A0A077ZIY7_TRITR Loading...

Coronin

AlphaFold DB , UniProt , Accession A0A077ZIY7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 433 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	I	22.8	Very low	32.2	Very low	186 Å²	186	119.3 Å²	119.3	95%	0.954	61%	0.609	S	S	*	*				0	104.5	0	-55.2	174.2	0	0	0	106.2	F6	I1-F6 HydrophobicContact CG2-CE2 4.41Å
2	C	25.2	Very low	33.9	Very low	30 Å²	30	113.6 Å²	113.6	20%	0.203	59%	0.586	C	S	.	*			trans	-61.3	133.9	178.3	176.8	0	0	0	0	108.7	I4 C5	C2-I4 PolarHBondContact O-N 3.48Å; C2-C5 PolarHBondContact O-N 3.38Å; C2-C5 VanDerWaalsContact O-N 3.16Å
3	P	26	Very low	35.6	Very low	96 Å²	96	118.8 Å²	118.8	62%	0.623	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-60.2	-15.6	-178.7	-21.4	31.8	0	0	0	114.2
4	I	30.5	Very low	37.1	Very low	58 Å²	58	112.6 Å²	112.6	30%	0.297	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-88.2	-14.6	-178.3	-66.5	171.7	0	0	0	112.8	C2 F6 L7	C2-I4 PolarHBondContact O-N 3.48Å; I4-F6 PolarHBondContact O-N 3.37Å; I4-L7 PolarHBondContact O-N 3.38Å
5	C	27.6	Very low	38.1	Very low	52 Å²	52	110.8 Å²	110.8	35%	0.351	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-62.1	-16.6	173.6	-60.1	0	0	0	0	112.8	C2 L7	C2-C5 PolarHBondContact O-N 3.38Å; C2-C5 VanDerWaalsContact O-N 3.16Å; C5-L7 VanDerWaalsContact C-N 3.26Å; C5-L7 PolarHBondContact O-N 3.05Å
6	F	25.5	Very low	38.8	Very low	175 Å²	175	107.2 Å²	107.2	77%	0.768	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-71.4	-9.5	-179.4	-82.7	-79.8	0	0	0	115.4	I1 I4	I1-F6 HydrophobicContact CG2-CE2 4.41Å; I4-F6 PolarHBondContact O-N 3.37Å
7	L	32	Very low	39.3	Very low	141 Å²	141	104.3 Å²	104.3	74%	0.738	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-85.5	-7.7	179.5	-80.2	168.7	0	0	0	114.4	I4 C5	I4-L7 PolarHBondContact O-N 3.38Å; C5-L7 VanDerWaalsContact C-N 3.26Å; C5-L7 PolarHBondContact O-N 3.05Å
8	Y	34.9	Very low	39.5	Very low	111 Å²	111	109.9 Å²	109.9	44%	0.435	58%	0.576	S	S	.	*	S	Bend	trans	-114.3	116.6	-176.4	-62.5	-83.4	0	0	0	109.3	E10	Y8-E10 PolarHBondContact O-N 3.48Å
9	K	38.2	Very low	39.9	Very low	217 Å²	217	106.1 Å²	106.1	94%	0.943	56%	0.559	S	S	*	*	S	Bend	trans	-51.8	-32.3	-170.7	-96.1	-178.8	172	-178.8	0	113.2
10	E	42.3	Very low	40.2	Very low	179 Å²	179	110.8 Å²	110.8	84%	0.836	58%	0.575	S	S	*	*			trans	-148.3	97.6	178.7	-65.1	177.1	-179.6	0	0	107.7	Y8	Y8-E10 PolarHBondContact O-N 3.48Å
11	A	49.6	Very low	40.5	Very low	67 Å²	67	107.8 Å²	107.8	55%	0.554	56%	0.557	S	S	*	*			trans	-80.2	126.2	166.4	0	0	0	0	0	107.5
12	P	52.4	Low	41.4	Very low	51 Å²	51	105.6 Å²	105.6	33%	0.331	54%	0.543	S	S	.	.			trans	-60.7	144.2	176.7	10.4	-12.4	0	0	0	110.8	L14 V52	P12-L14 PolarHBondContact O-N 3.47Å; P12-L14 VanDerWaalsContact O-N 3.1Å; P12-V52 HydrophobicContact CG-CG1 3.61Å; P12-V52 WeakPolarHBondContact CG-O 3.39Å
13	E	56.4	Low	42.4	Very low	182 Å²	182	105.1 Å²	105.1	85%	0.85	54%	0.538	S	S	*	.			trans	-70.9	105	172.5	-172.1	172.2	-174.5	0	0	108.6
14	L	56	Low	43.4	Very low	32 Å²	32	103.7 Å²	103.7	17%	0.168	53%	0.525	C	S	.	.			trans	-72	133.1	173	-55.7	175.7	0	0	0	107.8	P12 H17 I39 W50	P12-L14 PolarHBondContact O-N 3.47Å; P12-L14 VanDerWaalsContact O-N 3.1Å; L14-H17 PolarHBondContact O-CE1 3.48Å; L14-H17 PolarHBondContact O-NE2 3.16Å; L14-I39 HydrophobicContact CD1-CD1 3.83Å; L14-W50 HydrophobicContact CD2-CB 4.07Å; L14-W50 HydrophobicContact CD2-CG 3.97Å
15	S	51.8	Low	44	Very low	85 Å²	85	101.2 Å²	101.2	59%	0.594	51%	0.513	S	S	*	.			trans	-131.4	173.8	178.3	63.1	0	0	0	0	110.9
16	G	50	Low	44.7	Very low	53 Å²	53	103.4 Å²	103.4	55%	0.546	52%	0.521	S	S	.	.			trans	103.1	1.1	-179.5	0	0	0	0	0	115.6
17	H	46.9	Very low	45.5	Very low	58 Å²	58	97.2 Å²	97.2	27%	0.269	50%	0.495	S	S	.	.			trans	-102.2	131.1	176.9	31.9	-87.1	0	0	0	110.9	L14 F21	L14-H17 PolarHBondContact O-CE1 3.48Å; L14-H17 PolarHBondContact O-NE2 3.16Å; H17-F21 HydrophobicContact CB-CE1 3.98Å; H17-F21 HydrophobicContact CB-CE2 4.07Å; H17-F21 HydrophobicContact CB-CZ 3.4Å; H17-F21 AromaticContact CD2-CE2 3.22Å; H17-F21 WeakPolarHBondContact CD2-CE2 3.33Å; H17-F21 AromaticContact CD2-CZ 3.47Å; H17-F21 VanDerWaalsContact CD2-CZ 3.47Å; H17-F21 WeakPolarHBondContact CD2-CZ 3.44Å; H17-F21 AromaticContact CE1-CE2 3.68Å; H17-F21 AromaticContact CE1-CZ 3.73Å; H17-F21 AromaticContact CG-CE2 3.45Å; H17-F21 VanDerWaalsContact CG-CE2 3.45Å; H17-F21 AromaticContact CG-CZ 3.12Å; H17-F21 AromaticContact ND1-CE2 3.77Å; H17-F21 AromaticContact ND1-CZ 3.36Å; H17-F21 WeakPolarHBondContact ND1-CZ 3.49Å; H17-F21 AromaticContact NE2-CE2 3.38Å; H17-F21 WeakPolarHBondContact NE2-CE2 3.43Å; H17-F21 AromaticContact NE2-CZ 3.83Å
18	F	43.4	Very low	45.9	Very low	206 Å²	206	92.4 Å²	92.4	90%	0.904	47%	0.469	S	S	*	.			trans	-94	-8.1	-173.8	-59.8	-81.7	0	0	0	113.5
19	S	46.1	Very low	46.2	Very low	37 Å²	37	89.3 Å²	89.3	26%	0.259	46%	0.458	S	S	.	.	S	Bend	trans	-134.2	160.7	-173.9	62.5	0	0	0	0	112.5	F21 D44	S19-F21 PolarHBondContact O-N 3.38Å; S19-D44 WeakPolarHBondContact CB-OD2 3.18Å; S19-D44 VanDerWaalsContact OG-CG 3.29Å; S19-D44 PolarHBondContact OG-OD1 3.18Å; S19-D44 PolarHBondContact OG-OD2 2.91Å
20	K	46.2	Very low	46.2	Very low	200 Å²	200	79.8 Å²	79.8	87%	0.87	42%	0.419	S	S	*	.			trans	-73.7	121	-179.9	-171	177.1	-176.6	178.4	0	109.3	E22	K20-E22 PolarHBondContact O-N 3.21Å
21	F	46	Very low	46.1	Very low	47 Å²	47	71.4 Å²	71.4	21%	0.206	38%	0.38	C	S	.	.			trans	-60.3	126	178.5	-62.9	-70.4	0	0	0	112.3	H17 S19 I24 L41 A43 W50	H17-F21 HydrophobicContact CB-CE1 3.98Å; H17-F21 HydrophobicContact CB-CE2 4.07Å; H17-F21 HydrophobicContact CB-CZ 3.4Å; H17-F21 AromaticContact CD2-CE2 3.22Å; H17-F21 WeakPolarHBondContact CD2-CE2 3.33Å; H17-F21 AromaticContact CD2-CZ 3.47Å; H17-F21 VanDerWaalsContact CD2-CZ 3.47Å; H17-F21 WeakPolarHBondContact CD2-CZ 3.44Å; H17-F21 AromaticContact CE1-CE2 3.68Å; H17-F21 AromaticContact CE1-CZ 3.73Å; H17-F21 AromaticContact CG-CE2 3.45Å; H17-F21 VanDerWaalsContact CG-CE2 3.45Å; H17-F21 AromaticContact CG-CZ 3.12Å; H17-F21 AromaticContact ND1-CE2 3.77Å; H17-F21 AromaticContact ND1-CZ 3.36Å; H17-F21 WeakPolarHBondContact ND1-CZ 3.49Å; H17-F21 AromaticContact NE2-CE2 3.38Å; H17-F21 WeakPolarHBondContact NE2-CE2 3.43Å; H17-F21 AromaticContact NE2-CZ 3.83Å; S19-F21 PolarHBondContact O-N 3.38Å; F21-I24 HydrophobicContact CB-CG1 4.23Å; F21-L41 HydrophobicContact CD1-CB 3.84Å; F21-L41 HydrophobicContact CD1-CD1 4.11Å; F21-L41 HydrophobicContact CD1-CG 4.41Å; F21-L41 HydrophobicContact CD2-CD1 4.33Å; F21-L41 HydrophobicContact CE1-CB 3.48Å; F21-L41 VanDerWaalsContact CE1-CB 3.48Å; F21-L41 HydrophobicContact CE1-CD1 3.54Å; F21-L41 HydrophobicContact CE1-CG 4.06Å; F21-L41 HydrophobicContact CE2-CD1 3.75Å; F21-L41 HydrophobicContact CG-CD1 4.46Å; F21-L41 HydrophobicContact CZ-CB 4.16Å; F21-L41 HydrophobicContact CZ-CD1 3.3Å; F21-L41 HydrophobicContact CZ-CG 4.3Å; F21-A43 HydrophobicContact CD1-CB 3.88Å; F21-A43 HydrophobicContact CE1-CB 3.85Å; F21-W50 HydrophobicContact CZ-CH2 4.44Å
22	E	43.3	Very low	45.8	Very low	140 Å²	140	70.1 Å²	70.1	65%	0.654	36%	0.361	S	S	*	.	S	Bend	trans	-86	-33.8	169	-68.9	-165.8	154.1	0	0	111.8	K20	K20-E22 PolarHBondContact O-N 3.21Å
23	N	45.1	Very low	45.5	Very low	20 Å²	20	70 Å²	70	11%	0.107	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	95.5	-175.3	-63.2	-60	0	0	0	110.2	I68 W69 R113	N23-I68 PolarHBondContact ND2-O 3.44Å; N23-W69 PolarHBondContact ND2-O 2.98Å; N23-W69 PolarHBondContact OD1-O 3.03Å; N23-R113 PolarHBondContact OD1-NH2 3.45Å
24	I	46.3	Very low	45	Very low	66 Å²	66	61.5 Å²	61.5	34%	0.338	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.7	157.6	-64.1	173.3	0	0	0	106	F21 D26 F28 L41	F21-I24 HydrophobicContact CB-CG1 4.23Å; I24-D26 PolarHBondContact O-N 3.4Å; I24-F28 HydrophobicContact CG2-CD2 4.45Å; I24-F28 HydrophobicContact CG2-CE2 3.57Å; I24-F28 HydrophobicContact CG2-CZ 4.39Å; I24-L41 HydrophobicContact CB-CD2 4Å; I24-L41 HydrophobicContact CG1-CD2 3.86Å; I24-L41 HydrophobicContact CG2-CD2 3.94Å
25	V	43.6	Very low	44.7	Very low	7 Å²	7	60 Å²	60	4%	0.042	31%	0.307	C	S	.	.			trans	-56	104.1	171.5	167.3	0	0	0	0	107.9	N27 F28 V31 A40 I71	V25-N27 HydrophobicContact CG1-CB 4.15Å; V25-N27 PolarHBondContact O-N 3.39Å; V25-F28 WeakPolarHBondContact O-CD2 3.49Å; V25-V31 HydrophobicContact CG1-CG2 4.31Å; V25-A40 HydrophobicContact CG2-CB 4.11Å; V25-A40 WeakPolarHBondContact CG2-O 3.25Å; V25-I71 HydrophobicContact CG2-CB 3.7Å; V25-I71 HydrophobicContact CG2-CG2 3.85Å
26	D	42.2	Very low	44.7	Very low	97 Å²	97	58.5 Å²	58.5	52%	0.519	29%	0.292	S	S	.	.	S	Bend	trans	-67	-14.8	178.4	-70.9	-40.2	0	0	0	111	I24 F28	I24-D26 PolarHBondContact O-N 3.4Å; D26-F28 VanDerWaalsContact C-N 3.31Å; D26-F28 PolarHBondContact O-N 3.19Å
27	N	43.1	Very low	44.8	Very low	45 Å²	45	59.5 Å²	59.5	24%	0.241	28%	0.28	C	S	.	.			trans	-94.8	44.8	178.9	-133.3	2.3	0	0	0	112.5	V25 Q29 S30 D72	V25-N27 HydrophobicContact CG1-CB 4.15Å; V25-N27 PolarHBondContact O-N 3.39Å; N27-Q29 PolarHBondContact O-N 3.26Å; N27-S30 PolarHBondContact O-N 3.33Å; N27-D72 PolarHBondContact ND2-OD1 3.45Å
28	F	39.5	Very low	44.9	Very low	40 Å²	40	56.7 Å²	56.7	18%	0.175	27%	0.267	C	S	.	.	H	α-helix	trans	-43.1	-33.5	172.8	-101.7	-98.7	0	0	0	112.4	I24 V25 D26 S30 Y32 I39	I24-F28 HydrophobicContact CG2-CD2 4.45Å; I24-F28 HydrophobicContact CG2-CE2 3.57Å; I24-F28 HydrophobicContact CG2-CZ 4.39Å; V25-F28 WeakPolarHBondContact O-CD2 3.49Å; D26-F28 VanDerWaalsContact C-N 3.31Å; D26-F28 PolarHBondContact O-N 3.19Å; F28-S30 PolarHBondContact O-N 3.14Å; F28-Y32 AromaticContact CD1-CD2 3.57Å; F28-Y32 HydrophobicContact CD1-CD2 3.57Å; F28-Y32 AromaticContact CD1-CE2 3.1Å; F28-Y32 HydrophobicContact CD1-CE2 3.1Å; F28-Y32 AromaticContact CD1-CZ 3.79Å; F28-Y32 HydrophobicContact CE1-CD2 4.22Å; F28-Y32 AromaticContact CE1-CE2 3.3Å; F28-Y32 HydrophobicContact CE1-CE2 3.3Å; F28-Y32 AromaticContact CE1-CZ 3.77Å; F28-Y32 HydrophobicContact CG-CD2 4.44Å; F28-Y32 HydrophobicContact CG-CE2 4.28Å; F28-Y32 WeakPolarHBondContact O-CB 3.23Å; F28-Y32 WeakPolarHBondContact O-CD2 3.23Å; F28-Y32 PolarHBondContact O-N 2.79Å; F28-Y32 VanDerWaalsContact O-N 3.12Å; F28-I39 HydrophobicContact CE1-CD1 3.59Å; F28-I39 HydrophobicContact CE1-CG1 3.96Å; F28-I39 HydrophobicContact CZ-CD1 3.63Å; F28-I39 HydrophobicContact CZ-CG1 4.11Å
29	Q	40.9	Very low	45.4	Very low	47 Å²	47	47.4 Å²	47.4	22%	0.22	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-45.2	179	-75.9	-175.4	9.4	0	0	113.3	N27 R33	N27-Q29 PolarHBondContact O-N 3.26Å; Q29-R33 VanDerWaalsContact O-CB 3.29Å; Q29-R33 WeakPolarHBondContact O-CB 3.18Å; Q29-R33 WeakPolarHBondContact O-CD 3.44Å; Q29-R33 WeakPolarHBondContact O-CG 3.34Å; Q29-R33 PolarHBondContact O-N 2.71Å; Q29-R33 PolarHBondContact O-NE 2.64Å
30	S	40	Very low	45.7	Very low	17 Å²	17	45.6 Å²	45.6	12%	0.119	21%	0.214	C	C	.	.	H	α-helix	trans	-66.5	-42.1	-176.7	-61.6	0	0	0	0	111.7	N27 F28 L34	N27-S30 PolarHBondContact O-N 3.33Å; F28-S30 PolarHBondContact O-N 3.14Å; S30-L34 WeakPolarHBondContact O-CD1 3.36Å
31	V	39.8	Very low	46.1	Very low	3 Å²	3	36.5 Å²	36.5	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-77	-42	-173.7	-154.8	0	0	0	0	112.6	V25 R33 L34 L35 C38 F73	V25-V31 HydrophobicContact CG1-CG2 4.31Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 3.25Å; V31-L34 PolarHBondContact O-N 3.31Å; V31-L35 PolarHBondContact O-N 3.4Å; V31-L35 VanDerWaalsContact O-N 3.12Å; V31-C38 VanDerWaalsContact CB-O 3.26Å; V31-C38 WeakPolarHBondContact CB-O 3.5Å; V31-C38 HydrophobicContact CG1-CB 3.78Å; V31-C38 WeakPolarHBondContact CG1-O 3.26Å; V31-F73 HydrophobicContact CB-CD2 4.14Å; V31-F73 HydrophobicContact CB-CE2 4.37Å; V31-F73 HydrophobicContact CG1-CD2 3.77Å; V31-F73 HydrophobicContact CG1-CE2 3.6Å; V31-F73 HydrophobicContact CG1-CG 4.34Å; V31-F73 HydrophobicContact CG1-CZ 4.08Å; V31-F73 HydrophobicContact CG2-CB 4.34Å; V31-F73 HydrophobicContact CG2-CD2 3.29Å; V31-F73 HydrophobicContact CG2-CE2 3.78Å; V31-F73 HydrophobicContact CG2-CG 4.1Å
32	Y	41.8	Very low	46.5	Very low	40 Å²	40	34.5 Å²	34.5	16%	0.157	17%	0.168	C	C	.	.	H	α-helix	trans	-67.4	-27.3	177	-88.7	-110.5	0	0	0	113.4	F28 L34 L35 Y37 I39	F28-Y32 AromaticContact CD1-CD2 3.57Å; F28-Y32 HydrophobicContact CD1-CD2 3.57Å; F28-Y32 AromaticContact CD1-CE2 3.1Å; F28-Y32 HydrophobicContact CD1-CE2 3.1Å; F28-Y32 AromaticContact CD1-CZ 3.79Å; F28-Y32 HydrophobicContact CE1-CD2 4.22Å; F28-Y32 AromaticContact CE1-CE2 3.3Å; F28-Y32 HydrophobicContact CE1-CE2 3.3Å; F28-Y32 AromaticContact CE1-CZ 3.77Å; F28-Y32 HydrophobicContact CG-CD2 4.44Å; F28-Y32 HydrophobicContact CG-CE2 4.28Å; F28-Y32 WeakPolarHBondContact O-CB 3.23Å; F28-Y32 WeakPolarHBondContact O-CD2 3.23Å; F28-Y32 PolarHBondContact O-N 2.79Å; F28-Y32 VanDerWaalsContact O-N 3.12Å; Y32-L34 PolarHBondContact O-N 3.13Å; Y32-L35 CarbonylContact C-O 3.6Å; Y32-Y37 AromaticContact CD1-CD1 3.86Å; Y32-Y37 HydrophobicContact CD1-CD1 3.86Å; Y32-Y37 AromaticContact CD1-CE1 3.92Å; Y32-Y37 HydrophobicContact CD1-CE1 3.92Å; Y32-Y37 AromaticContact CE1-CD1 3.27Å; Y32-Y37 HydrophobicContact CE1-CD1 3.27Å; Y32-Y37 AromaticContact CE1-CE1 3.42Å; Y32-Y37 HydrophobicContact CE1-CE1 3.42Å; Y32-Y37 VanDerWaalsContact CE1-CE1 3.42Å; Y32-Y37 AromaticContact CZ-CD1 3.83Å; Y32-I39 HydrophobicContact CE2-CD1 4.29Å; Y32-I39 HydrophobicContact CE2-CG1 4.01Å
33	R	46.7	Very low	47	Very low	48 Å²	48	28.2 Å²	28.2	18%	0.181	14%	0.14	C	C	.	.	H	α-helix	trans	-66.1	-33.1	178.7	-82.2	168.1	-160.8	-141.3	13.6	111.5	Q29 V31 A257 L276	Q29-R33 VanDerWaalsContact O-CB 3.29Å; Q29-R33 WeakPolarHBondContact O-CB 3.18Å; Q29-R33 WeakPolarHBondContact O-CD 3.44Å; Q29-R33 WeakPolarHBondContact O-CG 3.34Å; Q29-R33 PolarHBondContact O-N 2.71Å; Q29-R33 PolarHBondContact O-NE 2.64Å; V31-R33 VanDerWaalsContact C-N 3.28Å; V31-R33 PolarHBondContact O-N 3.25Å; R33-A257 HydrophobicContact CB-CB 4.48Å; R33-A257 VanDerWaalsContact CD-CB 3.4Å; R33-A257 HydrophobicContact CG-CB 3.76Å; R33-L276 HydrophobicContact CB-CD1 4.05Å; R33-L276 HydrophobicContact CB-CD2 3.88Å; R33-L276 HydrophobicContact CG-CD2 4.33Å; R33-L276 WeakPolarHBondContact O-CD1 3.4Å
34	L	46.1	Very low	48	Very low	3 Å²	3	32.2 Å²	32.2	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-93.9	-52.1	-172	-78.4	158.8	0	0	0	112.8	S30 V31 Y32 Y75 N76 G77 I263 L276	S30-L34 WeakPolarHBondContact O-CD1 3.36Å; V31-L34 PolarHBondContact O-N 3.31Å; Y32-L34 PolarHBondContact O-N 3.13Å; L34-Y75 VanDerWaalsContact CD1-O 3.29Å; L34-Y75 WeakPolarHBondContact CD1-O 3.47Å; L34-Y75 WeakPolarHBondContact CD2-O 3.43Å; L34-N76 VanDerWaalsContact CD2-C 3.41Å; L34-N76 HydrophobicContact CD2-CB 4.42Å; L34-N76 WeakPolarHBondContact CD2-O 3.38Å; L34-G77 VanDerWaalsContact CD1-CA 3.47Å; L34-I263 VanDerWaalsContact O-CG2 3.26Å; L34-I263 WeakPolarHBondContact O-CG2 3.37Å; L34-I263 PolarHBondContact O-N 3.1Å; L34-L276 HydrophobicContact CB-CD1 4.3Å; L34-L276 HydrophobicContact CD2-CD1 3.17Å; L34-L276 HydrophobicContact CG-CD1 3.43Å; L34-L276 VanDerWaalsContact CG-CD1 3.43Å
35	L	50	Low	49.5	Very low	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-106.7	137.1	-175.5	-65.2	165.6	0	0	0	106.5	V31 Y32 Y37 C38 I263 W268	V31-L35 PolarHBondContact O-N 3.4Å; V31-L35 VanDerWaalsContact O-N 3.12Å; Y32-L35 CarbonylContact C-O 3.6Å; L35-Y37 PolarHBondContact O-N 3.23Å; L35-C38 HydrophobicContact CB-CB 4.1Å; L35-C38 HydrophobicContact CD1-CB 3.67Å; L35-C38 HydrophobicContact CG-CB 4.5Å; L35-I263 HydrophobicContact CD2-CG2 4.1Å; L35-W268 HydrophobicContact CD1-CD2 3.71Å; L35-W268 HydrophobicContact CD1-CE3 4.06Å; L35-W268 HydrophobicContact CD1-CG 4.08Å; L35-W268 HydrophobicContact CD1-CH2 4.41Å; L35-W268 HydrophobicContact CD1-CZ2 4.06Å; L35-W268 HydrophobicContact CD1-CZ3 4.41Å; L35-W268 HydrophobicContact CD2-CB 3.07Å; L35-W268 HydrophobicContact CD2-CD2 3.56Å; L35-W268 HydrophobicContact CD2-CE3 4.14Å; L35-W268 HydrophobicContact CD2-CG 3.07Å; L35-W268 HydrophobicContact CG-CB 4.47Å; L35-W268 HydrophobicContact CG-CD2 4.26Å; L35-W268 HydrophobicContact CG-CG 4.11Å
36	D	51.8	Low	51.3	Low	54 Å²	54	33.1 Å²	33.1	29%	0.289	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-29.2	-53.7	170.3	-113.9	-34.3	0	0	0	108.7	P261 I263	D36-P261 VanDerWaalsContact OD1-CG 3.28Å; D36-P261 WeakPolarHBondContact OD1-CG 3.39Å; D36-I263 PolarHBondContact N-O 3.35Å
37	Y	51	Low	53.2	Low	73 Å²	73	28.5 Å²	28.5	29%	0.286	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-166.7	84.3	-178.2	-74.5	-69.3	0	0	0	112.8	Y32 L35 N51 V52	Y32-Y37 AromaticContact CD1-CD1 3.86Å; Y32-Y37 HydrophobicContact CD1-CD1 3.86Å; Y32-Y37 AromaticContact CD1-CE1 3.92Å; Y32-Y37 HydrophobicContact CD1-CE1 3.92Å; Y32-Y37 AromaticContact CE1-CD1 3.27Å; Y32-Y37 HydrophobicContact CE1-CD1 3.27Å; Y32-Y37 AromaticContact CE1-CE1 3.42Å; Y32-Y37 HydrophobicContact CE1-CE1 3.42Å; Y32-Y37 VanDerWaalsContact CE1-CE1 3.42Å; Y32-Y37 AromaticContact CZ-CD1 3.83Å; L35-Y37 PolarHBondContact O-N 3.23Å; Y37-N51 CarbonylContact O-C 3.58Å; Y37-N51 VanDerWaalsContact O-CA 3.22Å; Y37-N51 WeakPolarHBondContact O-CA 3.21Å; Y37-V52 VanDerWaalsContact CB-CA 3.45Å; Y37-V52 HydrophobicContact CD1-CB 3.68Å; Y37-V52 HydrophobicContact CD1-CG1 4.29Å; Y37-V52 HydrophobicContact CD1-CG2 4.37Å; Y37-V52 HydrophobicContact CG-CB 3.7Å; Y37-V52 HydrophobicContact CG-CG2 4.44Å; Y37-V52 PolarHBondContact O-N 2.98Å
38	C	50.2	Low	55	Low	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.6	166.3	-70.6	0	0	0	0	112.8	V31 L35 W50	V31-C38 VanDerWaalsContact CB-O 3.26Å; V31-C38 WeakPolarHBondContact CB-O 3.5Å; V31-C38 HydrophobicContact CG1-CB 3.78Å; V31-C38 WeakPolarHBondContact CG1-O 3.26Å; L35-C38 HydrophobicContact CB-CB 4.1Å; L35-C38 HydrophobicContact CD1-CB 3.67Å; L35-C38 HydrophobicContact CG-CB 4.5Å; C38-W50 WeakPolarHBondContact CA-O 3.25Å; C38-W50 PolarHBondContact SG-O 2.75Å
39	I	54.1	Low	57	Low	10 Å²	10	25.9 Å²	25.9	5%	0.051	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131	173.2	-64.9	169.6	0	0	0	106.6	L14 F28 Y32 L41 L49 W50 V52	L14-I39 HydrophobicContact CD1-CD1 3.83Å; F28-I39 HydrophobicContact CE1-CD1 3.59Å; F28-I39 HydrophobicContact CE1-CG1 3.96Å; F28-I39 HydrophobicContact CZ-CD1 3.63Å; F28-I39 HydrophobicContact CZ-CG1 4.11Å; Y32-I39 HydrophobicContact CE2-CD1 4.29Å; Y32-I39 HydrophobicContact CE2-CG1 4.01Å; I39-L41 HydrophobicContact CG2-CD1 4.39Å; I39-L41 HydrophobicContact CG2-CD2 3.71Å; I39-L41 HydrophobicContact CG2-CG 3.76Å; I39-L49 VanDerWaalsContact O-CA 3.28Å; I39-L49 WeakPolarHBondContact O-CA 3.22Å; I39-W50 HydrophobicContact CB-CE3 4.47Å; I39-W50 VanDerWaalsContact O-CE3 3.28Å; I39-W50 PolarHBondContact O-N 3Å; I39-V52 HydrophobicContact CD1-CG2 3.47Å; I39-V52 VanDerWaalsContact CD1-CG2 3.47Å; I39-V52 HydrophobicContact CG1-CG2 3.68Å
40	A	52.5	Low	58.7	Low	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	127.3	167.1	0	0	0	0	0	109.2	V25 I47 F48 I71 F73 L80	V25-A40 HydrophobicContact CG2-CB 4.11Å; V25-A40 WeakPolarHBondContact CG2-O 3.25Å; A40-I47 HydrophobicContact CB-CG2 3.62Å; A40-F48 WeakPolarHBondContact CA-O 3.37Å; A40-I71 HydrophobicContact CB-CG2 3.77Å; A40-F73 HydrophobicContact CB-CE2 3.93Å; A40-L80 HydrophobicContact CB-CD1 4.34Å
41	L	55.1	Low	60.4	Low	8 Å²	8	23.3 Å²	23.3	4%	0.042	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.9	174.4	-60.2	176.2	0	0	0	110.8	F21 I24 I39 I47 F48 W50	F21-L41 HydrophobicContact CD1-CB 3.84Å; F21-L41 HydrophobicContact CD1-CD1 4.11Å; F21-L41 HydrophobicContact CD1-CG 4.41Å; F21-L41 HydrophobicContact CD2-CD1 4.33Å; F21-L41 HydrophobicContact CE1-CB 3.48Å; F21-L41 VanDerWaalsContact CE1-CB 3.48Å; F21-L41 HydrophobicContact CE1-CD1 3.54Å; F21-L41 HydrophobicContact CE1-CG 4.06Å; F21-L41 HydrophobicContact CE2-CD1 3.75Å; F21-L41 HydrophobicContact CG-CD1 4.46Å; F21-L41 HydrophobicContact CZ-CB 4.16Å; F21-L41 HydrophobicContact CZ-CD1 3.3Å; F21-L41 HydrophobicContact CZ-CG 4.3Å; I24-L41 HydrophobicContact CB-CD2 4Å; I24-L41 HydrophobicContact CG1-CD2 3.86Å; I24-L41 HydrophobicContact CG2-CD2 3.94Å; I39-L41 HydrophobicContact CG2-CD1 4.39Å; I39-L41 HydrophobicContact CG2-CD2 3.71Å; I39-L41 HydrophobicContact CG2-CG 3.76Å; L41-I47 WeakPolarHBondContact O-CA 3.19Å; L41-F48 PolarHBondContact N-O 3.2Å; L41-F48 VanDerWaalsContact N-O 3.17Å; L41-F48 PolarHBondContact O-N 2.92Å; L41-W50 HydrophobicContact CB-CH2 3.75Å; L41-W50 HydrophobicContact CB-CZ3 3.54Å; L41-W50 HydrophobicContact CD1-CE3 4.3Å; L41-W50 HydrophobicContact CD1-CH2 3.54Å; L41-W50 HydrophobicContact CD1-CZ2 4.46Å; L41-W50 HydrophobicContact CD1-CZ3 3.48Å; L41-W50 VanDerWaalsContact CD1-CZ3 3.48Å; L41-W50 HydrophobicContact CG-CE3 4.32Å; L41-W50 HydrophobicContact CG-CH2 3.86Å; L41-W50 HydrophobicContact CG-CZ3 3.41Å; L41-W50 VanDerWaalsContact CG-CZ3 3.41Å
42	G	53.7	Low	61.9	Low	6 Å²	6	23.6 Å²	23.6	6%	0.062	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	104	174.5	0	0	0	0	0	111.3	K46	G42-K46 CarbonylContact C-O 3.55Å; G42-K46 VanDerWaalsContact CA-O 3.24Å; G42-K46 WeakPolarHBondContact CA-O 3.03Å
43	A	53.3	Low	63.4	Low	8 Å²	8	25 Å²	25	7%	0.066	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.9	171.9	0	0	0	0	0	109	F21 A45 K46	F21-A43 HydrophobicContact CD1-CB 3.88Å; F21-A43 HydrophobicContact CE1-CB 3.85Å; A43-A45 VanDerWaalsContact C-N 3.26Å; A43-A45 PolarHBondContact O-N 3.29Å; A43-K46 PolarHBondContact N-O 2.99Å; A43-K46 WeakPolarHBondContact O-CB 3.35Å; A43-K46 PolarHBondContact O-N 3.31Å
44	D	65.4	Low	64.8	Low	103 Å²	103	26.1 Å²	26.1	55%	0.551	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.6	41	177.3	-53.9	-45.3	0	0	0	114	S19 K46	S19-D44 WeakPolarHBondContact CB-OD2 3.18Å; S19-D44 VanDerWaalsContact OG-CG 3.29Å; S19-D44 PolarHBondContact OG-OD1 3.18Å; S19-D44 PolarHBondContact OG-OD2 2.91Å; D44-K46 PolarHBondContact O-N 2.74Å
45	A	78.7	Confident	66.1	Low	16 Å²	16	26.9 Å²	26.9	13%	0.132	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	24	-177	0	0	0	0	0	114.9	A43 H64 D66	A43-A45 VanDerWaalsContact C-N 3.26Å; A43-A45 PolarHBondContact O-N 3.29Å; A45-H64 HydrophobicContact CB-CB 4.1Å; A45-H64 WeakPolarHBondContact CB-O 3.49Å; A45-H64 WeakPolarHBondContact O-CB 3.42Å; A45-D66 WeakPolarHBondContact CB-O 3.39Å
46	K	81	Confident	67.4	Low	77 Å²	77	32.4 Å²	32.4	34%	0.335	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	153.9	174.9	-62.1	175.4	169.3	-156	0	110.7	G42 A43 D44 F48 E60 I61	G42-K46 CarbonylContact C-O 3.55Å; G42-K46 VanDerWaalsContact CA-O 3.24Å; G42-K46 WeakPolarHBondContact CA-O 3.03Å; A43-K46 PolarHBondContact N-O 2.99Å; A43-K46 WeakPolarHBondContact O-CB 3.35Å; A43-K46 PolarHBondContact O-N 3.31Å; D44-K46 PolarHBondContact O-N 2.74Å; K46-F48 HydrophobicContact CB-CE2 3.97Å; K46-F48 HydrophobicContact CB-CZ 4.4Å; K46-F48 HydrophobicContact CD-CE2 4.44Å; K46-F48 HydrophobicContact CD-CZ 4.2Å; K46-E60 VanDerWaalsContact CD-OE1 3.3Å; K46-E60 WeakPolarHBondContact CD-OE1 2.87Å; K46-E60 VanDerWaalsContact CE-OE1 3.32Å; K46-E60 WeakPolarHBondContact CE-OE1 3.31Å; K46-E60 IonicContact NZ-OE1 2.77Å; K46-E60 PolarHBondContact NZ-OE1 3.43Å; K46-I61 WeakPolarHBondContact CA-O 3.43Å
47	I	83.6	Confident	68.7	Low	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.2	172.7	-51.1	175.4	0	0	0	108.1	A40 L41 L49 E60 I61 I68 I71 L80 T82	A40-I47 HydrophobicContact CB-CG2 3.62Å; L41-I47 WeakPolarHBondContact O-CA 3.19Å; I47-L49 HydrophobicContact CG2-CD1 4.12Å; I47-E60 CarbonylContact O-C 3.46Å; I47-E60 WeakPolarHBondContact O-CA 3.4Å; I47-I61 HydrophobicContact CB-CB 4.18Å; I47-I61 PolarHBondContact N-O 3.33Å; I47-I61 PolarHBondContact O-N 3.19Å; I47-I68 HydrophobicContact CD1-CD1 3.94Å; I47-I68 HydrophobicContact CG1-CD1 3.44Å; I47-I68 VanDerWaalsContact CG1-CD1 3.44Å; I47-I71 HydrophobicContact CD1-CD1 4.01Å; I47-I71 HydrophobicContact CD1-CG1 4.34Å; I47-I71 HydrophobicContact CG1-CD1 3.91Å; I47-I71 HydrophobicContact CG2-CD1 4.1Å; I47-L80 HydrophobicContact CD1-CD2 3.8Å; I47-L80 HydrophobicContact CG2-CD2 4.2Å; I47-T82 HydrophobicContact CD1-CG2 3.42Å; I47-T82 VanDerWaalsContact CD1-CG2 3.42Å
48	F	80.8	Confident	70.2	Confident	30 Å²	30	32 Å²	32	13%	0.132	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.7	174.9	-67.5	-85.8	0	0	0	108.8	A40 L41 K46 W50 I59 E60	A40-F48 WeakPolarHBondContact CA-O 3.37Å; L41-F48 PolarHBondContact N-O 3.2Å; L41-F48 VanDerWaalsContact N-O 3.17Å; L41-F48 PolarHBondContact O-N 2.92Å; K46-F48 HydrophobicContact CB-CE2 3.97Å; K46-F48 HydrophobicContact CB-CZ 4.4Å; K46-F48 HydrophobicContact CD-CE2 4.44Å; K46-F48 HydrophobicContact CD-CZ 4.2Å; F48-W50 HydrophobicContact CB-CD2 4.32Å; F48-W50 HydrophobicContact CB-CE3 3.9Å; F48-W50 HydrophobicContact CB-CH2 3.03Å; F48-W50 HydrophobicContact CB-CZ2 3.48Å; F48-W50 VanDerWaalsContact CB-CZ2 3.48Å; F48-W50 HydrophobicContact CB-CZ3 3.23Å; F48-W50 HydrophobicContact CD2-CH2 4.03Å; F48-W50 HydrophobicContact CD2-CZ2 4.48Å; F48-W50 AromaticContact CG-CH2 3.75Å; F48-W50 HydrophobicContact CG-CH2 3.75Å; F48-W50 AromaticContact CG-CZ2 3.98Å; F48-W50 HydrophobicContact CG-CZ2 3.98Å; F48-W50 HydrophobicContact CG-CZ3 4.38Å; F48-W50 VanDerWaalsContact O-CE3 3.31Å; F48-W50 WeakPolarHBondContact O-CZ3 3.21Å; F48-I59 CarbonylContact C-O 3.55Å; F48-I59 WeakPolarHBondContact CA-O 3.33Å; F48-E60 HydrophobicContact CD1-CB 4.05Å; F48-E60 HydrophobicContact CD1-CG 4Å; F48-E60 HydrophobicContact CE1-CB 4.04Å; F48-E60 HydrophobicContact CE1-CG 3.62Å; F48-E60 HydrophobicContact CZ-CG 4.16Å
49	L	81.1	Confident	71.9	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.7	172.5	-70.7	78.4	0	0	0	108.4	I39 I47 L58 I59 I61 F73 P94 W268	I39-L49 VanDerWaalsContact O-CA 3.28Å; I39-L49 WeakPolarHBondContact O-CA 3.22Å; I47-L49 HydrophobicContact CG2-CD1 4.12Å; L49-L58 PolarHBondContact O-N 3.03Å; L49-I59 HydrophobicContact CB-CB 4.19Å; L49-I59 HydrophobicContact CD1-CB 4.32Å; L49-I59 HydrophobicContact CD1-CG2 4.42Å; L49-I59 HydrophobicContact CD2-CD1 4.38Å; L49-I59 PolarHBondContact N-O 3.07Å; L49-I59 PolarHBondContact O-N 3.24Å; L49-I61 HydrophobicContact CD1-CD1 3.78Å; L49-I61 HydrophobicContact CD1-CG1 4.15Å; L49-F73 HydrophobicContact CD2-CZ 3.89Å; L49-P94 HydrophobicContact CD2-CB 3.97Å; L49-W268 HydrophobicContact CD2-CH2 3.78Å; L49-W268 HydrophobicContact CD2-CZ3 4.37Å
50	W	76.6	Confident	73.4	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.008	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	158.1	175.4	-69.4	-96.6	0	0	0	111.8	L14 F21 C38 I39 L41 F48 E56	L14-W50 HydrophobicContact CD2-CB 4.07Å; L14-W50 HydrophobicContact CD2-CG 3.97Å; F21-W50 HydrophobicContact CZ-CH2 4.44Å; C38-W50 WeakPolarHBondContact CA-O 3.25Å; C38-W50 PolarHBondContact SG-O 2.75Å; I39-W50 HydrophobicContact CB-CE3 4.47Å; I39-W50 VanDerWaalsContact O-CE3 3.28Å; I39-W50 PolarHBondContact O-N 3Å; L41-W50 HydrophobicContact CB-CH2 3.75Å; L41-W50 HydrophobicContact CB-CZ3 3.54Å; L41-W50 HydrophobicContact CD1-CE3 4.3Å; L41-W50 HydrophobicContact CD1-CH2 3.54Å; L41-W50 HydrophobicContact CD1-CZ2 4.46Å; L41-W50 HydrophobicContact CD1-CZ3 3.48Å; L41-W50 VanDerWaalsContact CD1-CZ3 3.48Å; L41-W50 HydrophobicContact CG-CE3 4.32Å; L41-W50 HydrophobicContact CG-CH2 3.86Å; L41-W50 HydrophobicContact CG-CZ3 3.41Å; L41-W50 VanDerWaalsContact CG-CZ3 3.41Å; F48-W50 HydrophobicContact CB-CD2 4.32Å; F48-W50 HydrophobicContact CB-CE3 3.9Å; F48-W50 HydrophobicContact CB-CH2 3.03Å; F48-W50 HydrophobicContact CB-CZ2 3.48Å; F48-W50 VanDerWaalsContact CB-CZ2 3.48Å; F48-W50 HydrophobicContact CB-CZ3 3.23Å; F48-W50 HydrophobicContact CD2-CH2 4.03Å; F48-W50 HydrophobicContact CD2-CZ2 4.48Å; F48-W50 AromaticContact CG-CH2 3.75Å; F48-W50 HydrophobicContact CG-CH2 3.75Å; F48-W50 AromaticContact CG-CZ2 3.98Å; F48-W50 HydrophobicContact CG-CZ2 3.98Å; F48-W50 HydrophobicContact CG-CZ3 4.38Å; F48-W50 VanDerWaalsContact O-CE3 3.31Å; F48-W50 WeakPolarHBondContact O-CZ3 3.21Å; W50-E56 CarbonylContact C-O 3.56Å; W50-E56 VanDerWaalsContact CA-O 3.23Å; W50-E56 WeakPolarHBondContact CA-O 3.41Å
51	N	75.4	Confident	75.1	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.043	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	109.2	154.7	-174.3	-11.4	0	0	0	108.1	Y37 S53 T54 G55 E56 L58	Y37-N51 CarbonylContact O-C 3.58Å; Y37-N51 VanDerWaalsContact O-CA 3.22Å; Y37-N51 WeakPolarHBondContact O-CA 3.21Å; N51-S53 VanDerWaalsContact C-N 3.28Å; N51-S53 PolarHBondContact O-N 3.27Å; N51-S53 PolarHBondContact OD1-N 2.81Å; N51-S53 PolarHBondContact OD1-OG 3.42Å; N51-T54 WeakPolarHBondContact CB-OG1 3.25Å; N51-T54 PolarHBondContact ND2-OG1 2.6Å; N51-T54 PolarHBondContact O-N 2.88Å; N51-G55 CarbonylContact O-C 3.41Å; N51-G55 WeakPolarHBondContact O-CA 3.27Å; N51-G55 PolarHBondContact O-N 3.23Å; N51-E56 PolarHBondContact N-O 2.72Å; N51-E56 PolarHBondContact O-N 3.17Å; N51-L58 HydrophobicContact CB-CD1 3.91Å; N51-L58 HydrophobicContact CB-CD2 4.13Å; N51-L58 HydrophobicContact CB-CG 3.96Å
52	V	70.4	Confident	76.6	Confident	8 Å²	8	40.6 Å²	40.6	5%	0.048	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.5	178.9	-156.4	0	0	0	0	112.2	P12 Y37 I39	P12-V52 HydrophobicContact CG-CG1 3.61Å; P12-V52 WeakPolarHBondContact CG-O 3.39Å; Y37-V52 VanDerWaalsContact CB-CA 3.45Å; Y37-V52 HydrophobicContact CD1-CB 3.68Å; Y37-V52 HydrophobicContact CD1-CG1 4.29Å; Y37-V52 HydrophobicContact CD1-CG2 4.37Å; Y37-V52 HydrophobicContact CG-CB 3.7Å; Y37-V52 HydrophobicContact CG-CG2 4.44Å; Y37-V52 PolarHBondContact O-N 2.98Å; I39-V52 HydrophobicContact CD1-CG2 3.47Å; I39-V52 VanDerWaalsContact CD1-CG2 3.47Å; I39-V52 HydrophobicContact CG1-CG2 3.68Å
53	S	73	Confident	78	Confident	69 Å²	69	43.5 Å²	43.5	48%	0.483	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-36.8	168.5	63.7	0	0	0	0	111.7	N51	N51-S53 VanDerWaalsContact C-N 3.28Å; N51-S53 PolarHBondContact O-N 3.27Å; N51-S53 PolarHBondContact OD1-N 2.81Å; N51-S53 PolarHBondContact OD1-OG 3.42Å
54	T	77.2	Confident	79.7	Confident	73 Å²	73	44 Å²	44	45%	0.448	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-16.9	-179	65.4	0	0	0	0	113.5	N51 E56	N51-T54 WeakPolarHBondContact CB-OG1 3.25Å; N51-T54 PolarHBondContact ND2-OG1 2.6Å; N51-T54 PolarHBondContact O-N 2.88Å; T54-E56 PolarHBondContact O-N 3.05Å; T54-E56 WeakPolarHBondContact OG1-CB 3.46Å; T54-E56 WeakPolarHBondContact OG1-CG 3.4Å; T54-E56 PolarHBondContact OG1-N 2.65Å; T54-E56 PolarHBondContact OG1-OE2 3.06Å
55	G	73.4	Confident	80.9	Confident	19 Å²	19	43.3 Å²	43.3	20%	0.196	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	3.9	-171.6	0	0	0	0	0	114.1	N51	N51-G55 CarbonylContact O-C 3.41Å; N51-G55 WeakPolarHBondContact O-CA 3.27Å; N51-G55 PolarHBondContact O-N 3.23Å
56	E	77.7	Confident	81.4	Confident	116 Å²	116	45.1 Å²	45.1	54%	0.542	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	140.1	-172.7	-65.2	171.3	149	0	0	112	W50 N51 T54 L58	W50-E56 CarbonylContact C-O 3.56Å; W50-E56 VanDerWaalsContact CA-O 3.23Å; W50-E56 WeakPolarHBondContact CA-O 3.41Å; N51-E56 PolarHBondContact N-O 2.72Å; N51-E56 PolarHBondContact O-N 3.17Å; T54-E56 PolarHBondContact O-N 3.05Å; T54-E56 WeakPolarHBondContact OG1-CB 3.46Å; T54-E56 WeakPolarHBondContact OG1-CG 3.4Å; T54-E56 PolarHBondContact OG1-N 2.65Å; T54-E56 PolarHBondContact OG1-OE2 3.06Å; E56-L58 PolarHBondContact O-N 2.9Å
57	A	79.3	Confident	81.7	Confident	63 Å²	63	44.4 Å²	44.4	52%	0.521	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	115.9	169.1	0	0	0	0	0	109.3
58	L	82.7	Confident	81.8	Confident	55 Å²	55	44.7 Å²	44.7	29%	0.288	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-48.6	-177.4	-62.9	-179.5	0	0	0	112.3	L49 N51 E56 A265	L49-L58 PolarHBondContact O-N 3.03Å; N51-L58 HydrophobicContact CB-CD1 3.91Å; N51-L58 HydrophobicContact CB-CD2 4.13Å; N51-L58 HydrophobicContact CB-CG 3.96Å; E56-L58 PolarHBondContact O-N 2.9Å; L58-A265 HydrophobicContact CD1-CB 4.47Å
59	I	85.4	Confident	82.1	Confident	23 Å²	23	44.1 Å²	44.1	12%	0.118	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	137.3	-172.1	-60.5	157.7	0	0	0	109.7	F48 L49 I61 W268 L269	F48-I59 CarbonylContact C-O 3.55Å; F48-I59 WeakPolarHBondContact CA-O 3.33Å; L49-I59 HydrophobicContact CB-CB 4.19Å; L49-I59 HydrophobicContact CD1-CB 4.32Å; L49-I59 HydrophobicContact CD1-CG2 4.42Å; L49-I59 HydrophobicContact CD2-CD1 4.38Å; L49-I59 PolarHBondContact N-O 3.07Å; L49-I59 PolarHBondContact O-N 3.24Å; I59-I61 HydrophobicContact CG2-CG1 3.94Å; I59-W268 HydrophobicContact CD1-CH2 4.29Å; I59-W268 HydrophobicContact CD1-CZ3 4.01Å; I59-L269 HydrophobicContact CD1-CD1 3.65Å; I59-L269 HydrophobicContact CG1-CD1 4.1Å
60	E	86.1	Confident	82.5	Confident	96 Å²	96	44.4 Å²	44.4	45%	0.449	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116.4	166.5	-179.9	-176.8	162.8	0	0	109	K46 I47 F48	K46-E60 VanDerWaalsContact CD-OE1 3.3Å; K46-E60 WeakPolarHBondContact CD-OE1 2.87Å; K46-E60 VanDerWaalsContact CE-OE1 3.32Å; K46-E60 WeakPolarHBondContact CE-OE1 3.31Å; K46-E60 IonicContact NZ-OE1 2.77Å; K46-E60 PolarHBondContact NZ-OE1 3.43Å; I47-E60 CarbonylContact O-C 3.46Å; I47-E60 WeakPolarHBondContact O-CA 3.4Å; F48-E60 HydrophobicContact CD1-CB 4.05Å; F48-E60 HydrophobicContact CD1-CG 4Å; F48-E60 HydrophobicContact CE1-CB 4.04Å; F48-E60 HydrophobicContact CE1-CG 3.62Å; F48-E60 HydrophobicContact CZ-CG 4.16Å
61	I	87.3	Confident	83.1	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113	171.3	-52.2	173.6	0	0	0	107.3	K46 I47 L49 I59 L80 I92	K46-I61 WeakPolarHBondContact CA-O 3.43Å; I47-I61 HydrophobicContact CB-CB 4.18Å; I47-I61 PolarHBondContact N-O 3.33Å; I47-I61 PolarHBondContact O-N 3.19Å; L49-I61 HydrophobicContact CD1-CD1 3.78Å; L49-I61 HydrophobicContact CD1-CG1 4.15Å; I59-I61 HydrophobicContact CG2-CG1 3.94Å; I61-L80 HydrophobicContact CD1-CD2 3.91Å; I61-I92 HydrophobicContact CD1-CG2 4.35Å; I61-I92 HydrophobicContact CG2-CG2 4.37Å
62	S	86.1	Confident	83.7	Confident	75 Å²	75	44.7 Å²	44.7	52%	0.524	28%	0.278	S	S	.	.			trans	-116.2	161.2	174.4	60.2	0	0	0	0	110.2
63	G	84.1	Confident	84.5	Confident	68 Å²	68	44.4 Å²	44.4	70%	0.701	28%	0.276	S	S	*	.			trans	125	-5.6	177	0	0	0	0	0	114.9
64	H	88.6	Confident	85.2	Confident	17 Å²	17	41.9 Å²	41.9	8%	0.079	26%	0.257	C	S	.	.			trans	-64.5	133.1	166.7	-68.5	79	0	0	0	109.5	A45 D66 I68 T82	A45-H64 HydrophobicContact CB-CB 4.1Å; A45-H64 WeakPolarHBondContact CB-O 3.49Å; A45-H64 WeakPolarHBondContact O-CB 3.42Å; H64-D66 VanDerWaalsContact C-N 3.3Å; H64-D66 PolarHBondContact O-N 3.28Å; H64-I68 HydrophobicContact CB-CD1 4.13Å; H64-I68 HydrophobicContact CB-CG1 3.98Å; H64-T82 PolarHBondContact NE2-OG1 3.24Å
65	P	90.9	Very high	85.3	Confident	90 Å²	90	41.1 Å²	41.1	58%	0.584	25%	0.247	S	C	*	.	S	Bend	trans	-78.8	-14.1	-176	31.4	-36.3	0	0	0	113.4	D86	P65-D86 WeakPolarHBondContact CD-OD2 3.44Å; P65-D86 HydrophobicContact CG-CB 3.86Å; P65-D86 WeakPolarHBondContact CG-OD2 3.27Å
66	D	89.2	Confident	85.5	Confident	53 Å²	53	41.8 Å²	41.8	28%	0.283	25%	0.246	S	C	.	.	S	Bend	trans	-153.3	-177.4	-178.2	-154.5	-31.3	0	0	0	109.5	A45 H64 I68 C84 K85	A45-D66 WeakPolarHBondContact CB-O 3.39Å; H64-D66 VanDerWaalsContact C-N 3.3Å; H64-D66 PolarHBondContact O-N 3.28Å; D66-I68 PolarHBondContact O-N 2.74Å; D66-C84 VanDerWaalsContact C-SG 3.55Å; D66-C84 PolarHBondContact O-SG 2.96Å; D66-K85 HydrophobicContact CB-CB 4.01Å; D66-K85 VanDerWaalsContact CG-NZ 3.28Å; D66-K85 IonicContact OD1-NZ 3.94Å; D66-K85 PolarHBondContact OD1-NZ 2.63Å; D66-K85 WeakPolarHBondContact OD2-CG 3.29Å; D66-K85 IonicContact OD2-NZ 2.66Å; D66-K85 PolarHBondContact OD2-NZ 2.99Å
67	L	86.2	Confident	85.6	Confident	63 Å²	63	36.3 Å²	36.3	33%	0.33	22%	0.22	S	C	.	.			trans	-52.7	136.6	-177.7	-67.3	172.6	0	0	0	112.7	C84 K85	L67-C84 CarbonylContact O-C 3.49Å; L67-C84 VanDerWaalsContact O-CA 3.31Å; L67-C84 WeakPolarHBondContact O-CA 3.4Å; L67-C84 PolarHBondContact O-SG 2.81Å; L67-C84 VanDerWaalsContact O-SG 3.36Å; L67-K85 HydrophobicContact CB-CB 4.2Å; L67-K85 HydrophobicContact CB-CD 4.44Å; L67-K85 HydrophobicContact CD1-CD 4.26Å; L67-K85 PolarHBondContact O-N 3.33Å
68	I	85.4	Confident	86	Confident	6 Å²	6	34.3 Å²	34.3	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.5	175.2	-57.5	167.3	0	0	0	107.8	N23 I47 H64 D66 I71 T83	N23-I68 PolarHBondContact ND2-O 3.44Å; I47-I68 HydrophobicContact CD1-CD1 3.94Å; I47-I68 HydrophobicContact CG1-CD1 3.44Å; I47-I68 VanDerWaalsContact CG1-CD1 3.44Å; H64-I68 HydrophobicContact CB-CD1 4.13Å; H64-I68 HydrophobicContact CB-CG1 3.98Å; D66-I68 PolarHBondContact O-N 2.74Å; I68-I71 HydrophobicContact CG2-CD1 3.98Å; I68-I71 HydrophobicContact CG2-CG1 3.58Å; I68-T83 CarbonylContact C-O 3.58Å; I68-T83 WeakPolarHBondContact CA-O 3.31Å
69	W	89.1	Confident	86.4	Confident	17 Å²	17	34 Å²	34	6%	0.064	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-32.1	-176.1	-70.4	-31.9	0	0	0	113.7	N23 T83 C84 K85 K110 P111 Q112 R113	N23-W69 PolarHBondContact ND2-O 2.98Å; N23-W69 PolarHBondContact OD1-O 3.03Å; W69-T83 PolarHBondContact N-O 3.18Å; W69-C84 WeakPolarHBondContact CZ3-O 3.48Å; W69-K85 HydrophobicContact CD2-CB 4.26Å; W69-K85 HydrophobicContact CH2-CB 4.09Å; W69-K85 HydrophobicContact CH2-CG 4.16Å; W69-K85 HydrophobicContact CZ2-CB 3.54Å; W69-K85 HydrophobicContact CZ2-CD 3.95Å; W69-K85 HydrophobicContact CZ2-CG 3.56Å; W69-K110 WeakPolarHBondContact CH2-O 3.23Å; W69-P111 HydrophobicContact CB-CB 4.22Å; W69-P111 HydrophobicContact CD2-CB 3.91Å; W69-P111 HydrophobicContact CD2-CG 4.45Å; W69-P111 HydrophobicContact CE3-CB 4.49Å; W69-P111 HydrophobicContact CG-CB 3.82Å; W69-P111 HydrophobicContact CG-CG 4.44Å; W69-P111 HydrophobicContact CZ2-CG 4.47Å; W69-Q112 HydrophobicContact CE3-CG 3.61Å; W69-Q112 HydrophobicContact CZ3-CG 3.84Å; W69-R113 PolarHBondContact O-NH1 3.43Å; W69-R113 VanDerWaalsContact O-NH1 3.1Å
70	S	88.3	Confident	86.7	Confident	7 Å²	7	33 Å²	33	5%	0.049	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	145.4	-178.4	-160.5	0	0	0	0	110	T82 T83 R113 A114	S70-T82 CarbonylContact O-C 3.59Å; S70-T82 VanDerWaalsContact O-CA 3.27Å; S70-T82 WeakPolarHBondContact O-CA 3.36Å; S70-T83 WeakPolarHBondContact CB-OG1 3.48Å; S70-T83 PolarHBondContact N-OG1 3.3Å; S70-T83 PolarHBondContact O-N 2.67Å; S70-R113 WeakPolarHBondContact OG-CD 3.41Å; S70-A114 PolarHBondContact OG-O 3.45Å
71	I	88.6	Confident	87.1	Confident	12 Å²	12	28.4 Å²	28.4	6%	0.062	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	135.8	173.9	-56.5	173	0	0	0	107.2	V25 A40 I47 I68 L80 L81 T82	V25-I71 HydrophobicContact CG2-CB 3.7Å; V25-I71 HydrophobicContact CG2-CG2 3.85Å; A40-I71 HydrophobicContact CB-CG2 3.77Å; I47-I71 HydrophobicContact CD1-CD1 4.01Å; I47-I71 HydrophobicContact CD1-CG1 4.34Å; I47-I71 HydrophobicContact CG1-CD1 3.91Å; I47-I71 HydrophobicContact CG2-CD1 4.1Å; I68-I71 HydrophobicContact CG2-CD1 3.98Å; I68-I71 HydrophobicContact CG2-CG1 3.58Å; I71-L80 HydrophobicContact CG2-CD1 3.5Å; I71-L80 HydrophobicContact CG2-CD2 4.35Å; I71-L80 HydrophobicContact CG2-CG 4.03Å; I71-L81 CarbonylContact C-O 3.54Å; I71-L81 VanDerWaalsContact CA-O 3.24Å; I71-L81 WeakPolarHBondContact CA-O 3.29Å; I71-T82 HydrophobicContact CG1-CG2 4.35Å
72	D	89.5	Confident	87.3	Confident	3 Å²	3	28.2 Å²	28.2	2%	0.016	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	145.4	176.3	-168.3	49.3	0	0	0	110.5	N27 L81 I115 F116	N27-D72 PolarHBondContact ND2-OD1 3.45Å; D72-L81 HydrophobicContact CB-CB 4.44Å; D72-L81 PolarHBondContact N-O 3.2Å; D72-L81 PolarHBondContact O-N 2.71Å; D72-I115 HydrophobicContact CB-CG2 4.42Å; D72-I115 VanDerWaalsContact OD2-CA 3.26Å; D72-I115 WeakPolarHBondContact OD2-CA 3.38Å; D72-F116 PolarHBondContact OD2-N 3.47Å
73	F	87	Confident	87.6	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.009	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.6	173.3	-84	-94.7	0	0	0	109.9	V31 A40 L49 L80 P94 W268	V31-F73 HydrophobicContact CB-CD2 4.14Å; V31-F73 HydrophobicContact CB-CE2 4.37Å; V31-F73 HydrophobicContact CG1-CD2 3.77Å; V31-F73 HydrophobicContact CG1-CE2 3.6Å; V31-F73 HydrophobicContact CG1-CG 4.34Å; V31-F73 HydrophobicContact CG1-CZ 4.08Å; V31-F73 HydrophobicContact CG2-CB 4.34Å; V31-F73 HydrophobicContact CG2-CD2 3.29Å; V31-F73 HydrophobicContact CG2-CE2 3.78Å; V31-F73 HydrophobicContact CG2-CG 4.1Å; A40-F73 HydrophobicContact CB-CE2 3.93Å; L49-F73 HydrophobicContact CD2-CZ 3.89Å; F73-L80 HydrophobicContact CD1-CD1 4.07Å; F73-L80 HydrophobicContact CD2-CD1 3.57Å; F73-L80 HydrophobicContact CE1-CD1 3.95Å; F73-L80 HydrophobicContact CE2-CD1 3.45Å; F73-L80 VanDerWaalsContact CE2-CD1 3.45Å; F73-L80 HydrophobicContact CG-CD1 3.94Å; F73-L80 HydrophobicContact CZ-CD1 3.66Å; F73-P94 HydrophobicContact CE1-CB 3.95Å; F73-P94 HydrophobicContact CE1-CG 4.08Å; F73-P94 HydrophobicContact CZ-CB 4.46Å; F73-W268 HydrophobicContact CE1-CZ2 4.46Å
74	N	87.8	Confident	88	Confident	16 Å²	16	21.4 Å²	21.4	9%	0.086	11%	0.113	C	C	.	.			trans	-69.8	167.8	169.2	77.6	-39.6	0	0	0	110.9	N76 G77 S78 K79 F116	N74-N76 PolarHBondContact ND2-OD1 3.44Å; N74-N76 PolarHBondContact O-N 3.07Å; N74-N76 PolarHBondContact OD1-OD1 3.11Å; N74-G77 PolarHBondContact O-N 2.83Å; N74-G77 WeakPolarHBondContact OD1-CA 3.5Å; N74-G77 PolarHBondContact OD1-N 2.99Å; N74-S78 PolarHBondContact ND2-OG 2.76Å; N74-S78 PolarHBondContact OD1-N 3.31Å; N74-K79 HydrophobicContact CB-CB 4.2Å; N74-K79 PolarHBondContact N-O 2.82Å; N74-K79 PolarHBondContact OD1-N 3.36Å; N74-K79 PolarHBondContact OD1-O 3.32Å; N74-F116 VanDerWaalsContact CA-CD2 3.4Å; N74-F116 HydrophobicContact CB-CB 4.2Å; N74-F116 HydrophobicContact CB-CD1 3.99Å; N74-F116 HydrophobicContact CB-CD2 3.54Å; N74-F116 HydrophobicContact CB-CE1 4.18Å; N74-F116 HydrophobicContact CB-CE2 3.68Å; N74-F116 HydrophobicContact CB-CG 3.66Å; N74-F116 HydrophobicContact CB-CZ 4.02Å
75	Y	78.9	Confident	88.1	Confident	57 Å²	57	25 Å²	25	22%	0.224	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.8	-171.1	-170.6	-98.4	0	0	0	115.3	L34 N165 L276	L34-Y75 VanDerWaalsContact CD1-O 3.29Å; L34-Y75 WeakPolarHBondContact CD1-O 3.47Å; L34-Y75 WeakPolarHBondContact CD2-O 3.43Å; Y75-N165 HydrophobicContact CD2-CB 4.46Å; Y75-N165 HydrophobicContact CE2-CB 4.23Å; Y75-L276 HydrophobicContact CD1-CB 4.4Å; Y75-L276 HydrophobicContact CE1-CB 3.53Å
76	N	78	Confident	88.3	Confident	34 Å²	34	23 Å²	23	18%	0.182	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	3.7	177	73.9	6.7	0	0	0	115.1	L34 N74 S78 D275	L34-N76 VanDerWaalsContact CD2-C 3.41Å; L34-N76 HydrophobicContact CD2-CB 4.42Å; L34-N76 WeakPolarHBondContact CD2-O 3.38Å; N74-N76 PolarHBondContact ND2-OD1 3.44Å; N74-N76 PolarHBondContact O-N 3.07Å; N74-N76 PolarHBondContact OD1-OD1 3.11Å; N76-S78 PolarHBondContact O-N 2.64Å; N76-S78 WeakPolarHBondContact OD1-CB 3.34Å; N76-S78 PolarHBondContact OD1-N 3.44Å; N76-S78 PolarHBondContact OD1-OG 3.05Å; N76-D275 PolarHBondContact ND2-OD1 2.77Å
77	G	80.2	Confident	88.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	74.7	2.8	173.1	0	0	0	0	0	115.4	L34 N74 K79 W268	L34-G77 VanDerWaalsContact CD1-CA 3.47Å; N74-G77 PolarHBondContact O-N 2.83Å; N74-G77 WeakPolarHBondContact OD1-CA 3.5Å; N74-G77 PolarHBondContact OD1-N 2.99Å; G77-K79 PolarHBondContact O-N 2.81Å; G77-W268 PolarHBondContact O-NE1 2.94Å
78	S	87.2	Confident	89.1	Confident	21 Å²	21	22.9 Å²	22.9	15%	0.147	11%	0.108	C	C	.	.	S	Bend	trans	-73.5	-14.7	177	61.8	0	0	0	0	113.2	N74 N76 P94	N74-S78 PolarHBondContact ND2-OG 2.76Å; N74-S78 PolarHBondContact OD1-N 3.31Å; N76-S78 PolarHBondContact O-N 2.64Å; N76-S78 WeakPolarHBondContact OD1-CB 3.34Å; N76-S78 PolarHBondContact OD1-N 3.44Å; N76-S78 PolarHBondContact OD1-OG 3.05Å; S78-P94 VanDerWaalsContact O-CD 3.23Å; S78-P94 WeakPolarHBondContact O-CD 3.49Å
79	K	91.7	Very high	89.6	Confident	50 Å²	50	22.6 Å²	22.6	22%	0.217	11%	0.107	C	C	.	.			trans	-137	143.8	-176.2	-60.4	173.6	-166.7	162.8	0	111.7	N74 G77 V91 L100 F116 E140	N74-K79 HydrophobicContact CB-CB 4.2Å; N74-K79 PolarHBondContact N-O 2.82Å; N74-K79 PolarHBondContact OD1-N 3.36Å; N74-K79 PolarHBondContact OD1-O 3.32Å; G77-K79 PolarHBondContact O-N 2.81Å; K79-V91 HydrophobicContact CB-CG1 4.08Å; K79-V91 HydrophobicContact CD-CG1 4.07Å; K79-V91 HydrophobicContact CG-CG1 4.27Å; K79-L100 HydrophobicContact CG-CD1 4.33Å; K79-F116 HydrophobicContact CB-CE2 4.19Å; K79-F116 HydrophobicContact CB-CZ 3.89Å; K79-E140 VanDerWaalsContact CD-OE1 3.23Å; K79-E140 WeakPolarHBondContact CD-OE1 3.29Å; K79-E140 WeakPolarHBondContact CE-OE1 3.1Å; K79-E140 IonicContact NZ-OE1 3.36Å; K79-E140 PolarHBondContact NZ-OE1 3.22Å; K79-E140 IonicContact NZ-OE2 2.9Å; K79-E140 PolarHBondContact NZ-OE2 3.36Å
80	L	90.9	Very high	90	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122	176.1	-169.9	72.1	0	0	0	109.8	A40 I47 I61 I71 F73 T82 V91 I92 P94	A40-L80 HydrophobicContact CB-CD1 4.34Å; I47-L80 HydrophobicContact CD1-CD2 3.8Å; I47-L80 HydrophobicContact CG2-CD2 4.2Å; I61-L80 HydrophobicContact CD1-CD2 3.91Å; I71-L80 HydrophobicContact CG2-CD1 3.5Å; I71-L80 HydrophobicContact CG2-CD2 4.35Å; I71-L80 HydrophobicContact CG2-CG 4.03Å; F73-L80 HydrophobicContact CD1-CD1 4.07Å; F73-L80 HydrophobicContact CD2-CD1 3.57Å; F73-L80 HydrophobicContact CE1-CD1 3.95Å; F73-L80 HydrophobicContact CE2-CD1 3.45Å; F73-L80 VanDerWaalsContact CE2-CD1 3.45Å; F73-L80 HydrophobicContact CG-CD1 3.94Å; F73-L80 HydrophobicContact CZ-CD1 3.66Å; L80-T82 HydrophobicContact CD2-CG2 4.21Å; L80-T82 HydrophobicContact CG-CG2 4.18Å; L80-V91 CarbonylContact O-C 3.57Å; L80-V91 WeakPolarHBondContact O-CA 3.05Å; L80-I92 HydrophobicContact CB-CB 4.35Å; L80-I92 PolarHBondContact N-O 2.9Å; L80-I92 PolarHBondContact O-N 3.48Å; L80-P94 HydrophobicContact CB-CB 4.13Å
81	L	93.5	Very high	90.4	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	133.6	173.9	174.1	58.7	0	0	0	109.4	I71 D72 I89 R90 V91 A114 F116 I122	I71-L81 CarbonylContact C-O 3.54Å; I71-L81 VanDerWaalsContact CA-O 3.24Å; I71-L81 WeakPolarHBondContact CA-O 3.29Å; D72-L81 HydrophobicContact CB-CB 4.44Å; D72-L81 PolarHBondContact N-O 3.2Å; D72-L81 PolarHBondContact O-N 2.71Å; L81-I89 HydrophobicContact CD1-CG2 3.38Å; L81-R90 CarbonylContact C-O 3.29Å; L81-R90 WeakPolarHBondContact CA-O 3.34Å; L81-R90 WeakPolarHBondContact CD1-O 3.17Å; L81-V91 HydrophobicContact CD1-CG2 4.29Å; L81-A114 HydrophobicContact CD1-CB 4.42Å; L81-A114 HydrophobicContact CD2-CB 3.74Å; L81-A114 HydrophobicContact CG-CB 4.15Å; L81-F116 HydrophobicContact CB-CD2 3.68Å; L81-F116 HydrophobicContact CB-CE2 3.31Å; L81-F116 HydrophobicContact CB-CZ 3.9Å; L81-F116 HydrophobicContact CD2-CD2 4.25Å; L81-F116 HydrophobicContact CD2-CE2 4.49Å; L81-F116 HydrophobicContact CD2-CG 4.47Å; L81-F116 HydrophobicContact CG-CE2 4.49Å; L81-I122 HydrophobicContact CD1-CD1 3.72Å; L81-I122 HydrophobicContact CD1-CG2 4.32Å; L81-I122 HydrophobicContact CD2-CB 4.49Å; L81-I122 HydrophobicContact CD2-CD1 4.09Å; L81-I122 HydrophobicContact CD2-CG1 4.24Å; L81-I122 HydrophobicContact CD2-CG2 3.6Å; L81-I122 HydrophobicContact CG-CD1 4.48Å
82	T	92.4	Very high	90.7	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.6	177.7	67.2	0	0	0	0	110.8	I47 H64 S70 I71 L80 I89 R90 I92	I47-T82 HydrophobicContact CD1-CG2 3.42Å; I47-T82 VanDerWaalsContact CD1-CG2 3.42Å; H64-T82 PolarHBondContact NE2-OG1 3.24Å; S70-T82 CarbonylContact O-C 3.59Å; S70-T82 VanDerWaalsContact O-CA 3.27Å; S70-T82 WeakPolarHBondContact O-CA 3.36Å; I71-T82 HydrophobicContact CG1-CG2 4.35Å; L80-T82 HydrophobicContact CD2-CG2 4.21Å; L80-T82 HydrophobicContact CG-CG2 4.18Å; T82-I89 WeakPolarHBondContact O-CA 3.09Å; T82-R90 PolarHBondContact N-O 2.88Å; T82-R90 PolarHBondContact O-N 2.77Å; T82-I92 HydrophobicContact CG2-CD1 3.91Å
83	T	93.1	Very high	90.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.8	167.3	67.5	0	0	0	0	109.3	I68 W69 S70 I89 Q112 A114	I68-T83 CarbonylContact C-O 3.58Å; I68-T83 WeakPolarHBondContact CA-O 3.31Å; W69-T83 PolarHBondContact N-O 3.18Å; S70-T83 WeakPolarHBondContact CB-OG1 3.48Å; S70-T83 PolarHBondContact N-OG1 3.3Å; S70-T83 PolarHBondContact O-N 2.67Å; T83-I89 HydrophobicContact CG2-CG1 4.1Å; T83-Q112 HydrophobicContact CG2-CG 4.27Å; T83-Q112 PolarHBondContact OG1-O 3.15Å; T83-A114 HydrophobicContact CG2-CB 3.41Å; T83-A114 VanDerWaalsContact CG2-CB 3.41Å
84	C	91.6	Very high	90.9	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	157.9	-174	177.1	0	0	0	0	111.1	D66 L67 W69 D86 K87 M88	D66-C84 VanDerWaalsContact C-SG 3.55Å; D66-C84 PolarHBondContact O-SG 2.96Å; L67-C84 CarbonylContact O-C 3.49Å; L67-C84 VanDerWaalsContact O-CA 3.31Å; L67-C84 WeakPolarHBondContact O-CA 3.4Å; L67-C84 PolarHBondContact O-SG 2.81Å; L67-C84 VanDerWaalsContact O-SG 3.36Å; W69-C84 WeakPolarHBondContact CZ3-O 3.48Å; C84-D86 WeakPolarHBondContact CB-OD1 3.28Å; C84-D86 PolarHBondContact O-N 2.85Å; C84-D86 VanDerWaalsContact SG-CG 3.52Å; C84-D86 PolarHBondContact SG-OD1 2.82Å; C84-D86 VanDerWaalsContact SG-OD1 3.35Å; C84-K87 WeakPolarHBondContact O-CA 3.31Å; C84-K87 PolarHBondContact O-N 3.43Å; C84-M88 PolarHBondContact N-O 2.83Å; C84-M88 VanDerWaalsContact N-O 3.11Å
85	K	91.5	Very high	90.9	Very high	92 Å²	92	25 Å²	25	40%	0.4	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.4	178.1	177.5	159.3	155	-85	0	113.6	D66 L67 W69 K87	D66-K85 HydrophobicContact CB-CB 4.01Å; D66-K85 VanDerWaalsContact CG-NZ 3.28Å; D66-K85 IonicContact OD1-NZ 3.94Å; D66-K85 PolarHBondContact OD1-NZ 2.63Å; D66-K85 WeakPolarHBondContact OD2-CG 3.29Å; D66-K85 IonicContact OD2-NZ 2.66Å; D66-K85 PolarHBondContact OD2-NZ 2.99Å; L67-K85 HydrophobicContact CB-CB 4.2Å; L67-K85 HydrophobicContact CB-CD 4.44Å; L67-K85 HydrophobicContact CD1-CD 4.26Å; L67-K85 PolarHBondContact O-N 3.33Å; W69-K85 HydrophobicContact CD2-CB 4.26Å; W69-K85 HydrophobicContact CH2-CB 4.09Å; W69-K85 HydrophobicContact CH2-CG 4.16Å; W69-K85 HydrophobicContact CZ2-CB 3.54Å; W69-K85 HydrophobicContact CZ2-CD 3.95Å; W69-K85 HydrophobicContact CZ2-CG 3.56Å; K85-K87 PolarHBondContact O-N 2.86Å; K85-K87 VanDerWaalsContact O-N 3.12Å
86	D	94.1	Very high	91.5	Very high	48 Å²	48	25.9 Å²	25.9	26%	0.257	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	2.4	165.4	72.3	-6.8	0	0	0	113.9	P65 C84 M88 R90	P65-D86 WeakPolarHBondContact CD-OD2 3.44Å; P65-D86 HydrophobicContact CG-CB 3.86Å; P65-D86 WeakPolarHBondContact CG-OD2 3.27Å; C84-D86 WeakPolarHBondContact CB-OD1 3.28Å; C84-D86 PolarHBondContact O-N 2.85Å; C84-D86 VanDerWaalsContact SG-CG 3.52Å; C84-D86 PolarHBondContact SG-OD1 2.82Å; C84-D86 VanDerWaalsContact SG-OD1 3.35Å; D86-M88 PolarHBondContact O-N 2.87Å; D86-M88 WeakPolarHBondContact OD1-CB 3.13Å; D86-M88 PolarHBondContact OD1-N 2.83Å; D86-R90 IonicContact OD1-NH1 3.79Å; D86-R90 PolarHBondContact OD1-NH1 2.77Å; D86-R90 IonicContact OD2-CZ 2.67Å; D86-R90 IonicContact OD2-NH1 3Å; D86-R90 PolarHBondContact OD2-NH1 3.21Å; D86-R90 IonicContact OD2-NH2 3.23Å; D86-R90 PolarHBondContact OD2-NH2 2.83Å
87	K	95.3	Very high	92.1	Very high	78 Å²	78	25.2 Å²	25.2	34%	0.339	13%	0.131	S	C	.	.	S	Bend	trans	72.5	4.4	-179.3	-51.1	-177.7	-178	-175	0	114.9	C84 K85 G105 E107 Q112	C84-K87 WeakPolarHBondContact O-CA 3.31Å; C84-K87 PolarHBondContact O-N 3.43Å; K85-K87 PolarHBondContact O-N 2.86Å; K85-K87 VanDerWaalsContact O-N 3.12Å; K87-G105 VanDerWaalsContact O-CA 3.28Å; K87-G105 WeakPolarHBondContact O-CA 3.31Å; K87-G105 PolarHBondContact O-N 2.88Å; K87-E107 WeakPolarHBondContact CE-O 3.08Å; K87-E107 PolarHBondContact NZ-O 2.94Å; K87-Q112 PolarHBondContact O-NE2 2.73Å
88	M	96.6	Very high	92.8	Very high	37 Å²	37	33 Å²	33	18%	0.182	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144	-179.6	-58.7	-62.2	-75.6	0	0	111.5	C84 D86 Q102	C84-M88 PolarHBondContact N-O 2.83Å; C84-M88 VanDerWaalsContact N-O 3.11Å; D86-M88 PolarHBondContact O-N 2.87Å; D86-M88 WeakPolarHBondContact OD1-CB 3.13Å; D86-M88 PolarHBondContact OD1-N 2.83Å; M88-Q102 HydrophobicContact CE-CB 4.37Å; M88-Q102 HydrophobicContact CE-CG 4.24Å
89	I	97.5	Very high	93.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132	165.6	-56.1	-178	0	0	0	107.1	L81 T82 T83 Q102 G103	L81-I89 HydrophobicContact CD1-CG2 3.38Å; T82-I89 WeakPolarHBondContact O-CA 3.09Å; T83-I89 HydrophobicContact CG2-CG1 4.1Å; I89-Q102 VanDerWaalsContact O-CA 3.27Å; I89-Q102 WeakPolarHBondContact O-CA 3.49Å; I89-G103 PolarHBondContact N-O 2.8Å; I89-G103 PolarHBondContact O-N 3.24Å
90	R	96.7	Very high	93.5	Very high	20 Å²	20	36.1 Å²	36.1	8%	0.075	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136	-179	-59.5	-179.1	170.9	84.7	0.6	111.2	L81 T82 D86 I92 Q101 Q102	L81-R90 CarbonylContact C-O 3.29Å; L81-R90 WeakPolarHBondContact CA-O 3.34Å; L81-R90 WeakPolarHBondContact CD1-O 3.17Å; T82-R90 PolarHBondContact N-O 2.88Å; T82-R90 PolarHBondContact O-N 2.77Å; D86-R90 IonicContact OD1-NH1 3.79Å; D86-R90 PolarHBondContact OD1-NH1 2.77Å; D86-R90 IonicContact OD2-CZ 2.67Å; D86-R90 IonicContact OD2-NH1 3Å; D86-R90 PolarHBondContact OD2-NH1 3.21Å; D86-R90 IonicContact OD2-NH2 3.23Å; D86-R90 PolarHBondContact OD2-NH2 2.83Å; R90-I92 HydrophobicContact CB-CD1 4.25Å; R90-I92 HydrophobicContact CB-CG1 4.04Å; R90-Q101 WeakPolarHBondContact CA-O 3.43Å; R90-Q102 HydrophobicContact CG-CB 3.92Å
91	V	96.8	Very high	93.8	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	124.5	164.1	176.7	0	0	0	0	107.4	K79 L80 L81 L100 Q101 F116 I122 E140 L143	K79-V91 HydrophobicContact CB-CG1 4.08Å; K79-V91 HydrophobicContact CD-CG1 4.07Å; K79-V91 HydrophobicContact CG-CG1 4.27Å; L80-V91 CarbonylContact O-C 3.57Å; L80-V91 WeakPolarHBondContact O-CA 3.05Å; L81-V91 HydrophobicContact CD1-CG2 4.29Å; V91-L100 HydrophobicContact CG1-CB 4.42Å; V91-L100 HydrophobicContact CG1-CD1 4.41Å; V91-L100 PolarHBondContact O-N 3.42Å; V91-Q101 HydrophobicContact CB-CB 4.24Å; V91-Q101 PolarHBondContact N-O 3.16Å; V91-Q101 PolarHBondContact O-N 3Å; V91-Q101 VanDerWaalsContact O-N 3.14Å; V91-F116 HydrophobicContact CG1-CZ 4.12Å; V91-F116 HydrophobicContact CG2-CE1 4.4Å; V91-F116 HydrophobicContact CG2-CZ 4.07Å; V91-I122 HydrophobicContact CG2-CD1 3.67Å; V91-E140 HydrophobicContact CG2-CG 4.17Å; V91-L143 HydrophobicContact CG2-CD1 4.02Å
92	I	94.5	Very high	94	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	141.9	-169.9	-57.3	176.4	0	0	0	107.9	I61 L80 T82 R90 P94 R98 I99	I61-I92 HydrophobicContact CD1-CG2 4.35Å; I61-I92 HydrophobicContact CG2-CG2 4.37Å; L80-I92 HydrophobicContact CB-CB 4.35Å; L80-I92 PolarHBondContact N-O 2.9Å; L80-I92 PolarHBondContact O-N 3.48Å; T82-I92 HydrophobicContact CG2-CD1 3.91Å; R90-I92 HydrophobicContact CB-CD1 4.25Å; R90-I92 HydrophobicContact CB-CG1 4.04Å; I92-P94 VanDerWaalsContact O-CD 3.29Å; I92-P94 WeakPolarHBondContact O-CD 3.42Å; I92-R98 WeakPolarHBondContact CA-O 3.49Å; I92-I99 HydrophobicContact CG1-CG1 4.35Å
93	D	92.5	Very high	94.2	Very high	32 Å²	32	44.7 Å²	44.7	17%	0.171	22%	0.216	C	C	.	.			trans	-74.7	110.9	163.5	170.2	3.5	0	0	0	108.3	R95 S96 G97 R98 L100	D93-R95 PolarHBondContact O-N 3.18Å; D93-R95 WeakPolarHBondContact OD1-CB 3.25Å; D93-R95 PolarHBondContact OD1-N 3.02Å; D93-S96 WeakPolarHBondContact CB-OG 3.3Å; D93-S96 PolarHBondContact O-N 3.05Å; D93-S96 WeakPolarHBondContact OD2-CB 3.4Å; D93-S96 PolarHBondContact OD2-OG 2.98Å; D93-G97 WeakPolarHBondContact O-CA 3.39Å; D93-G97 PolarHBondContact O-N 3.34Å; D93-R98 PolarHBondContact N-O 3.45Å; D93-L100 HydrophobicContact CB-CD1 4.11Å; D93-L100 HydrophobicContact CB-CD2 4.08Å; D93-L100 HydrophobicContact CB-CG 4.11Å
94	P	88.4	Confident	94.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.5	-174.6	25.8	-33.6	0	0	0	113.6	L49 F73 S78 L80 I92 W268	L49-P94 HydrophobicContact CD2-CB 3.97Å; F73-P94 HydrophobicContact CE1-CB 3.95Å; F73-P94 HydrophobicContact CE1-CG 4.08Å; F73-P94 HydrophobicContact CZ-CB 4.46Å; S78-P94 VanDerWaalsContact O-CD 3.23Å; S78-P94 WeakPolarHBondContact O-CD 3.49Å; L80-P94 HydrophobicContact CB-CB 4.13Å; I92-P94 VanDerWaalsContact O-CD 3.29Å; I92-P94 WeakPolarHBondContact O-CD 3.42Å; P94-W268 HydrophobicContact CB-CH2 4Å; P94-W268 HydrophobicContact CB-CZ2 4.03Å; P94-W268 HydrophobicContact CG-CH2 4.05Å; P94-W268 HydrophobicContact CG-CZ2 3.6Å
95	R	88	Confident	94.7	Very high	54 Å²	54	47.7 Å²	47.7	20%	0.204	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-39.3	-177.6	-62.7	172.9	-179.8	123	-3.7	112.2	D93 W268 K272 D273	D93-R95 PolarHBondContact O-N 3.18Å; D93-R95 WeakPolarHBondContact OD1-CB 3.25Å; D93-R95 PolarHBondContact OD1-N 3.02Å; R95-W268 HydrophobicContact CG-CH2 3.85Å; R95-W268 HydrophobicContact CG-CZ2 4.01Å; R95-W268 HydrophobicContact CG-CZ3 4.15Å; R95-W268 VanDerWaalsContact CZ-O 3.28Å; R95-W268 PolarHBondContact NE-O 3.44Å; R95-W268 PolarHBondContact NH2-O 2.81Å; R95-K272 PolarHBondContact NH2-O 2.76Å; R95-D273 IonicContact CZ-OD1 3.22Å; R95-D273 VanDerWaalsContact CZ-OD1 3.25Å; R95-D273 IonicContact NH1-OD1 2.71Å; R95-D273 PolarHBondContact NH1-OD1 3.24Å; R95-D273 IonicContact NH1-OD2 3Å; R95-D273 PolarHBondContact NH1-OD2 3.29Å; R95-D273 IonicContact NH2-OD1 3.15Å; R95-D273 PolarHBondContact NH2-OD1 3.1Å; R95-D273 IonicContact NH2-OD2 2.96Å
96	S	91.2	Very high	95	Very high	74 Å²	74	43.5 Å²	43.5	52%	0.517	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-15.9	-177.5	66.2	0	0	0	0	113.7	D93 R98	D93-S96 WeakPolarHBondContact CB-OG 3.3Å; D93-S96 PolarHBondContact O-N 3.05Å; D93-S96 WeakPolarHBondContact OD2-CB 3.4Å; D93-S96 PolarHBondContact OD2-OG 2.98Å; S96-R98 PolarHBondContact O-N 3.24Å; S96-R98 WeakPolarHBondContact OG-CB 3.19Å; S96-R98 PolarHBondContact OG-N 3.12Å
97	G	90.6	Very high	95.1	Very high	21 Å²	21	47.1 Å²	47.1	22%	0.216	23%	0.233	C	C	.	.			trans	71.2	5.6	-170.8	0	0	0	0	0	113.9	D93	D93-G97 WeakPolarHBondContact O-CA 3.39Å; D93-G97 PolarHBondContact O-N 3.34Å
98	R	95.3	Very high	95.1	Very high	162 Å²	162	43.6 Å²	43.6	61%	0.611	22%	0.219	S	C	*	.			trans	-73.6	130.4	-178	-173.9	178.8	66.8	168.5	0.6	110.9	I92 D93 S96 L100	I92-R98 WeakPolarHBondContact CA-O 3.49Å; D93-R98 PolarHBondContact N-O 3.45Å; S96-R98 PolarHBondContact O-N 3.24Å; S96-R98 WeakPolarHBondContact OG-CB 3.19Å; S96-R98 PolarHBondContact OG-N 3.12Å; R98-L100 PolarHBondContact O-N 2.88Å
99	I	96.2	Very high	95	Very high	78 Å²	78	47.2 Å²	47.2	40%	0.4	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	116.8	170	-58.8	169.8	0	0	0	108.5	I92 Q101 Q102	I92-I99 HydrophobicContact CG1-CG1 4.35Å; I99-Q101 WeakPolarHBondContact CG2-O 3.26Å; I99-Q102 HydrophobicContact CG2-CB 4.1Å
100	L	96.6	Very high	94.8	Very high	60 Å²	60	49.4 Å²	49.4	31%	0.314	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-42.8	177	-60.3	178.9	0	0	0	111.1	K79 V91 D93 R98	K79-L100 HydrophobicContact CG-CD1 4.33Å; V91-L100 HydrophobicContact CG1-CB 4.42Å; V91-L100 HydrophobicContact CG1-CD1 4.41Å; V91-L100 PolarHBondContact O-N 3.42Å; D93-L100 HydrophobicContact CB-CD1 4.11Å; D93-L100 HydrophobicContact CB-CD2 4.08Å; D93-L100 HydrophobicContact CB-CG 4.11Å; R98-L100 PolarHBondContact O-N 2.88Å
101	Q	97.2	Very high	94.6	Very high	81 Å²	81	50.7 Å²	50.7	38%	0.379	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150	176.7	-66.7	-62.7	-15.7	0	0	110	R90 V91 I99 L143	R90-Q101 WeakPolarHBondContact CA-O 3.43Å; V91-Q101 HydrophobicContact CB-CB 4.24Å; V91-Q101 PolarHBondContact N-O 3.16Å; V91-Q101 PolarHBondContact O-N 3Å; V91-Q101 VanDerWaalsContact O-N 3.14Å; I99-Q101 WeakPolarHBondContact CG2-O 3.26Å; Q101-L143 HydrophobicContact CB-CD1 3.88Å; Q101-L143 HydrophobicContact CB-CG 4.45Å
102	Q	97.2	Very high	94.5	Very high	99 Å²	99	50.8 Å²	50.8	46%	0.463	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	152.7	170	66.8	177.4	11.3	0	0	110.6	M88 I89 R90 I99	M88-Q102 HydrophobicContact CE-CB 4.37Å; M88-Q102 HydrophobicContact CE-CG 4.24Å; I89-Q102 VanDerWaalsContact O-CA 3.27Å; I89-Q102 WeakPolarHBondContact O-CA 3.49Å; R90-Q102 HydrophobicContact CG-CB 3.92Å; I99-Q102 HydrophobicContact CG2-CB 4.1Å
103	G	97.9	Very high	94.6	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	163.8	172.9	0	0	0	0	0	112	I89 G105 E144	I89-G103 PolarHBondContact N-O 2.8Å; I89-G103 PolarHBondContact O-N 3.24Å; G103-G105 PolarHBondContact O-N 3.44Å; G103-E144 WeakPolarHBondContact CA-OE2 3.41Å
104	T	97.6	Very high	94.7	Very high	57 Å²	57	50.2 Å²	50.2	35%	0.35	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	126.3	177	-55.4	0	0	0	0	110.4	E144	T104-E144 VanDerWaalsContact CB-OE1 3.25Å; T104-E144 WeakPolarHBondContact CB-OE1 3.25Å; T104-E144 PolarHBondContact N-OE2 2.9Å; T104-E144 PolarHBondContact OG1-OE1 2.88Å; T104-E144 PolarHBondContact OG1-OE2 2.75Å
105	G	96.8	Very high	95	Very high	6 Å²	6	50.7 Å²	50.7	6%	0.062	26%	0.261	C	S	.	.			trans	-86.2	-141.7	174.8	0	0	0	0	0	112.3	K87 G103	K87-G105 VanDerWaalsContact O-CA 3.28Å; K87-G105 WeakPolarHBondContact O-CA 3.31Å; K87-G105 PolarHBondContact O-N 2.88Å; G103-G105 PolarHBondContact O-N 3.44Å
106	H	97.8	Very high	95.3	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.019	25%	0.254	C	S	.	.			trans	-75.6	144	179.3	-62	-77.3	0	0	0	112.5	G108 Q112 S124 T125 G126 M134	H106-G108 VanDerWaalsContact C-N 3.3Å; H106-G108 PolarHBondContact O-N 3.4Å; H106-Q112 PolarHBondContact CD2-OE1 2.74Å; H106-S124 WeakPolarHBondContact NE2-CB 3.47Å; H106-S124 PolarHBondContact NE2-OG 2.98Å; H106-T125 VanDerWaalsContact NE2-C 3.34Å; H106-G126 PolarHBondContact CD2-N 3.38Å; H106-G126 PolarHBondContact NE2-N 3.15Å; H106-M134 PolarHBondContact ND1-SD 2.68Å; H106-M134 VanDerWaalsContact ND1-SD 3.36Å
107	E	96	Very high	95.5	Very high	124 Å²	124	45.1 Å²	45.1	58%	0.579	23%	0.23	S	C	*	.	S	Bend	trans	-69.8	-24.8	-175.3	-62	-171.9	160.1	0	0	114.4	K87 R129	K87-E107 WeakPolarHBondContact CE-O 3.08Å; K87-E107 PolarHBondContact NZ-O 2.94Å; E107-R129 HydrophobicContact CB-CB 4.46Å
108	G	95.8	Very high	95.4	Very high	4 Å²	4	48.1 Å²	48.1	4%	0.041	24%	0.24	C	C	.	.	S	Bend	trans	-61	158.8	-176.9	0	0	0	0	0	113.4	H106 F127 T128	H106-G108 VanDerWaalsContact C-N 3.3Å; H106-G108 PolarHBondContact O-N 3.4Å; G108-F127 VanDerWaalsContact CA-O 3.29Å; G108-F127 WeakPolarHBondContact CA-O 3.22Å; G108-F127 PolarHBondContact N-O 3.17Å; G108-T128 WeakPolarHBondContact CA-O 3.5Å
109	V	93.8	Very high	95.1	Very high	114 Å²	114	44 Å²	44	69%	0.691	23%	0.23	S	C	*	.	S	Bend	trans	-88.5	-11.1	179.7	-62.4	0	0	0	0	113.4
110	K	93.7	Very high	94.9	Very high	46 Å²	46	41.1 Å²	41.1	20%	0.2	22%	0.22	C	C	.	.	S	Bend	trans	-82.7	159	-179.5	-68.9	177.7	-177.5	177.8	0	110.5	W69 Q112 F127 N156	W69-K110 WeakPolarHBondContact CH2-O 3.23Å; K110-Q112 PolarHBondContact O-N 3.37Å; K110-F127 HydrophobicContact CB-CD2 3.44Å; K110-F127 VanDerWaalsContact CB-CD2 3.44Å; K110-F127 HydrophobicContact CB-CE2 3.61Å; K110-F127 HydrophobicContact CB-CG 4.01Å; K110-F127 HydrophobicContact CB-CZ 4.27Å; K110-F127 HydrophobicContact CD-CD1 3.76Å; K110-F127 HydrophobicContact CD-CD2 3.99Å; K110-F127 HydrophobicContact CD-CE1 3.6Å; K110-F127 HydrophobicContact CD-CE2 3.88Å; K110-F127 HydrophobicContact CD-CG 3.93Å; K110-F127 HydrophobicContact CD-CZ 3.67Å; K110-F127 HydrophobicContact CG-CD2 4.35Å; K110-F127 HydrophobicContact CG-CE2 4.43Å; K110-N156 PolarHBondContact NZ-OD1 2.95Å
111	P	93.4	Very high	94.9	Very high	46 Å²	46	39.6 Å²	39.6	30%	0.299	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-56.4	135.2	178.7	-25	34.4	0	0	0	113.2	W69 V158	W69-P111 HydrophobicContact CB-CB 4.22Å; W69-P111 HydrophobicContact CD2-CB 3.91Å; W69-P111 HydrophobicContact CD2-CG 4.45Å; W69-P111 HydrophobicContact CE3-CB 4.49Å; W69-P111 HydrophobicContact CG-CB 3.82Å; W69-P111 HydrophobicContact CG-CG 4.44Å; W69-P111 HydrophobicContact CZ2-CG 4.47Å; P111-V158 HydrophobicContact CB-CG2 4.05Å; P111-V158 HydrophobicContact CG-CG2 4.26Å
112	Q	95	Very high	94.9	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.009	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-101.3	157.4	169.2	50.1	-178.9	-25.4	0	0	110.4	W69 T83 K87 H106 K110 T125	W69-Q112 HydrophobicContact CE3-CG 3.61Å; W69-Q112 HydrophobicContact CZ3-CG 3.84Å; T83-Q112 HydrophobicContact CG2-CG 4.27Å; T83-Q112 PolarHBondContact OG1-O 3.15Å; K87-Q112 PolarHBondContact O-NE2 2.73Å; H106-Q112 PolarHBondContact CD2-OE1 2.74Å; K110-Q112 PolarHBondContact O-N 3.37Å; Q112-T125 CarbonylContact C-O 3.52Å; Q112-T125 WeakPolarHBondContact CA-O 3.39Å; Q112-T125 WeakPolarHBondContact CB-O 3.28Å
113	R	95	Very high	95	Very high	22 Å²	22	31 Å²	31	8%	0.083	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	149.3	169.1	-61.3	-68.6	178.7	167.8	-14.5	108.6	N23 W69 S70 S124 T125 V158 L159 P161	N23-R113 PolarHBondContact OD1-NH2 3.45Å; W69-R113 PolarHBondContact O-NH1 3.43Å; W69-R113 VanDerWaalsContact O-NH1 3.1Å; S70-R113 WeakPolarHBondContact OG-CD 3.41Å; R113-S124 CarbonylContact O-C 3.56Å; R113-S124 WeakPolarHBondContact O-CA 3.29Å; R113-S124 VanDerWaalsContact O-CB 3.29Å; R113-S124 WeakPolarHBondContact O-CB 3.14Å; R113-T125 WeakPolarHBondContact CB-OG1 3.26Å; R113-T125 PolarHBondContact N-O 2.89Å; R113-T125 PolarHBondContact O-N 3.25Å; R113-V158 HydrophobicContact CG-CG1 4.02Å; R113-L159 WeakPolarHBondContact CG-O 3.48Å; R113-P161 HydrophobicContact CB-CG 4.26Å
114	A	96.1	Very high	95	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	142.2	170.8	0	0	0	0	0	109	S70 L81 T83 I122 F123	S70-A114 PolarHBondContact OG-O 3.45Å; L81-A114 HydrophobicContact CD1-CB 4.42Å; L81-A114 HydrophobicContact CD2-CB 3.74Å; L81-A114 HydrophobicContact CG-CB 4.15Å; T83-A114 HydrophobicContact CG2-CB 3.41Å; T83-A114 VanDerWaalsContact CG2-CB 3.41Å; A114-I122 HydrophobicContact CB-CG2 4.05Å; A114-F123 WeakPolarHBondContact CA-O 3.48Å
115	I	94.7	Very high	95	Very high	10 Å²	10	28.3 Å²	28.3	5%	0.051	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	150.4	-179.8	58.1	169.6	0	0	0	110.1	D72 I122 F123 P161	D72-I115 HydrophobicContact CB-CG2 4.42Å; D72-I115 VanDerWaalsContact OD2-CA 3.26Å; D72-I115 WeakPolarHBondContact OD2-CA 3.38Å; I115-I122 WeakPolarHBondContact O-CA 3.28Å; I115-F123 HydrophobicContact CG1-CB 4.16Å; I115-F123 WeakPolarHBondContact CG1-O 3.32Å; I115-F123 PolarHBondContact N-O 2.94Å; I115-F123 PolarHBondContact O-N 3.44Å; I115-P161 HydrophobicContact CD1-CB 3.74Å; I115-P161 HydrophobicContact CD1-CG 3.97Å; I115-P161 HydrophobicContact CG1-CB 4.22Å; I115-P161 HydrophobicContact CG1-CG 3.99Å; I115-P161 HydrophobicContact CG2-CG 4.11Å
116	F	94	Very high	95.1	Very high	9 Å²	9	28.2 Å²	28.2	4%	0.039	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	144	167.4	-79.6	-72.1	0	0	0	110.8	D72 N74 K79 L81 V91 I122 E140	D72-F116 PolarHBondContact OD2-N 3.47Å; N74-F116 VanDerWaalsContact CA-CD2 3.4Å; N74-F116 HydrophobicContact CB-CB 4.2Å; N74-F116 HydrophobicContact CB-CD1 3.99Å; N74-F116 HydrophobicContact CB-CD2 3.54Å; N74-F116 HydrophobicContact CB-CE1 4.18Å; N74-F116 HydrophobicContact CB-CE2 3.68Å; N74-F116 HydrophobicContact CB-CG 3.66Å; N74-F116 HydrophobicContact CB-CZ 4.02Å; K79-F116 HydrophobicContact CB-CE2 4.19Å; K79-F116 HydrophobicContact CB-CZ 3.89Å; L81-F116 HydrophobicContact CB-CD2 3.68Å; L81-F116 HydrophobicContact CB-CE2 3.31Å; L81-F116 HydrophobicContact CB-CZ 3.9Å; L81-F116 HydrophobicContact CD2-CD2 4.25Å; L81-F116 HydrophobicContact CD2-CE2 4.49Å; L81-F116 HydrophobicContact CD2-CG 4.47Å; L81-F116 HydrophobicContact CG-CE2 4.49Å; V91-F116 HydrophobicContact CG1-CZ 4.12Å; V91-F116 HydrophobicContact CG2-CE1 4.4Å; V91-F116 HydrophobicContact CG2-CZ 4.07Å; F116-I122 HydrophobicContact CD1-CD1 4.43Å; F116-I122 HydrophobicContact CD1-CG1 3.98Å; F116-I122 HydrophobicContact CE1-CD1 3.99Å; F116-I122 HydrophobicContact CE1-CG1 4.02Å; F116-E140 HydrophobicContact CE1-CG 4.37Å
117	L	94.3	Very high	95.1	Very high	3 Å²	3	28.2 Å²	28.2	2%	0.016	15%	0.153	C	C	.	.			trans	-96.9	168.5	166.3	-54.3	-174.1	0	0	0	110.2	D119 G120 R121 F123 L137 Y163 V170 V185	L117-D119 PolarHBondContact O-N 2.66Å; L117-G120 PolarHBondContact O-N 2.81Å; L117-R121 WeakPolarHBondContact CB-O 3.27Å; L117-R121 HydrophobicContact CD1-CB 4.2Å; L117-R121 PolarHBondContact N-O 2.9Å; L117-F123 HydrophobicContact CD1-CB 4.3Å; L117-F123 HydrophobicContact CD2-CB 3.87Å; L117-F123 HydrophobicContact CG-CB 4.21Å; L117-L137 HydrophobicContact CD1-CD1 3.55Å; L117-Y163 HydrophobicContact CB-CE1 4.1Å; L117-Y163 HydrophobicContact CD2-CD1 3.85Å; L117-Y163 HydrophobicContact CD2-CD2 3.72Å; L117-Y163 HydrophobicContact CD2-CE1 3.99Å; L117-Y163 HydrophobicContact CD2-CE2 3.8Å; L117-Y163 HydrophobicContact CD2-CG 3.71Å; L117-V170 HydrophobicContact CD2-CG2 4.36Å; L117-V185 HydrophobicContact CD1-CB 4.2Å; L117-V185 HydrophobicContact CD1-CG1 3.56Å
118	N	88.2	Confident	95.2	Very high	83 Å²	83	22.7 Å²	22.7	44%	0.444	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.8	-174.8	-167.5	24.5	0	0	0	112.5	G120 Y163 N165	N118-G120 VanDerWaalsContact C-N 3.31Å; N118-Y163 HydrophobicContact CB-CE1 4.11Å; N118-N165 HydrophobicContact CB-CB 4.48Å; N118-N165 PolarHBondContact ND2-O 3.21Å
119	D	89.8	Confident	95.2	Very high	75 Å²	75	32.6 Å²	32.6	40%	0.401	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	7	176.2	60	18.7	0	0	0	114	L117 R121	L117-D119 PolarHBondContact O-N 2.66Å; D119-R121 VanDerWaalsContact C-N 3.3Å; D119-R121 VanDerWaalsContact CG-NE 3.3Å; D119-R121 PolarHBondContact O-N 3.11Å; D119-R121 VanDerWaalsContact OD1-CB 3.25Å; D119-R121 WeakPolarHBondContact OD1-CB 3.43Å; D119-R121 WeakPolarHBondContact OD1-CG 3.24Å; D119-R121 PolarHBondContact OD1-N 2.91Å; D119-R121 IonicContact OD1-NE 3.2Å; D119-R121 PolarHBondContact OD1-NE 2.97Å; D119-R121 IonicContact OD2-CZ 2.72Å; D119-R121 IonicContact OD2-NE 2.75Å; D119-R121 PolarHBondContact OD2-NE 3.01Å; D119-R121 IonicContact OD2-NH2 3.25Å; D119-R121 PolarHBondContact OD2-NH2 3.31Å
120	G	92	Very high	95.3	Very high	18 Å²	18	35.2 Å²	35.2	19%	0.186	16%	0.161	C	C	.	.	S	Bend	trans	83.3	-6	-179.6	0	0	0	0	0	114.9	L117 N118	L117-G120 PolarHBondContact O-N 2.81Å; N118-G120 VanDerWaalsContact C-N 3.31Å
121	R	96.7	Very high	95.4	Very high	28 Å²	28	35 Å²	35	11%	0.106	17%	0.166	C	C	.	.			trans	-63.8	161.9	169.8	-66.6	-178.2	-67.7	175.3	-0.7	110.5	L117 D119 L137 R138 N186 N187	L117-R121 WeakPolarHBondContact CB-O 3.27Å; L117-R121 HydrophobicContact CD1-CB 4.2Å; L117-R121 PolarHBondContact N-O 2.9Å; D119-R121 VanDerWaalsContact C-N 3.3Å; D119-R121 VanDerWaalsContact CG-NE 3.3Å; D119-R121 PolarHBondContact O-N 3.11Å; D119-R121 VanDerWaalsContact OD1-CB 3.25Å; D119-R121 WeakPolarHBondContact OD1-CB 3.43Å; D119-R121 WeakPolarHBondContact OD1-CG 3.24Å; D119-R121 PolarHBondContact OD1-N 2.91Å; D119-R121 IonicContact OD1-NE 3.2Å; D119-R121 PolarHBondContact OD1-NE 2.97Å; D119-R121 IonicContact OD2-CZ 2.72Å; D119-R121 IonicContact OD2-NE 2.75Å; D119-R121 PolarHBondContact OD2-NE 3.01Å; D119-R121 IonicContact OD2-NH2 3.25Å; D119-R121 PolarHBondContact OD2-NH2 3.31Å; R121-L137 HydrophobicContact CB-CD1 4.11Å; R121-R138 WeakPolarHBondContact CB-O 2.97Å; R121-N186 PolarHBondContact NH1-O 2.55Å; R121-N186 PolarHBondContact NH2-O 3.3Å; R121-N187 PolarHBondContact NH2-OD1 3.14Å
122	I	98.1	Very high	95.7	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.9	-176.4	-60.5	-175.2	0	0	0	109.2	L81 V91 A114 I115 F116 L137 R138 L143	L81-I122 HydrophobicContact CD1-CD1 3.72Å; L81-I122 HydrophobicContact CD1-CG2 4.32Å; L81-I122 HydrophobicContact CD2-CB 4.49Å; L81-I122 HydrophobicContact CD2-CD1 4.09Å; L81-I122 HydrophobicContact CD2-CG1 4.24Å; L81-I122 HydrophobicContact CD2-CG2 3.6Å; L81-I122 HydrophobicContact CG-CD1 4.48Å; V91-I122 HydrophobicContact CG2-CD1 3.67Å; A114-I122 HydrophobicContact CB-CG2 4.05Å; I115-I122 WeakPolarHBondContact O-CA 3.28Å; F116-I122 HydrophobicContact CD1-CD1 4.43Å; F116-I122 HydrophobicContact CD1-CG1 3.98Å; F116-I122 HydrophobicContact CE1-CD1 3.99Å; F116-I122 HydrophobicContact CE1-CG1 4.02Å; I122-L137 CarbonylContact O-C 3.58Å; I122-L137 WeakPolarHBondContact O-CA 3.5Å; I122-R138 HydrophobicContact CB-CB 4.45Å; I122-R138 PolarHBondContact N-O 2.91Å; I122-R138 PolarHBondContact O-N 3.11Å; I122-L143 HydrophobicContact CD1-CD2 3.53Å; I122-L143 HydrophobicContact CG1-CD2 4.45Å
123	F	98.3	Very high	95.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.7	171.3	-170.4	-81.1	0	0	0	108.8	A114 I115 L117 T125 Y135 L137 P161 V170 L172 V185 V192	A114-F123 WeakPolarHBondContact CA-O 3.48Å; I115-F123 HydrophobicContact CG1-CB 4.16Å; I115-F123 WeakPolarHBondContact CG1-O 3.32Å; I115-F123 PolarHBondContact N-O 2.94Å; I115-F123 PolarHBondContact O-N 3.44Å; L117-F123 HydrophobicContact CD1-CB 4.3Å; L117-F123 HydrophobicContact CD2-CB 3.87Å; L117-F123 HydrophobicContact CG-CB 4.21Å; F123-T125 HydrophobicContact CD1-CG2 4.47Å; F123-T125 HydrophobicContact CE1-CG2 3.83Å; F123-Y135 HydrophobicContact CE1-CG 4.42Å; F123-Y135 AromaticContact CE2-CD2 3.55Å; F123-Y135 HydrophobicContact CE2-CD2 3.55Å; F123-Y135 HydrophobicContact CE2-CE2 4.15Å; F123-Y135 HydrophobicContact CE2-CG 4.06Å; F123-Y135 VanDerWaalsContact CZ-CB 3.47Å; F123-Y135 HydrophobicContact CZ-CD1 4.45Å; F123-Y135 AromaticContact CZ-CD2 3.6Å; F123-Y135 HydrophobicContact CZ-CD2 3.6Å; F123-Y135 HydrophobicContact CZ-CE2 4.46Å; F123-Y135 AromaticContact CZ-CG 3.59Å; F123-Y135 HydrophobicContact CZ-CG 3.59Å; F123-L137 HydrophobicContact CB-CD1 4.43Å; F123-L137 HydrophobicContact CD2-CD1 4.35Å; F123-P161 HydrophobicContact CD1-CB 3.88Å; F123-P161 HydrophobicContact CD1-CG 4.43Å; F123-P161 HydrophobicContact CE1-CB 4.07Å; F123-V170 HydrophobicContact CD1-CG1 4.21Å; F123-V170 HydrophobicContact CD2-CG2 4.48Å; F123-V170 HydrophobicContact CE1-CG1 3.99Å; F123-V170 HydrophobicContact CZ-CG1 4.19Å; F123-L172 HydrophobicContact CE1-CD2 3.67Å; F123-L172 HydrophobicContact CZ-CD1 4.48Å; F123-L172 HydrophobicContact CZ-CD2 4.09Å; F123-V185 HydrophobicContact CD2-CG2 4.38Å; F123-V192 HydrophobicContact CE2-CG1 4.12Å; F123-V192 HydrophobicContact CE2-CG2 4.21Å
124	S	98.3	Very high	96	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.7	178.5	68.2	0	0	0	0	111.9	H106 R113 Y135 A136	H106-S124 WeakPolarHBondContact NE2-CB 3.47Å; H106-S124 PolarHBondContact NE2-OG 2.98Å; R113-S124 CarbonylContact O-C 3.56Å; R113-S124 WeakPolarHBondContact O-CA 3.29Å; R113-S124 VanDerWaalsContact O-CB 3.29Å; R113-S124 WeakPolarHBondContact O-CB 3.14Å; S124-Y135 CarbonylContact O-C 3.54Å; S124-Y135 WeakPolarHBondContact O-CA 3.35Å; S124-Y135 WeakPolarHBondContact O-CB 2.9Å; S124-A136 PolarHBondContact N-O 2.79Å; S124-A136 PolarHBondContact O-N 3.41Å
125	T	98.2	Very high	96.1	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.7	169.3	60	0	0	0	0	109.2	H106 Q112 R113 F123 M134 L159 P161 L172	H106-T125 VanDerWaalsContact NE2-C 3.34Å; Q112-T125 CarbonylContact C-O 3.52Å; Q112-T125 WeakPolarHBondContact CA-O 3.39Å; Q112-T125 WeakPolarHBondContact CB-O 3.28Å; R113-T125 WeakPolarHBondContact CB-OG1 3.26Å; R113-T125 PolarHBondContact N-O 2.89Å; R113-T125 PolarHBondContact O-N 3.25Å; F123-T125 HydrophobicContact CD1-CG2 4.47Å; F123-T125 HydrophobicContact CE1-CG2 3.83Å; T125-M134 WeakPolarHBondContact CA-O 3.44Å; T125-L159 HydrophobicContact CG2-CB 3.97Å; T125-L159 PolarHBondContact OG1-O 2.74Å; T125-P161 HydrophobicContact CG2-CB 4.23Å; T125-P161 HydrophobicContact CG2-CG 4.17Å; T125-L172 HydrophobicContact CG2-CD2 3.93Å
126	G	97.3	Very high	96.3	Very high	4 Å²	4	33.1 Å²	33.1	4%	0.041	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.5	-149.3	178	0	0	0	0	0	110.8	H106 R133 M134	H106-G126 PolarHBondContact CD2-N 3.38Å; H106-G126 PolarHBondContact NE2-N 3.15Å; G126-R133 WeakPolarHBondContact O-CA 3.28Å; G126-M134 PolarHBondContact N-O 3.48Å; G126-M134 PolarHBondContact O-N 3.2Å
127	F	98.2	Very high	96.5	Very high	3 Å²	3	32.7 Å²	32.7	1%	0.013	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	147.8	-175.1	-64.2	-99	0	0	0	111.5	G108 K110 S131 E132 R133 V158	G108-F127 VanDerWaalsContact CA-O 3.29Å; G108-F127 WeakPolarHBondContact CA-O 3.22Å; G108-F127 PolarHBondContact N-O 3.17Å; K110-F127 HydrophobicContact CB-CD2 3.44Å; K110-F127 VanDerWaalsContact CB-CD2 3.44Å; K110-F127 HydrophobicContact CB-CE2 3.61Å; K110-F127 HydrophobicContact CB-CG 4.01Å; K110-F127 HydrophobicContact CB-CZ 4.27Å; K110-F127 HydrophobicContact CD-CD1 3.76Å; K110-F127 HydrophobicContact CD-CD2 3.99Å; K110-F127 HydrophobicContact CD-CE1 3.6Å; K110-F127 HydrophobicContact CD-CE2 3.88Å; K110-F127 HydrophobicContact CD-CG 3.93Å; K110-F127 HydrophobicContact CD-CZ 3.67Å; K110-F127 HydrophobicContact CG-CD2 4.35Å; K110-F127 HydrophobicContact CG-CE2 4.43Å; F127-S131 WeakPolarHBondContact CD1-O 3.42Å; F127-E132 CarbonylContact C-O 3.56Å; F127-E132 WeakPolarHBondContact CA-O 3.2Å; F127-R133 HydrophobicContact CD1-CG 3.89Å; F127-R133 HydrophobicContact CE1-CG 3.44Å; F127-R133 VanDerWaalsContact CE1-CG 3.44Å; F127-R133 HydrophobicContact CZ-CG 4.07Å; F127-V158 HydrophobicContact CE2-CG2 4.24Å
128	T	97.9	Very high	96.7	Very high	9 Å²	9	32.7 Å²	32.7	6%	0.055	15%	0.151	C	C	.	.			trans	-64.3	167.5	164.1	67.2	0	0	0	0	110.1	G108 R130 S131 E132 M134 E151	G108-T128 WeakPolarHBondContact CA-O 3.5Å; T128-R130 PolarHBondContact O-N 3Å; T128-R130 VanDerWaalsContact O-N 3.16Å; T128-R130 PolarHBondContact OG1-N 3.25Å; T128-R130 VanDerWaalsContact OG1-N 3.1Å; T128-S131 PolarHBondContact O-N 3.03Å; T128-S131 PolarHBondContact OG1-N 3.5Å; T128-E132 HydrophobicContact CG2-CB 3.96Å; T128-E132 PolarHBondContact N-O 3.34Å; T128-E132 WeakPolarHBondContact OG1-CB 3.26Å; T128-E132 PolarHBondContact OG1-N 3.03Å; T128-E132 PolarHBondContact OG1-OE2 3.09Å; T128-M134 HydrophobicContact CG2-CE 3.33Å; T128-M134 HydrophobicContact CG2-SD 4.13Å; T128-E151 HydrophobicContact CG2-CG 3.77Å; T128-E151 WeakPolarHBondContact CG2-OE1 3.23Å
129	R	96.4	Very high	97.1	Very high	211 Å²	211	30.8 Å²	30.8	80%	0.796	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-28.7	165.8	-179.4	175.6	164.6	159.7	-3	113.1	E107 S131	E107-R129 HydrophobicContact CB-CB 4.46Å; R129-S131 VanDerWaalsContact C-N 3.27Å; R129-S131 PolarHBondContact O-N 3.43Å
130	R	96.2	Very high	97.3	Very high	170 Å²	170	28.9 Å²	28.9	64%	0.642	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	6.3	177.3	-60.1	-174	-60.5	-178.6	-4.8	113.8	T128 E132 E151	T128-R130 PolarHBondContact O-N 3Å; T128-R130 VanDerWaalsContact O-N 3.16Å; T128-R130 PolarHBondContact OG1-N 3.25Å; T128-R130 VanDerWaalsContact OG1-N 3.1Å; R130-E132 VanDerWaalsContact C-N 3.31Å; R130-E132 IonicContact CZ-OE1 2.68Å; R130-E132 IonicContact CZ-OE2 3.21Å; R130-E132 VanDerWaalsContact CZ-OE2 3.22Å; R130-E132 IonicContact NE-OE1 2.81Å; R130-E132 PolarHBondContact NE-OE1 3.38Å; R130-E132 IonicContact NE-OE2 2.91Å; R130-E132 PolarHBondContact NE-OE2 3.26Å; R130-E132 IonicContact NH1-OE1 2.83Å; R130-E132 VanDerWaalsContact NH2-CD 3.29Å; R130-E132 IonicContact NH2-OE1 3.72Å; R130-E132 PolarHBondContact NH2-OE1 3.34Å; R130-E132 IonicContact NH2-OE2 2.75Å; R130-E132 PolarHBondContact NH2-OE2 3.47Å; R130-E151 IonicContact NH2-OE2 3.21Å; R130-E151 PolarHBondContact NH2-OE2 3Å
131	S	96.4	Very high	97.4	Very high	42 Å²	42	35.7 Å²	35.7	29%	0.294	16%	0.16	S	C	.	.	S	Bend	trans	68	22.8	-177.9	-55.3	0	0	0	0	115.2	F127 T128 R129	F127-S131 WeakPolarHBondContact CD1-O 3.42Å; T128-S131 PolarHBondContact O-N 3.03Å; T128-S131 PolarHBondContact OG1-N 3.5Å; R129-S131 VanDerWaalsContact C-N 3.27Å; R129-S131 PolarHBondContact O-N 3.43Å
132	E	97.9	Very high	97.4	Very high	28 Å²	28	36.9 Å²	36.9	13%	0.131	18%	0.176	C	C	.	.			trans	-79.9	141.6	166.2	-67	140.9	160.1	0	0	109.6	F127 T128 R130 D153 T154	F127-E132 CarbonylContact C-O 3.56Å; F127-E132 WeakPolarHBondContact CA-O 3.2Å; T128-E132 HydrophobicContact CG2-CB 3.96Å; T128-E132 PolarHBondContact N-O 3.34Å; T128-E132 WeakPolarHBondContact OG1-CB 3.26Å; T128-E132 PolarHBondContact OG1-N 3.03Å; T128-E132 PolarHBondContact OG1-OE2 3.09Å; R130-E132 VanDerWaalsContact C-N 3.31Å; R130-E132 IonicContact CZ-OE1 2.68Å; R130-E132 IonicContact CZ-OE2 3.21Å; R130-E132 VanDerWaalsContact CZ-OE2 3.22Å; R130-E132 IonicContact NE-OE1 2.81Å; R130-E132 PolarHBondContact NE-OE1 3.38Å; R130-E132 IonicContact NE-OE2 2.91Å; R130-E132 PolarHBondContact NE-OE2 3.26Å; R130-E132 IonicContact NH1-OE1 2.83Å; R130-E132 VanDerWaalsContact NH2-CD 3.29Å; R130-E132 IonicContact NH2-OE1 3.72Å; R130-E132 PolarHBondContact NH2-OE1 3.34Å; R130-E132 IonicContact NH2-OE2 2.75Å; R130-E132 PolarHBondContact NH2-OE2 3.47Å; E132-D153 CarbonylContact C-O 3.48Å; E132-D153 VanDerWaalsContact CA-O 3.32Å; E132-D153 WeakPolarHBondContact CA-O 3.36Å; E132-T154 HydrophobicContact CG-CG2 3.86Å
133	R	98.1	Very high	97.3	Very high	4 Å²	4	37 Å²	37	2%	0.015	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	141.9	176.6	-60.5	-170.3	-58.6	179.3	-4.5	109.7	G126 F127 L152 D153 S155 G157 L159 D177	G126-R133 WeakPolarHBondContact O-CA 3.28Å; F127-R133 HydrophobicContact CD1-CG 3.89Å; F127-R133 HydrophobicContact CE1-CG 3.44Å; F127-R133 VanDerWaalsContact CE1-CG 3.44Å; F127-R133 HydrophobicContact CZ-CG 4.07Å; R133-L152 HydrophobicContact CB-CB 4.37Å; R133-L152 WeakPolarHBondContact O-CB 3.45Å; R133-L152 PolarHBondContact O-N 2.84Å; R133-D153 IonicContact CZ-OD1 3.17Å; R133-D153 IonicContact CZ-OD2 3.98Å; R133-D153 PolarHBondContact N-O 3.2Å; R133-D153 IonicContact NE-OD1 3.66Å; R133-D153 PolarHBondContact NE-OD1 2.85Å; R133-D153 IonicContact NE-OD2 3.35Å; R133-D153 VanDerWaalsContact NH2-CG 3.26Å; R133-D153 IonicContact NH2-OD1 2.65Å; R133-D153 PolarHBondContact NH2-OD1 2.83Å; R133-D153 IonicContact NH2-OD2 3.28Å; R133-D153 PolarHBondContact NH2-OD2 2.91Å; R133-S155 WeakPolarHBondContact CD-O 3.5Å; R133-S155 VanDerWaalsContact CG-O 3.26Å; R133-S155 WeakPolarHBondContact CG-O 3.42Å; R133-S155 VanDerWaalsContact CZ-CB 3.48Å; R133-G157 WeakPolarHBondContact CD-O 3.27Å; R133-G157 PolarHBondContact NH1-O 2.81Å; R133-L159 HydrophobicContact CB-CD1 3.94Å; R133-L159 VanDerWaalsContact NH1-CD2 3.34Å; R133-D177 IonicContact CZ-OD2 2.7Å; R133-D177 IonicContact NH1-OD1 3.93Å; R133-D177 PolarHBondContact NH1-OD1 2.91Å; R133-D177 IonicContact NH1-OD2 3.5Å; R133-D177 PolarHBondContact NH1-OD2 3.46Å; R133-D177 IonicContact NH2-OD1 2.68Å; R133-D177 IonicContact NH2-OD2 3.45Å; R133-D177 PolarHBondContact NH2-OD2 3.18Å; R133-D177 VanDerWaalsContact NH2-OD2 3.17Å
134	M	98.2	Very high	97.2	Very high	7 Å²	7	41.5 Å²	41.5	3%	0.034	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	161.6	177.1	53.4	171.9	25.1	0	0	111	H106 T125 G126 T128 Q149 E150 E151	H106-M134 PolarHBondContact ND1-SD 2.68Å; H106-M134 VanDerWaalsContact ND1-SD 3.36Å; T125-M134 WeakPolarHBondContact CA-O 3.44Å; G126-M134 PolarHBondContact N-O 3.48Å; G126-M134 PolarHBondContact O-N 3.2Å; T128-M134 HydrophobicContact CG2-CE 3.33Å; T128-M134 HydrophobicContact CG2-SD 4.13Å; M134-Q149 HydrophobicContact CE-CG 3.89Å; M134-Q149 HydrophobicContact SD-CG 4.18Å; M134-E150 CarbonylContact C-O 3.46Å; M134-E150 WeakPolarHBondContact CA-O 3.44Å; M134-E150 WeakPolarHBondContact CB-O 3.37Å; M134-E151 HydrophobicContact CE-CG 3.86Å
135	Y	98.5	Very high	97.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	159.9	164.7	72.9	-93.9	0	0	0	110.6	F123 S124 Q149 E150 L152 Y183 V192	F123-Y135 HydrophobicContact CE1-CG 4.42Å; F123-Y135 AromaticContact CE2-CD2 3.55Å; F123-Y135 HydrophobicContact CE2-CD2 3.55Å; F123-Y135 HydrophobicContact CE2-CE2 4.15Å; F123-Y135 HydrophobicContact CE2-CG 4.06Å; F123-Y135 VanDerWaalsContact CZ-CB 3.47Å; F123-Y135 HydrophobicContact CZ-CD1 4.45Å; F123-Y135 AromaticContact CZ-CD2 3.6Å; F123-Y135 HydrophobicContact CZ-CD2 3.6Å; F123-Y135 HydrophobicContact CZ-CE2 4.46Å; F123-Y135 AromaticContact CZ-CG 3.59Å; F123-Y135 HydrophobicContact CZ-CG 3.59Å; S124-Y135 CarbonylContact O-C 3.54Å; S124-Y135 WeakPolarHBondContact O-CA 3.35Å; S124-Y135 WeakPolarHBondContact O-CB 2.9Å; Y135-Q149 WeakPolarHBondContact O-CA 2.97Å; Y135-Q149 WeakPolarHBondContact O-CG 3.33Å; Y135-E150 HydrophobicContact CD1-CB 4.29Å; Y135-E150 HydrophobicContact CE1-CB 3.64Å; Y135-E150 HydrophobicContact CE1-CG 4.35Å; Y135-E150 HydrophobicContact CE2-CB 4.42Å; Y135-E150 PolarHBondContact N-O 2.76Å; Y135-E150 PolarHBondContact O-N 2.83Å; Y135-E150 PolarHBondContact OH-OE2 2.95Å; Y135-L152 HydrophobicContact CD1-CD1 4.14Å; Y135-L152 HydrophobicContact CD1-CD2 3.72Å; Y135-L152 HydrophobicContact CD1-CG 4.03Å; Y135-L152 HydrophobicContact CE1-CD2 3.85Å; Y135-Y183 HydrophobicContact CE1-CE1 4.21Å; Y135-V192 HydrophobicContact CD2-CG1 4.48Å; Y135-V192 HydrophobicContact CE2-CB 3.84Å; Y135-V192 HydrophobicContact CE2-CG1 3.65Å; Y135-V192 HydrophobicContact CE2-CG2 3.89Å
136	A	98.5	Very high	97.1	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	146.3	169.8	0	0	0	0	0	110.3	S124 P146 I148 Q149	S124-A136 PolarHBondContact N-O 2.79Å; S124-A136 PolarHBondContact O-N 3.41Å; A136-P146 HydrophobicContact CB-CB 4.01Å; A136-I148 CarbonylContact C-O 3.56Å; A136-I148 VanDerWaalsContact CA-O 3.23Å; A136-I148 WeakPolarHBondContact CA-O 3.17Å; A136-Q149 HydrophobicContact CB-CB 4.09Å; A136-Q149 HydrophobicContact CB-CG 4.12Å
137	L	98.6	Very high	97	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	130.3	169	-176.4	68.5	0	0	0	108.5	L117 R121 I122 F123 P146 I147 I148 V185 F191 V192	L117-L137 HydrophobicContact CD1-CD1 3.55Å; R121-L137 HydrophobicContact CB-CD1 4.11Å; I122-L137 CarbonylContact O-C 3.58Å; I122-L137 WeakPolarHBondContact O-CA 3.5Å; F123-L137 HydrophobicContact CB-CD1 4.43Å; F123-L137 HydrophobicContact CD2-CD1 4.35Å; L137-P146 CarbonylContact O-C 3.51Å; L137-I147 HydrophobicContact CG-CD1 4.43Å; L137-I147 WeakPolarHBondContact O-CB 3.06Å; L137-I147 PolarHBondContact O-N 2.78Å; L137-I148 HydrophobicContact CB-CG2 3.69Å; L137-I148 HydrophobicContact CD2-CG2 4.41Å; L137-I148 PolarHBondContact N-O 3.43Å; L137-I148 PolarHBondContact O-N 2.88Å; L137-V185 HydrophobicContact CD1-CG1 4.23Å; L137-V185 HydrophobicContact CD2-CG1 4.11Å; L137-F191 HydrophobicContact CD2-CB 3.79Å; L137-V192 HydrophobicContact CB-CG2 4.16Å; L137-V192 HydrophobicContact CD2-CG2 3.98Å
138	R	98.1	Very high	97	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.7	-175.2	-62.8	176.7	-179.7	-80	-4.4	110.5	R121 I122 L143 E144 P146	R121-R138 WeakPolarHBondContact CB-O 2.97Å; I122-R138 HydrophobicContact CB-CB 4.45Å; I122-R138 PolarHBondContact N-O 2.91Å; I122-R138 PolarHBondContact O-N 3.11Å; R138-L143 HydrophobicContact CB-CD2 4.4Å; R138-L143 WeakPolarHBondContact CD-O 3.29Å; R138-L143 PolarHBondContact NH1-O 2.81Å; R138-E144 PolarHBondContact NH1-O 3.24Å; R138-P146 HydrophobicContact CG-CB 4.16Å
139	S	96.6	Very high	97	Very high	42 Å²	42	58 Å²	58	29%	0.294	28%	0.278	S	S	.	.	B	Isolated β-bridge	trans	-78	141.2	165.7	175	0	0	0	0	109.2	Q141 A142 L143	S139-Q141 PolarHBondContact O-N 2.94Å; S139-Q141 PolarHBondContact OG-N 2.83Å; S139-A142 CarbonylContact O-C 3.59Å; S139-A142 VanDerWaalsContact O-C 3.29Å; S139-A142 PolarHBondContact O-N 2.74Å; S139-A142 VanDerWaalsContact O-N 3.13Å; S139-L143 WeakPolarHBondContact O-CD2 3.44Å
140	E	95.5	Very high	97.1	Very high	36 Å²	36	51.7 Å²	51.7	17%	0.168	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-37.7	174.6	-166	-164	133	0	0	112.1	K79 V91 F116 A142	K79-E140 VanDerWaalsContact CD-OE1 3.23Å; K79-E140 WeakPolarHBondContact CD-OE1 3.29Å; K79-E140 WeakPolarHBondContact CE-OE1 3.1Å; K79-E140 IonicContact NZ-OE1 3.36Å; K79-E140 PolarHBondContact NZ-OE1 3.22Å; K79-E140 IonicContact NZ-OE2 2.9Å; K79-E140 PolarHBondContact NZ-OE2 3.36Å; V91-E140 HydrophobicContact CG2-CG 4.17Å; F116-E140 HydrophobicContact CE1-CG 4.37Å; E140-A142 VanDerWaalsContact C-N 3.33Å
141	Q	94.4	Very high	97.2	Very high	161 Å²	161	48.8 Å²	48.8	75%	0.752	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-13.5	-176.8	-61.5	-167	2	0	0	113.7	S139	S139-Q141 PolarHBondContact O-N 2.94Å; S139-Q141 PolarHBondContact OG-N 2.83Å
142	A	94.9	Very high	97.2	Very high	53 Å²	53	48.4 Å²	48.4	44%	0.438	25%	0.246	S	C	.	.	B	Isolated β-bridge	trans	-141	74.8	-175.7	0	0	0	0	0	109.3	S139 E140 E144	S139-A142 CarbonylContact O-C 3.59Å; S139-A142 VanDerWaalsContact O-C 3.29Å; S139-A142 PolarHBondContact O-N 2.74Å; S139-A142 VanDerWaalsContact O-N 3.13Å; E140-A142 VanDerWaalsContact C-N 3.33Å; A142-E144 VanDerWaalsContact C-N 3.35Å
143	L	96.8	Very high	97.1	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.249	C	C	.	.			trans	-75.8	-22	-177.4	-63.6	178.9	0	0	0	113.6	V91 Q101 I122 R138 S139	V91-L143 HydrophobicContact CG2-CD1 4.02Å; Q101-L143 HydrophobicContact CB-CD1 3.88Å; Q101-L143 HydrophobicContact CB-CG 4.45Å; I122-L143 HydrophobicContact CD1-CD2 3.53Å; I122-L143 HydrophobicContact CG1-CD2 4.45Å; R138-L143 HydrophobicContact CB-CD2 4.4Å; R138-L143 WeakPolarHBondContact CD-O 3.29Å; R138-L143 PolarHBondContact NH1-O 2.81Å; S139-L143 WeakPolarHBondContact O-CD2 3.44Å
144	E	96.8	Very high	97	Very high	93 Å²	93	53.6 Å²	53.6	44%	0.435	28%	0.279	S	S	.	.	S	Bend	trans	-64.8	-48.6	-176.5	-165.3	63.6	-158.7	0	0	111.5	G103 T104 R138 A142	G103-E144 WeakPolarHBondContact CA-OE2 3.41Å; T104-E144 VanDerWaalsContact CB-OE1 3.25Å; T104-E144 WeakPolarHBondContact CB-OE1 3.25Å; T104-E144 PolarHBondContact N-OE2 2.9Å; T104-E144 PolarHBondContact OG1-OE1 2.88Å; T104-E144 PolarHBondContact OG1-OE2 2.75Å; R138-E144 PolarHBondContact NH1-O 3.24Å; A142-E144 VanDerWaalsContact C-N 3.35Å
145	E	95.5	Very high	96.9	Very high	142 Å²	142	55.7 Å²	55.7	66%	0.664	29%	0.294	S	S	*	.	S	Bend	trans	-105.7	122.6	-175.3	-65.5	-61.3	157.8	0	0	110.9
146	P	97.5	Very high	96.5	Very high	37 Å²	37	61.4 Å²	61.4	24%	0.24	33%	0.325	C	S	.	.			trans	-73.4	143.2	177.5	30.5	-31.2	0	0	0	111.5	A136 L137 R138 I148 Q149	A136-P146 HydrophobicContact CB-CB 4.01Å; L137-P146 CarbonylContact O-C 3.51Å; R138-P146 HydrophobicContact CG-CB 4.16Å; P146-I148 VanDerWaalsContact C-N 3.3Å; P146-Q149 HydrophobicContact CB-CB 4.21Å; P146-Q149 HydrophobicContact CG-CB 3.96Å
147	I	97.1	Very high	96.2	Very high	74 Å²	74	62.3 Å²	62.3	38%	0.379	33%	0.334	S	S	.	.	S	Bend	trans	-62.6	-44.9	169.8	-60	170.5	0	0	0	109.1	L137 F191	L137-I147 HydrophobicContact CG-CD1 4.43Å; L137-I147 WeakPolarHBondContact O-CB 3.06Å; L137-I147 PolarHBondContact O-N 2.78Å; I147-F191 HydrophobicContact CG2-CD2 3.72Å; I147-F191 HydrophobicContact CG2-CE2 3.79Å; I147-F191 HydrophobicContact CG2-CG 4.29Å; I147-F191 HydrophobicContact CG2-CZ 4.41Å
148	I	97.9	Very high	95.9	Very high	28 Å²	28	63.6 Å²	63.6	14%	0.144	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.3	173.4	-175.5	165.9	0	0	0	108.9	A136 L137 P146 E150 P190 V192	A136-I148 CarbonylContact C-O 3.56Å; A136-I148 VanDerWaalsContact CA-O 3.23Å; A136-I148 WeakPolarHBondContact CA-O 3.17Å; L137-I148 HydrophobicContact CB-CG2 3.69Å; L137-I148 HydrophobicContact CD2-CG2 4.41Å; L137-I148 PolarHBondContact N-O 3.43Å; L137-I148 PolarHBondContact O-N 2.88Å; P146-I148 VanDerWaalsContact C-N 3.3Å; I148-E150 HydrophobicContact CD1-CG 4.2Å; I148-E150 HydrophobicContact CG1-CG 4.08Å; I148-P190 HydrophobicContact CD1-CB 4.11Å; I148-P190 WeakPolarHBondContact CD1-O 3.07Å; I148-V192 HydrophobicContact CG2-CG2 4.01Å
149	Q	97.8	Very high	95.7	Very high	83 Å²	83	63.7 Å²	63.7	39%	0.388	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	126.3	173.6	179.4	173.5	-77.5	0	0	108.8	M134 Y135 A136 P146	M134-Q149 HydrophobicContact CE-CG 3.89Å; M134-Q149 HydrophobicContact SD-CG 4.18Å; Y135-Q149 WeakPolarHBondContact O-CA 2.97Å; Y135-Q149 WeakPolarHBondContact O-CG 3.33Å; A136-Q149 HydrophobicContact CB-CB 4.09Å; A136-Q149 HydrophobicContact CB-CG 4.12Å; P146-Q149 HydrophobicContact CB-CB 4.21Å; P146-Q149 HydrophobicContact CG-CB 3.96Å
150	E	97.9	Very high	95.6	Very high	79 Å²	79	64.4 Å²	64.4	37%	0.369	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.2	-177.4	-66.2	-170.4	168.7	0	0	111.9	M134 Y135 I148	M134-E150 CarbonylContact C-O 3.46Å; M134-E150 WeakPolarHBondContact CA-O 3.44Å; M134-E150 WeakPolarHBondContact CB-O 3.37Å; Y135-E150 HydrophobicContact CD1-CB 4.29Å; Y135-E150 HydrophobicContact CE1-CB 3.64Å; Y135-E150 HydrophobicContact CE1-CG 4.35Å; Y135-E150 HydrophobicContact CE2-CB 4.42Å; Y135-E150 PolarHBondContact N-O 2.76Å; Y135-E150 PolarHBondContact O-N 2.83Å; Y135-E150 PolarHBondContact OH-OE2 2.95Å; I148-E150 HydrophobicContact CD1-CG 4.2Å; I148-E150 HydrophobicContact CG1-CG 4.08Å
151	E	98	Very high	95.5	Very high	109 Å²	109	63.2 Å²	63.2	51%	0.509	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	139	170.6	-65	179.9	-168.7	0	0	110.1	T128 R130 M134	T128-E151 HydrophobicContact CG2-CG 3.77Å; T128-E151 WeakPolarHBondContact CG2-OE1 3.23Å; R130-E151 IonicContact NH2-OE2 3.21Å; R130-E151 PolarHBondContact NH2-OE2 3Å; M134-E151 HydrophobicContact CE-CG 3.86Å
152	L	97.1	Very high	95.4	Very high	34 Å²	34	57.6 Å²	57.6	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-61.9	-175	-66.3	175.4	0	0	0	112	R133 Y135 L159 L172 Y183	R133-L152 HydrophobicContact CB-CB 4.37Å; R133-L152 WeakPolarHBondContact O-CB 3.45Å; R133-L152 PolarHBondContact O-N 2.84Å; Y135-L152 HydrophobicContact CD1-CD1 4.14Å; Y135-L152 HydrophobicContact CD1-CD2 3.72Å; Y135-L152 HydrophobicContact CD1-CG 4.03Å; Y135-L152 HydrophobicContact CE1-CD2 3.85Å; L152-L159 HydrophobicContact CD1-CD1 3.4Å; L152-L159 VanDerWaalsContact CD1-CD1 3.4Å; L152-L172 HydrophobicContact CD1-CD1 3.78Å; L152-Y183 WeakPolarHBondContact CD2-OH 3.32Å
153	D	96.1	Very high	95.3	Very high	34 Å²	34	56.8 Å²	56.8	18%	0.182	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	179.1	-178.9	60.1	49.6	0	0	0	111.5	E132 R133 S155 R181	E132-D153 CarbonylContact C-O 3.48Å; E132-D153 VanDerWaalsContact CA-O 3.32Å; E132-D153 WeakPolarHBondContact CA-O 3.36Å; R133-D153 IonicContact CZ-OD1 3.17Å; R133-D153 IonicContact CZ-OD2 3.98Å; R133-D153 PolarHBondContact N-O 3.2Å; R133-D153 IonicContact NE-OD1 3.66Å; R133-D153 PolarHBondContact NE-OD1 2.85Å; R133-D153 IonicContact NE-OD2 3.35Å; R133-D153 VanDerWaalsContact NH2-CG 3.26Å; R133-D153 IonicContact NH2-OD1 2.65Å; R133-D153 PolarHBondContact NH2-OD1 2.83Å; R133-D153 IonicContact NH2-OD2 3.28Å; R133-D153 PolarHBondContact NH2-OD2 2.91Å; D153-S155 VanDerWaalsContact OD1-CB 3.3Å; D153-S155 WeakPolarHBondContact OD1-CB 3.39Å; D153-S155 PolarHBondContact OD1-N 2.77Å; D153-S155 PolarHBondContact OD1-OG 3.47Å; D153-R181 IonicContact OD2-CZ 3.2Å; D153-R181 IonicContact OD2-NH1 2.68Å; D153-R181 PolarHBondContact OD2-NH1 3.46Å; D153-R181 IonicContact OD2-NH2 2.99Å; D153-R181 PolarHBondContact OD2-NH2 3.2Å
154	T	96.3	Very high	95	Very high	107 Å²	107	57.4 Å²	57.4	66%	0.656	30%	0.299	S	S	*	.	S	Bend	trans	-94.6	13.1	-177.4	60.7	0	0	0	0	113.8	E132	E132-T154 HydrophobicContact CG-CG2 3.86Å
155	S	95.1	Very high	94.5	Very high	50 Å²	50	54.2 Å²	54.2	35%	0.35	28%	0.284	S	S	.	.			trans	-72.7	157.9	-177.7	-64.7	0	0	0	0	111.9	R133 D153	R133-S155 WeakPolarHBondContact CD-O 3.5Å; R133-S155 VanDerWaalsContact CG-O 3.26Å; R133-S155 WeakPolarHBondContact CG-O 3.42Å; R133-S155 VanDerWaalsContact CZ-CB 3.48Å; D153-S155 VanDerWaalsContact OD1-CB 3.3Å; D153-S155 WeakPolarHBondContact OD1-CB 3.39Å; D153-S155 PolarHBondContact OD1-N 2.77Å; D153-S155 PolarHBondContact OD1-OG 3.47Å
156	N	90.8	Very high	94.2	Very high	120 Å²	120	48.4 Å²	48.4	64%	0.642	26%	0.258	S	S	*	.			trans	-93	-18.1	-169.7	-74.4	-57.7	0	0	0	115.3	K110	K110-N156 PolarHBondContact NZ-OD1 2.95Å
157	G	91.2	Very high	94	Very high	19 Å²	19	48.1 Å²	48.1	20%	0.196	26%	0.256	C	S	.	.	S	Bend	trans	-73.4	135.7	-173.7	0	0	0	0	0	112.7	R133 L159	R133-G157 WeakPolarHBondContact CD-O 3.27Å; R133-G157 PolarHBondContact NH1-O 2.81Å; G157-L159 PolarHBondContact O-N 2.98Å
158	V	92.2	Very high	93.8	Very high	27 Å²	27	45 Å²	45	16%	0.164	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-60.3	130.5	171.8	179.2	0	0	0	0	108.7	P111 R113 F127 Y160 G174	P111-V158 HydrophobicContact CB-CG2 4.05Å; P111-V158 HydrophobicContact CG-CG2 4.26Å; R113-V158 HydrophobicContact CG-CG1 4.02Å; F127-V158 HydrophobicContact CE2-CG2 4.24Å; V158-Y160 HydrophobicContact CB-CE2 4.23Å; V158-Y160 HydrophobicContact CG1-CE2 4.28Å; V158-Y160 VanDerWaalsContact O-CD2 3.31Å; V158-Y160 WeakPolarHBondContact O-CD2 3.44Å; V158-Y160 WeakPolarHBondContact O-CE2 3.27Å; V158-G174 WeakPolarHBondContact O-CA 3.33Å
159	L	95	Very high	93.7	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.5	175.3	-71.8	170.3	0	0	0	110.2	R113 T125 R133 L152 G157 P161 L172	R113-L159 WeakPolarHBondContact CG-O 3.48Å; T125-L159 HydrophobicContact CG2-CB 3.97Å; T125-L159 PolarHBondContact OG1-O 2.74Å; R133-L159 HydrophobicContact CB-CD1 3.94Å; R133-L159 VanDerWaalsContact NH1-CD2 3.34Å; L152-L159 HydrophobicContact CD1-CD1 3.4Å; L152-L159 VanDerWaalsContact CD1-CD1 3.4Å; G157-L159 PolarHBondContact O-N 2.98Å; L159-P161 WeakPolarHBondContact O-CD 3.34Å; L159-L172 HydrophobicContact CD1-CD1 4.47Å; L159-L172 HydrophobicContact CD2-CB 4.33Å
160	Y	93.3	Very high	93.7	Very high	58 Å²	58	40.6 Å²	40.6	23%	0.227	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	106.8	175.6	-65.5	-101.3	0	0	0	107.4	V158 C173	V158-Y160 HydrophobicContact CB-CE2 4.23Å; V158-Y160 HydrophobicContact CG1-CE2 4.28Å; V158-Y160 VanDerWaalsContact O-CD2 3.31Å; V158-Y160 WeakPolarHBondContact O-CD2 3.44Å; V158-Y160 WeakPolarHBondContact O-CE2 3.27Å; Y160-C173 WeakPolarHBondContact CB-O 3.31Å; Y160-C173 WeakPolarHBondContact CD2-O 3.47Å; Y160-C173 PolarHBondContact N-O 2.79Å; Y160-C173 PolarHBondContact O-N 3Å
161	P	94.8	Very high	93.6	Very high	10 Å²	10	36.9 Å²	36.9	7%	0.065	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	125.7	173.1	31.6	-33	0	0	0	109.2	R113 I115 F123 T125 L159 V170 L172	R113-P161 HydrophobicContact CB-CG 4.26Å; I115-P161 HydrophobicContact CD1-CB 3.74Å; I115-P161 HydrophobicContact CD1-CG 3.97Å; I115-P161 HydrophobicContact CG1-CB 4.22Å; I115-P161 HydrophobicContact CG1-CG 3.99Å; I115-P161 HydrophobicContact CG2-CG 4.11Å; F123-P161 HydrophobicContact CD1-CB 3.88Å; F123-P161 HydrophobicContact CD1-CG 4.43Å; F123-P161 HydrophobicContact CE1-CB 4.07Å; T125-P161 HydrophobicContact CG2-CB 4.23Å; T125-P161 HydrophobicContact CG2-CG 4.17Å; L159-P161 WeakPolarHBondContact O-CD 3.34Å; P161-V170 HydrophobicContact CB-CG1 4.03Å; P161-L172 HydrophobicContact CB-CD2 3.79Å
162	L	91.1	Very high	93.6	Very high	43 Å²	43	31.9 Å²	31.9	23%	0.225	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	113.2	173.9	-55.6	175.6	0	0	0	107.4	V170 Y171 I207 F209	L162-V170 CarbonylContact O-C 3.58Å; L162-V170 WeakPolarHBondContact O-CA 3.43Å; L162-Y171 PolarHBondContact N-O 2.84Å; L162-Y171 PolarHBondContact O-N 3.25Å; L162-I207 HydrophobicContact CD1-CG2 3.61Å; L162-F209 HydrophobicContact CB-CD2 4.32Å; L162-F209 HydrophobicContact CB-CE2 4.18Å; L162-F209 HydrophobicContact CD1-CD2 3.81Å; L162-F209 HydrophobicContact CD1-CE2 4.12Å
163	Y	92.5	Very high	93.4	Very high	37 Å²	37	30.4 Å²	30.4	15%	0.145	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	130.7	-175	178.5	-118.7	0	0	0	111.7	L117 N118 N165 L169 V170	L117-Y163 HydrophobicContact CB-CE1 4.1Å; L117-Y163 HydrophobicContact CD2-CD1 3.85Å; L117-Y163 HydrophobicContact CD2-CD2 3.72Å; L117-Y163 HydrophobicContact CD2-CE1 3.99Å; L117-Y163 HydrophobicContact CD2-CE2 3.8Å; L117-Y163 HydrophobicContact CD2-CG 3.71Å; N118-Y163 HydrophobicContact CB-CE1 4.11Å; Y163-N165 HydrophobicContact CE1-CB 4.28Å; Y163-N165 VanDerWaalsContact CE1-OD1 3.27Å; Y163-N165 WeakPolarHBondContact CE1-OD1 3.17Å; Y163-L169 WeakPolarHBondContact CA-O 3.37Å; Y163-L169 WeakPolarHBondContact CD2-O 3.23Å; Y163-V170 HydrophobicContact CD2-CG2 3.47Å; Y163-V170 VanDerWaalsContact CD2-CG2 3.47Å; Y163-V170 HydrophobicContact CE2-CG2 4.17Å; Y163-V170 HydrophobicContact CG-CG2 4.3Å
164	D	91	Very high	93.2	Very high	16 Å²	16	28.9 Å²	28.9	9%	0.086	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	105.6	169.8	-179.1	22.3	0	0	0	110	D166 T167 G168 L169 K212	D164-D166 PolarHBondContact O-N 3.5Å; D164-D166 VanDerWaalsContact O-N 3.15Å; D164-D166 PolarHBondContact OD1-N 3Å; D164-T167 VanDerWaalsContact CG-OG1 3.3Å; D164-T167 PolarHBondContact O-N 3.41Å; D164-T167 WeakPolarHBondContact OD2-CB 3.48Å; D164-T167 VanDerWaalsContact OD2-CG2 3.25Å; D164-T167 WeakPolarHBondContact OD2-CG2 3.32Å; D164-T167 PolarHBondContact OD2-OG1 2.81Å; D164-G168 PolarHBondContact O-N 2.59Å; D164-L169 PolarHBondContact N-O 3.31Å; D164-K212 VanDerWaalsContact CG-CE 3.49Å; D164-K212 WeakPolarHBondContact OD1-CE 3.38Å; D164-K212 IonicContact OD1-NZ 3.17Å; D164-K212 WeakPolarHBondContact OD2-CE 3.3Å; D164-K212 IonicContact OD2-NZ 3.36Å; D164-K212 PolarHBondContact OD2-NZ 2.9Å
165	N	87.5	Confident	92.9	Very high	25 Å²	25	31.7 Å²	31.7	13%	0.134	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.1	-178	-72.2	-77.1	0	0	0	113.7	Y75 N118 Y163	Y75-N165 HydrophobicContact CD2-CB 4.46Å; Y75-N165 HydrophobicContact CE2-CB 4.23Å; N118-N165 HydrophobicContact CB-CB 4.48Å; N118-N165 PolarHBondContact ND2-O 3.21Å; Y163-N165 HydrophobicContact CE1-CB 4.28Å; Y163-N165 VanDerWaalsContact CE1-OD1 3.27Å; Y163-N165 WeakPolarHBondContact CE1-OD1 3.17Å
166	D	88.5	Confident	92.7	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.112	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-38.8	-174.1	-67.4	4	0	0	0	111.9	D164 K212 P254 T256	D164-D166 PolarHBondContact O-N 3.5Å; D164-D166 VanDerWaalsContact O-N 3.15Å; D164-D166 PolarHBondContact OD1-N 3Å; D166-K212 VanDerWaalsContact OD2-CE 3.31Å; D166-K212 WeakPolarHBondContact OD2-CE 3.48Å; D166-K212 VanDerWaalsContact OD2-CG 3.31Å; D166-K212 WeakPolarHBondContact OD2-CG 3.42Å; D166-P254 HydrophobicContact CB-CG 3.86Å; D166-T256 VanDerWaalsContact CG-OG1 3.24Å; D166-T256 PolarHBondContact OD1-OG1 3.12Å; D166-T256 WeakPolarHBondContact OD2-CB 3.4Å; D166-T256 PolarHBondContact OD2-OG1 3.47Å
167	T	92.3	Very high	92.9	Very high	30 Å²	30	26.8 Å²	26.8	18%	0.184	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-11.3	-175.7	61.8	0	0	0	0	113.5	D164 L169 I222	D164-T167 VanDerWaalsContact CG-OG1 3.3Å; D164-T167 PolarHBondContact O-N 3.41Å; D164-T167 WeakPolarHBondContact OD2-CB 3.48Å; D164-T167 VanDerWaalsContact OD2-CG2 3.25Å; D164-T167 WeakPolarHBondContact OD2-CG2 3.32Å; D164-T167 PolarHBondContact OD2-OG1 2.81Å; T167-L169 PolarHBondContact O-N 2.86Å; T167-L169 WeakPolarHBondContact OG1-CG 3.1Å; T167-I222 HydrophobicContact CG2-CB 4.3Å; T167-I222 HydrophobicContact CG2-CG2 4.23Å
168	G	93.9	Very high	93	Very high	10 Å²	10	27.9 Å²	27.9	10%	0.103	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	12.3	-174.9	0	0	0	0	0	113.8	D164 V185	D164-G168 PolarHBondContact O-N 2.59Å; G168-V185 PolarHBondContact O-N 3.24Å
169	L	96.2	Very high	93.2	Very high	17 Å²	17	28.7 Å²	28.7	9%	0.089	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	133.6	-178.6	-65.8	179.6	0	0	0	112.6	Y163 D164 T167 Y171 Y183 E184 I195 I222	Y163-L169 WeakPolarHBondContact CA-O 3.37Å; Y163-L169 WeakPolarHBondContact CD2-O 3.23Å; D164-L169 PolarHBondContact N-O 3.31Å; T167-L169 PolarHBondContact O-N 2.86Å; T167-L169 WeakPolarHBondContact OG1-CG 3.1Å; L169-Y171 HydrophobicContact CB-CE2 3.83Å; L169-Y183 CarbonylContact C-O 3.57Å; L169-Y183 VanDerWaalsContact CA-O 3.29Å; L169-Y183 WeakPolarHBondContact CA-O 3.21Å; L169-E184 HydrophobicContact CD2-CB 3.78Å; L169-E184 HydrophobicContact CD2-CG 4.27Å; L169-I195 HydrophobicContact CD2-CG1 4.24Å; L169-I222 HydrophobicContact CD1-CD1 3.51Å
170	V	96.8	Very high	93.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.9	170.9	178	0	0	0	0	109.4	L117 F123 P161 L162 Y163 L172 Y182 Y183 V185	L117-V170 HydrophobicContact CD2-CG2 4.36Å; F123-V170 HydrophobicContact CD1-CG1 4.21Å; F123-V170 HydrophobicContact CD2-CG2 4.48Å; F123-V170 HydrophobicContact CE1-CG1 3.99Å; F123-V170 HydrophobicContact CZ-CG1 4.19Å; P161-V170 HydrophobicContact CB-CG1 4.03Å; L162-V170 CarbonylContact O-C 3.58Å; L162-V170 WeakPolarHBondContact O-CA 3.43Å; Y163-V170 HydrophobicContact CD2-CG2 3.47Å; Y163-V170 VanDerWaalsContact CD2-CG2 3.47Å; Y163-V170 HydrophobicContact CE2-CG2 4.17Å; Y163-V170 HydrophobicContact CG-CG2 4.3Å; V170-L172 HydrophobicContact CG1-CD2 3.59Å; V170-L172 HydrophobicContact CG1-CG 4.45Å; V170-Y182 CarbonylContact O-C 3.51Å; V170-Y182 WeakPolarHBondContact O-CA 3.16Å; V170-Y182 WeakPolarHBondContact O-CB 3.16Å; V170-Y183 PolarHBondContact N-O 3.35Å; V170-Y183 PolarHBondContact O-N 3.16Å; V170-V185 HydrophobicContact CB-CG2 4.5Å; V170-V185 HydrophobicContact CG2-CG2 3.65Å
171	Y	96.8	Very high	93.4	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119.9	173.3	-58.5	-101.3	0	0	0	109.8	L162 L169 I180 R181 Y182 F209 A223 I225 F239	L162-Y171 PolarHBondContact N-O 2.84Å; L162-Y171 PolarHBondContact O-N 3.25Å; L169-Y171 HydrophobicContact CB-CE2 3.83Å; Y171-I180 HydrophobicContact CD1-CG2 4.34Å; Y171-R181 CarbonylContact C-O 3.45Å; Y171-Y182 HydrophobicContact CD1-CD1 4.39Å; Y171-Y182 HydrophobicContact CD1-CG 4.08Å; Y171-Y182 HydrophobicContact CE1-CD1 4.44Å; Y171-Y182 HydrophobicContact CE1-CD2 4.41Å; Y171-Y182 HydrophobicContact CE1-CG 4.02Å; Y171-F209 HydrophobicContact CD2-CE2 4Å; Y171-F209 AromaticContact CD2-CZ 3.64Å; Y171-F209 HydrophobicContact CD2-CZ 3.64Å; Y171-F209 HydrophobicContact CE2-CE2 4.44Å; Y171-F209 AromaticContact CE2-CZ 3.67Å; Y171-F209 HydrophobicContact CE2-CZ 3.67Å; Y171-F209 HydrophobicContact CG-CE2 4.24Å; Y171-F209 HydrophobicContact CG-CZ 4.26Å; Y171-A223 HydrophobicContact CE2-CB 4.32Å; Y171-A223 WeakPolarHBondContact OH-CB 3.36Å; Y171-I225 HydrophobicContact CD1-CD1 3.91Å; Y171-I225 HydrophobicContact CE1-CD1 4.36Å; Y171-I225 HydrophobicContact CG-CD1 4.29Å; Y171-F239 HydrophobicContact CD1-CZ 4.46Å; Y171-F239 HydrophobicContact CE1-CD1 4.05Å; Y171-F239 HydrophobicContact CE1-CD2 4.34Å; Y171-F239 HydrophobicContact CE1-CE1 4.01Å; Y171-F239 HydrophobicContact CE1-CE2 4.32Å; Y171-F239 HydrophobicContact CE1-CG 4.21Å; Y171-F239 HydrophobicContact CE1-CZ 4.16Å
172	L	96.4	Very high	93.5	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	110.6	178.3	-55.5	-169.8	0	0	0	110.2	F123 T125 L152 L159 P161 V170 R181 Y183	F123-L172 HydrophobicContact CE1-CD2 3.67Å; F123-L172 HydrophobicContact CZ-CD1 4.48Å; F123-L172 HydrophobicContact CZ-CD2 4.09Å; T125-L172 HydrophobicContact CG2-CD2 3.93Å; L152-L172 HydrophobicContact CD1-CD1 3.78Å; L159-L172 HydrophobicContact CD1-CD1 4.47Å; L159-L172 HydrophobicContact CD2-CB 4.33Å; P161-L172 HydrophobicContact CB-CD2 3.79Å; V170-L172 HydrophobicContact CG1-CD2 3.59Å; V170-L172 HydrophobicContact CG1-CG 4.45Å; L172-R181 HydrophobicContact CB-CB 4.48Å; L172-R181 PolarHBondContact N-O 3.03Å; L172-R181 PolarHBondContact O-N 3.36Å; L172-Y183 HydrophobicContact CD1-CD2 4.15Å; L172-Y183 HydrophobicContact CD1-CE2 3.56Å; L172-Y183 HydrophobicContact CG-CD2 4.17Å; L172-Y183 HydrophobicContact CG-CE2 3.93Å
173	C	93.9	Very high	93.9	Very high	4 Å²	4	26.7 Å²	26.7	3%	0.027	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	122.9	-178.9	-61	0	0	0	0	110.8	Y160 I207	Y160-C173 WeakPolarHBondContact CB-O 3.31Å; Y160-C173 WeakPolarHBondContact CD2-O 3.47Å; Y160-C173 PolarHBondContact N-O 2.79Å; Y160-C173 PolarHBondContact O-N 3Å; C173-I207 HydrophobicContact CB-CG1 3.96Å
174	G	91.8	Very high	94.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.01	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	138.2	170.9	0	0	0	0	0	112.7	V158 G176 D177 Q204	V158-G174 WeakPolarHBondContact O-CA 3.33Å; G174-G176 PolarHBondContact O-N 2.6Å; G174-D177 WeakPolarHBondContact CA-OD2 3.24Å; G174-D177 WeakPolarHBondContact O-CB 3.29Å; G174-D177 PolarHBondContact O-N 2.83Å; G174-D177 VanDerWaalsContact O-N 3.12Å; G174-Q204 VanDerWaalsContact N-NE2 3.13Å; G174-Q204 WeakPolarHBondContact O-CG 3.49Å; G174-Q204 PolarHBondContact O-NE2 3.03Å
175	R	89.7	Confident	94.4	Very high	167 Å²	167	28.2 Å²	28.2	63%	0.63	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	127.6	170	178.8	179.7	-73.4	156.9	5.2	109.4	D177 R205	R175-D177 VanDerWaalsContact C-N 3.3Å; R175-R205 PolarHBondContact NE-O 2.93Å
176	G	92	Very high	94.8	Very high	49 Å²	49	28.9 Å²	28.9	51%	0.505	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.9	-5.9	-175.2	0	0	0	0	0	113.6	G174 P203 Q204	G174-G176 PolarHBondContact O-N 2.6Å; G176-P203 VanDerWaalsContact O-CB 3.27Å; G176-P203 WeakPolarHBondContact O-CB 3.49Å; G176-Q204 PolarHBondContact N-O 2.67Å
177	D	93.8	Very high	95	Very high	17 Å²	17	33.2 Å²	33.2	9%	0.091	18%	0.176	C	C	.	.			trans	-79.5	145.9	176.2	-68.8	7.2	0	0	0	110.8	R133 G174 R175 N179 P203 Q204	R133-D177 IonicContact CZ-OD2 2.7Å; R133-D177 IonicContact NH1-OD1 3.93Å; R133-D177 PolarHBondContact NH1-OD1 2.91Å; R133-D177 IonicContact NH1-OD2 3.5Å; R133-D177 PolarHBondContact NH1-OD2 3.46Å; R133-D177 IonicContact NH2-OD1 2.68Å; R133-D177 IonicContact NH2-OD2 3.45Å; R133-D177 PolarHBondContact NH2-OD2 3.18Å; R133-D177 VanDerWaalsContact NH2-OD2 3.17Å; G174-D177 WeakPolarHBondContact CA-OD2 3.24Å; G174-D177 WeakPolarHBondContact O-CB 3.29Å; G174-D177 PolarHBondContact O-N 2.83Å; G174-D177 VanDerWaalsContact O-N 3.12Å; R175-D177 VanDerWaalsContact C-N 3.3Å; D177-N179 VanDerWaalsContact C-N 3.33Å; D177-P203 CarbonylContact O-C 3.59Å; D177-P203 WeakPolarHBondContact O-CA 3.26Å; D177-Q204 VanDerWaalsContact O-CG 3.3Å; D177-Q204 WeakPolarHBondContact O-CG 3.14Å; D177-Q204 PolarHBondContact O-N 3.36Å
178	S	93.9	Very high	95.1	Very high	42 Å²	42	36.9 Å²	36.9	29%	0.294	20%	0.195	S	C	.	.	S	Bend	trans	-87.2	-9.2	167.2	55.5	0	0	0	0	113.1	S200	S178-S200 WeakPolarHBondContact CB-O 3.41Å; S178-S200 PolarHBondContact O-N 3.03Å; S178-S200 PolarHBondContact O-OG 2.86Å
179	N	95.1	Very high	95.1	Very high	45 Å²	45	41 Å²	41	24%	0.241	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	145.6	-167.5	-60	-8	0	0	0	111.2	D177 T197 Y198 T199	D177-N179 VanDerWaalsContact C-N 3.33Å; N179-T197 HydrophobicContact CB-CG2 3.84Å; N179-Y198 CarbonylContact C-O 3.51Å; N179-Y198 WeakPolarHBondContact CA-O 3.21Å; N179-T199 WeakPolarHBondContact OD1-CG2 3.35Å; N179-T199 PolarHBondContact OD1-OG1 3.12Å
180	I	95.9	Very high	95.1	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	111.6	170.1	-58.8	172.3	0	0	0	106.9	Y171 T197 Y198 I207 L237	Y171-I180 HydrophobicContact CD1-CG2 4.34Å; I180-T197 CarbonylContact O-C 3.42Å; I180-T197 WeakPolarHBondContact O-CA 3.21Å; I180-Y198 HydrophobicContact CD1-CD1 4.34Å; I180-Y198 PolarHBondContact N-O 2.91Å; I180-Y198 PolarHBondContact O-N 2.78Å; I180-I207 HydrophobicContact CD1-CD1 4.23Å; I180-L237 HydrophobicContact CD1-CD1 3.69Å
181	R	97.5	Very high	95	Very high	42 Å²	42	45.9 Å²	45.9	16%	0.158	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	140.9	174.4	-59.5	-169.2	176.9	86.3	-7.9	109	D153 Y171 L172 Y183 T197	D153-R181 IonicContact OD2-CZ 3.2Å; D153-R181 IonicContact OD2-NH1 2.68Å; D153-R181 PolarHBondContact OD2-NH1 3.46Å; D153-R181 IonicContact OD2-NH2 2.99Å; D153-R181 PolarHBondContact OD2-NH2 3.2Å; Y171-R181 CarbonylContact C-O 3.45Å; L172-R181 HydrophobicContact CB-CB 4.48Å; L172-R181 PolarHBondContact N-O 3.03Å; L172-R181 PolarHBondContact O-N 3.36Å; R181-Y183 HydrophobicContact CB-CE2 3.62Å; R181-Y183 WeakPolarHBondContact CD-OH 3.05Å; R181-T197 HydrophobicContact CG-CG2 3.98Å
182	Y	97.5	Very high	95.1	Very high	21 Å²	21	46 Å²	46	8%	0.082	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	145.1	175.3	56.4	-82.3	0	0	0	112.3	V170 Y171 I195 N196 F239	V170-Y182 CarbonylContact O-C 3.51Å; V170-Y182 WeakPolarHBondContact O-CA 3.16Å; V170-Y182 WeakPolarHBondContact O-CB 3.16Å; Y171-Y182 HydrophobicContact CD1-CD1 4.39Å; Y171-Y182 HydrophobicContact CD1-CG 4.08Å; Y171-Y182 HydrophobicContact CE1-CD1 4.44Å; Y171-Y182 HydrophobicContact CE1-CD2 4.41Å; Y171-Y182 HydrophobicContact CE1-CG 4.02Å; Y182-I195 HydrophobicContact CD2-CB 3.69Å; Y182-I195 HydrophobicContact CD2-CG1 4.42Å; Y182-I195 HydrophobicContact CD2-CG2 3.85Å; Y182-I195 HydrophobicContact CE2-CB 3.75Å; Y182-I195 HydrophobicContact CE2-CG2 3.39Å; Y182-I195 WeakPolarHBondContact O-CB 3.15Å; Y182-I195 PolarHBondContact O-N 3.17Å; Y182-N196 VanDerWaalsContact CD1-O 3.26Å; Y182-N196 WeakPolarHBondContact CD1-O 3.5Å; Y182-N196 HydrophobicContact CE1-CB 3.76Å; Y182-N196 WeakPolarHBondContact CE1-O 3.49Å; Y182-N196 HydrophobicContact CE2-CB 4.05Å; Y182-N196 VanDerWaalsContact CZ-CB 3.4Å; Y182-N196 PolarHBondContact N-O 3.49Å; Y182-N196 PolarHBondContact O-N 3.21Å; Y182-N196 WeakPolarHBondContact OH-CB 3.13Å; Y182-F239 HydrophobicContact CD1-CE1 4.22Å; Y182-F239 HydrophobicContact CE1-CD1 4.39Å; Y182-F239 AromaticContact CE1-CE1 3.84Å; Y182-F239 HydrophobicContact CE1-CE1 3.84Å
183	Y	98.5	Very high	95.2	Very high	11 Å²	11	48.2 Å²	48.2	4%	0.043	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	148.4	-168.7	-57.7	-100.3	0	0	0	109.1	Y135 L152 L169 V170 L172 R181 V192 H193 Y194	Y135-Y183 HydrophobicContact CE1-CE1 4.21Å; L152-Y183 WeakPolarHBondContact CD2-OH 3.32Å; L169-Y183 CarbonylContact C-O 3.57Å; L169-Y183 VanDerWaalsContact CA-O 3.29Å; L169-Y183 WeakPolarHBondContact CA-O 3.21Å; V170-Y183 PolarHBondContact N-O 3.35Å; V170-Y183 PolarHBondContact O-N 3.16Å; L172-Y183 HydrophobicContact CD1-CD2 4.15Å; L172-Y183 HydrophobicContact CD1-CE2 3.56Å; L172-Y183 HydrophobicContact CG-CD2 4.17Å; L172-Y183 HydrophobicContact CG-CE2 3.93Å; R181-Y183 HydrophobicContact CB-CE2 3.62Å; R181-Y183 WeakPolarHBondContact CD-OH 3.05Å; Y183-V192 HydrophobicContact CD1-CG1 3.73Å; Y183-V192 HydrophobicContact CG-CG1 3.93Å; Y183-H193 CarbonylContact C-O 3.27Å; Y183-H193 WeakPolarHBondContact CA-O 3.14Å; Y183-H193 WeakPolarHBondContact CB-O 3.02Å; Y183-Y194 VanDerWaalsContact CD1-CA 3.5Å; Y183-Y194 HydrophobicContact CD1-CD2 4.33Å; Y183-Y194 AromaticContact CE1-CD2 3.76Å; Y183-Y194 HydrophobicContact CE1-CD2 3.76Å; Y183-Y194 HydrophobicContact CE1-CG 4.31Å; Y183-Y194 AromaticContact CZ-CD2 3.98Å
184	E	97.3	Very high	95.4	Very high	77 Å²	77	54 Å²	54	36%	0.36	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.7	166	-175.5	-177.1	172.4	0	0	109	L169 H193 I195	L169-E184 HydrophobicContact CD2-CB 3.78Å; L169-E184 HydrophobicContact CD2-CG 4.27Å; E184-H193 HydrophobicContact CB-CB 4.4Å; E184-H193 PolarHBondContact N-O 2.96Å; E184-H193 PolarHBondContact O-N 2.99Å; E184-I195 HydrophobicContact CB-CD1 3.88Å; E184-I195 HydrophobicContact CB-CG1 4.11Å
185	V	97.6	Very high	95.6	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.055	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	118.6	175.5	-172.5	0	0	0	0	109.2	L117 F123 L137 G168 V170 F191 V192	L117-V185 HydrophobicContact CD1-CB 4.2Å; L117-V185 HydrophobicContact CD1-CG1 3.56Å; F123-V185 HydrophobicContact CD2-CG2 4.38Å; L137-V185 HydrophobicContact CD1-CG1 4.23Å; L137-V185 HydrophobicContact CD2-CG1 4.11Å; G168-V185 PolarHBondContact O-N 3.24Å; V170-V185 HydrophobicContact CB-CG2 4.5Å; V170-V185 HydrophobicContact CG2-CG2 3.65Å; V185-F191 VanDerWaalsContact CA-O 3.28Å; V185-F191 WeakPolarHBondContact CA-O 3.39Å; V185-F191 WeakPolarHBondContact CG1-O 3.48Å; V185-V192 HydrophobicContact CG1-CG2 4.48Å; V185-V192 HydrophobicContact CG2-CG1 4.44Å; V185-V192 HydrophobicContact CG2-CG2 4.28Å
186	N	94.6	Very high	95.9	Very high	39 Å²	39	50.7 Å²	50.7	21%	0.209	27%	0.274	C	S	.	.			trans	-136.3	-171.5	179.6	65.7	29.8	0	0	0	110.9	R121 D188 F191 H193	R121-N186 PolarHBondContact NH1-O 2.55Å; R121-N186 PolarHBondContact NH2-O 3.3Å; N186-D188 PolarHBondContact OD1-N 3.4Å; N186-D188 PolarHBondContact OD1-O 3.44Å; N186-F191 PolarHBondContact N-O 3.48Å; N186-H193 VanDerWaalsContact CG-NE2 3.33Å; N186-H193 PolarHBondContact ND2-CD2 2.99Å; N186-H193 PolarHBondContact ND2-NE2 3.38Å; N186-H193 VanDerWaalsContact ND2-NE2 3.16Å; N186-H193 PolarHBondContact OD1-CD2 2.82Å; N186-H193 PolarHBondContact OD1-NE2 3.31Å
187	N	93.6	Very high	96.1	Very high	111 Å²	111	49.9 Å²	49.9	59%	0.594	26%	0.259	S	S	*	.	S	Bend	trans	-93.1	0.7	-174.9	-69	-40.7	0	0	0	113.5	R121 F191	R121-N187 PolarHBondContact NH2-OD1 3.14Å; N187-F191 VanDerWaalsContact O-CE1 3.25Å; N187-F191 WeakPolarHBondContact O-CE1 3.11Å
188	D	94	Very high	96.2	Very high	108 Å²	108	52.4 Å²	52.4	58%	0.578	27%	0.268	S	S	*	.	S	Bend	trans	-107.5	133.3	-175.3	-63.1	-63.3	0	0	0	110.2	N186 F191 H193	N186-D188 PolarHBondContact OD1-N 3.4Å; N186-D188 PolarHBondContact OD1-O 3.44Å; D188-F191 WeakPolarHBondContact O-CA 3.23Å; D188-F191 PolarHBondContact O-N 3.43Å; D188-H193 PolarHBondContact O-NE2 3.03Å; D188-H193 VanDerWaalsContact O-NE2 3.11Å
189	P	94.5	Very high	96.3	Very high	97 Å²	97	54.5 Å²	54.5	63%	0.63	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	140.8	176.1	-26.5	32.9	0	0	0	112.8	F191	P189-F191 VanDerWaalsContact C-N 3.26Å; P189-F191 VanDerWaalsContact CA-N 3.28Å; P189-F191 HydrophobicContact CB-CE2 4.19Å; P189-F191 HydrophobicContact CB-CZ 4.37Å; P189-F191 HydrophobicContact CG-CE1 4.18Å; P189-F191 HydrophobicContact CG-CE2 3.98Å; P189-F191 HydrophobicContact CG-CZ 3.68Å
190	P	95.1	Very high	96.2	Very high	63 Å²	63	52.8 Å²	52.8	41%	0.409	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	cis	-78.2	14.7	3.4	32.9	-40.5	0	0	0	115.8	I148 V192 H193	I148-P190 HydrophobicContact CD1-CB 4.11Å; I148-P190 WeakPolarHBondContact CD1-O 3.07Å; P190-V192 PolarHBondContact O-N 2.95Å; P190-H193 VanDerWaalsContact CD-CE1 3.4Å; P190-H193 WeakPolarHBondContact CD-CE1 3.34Å
191	F	96.4	Very high	95.9	Very high	56 Å²	56	58.3 Å²	58.3	25%	0.246	31%	0.307	C	S	.	.	S	Bend	trans	69.8	-33.5	179.6	-48.5	-80.1	0	0	0	114.9	L137 I147 V185 N186 N187 D188 P189	L137-F191 HydrophobicContact CD2-CB 3.79Å; I147-F191 HydrophobicContact CG2-CD2 3.72Å; I147-F191 HydrophobicContact CG2-CE2 3.79Å; I147-F191 HydrophobicContact CG2-CG 4.29Å; I147-F191 HydrophobicContact CG2-CZ 4.41Å; V185-F191 VanDerWaalsContact CA-O 3.28Å; V185-F191 WeakPolarHBondContact CA-O 3.39Å; V185-F191 WeakPolarHBondContact CG1-O 3.48Å; N186-F191 PolarHBondContact N-O 3.48Å; N187-F191 VanDerWaalsContact O-CE1 3.25Å; N187-F191 WeakPolarHBondContact O-CE1 3.11Å; D188-F191 WeakPolarHBondContact O-CA 3.23Å; D188-F191 PolarHBondContact O-N 3.43Å; P189-F191 VanDerWaalsContact C-N 3.26Å; P189-F191 VanDerWaalsContact CA-N 3.28Å; P189-F191 HydrophobicContact CB-CE2 4.19Å; P189-F191 HydrophobicContact CB-CZ 4.37Å; P189-F191 HydrophobicContact CG-CE1 4.18Å; P189-F191 HydrophobicContact CG-CE2 3.98Å; P189-F191 HydrophobicContact CG-CZ 3.68Å
192	V	98.3	Very high	95.6	Very high	4 Å²	4	58.6 Å²	58.6	2%	0.024	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	107.1	173.4	-175.1	0	0	0	0	108	F123 Y135 L137 I148 Y183 V185 P190	F123-V192 HydrophobicContact CE2-CG1 4.12Å; F123-V192 HydrophobicContact CE2-CG2 4.21Å; Y135-V192 HydrophobicContact CD2-CG1 4.48Å; Y135-V192 HydrophobicContact CE2-CB 3.84Å; Y135-V192 HydrophobicContact CE2-CG1 3.65Å; Y135-V192 HydrophobicContact CE2-CG2 3.89Å; L137-V192 HydrophobicContact CB-CG2 4.16Å; L137-V192 HydrophobicContact CD2-CG2 3.98Å; I148-V192 HydrophobicContact CG2-CG2 4.01Å; Y183-V192 HydrophobicContact CD1-CG1 3.73Å; Y183-V192 HydrophobicContact CG-CG1 3.93Å; V185-V192 HydrophobicContact CG1-CG2 4.48Å; V185-V192 HydrophobicContact CG2-CG1 4.44Å; V185-V192 HydrophobicContact CG2-CG2 4.28Å; P190-V192 PolarHBondContact O-N 2.95Å
193	H	98	Very high	95.4	Very high	49 Å²	49	59.3 Å²	59.3	23%	0.227	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	118.3	-174.6	-58.3	-92.2	0	0	0	109.4	Y183 E184 N186 D188 P190 I195	Y183-H193 CarbonylContact C-O 3.27Å; Y183-H193 WeakPolarHBondContact CA-O 3.14Å; Y183-H193 WeakPolarHBondContact CB-O 3.02Å; E184-H193 HydrophobicContact CB-CB 4.4Å; E184-H193 PolarHBondContact N-O 2.96Å; E184-H193 PolarHBondContact O-N 2.99Å; N186-H193 VanDerWaalsContact CG-NE2 3.33Å; N186-H193 PolarHBondContact ND2-CD2 2.99Å; N186-H193 PolarHBondContact ND2-NE2 3.38Å; N186-H193 VanDerWaalsContact ND2-NE2 3.16Å; N186-H193 PolarHBondContact OD1-CD2 2.82Å; N186-H193 PolarHBondContact OD1-NE2 3.31Å; D188-H193 PolarHBondContact O-NE2 3.03Å; D188-H193 VanDerWaalsContact O-NE2 3.11Å; P190-H193 VanDerWaalsContact CD-CE1 3.4Å; P190-H193 WeakPolarHBondContact CD-CE1 3.34Å; H193-I195 PolarHBondContact O-N 3.24Å
194	Y	97.8	Very high	95.1	Very high	125 Å²	125	58.9 Å²	58.9	49%	0.49	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	126.9	173.5	173.1	-99.2	0	0	0	110.3	Y183 N196 T197	Y183-Y194 VanDerWaalsContact CD1-CA 3.5Å; Y183-Y194 HydrophobicContact CD1-CD2 4.33Å; Y183-Y194 AromaticContact CE1-CD2 3.76Å; Y183-Y194 HydrophobicContact CE1-CD2 3.76Å; Y183-Y194 HydrophobicContact CE1-CG 4.31Å; Y183-Y194 AromaticContact CZ-CD2 3.98Å; Y194-N196 VanDerWaalsContact CZ-C 3.49Å; Y194-N196 VanDerWaalsContact CZ-CA 3.49Å; Y194-N196 VanDerWaalsContact OH-C 3.24Å; Y194-N196 WeakPolarHBondContact OH-CA 3.38Å; Y194-T197 WeakPolarHBondContact CE2-OG1 3.35Å; Y194-T197 PolarHBondContact OH-N 3.26Å; Y194-T197 PolarHBondContact OH-OG1 2.7Å
195	I	96.3	Very high	94.8	Very high	62 Å²	62	63 Å²	63	32%	0.318	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-62.6	176.9	-55.5	-59.7	0	0	0	109.9	L169 Y182 E184 H193	L169-I195 HydrophobicContact CD2-CG1 4.24Å; Y182-I195 HydrophobicContact CD2-CB 3.69Å; Y182-I195 HydrophobicContact CD2-CG1 4.42Å; Y182-I195 HydrophobicContact CD2-CG2 3.85Å; Y182-I195 HydrophobicContact CE2-CB 3.75Å; Y182-I195 HydrophobicContact CE2-CG2 3.39Å; Y182-I195 WeakPolarHBondContact O-CB 3.15Å; Y182-I195 PolarHBondContact O-N 3.17Å; E184-I195 HydrophobicContact CB-CD1 3.88Å; E184-I195 HydrophobicContact CB-CG1 4.11Å; H193-I195 PolarHBondContact O-N 3.24Å
196	N	96.4	Very high	94.3	Very high	37 Å²	37	63.9 Å²	63.9	20%	0.198	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	176.6	177.4	-147.9	-23.5	0	0	0	112	Y182 Y194 T355	Y182-N196 VanDerWaalsContact CD1-O 3.26Å; Y182-N196 WeakPolarHBondContact CD1-O 3.5Å; Y182-N196 HydrophobicContact CE1-CB 3.76Å; Y182-N196 WeakPolarHBondContact CE1-O 3.49Å; Y182-N196 HydrophobicContact CE2-CB 4.05Å; Y182-N196 VanDerWaalsContact CZ-CB 3.4Å; Y182-N196 PolarHBondContact N-O 3.49Å; Y182-N196 PolarHBondContact O-N 3.21Å; Y182-N196 WeakPolarHBondContact OH-CB 3.13Å; Y194-N196 VanDerWaalsContact CZ-C 3.49Å; Y194-N196 VanDerWaalsContact CZ-CA 3.49Å; Y194-N196 VanDerWaalsContact OH-C 3.24Å; Y194-N196 WeakPolarHBondContact OH-CA 3.38Å; N196-T355 PolarHBondContact ND2-OG1 3.47Å
197	T	96.9	Very high	94.1	Very high	32 Å²	32	64.2 Å²	64.2	20%	0.196	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	113.3	171.2	-57.8	0	0	0	0	109.2	N179 I180 R181 Y194	N179-T197 HydrophobicContact CB-CG2 3.84Å; I180-T197 CarbonylContact O-C 3.42Å; I180-T197 WeakPolarHBondContact O-CA 3.21Å; R181-T197 HydrophobicContact CG-CG2 3.98Å; Y194-T197 WeakPolarHBondContact CE2-OG1 3.35Å; Y194-T197 PolarHBondContact OH-N 3.26Å; Y194-T197 PolarHBondContact OH-OG1 2.7Å
198	Y	95.6	Very high	93.7	Very high	70 Å²	70	59.8 Å²	59.8	28%	0.275	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131.1	164	175.6	-95.8	0	0	0	109	N179 I180 L237	N179-Y198 CarbonylContact C-O 3.51Å; N179-Y198 WeakPolarHBondContact CA-O 3.21Å; I180-Y198 HydrophobicContact CD1-CD1 4.34Å; I180-Y198 PolarHBondContact N-O 2.91Å; I180-Y198 PolarHBondContact O-N 2.78Å; Y198-L237 HydrophobicContact CD1-CD1 3.73Å; Y198-L237 HydrophobicContact CE1-CD1 3.5Å; Y198-L237 VanDerWaalsContact CE1-CD1 3.5Å; Y198-L237 HydrophobicContact CE1-CD2 3.73Å; Y198-L237 HydrophobicContact CE1-CG 4.25Å; Y198-L237 HydrophobicContact CE2-CD2 4.07Å; Y198-L237 HydrophobicContact CG-CD1 4.42Å; Y198-L237 VanDerWaalsContact CZ-CD2 3.41Å; Y198-L237 WeakPolarHBondContact OH-CD2 3.49Å
199	T	95.7	Very high	93.3	Very high	87 Å²	87	56.3 Å²	56.3	53%	0.534	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	137.5	179.9	-62.7	0	0	0	0	109.2	N179	N179-T199 WeakPolarHBondContact OD1-CG2 3.35Å; N179-T199 PolarHBondContact OD1-OG1 3.12Å
200	S	92	Very high	93	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.063	28%	0.281	C	S	.	.			trans	-133.5	160.5	178.5	62.5	0	0	0	0	110.9	S178 E202 K227	S178-S200 WeakPolarHBondContact CB-O 3.41Å; S178-S200 PolarHBondContact O-N 3.03Å; S178-S200 PolarHBondContact O-OG 2.86Å; S200-E202 VanDerWaalsContact C-N 3.35Å; S200-E202 PolarHBondContact OG-O 3.35Å; S200-K227 VanDerWaalsContact OG-CE 3.24Å; S200-K227 WeakPolarHBondContact OG-CE 3.32Å; S200-K227 PolarHBondContact OG-NZ 2.95Å
201	P	90.3	Very high	92.5	Very high	116 Å²	116	53.7 Å²	53.7	75%	0.753	28%	0.28	S	S	*	.	S	Bend	trans	-75.1	-25.6	177.7	28.1	-33.9	0	0	0	113.1
202	E	91.7	Very high	91.9	Very high	48 Å²	48	51.7 Å²	51.7	22%	0.224	27%	0.271	C	S	.	.	S	Bend	trans	-103.2	132.5	-174	-69.2	-70.1	160.1	0	0	111.2	S200 K227 T229 K231	S200-E202 VanDerWaalsContact C-N 3.35Å; S200-E202 PolarHBondContact OG-O 3.35Å; E202-K227 VanDerWaalsContact O-CE 3.31Å; E202-K227 WeakPolarHBondContact O-CE 3.26Å; E202-K227 PolarHBondContact O-NZ 2.99Å; E202-T229 HydrophobicContact CB-CG2 4.23Å; E202-K231 VanDerWaalsContact OE1-CE 3.31Å; E202-K231 WeakPolarHBondContact OE1-CE 3.45Å; E202-K231 IonicContact OE1-NZ 2.67Å; E202-K231 PolarHBondContact OE1-NZ 2.83Å
203	P	93.3	Very high	91.1	Very high	36 Å²	36	56.2 Å²	56.2	23%	0.234	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-68	143	176.8	29.2	-35.4	0	0	0	111.5	G176 D177	G176-P203 VanDerWaalsContact O-CB 3.27Å; G176-P203 WeakPolarHBondContact O-CB 3.49Å; D177-P203 CarbonylContact O-C 3.59Å; D177-P203 WeakPolarHBondContact O-CA 3.26Å
204	Q	92.4	Very high	90.6	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.009	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.7	174.8	70.3	-155.8	13.5	0	0	111.5	G174 G176 D177 I207 K227	G174-Q204 VanDerWaalsContact N-NE2 3.13Å; G174-Q204 WeakPolarHBondContact O-CG 3.49Å; G174-Q204 PolarHBondContact O-NE2 3.03Å; G176-Q204 PolarHBondContact N-O 2.67Å; D177-Q204 VanDerWaalsContact O-CG 3.3Å; D177-Q204 WeakPolarHBondContact O-CG 3.14Å; D177-Q204 PolarHBondContact O-N 3.36Å; Q204-I207 HydrophobicContact CB-CD1 4.03Å; Q204-I207 HydrophobicContact CG-CD1 4.27Å; Q204-I207 HydrophobicContact CG-CG1 4.35Å; Q204-K227 HydrophobicContact CB-CD 4Å; Q204-K227 HydrophobicContact CB-CG 3.77Å
205	R	90.4	Very high	90.3	Very high	162 Å²	162	50 Å²	50	61%	0.611	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	-33.1	172.5	-175.3	-179.8	174.2	113.3	-1.2	111.8	R175 C228	R175-R205 PolarHBondContact NE-O 2.93Å; R205-C228 WeakPolarHBondContact CB-O 3.48Å; R205-C228 PolarHBondContact N-O 3.42Å
206	G	87.4	Confident	90	Very high	29 Å²	29	49.3 Å²	49.3	30%	0.299	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.6	158.8	179.9	0	0	0	0	0	110.7	C228	G206-C228 PolarHBondContact O-N 3.3Å
207	I	89.2	Confident	89.7	Confident	46 Å²	46	48.2 Å²	48.2	24%	0.236	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	141.2	-176.4	-66.4	-60	0	0	0	108.5	L162 C173 I180 Q204 I225 Y226 K227	L162-I207 HydrophobicContact CD1-CG2 3.61Å; C173-I207 HydrophobicContact CB-CG1 3.96Å; I180-I207 HydrophobicContact CD1-CD1 4.23Å; Q204-I207 HydrophobicContact CB-CD1 4.03Å; Q204-I207 HydrophobicContact CG-CD1 4.27Å; Q204-I207 HydrophobicContact CG-CG1 4.35Å; I207-I225 HydrophobicContact CD1-CG2 4.05Å; I207-I225 HydrophobicContact CG2-CG2 3.42Å; I207-I225 VanDerWaalsContact CG2-CG2 3.42Å; I207-Y226 CarbonylContact C-O 3.6Å; I207-Y226 WeakPolarHBondContact CA-O 3.44Å; I207-K227 HydrophobicContact CD1-CB 3.77Å; I207-K227 HydrophobicContact CD1-CG 3.99Å
208	G	85.9	Confident	89.2	Confident	17 Å²	17	50.3 Å²	50.3	18%	0.175	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	146.1	168.2	0	0	0	0	0	111.1	I225 Y226	G208-I225 CarbonylContact O-C 3.56Å; G208-I225 WeakPolarHBondContact O-CA 3.09Å; G208-Y226 PolarHBondContact N-O 2.85Å; G208-Y226 PolarHBondContact O-N 3.35Å
209	F	85.4	Confident	88.9	Confident	36 Å²	36	52.3 Å²	52.3	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	132.3	-178.6	-127.6	-100.3	0	0	0	110.9	L162 Y171 A223 I225	L162-F209 HydrophobicContact CB-CD2 4.32Å; L162-F209 HydrophobicContact CB-CE2 4.18Å; L162-F209 HydrophobicContact CD1-CD2 3.81Å; L162-F209 HydrophobicContact CD1-CE2 4.12Å; Y171-F209 HydrophobicContact CD2-CE2 4Å; Y171-F209 AromaticContact CD2-CZ 3.64Å; Y171-F209 HydrophobicContact CD2-CZ 3.64Å; Y171-F209 HydrophobicContact CE2-CE2 4.44Å; Y171-F209 AromaticContact CE2-CZ 3.67Å; Y171-F209 HydrophobicContact CE2-CZ 3.67Å; Y171-F209 HydrophobicContact CG-CE2 4.24Å; Y171-F209 HydrophobicContact CG-CZ 4.26Å; F209-A223 HydrophobicContact CE1-CB 3.82Å; F209-A223 HydrophobicContact CZ-CB 3.81Å; F209-I225 HydrophobicContact CD2-CD1 4.24Å; F209-I225 HydrophobicContact CD2-CG1 3.85Å; F209-I225 HydrophobicContact CE2-CD1 3.53Å; F209-I225 HydrophobicContact CE2-CG1 3.49Å; F209-I225 VanDerWaalsContact CE2-CG1 3.49Å; F209-I225 HydrophobicContact CZ-CD1 4.22Å; F209-I225 HydrophobicContact CZ-CG1 4.09Å
210	M	88	Confident	88.7	Confident	45 Å²	45	48.5 Å²	48.5	22%	0.222	26%	0.261	C	S	.	.			trans	-74	130.3	169.6	-177.5	51.6	81.9	0	0	109.8	L215 R224 Y226	M210-L215 HydrophobicContact CB-CD2 3.93Å; M210-L215 HydrophobicContact CG-CD2 3.71Å; M210-L215 HydrophobicContact CG-CG 4.48Å; M210-R224 HydrophobicContact CB-CB 3.71Å; M210-R224 HydrophobicContact CB-CG 4.31Å; M210-R224 WeakPolarHBondContact CB-O 3.45Å; M210-R224 HydrophobicContact CG-CB 4.32Å; M210-R224 PolarHBondContact N-O 3.4Å; M210-Y226 HydrophobicContact CB-CE2 4.04Å; M210-Y226 HydrophobicContact CE-CE2 3.71Å; M210-Y226 WeakPolarHBondContact CE-OH 3.47Å
211	P	84.4	Confident	88.8	Confident	59 Å²	59	48.1 Å²	48.1	38%	0.383	26%	0.258	S	S	.	.			trans	-60.1	152.1	168.4	-22.9	33.2	0	0	0	112	R213 G214	P211-R213 PolarHBondContact O-N 2.82Å; P211-G214 PolarHBondContact O-N 2.95Å
212	K	85.2	Confident	89	Confident	15 Å²	15	43.2 Å²	43.2	7%	0.065	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-49.9	-35.5	-178.9	-71.2	-74.9	-170	-178.4	0	114.7	D164 D166 G214 L215 I222 Y253 T256	D164-K212 VanDerWaalsContact CG-CE 3.49Å; D164-K212 WeakPolarHBondContact OD1-CE 3.38Å; D164-K212 IonicContact OD1-NZ 3.17Å; D164-K212 WeakPolarHBondContact OD2-CE 3.3Å; D164-K212 IonicContact OD2-NZ 3.36Å; D164-K212 PolarHBondContact OD2-NZ 2.9Å; D166-K212 VanDerWaalsContact OD2-CE 3.31Å; D166-K212 WeakPolarHBondContact OD2-CE 3.48Å; D166-K212 VanDerWaalsContact OD2-CG 3.31Å; D166-K212 WeakPolarHBondContact OD2-CG 3.42Å; K212-G214 PolarHBondContact O-N 3.22Å; K212-L215 HydrophobicContact CD-CD1 3.8Å; K212-L215 WeakPolarHBondContact O-CB 3.21Å; K212-L215 PolarHBondContact O-N 3.18Å; K212-L215 VanDerWaalsContact O-N 3.16Å; K212-I222 PolarHBondContact NZ-O 3.02Å; K212-Y253 HydrophobicContact CD-CD1 4.28Å; K212-Y253 HydrophobicContact CD-CE1 4.24Å; K212-T256 HydrophobicContact CB-CG2 4.34Å
213	R	82	Confident	89.1	Confident	98 Å²	98	41 Å²	41	37%	0.37	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-60.9	-25.6	177.3	-166.2	-174.2	-60.1	165.4	-3.3	114	P211 T259 L280	P211-R213 PolarHBondContact O-N 2.82Å; R213-T259 PolarHBondContact NH1-OG1 2.9Å; R213-T259 PolarHBondContact NH2-OG1 3.36Å; R213-L280 HydrophobicContact CG-CD2 4.41Å
214	G	87.3	Confident	89.2	Confident	29 Å²	29	41.4 Å²	41.4	30%	0.299	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-93.1	4.8	180	0	0	0	0	0	114.5	P211 K212 R224	P211-G214 PolarHBondContact O-N 2.95Å; K212-G214 PolarHBondContact O-N 3.22Å; G214-R224 PolarHBondContact O-NH1 3.17Å
215	L	91.1	Very high	89.2	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.073	21%	0.212	C	C	.	.	S	Bend	trans	-92.7	154.8	-179.9	-53.7	-177.1	0	0	0	111.4	M210 K212 V217 E221 I222 R224	M210-L215 HydrophobicContact CB-CD2 3.93Å; M210-L215 HydrophobicContact CG-CD2 3.71Å; M210-L215 HydrophobicContact CG-CG 4.48Å; K212-L215 HydrophobicContact CD-CD1 3.8Å; K212-L215 WeakPolarHBondContact O-CB 3.21Å; K212-L215 PolarHBondContact O-N 3.18Å; K212-L215 VanDerWaalsContact O-N 3.16Å; L215-V217 PolarHBondContact O-N 3.28Å; L215-V217 VanDerWaalsContact O-N 3.16Å; L215-E221 WeakPolarHBondContact CA-OE2 3.34Å; L215-E221 HydrophobicContact CB-CB 4.29Å; L215-E221 HydrophobicContact CB-CG 4.35Å; L215-E221 WeakPolarHBondContact CB-O 3.33Å; L215-E221 VanDerWaalsContact CD1-O 3.22Å; L215-E221 WeakPolarHBondContact CD1-O 3.35Å; L215-E221 HydrophobicContact CD2-CG 4.32Å; L215-I222 VanDerWaalsContact CD1-C 3.45Å; L215-I222 VanDerWaalsContact CD1-O 3.23Å; L215-I222 WeakPolarHBondContact CD1-O 3.26Å; L215-R224 HydrophobicContact CD2-CB 3.46Å; L215-R224 VanDerWaalsContact CD2-CB 3.46Å
216	N	90.6	Very high	89.3	Confident	49 Å²	49	36.7 Å²	36.7	26%	0.262	20%	0.195	S	C	.	.			trans	-80	92.1	174	-165.9	-9.6	0	0	0	110.7	D218 E219 N220 E221	N216-D218 VanDerWaalsContact C-N 3.3Å; N216-D218 PolarHBondContact O-N 3.45Å; N216-D218 PolarHBondContact OD1-N 3.36Å; N216-E219 HydrophobicContact CB-CB 4.25Å; N216-E219 VanDerWaalsContact ND2-CG 3.26Å; N216-E219 WeakPolarHBondContact ND2-CG 3.43Å; N216-E219 PolarHBondContact ND2-OE1 3.47Å; N216-E219 PolarHBondContact ND2-OE2 3.31Å; N216-E219 PolarHBondContact O-N 2.9Å; N216-E219 PolarHBondContact OD1-N 3.45Å; N216-N220 PolarHBondContact O-N 3.48Å; N216-E221 HydrophobicContact CB-CB 4.08Å; N216-E221 WeakPolarHBondContact CB-OE2 3.48Å; N216-E221 PolarHBondContact N-OE2 3.43Å; N216-E221 WeakPolarHBondContact O-CB 3.48Å; N216-E221 PolarHBondContact O-N 2.82Å
217	V	88.4	Confident	89.5	Confident	13 Å²	13	35.3 Å²	35.3	8%	0.079	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-37.8	-179.2	177.8	0	0	0	0	112.1	L215 E219 N220 F248 Y253 L284 V288	L215-V217 PolarHBondContact O-N 3.28Å; L215-V217 VanDerWaalsContact O-N 3.16Å; V217-E219 VanDerWaalsContact C-N 3.3Å; V217-E219 PolarHBondContact O-N 3.4Å; V217-N220 PolarHBondContact O-N 2.74Å; V217-N220 VanDerWaalsContact O-N 3.14Å; V217-F248 HydrophobicContact CG1-CD2 3.55Å; V217-F248 HydrophobicContact CG1-CE2 3.5Å; V217-F248 VanDerWaalsContact CG1-CE2 3.5Å; V217-Y253 WeakPolarHBondContact CA-OH 3.46Å; V217-Y253 HydrophobicContact CB-CE2 4.21Å; V217-Y253 HydrophobicContact CG1-CD2 3.88Å; V217-Y253 HydrophobicContact CG1-CE2 3.78Å; V217-Y253 HydrophobicContact CG1-CG 4.39Å; V217-Y253 HydrophobicContact CG2-CD1 4.28Å; V217-Y253 HydrophobicContact CG2-CE1 3.94Å; V217-Y253 HydrophobicContact CG2-CE2 4.33Å; V217-L284 HydrophobicContact CG2-CD2 4.28Å; V217-V288 HydrophobicContact CB-CG2 4.45Å; V217-V288 HydrophobicContact CG1-CG2 3.94Å
218	D	86.4	Confident	89.7	Confident	77 Å²	77	34.9 Å²	34.9	41%	0.412	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-30.8	-176.9	-60.2	-29	0	0	0	111.8	N216 N220 V288	N216-D218 VanDerWaalsContact C-N 3.3Å; N216-D218 PolarHBondContact O-N 3.45Å; N216-D218 PolarHBondContact OD1-N 3.36Å; D218-N220 VanDerWaalsContact C-N 3.34Å; D218-V288 WeakPolarHBondContact OD1-CG1 3.22Å; D218-V288 VanDerWaalsContact OD1-CG2 3.27Å; D218-V288 WeakPolarHBondContact OD1-CG2 3.22Å
219	E	89.9	Confident	89.9	Confident	112 Å²	112	34.3 Å²	34.3	52%	0.523	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.6	175.7	-69.6	178.8	-177.8	0	0	113.2	N216 V217 E221 F240	N216-E219 HydrophobicContact CB-CB 4.25Å; N216-E219 VanDerWaalsContact ND2-CG 3.26Å; N216-E219 WeakPolarHBondContact ND2-CG 3.43Å; N216-E219 PolarHBondContact ND2-OE1 3.47Å; N216-E219 PolarHBondContact ND2-OE2 3.31Å; N216-E219 PolarHBondContact O-N 2.9Å; N216-E219 PolarHBondContact OD1-N 3.45Å; V217-E219 VanDerWaalsContact C-N 3.3Å; V217-E219 PolarHBondContact O-N 3.4Å; E219-E221 VanDerWaalsContact C-N 3.34Å; E219-E221 PolarHBondContact O-N 2.72Å; E219-F240 HydrophobicContact CB-CD1 4.28Å; E219-F240 HydrophobicContact CB-CE1 4.08Å; E219-F240 WeakPolarHBondContact O-CD1 3.47Å
220	N	92	Very high	90	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	38.2	-177.3	-48.3	-72.6	0	0	0	113.4	N216 V217 D218 I222 F240 V241 Q249 L252	N216-N220 PolarHBondContact O-N 3.48Å; V217-N220 PolarHBondContact O-N 2.74Å; V217-N220 VanDerWaalsContact O-N 3.14Å; D218-N220 VanDerWaalsContact C-N 3.34Å; N220-I222 PolarHBondContact O-N 2.85Å; N220-F240 WeakPolarHBondContact O-CA 3.45Å; N220-V241 HydrophobicContact CB-CB 4.45Å; N220-V241 VanDerWaalsContact CB-O 3.27Å; N220-V241 WeakPolarHBondContact CB-O 3.31Å; N220-V241 PolarHBondContact O-N 2.82Å; N220-Q249 WeakPolarHBondContact OD1-CG 3.15Å; N220-L252 HydrophobicContact CB-CD1 3.96Å
221	E	94.3	Very high	90	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	104.5	174.4	-171.2	-174.3	-168.9	0	0	110.9	L215 N216 E219 R224 Q238 F239 F240 Y253	L215-E221 WeakPolarHBondContact CA-OE2 3.34Å; L215-E221 HydrophobicContact CB-CB 4.29Å; L215-E221 HydrophobicContact CB-CG 4.35Å; L215-E221 WeakPolarHBondContact CB-O 3.33Å; L215-E221 VanDerWaalsContact CD1-O 3.22Å; L215-E221 WeakPolarHBondContact CD1-O 3.35Å; L215-E221 HydrophobicContact CD2-CG 4.32Å; N216-E221 HydrophobicContact CB-CB 4.08Å; N216-E221 WeakPolarHBondContact CB-OE2 3.48Å; N216-E221 PolarHBondContact N-OE2 3.43Å; N216-E221 WeakPolarHBondContact O-CB 3.48Å; N216-E221 PolarHBondContact O-N 2.82Å; E219-E221 VanDerWaalsContact C-N 3.34Å; E219-E221 PolarHBondContact O-N 2.72Å; E221-R224 VanDerWaalsContact CD-NH2 3.33Å; E221-R224 WeakPolarHBondContact OE1-CB 3.42Å; E221-R224 IonicContact OE1-CZ 3.36Å; E221-R224 IonicContact OE1-NE 3.58Å; E221-R224 PolarHBondContact OE1-NE 2.93Å; E221-R224 IonicContact OE1-NH2 2.67Å; E221-R224 PolarHBondContact OE1-NH2 2.75Å; E221-R224 IonicContact OE2-CZ 2.79Å; E221-R224 IonicContact OE2-NE 3.61Å; E221-R224 IonicContact OE2-NH2 2.78Å; E221-R224 PolarHBondContact OE2-NH2 3.43Å; E221-Q238 VanDerWaalsContact OE1-CG 3.29Å; E221-Q238 WeakPolarHBondContact OE1-CG 3.48Å; E221-Q238 PolarHBondContact OE1-OE1 3.16Å; E221-F239 CarbonylContact C-O 3.46Å; E221-F239 WeakPolarHBondContact CA-O 3.44Å; E221-F240 HydrophobicContact CB-CD1 3.71Å; E221-F240 HydrophobicContact CB-CE1 3.57Å; E221-F240 HydrophobicContact CB-CZ 4.43Å; E221-F240 HydrophobicContact CG-CD1 4.16Å; E221-F240 HydrophobicContact CG-CE1 3.85Å; E221-F240 HydrophobicContact CG-CZ 4.23Å; E221-Y253 PolarHBondContact N-OH 2.96Å; E221-Y253 PolarHBondContact O-OH 3.18Å
222	I	93.6	Very high	90.2	Very high	14 Å²	14	42.4 Å²	42.4	7%	0.072	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-24.9	-175	52.7	162.5	0	0	0	113.8	T167 L169 K212 L215 N220 F239 V241 L252	T167-I222 HydrophobicContact CG2-CB 4.3Å; T167-I222 HydrophobicContact CG2-CG2 4.23Å; L169-I222 HydrophobicContact CD1-CD1 3.51Å; K212-I222 PolarHBondContact NZ-O 3.02Å; L215-I222 VanDerWaalsContact CD1-C 3.45Å; L215-I222 VanDerWaalsContact CD1-O 3.23Å; L215-I222 WeakPolarHBondContact CD1-O 3.26Å; N220-I222 PolarHBondContact O-N 2.85Å; I222-F239 HydrophobicContact CG1-CB 4.2Å; I222-F239 WeakPolarHBondContact CG1-O 3.47Å; I222-F239 PolarHBondContact N-O 2.97Å; I222-V241 HydrophobicContact CB-CG2 4.45Å; I222-V241 HydrophobicContact CD1-CG2 3.74Å; I222-V241 HydrophobicContact CG1-CG2 4.08Å; I222-V241 HydrophobicContact CG2-CG2 3.58Å; I222-L252 HydrophobicContact CG2-CB 4.24Å; I222-L252 HydrophobicContact CG2-CD1 4.13Å; I222-L252 HydrophobicContact CG2-CD2 4.15Å; I222-L252 HydrophobicContact CG2-CG 4.41Å
223	A	94.6	Very high	90.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	146.8	176.6	0	0	0	0	0	111.8	Y171 F209 F239	Y171-A223 HydrophobicContact CE2-CB 4.32Å; Y171-A223 WeakPolarHBondContact OH-CB 3.36Å; F209-A223 HydrophobicContact CE1-CB 3.82Å; F209-A223 HydrophobicContact CZ-CB 3.81Å; A223-F239 HydrophobicContact CB-CB 4.16Å; A223-F239 HydrophobicContact CB-CD2 4.14Å; A223-F239 HydrophobicContact CB-CG 4.44Å; A223-F239 PolarHBondContact N-O 3.21Å; A223-F239 PolarHBondContact O-N 3.33Å
224	R	93.9	Very high	91	Very high	45 Å²	45	46.1 Å²	46.1	17%	0.17	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	122.5	169.5	-175.4	-176.1	-62.8	162.6	-1.8	110.3	M210 G214 L215 E221 Y226 I236 L237 Q238	M210-R224 HydrophobicContact CB-CB 3.71Å; M210-R224 HydrophobicContact CB-CG 4.31Å; M210-R224 WeakPolarHBondContact CB-O 3.45Å; M210-R224 HydrophobicContact CG-CB 4.32Å; M210-R224 PolarHBondContact N-O 3.4Å; G214-R224 PolarHBondContact O-NH1 3.17Å; L215-R224 HydrophobicContact CD2-CB 3.46Å; L215-R224 VanDerWaalsContact CD2-CB 3.46Å; E221-R224 VanDerWaalsContact CD-NH2 3.33Å; E221-R224 WeakPolarHBondContact OE1-CB 3.42Å; E221-R224 IonicContact OE1-CZ 3.36Å; E221-R224 IonicContact OE1-NE 3.58Å; E221-R224 PolarHBondContact OE1-NE 2.93Å; E221-R224 IonicContact OE1-NH2 2.67Å; E221-R224 PolarHBondContact OE1-NH2 2.75Å; E221-R224 IonicContact OE2-CZ 2.79Å; E221-R224 IonicContact OE2-NE 3.61Å; E221-R224 IonicContact OE2-NH2 2.78Å; E221-R224 PolarHBondContact OE2-NH2 3.43Å; R224-Y226 WeakPolarHBondContact CD-OH 3.42Å; R224-Y226 HydrophobicContact CG-CE2 4.42Å; R224-I236 HydrophobicContact CG-CG2 3.7Å; R224-L237 CarbonylContact C-O 3.44Å; R224-L237 VanDerWaalsContact CA-O 3.27Å; R224-L237 WeakPolarHBondContact CA-O 2.93Å; R224-Q238 HydrophobicContact CG-CG 4.14Å
225	I	92.7	Very high	91.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	128	-176.4	-56.3	-174.8	0	0	0	109.5	Y171 I207 G208 F209 L237 F239	Y171-I225 HydrophobicContact CD1-CD1 3.91Å; Y171-I225 HydrophobicContact CE1-CD1 4.36Å; Y171-I225 HydrophobicContact CG-CD1 4.29Å; I207-I225 HydrophobicContact CD1-CG2 4.05Å; I207-I225 HydrophobicContact CG2-CG2 3.42Å; I207-I225 VanDerWaalsContact CG2-CG2 3.42Å; G208-I225 CarbonylContact O-C 3.56Å; G208-I225 WeakPolarHBondContact O-CA 3.09Å; F209-I225 HydrophobicContact CD2-CD1 4.24Å; F209-I225 HydrophobicContact CD2-CG1 3.85Å; F209-I225 HydrophobicContact CE2-CD1 3.53Å; F209-I225 HydrophobicContact CE2-CG1 3.49Å; F209-I225 VanDerWaalsContact CE2-CG1 3.49Å; F209-I225 HydrophobicContact CZ-CD1 4.22Å; F209-I225 HydrophobicContact CZ-CG1 4.09Å; I225-L237 HydrophobicContact CB-CB 4.17Å; I225-L237 HydrophobicContact CB-CD1 4.48Å; I225-L237 PolarHBondContact N-O 2.66Å; I225-L237 PolarHBondContact O-N 2.75Å; I225-F239 HydrophobicContact CB-CE2 4.31Å; I225-F239 HydrophobicContact CD1-CD2 4.42Å; I225-F239 HydrophobicContact CD1-CE2 3.57Å; I225-F239 HydrophobicContact CD1-CZ 4.05Å; I225-F239 HydrophobicContact CG1-CD2 4.37Å; I225-F239 HydrophobicContact CG1-CE2 3.78Å
226	Y	93	Very high	91.3	Very high	66 Å²	66	51 Å²	51	26%	0.259	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	105.4	171.1	-65.4	-80.7	0	0	0	109.4	I207 G208 M210 R224 V234 E235 I236	I207-Y226 CarbonylContact C-O 3.6Å; I207-Y226 WeakPolarHBondContact CA-O 3.44Å; G208-Y226 PolarHBondContact N-O 2.85Å; G208-Y226 PolarHBondContact O-N 3.35Å; M210-Y226 HydrophobicContact CB-CE2 4.04Å; M210-Y226 HydrophobicContact CE-CE2 3.71Å; M210-Y226 WeakPolarHBondContact CE-OH 3.47Å; R224-Y226 WeakPolarHBondContact CD-OH 3.42Å; R224-Y226 HydrophobicContact CG-CE2 4.42Å; Y226-V234 HydrophobicContact CD1-CG1 3.89Å; Y226-V234 HydrophobicContact CG-CG1 4.32Å; Y226-E235 CarbonylContact C-O 3.58Å; Y226-E235 WeakPolarHBondContact CA-O 3.36Å; Y226-I236 HydrophobicContact CD1-CG1 3.96Å; Y226-I236 HydrophobicContact CE1-CD1 3.99Å; Y226-I236 HydrophobicContact CE1-CG1 3.83Å; Y226-I236 HydrophobicContact CE1-CG2 4.27Å
227	K	91.8	Very high	91.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108.6	-179.1	170	171.5	171.8	-85.8	0	110.6	S200 E202 Q204 I207 V234 E235 L237	S200-K227 VanDerWaalsContact OG-CE 3.24Å; S200-K227 WeakPolarHBondContact OG-CE 3.32Å; S200-K227 PolarHBondContact OG-NZ 2.95Å; E202-K227 VanDerWaalsContact O-CE 3.31Å; E202-K227 WeakPolarHBondContact O-CE 3.26Å; E202-K227 PolarHBondContact O-NZ 2.99Å; Q204-K227 HydrophobicContact CB-CD 4Å; Q204-K227 HydrophobicContact CB-CG 3.77Å; I207-K227 HydrophobicContact CD1-CB 3.77Å; I207-K227 HydrophobicContact CD1-CG 3.99Å; K227-V234 CarbonylContact O-C 3.54Å; K227-V234 WeakPolarHBondContact O-CA 3.44Å; K227-E235 HydrophobicContact CB-CB 4.23Å; K227-E235 PolarHBondContact N-O 2.84Å; K227-E235 IonicContact NZ-OE1 2.75Å; K227-E235 IonicContact NZ-OE2 3.72Å; K227-E235 PolarHBondContact NZ-OE2 2.9Å; K227-E235 PolarHBondContact O-N 2.79Å; K227-L237 HydrophobicContact CB-CD1 4.27Å; K227-L237 HydrophobicContact CB-CG 4.44Å; K227-L237 HydrophobicContact CD-CD1 4.18Å
228	C	93	Very high	91.8	Very high	37 Å²	37	53 Å²	53	25%	0.25	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.2	173.8	-62.7	0	0	0	0	109.9	R205 G206 L233	R205-C228 WeakPolarHBondContact CB-O 3.48Å; R205-C228 PolarHBondContact N-O 3.42Å; G206-C228 PolarHBondContact O-N 3.3Å; C228-L233 CarbonylContact C-O 3.57Å; C228-L233 WeakPolarHBondContact CA-O 3.38Å
229	T	90.2	Very high	92.2	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.025	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	168.4	179.4	71.5	0	0	0	0	112	E202 K231 G232 L233 E235	E202-T229 HydrophobicContact CB-CG2 4.23Å; T229-K231 PolarHBondContact O-N 3.43Å; T229-K231 PolarHBondContact OG1-N 2.84Å; T229-G232 PolarHBondContact O-N 2.86Å; T229-L233 PolarHBondContact N-O 2.85Å; T229-L233 PolarHBondContact OG1-N 3.22Å; T229-L233 PolarHBondContact OG1-O 2.95Å; T229-E235 HydrophobicContact CG2-CG 4.07Å
230	N	88.1	Confident	92.4	Very high	98 Å²	98	49 Å²	49	52%	0.524	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.1	175.2	-74.1	-24.3	0	0	0	113.7	G232	N230-G232 PolarHBondContact O-N 2.79Å
231	K	88.7	Confident	92.4	Very high	144 Å²	144	50.3 Å²	50.3	63%	0.626	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	3.3	176	-67.7	175.2	174.9	167.5	0	113.2	E202 T229 L233	E202-K231 VanDerWaalsContact OE1-CE 3.31Å; E202-K231 WeakPolarHBondContact OE1-CE 3.45Å; E202-K231 IonicContact OE1-NZ 2.67Å; E202-K231 PolarHBondContact OE1-NZ 2.83Å; T229-K231 PolarHBondContact O-N 3.43Å; T229-K231 PolarHBondContact OG1-N 2.84Å; K231-L233 VanDerWaalsContact C-N 3.26Å; K231-L233 HydrophobicContact CB-CG 4.45Å; K231-L233 PolarHBondContact O-N 3.5Å
232	G	86.7	Confident	92.2	Very high	69 Å²	69	56 Å²	56	71%	0.711	30%	0.303	S	S	*	.	S	Bend	trans	74.2	17	-177.3	0	0	0	0	0	113.6	T229 N230	T229-G232 PolarHBondContact O-N 2.86Å; N230-G232 PolarHBondContact O-N 2.79Å
233	L	90.9	Very high	91.9	Very high	108 Å²	108	59.5 Å²	59.5	57%	0.565	32%	0.315	S	S	*	.			trans	-95.6	155.8	174.4	-61.4	174.8	0	0	0	110.4	C228 T229 K231	C228-L233 CarbonylContact C-O 3.57Å; C228-L233 WeakPolarHBondContact CA-O 3.38Å; T229-L233 PolarHBondContact N-O 2.85Å; T229-L233 PolarHBondContact OG1-N 3.22Å; T229-L233 PolarHBondContact OG1-O 2.95Å; K231-L233 VanDerWaalsContact C-N 3.26Å; K231-L233 HydrophobicContact CB-CG 4.45Å; K231-L233 PolarHBondContact O-N 3.5Å
234	V	93.1	Very high	91.2	Very high	82 Å²	82	69.9 Å²	69.9	50%	0.497	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	111.4	170.7	-176.1	0	0	0	0	108	Y226 K227	Y226-V234 HydrophobicContact CD1-CG1 3.89Å; Y226-V234 HydrophobicContact CG-CG1 4.32Å; K227-V234 CarbonylContact O-C 3.54Å; K227-V234 WeakPolarHBondContact O-CA 3.44Å
235	E	92.1	Very high	90.4	Very high	54 Å²	54	70 Å²	70	25%	0.252	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	138.2	171.8	-68.9	172.4	-176.2	0	0	109.3	Y226 K227 T229	Y226-E235 CarbonylContact C-O 3.58Å; Y226-E235 WeakPolarHBondContact CA-O 3.36Å; K227-E235 HydrophobicContact CB-CB 4.23Å; K227-E235 PolarHBondContact N-O 2.84Å; K227-E235 IonicContact NZ-OE1 2.75Å; K227-E235 IonicContact NZ-OE2 3.72Å; K227-E235 PolarHBondContact NZ-OE2 2.9Å; K227-E235 PolarHBondContact O-N 2.79Å; T229-E235 HydrophobicContact CG2-CG 4.07Å
236	I	94.4	Very high	89.7	Confident	91 Å²	91	77.8 Å²	77.8	47%	0.467	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.2	177.6	-52.9	178.1	0	0	0	107.8	R224 Y226 Q238	R224-I236 HydrophobicContact CG-CG2 3.7Å; Y226-I236 HydrophobicContact CD1-CG1 3.96Å; Y226-I236 HydrophobicContact CE1-CD1 3.99Å; Y226-I236 HydrophobicContact CE1-CG1 3.83Å; Y226-I236 HydrophobicContact CE1-CG2 4.27Å; I236-Q238 HydrophobicContact CG2-CG 4.08Å
237	L	94	Very high	89.3	Confident	11 Å²	11	81.2 Å²	81.2	6%	0.058	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.9	175.8	-45.2	-178.6	0	0	0	108.1	I180 Y198 R224 I225 K227 F239	I180-L237 HydrophobicContact CD1-CD1 3.69Å; Y198-L237 HydrophobicContact CD1-CD1 3.73Å; Y198-L237 HydrophobicContact CE1-CD1 3.5Å; Y198-L237 VanDerWaalsContact CE1-CD1 3.5Å; Y198-L237 HydrophobicContact CE1-CD2 3.73Å; Y198-L237 HydrophobicContact CE1-CG 4.25Å; Y198-L237 HydrophobicContact CE2-CD2 4.07Å; Y198-L237 HydrophobicContact CG-CD1 4.42Å; Y198-L237 VanDerWaalsContact CZ-CD2 3.41Å; Y198-L237 WeakPolarHBondContact OH-CD2 3.49Å; R224-L237 CarbonylContact C-O 3.44Å; R224-L237 VanDerWaalsContact CA-O 3.27Å; R224-L237 WeakPolarHBondContact CA-O 2.93Å; I225-L237 HydrophobicContact CB-CB 4.17Å; I225-L237 HydrophobicContact CB-CD1 4.48Å; I225-L237 PolarHBondContact N-O 2.66Å; I225-L237 PolarHBondContact O-N 2.75Å; K227-L237 HydrophobicContact CB-CD1 4.27Å; K227-L237 HydrophobicContact CB-CG 4.44Å; K227-L237 HydrophobicContact CD-CD1 4.18Å; L237-F239 HydrophobicContact CB-CE2 3.84Å; L237-F239 HydrophobicContact CB-CZ 4.37Å
238	Q	94.5	Very high	89.1	Confident	93 Å²	93	83.1 Å²	83.1	44%	0.435	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	131.6	-179.4	-61.4	175.5	71.4	0	0	108.1	E221 R224 I236 F240	E221-Q238 VanDerWaalsContact OE1-CG 3.29Å; E221-Q238 WeakPolarHBondContact OE1-CG 3.48Å; E221-Q238 PolarHBondContact OE1-OE1 3.16Å; R224-Q238 HydrophobicContact CG-CG 4.14Å; I236-Q238 HydrophobicContact CG2-CG 4.08Å; Q238-F240 HydrophobicContact CB-CD2 4.29Å; Q238-F240 HydrophobicContact CB-CE2 3.38Å; Q238-F240 HydrophobicContact CB-CZ 3.68Å; Q238-F240 HydrophobicContact CG-CZ 4.48Å
239	F	95.1	Very high	88.9	Confident	20 Å²	20	82.6 Å²	82.6	9%	0.088	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.1	-178.2	-62.9	-98.7	0	0	0	108.2	Y171 Y182 E221 I222 A223 I225 L237	Y171-F239 HydrophobicContact CD1-CZ 4.46Å; Y171-F239 HydrophobicContact CE1-CD1 4.05Å; Y171-F239 HydrophobicContact CE1-CD2 4.34Å; Y171-F239 HydrophobicContact CE1-CE1 4.01Å; Y171-F239 HydrophobicContact CE1-CE2 4.32Å; Y171-F239 HydrophobicContact CE1-CG 4.21Å; Y171-F239 HydrophobicContact CE1-CZ 4.16Å; Y182-F239 HydrophobicContact CD1-CE1 4.22Å; Y182-F239 HydrophobicContact CE1-CD1 4.39Å; Y182-F239 AromaticContact CE1-CE1 3.84Å; Y182-F239 HydrophobicContact CE1-CE1 3.84Å; E221-F239 CarbonylContact C-O 3.46Å; E221-F239 WeakPolarHBondContact CA-O 3.44Å; I222-F239 HydrophobicContact CG1-CB 4.2Å; I222-F239 WeakPolarHBondContact CG1-O 3.47Å; I222-F239 PolarHBondContact N-O 2.97Å; A223-F239 HydrophobicContact CB-CB 4.16Å; A223-F239 HydrophobicContact CB-CD2 4.14Å; A223-F239 HydrophobicContact CB-CG 4.44Å; A223-F239 PolarHBondContact N-O 3.21Å; A223-F239 PolarHBondContact O-N 3.33Å; I225-F239 HydrophobicContact CB-CE2 4.31Å; I225-F239 HydrophobicContact CD1-CD2 4.42Å; I225-F239 HydrophobicContact CD1-CE2 3.57Å; I225-F239 HydrophobicContact CD1-CZ 4.05Å; I225-F239 HydrophobicContact CG1-CD2 4.37Å; I225-F239 HydrophobicContact CG1-CE2 3.78Å; L237-F239 HydrophobicContact CB-CE2 3.84Å; L237-F239 HydrophobicContact CB-CZ 4.37Å
240	F	93.7	Very high	88.8	Confident	85 Å²	85	88 Å²	88	37%	0.373	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	145.5	-175.9	-58.6	-90.9	0	0	0	110.3	E219 N220 E221 Q238	E219-F240 HydrophobicContact CB-CD1 4.28Å; E219-F240 HydrophobicContact CB-CE1 4.08Å; E219-F240 WeakPolarHBondContact O-CD1 3.47Å; N220-F240 WeakPolarHBondContact O-CA 3.45Å; E221-F240 HydrophobicContact CB-CD1 3.71Å; E221-F240 HydrophobicContact CB-CE1 3.57Å; E221-F240 HydrophobicContact CB-CZ 4.43Å; E221-F240 HydrophobicContact CG-CD1 4.16Å; E221-F240 HydrophobicContact CG-CE1 3.85Å; E221-F240 HydrophobicContact CG-CZ 4.23Å; Q238-F240 HydrophobicContact CB-CD2 4.29Å; Q238-F240 HydrophobicContact CB-CE2 3.38Å; Q238-F240 HydrophobicContact CB-CZ 3.68Å; Q238-F240 HydrophobicContact CG-CZ 4.48Å
241	V	92.5	Very high	88.8	Confident	36 Å²	36	87.6 Å²	87.6	22%	0.218	45%	0.45	C	S	.	.			trans	-92.9	115.8	163.9	-177.4	0	0	0	0	107.5	N220 I222 R243 L252	N220-V241 HydrophobicContact CB-CB 4.45Å; N220-V241 VanDerWaalsContact CB-O 3.27Å; N220-V241 WeakPolarHBondContact CB-O 3.31Å; N220-V241 PolarHBondContact O-N 2.82Å; I222-V241 HydrophobicContact CB-CG2 4.45Å; I222-V241 HydrophobicContact CD1-CG2 3.74Å; I222-V241 HydrophobicContact CG1-CG2 4.08Å; I222-V241 HydrophobicContact CG2-CG2 3.58Å; V241-R243 VanDerWaalsContact C-N 3.35Å; V241-R243 HydrophobicContact CG1-CG 3.9Å; V241-R243 PolarHBondContact O-N 3.46Å; V241-L252 HydrophobicContact CB-CD1 3.87Å; V241-L252 HydrophobicContact CB-CD2 4.48Å; V241-L252 HydrophobicContact CG1-CD1 4.32Å; V241-L252 HydrophobicContact CG2-CD1 4.05Å; V241-L252 HydrophobicContact CG2-CD2 3.95Å
242	P	89.3	Confident	88.8	Confident	120 Å²	120	81.4 Å²	81.4	78%	0.779	42%	0.424	S	S	*	.			trans	-73.8	85.4	-173.3	30	-35.2	0	0	0	111.1
243	R	87.3	Confident	88.9	Confident	87 Å²	87	78.1 Å²	78.1	33%	0.328	39%	0.39	S	S	.	.			trans	-107.7	145.2	174.6	-58.4	-169.2	176.4	-176	3.6	110.7	V241 Q249 D251	V241-R243 VanDerWaalsContact C-N 3.35Å; V241-R243 HydrophobicContact CG1-CG 3.9Å; V241-R243 PolarHBondContact O-N 3.46Å; R243-Q249 VanDerWaalsContact CD-OE1 3.22Å; R243-D251 IonicContact CZ-OD1 2.74Å; R243-D251 IonicContact CZ-OD2 3.28Å; R243-D251 VanDerWaalsContact CZ-OD2 3.23Å; R243-D251 VanDerWaalsContact NH1-CG 3.26Å; R243-D251 IonicContact NH1-OD1 2.89Å; R243-D251 PolarHBondContact NH1-OD1 3.2Å; R243-D251 IonicContact NH1-OD2 3.81Å; R243-D251 PolarHBondContact NH1-OD2 3.16Å; R243-D251 IonicContact NH2-OD1 2.64Å; R243-D251 IonicContact NH2-OD2 3.04Å; R243-D251 PolarHBondContact NH2-OD2 3.37Å
244	K	79.9	Confident	88.8	Confident	217 Å²	217	75 Å²	75	94%	0.943	38%	0.376	S	S	*	.			trans	-87.4	-13.5	-179.8	-66.4	-176.4	179.7	178.7	0	113.7
245	S	77.2	Confident	88.2	Confident	49 Å²	49	75 Å²	75	34%	0.343	37%	0.373	S	S	.	.			trans	-85.5	132.5	-175	53.5	0	0	0	0	111.5	M247 Q249	S245-M247 PolarHBondContact O-N 2.91Å; S245-Q249 PolarHBondContact OG-NE2 2.97Å
246	E	77.8	Confident	87.6	Confident	163 Å²	163	72.5 Å²	72.5	76%	0.762	36%	0.362	S	S	*	.			trans	-80.4	-0.1	171.4	-59.9	177.4	177	0	0	112.8
247	M	85	Confident	86.5	Confident	137 Å²	137	68.7 Å²	68.7	68%	0.675	34%	0.343	S	S	*	.	S	Bend	trans	-74.1	148.7	176.6	-64.3	-63.7	-76.8	0	0	110.2	S245 Q249	S245-M247 PolarHBondContact O-N 2.91Å; M247-Q249 PolarHBondContact O-N 3.31Å; M247-Q249 PolarHBondContact O-NE2 3.29Å
248	F	87.1	Confident	85.5	Confident	40 Å²	40	68.8 Å²	68.8	18%	0.175	35%	0.347	C	S	.	.			trans	-60.1	130.7	172.2	179.7	-98.8	0	0	0	111.1	V217 E250 Y253 L281 L284 K285 V288	V217-F248 HydrophobicContact CG1-CD2 3.55Å; V217-F248 HydrophobicContact CG1-CE2 3.5Å; V217-F248 VanDerWaalsContact CG1-CE2 3.5Å; F248-E250 HydrophobicContact CD1-CG 3.71Å; F248-E250 HydrophobicContact CE1-CB 4.32Å; F248-E250 HydrophobicContact CE1-CG 3.79Å; F248-Y253 HydrophobicContact CE2-CD2 4.3Å; F248-Y253 HydrophobicContact CE2-CG 4.37Å; F248-Y253 HydrophobicContact CZ-CG 4.44Å; F248-L281 HydrophobicContact CE1-CD1 3.69Å; F248-L281 HydrophobicContact CZ-CD1 3.56Å; F248-L284 HydrophobicContact CE2-CB 4.48Å; F248-K285 HydrophobicContact CD1-CG 4.03Å; F248-K285 HydrophobicContact CE1-CD 4.45Å; F248-K285 HydrophobicContact CE1-CG 3.84Å; F248-K285 HydrophobicContact CZ-CG 4.17Å; F248-V288 HydrophobicContact CB-CG1 4.29Å; F248-V288 HydrophobicContact CD2-CG2 4Å
249	Q	88.4	Confident	84.4	Confident	26 Å²	26	69.1 Å²	69.1	12%	0.121	36%	0.356	C	S	.	.			trans	-96.8	94.9	-178	-55.9	-59.7	-67.6	0	0	110.5	N220 R243 S245 M247 D251 L252 Y253	N220-Q249 WeakPolarHBondContact OD1-CG 3.15Å; R243-Q249 VanDerWaalsContact CD-OE1 3.22Å; S245-Q249 PolarHBondContact OG-NE2 2.97Å; M247-Q249 PolarHBondContact O-N 3.31Å; M247-Q249 PolarHBondContact O-NE2 3.29Å; Q249-D251 PolarHBondContact O-N 2.8Å; Q249-L252 HydrophobicContact CB-CB 4.09Å; Q249-L252 HydrophobicContact CB-CD1 3.97Å; Q249-L252 HydrophobicContact CB-CG 3.95Å; Q249-L252 HydrophobicContact CG-CD1 4.2Å; Q249-L252 PolarHBondContact O-N 3.3Å; Q249-Y253 PolarHBondContact O-N 2.75Å; Q249-Y253 VanDerWaalsContact O-N 3.11Å
250	E	87.8	Confident	83.4	Confident	118 Å²	118	73.4 Å²	73.4	55%	0.551	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.8	-177.1	-60.7	-167.3	156.6	0	0	113.8	F248 Y253 P254 K285	F248-E250 HydrophobicContact CD1-CG 3.71Å; F248-E250 HydrophobicContact CE1-CB 4.32Å; F248-E250 HydrophobicContact CE1-CG 3.79Å; E250-Y253 CarbonylContact O-C 3.48Å; E250-Y253 VanDerWaalsContact O-C 3.27Å; E250-P254 WeakPolarHBondContact O-CA 3.41Å; E250-P254 VanDerWaalsContact O-N 3.12Å; E250-K285 WeakPolarHBondContact OE1-CE 3.33Å; E250-K285 IonicContact OE1-NZ 2.65Å; E250-K285 PolarHBondContact OE1-NZ 2.77Å
251	D	89	Confident	82.5	Confident	90 Å²	90	71.2 Å²	71.2	48%	0.481	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-29.8	177.4	65	-51	0	0	0	112.9	R243 Q249	R243-D251 IonicContact CZ-OD1 2.74Å; R243-D251 IonicContact CZ-OD2 3.28Å; R243-D251 VanDerWaalsContact CZ-OD2 3.23Å; R243-D251 VanDerWaalsContact NH1-CG 3.26Å; R243-D251 IonicContact NH1-OD1 2.89Å; R243-D251 PolarHBondContact NH1-OD1 3.2Å; R243-D251 IonicContact NH1-OD2 3.81Å; R243-D251 PolarHBondContact NH1-OD2 3.16Å; R243-D251 IonicContact NH2-OD1 2.64Å; R243-D251 IonicContact NH2-OD2 3.04Å; R243-D251 PolarHBondContact NH2-OD2 3.37Å; Q249-D251 PolarHBondContact O-N 2.8Å
252	L	89.7	Confident	81.8	Confident	14 Å²	14	70.9 Å²	70.9	7%	0.073	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-26.9	174.9	-59.9	-174.4	0	0	0	112.6	N220 I222 V241 Q249 P254	N220-L252 HydrophobicContact CB-CD1 3.96Å; I222-L252 HydrophobicContact CG2-CB 4.24Å; I222-L252 HydrophobicContact CG2-CD1 4.13Å; I222-L252 HydrophobicContact CG2-CD2 4.15Å; I222-L252 HydrophobicContact CG2-CG 4.41Å; V241-L252 HydrophobicContact CB-CD1 3.87Å; V241-L252 HydrophobicContact CB-CD2 4.48Å; V241-L252 HydrophobicContact CG1-CD1 4.32Å; V241-L252 HydrophobicContact CG2-CD1 4.05Å; V241-L252 HydrophobicContact CG2-CD2 3.95Å; Q249-L252 HydrophobicContact CB-CB 4.09Å; Q249-L252 HydrophobicContact CB-CD1 3.97Å; Q249-L252 HydrophobicContact CB-CG 3.95Å; Q249-L252 HydrophobicContact CG-CD1 4.2Å; Q249-L252 PolarHBondContact O-N 3.3Å; L252-P254 VanDerWaalsContact C-CD 3.47Å
253	Y	88.7	Confident	81.3	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-130.5	71.4	178.2	-55.9	-82.7	0	0	0	109.1	K212 V217 E221 F248 Q249 E250 L281	K212-Y253 HydrophobicContact CD-CD1 4.28Å; K212-Y253 HydrophobicContact CD-CE1 4.24Å; V217-Y253 WeakPolarHBondContact CA-OH 3.46Å; V217-Y253 HydrophobicContact CB-CE2 4.21Å; V217-Y253 HydrophobicContact CG1-CD2 3.88Å; V217-Y253 HydrophobicContact CG1-CE2 3.78Å; V217-Y253 HydrophobicContact CG1-CG 4.39Å; V217-Y253 HydrophobicContact CG2-CD1 4.28Å; V217-Y253 HydrophobicContact CG2-CE1 3.94Å; V217-Y253 HydrophobicContact CG2-CE2 4.33Å; E221-Y253 PolarHBondContact N-OH 2.96Å; E221-Y253 PolarHBondContact O-OH 3.18Å; F248-Y253 HydrophobicContact CE2-CD2 4.3Å; F248-Y253 HydrophobicContact CE2-CG 4.37Å; F248-Y253 HydrophobicContact CZ-CG 4.44Å; Q249-Y253 PolarHBondContact O-N 2.75Å; Q249-Y253 VanDerWaalsContact O-N 3.11Å; E250-Y253 CarbonylContact O-C 3.48Å; E250-Y253 VanDerWaalsContact O-C 3.27Å; Y253-L281 WeakPolarHBondContact O-CD1 3.47Å
254	P	87.1	Confident	81.1	Confident	41 Å²	41	63 Å²	63	27%	0.266	34%	0.339	S	S	.	.			trans	-62.8	178	167.7	31	-36.5	0	0	0	109.9	D166 E250 L252 T256	D166-P254 HydrophobicContact CB-CG 3.86Å; E250-P254 WeakPolarHBondContact O-CA 3.41Å; E250-P254 VanDerWaalsContact O-N 3.12Å; L252-P254 VanDerWaalsContact C-CD 3.47Å; P254-T256 PolarHBondContact O-N 2.64Å
255	D	80.8	Confident	81	Confident	83 Å²	83	52.8 Å²	52.8	44%	0.444	30%	0.295	S	S	.	.	S	Bend	trans	-52	108	167.3	-84.3	-37.8	0	0	0	111.3	A278 L281	D255-A278 HydrophobicContact CB-CB 3.4Å; D255-A278 VanDerWaalsContact CB-CB 3.4Å; D255-L281 WeakPolarHBondContact OD1-CB 3.43Å; D255-L281 WeakPolarHBondContact OD1-CD2 3.27Å
256	T	79.4	Confident	81.3	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	31%	0.309	C	S	.	.			trans	-118	168.7	-173.6	-165.2	0	0	0	0	112.5	D166 K212 P254 G258 L280	D166-T256 VanDerWaalsContact CG-OG1 3.24Å; D166-T256 PolarHBondContact OD1-OG1 3.12Å; D166-T256 WeakPolarHBondContact OD2-CB 3.4Å; D166-T256 PolarHBondContact OD2-OG1 3.47Å; K212-T256 HydrophobicContact CB-CG2 4.34Å; P254-T256 PolarHBondContact O-N 2.64Å; T256-G258 PolarHBondContact O-N 3.27Å; T256-L280 HydrophobicContact CG2-CB 3.99Å; T256-L280 HydrophobicContact CG2-CD1 4.11Å
257	A	73	Confident	81.7	Confident	10 Å²	10	53.2 Å²	53.2	8%	0.083	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-68.1	121.9	-171.7	0	0	0	0	0	114.6	R33 L276 L280	R33-A257 HydrophobicContact CB-CB 4.48Å; R33-A257 VanDerWaalsContact CD-CB 3.4Å; R33-A257 HydrophobicContact CG-CB 3.76Å; A257-L276 HydrophobicContact CB-CD2 3.13Å; A257-L280 WeakPolarHBondContact O-CD1 3.45Å
258	G	71.5	Confident	81.7	Confident	14 Å²	14	46.8 Å²	46.8	14%	0.144	26%	0.26	C	S	.	.			trans	-71.2	-175.1	174.7	0	0	0	0	0	115.6	T256	T256-G258 PolarHBondContact O-N 3.27Å
259	T	72.2	Confident	81.6	Confident	100 Å²	100	48.2 Å²	48.2	61%	0.613	27%	0.269	S	S	*	.	S	Bend	trans	-96.1	-6.5	169.3	34.8	0	0	0	0	113	R213	R213-T259 PolarHBondContact NH1-OG1 2.9Å; R213-T259 PolarHBondContact NH2-OG1 3.36Å
260	V	74.9	Confident	81.6	Confident	109 Å²	109	53.5 Å²	53.5	66%	0.661	30%	0.298	S	S	*	.	S	Bend	trans	-92.2	124	174.5	-177.2	0	0	0	0	106.4
261	P	74.2	Confident	81.4	Confident	39 Å²	39	49.9 Å²	49.9	25%	0.253	29%	0.293	S	S	.	.			trans	-62.4	143.5	176.5	26	-32.6	0	0	0	109.8	D36 I263	D36-P261 VanDerWaalsContact OD1-CG 3.28Å; D36-P261 WeakPolarHBondContact OD1-CG 3.39Å; P261-I263 VanDerWaalsContact C-N 3.27Å; P261-I263 PolarHBondContact O-N 3.16Å
262	A	76.6	Confident	81.2	Confident	29 Å²	29	50.4 Å²	50.4	24%	0.24	29%	0.29	C	S	.	.	S	Bend	trans	-70.7	-27.2	-179.1	0	0	0	0	0	112.5	V274	A262-V274 HydrophobicContact CB-CB 4.45Å; A262-V274 HydrophobicContact CB-CG1 4.08Å
263	I	80.2	Confident	80.8	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.041	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-151.4	150.1	-175.7	-172	166.3	0	0	0	110.8	L34 L35 D36 P261 E267 W268 K272 V274	L34-I263 VanDerWaalsContact O-CG2 3.26Å; L34-I263 WeakPolarHBondContact O-CG2 3.37Å; L34-I263 PolarHBondContact O-N 3.1Å; L35-I263 HydrophobicContact CD2-CG2 4.1Å; D36-I263 PolarHBondContact N-O 3.35Å; P261-I263 VanDerWaalsContact C-N 3.27Å; P261-I263 PolarHBondContact O-N 3.16Å; I263-E267 HydrophobicContact CD1-CB 3.61Å; I263-E267 HydrophobicContact CG1-CB 3.47Å; I263-E267 VanDerWaalsContact CG1-CB 3.47Å; I263-E267 HydrophobicContact CG1-CG 4.45Å; I263-E267 WeakPolarHBondContact CG1-OE2 3.41Å; I263-W268 HydrophobicContact CD1-CB 4.38Å; I263-W268 HydrophobicContact CG2-CB 4.25Å; I263-K272 HydrophobicContact CD1-CB 3.62Å; I263-K272 HydrophobicContact CD1-CD 3.55Å; I263-K272 HydrophobicContact CD1-CG 3.47Å; I263-K272 VanDerWaalsContact CD1-CG 3.47Å; I263-K272 WeakPolarHBondContact CD1-O 3.08Å; I263-V274 HydrophobicContact CB-CG2 4.37Å; I263-V274 HydrophobicContact CD1-CG2 4.03Å
264	S	82.1	Confident	80	Confident	33 Å²	33	55 Å²	55	23%	0.231	32%	0.317	C	S	.	.			trans	-72.7	156.7	173.4	73.9	0	0	0	0	111.4	E266 E267 W268	S264-E266 PolarHBondContact O-N 2.97Å; S264-E267 PolarHBondContact O-N 3.07Å; S264-E267 WeakPolarHBondContact OG-CG 2.97Å; S264-E267 PolarHBondContact OG-N 2.96Å; S264-W268 PolarHBondContact O-N 2.8Å; S264-W268 VanDerWaalsContact O-N 3.07Å
265	A	78.6	Confident	79.1	Confident	3 Å²	3	58.6 Å²	58.6	3%	0.025	33%	0.334	C	S	.	.	H	α-helix	trans	-58.4	-36.5	176.7	0	0	0	0	0	112.3	L58 L269	L58-A265 HydrophobicContact CD1-CB 4.47Å; A265-L269 VanDerWaalsContact O-CB 3.31Å; A265-L269 WeakPolarHBondContact O-CB 3.29Å; A265-L269 PolarHBondContact O-N 3.1Å
266	E	83	Confident	78.2	Confident	136 Å²	136	55.5 Å²	55.5	64%	0.636	32%	0.317	S	S	*	.	H	α-helix	trans	-68.2	-46.7	178.5	-65.5	177	-173.2	0	0	112.4	S264 W268 L269 N270	S264-E266 PolarHBondContact O-N 2.97Å; E266-W268 VanDerWaalsContact C-N 3.29Å; E266-W268 PolarHBondContact O-N 3.42Å; E266-L269 PolarHBondContact O-N 3.37Å; E266-N270 WeakPolarHBondContact O-CB 3.22Å; E266-N270 PolarHBondContact O-N 3.45Å; E266-N270 PolarHBondContact O-ND2 2.96Å
267	E	85.9	Confident	76.8	Confident	85 Å²	85	58.3 Å²	58.3	40%	0.397	34%	0.34	S	S	.	.	H	α-helix	trans	-63.6	-39.1	178.8	-72.5	-174.6	177.3	0	0	111.1	I263 S264 N270 K272	I263-E267 HydrophobicContact CD1-CB 3.61Å; I263-E267 HydrophobicContact CG1-CB 3.47Å; I263-E267 VanDerWaalsContact CG1-CB 3.47Å; I263-E267 HydrophobicContact CG1-CG 4.45Å; I263-E267 WeakPolarHBondContact CG1-OE2 3.41Å; S264-E267 PolarHBondContact O-N 3.07Å; S264-E267 WeakPolarHBondContact OG-CG 2.97Å; S264-E267 PolarHBondContact OG-N 2.96Å; E267-N270 PolarHBondContact O-N 2.93Å; E267-K272 HydrophobicContact CB-CD 4.44Å; E267-K272 WeakPolarHBondContact O-CB 3.38Å; E267-K272 PolarHBondContact O-N 2.94Å; E267-K272 IonicContact OE2-NZ 3.99Å; E267-K272 PolarHBondContact OE2-NZ 2.83Å
268	W	85.3	Confident	75.7	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-66.8	-40.8	173.9	175.4	92.5	0	0	0	112.6	L35 L49 I59 F73 G77 P94 R95 I263 S264 E266 N270 G271	L35-W268 HydrophobicContact CD1-CD2 3.71Å; L35-W268 HydrophobicContact CD1-CE3 4.06Å; L35-W268 HydrophobicContact CD1-CG 4.08Å; L35-W268 HydrophobicContact CD1-CH2 4.41Å; L35-W268 HydrophobicContact CD1-CZ2 4.06Å; L35-W268 HydrophobicContact CD1-CZ3 4.41Å; L35-W268 HydrophobicContact CD2-CB 3.07Å; L35-W268 HydrophobicContact CD2-CD2 3.56Å; L35-W268 HydrophobicContact CD2-CE3 4.14Å; L35-W268 HydrophobicContact CD2-CG 3.07Å; L35-W268 HydrophobicContact CG-CB 4.47Å; L35-W268 HydrophobicContact CG-CD2 4.26Å; L35-W268 HydrophobicContact CG-CG 4.11Å; L49-W268 HydrophobicContact CD2-CH2 3.78Å; L49-W268 HydrophobicContact CD2-CZ3 4.37Å; I59-W268 HydrophobicContact CD1-CH2 4.29Å; I59-W268 HydrophobicContact CD1-CZ3 4.01Å; F73-W268 HydrophobicContact CE1-CZ2 4.46Å; G77-W268 PolarHBondContact O-NE1 2.94Å; P94-W268 HydrophobicContact CB-CH2 4Å; P94-W268 HydrophobicContact CB-CZ2 4.03Å; P94-W268 HydrophobicContact CG-CH2 4.05Å; P94-W268 HydrophobicContact CG-CZ2 3.6Å; R95-W268 HydrophobicContact CG-CH2 3.85Å; R95-W268 HydrophobicContact CG-CZ2 4.01Å; R95-W268 HydrophobicContact CG-CZ3 4.15Å; R95-W268 VanDerWaalsContact CZ-O 3.28Å; R95-W268 PolarHBondContact NE-O 3.44Å; R95-W268 PolarHBondContact NH2-O 2.81Å; I263-W268 HydrophobicContact CD1-CB 4.38Å; I263-W268 HydrophobicContact CG2-CB 4.25Å; S264-W268 PolarHBondContact O-N 2.8Å; S264-W268 VanDerWaalsContact O-N 3.07Å; E266-W268 VanDerWaalsContact C-N 3.29Å; E266-W268 PolarHBondContact O-N 3.42Å; W268-N270 PolarHBondContact O-N 2.94Å; W268-G271 PolarHBondContact O-N 2.89Å
269	L	84.4	Confident	74.8	Confident	71 Å²	71	62.2 Å²	62.2	37%	0.372	37%	0.368	S	S	.	.	H	α-helix	trans	-60.5	-33.9	176.2	-173.2	65.3	0	0	0	110.9	I59 A265 E266 G271	I59-L269 HydrophobicContact CD1-CD1 3.65Å; I59-L269 HydrophobicContact CG1-CD1 4.1Å; A265-L269 VanDerWaalsContact O-CB 3.31Å; A265-L269 WeakPolarHBondContact O-CB 3.29Å; A265-L269 PolarHBondContact O-N 3.1Å; E266-L269 PolarHBondContact O-N 3.37Å; L269-G271 PolarHBondContact O-N 3Å
270	N	88.4	Confident	73.8	Confident	137 Å²	137	57.6 Å²	57.6	73%	0.733	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	8.9	173.5	-69.6	-45.5	0	0	0	114.3	E266 E267 W268	E266-N270 WeakPolarHBondContact O-CB 3.22Å; E266-N270 PolarHBondContact O-N 3.45Å; E266-N270 PolarHBondContact O-ND2 2.96Å; E267-N270 PolarHBondContact O-N 2.93Å; W268-N270 PolarHBondContact O-N 2.94Å
271	G	84.8	Confident	72.7	Confident	42 Å²	42	53.1 Å²	53.1	43%	0.433	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.9	7.9	170.2	0	0	0	0	0	115.3	W268 L269	W268-G271 PolarHBondContact O-N 2.89Å; L269-G271 PolarHBondContact O-N 3Å
272	K	83.7	Confident	71.7	Confident	100 Å²	100	55.2 Å²	55.2	44%	0.435	32%	0.324	S	S	.	.			trans	-80.7	126.3	175.8	-177.8	179.9	163	-163.1	0	109.8	R95 I263 E267 V274	R95-K272 PolarHBondContact NH2-O 2.76Å; I263-K272 HydrophobicContact CD1-CB 3.62Å; I263-K272 HydrophobicContact CD1-CD 3.55Å; I263-K272 HydrophobicContact CD1-CG 3.47Å; I263-K272 VanDerWaalsContact CD1-CG 3.47Å; I263-K272 WeakPolarHBondContact CD1-O 3.08Å; E267-K272 HydrophobicContact CB-CD 4.44Å; E267-K272 WeakPolarHBondContact O-CB 3.38Å; E267-K272 PolarHBondContact O-N 2.94Å; E267-K272 IonicContact OE2-NZ 3.99Å; E267-K272 PolarHBondContact OE2-NZ 2.83Å; K272-V274 HydrophobicContact CD-CG2 4.5Å; K272-V274 HydrophobicContact CG-CG2 4.18Å
273	D	81.3	Confident	70.9	Confident	72 Å²	72	59.4 Å²	59.4	39%	0.385	34%	0.339	S	S	.	.			trans	-108.7	133.9	172.5	-67.5	-43.8	0	0	0	108.8	R95	R95-D273 IonicContact CZ-OD1 3.22Å; R95-D273 VanDerWaalsContact CZ-OD1 3.25Å; R95-D273 IonicContact NH1-OD1 2.71Å; R95-D273 PolarHBondContact NH1-OD1 3.24Å; R95-D273 IonicContact NH1-OD2 3Å; R95-D273 PolarHBondContact NH1-OD2 3.29Å; R95-D273 IonicContact NH2-OD1 3.15Å; R95-D273 PolarHBondContact NH2-OD1 3.1Å; R95-D273 IonicContact NH2-OD2 2.96Å
274	V	73.4	Confident	69.8	Low	39 Å²	39	59.9 Å²	59.9	24%	0.236	34%	0.341	C	S	.	.			trans	-130.5	122.1	178	178.3	0	0	0	0	107.4	A262 I263 K272 L276	A262-V274 HydrophobicContact CB-CB 4.45Å; A262-V274 HydrophobicContact CB-CG1 4.08Å; I263-V274 HydrophobicContact CB-CG2 4.37Å; I263-V274 HydrophobicContact CD1-CG2 4.03Å; K272-V274 HydrophobicContact CD-CG2 4.5Å; K272-V274 HydrophobicContact CG-CG2 4.18Å; V274-L276 PolarHBondContact O-N 2.76Å
275	D	68.6	Low	68.8	Low	117 Å²	117	60.7 Å²	60.7	63%	0.626	34%	0.34	S	S	*	.			trans	-63.8	133.7	168.9	-66.5	-23.8	0	0	0	108.1	N76 A277	N76-D275 PolarHBondContact ND2-OD1 2.77Å; D275-A277 PolarHBondContact O-N 3.37Å
276	L	60.3	Low	67.9	Low	18 Å²	18	64.8 Å²	64.8	9%	0.094	36%	0.359	C	S	.	.			trans	-48.7	119.4	-170.8	-135	81.1	0	0	0	110.9	R33 L34 Y75 A257 V274 A278	R33-L276 HydrophobicContact CB-CD1 4.05Å; R33-L276 HydrophobicContact CB-CD2 3.88Å; R33-L276 HydrophobicContact CG-CD2 4.33Å; R33-L276 WeakPolarHBondContact O-CD1 3.4Å; L34-L276 HydrophobicContact CB-CD1 4.3Å; L34-L276 HydrophobicContact CD2-CD1 3.17Å; L34-L276 HydrophobicContact CG-CD1 3.43Å; L34-L276 VanDerWaalsContact CG-CD1 3.43Å; Y75-L276 HydrophobicContact CD1-CB 4.4Å; Y75-L276 HydrophobicContact CE1-CB 3.53Å; A257-L276 HydrophobicContact CB-CD2 3.13Å; V274-L276 PolarHBondContact O-N 2.76Å; L276-A278 PolarHBondContact O-N 3.03Å
277	A	51.2	Low	66.7	Low	60 Å²	60	61 Å²	61	50%	0.496	35%	0.351	S	S	.	.			trans	-65.2	100.3	179.3	0	0	0	0	0	108.9	D275 S279	D275-A277 PolarHBondContact O-N 3.37Å; A277-S279 PolarHBondContact O-N 3.16Å; A277-S279 PolarHBondContact O-OG 3.04Å
278	A	50.1	Low	65.4	Low	52 Å²	52	57.3 Å²	57.3	43%	0.43	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-34.9	73.1	157.3	0	0	0	0	0	113.1	D255 L276	D255-A278 HydrophobicContact CB-CB 3.4Å; D255-A278 VanDerWaalsContact CB-CB 3.4Å; L276-A278 PolarHBondContact O-N 3.03Å
279	S	51.1	Low	64	Low	54 Å²	54	65.4 Å²	65.4	38%	0.378	37%	0.365	S	S	.	.			trans	-111.5	-21.6	-174.2	62.5	0	0	0	0	113.4	A277 L281	A277-S279 PolarHBondContact O-N 3.16Å; A277-S279 PolarHBondContact O-OG 3.04Å; S279-L281 PolarHBondContact O-N 3.34Å
280	L	52	Low	62.5	Low	4 Å²	4	69.6 Å²	69.6	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-75.1	-25.4	-175.2	-101.7	170	0	0	0	114.8	R213 T256 A257 T282 E283 L284	R213-L280 HydrophobicContact CG-CD2 4.41Å; T256-L280 HydrophobicContact CG2-CB 3.99Å; T256-L280 HydrophobicContact CG2-CD1 4.11Å; A257-L280 WeakPolarHBondContact O-CD1 3.45Å; L280-T282 PolarHBondContact O-N 3.05Å; L280-E283 HydrophobicContact CD2-CB 4.3Å; L280-E283 VanDerWaalsContact CD2-OE2 3.32Å; L280-E283 WeakPolarHBondContact CD2-OE2 3.3Å; L280-E283 PolarHBondContact O-N 2.81Å; L280-L284 PolarHBondContact O-N 2.79Å
281	L	50.8	Low	60.9	Low	15 Å²	15	65 Å²	65	8%	0.079	36%	0.356	C	S	.	.	H	α-helix	trans	-60.5	-33.3	-176.2	-167.9	62.7	0	0	0	111.5	F248 Y253 D255 S279 E283 K285	F248-L281 HydrophobicContact CE1-CD1 3.69Å; F248-L281 HydrophobicContact CZ-CD1 3.56Å; Y253-L281 WeakPolarHBondContact O-CD1 3.47Å; D255-L281 WeakPolarHBondContact OD1-CB 3.43Å; D255-L281 WeakPolarHBondContact OD1-CD2 3.27Å; S279-L281 PolarHBondContact O-N 3.34Å; L281-E283 VanDerWaalsContact C-N 3.31Å; L281-E283 PolarHBondContact O-N 3.05Å; L281-K285 HydrophobicContact CD1-CD 4.2Å; L281-K285 HydrophobicContact CD1-CG 4.07Å; L281-K285 HydrophobicContact CD2-CD 4.25Å; L281-K285 VanDerWaalsContact CD2-CE 3.44Å; L281-K285 VanDerWaalsContact CD2-NZ 3.32Å; L281-K285 HydrophobicContact CG-CD 3.77Å; L281-K285 HydrophobicContact CG-CG 4.06Å; L281-K285 WeakPolarHBondContact O-CB 3.5Å; L281-K285 WeakPolarHBondContact O-CG 3.41Å; L281-K285 PolarHBondContact O-N 3.4Å
282	T	54.4	Low	59.6	Low	83 Å²	83	65.5 Å²	65.5	51%	0.509	35%	0.349	S	S	.	.	H	α-helix	trans	-63.7	-38.7	176.5	-53.6	0	0	0	0	111.3	L280 Q286	L280-T282 PolarHBondContact O-N 3.05Å; T282-Q286 WeakPolarHBondContact O-CB 3.38Å; T282-Q286 WeakPolarHBondContact O-CG 3.33Å; T282-Q286 PolarHBondContact O-N 3.29Å
283	E	59.2	Low	58.3	Low	117 Å²	117	65.7 Å²	65.7	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-74.8	-45.6	179	-61.8	-176.8	168.7	0	0	112	L280 L281 Q286 A287	L280-E283 HydrophobicContact CD2-CB 4.3Å; L280-E283 VanDerWaalsContact CD2-OE2 3.32Å; L280-E283 WeakPolarHBondContact CD2-OE2 3.3Å; L280-E283 PolarHBondContact O-N 2.81Å; L281-E283 VanDerWaalsContact C-N 3.31Å; L281-E283 PolarHBondContact O-N 3.05Å; E283-Q286 PolarHBondContact O-N 2.83Å; E283-A287 PolarHBondContact O-N 2.88Å
284	L	57.8	Low	57	Low	18 Å²	18	68.3 Å²	68.3	9%	0.094	37%	0.367	C	S	.	.	H	α-helix	trans	-66.2	-45.2	-179.7	-68.8	173.7	0	0	0	111.5	V217 F248 L280 Q286 A287 V288	V217-L284 HydrophobicContact CG2-CD2 4.28Å; F248-L284 HydrophobicContact CE2-CB 4.48Å; L280-L284 PolarHBondContact O-N 2.79Å; L284-Q286 VanDerWaalsContact C-N 3.28Å; L284-Q286 PolarHBondContact O-N 3.01Å; L284-A287 PolarHBondContact O-N 2.8Å; L284-A287 VanDerWaalsContact O-N 3.17Å; L284-V288 PolarHBondContact O-N 2.64Å; L284-V288 VanDerWaalsContact O-N 3.15Å
285	K	61.1	Low	56.2	Low	50 Å²	50	70.7 Å²	70.7	22%	0.217	39%	0.391	C	S	.	.	H	α-helix	trans	-60	-38.5	174.8	-74.1	-177.9	177	178.6	0	111.8	F248 E250 L281 R289	F248-K285 HydrophobicContact CD1-CG 4.03Å; F248-K285 HydrophobicContact CE1-CD 4.45Å; F248-K285 HydrophobicContact CE1-CG 3.84Å; F248-K285 HydrophobicContact CZ-CG 4.17Å; E250-K285 WeakPolarHBondContact OE1-CE 3.33Å; E250-K285 IonicContact OE1-NZ 2.65Å; E250-K285 PolarHBondContact OE1-NZ 2.77Å; L281-K285 HydrophobicContact CD1-CD 4.2Å; L281-K285 HydrophobicContact CD1-CG 4.07Å; L281-K285 HydrophobicContact CD2-CD 4.25Å; L281-K285 VanDerWaalsContact CD2-CE 3.44Å; L281-K285 VanDerWaalsContact CD2-NZ 3.32Å; L281-K285 HydrophobicContact CG-CD 3.77Å; L281-K285 HydrophobicContact CG-CG 4.06Å; L281-K285 WeakPolarHBondContact O-CB 3.5Å; L281-K285 WeakPolarHBondContact O-CG 3.41Å; L281-K285 PolarHBondContact O-N 3.4Å; K285-R289 WeakPolarHBondContact O-CB 3.18Å; K285-R289 VanDerWaalsContact O-CG 3.3Å; K285-R289 WeakPolarHBondContact O-CG 3.3Å; K285-R289 PolarHBondContact O-N 3.17Å; K285-R289 VanDerWaalsContact O-N 3.09Å
286	Q	59.4	Low	55.6	Low	88 Å²	88	72.7 Å²	72.7	41%	0.411	40%	0.396	S	S	.	.	H	α-helix	trans	-67.6	-37.2	177.3	-78.4	176.4	26.4	0	0	112.2	T282 E283 L284 R290	T282-Q286 WeakPolarHBondContact O-CB 3.38Å; T282-Q286 WeakPolarHBondContact O-CG 3.33Å; T282-Q286 PolarHBondContact O-N 3.29Å; E283-Q286 PolarHBondContact O-N 2.83Å; L284-Q286 VanDerWaalsContact C-N 3.28Å; L284-Q286 PolarHBondContact O-N 3.01Å; Q286-R290 WeakPolarHBondContact O-CB 3.19Å; Q286-R290 VanDerWaalsContact O-CG 3.25Å; Q286-R290 WeakPolarHBondContact O-CG 3.49Å; Q286-R290 PolarHBondContact O-N 3.17Å
287	A	57.2	Low	55	Low	56 Å²	56	75.8 Å²	75.8	46%	0.463	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-49.8	177.6	0	0	0	0	0	111.8	E283 L284 R290 A291	E283-A287 PolarHBondContact O-N 2.88Å; L284-A287 PolarHBondContact O-N 2.8Å; L284-A287 VanDerWaalsContact O-N 3.17Å; A287-R290 PolarHBondContact O-N 3.3Å; A287-A291 PolarHBondContact O-N 3.48Å
288	V	58.4	Low	54.5	Low	8 Å²	8	77.8 Å²	77.8	5%	0.048	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-43.9	179.2	179.6	0	0	0	0	111.4	V217 D218 F248 L284 R290 A291 N292	V217-V288 HydrophobicContact CB-CG2 4.45Å; V217-V288 HydrophobicContact CG1-CG2 3.94Å; D218-V288 WeakPolarHBondContact OD1-CG1 3.22Å; D218-V288 VanDerWaalsContact OD1-CG2 3.27Å; D218-V288 WeakPolarHBondContact OD1-CG2 3.22Å; F248-V288 HydrophobicContact CB-CG1 4.29Å; F248-V288 HydrophobicContact CD2-CG2 4Å; L284-V288 PolarHBondContact O-N 2.64Å; L284-V288 VanDerWaalsContact O-N 3.15Å; V288-R290 VanDerWaalsContact C-N 3.33Å; V288-R290 PolarHBondContact O-N 2.95Å; V288-A291 PolarHBondContact O-N 3.4Å; V288-N292 PolarHBondContact O-N 3.31Å
289	R	56.5	Low	54.3	Low	173 Å²	173	81.1 Å²	81.1	65%	0.653	44%	0.441	S	S	*	.	H	α-helix	trans	-59.8	-42	175.8	-76.4	-179.6	-179.3	-177.1	1.5	112.4	K285 N292 I293	K285-R289 WeakPolarHBondContact O-CB 3.18Å; K285-R289 VanDerWaalsContact O-CG 3.3Å; K285-R289 WeakPolarHBondContact O-CG 3.3Å; K285-R289 PolarHBondContact O-N 3.17Å; K285-R289 VanDerWaalsContact O-N 3.09Å; R289-N292 PolarHBondContact O-N 3.42Å; R289-I293 WeakPolarHBondContact O-CD1 3.4Å; R289-I293 WeakPolarHBondContact O-CG1 3.27Å; R289-I293 PolarHBondContact O-N 2.76Å
290	R	52.4	Low	53.8	Low	158 Å²	158	84.7 Å²	84.7	60%	0.596	46%	0.461	S	S	*	.	H	α-helix	trans	-64.9	-41.6	178	-76.7	175	-176.6	155	6.3	111.5	Q286 A287 V288 I293 L294	Q286-R290 WeakPolarHBondContact O-CB 3.19Å; Q286-R290 VanDerWaalsContact O-CG 3.25Å; Q286-R290 WeakPolarHBondContact O-CG 3.49Å; Q286-R290 PolarHBondContact O-N 3.17Å; A287-R290 PolarHBondContact O-N 3.3Å; V288-R290 VanDerWaalsContact C-N 3.33Å; V288-R290 PolarHBondContact O-N 2.95Å; R290-I293 PolarHBondContact O-N 3.42Å; R290-L294 WeakPolarHBondContact O-CB 3.49Å; R290-L294 WeakPolarHBondContact O-CD1 3.31Å; R290-L294 VanDerWaalsContact O-CG 3.23Å; R290-L294 WeakPolarHBondContact O-CG 3.21Å; R290-L294 PolarHBondContact O-N 3.41Å
291	A	54.4	Low	53.1	Low	40 Å²	40	92.5 Å²	92.5	33%	0.331	50%	0.497	S	S	.	.	H	α-helix	trans	-62.1	-46.5	177.4	0	0	0	0	0	111.6	A287 V288 I293 L294 A295	A287-A291 PolarHBondContact O-N 3.48Å; V288-A291 PolarHBondContact O-N 3.4Å; A291-I293 PolarHBondContact O-N 2.75Å; A291-L294 PolarHBondContact O-N 3.17Å; A291-A295 PolarHBondContact O-N 2.65Å
292	N	57.8	Low	52.6	Low	54 Å²	54	98 Å²	98	29%	0.289	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-42.2	179.1	-67.7	1	0	0	0	111.8	V288 R289 L294 A295 E296	V288-N292 PolarHBondContact O-N 3.31Å; R289-N292 PolarHBondContact O-N 3.42Å; N292-L294 PolarHBondContact O-N 2.99Å; N292-A295 PolarHBondContact O-N 2.79Å; N292-E296 WeakPolarHBondContact O-CG 3.24Å; N292-E296 PolarHBondContact O-N 2.78Å
293	I	56.3	Low	51.7	Low	103 Å²	103	100.6 Å²	100.6	53%	0.528	55%	0.55	S	S	.	.	H	α-helix	trans	-63.7	-41.8	175.6	-66	164	0	0	0	110.9	R289 R290 A291 A295 E296 V297	R289-I293 WeakPolarHBondContact O-CD1 3.4Å; R289-I293 WeakPolarHBondContact O-CG1 3.27Å; R289-I293 PolarHBondContact O-N 2.76Å; R290-I293 PolarHBondContact O-N 3.42Å; A291-I293 PolarHBondContact O-N 2.75Å; I293-A295 VanDerWaalsContact C-N 3.31Å; I293-A295 PolarHBondContact O-N 2.99Å; I293-E296 PolarHBondContact O-N 2.68Å; I293-V297 WeakPolarHBondContact O-CG2 3.4Å; I293-V297 PolarHBondContact O-N 3.28Å
294	L	54.8	Low	50.7	Low	128 Å²	128	100.3 Å²	100.3	67%	0.67	56%	0.561	S	S	*	*	H	α-helix	trans	-67.4	-31.4	179.6	-76.2	163.2	0	0	0	112.7	R290 A291 N292 E296	R290-L294 WeakPolarHBondContact O-CB 3.49Å; R290-L294 WeakPolarHBondContact O-CD1 3.31Å; R290-L294 VanDerWaalsContact O-CG 3.23Å; R290-L294 WeakPolarHBondContact O-CG 3.21Å; R290-L294 PolarHBondContact O-N 3.41Å; A291-L294 PolarHBondContact O-N 3.17Å; N292-L294 PolarHBondContact O-N 2.99Å; L294-E296 VanDerWaalsContact C-N 3.32Å
295	A	55.8	Low	49.4	Very low	88 Å²	88	104.1 Å²	104.1	73%	0.727	60%	0.595	S	S	*	*	H	α-helix	trans	-70.3	-28.9	173.8	0	0	0	0	0	112.5	A291 N292 I293	A291-A295 PolarHBondContact O-N 2.65Å; N292-A295 PolarHBondContact O-N 2.79Å; I293-A295 VanDerWaalsContact C-N 3.31Å; I293-A295 PolarHBondContact O-N 2.99Å
296	E	56	Low	48.2	Very low	159 Å²	159	106.1 Å²	106.1	74%	0.743	62%	0.62	S	S	*	*	H	α-helix	trans	-81.7	-19.3	176.8	-71.3	-178.7	-177.6	0	0	113.7	N292 I293 L294 P298	N292-E296 WeakPolarHBondContact O-CG 3.24Å; N292-E296 PolarHBondContact O-N 2.78Å; I293-E296 PolarHBondContact O-N 2.68Å; L294-E296 VanDerWaalsContact C-N 3.32Å; E296-P298 VanDerWaalsContact O-CD 3.26Å; E296-P298 WeakPolarHBondContact O-CD 3.41Å
297	V	47.8	Very low	46.8	Very low	84 Å²	84	108.4 Å²	108.4	51%	0.509	64%	0.641	S	S	.	*	S	Bend	trans	-78.2	114.4	175.5	178.5	0	0	0	0	108.9	I293	I293-V297 WeakPolarHBondContact O-CG2 3.4Å; I293-V297 PolarHBondContact O-N 3.28Å
298	P	41.8	Very low	45.7	Very low	101 Å²	101	112.4 Å²	112.4	66%	0.656	66%	0.659	S	S	*	*			trans	-59.3	140.3	177.5	-17.7	30.1	0	0	0	109.7	E296 T300	E296-P298 VanDerWaalsContact O-CD 3.26Å; E296-P298 WeakPolarHBondContact O-CD 3.41Å; P298-T300 PolarHBondContact O-N 2.84Å
299	P	44.5	Very low	44.4	Very low	123 Å²	123	117 Å²	117	80%	0.799	69%	0.692	S	S	*	*			trans	-59.2	114.9	178.4	22.7	-30.5	0	0	0	108.8	E301	P299-E301 PolarHBondContact O-N 3.12Å
300	T	40.8	Very low	43.1	Very low	129 Å²	129	118.6 Å²	118.6	79%	0.791	70%	0.703	S	S	*	*			trans	-63.6	106.5	176.7	-15.8	0	0	0	0	107.7	P298	P298-T300 PolarHBondContact O-N 2.84Å
301	E	38.2	Very low	42	Very low	168 Å²	168	123 Å²	123	79%	0.785	72%	0.72	S	S	*	*			trans	-55	135.4	174.6	-72.6	-174.7	161.3	0	0	109.4	P299 T303	P299-E301 PolarHBondContact O-N 3.12Å; E301-T303 PolarHBondContact O-N 2.87Å; E301-T303 PolarHBondContact O-OG1 2.92Å
302	P	40	Very low	40.6	Very low	131 Å²	131	132.4 Å²	132.4	85%	0.851	75%	0.747	S	S	*	*			trans	-64.4	99.1	-174.4	25.1	-32.2	0	0	0	109.3	S304	P302-S304 PolarHBondContact O-N 3.02Å; P302-S304 VanDerWaalsContact O-N 3.16Å
303	T	36.1	Very low	39.3	Very low	136 Å²	136	134.7 Å²	134.7	83%	0.834	77%	0.767	S	S	*	*			trans	-73	114.2	179.7	-17.6	0	0	0	0	108	E301	E301-T303 PolarHBondContact O-N 2.87Å; E301-T303 PolarHBondContact O-OG1 2.92Å
304	S	36.9	Very low	37.9	Very low	112 Å²	112	136.6 Å²	136.6	78%	0.783	78%	0.783	S	S	*	*			trans	-35.7	133.3	177.3	176.5	0	0	0	0	114.2	P302 A306	P302-S304 PolarHBondContact O-N 3.02Å; P302-S304 VanDerWaalsContact O-N 3.16Å; S304-A306 PolarHBondContact O-N 3.44Å
305	A	31.8	Very low	36.7	Very low	97 Å²	97	134.9 Å²	134.9	80%	0.802	79%	0.788	S	S	*	*			trans	-52.5	112.1	178.6	0	0	0	0	0	112.8
306	A	35.5	Very low	35.2	Very low	92 Å²	92	135.5 Å²	135.5	76%	0.76	79%	0.792	S	S	*	*			trans	-113.9	102.2	163.8	0	0	0	0	0	109.5	S304 V308	S304-A306 PolarHBondContact O-N 3.44Å; A306-V308 PolarHBondContact O-N 3.49Å
307	T	28.9	Very low	33.9	Very low	137 Å²	137	133.1 Å²	133.1	84%	0.84	79%	0.793	S	S	*	*			trans	-51.3	113.2	171	-49.5	0	0	0	0	111.7
308	V	34.7	Very low	32.9	Very low	140 Å²	140	137.8 Å²	137.8	85%	0.848	81%	0.81	S	S	*	*			trans	-130.2	97.9	158.6	-177	0	0	0	0	110.7	A306	A306-V308 PolarHBondContact O-N 3.49Å
309	S	32.3	Very low	32.1	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	82%	0.822	S	S	*	*			trans	0.2	129.5	153.9	-156.4	0	0	0	0	119.9
310	K	28.6	Very low	31.2	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.896	82%	0.824	S	S	*	*			trans	-37.9	128.8	162.5	-68	170.7	175.5	174.3	0	113.5
311	R	29.4	Very low	30.5	Very low	250 Å²	250	142.9 Å²	142.9	94%	0.943	82%	0.823	S	S	*	*			trans	-137.6	120.2	146.6	-128.4	172.4	-174.9	176.2	0.6	110.6
312	R	25.2	Very low	30.2	Very low	238 Å²	238	141 Å²	141	90%	0.898	83%	0.826	S	S	*	*			trans	-50	148.8	158.9	-62.4	159.1	100.9	172.4	3.7	107.8
313	S	31	Very low	29.7	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	83%	0.827	S	S	*	*				-178.9	142.4	52.3	42.1	0	0	0	0	110.2
314	V	26.1	Very low	29.5	Very low	143 Å²	143	142.5 Å²	142.5	87%	0.867	83%	0.826	S	S	*	*			trans	29.2	117	133.8	-167.6	0	0	0	0	118.3
315	A	29.3	Very low	29.3	Very low	93 Å²	93	144.2 Å²	144.2	77%	0.769	83%	0.826	S	S	*	*				-175.1	130.6	122.2	0	0	0	0	0	110.7
316	A	25.2	Very low	29.5	Very low	100 Å²	100	144.9 Å²	144.9	83%	0.826	83%	0.825	S	S	*	*			trans	-67.2	143.6	175.5	0	0	0	0	0	112.1
317	S	26.9	Very low	29.6	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	82%	0.815	S	S	*	*			trans	-157.5	112.1	150.8	-24.4	0	0	0	0	111.5
318	Q	27.8	Very low	30.1	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	81%	0.812	S	S	*	*			trans	66.5	105.9	135.9	-61.2	-176.3	-6.1	0	0	119.3	T320	Q318-T320 PolarHBondContact O-N 3.36Å
319	E	24.7	Very low	30.3	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	80%	0.8	S	S	*	*			trans	-43.6	120.3	157.7	-67.5	164.9	147	0	0	111.5
320	T	25.8	Very low	30.8	Very low	134 Å²	134	140.5 Å²	140.5	82%	0.822	79%	0.792	S	S	*	*			trans	-107.3	118.1	163.9	46.1	0	0	0	0	107.9	Q318	Q318-T320 PolarHBondContact O-N 3.36Å
321	T	25.9	Very low	31.3	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-60.3	140.3	176.2	44.9	0	0	0	0	111.4	K323	T321-K323 PolarHBondContact O-N 2.83Å
322	P	31.6	Very low	31.8	Very low	129 Å²	129	127.6 Å²	127.6	84%	0.838	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-74.9	123.7	-171.8	30	-32	0	0	0	110.8
323	K	29.3	Very low	32.5	Very low	201 Å²	201	121.8 Å²	121.8	87%	0.874	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-75.3	128.6	167.6	-81	-178.2	175	178.4	0	108.9	T321 D325	T321-K323 PolarHBondContact O-N 2.83Å; K323-D325 PolarHBondContact O-N 2.92Å
324	A	32.7	Very low	33	Very low	98 Å²	98	121.6 Å²	121.6	81%	0.81	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-57.5	125.9	179.5	0	0	0	0	0	112.1	S326	A324-S326 PolarHBondContact O-N 2.8Å; A324-S326 VanDerWaalsContact O-N 3.16Å
325	D	33.6	Very low	33.6	Very low	147 Å²	147	121.2 Å²	121.2	79%	0.786	73%	0.732	S	S	*	*			trans	-65.2	106	174	-83.2	-37.6	0	0	0	110.5	K323 S327	K323-D325 PolarHBondContact O-N 2.92Å; D325-S327 PolarHBondContact O-N 2.89Å
326	S	35	Very low	34.1	Very low	112 Å²	112	121.7 Å²	121.7	78%	0.783	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	28.7	176.2	65.8	0	0	0	0	113.3	A324	A324-S326 PolarHBondContact O-N 2.8Å; A324-S326 VanDerWaalsContact O-N 3.16Å
327	S	37.7	Very low	34.9	Very low	79 Å²	79	125 Å²	125	55%	0.552	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-7.2	-177.2	59	0	0	0	0	114.2	D325	D325-S327 PolarHBondContact O-N 2.89Å
328	L	38.5	Very low	35.2	Very low	148 Å²	148	130.6 Å²	130.6	78%	0.775	73%	0.728	S	S	*	*	S	Bend	trans	-81.1	-24.9	-176.2	-140	82.6	0	0	0	114.2	T332	L328-T332 PolarHBondContact O-OG1 3.24Å
329	S	40	Very low	35.4	Very low	86 Å²	86	133 Å²	133	60%	0.601	73%	0.729	S	S	*	*	H	α-helix	trans	-77.9	-22.3	-176.5	55.7	0	0	0	0	114	V331	S329-V331 PolarHBondContact O-N 3.4Å
330	A	42.8	Very low	35.6	Very low	67 Å²	67	134.4 Å²	134.4	55%	0.554	73%	0.726	S	S	*	*	H	α-helix	trans	-76.7	-20.4	-177.3	0	0	0	0	0	113.6
331	V	38.6	Very low	35.8	Very low	96 Å²	96	137 Å²	137	58%	0.582	73%	0.729	S	S	*	*	H	α-helix	trans	-86.9	-25.7	-176.2	-172.5	0	0	0	0	111.8	S329 D333	S329-V331 PolarHBondContact O-N 3.4Å; V331-D333 VanDerWaalsContact C-N 3.35Å; V331-D333 PolarHBondContact O-N 2.82Å
332	T	39.6	Very low	35.9	Very low	90 Å²	90	136.8 Å²	136.8	55%	0.552	73%	0.732	S	S	*	*	H	α-helix	trans	-70.8	-30.2	-178.4	-33.4	0	0	0	0	112.7	L328 T336	L328-T332 PolarHBondContact O-OG1 3.24Å; T332-T336 PolarHBondContact O-OG1 3.15Å; T332-T336 VanDerWaalsContact O-OG1 3.05Å
333	D	40.1	Very low	35.8	Very low	115 Å²	115	136.6 Å²	136.6	62%	0.615	73%	0.729	S	S	*	*	H	α-helix	trans	-74.5	-26.4	-178.9	-73.9	-16.6	0	0	0	113.2	V331 T336	V331-D333 VanDerWaalsContact C-N 3.35Å; V331-D333 PolarHBondContact O-N 2.82Å; D333-T336 PolarHBondContact O-OG1 3.16Å
334	V	42.9	Very low	35.6	Very low	99 Å²	99	132.8 Å²	132.8	60%	0.6	72%	0.724	S	S	*	*	H	α-helix	trans	-76.5	-30.4	179.8	-179.5	0	0	0	0	111.8
335	L	37.6	Very low	35.3	Very low	135 Å²	135	137.2 Å²	137.2	71%	0.707	73%	0.731	S	S	*	*	H	α-helix	trans	-78.4	-28.6	-179	-74	166.2	0	0	0	112.9
336	T	39.7	Very low	34.7	Very low	102 Å²	102	139.5 Å²	139.5	63%	0.626	73%	0.734	S	S	*	*	H	α-helix	trans	-75.5	-25.8	-179.1	22.3	0	0	0	0	113.4	T332 D333	T332-T336 PolarHBondContact O-OG1 3.15Å; T332-T336 VanDerWaalsContact O-OG1 3.05Å; D333-T336 PolarHBondContact O-OG1 3.16Å
337	Q	41.6	Very low	34.2	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.794	73%	0.734	S	S	*	*	H	α-helix	trans	-73.9	-23.9	179	-91.2	-178.2	-14.4	0	0	114.5	R339	Q337-R339 VanDerWaalsContact C-N 3.32Å; Q337-R339 PolarHBondContact O-N 2.97Å
338	R	33.7	Very low	33.6	Very low	227 Å²	227	143.4 Å²	143.4	86%	0.857	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.6	1.5	-176.8	-75.8	-169.1	177.4	-166.4	0.2	115.2	R340	R338-R340 VanDerWaalsContact C-N 3.31Å; R338-R340 PolarHBondContact O-N 3.17Å
339	R	31.4	Very low	32.8	Very low	234 Å²	234	144.7 Å²	144.7	88%	0.883	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	12.9	-177.9	-136.1	-176.8	-153.6	-158.9	6.3	115.4	Q337	Q337-R339 VanDerWaalsContact C-N 3.32Å; Q337-R339 PolarHBondContact O-N 2.97Å
340	R	29.5	Very low	32.1	Very low	225 Å²	225	149.3 Å²	149.3	85%	0.849	76%	0.76	S	S	*	*			trans	-124.6	82.5	176.9	-69.1	-174.7	-178.6	174	1.5	110.4	R338	R338-R340 VanDerWaalsContact C-N 3.31Å; R338-R340 PolarHBondContact O-N 3.17Å
341	E	29.7	Very low	31.2	Very low	190 Å²	190	150.4 Å²	150.4	89%	0.888	77%	0.769	S	S	*	*			trans	-176.1	73.4	155	-101.7	161.2	-143.7	0	0	108.4	V343	E341-V343 PolarHBondContact O-N 3.35Å
342	S	28.5	Very low	30.7	Very low	122 Å²	122	153.7 Å²	153.7	85%	0.853	78%	0.783	S	S	*	*			trans	-86.9	101.6	170.3	55.2	0	0	0	0	109.1
343	V	28.9	Very low	30.2	Very low	126 Å²	126	154.9 Å²	154.9	76%	0.764	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-93.1	127.3	168	-179.7	0	0	0	0	108.2	E341 M345	E341-V343 PolarHBondContact O-N 3.35Å; V343-M345 PolarHBondContact O-N 2.81Å
344	P	26.2	Very low	29.7	Very low	120 Å²	120	156.8 Å²	156.8	78%	0.779	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.2	118.4	-174.2	29.1	-31	0	0	0	110.9
345	M	25.2	Very low	29.3	Very low	191 Å²	191	155.5 Å²	155.5	94%	0.941	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-77.8	127.1	173.1	-100.6	-167.3	166.6	0	0	110.5	V343	V343-M345 PolarHBondContact O-N 2.81Å
346	K	22.6	Very low	28.7	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.5	133.4	173.5	-78.7	179	172.7	179.3	0	110.2	E348	K346-E348 PolarHBondContact O-N 3.2Å
347	S	24.2	Very low	28.2	Very low	114 Å²	114	152.1 Å²	152.1	80%	0.797	79%	0.786	S	S	*	*			trans	-65.5	111.4	173.8	56.6	0	0	0	0	111
348	E	23.8	Very low	27.4	Very low	159 Å²	159	150.2 Å²	150.2	74%	0.743	79%	0.785	S	S	*	*			trans	-110.7	122.4	161.6	-71.9	-173.3	171.9	0	0	108.2	K346 F350	K346-E348 PolarHBondContact O-N 3.2Å; E348-F350 VanDerWaalsContact O-CD2 3.31Å; E348-F350 WeakPolarHBondContact O-CD2 3.27Å; E348-F350 PolarHBondContact O-N 2.82Å
349	L	22.1	Very low	27	Very low	175 Å²	175	148 Å²	148	92%	0.916	78%	0.784	S	S	*	*			trans	-56.6	112.1	177.3	-101.1	72.8	0	0	0	109.8
350	F	25.6	Very low	26.8	Very low	183 Å²	183	144 Å²	144	80%	0.803	78%	0.78	S	S	*	*			trans	-91.9	111.5	165.3	-73.4	-80.7	0	0	0	109.2	E348	E348-F350 VanDerWaalsContact O-CD2 3.31Å; E348-F350 WeakPolarHBondContact O-CD2 3.27Å; E348-F350 PolarHBondContact O-N 2.82Å
351	A	23.4	Very low	26.7	Very low	90 Å²	90	145 Å²	145	74%	0.744	78%	0.784	S	S	*	*			trans	-74.7	137.1	168.3	0	0	0	0	0	110.4	V353	A351-V353 PolarHBondContact O-N 3.15Å
352	D	27.9	Very low	26.6	Very low	165 Å²	165	143.5 Å²	143.5	88%	0.882	78%	0.777	S	S	*	*			trans	31.3	74.4	163.3	-75	-21.4	0	0	0	116.2	D354	D352-D354 PolarHBondContact O-N 2.76Å
353	V	29.9	Very low	26.5	Very low	114 Å²	114	147.1 Å²	147.1	69%	0.691	78%	0.78	S	S	*	*			trans	-77.4	102.6	157.8	-178.5	0	0	0	0	106.7	A351 T355	A351-V353 PolarHBondContact O-N 3.15Å; V353-T355 VanDerWaalsContact C-N 3.34Å; V353-T355 PolarHBondContact O-N 2.78Å
354	D	30.1	Very low	26.5	Very low	155 Å²	155	149.4 Å²	149.4	83%	0.829	78%	0.782	S	S	*	*			trans	-37.6	95.5	167.3	-158.2	6.3	0	0	0	109.3	D352 G356	D352-D354 PolarHBondContact O-N 2.76Å; D354-G356 VanDerWaalsContact C-N 3.33Å; D354-G356 PolarHBondContact O-N 2.84Å
355	T	33.3	Very low	26.6	Very low	73 Å²	73	148.7 Å²	148.7	45%	0.448	78%	0.78	S	S	.	*			trans	-66.6	99.5	-176	55.9	0	0	0	0	105.5	N196 V353 I357	N196-T355 PolarHBondContact ND2-OG1 3.47Å; V353-T355 VanDerWaalsContact C-N 3.34Å; V353-T355 PolarHBondContact O-N 2.78Å; T355-I357 PolarHBondContact O-N 2.95Å
356	G	24.6	Very low	26.7	Very low	65 Å²	65	150.5 Å²	150.5	67%	0.67	78%	0.776	S	S	*	*			trans	-63.2	59.7	-170.3	0	0	0	0	0	114.5	D354 V358	D354-G356 VanDerWaalsContact C-N 3.33Å; D354-G356 PolarHBondContact O-N 2.84Å; G356-V358 PolarHBondContact O-N 3.15Å
357	I	29.7	Very low	27.1	Very low	101 Å²	101	148.5 Å²	148.5	52%	0.518	78%	0.775	S	S	.	*			trans	-73.7	103.5	169.5	-61.2	174.6	0	0	0	105.4	T355 Q359	T355-I357 PolarHBondContact O-N 2.95Å; I357-Q359 PolarHBondContact O-N 2.68Å
358	V	26.1	Very low	27.2	Very low	130 Å²	130	151.8 Å²	151.8	79%	0.788	78%	0.777	S	S	*	*			trans	-59	105.7	171	178.3	0	0	0	0	107.8	G356 L360	G356-V358 PolarHBondContact O-N 3.15Å; V358-L360 PolarHBondContact O-N 2.81Å; V358-L360 VanDerWaalsContact O-N 3.16Å
359	Q	24.3	Very low	27.4	Very low	179 Å²	179	155.2 Å²	155.2	84%	0.836	79%	0.785	S	S	*	*			trans	-57.9	119.2	170.8	-88.6	-166.7	-24.1	0	0	109.3	I357 R361	I357-Q359 PolarHBondContact O-N 2.68Å; Q359-R361 PolarHBondContact O-N 2.86Å; Q359-R361 VanDerWaalsContact O-N 3.15Å
360	L	27.3	Very low	27.6	Very low	150 Å²	150	150 Å²	150	79%	0.785	77%	0.774	S	S	*	*			trans	-62.6	114.4	170.3	-75.3	161.5	0	0	0	108.5	V358 H362	V358-L360 PolarHBondContact O-N 2.81Å; V358-L360 VanDerWaalsContact O-N 3.16Å; L360-H362 PolarHBondContact O-N 3.42Å
361	R	26.4	Very low	27.7	Very low	248 Å²	248	147.2 Å²	147.2	94%	0.936	78%	0.777	S	S	*	*			trans	-65.9	106.4	175.8	-72.1	-177.1	178	175.5	-0.2	109.3	Q359	Q359-R361 PolarHBondContact O-N 2.86Å; Q359-R361 VanDerWaalsContact O-N 3.15Å
362	H	28.3	Very low	27.7	Very low	158 Å²	158	146.5 Å²	146.5	73%	0.731	78%	0.778	S	S	*	*			trans	-71.1	127	165.8	-74.6	-83.1	0	0	0	109.1	L360 E364	L360-H362 PolarHBondContact O-N 3.42Å; H362-E364 PolarHBondContact O-N 3.06Å
363	H	26	Very low	27.7	Very low	198 Å²	198	150.9 Å²	150.9	92%	0.917	78%	0.783	S	S	*	*			trans	-71.7	93	176.5	-142.6	-74.8	0	0	0	107.8	S365	H363-S365 PolarHBondContact O-N 2.89Å
364	E	29	Very low	27.5	Very low	173 Å²	173	154.9 Å²	154.9	81%	0.808	79%	0.794	S	S	*	*			trans	-69.3	115.4	173	-73.1	-177.6	162.7	0	0	109.2	H362 R366	H362-E364 PolarHBondContact O-N 3.06Å; E364-R366 PolarHBondContact O-N 2.82Å
365	S	28.4	Very low	27.1	Very low	105 Å²	105	151.2 Å²	151.2	73%	0.734	79%	0.793	S	S	*	*			trans	-65.5	100.7	165.3	49.8	0	0	0	0	108.3	H363 D367	H363-S365 PolarHBondContact O-N 2.89Å; S365-D367 PolarHBondContact O-N 3.35Å
366	R	28.3	Very low	26.9	Very low	230 Å²	230	152.9 Å²	152.9	87%	0.868	81%	0.814	S	S	*	*			trans	-68.4	108.6	170.7	-92.9	-179	165.8	176.9	-3.9	109.6	E364 E368	E364-R366 PolarHBondContact O-N 2.82Å; R366-E368 PolarHBondContact O-N 3.17Å
367	D	30.2	Very low	26.8	Very low	154 Å²	154	153.6 Å²	153.6	82%	0.824	82%	0.821	S	S	*	*			trans	-75.4	107.9	156.7	-73.3	-38.7	0	0	0	108.1	S365 Y369	S365-D367 PolarHBondContact O-N 3.35Å; D367-Y369 PolarHBondContact O-N 3.04Å
368	E	27.4	Very low	26.6	Very low	182 Å²	182	153.1 Å²	153.1	85%	0.85	83%	0.832	S	S	*	*			trans	-72.6	107.2	177.3	-74.2	-176.9	152.6	0	0	110.8	R366	R366-E368 PolarHBondContact O-N 3.17Å
369	Y	26.4	Very low	26.6	Very low	232 Å²	232	153.6 Å²	153.6	91%	0.91	84%	0.835	S	S	*	*			trans	-134.6	120.4	154.3	-100.1	-87	0	0	0	109.9	D367	D367-Y369 PolarHBondContact O-N 3.04Å
370	G	27	Very low	26.7	Very low	66 Å²	66	151.7 Å²	151.7	68%	0.68	84%	0.836	S	S	*	*			trans	93.2	98.4	140.2	0	0	0	0	0	119.1
371	S	27.7	Very low	26.7	Very low	124 Å²	124	153.6 Å²	153.6	87%	0.867	84%	0.841	S	S	*	*			trans	59	98.6	134.8	64.7	0	0	0	0	120.3
372	G	23.9	Very low	26.9	Very low	75 Å²	75	146.6 Å²	146.6	77%	0.773	83%	0.83	S	S	*	*				68.2	107.4	110.8	0	0	0	0	0	119.5
373	R	28	Very low	27	Very low	257 Å²	257	142.3 Å²	142.3	97%	0.97	83%	0.828	S	S	*	*				-166.8	141	115.2	-113.5	174.7	176.5	177.4	-1.2	111.4
374	Q	24.1	Very low	27.1	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	83%	0.826	S	S	*	*			trans	-77.7	149.3	-172.6	-66.7	166.3	-14	0	0	112.5
375	G	23.2	Very low	27.2	Very low	79 Å²	79	143.9 Å²	143.9	81%	0.814	83%	0.83	S	S	*	*			trans	101.3	99	130.1	0	0	0	0	0	117.1
376	A	28.8	Very low	27.5	Very low	107 Å²	107	143.4 Å²	143.4	88%	0.884	83%	0.827	S	S	*	*			trans	-170.4	115.5	132	0	0	0	0	0	107.8
377	G	22.3	Very low	28	Very low	81 Å²	81	136.6 Å²	136.6	84%	0.835	82%	0.82	S	S	*	*			trans	-84.4	155.7	176.8	0	0	0	0	0	112.3
378	A	25.9	Very low	28.6	Very low	90 Å²	90	132 Å²	132	74%	0.744	80%	0.804	S	S	*	*			trans	-172.9	114.4	140	0	0	0	0	0	109.8
379	V	26.2	Very low	29.1	Very low	140 Å²	140	131 Å²	131	85%	0.848	80%	0.801	S	S	*	*			trans	50	103.1	138.1	-163	0	0	0	0	117.6
380	T	25.8	Very low	29.9	Very low	139 Å²	139	123.8 Å²	123.8	85%	0.853	79%	0.789	S	S	*	*			trans	-128.7	120.8	157.1	54.6	0	0	0	0	109.9
381	E	28	Very low	31.1	Very low	191 Å²	191	124.1 Å²	124.1	89%	0.893	78%	0.781	S	S	*	*			trans	-56.5	129	176.7	-71.2	175.5	141	0	0	111.8	G383	E381-G383 PolarHBondContact O-N 3.5Å; E381-G383 VanDerWaalsContact O-N 3.17Å
382	S	29.7	Very low	32.3	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	76%	0.764	S	S	*	*			trans	-80.5	88.1	180	53.6	0	0	0	0	111
383	G	29.9	Very low	33.9	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	76%	0.761	S	S	*	*			trans	-87.2	93.8	159	0	0	0	0	0	109.7	E381 F385	E381-G383 PolarHBondContact O-N 3.5Å; E381-G383 VanDerWaalsContact O-N 3.17Å; G383-F385 PolarHBondContact O-N 3.39Å
384	F	28.9	Very low	35.9	Very low	197 Å²	197	120.1 Å²	120.1	86%	0.864	74%	0.738	S	S	*	*			trans	-65.3	93.9	176.7	-89	-97	0	0	0	110.9
385	F	31.3	Very low	38.1	Very low	207 Å²	207	117.2 Å²	117.2	91%	0.908	73%	0.725	S	S	*	*			trans	-99.9	115.1	156.8	-88.4	-82.9	0	0	0	109.2	G383 A387	G383-F385 PolarHBondContact O-N 3.39Å; F385-A387 PolarHBondContact O-N 3.37Å
386	S	33.9	Very low	40.6	Very low	95 Å²	95	119 Å²	119	66%	0.664	71%	0.712	S	S	*	*			trans	-54.2	115.4	-174.5	176.8	0	0	0	0	112.6	A388	S386-A388 PolarHBondContact O-N 2.95Å; S386-A388 WeakPolarHBondContact OG-CB 3.37Å; S386-A388 PolarHBondContact OG-N 3.18Å
387	A	40.4	Very low	42.8	Very low	88 Å²	88	119.4 Å²	119.4	73%	0.727	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-66.1	1.7	172.9	0	0	0	0	0	114.1	F385 M389	F385-A387 PolarHBondContact O-N 3.37Å; A387-M389 VanDerWaalsContact C-N 3.32Å; A387-M389 PolarHBondContact O-N 3.42Å
388	A	41.8	Very low	45.6	Very low	58 Å²	58	119.5 Å²	119.5	48%	0.479	68%	0.683	S	S	.	*	G	3₁₀ helix	trans	-70.3	-22.7	-176.3	0	0	0	0	0	114	S386 S391	S386-A388 PolarHBondContact O-N 2.95Å; S386-A388 WeakPolarHBondContact OG-CB 3.37Å; S386-A388 PolarHBondContact OG-N 3.18Å; A388-S391 PolarHBondContact O-OG 3.39Å
389	M	37.8	Very low	48.5	Very low	160 Å²	160	119.8 Å²	119.8	79%	0.788	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-80.8	-22.3	-179	-74	-143.9	160.6	0	0	114.1	A387 S391	A387-M389 VanDerWaalsContact C-N 3.32Å; A387-M389 PolarHBondContact O-N 3.42Å; M389-S391 VanDerWaalsContact C-N 3.33Å; M389-S391 PolarHBondContact O-N 3.26Å
390	A	43.9	Very low	51.3	Low	80 Å²	80	116.8 Å²	116.8	66%	0.661	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-23.6	-178	0	0	0	0	0	113.3
391	S	51.1	Low	54.3	Low	73 Å²	73	113.4 Å²	113.4	51%	0.51	63%	0.631	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.5	-13.9	-176.5	68.3	0	0	0	0	114.7	A388 M389	A388-S391 PolarHBondContact O-OG 3.39Å; M389-S391 VanDerWaalsContact C-N 3.33Å; M389-S391 PolarHBondContact O-N 3.26Å
392	Q	53	Low	57.2	Low	108 Å²	108	108.3 Å²	108.3	51%	0.505	61%	0.61	S	S	.	*	H	α-helix	trans	-82.8	-38.1	-176.6	-67.8	-172.4	-9.8	0	0	112.9	Q395 E396	Q392-Q395 PolarHBondContact O-N 3.42Å; Q392-E396 PolarHBondContact O-N 3.46Å
393	R	58.7	Low	60.2	Low	188 Å²	188	110.4 Å²	110.4	71%	0.709	60%	0.602	S	S	*	*	H	α-helix	trans	-54.2	-45.4	-178.3	-95.3	-177.4	-179.1	-177.8	-0.1	114.9	Q395 E396 L397	R393-Q395 VanDerWaalsContact C-N 3.28Å; R393-Q395 PolarHBondContact O-N 3.38Å; R393-E396 PolarHBondContact O-N 3.05Å; R393-L397 PolarHBondContact O-N 3.21Å
394	P	68.8	Low	63	Low	77 Å²	77	111.7 Å²	111.7	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-63.4	-34.1	178.4	-22.2	33.2	0	0	0	113	T398	P394-T398 WeakPolarHBondContact O-CB 3.45Å; P394-T398 PolarHBondContact O-N 2.67Å; P394-T398 VanDerWaalsContact O-N 3.1Å; P394-T398 PolarHBondContact O-OG1 3.4Å
395	Q	70.9	Confident	65.8	Low	135 Å²	135	107.5 Å²	107.5	63%	0.631	57%	0.574	S	S	*	*	H	α-helix	trans	-72	-43.5	178.9	-63.7	-174.9	-3.2	0	0	110.8	Q392 R393 L397 T398 V399	Q392-Q395 PolarHBondContact O-N 3.42Å; R393-Q395 VanDerWaalsContact C-N 3.28Å; R393-Q395 PolarHBondContact O-N 3.38Å; Q395-L397 PolarHBondContact O-N 3.01Å; Q395-T398 PolarHBondContact O-N 3.42Å; Q395-V399 WeakPolarHBondContact O-CG2 3.42Å; Q395-V399 PolarHBondContact O-N 3.18Å
396	E	75.5	Confident	68.6	Low	116 Å²	116	106.1 Å²	106.1	54%	0.542	56%	0.563	S	S	.	*	H	α-helix	trans	-59.5	-46.5	175.5	-70	174.1	171.1	0	0	112.2	Q392 R393 T398 V399 E400	Q392-E396 PolarHBondContact O-N 3.46Å; R393-E396 PolarHBondContact O-N 3.05Å; E396-T398 VanDerWaalsContact C-N 3.3Å; E396-T398 PolarHBondContact O-N 3.27Å; E396-V399 PolarHBondContact O-N 3.2Å; E396-E400 PolarHBondContact O-N 2.86Å
397	L	75.7	Confident	71.3	Confident	117 Å²	117	104.8 Å²	104.8	61%	0.613	55%	0.548	S	S	*	.	H	α-helix	trans	-59.9	-40.5	175.2	-84.7	153.9	0	0	0	112	R393 Q395 V399 E400 V401	R393-L397 PolarHBondContact O-N 3.21Å; Q395-L397 PolarHBondContact O-N 3.01Å; L397-V399 VanDerWaalsContact C-N 3.35Å; L397-E400 PolarHBondContact O-N 3.25Å; L397-V401 WeakPolarHBondContact O-CB 3.43Å; L397-V401 VanDerWaalsContact O-CG2 3.27Å; L397-V401 WeakPolarHBondContact O-CG2 3.37Å; L397-V401 PolarHBondContact O-N 3.39Å
398	T	81.4	Confident	73.6	Confident	82 Å²	82	105.2 Å²	105.2	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-66.2	-38.4	177.5	-57.2	0	0	0	0	111.5	P394 Q395 E396 N402	P394-T398 WeakPolarHBondContact O-CB 3.45Å; P394-T398 PolarHBondContact O-N 2.67Å; P394-T398 VanDerWaalsContact O-N 3.1Å; P394-T398 PolarHBondContact O-OG1 3.4Å; Q395-T398 PolarHBondContact O-N 3.42Å; E396-T398 VanDerWaalsContact C-N 3.3Å; E396-T398 PolarHBondContact O-N 3.27Å; T398-N402 WeakPolarHBondContact O-CB 3.45Å; T398-N402 VanDerWaalsContact O-CG 3.28Å; T398-N402 PolarHBondContact O-N 3.49Å; T398-N402 VanDerWaalsContact O-N 3.09Å; T398-N402 PolarHBondContact O-ND2 3.46Å
399	V	85.5	Confident	75.9	Confident	97 Å²	97	110.4 Å²	110.4	59%	0.588	55%	0.548	S	S	*	.	H	α-helix	trans	-64.1	-45	175	172.4	0	0	0	0	110.7	Q395 E396 L397 N402 R403	Q395-V399 WeakPolarHBondContact O-CG2 3.42Å; Q395-V399 PolarHBondContact O-N 3.18Å; E396-V399 PolarHBondContact O-N 3.2Å; L397-V399 VanDerWaalsContact C-N 3.35Å; V399-N402 PolarHBondContact O-N 3.48Å; V399-R403 PolarHBondContact O-N 3.4Å
400	E	86.2	Confident	78.3	Confident	76 Å²	76	108.8 Å²	108.8	36%	0.355	54%	0.539	S	S	.	.	H	α-helix	trans	-69.4	-39.8	-178.7	-164.6	58.4	-156.7	0	0	112.4	E396 L397 N402 R403 L404	E396-E400 PolarHBondContact O-N 2.86Å; L397-E400 PolarHBondContact O-N 3.25Å; E400-N402 VanDerWaalsContact C-N 3.28Å; E400-N402 PolarHBondContact O-N 3.08Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 2.99Å; E400-R403 VanDerWaalsContact O-N 3.17Å; E400-R403 IonicContact OE1-CZ 3.87Å; E400-R403 IonicContact OE1-NH1 2.82Å; E400-R403 PolarHBondContact OE1-NH1 2.86Å; E400-R403 WeakPolarHBondContact OE2-CD 3.41Å; E400-R403 IonicContact OE2-NH1 2.66Å; E400-L404 HydrophobicContact CG-CD1 4.49Å; E400-L404 WeakPolarHBondContact O-CG 3.38Å; E400-L404 PolarHBondContact O-N 3.31Å
401	V	87.3	Confident	80.4	Confident	68 Å²	68	109.5 Å²	109.5	41%	0.412	53%	0.531	S	S	.	.	H	α-helix	trans	-59.8	-40.3	172.6	168.9	0	0	0	0	111.1	L397 K405	L397-V401 WeakPolarHBondContact O-CB 3.43Å; L397-V401 VanDerWaalsContact O-CG2 3.27Å; L397-V401 WeakPolarHBondContact O-CG2 3.37Å; L397-V401 PolarHBondContact O-N 3.39Å; V401-K405 HydrophobicContact CG1-CD 4.21Å; V401-K405 WeakPolarHBondContact O-CB 3.4Å; V401-K405 VanDerWaalsContact O-CG 3.3Å; V401-K405 WeakPolarHBondContact O-CG 3.43Å; V401-K405 PolarHBondContact O-N 3.09Å
402	N	89.2	Confident	82.1	Confident	84 Å²	84	108.7 Å²	108.7	45%	0.449	53%	0.529	S	S	.	.	H	α-helix	trans	-70	-34.8	177.2	-76.2	-35.7	0	0	0	112.6	T398 V399 E400 R406	T398-N402 WeakPolarHBondContact O-CB 3.45Å; T398-N402 VanDerWaalsContact O-CG 3.28Å; T398-N402 PolarHBondContact O-N 3.49Å; T398-N402 VanDerWaalsContact O-N 3.09Å; T398-N402 PolarHBondContact O-ND2 3.46Å; V399-N402 PolarHBondContact O-N 3.48Å; E400-N402 VanDerWaalsContact C-N 3.28Å; E400-N402 PolarHBondContact O-N 3.08Å; N402-R406 PolarHBondContact O-N 2.92Å; N402-R406 VanDerWaalsContact O-N 3.13Å
403	R	92.1	Very high	83.7	Confident	146 Å²	146	106.7 Å²	106.7	55%	0.551	53%	0.527	S	S	*	.	H	α-helix	trans	-63.1	-49.7	172.8	-176.3	-177.6	174.9	-130.6	3.7	111.1	V399 E400 K405 R406 I407	V399-R403 PolarHBondContact O-N 3.4Å; E400-R403 WeakPolarHBondContact O-CB 3.31Å; E400-R403 PolarHBondContact O-N 2.99Å; E400-R403 VanDerWaalsContact O-N 3.17Å; E400-R403 IonicContact OE1-CZ 3.87Å; E400-R403 IonicContact OE1-NH1 2.82Å; E400-R403 PolarHBondContact OE1-NH1 2.86Å; E400-R403 WeakPolarHBondContact OE2-CD 3.41Å; E400-R403 IonicContact OE2-NH1 2.66Å; R403-K405 PolarHBondContact O-N 3.5Å; R403-R406 WeakPolarHBondContact O-CB 3.42Å; R403-R406 PolarHBondContact O-N 3.49Å; R403-R406 VanDerWaalsContact O-N 3.11Å; R403-I407 HydrophobicContact CG-CD1 4.41Å; R403-I407 PolarHBondContact O-N 2.92Å; R403-I407 VanDerWaalsContact O-N 3.1Å
404	L	88.7	Confident	85	Confident	94 Å²	94	106.2 Å²	106.2	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-61.3	-42.7	177.2	-71.6	169.6	0	0	0	111.9	E400 R406 I407 V408	E400-L404 HydrophobicContact CG-CD1 4.49Å; E400-L404 WeakPolarHBondContact O-CG 3.38Å; E400-L404 PolarHBondContact O-N 3.31Å; L404-R406 VanDerWaalsContact C-N 3.27Å; L404-R406 PolarHBondContact O-N 3.23Å; L404-I407 PolarHBondContact O-N 2.97Å; L404-I407 VanDerWaalsContact O-N 3.15Å; L404-V408 WeakPolarHBondContact O-CG2 3.47Å; L404-V408 PolarHBondContact O-N 3.03Å
405	K	89	Confident	85.8	Confident	109 Å²	109	107.6 Å²	107.6	47%	0.474	53%	0.527	S	S	.	.	H	α-helix	trans	-58.4	-36.5	174	-78.4	176	179.8	176.6	0	112.7	V401 R403 R409	V401-K405 HydrophobicContact CG1-CD 4.21Å; V401-K405 WeakPolarHBondContact O-CB 3.4Å; V401-K405 VanDerWaalsContact O-CG 3.3Å; V401-K405 WeakPolarHBondContact O-CG 3.43Å; V401-K405 PolarHBondContact O-N 3.09Å; R403-K405 PolarHBondContact O-N 3.5Å; K405-R409 WeakPolarHBondContact O-CG 3.3Å; K405-R409 PolarHBondContact O-N 3.11Å
406	R	89.8	Confident	86.3	Confident	178 Å²	178	107.3 Å²	107.3	67%	0.672	52%	0.524	S	S	*	.	H	α-helix	trans	-67.3	-44	174.5	-80.4	-176.8	-176.8	169.7	2.1	111.9	N402 R403 L404 V408 R409 Q410	N402-R406 PolarHBondContact O-N 2.92Å; N402-R406 VanDerWaalsContact O-N 3.13Å; R403-R406 WeakPolarHBondContact O-CB 3.42Å; R403-R406 PolarHBondContact O-N 3.49Å; R403-R406 VanDerWaalsContact O-N 3.11Å; L404-R406 VanDerWaalsContact C-N 3.27Å; L404-R406 PolarHBondContact O-N 3.23Å; R406-V408 PolarHBondContact O-N 3.46Å; R406-R409 PolarHBondContact O-N 2.97Å; R406-Q410 WeakPolarHBondContact O-CG 3.47Å; R406-Q410 PolarHBondContact O-N 3.47Å
407	I	91	Very high	86.6	Confident	66 Å²	66	105.2 Å²	105.2	34%	0.338	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-46.5	179	-65.9	169.1	0	0	0	110.3	R403 L404 R409 Q410 L411	R403-I407 HydrophobicContact CG-CD1 4.41Å; R403-I407 PolarHBondContact O-N 2.92Å; R403-I407 VanDerWaalsContact O-N 3.1Å; L404-I407 PolarHBondContact O-N 2.97Å; L404-I407 VanDerWaalsContact O-N 3.15Å; I407-R409 VanDerWaalsContact C-N 3.34Å; I407-R409 PolarHBondContact O-N 3.45Å; I407-Q410 PolarHBondContact O-N 3.18Å; I407-Q410 VanDerWaalsContact O-N 3.17Å; I407-L411 HydrophobicContact CG2-CD1 3.99Å; I407-L411 HydrophobicContact CG2-CG 4.43Å; I407-L411 WeakPolarHBondContact O-CG 3.46Å; I407-L411 PolarHBondContact O-N 3.19Å
408	V	87.8	Confident	86.7	Confident	97 Å²	97	103.3 Å²	103.3	59%	0.588	51%	0.513	S	S	*	.	H	α-helix	trans	-60.5	-42.7	178	173.5	0	0	0	0	111.5	L404 R406 Q410 L411 A412	L404-V408 WeakPolarHBondContact O-CG2 3.47Å; L404-V408 PolarHBondContact O-N 3.03Å; R406-V408 PolarHBondContact O-N 3.46Å; V408-Q410 PolarHBondContact O-N 3.33Å; V408-L411 PolarHBondContact O-N 2.94Å; V408-A412 WeakPolarHBondContact O-CB 3.33Å; V408-A412 PolarHBondContact O-N 2.97Å
409	R	89.6	Confident	86.5	Confident	167 Å²	167	104.7 Å²	104.7	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-63.7	-39.8	175.7	-72.2	177.8	-158.3	154.6	3.9	112.5	K405 R406 I407 A412 S413	K405-R409 WeakPolarHBondContact O-CG 3.3Å; K405-R409 PolarHBondContact O-N 3.11Å; R406-R409 PolarHBondContact O-N 2.97Å; I407-R409 VanDerWaalsContact C-N 3.34Å; I407-R409 PolarHBondContact O-N 3.45Å; R409-A412 PolarHBondContact O-N 2.97Å; R409-S413 PolarHBondContact O-N 3.15Å; R409-S413 PolarHBondContact O-OG 3.4Å
410	Q	88.5	Confident	86	Confident	126 Å²	126	106.2 Å²	106.2	59%	0.589	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-45.5	176.7	-76.3	178.4	-24.4	0	0	111.3	R406 I407 V408 A412 S413 R414	R406-Q410 WeakPolarHBondContact O-CG 3.47Å; R406-Q410 PolarHBondContact O-N 3.47Å; I407-Q410 PolarHBondContact O-N 3.18Å; I407-Q410 VanDerWaalsContact O-N 3.17Å; V408-Q410 PolarHBondContact O-N 3.33Å; Q410-A412 PolarHBondContact O-N 2.91Å; Q410-S413 PolarHBondContact O-N 3.3Å; Q410-S413 PolarHBondContact O-OG 3.27Å; Q410-R414 WeakPolarHBondContact O-CG 3.27Å; Q410-R414 PolarHBondContact O-N 3Å
411	L	89	Confident	85.5	Confident	95 Å²	95	107.6 Å²	107.6	50%	0.497	52%	0.521	S	S	.	.	H	α-helix	trans	-61.6	-44.1	176.3	-70.6	172.4	0	0	0	111.6	I407 V408 S413 R414 L415	I407-L411 HydrophobicContact CG2-CD1 3.99Å; I407-L411 HydrophobicContact CG2-CG 4.43Å; I407-L411 WeakPolarHBondContact O-CG 3.46Å; I407-L411 PolarHBondContact O-N 3.19Å; V408-L411 PolarHBondContact O-N 2.94Å; L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 2.68Å; L411-R414 PolarHBondContact O-N 3.18Å; L411-L415 PolarHBondContact O-N 3.49Å
412	A	86.5	Confident	84.6	Confident	57 Å²	57	107.4 Å²	107.4	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-60.3	-40	175.3	0	0	0	0	0	112.5	V408 R409 Q410 L415 K416	V408-A412 WeakPolarHBondContact O-CB 3.33Å; V408-A412 PolarHBondContact O-N 2.97Å; R409-A412 PolarHBondContact O-N 2.97Å; Q410-A412 PolarHBondContact O-N 2.91Å; A412-L415 PolarHBondContact O-N 3.17Å; A412-K416 PolarHBondContact O-N 2.97Å; A412-K416 VanDerWaalsContact O-N 3.09Å
413	S	86.7	Confident	83.6	Confident	65 Å²	65	110.4 Å²	110.4	46%	0.455	54%	0.535	S	S	.	.	H	α-helix	trans	-65.7	-40.2	174.8	66.2	0	0	0	0	112.8	R409 Q410 L411 K416 T417	R409-S413 PolarHBondContact O-N 3.15Å; R409-S413 PolarHBondContact O-OG 3.4Å; Q410-S413 PolarHBondContact O-N 3.3Å; Q410-S413 PolarHBondContact O-OG 3.27Å; L411-S413 VanDerWaalsContact C-N 3.32Å; L411-S413 PolarHBondContact O-N 2.68Å; S413-K416 PolarHBondContact O-N 2.91Å; S413-T417 PolarHBondContact O-N 3.24Å; S413-T417 PolarHBondContact O-OG1 3.47Å; S413-T417 VanDerWaalsContact O-OG1 3.11Å
414	R	86.8	Confident	82.2	Confident	178 Å²	178	106.1 Å²	106.1	67%	0.672	54%	0.536	S	S	*	.	H	α-helix	trans	-64.9	-42.4	177.3	-73.6	179.6	68.3	-179.7	1.2	111.2	Q410 L411 K416 T417 V418	Q410-R414 WeakPolarHBondContact O-CG 3.27Å; Q410-R414 PolarHBondContact O-N 3Å; L411-R414 PolarHBondContact O-N 3.18Å; R414-K416 VanDerWaalsContact C-N 3.32Å; R414-K416 PolarHBondContact O-N 3.13Å; R414-T417 PolarHBondContact O-N 3.1Å; R414-V418 WeakPolarHBondContact O-CG2 3.44Å; R414-V418 PolarHBondContact O-N 2.95Å
415	L	83.8	Confident	80.5	Confident	106 Å²	106	107 Å²	107	56%	0.555	54%	0.538	S	S	*	.	H	α-helix	trans	-58.5	-45.5	175.7	-120.7	139.4	0	0	0	111.1	L411 A412 T417 V418 E419	L411-L415 PolarHBondContact O-N 3.49Å; A412-L415 PolarHBondContact O-N 3.17Å; L415-T417 VanDerWaalsContact C-N 3.33Å; L415-T417 PolarHBondContact O-N 3.02Å; L415-V418 PolarHBondContact O-N 3.09Å; L415-E419 WeakPolarHBondContact O-CG 3.45Å; L415-E419 PolarHBondContact O-N 3.37Å
416	K	83.2	Confident	78.8	Confident	130 Å²	130	108.1 Å²	108.1	57%	0.565	55%	0.549	S	S	*	.	H	α-helix	trans	-63.4	-36.9	176.6	-165	174.9	-176.3	177.6	0	113	A412 S413 R414 Q420	A412-K416 PolarHBondContact O-N 2.97Å; A412-K416 VanDerWaalsContact O-N 3.09Å; S413-K416 PolarHBondContact O-N 2.91Å; R414-K416 VanDerWaalsContact C-N 3.32Å; R414-K416 PolarHBondContact O-N 3.13Å; K416-Q420 WeakPolarHBondContact O-CB 3.34Å; K416-Q420 VanDerWaalsContact O-CG 3.3Å; K416-Q420 WeakPolarHBondContact O-CG 3.44Å; K416-Q420 PolarHBondContact O-N 3.1Å
417	T	80.2	Confident	77.2	Confident	72 Å²	72	106.2 Å²	106.2	44%	0.442	55%	0.552	S	S	.	*	H	α-helix	trans	-65.6	-42.5	173.9	-55.8	0	0	0	0	111.4	S413 R414 L415 Q420 Q421	S413-T417 PolarHBondContact O-N 3.24Å; S413-T417 PolarHBondContact O-OG1 3.47Å; S413-T417 VanDerWaalsContact O-OG1 3.11Å; R414-T417 PolarHBondContact O-N 3.1Å; L415-T417 VanDerWaalsContact C-N 3.33Å; L415-T417 PolarHBondContact O-N 3.02Å; T417-Q420 PolarHBondContact O-N 3.2Å; T417-Q421 WeakPolarHBondContact O-CG 3.41Å; T417-Q421 PolarHBondContact O-N 3.03Å
418	V	78.5	Confident	75.4	Confident	77 Å²	77	107 Å²	107	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-64.1	-45.7	176.6	173.2	0	0	0	0	110.6	R414 L415 Q420 Q421 V422	R414-V418 WeakPolarHBondContact O-CG2 3.44Å; R414-V418 PolarHBondContact O-N 2.95Å; L415-V418 PolarHBondContact O-N 3.09Å; V418-Q420 VanDerWaalsContact C-N 3.27Å; V418-Q420 PolarHBondContact O-N 3.11Å; V418-Q421 PolarHBondContact O-N 3.05Å; V418-Q421 VanDerWaalsContact O-N 3.08Å; V418-V422 HydrophobicContact CG1-CG2 4.19Å; V418-V422 VanDerWaalsContact O-CG2 3.27Å; V418-V422 WeakPolarHBondContact O-CG2 3.3Å; V418-V422 PolarHBondContact O-N 2.75Å
419	E	76.8	Confident	73.9	Confident	110 Å²	110	107.7 Å²	107.7	51%	0.514	56%	0.563	S	S	.	*	H	α-helix	trans	-58.4	-38.3	175.3	-74.3	173.3	173.9	0	0	112.5	L415 N423	L415-E419 WeakPolarHBondContact O-CG 3.45Å; L415-E419 PolarHBondContact O-N 3.37Å; E419-N423 WeakPolarHBondContact O-CB 3.5Å; E419-N423 PolarHBondContact O-N 3.39Å; E419-N423 PolarHBondContact O-ND2 3.27Å
420	Q	76.4	Confident	72.3	Confident	129 Å²	129	102.8 Å²	102.8	60%	0.603	55%	0.549	S	S	*	.	H	α-helix	trans	-68.9	-36.1	175.3	-75.7	178.1	-16.2	0	0	112.8	K416 T417 V418 G424	K416-Q420 WeakPolarHBondContact O-CB 3.34Å; K416-Q420 VanDerWaalsContact O-CG 3.3Å; K416-Q420 WeakPolarHBondContact O-CG 3.44Å; K416-Q420 PolarHBondContact O-N 3.1Å; T417-Q420 PolarHBondContact O-N 3.2Å; V418-Q420 VanDerWaalsContact C-N 3.27Å; V418-Q420 PolarHBondContact O-N 3.11Å; Q420-G424 PolarHBondContact O-N 3.38Å
421	Q	74.5	Confident	70.5	Confident	106 Å²	106	105.2 Å²	105.2	50%	0.495	56%	0.561	S	S	.	*	H	α-helix	trans	-69.2	-41.8	175.3	-73.7	177.8	-39.3	0	0	111.5	T417 V418 G424 H425	T417-Q421 WeakPolarHBondContact O-CG 3.41Å; T417-Q421 PolarHBondContact O-N 3.03Å; V418-Q421 PolarHBondContact O-N 3.05Å; V418-Q421 VanDerWaalsContact O-N 3.08Å; Q421-G424 PolarHBondContact O-N 3.13Å; Q421-G424 VanDerWaalsContact O-N 3.13Å; Q421-H425 PolarHBondContact O-N 3.06Å
422	V	69.6	Low	68.6	Low	63 Å²	63	108.7 Å²	108.7	38%	0.382	58%	0.579	S	S	.	*	H	α-helix	trans	-64.8	-39.7	177.3	173.5	0	0	0	0	111.2	V418 G424 L430	V418-V422 HydrophobicContact CG1-CG2 4.19Å; V418-V422 VanDerWaalsContact O-CG2 3.27Å; V418-V422 WeakPolarHBondContact O-CG2 3.3Å; V418-V422 PolarHBondContact O-N 2.75Å; V422-G424 PolarHBondContact O-N 2.95Å; V422-L430 HydrophobicContact CG2-CD1 4.06Å
423	N	68.1	Low	66.5	Low	147 Å²	147	112.4 Å²	112.4	79%	0.786	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-14.4	175.9	-75.4	-27.2	0	0	0	113.7	E419	E419-N423 WeakPolarHBondContact O-CB 3.5Å; E419-N423 PolarHBondContact O-N 3.39Å; E419-N423 PolarHBondContact O-ND2 3.27Å
424	G	60.9	Low	65.5	Low	56 Å²	56	114.8 Å²	114.8	58%	0.577	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	-12.3	-178.2	0	0	0	0	0	115.1	Q420 Q421 V422	Q420-G424 PolarHBondContact O-N 3.38Å; Q421-G424 PolarHBondContact O-N 3.13Å; Q421-G424 VanDerWaalsContact O-N 3.13Å; V422-G424 PolarHBondContact O-N 2.95Å
425	H	53.2	Low	64.4	Low	112 Å²	112	111.4 Å²	111.4	52%	0.519	62%	0.615	S	S	.	*	S	Bend	trans	-133.7	135	-173.1	-76.1	-85	0	0	0	111.7	Q421	Q421-H425 PolarHBondContact O-N 3.06Å
426	D	53	Low	63.3	Low	134 Å²	134	111.7 Å²	111.7	72%	0.717	62%	0.618	S	S	*	*			trans	-57.9	135.3	171.9	-128.2	-23.2	0	0	0	109	S428 D429	D426-S428 PolarHBondContact O-N 3.07Å; D426-D429 PolarHBondContact O-N 3.22Å; D426-D429 VanDerWaalsContact O-N 3.15Å
427	L	56.3	Low	62.2	Low	138 Å²	138	110.6 Å²	110.6	72%	0.723	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-53.4	-20.5	-166.9	-97.7	99.3	0	0	0	114.7	D429	L427-D429 VanDerWaalsContact C-N 3.34Å; L427-D429 PolarHBondContact O-N 3.3Å
428	S	55.2	Low	61.1	Low	82 Å²	82	113.1 Å²	113.1	57%	0.573	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-68.3	-26.2	-178.6	55.9	0	0	0	0	114.6	D426 L430	D426-S428 PolarHBondContact O-N 3.07Å; S428-L430 VanDerWaalsContact C-N 3.32Å; S428-L430 PolarHBondContact O-N 3.26Å
429	D	56	Low	59.9	Low	112 Å²	112	115.5 Å²	115.5	60%	0.599	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-81.8	-12.3	-175.8	-72.1	-14.2	0	0	0	113.1	D426 L427	D426-D429 PolarHBondContact O-N 3.22Å; D426-D429 VanDerWaalsContact O-N 3.15Å; L427-D429 VanDerWaalsContact C-N 3.34Å; L427-D429 PolarHBondContact O-N 3.3Å
430	L	55.9	Low	58.7	Low	63 Å²	63	115.9 Å²	115.9	33%	0.33	65%	0.653	S	S	.	*	S	Bend	trans	-93.9	-16.9	-174.1	-94.1	146.5	0	0	0	114.7	V422 S428 N432 A433	V422-L430 HydrophobicContact CG2-CD1 4.06Å; S428-L430 VanDerWaalsContact C-N 3.32Å; S428-L430 PolarHBondContact O-N 3.26Å; L430-N432 PolarHBondContact O-N 3.4Å; L430-A433 PolarHBondContact O-N 3.27Å
431	E	49.5	Very low	57.3	Low	178 Å²	178	114.8 Å²	114.8	83%	0.832	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-19.8	-179.7	-76.7	-172.3	153.9	0	0	113.7
432	N	49.4	Very low	55.9	Low	167 Å²	167	115.6 Å²	115.6	89%	0.893	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-6.6	-179.5	-78.3	-41	0	0	0	114.8	L430	L430-N432 PolarHBondContact O-N 3.4Å
433	A	43.6	Very low	54.6	Low	135 Å²	135	120.4 Å²	120.4	100%	1.116	70%	0.697	S	S	*	*			trans	-106.6	0	-177.6	0	0	0	0	0	111.3	L430	L430-A433 PolarHBondContact O-N 3.27Å

Retrieved 433 of 433 residues in 346.7 ms (Link to these results)

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