A0A096M039_POEFO Loading...

Phospholipase A2

AlphaFold DB , UniProt , Accession A0A096M039, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 362 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	D	51.3	Low	47.1	Very low	184 Å²	184	71.6 Å²	71.6	98%	0.984	36%	0.356	S	S	*	.				0	106.3	0	-81.3	-41.3	0	0	0	111
2	C	46.3	Very low	46.9	Very low	9 Å²	9	69.4 Å²	69.4	6%	0.061	36%	0.357	C	S	.	.			trans	-97.8	-16	174.3	-92.1	0	0	0	0	113.8	G4 R28 C34 P35 R36	C2-G4 VanDerWaalsContact C-N 3.34Å; C2-G4 PolarHBondContact O-N 3.16Å; C2-R28 WeakPolarHBondContact SG-CD 3.4Å; C2-R28 VanDerWaalsContact SG-CZ 3.56Å; C2-R28 PolarHBondContact SG-NE 3.38Å; C2-C34 WeakPolarHBondContact CA-SG 3.41Å; C2-C34 HydrophobicContact CB-CB 3.48Å; C2-C34 VanDerWaalsContact CB-CB 3.48Å; C2-C34 WeakPolarHBondContact CB-SG 3.45Å; C2-C34 WeakPolarHBondContact O-CB 3.12Å; C2-C34 WeakPolarHBondContact SG-CB 3.1Å; C2-C34 CovalentContact SG-SG 2.04Å; C2-C34 PolarHBondContact SG-SG 3.35Å; C2-P35 WeakPolarHBondContact O-CD 3.42Å; C2-R36 PolarHBondContact O-N 2.86Å
3	L	50.7	Low	46.8	Very low	43 Å²	43	64.5 Å²	64.5	23%	0.225	33%	0.332	C	S	.	.	S	Bend	trans	-81.2	-11.8	-170.2	-70.1	168.3	0	0	0	114.1	F7 V24	L3-F7 HydrophobicContact CB-CD1 4.33Å; L3-F7 HydrophobicContact CB-CE1 3.51Å; L3-F7 HydrophobicContact CB-CE2 4.49Å; L3-F7 HydrophobicContact CB-CZ 3.59Å; L3-F7 HydrophobicContact CD1-CE1 3.86Å; L3-F7 HydrophobicContact CD1-CZ 4.02Å; L3-F7 HydrophobicContact CD2-CD1 4.44Å; L3-F7 HydrophobicContact CD2-CE1 3.81Å; L3-F7 HydrophobicContact CG-CE1 3.91Å; L3-F7 HydrophobicContact CG-CZ 4.27Å; L3-V24 HydrophobicContact CD2-CB 4.1Å; L3-V24 HydrophobicContact CD2-CG1 3.71Å; L3-V24 HydrophobicContact CD2-CG2 3.82Å; L3-V24 HydrophobicContact CG-CG1 4.5Å
4	G	41.1	Very low	47.1	Very low	18 Å²	18	60.3 Å²	60.3	19%	0.186	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	178.6	-178.2	0	0	0	0	0	112.9	C2	C2-G4 VanDerWaalsContact C-N 3.34Å; C2-G4 PolarHBondContact O-N 3.16Å
5	L	38.3	Very low	47.3	Very low	144 Å²	144	64.2 Å²	64.2	75%	0.754	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-14.2	-177.5	-73.6	166.7	0	0	0	112.8
6	R	46.3	Very low	47.6	Very low	183 Å²	183	61.4 Å²	61.4	69%	0.691	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.7	-2.6	-171.4	-56.9	-163.6	97.4	170.7	8.5	118.1	V8	R6-V8 HydrophobicContact CB-CG2 3.42Å; R6-V8 VanDerWaalsContact CB-CG2 3.42Å; R6-V8 WeakPolarHBondContact O-CG2 3.4Å; R6-V8 PolarHBondContact O-N 2.67Å
7	F	49.8	Very low	48	Very low	39 Å²	39	60.4 Å²	60.4	17%	0.171	31%	0.31	C	S	.	.			trans	52.5	16.6	169.2	-64.4	-95	0	0	0	116.4	L3 H11 F17 L20	L3-F7 HydrophobicContact CB-CD1 4.33Å; L3-F7 HydrophobicContact CB-CE1 3.51Å; L3-F7 HydrophobicContact CB-CE2 4.49Å; L3-F7 HydrophobicContact CB-CZ 3.59Å; L3-F7 HydrophobicContact CD1-CE1 3.86Å; L3-F7 HydrophobicContact CD1-CZ 4.02Å; L3-F7 HydrophobicContact CD2-CD1 4.44Å; L3-F7 HydrophobicContact CD2-CE1 3.81Å; L3-F7 HydrophobicContact CG-CE1 3.91Å; L3-F7 HydrophobicContact CG-CZ 4.27Å; F7-H11 PolarHBondContact O-CD2 2.92Å; F7-F17 HydrophobicContact CE1-CE2 4.2Å; F7-L20 HydrophobicContact CD1-CD2 4.31Å
8	V	52.6	Low	48.7	Very low	46 Å²	46	58.1 Å²	58.1	28%	0.279	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-42.8	-152.8	-156.8	0	0	0	0	113.4	R6 L10 H47	R6-V8 HydrophobicContact CB-CG2 3.42Å; R6-V8 VanDerWaalsContact CB-CG2 3.42Å; R6-V8 WeakPolarHBondContact O-CG2 3.4Å; R6-V8 PolarHBondContact O-N 2.67Å; V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.65Å; V8-H47 HydrophobicContact CB-CB 4.45Å; V8-H47 HydrophobicContact CG1-CB 3.67Å; V8-H47 PolarHBondContact O-CD2 2.62Å; V8-H47 VanDerWaalsContact O-CD2 3.24Å
9	W	46	Very low	49.5	Very low	5 Å²	5	55.1 Å²	55.1	2%	0.019	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-73.2	-26.1	-174.1	76.7	-88.6	0	0	0	114.3	A12 F23 P35 L38 R46	W9-A12 PolarHBondContact O-N 3.02Å; W9-F23 HydrophobicContact CH2-CE1 4.27Å; W9-P35 PolarHBondContact NE1-O 2.7Å; W9-L38 HydrophobicContact CZ2-CB 4.38Å; W9-R46 VanDerWaalsContact CB-C 3.43Å
10	L	49	Very low	50.6	Low	4 Å²	4	52.6 Å²	52.6	2%	0.021	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-79.5	-21.3	-177.9	-78.2	156.8	0	0	0	113.1	V8 A12 V13 F14 L20 F23 V24 P35	V8-L10 VanDerWaalsContact C-N 3.34Å; V8-L10 PolarHBondContact O-N 2.65Å; L10-A12 PolarHBondContact O-N 3.43Å; L10-V13 PolarHBondContact O-N 3.21Å; L10-V13 VanDerWaalsContact O-N 3.16Å; L10-F14 HydrophobicContact CB-CD2 4.35Å; L10-F14 HydrophobicContact CD2-CD2 3.55Å; L10-F14 HydrophobicContact CD2-CE2 3.36Å; L10-F14 PolarHBondContact O-N 2.55Å; L10-L20 HydrophobicContact CB-CD1 3.36Å; L10-L20 HydrophobicContact CD1-CD1 3.49Å; L10-L20 VanDerWaalsContact CD1-CD1 3.49Å; L10-L20 HydrophobicContact CD2-CD1 3.67Å; L10-L20 HydrophobicContact CG-CD1 3.65Å; L10-F23 HydrophobicContact CD2-CD1 4.01Å; L10-F23 HydrophobicContact CD2-CE1 4.07Å; L10-V24 HydrophobicContact CD1-CG2 4.22Å; L10-P35 HydrophobicContact CD1-CB 3.67Å; L10-P35 HydrophobicContact CD1-CG 4.08Å
11	H	46.4	Very low	51.4	Low	113 Å²	113	52.2 Å²	52.2	52%	0.523	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-65.3	-21.9	171	-85	-71.4	0	0	0	113.4	F7 V13	F7-H11 PolarHBondContact O-CD2 2.92Å; H11-V13 VanDerWaalsContact C-N 3.34Å
12	A	45.2	Very low	52.4	Low	45 Å²	45	44.7 Å²	44.7	37%	0.372	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-84.1	-8.9	175.2	0	0	0	0	0	113.5	W9 L10 H47	W9-A12 PolarHBondContact O-N 3.02Å; L10-A12 PolarHBondContact O-N 3.43Å; A12-H47 VanDerWaalsContact CB-O 3.29Å; A12-H47 WeakPolarHBondContact CB-O 3.33Å
13	V	45.9	Very low	53.9	Low	6 Å²	6	44.3 Å²	44.3	4%	0.036	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-36	-177	-176.9	0	0	0	0	111.3	L10 H11 Y68 Q76	L10-V13 PolarHBondContact O-N 3.21Å; L10-V13 VanDerWaalsContact O-N 3.16Å; H11-V13 VanDerWaalsContact C-N 3.34Å; V13-Y68 HydrophobicContact CG1-CD1 3.9Å; V13-Y68 HydrophobicContact CG1-CD2 3.9Å; V13-Y68 HydrophobicContact CG1-CE1 4.27Å; V13-Y68 HydrophobicContact CG1-CE2 4.31Å; V13-Y68 HydrophobicContact CG1-CG 3.7Å; V13-Y68 WeakPolarHBondContact O-CD1 3.49Å; V13-Y68 WeakPolarHBondContact O-CE1 3.43Å; V13-Q76 PolarHBondContact O-NE2 3.15Å
14	F	50.3	Low	55.2	Low	5 Å²	5	42.5 Å²	42.5	2%	0.022	22%	0.22	C	C	.	.			trans	-116.1	116	-177.9	-63.1	-83.1	0	0	0	111.1	L10 N16 S19 L20 F23 H64 Y68 D108	L10-F14 HydrophobicContact CB-CD2 4.35Å; L10-F14 HydrophobicContact CD2-CD2 3.55Å; L10-F14 HydrophobicContact CD2-CE2 3.36Å; L10-F14 PolarHBondContact O-N 2.55Å; F14-N16 PolarHBondContact O-N 3.23Å; F14-S19 VanDerWaalsContact CD1-CB 3.46Å; F14-L20 HydrophobicContact CB-CB 4.13Å; F14-L20 HydrophobicContact CD2-CD1 4Å; F14-L20 HydrophobicContact CG-CB 4.26Å; F14-F23 HydrophobicContact CE1-CB 4.11Å; F14-F23 HydrophobicContact CE2-CB 4.16Å; F14-F23 AromaticContact CE2-CD1 4Å; F14-F23 HydrophobicContact CE2-CD1 4Å; F14-F23 HydrophobicContact CE2-CG 4.01Å; F14-F23 HydrophobicContact CZ-CB 3.53Å; F14-F23 HydrophobicContact CZ-CD1 4.07Å; F14-F23 AromaticContact CZ-CD2 3.99Å; F14-F23 HydrophobicContact CZ-CD2 3.99Å; F14-F23 AromaticContact CZ-CG 3.59Å; F14-F23 HydrophobicContact CZ-CG 3.59Å; F14-H64 AromaticContact CE2-CE1 3.81Å; F14-H64 AromaticContact CZ-CE1 3.75Å; F14-Y68 AromaticContact CD1-CE1 3.9Å; F14-Y68 HydrophobicContact CD1-CE1 3.9Å; F14-Y68 AromaticContact CE1-CE1 3.83Å; F14-Y68 HydrophobicContact CE1-CE1 3.83Å; F14-Y68 AromaticContact CE1-CZ 3.58Å; F14-Y68 WeakPolarHBondContact CE1-OH 3.46Å; F14-Y68 HydrophobicContact CZ-CE1 4.49Å; F14-D108 VanDerWaalsContact CZ-OD1 3.26Å; F14-D108 WeakPolarHBondContact CZ-OD1 3.45Å
15	D	50.2	Low	56.8	Low	119 Å²	119	43.1 Å²	43.1	64%	0.636	22%	0.221	S	C	*	.	S	Bend	trans	-79.3	-6.5	174.3	-56.9	-43.8	0	0	0	112.6	Q76 Q304	D15-Q76 HydrophobicContact CB-CG 4.48Å; D15-Q304 PolarHBondContact O-NE2 3Å
16	N	52.8	Low	58.8	Low	19 Å²	19	39.3 Å²	39.3	10%	0.102	20%	0.197	C	C	.	.	S	Bend	trans	-139.9	141	179.9	81.9	90	0	0	0	112.8	F14 P18 S19 L20 Q76	F14-N16 PolarHBondContact O-N 3.23Å; N16-P18 WeakPolarHBondContact OD1-CB 3.4Å; N16-P18 VanDerWaalsContact OD1-CD 3.26Å; N16-P18 WeakPolarHBondContact OD1-CD 3.15Å; N16-S19 WeakPolarHBondContact ND2-CB 3.43Å; N16-S19 PolarHBondContact ND2-OG 3.3Å; N16-S19 PolarHBondContact OD1-N 3.01Å; N16-S19 PolarHBondContact OD1-OG 3.27Å; N16-S19 VanDerWaalsContact OD1-OG 3.13Å; N16-L20 PolarHBondContact O-N 2.75Å; N16-Q76 WeakPolarHBondContact ND2-CB 3.49Å; N16-Q76 PolarHBondContact ND2-O 3.01Å; N16-Q76 PolarHBondContact ND2-OE1 3.46Å
17	F	54.4	Low	60.5	Low	44 Å²	44	30.6 Å²	30.6	19%	0.193	16%	0.164	C	C	.	.	H	α-helix	trans	-68.4	-31.2	-176.7	-170.9	-93.1	0	0	0	114.5	F7 L20 L21 M308 L339	F7-F17 HydrophobicContact CE1-CE2 4.2Å; F17-L20 HydrophobicContact CD2-CD2 4.05Å; F17-L20 HydrophobicContact CE2-CD2 4.42Å; F17-L20 WeakPolarHBondContact O-CB 3.13Å; F17-L20 PolarHBondContact O-N 3.45Å; F17-L21 HydrophobicContact CE1-CB 4.43Å; F17-L21 HydrophobicContact CE1-CD2 4.3Å; F17-L21 WeakPolarHBondContact O-CB 3.45Å; F17-L21 PolarHBondContact O-N 2.6Å; F17-M308 HydrophobicContact CB-CE 3.9Å; F17-M308 HydrophobicContact CB-SD 3.64Å; F17-M308 HydrophobicContact CG-CE 4.48Å; F17-L339 HydrophobicContact CD1-CD2 3.55Å; F17-L339 HydrophobicContact CE1-CD2 3.19Å; F17-L339 HydrophobicContact CZ-CD2 4.04Å
18	P	60	Low	61.9	Low	20 Å²	20	35.2 Å²	35.2	13%	0.13	18%	0.18	C	C	.	.	H	α-helix	trans	-56.6	-50.2	171.9	-34.7	36.6	0	0	0	113.7	N16 L20 L21 S22 M308	N16-P18 WeakPolarHBondContact OD1-CB 3.4Å; N16-P18 VanDerWaalsContact OD1-CD 3.26Å; N16-P18 WeakPolarHBondContact OD1-CD 3.15Å; P18-L20 VanDerWaalsContact C-N 3.33Å; P18-L21 PolarHBondContact O-N 3.05Å; P18-S22 VanDerWaalsContact O-CB 3.27Å; P18-S22 WeakPolarHBondContact O-CB 3.42Å; P18-S22 PolarHBondContact O-N 2.84Å; P18-M308 WeakPolarHBondContact CD-SD 3.4Å; P18-M308 HydrophobicContact CG-SD 3.91Å
19	S	64.8	Low	63.2	Low	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-43.3	176.5	-64	0	0	0	0	111.3	F14 N16 S22 F23 L78	F14-S19 VanDerWaalsContact CD1-CB 3.46Å; N16-S19 WeakPolarHBondContact ND2-CB 3.43Å; N16-S19 PolarHBondContact ND2-OG 3.3Å; N16-S19 PolarHBondContact OD1-N 3.01Å; N16-S19 PolarHBondContact OD1-OG 3.27Å; N16-S19 VanDerWaalsContact OD1-OG 3.13Å; S19-S22 WeakPolarHBondContact O-CB 3.46Å; S19-S22 PolarHBondContact O-N 3.35Å; S19-F23 WeakPolarHBondContact O-CB 3.45Å; S19-F23 PolarHBondContact O-N 3.27Å; S19-L78 WeakPolarHBondContact OG-CB 3.43Å; S19-L78 WeakPolarHBondContact OG-CD1 3.29Å; S19-L78 WeakPolarHBondContact OG-CD2 3.05Å
20	L	70.8	Confident	64.9	Low	5 Å²	5	38.1 Å²	38.1	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-56.1	-55.5	174	175.5	59.1	0	0	0	111.2	F7 L10 F14 N16 F17 P18 S22 F23 V24	F7-L20 HydrophobicContact CD1-CD2 4.31Å; L10-L20 HydrophobicContact CB-CD1 3.36Å; L10-L20 HydrophobicContact CD1-CD1 3.49Å; L10-L20 VanDerWaalsContact CD1-CD1 3.49Å; L10-L20 HydrophobicContact CD2-CD1 3.67Å; L10-L20 HydrophobicContact CG-CD1 3.65Å; F14-L20 HydrophobicContact CB-CB 4.13Å; F14-L20 HydrophobicContact CD2-CD1 4Å; F14-L20 HydrophobicContact CG-CB 4.26Å; N16-L20 PolarHBondContact O-N 2.75Å; F17-L20 HydrophobicContact CD2-CD2 4.05Å; F17-L20 HydrophobicContact CE2-CD2 4.42Å; F17-L20 WeakPolarHBondContact O-CB 3.13Å; F17-L20 PolarHBondContact O-N 3.45Å; P18-L20 VanDerWaalsContact C-N 3.33Å; L20-S22 VanDerWaalsContact C-N 3.27Å; L20-S22 PolarHBondContact O-N 3.1Å; L20-F23 PolarHBondContact O-N 2.66Å; L20-V24 HydrophobicContact CD1-CG2 4.01Å; L20-V24 HydrophobicContact CG-CG2 4.49Å; L20-V24 VanDerWaalsContact O-CG2 3.25Å; L20-V24 WeakPolarHBondContact O-CG2 3.41Å; L20-V24 PolarHBondContact O-N 2.88Å
21	L	67.1	Low	66.3	Low	44 Å²	44	39.6 Å²	39.6	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-37.1	-178.1	-173.8	63.2	0	0	0	111.9	F17 P18 S25 P81 F85	F17-L21 HydrophobicContact CE1-CB 4.43Å; F17-L21 HydrophobicContact CE1-CD2 4.3Å; F17-L21 WeakPolarHBondContact O-CB 3.45Å; F17-L21 PolarHBondContact O-N 2.6Å; P18-L21 PolarHBondContact O-N 3.05Å; L21-S25 VanDerWaalsContact O-CB 3.29Å; L21-S25 WeakPolarHBondContact O-CB 3.3Å; L21-S25 PolarHBondContact O-N 3.46Å; L21-S25 PolarHBondContact O-OG 2.86Å; L21-P81 HydrophobicContact CD2-CG 4.25Å; L21-F85 HydrophobicContact CD2-CE2 4.34Å; L21-F85 HydrophobicContact CD2-CZ 3.83Å; L21-F85 HydrophobicContact CG-CE1 4.45Å; L21-F85 HydrophobicContact CG-CZ 4Å
22	S	71.9	Confident	67.8	Low	27 Å²	27	36.8 Å²	36.8	19%	0.189	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-49.4	173.8	-177.5	0	0	0	0	111.8	P18 S19 L20 S25 R26	P18-S22 VanDerWaalsContact O-CB 3.27Å; P18-S22 WeakPolarHBondContact O-CB 3.42Å; P18-S22 PolarHBondContact O-N 2.84Å; S19-S22 WeakPolarHBondContact O-CB 3.46Å; S19-S22 PolarHBondContact O-N 3.35Å; L20-S22 VanDerWaalsContact C-N 3.27Å; L20-S22 PolarHBondContact O-N 3.1Å; S22-S25 PolarHBondContact O-N 3.34Å; S22-R26 WeakPolarHBondContact O-CB 3.21Å; S22-R26 WeakPolarHBondContact O-CG 3.48Å; S22-R26 PolarHBondContact O-N 3.37Å; S22-R26 PolarHBondContact O-NE 3.41Å; S22-R26 VanDerWaalsContact OG-CZ 3.26Å; S22-R26 PolarHBondContact OG-NE 3Å; S22-R26 PolarHBondContact OG-NH2 2.74Å
23	F	78.9	Confident	69.4	Low	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.1	-49.6	175.7	175.7	-98.9	0	0	0	111.7	W9 L10 F14 S19 L20 S25 R26 L27 H64 D108 A111 I112 L115	W9-F23 HydrophobicContact CH2-CE1 4.27Å; L10-F23 HydrophobicContact CD2-CD1 4.01Å; L10-F23 HydrophobicContact CD2-CE1 4.07Å; F14-F23 HydrophobicContact CE1-CB 4.11Å; F14-F23 HydrophobicContact CE2-CB 4.16Å; F14-F23 AromaticContact CE2-CD1 4Å; F14-F23 HydrophobicContact CE2-CD1 4Å; F14-F23 HydrophobicContact CE2-CG 4.01Å; F14-F23 HydrophobicContact CZ-CB 3.53Å; F14-F23 HydrophobicContact CZ-CD1 4.07Å; F14-F23 AromaticContact CZ-CD2 3.99Å; F14-F23 HydrophobicContact CZ-CD2 3.99Å; F14-F23 AromaticContact CZ-CG 3.59Å; F14-F23 HydrophobicContact CZ-CG 3.59Å; S19-F23 WeakPolarHBondContact O-CB 3.45Å; S19-F23 PolarHBondContact O-N 3.27Å; L20-F23 PolarHBondContact O-N 2.66Å; F23-S25 VanDerWaalsContact C-N 3.32Å; F23-S25 PolarHBondContact O-N 2.79Å; F23-R26 PolarHBondContact O-N 3.48Å; F23-L27 HydrophobicContact CE1-CD2 4.07Å; F23-L27 HydrophobicContact CZ-CD2 4.38Å; F23-L27 WeakPolarHBondContact O-CB 3.15Å; F23-L27 PolarHBondContact O-N 3.31Å; F23-H64 AromaticContact CE2-CE1 3.82Å; F23-H64 AromaticContact CE2-NE2 3.99Å; F23-H64 AromaticContact CZ-CE1 3.98Å; F23-D108 HydrophobicContact CD2-CB 3.99Å; F23-D108 VanDerWaalsContact CD2-OD1 3.32Å; F23-D108 WeakPolarHBondContact CD2-OD1 3.36Å; F23-A111 HydrophobicContact CE2-CB 4.06Å; F23-I112 HydrophobicContact CD2-CD1 4.03Å; F23-I112 HydrophobicContact CD2-CG1 4.1Å; F23-I112 HydrophobicContact CE2-CD1 4.18Å; F23-I112 HydrophobicContact CE2-CG1 3.72Å; F23-I112 HydrophobicContact CZ-CG1 4.42Å; F23-L115 HydrophobicContact CZ-CD1 4.29Å
24	V	77.6	Confident	70.9	Confident	6 Å²	6	36.9 Å²	36.9	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-60.3	-42.6	-179.7	172.4	0	0	0	0	111.9	L3 L10 L20 R28 P35	L3-V24 HydrophobicContact CD2-CB 4.1Å; L3-V24 HydrophobicContact CD2-CG1 3.71Å; L3-V24 HydrophobicContact CD2-CG2 3.82Å; L3-V24 HydrophobicContact CG-CG1 4.5Å; L10-V24 HydrophobicContact CD1-CG2 4.22Å; L20-V24 HydrophobicContact CD1-CG2 4.01Å; L20-V24 HydrophobicContact CG-CG2 4.49Å; L20-V24 VanDerWaalsContact O-CG2 3.25Å; L20-V24 WeakPolarHBondContact O-CG2 3.41Å; L20-V24 PolarHBondContact O-N 2.88Å; V24-R28 WeakPolarHBondContact O-CB 3.42Å; V24-R28 PolarHBondContact O-N 3.11Å; V24-P35 HydrophobicContact CB-CG 3.92Å; V24-P35 HydrophobicContact CG1-CG 3.51Å; V24-P35 HydrophobicContact CG2-CB 4.39Å; V24-P35 HydrophobicContact CG2-CG 3.32Å
25	S	75.3	Confident	72	Confident	30 Å²	30	36.9 Å²	36.9	21%	0.21	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-45.1	-180	-58.8	0	0	0	0	111	L21 S22 F23 R28 C29 F85	L21-S25 VanDerWaalsContact O-CB 3.29Å; L21-S25 WeakPolarHBondContact O-CB 3.3Å; L21-S25 PolarHBondContact O-N 3.46Å; L21-S25 PolarHBondContact O-OG 2.86Å; S22-S25 PolarHBondContact O-N 3.34Å; F23-S25 VanDerWaalsContact C-N 3.32Å; F23-S25 PolarHBondContact O-N 2.79Å; S25-R28 PolarHBondContact O-N 3.45Å; S25-C29 PolarHBondContact O-N 3.23Å; S25-C29 PolarHBondContact O-SG 2.91Å; S25-C29 VanDerWaalsContact O-SG 3.35Å; S25-F85 WeakPolarHBondContact OG-CD1 3.45Å; S25-F85 VanDerWaalsContact OG-CE1 3.28Å; S25-F85 WeakPolarHBondContact OG-CE1 3.4Å
26	R	78.5	Confident	72.9	Confident	65 Å²	65	37.2 Å²	37.2	25%	0.245	21%	0.206	C	C	.	.	H	α-helix	trans	-66.5	-42.7	178.1	-69.4	-177.3	-70.7	-163.9	3.7	112.2	S22 F23 R28 C29 A30 D108 I112	S22-R26 WeakPolarHBondContact O-CB 3.21Å; S22-R26 WeakPolarHBondContact O-CG 3.48Å; S22-R26 PolarHBondContact O-N 3.37Å; S22-R26 PolarHBondContact O-NE 3.41Å; S22-R26 VanDerWaalsContact OG-CZ 3.26Å; S22-R26 PolarHBondContact OG-NE 3Å; S22-R26 PolarHBondContact OG-NH2 2.74Å; F23-R26 PolarHBondContact O-N 3.48Å; R26-R28 PolarHBondContact O-N 3.29Å; R26-C29 PolarHBondContact O-N 3.39Å; R26-A30 VanDerWaalsContact O-CB 3.32Å; R26-A30 WeakPolarHBondContact O-CB 3.19Å; R26-A30 PolarHBondContact O-N 2.76Å; R26-D108 IonicContact NH2-OD2 2.85Å; R26-D108 PolarHBondContact NH2-OD2 3.37Å; R26-I112 HydrophobicContact CB-CD1 3.51Å
27	L	82.1	Confident	73.9	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.3	-48.5	175.5	178.8	63.8	0	0	0	111.1	F23 C29 A30 S31 L33 L38 I112 L115	F23-L27 HydrophobicContact CE1-CD2 4.07Å; F23-L27 HydrophobicContact CZ-CD2 4.38Å; F23-L27 WeakPolarHBondContact O-CB 3.15Å; F23-L27 PolarHBondContact O-N 3.31Å; L27-C29 PolarHBondContact O-N 3.05Å; L27-A30 PolarHBondContact O-N 3.39Å; L27-S31 WeakPolarHBondContact CD1-OG 3.43Å; L27-S31 PolarHBondContact O-N 3.29Å; L27-S31 PolarHBondContact O-OG 3.22Å; L27-L33 HydrophobicContact CG-CB 4.45Å; L27-L38 HydrophobicContact CD2-CD1 4.44Å; L27-I112 HydrophobicContact CB-CG1 4.17Å; L27-I112 HydrophobicContact CD1-CG1 4.28Å; L27-L115 HydrophobicContact CD1-CB 4Å; L27-L115 HydrophobicContact CD1-CD1 3.76Å; L27-L115 HydrophobicContact CD2-CD1 4.29Å
28	R	79.3	Confident	75	Confident	136 Å²	136	36.8 Å²	36.8	51%	0.513	21%	0.206	S	C	.	.	H	α-helix	trans	-62.2	-44.6	179.4	-171.7	-171.3	-174.3	168	-3.8	111.8	C2 V24 S25 R26 G32 L33	C2-R28 WeakPolarHBondContact SG-CD 3.4Å; C2-R28 VanDerWaalsContact SG-CZ 3.56Å; C2-R28 PolarHBondContact SG-NE 3.38Å; V24-R28 WeakPolarHBondContact O-CB 3.42Å; V24-R28 PolarHBondContact O-N 3.11Å; S25-R28 PolarHBondContact O-N 3.45Å; R26-R28 PolarHBondContact O-N 3.29Å; R28-G32 WeakPolarHBondContact O-CA 3.26Å; R28-G32 PolarHBondContact O-N 3.23Å; R28-L33 WeakPolarHBondContact CA-O 3.45Å
29	C	80	Confident	75.7	Confident	55 Å²	55	37.2 Å²	37.2	37%	0.372	21%	0.206	S	C	.	.	H	α-helix	trans	-67	-37.5	179.2	-66.9	0	0	0	0	112.1	S25 R26 L27 C87	S25-C29 PolarHBondContact O-N 3.23Å; S25-C29 PolarHBondContact O-SG 2.91Å; S25-C29 VanDerWaalsContact O-SG 3.35Å; R26-C29 PolarHBondContact O-N 3.39Å; L27-C29 PolarHBondContact O-N 3.05Å; C29-C87 HydrophobicContact CB-CB 3.85Å; C29-C87 WeakPolarHBondContact CB-SG 3.39Å; C29-C87 VanDerWaalsContact SG-CA 3.54Å; C29-C87 WeakPolarHBondContact SG-CB 3.35Å; C29-C87 CovalentContact SG-SG 2.07Å; C29-C87 PolarHBondContact SG-SG 3.3Å
30	A	81.4	Confident	76.4	Confident	57 Å²	57	40.4 Å²	40.4	47%	0.471	22%	0.223	S	C	.	.	H	α-helix	trans	-79.2	-37.2	-176.3	0	0	0	0	0	113.9	R26 L27 I112	R26-A30 VanDerWaalsContact O-CB 3.32Å; R26-A30 WeakPolarHBondContact O-CB 3.19Å; R26-A30 PolarHBondContact O-N 2.76Å; L27-A30 PolarHBondContact O-N 3.39Å; A30-I112 HydrophobicContact CB-CG2 3.58Å
31	S	80.3	Confident	77	Confident	35 Å²	35	40.1 Å²	40.1	25%	0.245	22%	0.222	C	C	.	.	H	α-helix	trans	-120.6	-15.8	-170.1	68.6	0	0	0	0	114.6	L27 L33	L27-S31 WeakPolarHBondContact CD1-OG 3.43Å; L27-S31 PolarHBondContact O-N 3.29Å; L27-S31 PolarHBondContact O-OG 3.22Å; S31-L33 PolarHBondContact O-N 2.72Å; S31-L33 VanDerWaalsContact OG-CB 3.28Å; S31-L33 WeakPolarHBondContact OG-CB 3.09Å; S31-L33 WeakPolarHBondContact OG-CG 3.16Å; S31-L33 PolarHBondContact OG-N 3.47Å; S31-L33 VanDerWaalsContact OG-N 3.09Å
32	G	76.9	Confident	78	Confident	54 Å²	54	38 Å²	38	56%	0.557	21%	0.211	S	C	*	.			trans	73	-6.8	-167.5	0	0	0	0	0	114.5	R28	R28-G32 WeakPolarHBondContact O-CA 3.26Å; R28-G32 PolarHBondContact O-N 3.23Å
33	L	79	Confident	78.9	Confident	32 Å²	32	36.8 Å²	36.8	17%	0.168	20%	0.202	C	C	.	.			trans	-70.8	138.9	178.4	-61.7	171.7	0	0	0	111.1	L27 R28 S31 L115 C120	L27-L33 HydrophobicContact CG-CB 4.45Å; R28-L33 WeakPolarHBondContact CA-O 3.45Å; S31-L33 PolarHBondContact O-N 2.72Å; S31-L33 VanDerWaalsContact OG-CB 3.28Å; S31-L33 WeakPolarHBondContact OG-CB 3.09Å; S31-L33 WeakPolarHBondContact OG-CG 3.16Å; S31-L33 PolarHBondContact OG-N 3.47Å; S31-L33 VanDerWaalsContact OG-N 3.09Å; L33-L115 HydrophobicContact CD1-CB 4.42Å; L33-C120 HydrophobicContact CD2-CB 4.41Å
34	C	76.5	Confident	79.4	Confident	21 Å²	21	37 Å²	37	14%	0.142	20%	0.204	C	C	.	.			trans	-99	144.6	167.5	-63.8	0	0	0	0	110.2	C2 R36 D37	C2-C34 WeakPolarHBondContact CA-SG 3.41Å; C2-C34 HydrophobicContact CB-CB 3.48Å; C2-C34 VanDerWaalsContact CB-CB 3.48Å; C2-C34 WeakPolarHBondContact CB-SG 3.45Å; C2-C34 WeakPolarHBondContact O-CB 3.12Å; C2-C34 WeakPolarHBondContact SG-CB 3.1Å; C2-C34 CovalentContact SG-SG 2.04Å; C2-C34 PolarHBondContact SG-SG 3.35Å; C34-R36 HydrophobicContact CB-CB 4.48Å; C34-R36 PolarHBondContact O-N 2.93Å; C34-R36 VanDerWaalsContact O-N 3.1Å; C34-D37 VanDerWaalsContact CB-OD2 3.26Å; C34-D37 WeakPolarHBondContact CB-OD2 3.31Å; C34-D37 PolarHBondContact N-OD2 3.4Å; C34-D37 VanDerWaalsContact O-CB 3.32Å; C34-D37 WeakPolarHBondContact O-CB 3.28Å; C34-D37 PolarHBondContact O-N 2.94Å
35	P	74	Confident	79.8	Confident	4 Å²	4	36.7 Å²	36.7	3%	0.026	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-49.1	-34.8	169.5	-32.5	35.7	0	0	0	115.4	C2 W9 L10 V24 D37 L38 E39	C2-P35 WeakPolarHBondContact O-CD 3.42Å; W9-P35 PolarHBondContact NE1-O 2.7Å; L10-P35 HydrophobicContact CD1-CB 3.67Å; L10-P35 HydrophobicContact CD1-CG 4.08Å; V24-P35 HydrophobicContact CB-CG 3.92Å; V24-P35 HydrophobicContact CG1-CG 3.51Å; V24-P35 HydrophobicContact CG2-CB 4.39Å; V24-P35 HydrophobicContact CG2-CG 3.32Å; P35-D37 PolarHBondContact O-N 3.09Å; P35-L38 CarbonylContact O-C 3.11Å; P35-L38 PolarHBondContact O-N 2.63Å; P35-L38 VanDerWaalsContact O-N 3.14Å; P35-E39 PolarHBondContact O-N 2.04Å; P35-E39 VanDerWaalsContact O-N 3.14Å
36	R	70.3	Confident	80.1	Confident	126 Å²	126	36 Å²	36	48%	0.475	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-57.5	-33.3	173.7	-175.5	-172.9	175.2	-125.3	0	113	C2 C34 L38 E39 R125	C2-R36 PolarHBondContact O-N 2.86Å; C34-R36 HydrophobicContact CB-CB 4.48Å; C34-R36 PolarHBondContact O-N 2.93Å; C34-R36 VanDerWaalsContact O-N 3.1Å; R36-L38 PolarHBondContact O-N 2.88Å; R36-E39 WeakPolarHBondContact O-CB 3.49Å; R36-E39 PolarHBondContact O-N 2.77Å; R36-R125 PolarHBondContact O-NH2 3.34Å
37	D	73.3	Confident	79.6	Confident	54 Å²	54	37.2 Å²	37.2	29%	0.289	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-75.2	-22.1	-178.3	-53.2	-37.6	0	0	0	111.3	C34 P35 R125	C34-D37 VanDerWaalsContact CB-OD2 3.26Å; C34-D37 WeakPolarHBondContact CB-OD2 3.31Å; C34-D37 PolarHBondContact N-OD2 3.4Å; C34-D37 VanDerWaalsContact O-CB 3.32Å; C34-D37 WeakPolarHBondContact O-CB 3.28Å; C34-D37 PolarHBondContact O-N 2.94Å; P35-D37 PolarHBondContact O-N 3.09Å; D37-R125 WeakPolarHBondContact O-CD 3.35Å
38	L	76.3	Confident	79.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-100	1.8	177.5	-55.9	-177.4	0	0	0	112.9	W9 L27 P35 R36 D40 Y41 C45 L57 L115	W9-L38 HydrophobicContact CZ2-CB 4.38Å; L27-L38 HydrophobicContact CD2-CD1 4.44Å; P35-L38 CarbonylContact O-C 3.11Å; P35-L38 PolarHBondContact O-N 2.63Å; P35-L38 VanDerWaalsContact O-N 3.14Å; R36-L38 PolarHBondContact O-N 2.88Å; L38-D40 PolarHBondContact O-N 3.19Å; L38-Y41 VanDerWaalsContact O-CB 3.31Å; L38-Y41 WeakPolarHBondContact O-CB 3.45Å; L38-Y41 PolarHBondContact O-N 3.27Å; L38-C45 VanDerWaalsContact O-O 3.05Å; L38-L57 HydrophobicContact CD2-CD1 3.99Å; L38-L57 HydrophobicContact CD2-CD2 3.67Å; L38-L57 HydrophobicContact CD2-CG 4.46Å; L38-L115 HydrophobicContact CD1-CD1 4.13Å; L38-L115 HydrophobicContact CD1-CD2 4.08Å
39	E	75.9	Confident	79.2	Confident	29 Å²	29	37.4 Å²	37.4	14%	0.136	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	121.2	178.9	-172.8	169.4	-149.5	0	0	110.3	P35 R36 Y41 R125	P35-E39 PolarHBondContact O-N 2.04Å; P35-E39 VanDerWaalsContact O-N 3.14Å; R36-E39 WeakPolarHBondContact O-CB 3.49Å; R36-E39 PolarHBondContact O-N 2.77Å; E39-Y41 PolarHBondContact O-N 3.08Å; E39-R125 PolarHBondContact O-NE 3.34Å; E39-R125 PolarHBondContact O-NH2 2.98Å
40	D	78.3	Confident	79.1	Confident	68 Å²	68	35.5 Å²	35.5	36%	0.364	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	35.1	-173.1	-60.9	-40.9	0	0	0	113.4	L38 C45 R125 G126	L38-D40 PolarHBondContact O-N 3.19Å; D40-C45 WeakPolarHBondContact CA-O 3.32Å; D40-C45 PolarHBondContact N-O 3.5Å; D40-R125 CarbonylContact O-C 3.24Å; D40-R125 WeakPolarHBondContact O-CA 3.1Å; D40-G126 PolarHBondContact O-N 2.89Å
41	Y	84.8	Confident	79.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-81	130.4	175.6	-176.1	-77.5	0	0	0	111.1	L38 E39 C45 D55 L57 D58 N121 L124 R125	L38-Y41 VanDerWaalsContact O-CB 3.31Å; L38-Y41 WeakPolarHBondContact O-CB 3.45Å; L38-Y41 PolarHBondContact O-N 3.27Å; E39-Y41 PolarHBondContact O-N 3.08Å; Y41-C45 PolarHBondContact N-O 3.26Å; Y41-C45 WeakPolarHBondContact O-CA 3.21Å; Y41-C45 WeakPolarHBondContact O-CB 2.98Å; Y41-C45 PolarHBondContact O-N 2.91Å; Y41-D55 WeakPolarHBondContact CE1-OD1 3.04Å; Y41-D55 PolarHBondContact OH-OD2 3.19Å; Y41-L57 HydrophobicContact CD1-CD2 3.53Å; Y41-L57 HydrophobicContact CE1-CB 3.97Å; Y41-L57 HydrophobicContact CE1-CD2 3.45Å; Y41-L57 VanDerWaalsContact CE1-CD2 3.45Å; Y41-L57 HydrophobicContact CE1-CG 4.21Å; Y41-L57 HydrophobicContact CE2-CD2 4.47Å; Y41-L57 HydrophobicContact CG-CD2 4.13Å; Y41-D58 HydrophobicContact CE1-CB 4.32Å; Y41-N121 WeakPolarHBondContact CE2-O 3.05Å; Y41-N121 PolarHBondContact OH-N 3.38Å; Y41-L124 HydrophobicContact CD2-CB 4.48Å; Y41-L124 HydrophobicContact CE1-CB 4.35Å; Y41-L124 HydrophobicContact CE1-CD1 4.31Å; Y41-L124 HydrophobicContact CE2-CB 4.12Å; Y41-R125 HydrophobicContact CD2-CG 3.99Å
42	G	88.6	Confident	79.5	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	54	-154.4	177.4	0	0	0	0	0	111.4	R46 L124	G42-R46 PolarHBondContact O-NE 3.1Å; G42-R46 PolarHBondContact O-NH2 2.85Å; G42-L124 PolarHBondContact N-O 3.02Å
43	C	89.8	Confident	80.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-15.1	-173.1	-72.5	0	0	0	0	113.1	R46 A49 S50 N52 V54 D58 C132	C43-R46 VanDerWaalsContact O-CD 3.31Å; C43-R46 WeakPolarHBondContact O-CD 3.14Å; C43-R46 WeakPolarHBondContact O-CG 3.12Å; C43-A49 WeakPolarHBondContact O-CA 3.47Å; C43-S50 WeakPolarHBondContact CB-O 3.31Å; C43-S50 PolarHBondContact O-N 3.38Å; C43-N52 WeakPolarHBondContact CB-O 3.44Å; C43-V54 HydrophobicContact CB-CG1 4.41Å; C43-V54 WeakPolarHBondContact SG-CG1 3.24Å; C43-D58 WeakPolarHBondContact CB-OD2 3.06Å; C43-D58 VanDerWaalsContact N-CG 3.31Å; C43-D58 PolarHBondContact N-OD1 3.33Å; C43-D58 PolarHBondContact N-OD2 3.07Å; C43-C132 VanDerWaalsContact CA-SG 3.53Å; C43-C132 HydrophobicContact CB-CB 3.9Å; C43-C132 WeakPolarHBondContact CB-SG 3.22Å; C43-C132 WeakPolarHBondContact SG-CA 3.48Å; C43-C132 WeakPolarHBondContact SG-CB 3.26Å; C43-C132 CovalentContact SG-SG 2.04Å; C43-C132 PolarHBondContact SG-SG 3.4Å
44	S	89.1	Confident	80.7	Confident	4 Å²	4	41 Å²	41	3%	0.028	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-33.1	-172.1	-47.7	0	0	0	0	113.6	R46 D58 R65	S44-R46 PolarHBondContact O-N 3.14Å; S44-D58 VanDerWaalsContact CA-OD1 3.26Å; S44-D58 WeakPolarHBondContact CA-OD1 3.39Å; S44-D58 WeakPolarHBondContact CB-O 3.23Å; S44-D58 WeakPolarHBondContact CB-OD1 3.36Å; S44-D58 PolarHBondContact N-OD1 2.96Å; S44-D58 PolarHBondContact OG-OD1 3.28Å; S44-R65 VanDerWaalsContact O-CZ 3.29Å; S44-R65 PolarHBondContact O-NH1 3.43Å; S44-R65 PolarHBondContact O-NH2 3.14Å
45	C	85.8	Confident	81.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-80.8	52.3	175.7	-40.6	0	0	0	0	112.2	L38 D40 Y41 D58 C61	L38-C45 VanDerWaalsContact O-O 3.05Å; D40-C45 WeakPolarHBondContact CA-O 3.32Å; D40-C45 PolarHBondContact N-O 3.5Å; Y41-C45 PolarHBondContact N-O 3.26Å; Y41-C45 WeakPolarHBondContact O-CA 3.21Å; Y41-C45 WeakPolarHBondContact O-CB 2.98Å; Y41-C45 PolarHBondContact O-N 2.91Å; C45-D58 PolarHBondContact N-OD1 3.32Å; C45-C61 HydrophobicContact CB-CB 3.82Å; C45-C61 WeakPolarHBondContact CB-SG 3.46Å; C45-C61 WeakPolarHBondContact SG-CB 3.15Å; C45-C61 CovalentContact SG-SG 2.02Å; C45-C61 PolarHBondContact SG-SG 2.9Å
46	R	81.3	Confident	82	Confident	16 Å²	16	45.4 Å²	45.4	6%	0.06	26%	0.262	C	S	.	.	S	Bend	trans	-139.6	167	-177.9	52.7	173.4	71.9	-172.3	-2.6	110.5	W9 G42 C43 S44 V48 R65 L127	W9-R46 VanDerWaalsContact CB-C 3.43Å; G42-R46 PolarHBondContact O-NE 3.1Å; G42-R46 PolarHBondContact O-NH2 2.85Å; C43-R46 VanDerWaalsContact O-CD 3.31Å; C43-R46 WeakPolarHBondContact O-CD 3.14Å; C43-R46 WeakPolarHBondContact O-CG 3.12Å; S44-R46 PolarHBondContact O-N 3.14Å; R46-V48 WeakPolarHBondContact CD-O 3.45Å; R46-V48 WeakPolarHBondContact CG-O 3.41Å; R46-R65 PolarHBondContact O-NH2 3.5Å; R46-L127 PolarHBondContact NH2-O 2.84Å
47	H	68.1	Low	82.9	Confident	91 Å²	91	39.4 Å²	39.4	42%	0.421	24%	0.239	S	C	.	.	S	Bend	trans	-59.4	-48.7	-179	179.6	-91.7	0	0	0	112.7	V8 A12	V8-H47 HydrophobicContact CB-CB 4.45Å; V8-H47 HydrophobicContact CG1-CB 3.67Å; V8-H47 PolarHBondContact O-CD2 2.62Å; V8-H47 VanDerWaalsContact O-CD2 3.24Å; A12-H47 VanDerWaalsContact CB-O 3.29Å; A12-H47 WeakPolarHBondContact CB-O 3.33Å
48	V	75.1	Confident	83.7	Confident	91 Å²	91	36.8 Å²	36.8	55%	0.552	23%	0.225	S	C	*	.	S	Bend	trans	-111.8	114.8	173.9	-173.2	0	0	0	0	107.6	R46 S50	R46-V48 WeakPolarHBondContact CD-O 3.45Å; R46-V48 WeakPolarHBondContact CG-O 3.41Å; V48-S50 PolarHBondContact O-N 3.22Å
49	A	77.8	Confident	84.5	Confident	49 Å²	49	40 Å²	40	41%	0.405	25%	0.245	S	C	.	.			trans	-58.9	137.6	174.3	0	0	0	0	0	109.6	C43	C43-A49 WeakPolarHBondContact O-CA 3.47Å
50	S	78.9	Confident	85.3	Confident	15 Å²	15	38.7 Å²	38.7	11%	0.105	24%	0.239	C	C	.	.			trans	-126.8	116.8	-178.7	-175.9	0	0	0	0	107.3	C43 V48 E129 C132	C43-S50 WeakPolarHBondContact CB-O 3.31Å; C43-S50 PolarHBondContact O-N 3.38Å; V48-S50 PolarHBondContact O-N 3.22Å; S50-E129 WeakPolarHBondContact OG-CB 3.1Å; S50-C132 WeakPolarHBondContact O-CB 3.45Å; S50-C132 PolarHBondContact O-SG 3.18Å; S50-C132 VanDerWaalsContact O-SG 3.41Å
51	G	84.1	Confident	85.7	Confident	53 Å²	53	35.7 Å²	35.7	55%	0.546	22%	0.223	S	C	.	.	S	Bend	trans	59.9	-147.1	174.9	0	0	0	0	0	115.6	C132	G51-C132 WeakPolarHBondContact CA-O 3.35Å
52	N	85.6	Confident	86	Confident	126 Å²	126	37 Å²	37	67%	0.674	23%	0.234	S	C	*	.	S	Bend	trans	-96.1	150.4	-172.3	-68.6	-53.9	0	0	0	112.7	C43 V54 C132	C43-N52 WeakPolarHBondContact CB-O 3.44Å; N52-V54 PolarHBondContact O-N 3.24Å; N52-C132 PolarHBondContact N-O 2.98Å
53	P	90.3	Very high	86.1	Confident	51 Å²	51	38 Å²	38	33%	0.331	24%	0.242	S	C	.	.			trans	-59.3	135.8	174.3	-21.2	32.1	0	0	0	112.4	D58 A62	P53-D58 WeakPolarHBondContact CA-OD2 3.32Å; P53-D58 HydrophobicContact CB-CB 4.17Å; P53-A62 HydrophobicContact CG-CB 3.71Å
54	V	90.2	Very high	86	Confident	62 Å²	62	38.1 Å²	38.1	38%	0.376	24%	0.243	S	C	.	.			trans	-95.4	-15.5	-174.2	-68.6	0	0	0	0	114.3	C43 N52 D58 L124 L127	C43-V54 HydrophobicContact CB-CG1 4.41Å; C43-V54 WeakPolarHBondContact SG-CG1 3.24Å; N52-V54 PolarHBondContact O-N 3.24Å; V54-D58 HydrophobicContact CG2-CB 4.33Å; V54-D58 WeakPolarHBondContact CG2-OD2 3.33Å; V54-D58 PolarHBondContact N-OD2 2.97Å; V54-L124 HydrophobicContact CG2-CD1 4.12Å; V54-L124 HydrophobicContact CG2-CD2 4.46Å; V54-L127 HydrophobicContact CG1-CD2 4.27Å
55	D	87.9	Confident	85.8	Confident	27 Å²	27	39 Å²	39	14%	0.144	25%	0.246	C	C	.	.	S	Bend	trans	-154.1	177	177.4	83	-13.2	0	0	0	112.2	Y41 L57 D58 T59 L124	Y41-D55 WeakPolarHBondContact CE1-OD1 3.04Å; Y41-D55 PolarHBondContact OH-OD2 3.19Å; D55-L57 VanDerWaalsContact C-N 3.31Å; D55-L57 PolarHBondContact O-N 3.33Å; D55-L57 PolarHBondContact OD1-N 2.04Å; D55-L57 VanDerWaalsContact OD1-N 3.11Å; D55-D58 PolarHBondContact O-N 3.24Å; D55-D58 WeakPolarHBondContact OD1-CB 3.07Å; D55-D58 PolarHBondContact OD1-N 3.44Å; D55-T59 PolarHBondContact O-N 2.03Å; D55-T59 PolarHBondContact O-OG1 2.92Å; D55-L124 HydrophobicContact CB-CD1 3.98Å; D55-L124 WeakPolarHBondContact OD2-CD1 3.39Å
56	P	90.5	Very high	85.8	Confident	91 Å²	91	44.4 Å²	44.4	59%	0.591	27%	0.271	S	S	*	.	H	α-helix	trans	-60.7	-34.5	178.8	-26.7	36.5	0	0	0	114.3	T59 C60	P56-T59 WeakPolarHBondContact O-CB 3.09Å; P56-T59 PolarHBondContact O-N 2.96Å; P56-C60 PolarHBondContact O-N 3.46Å; P56-C60 PolarHBondContact O-SG 2.99Å
57	L	89.6	Confident	86.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-43.7	179.1	-170.9	147.8	0	0	0	110.8	L38 Y41 D55 T59 C60 C61 L115 C120	L38-L57 HydrophobicContact CD2-CD1 3.99Å; L38-L57 HydrophobicContact CD2-CD2 3.67Å; L38-L57 HydrophobicContact CD2-CG 4.46Å; Y41-L57 HydrophobicContact CD1-CD2 3.53Å; Y41-L57 HydrophobicContact CE1-CB 3.97Å; Y41-L57 HydrophobicContact CE1-CD2 3.45Å; Y41-L57 VanDerWaalsContact CE1-CD2 3.45Å; Y41-L57 HydrophobicContact CE1-CG 4.21Å; Y41-L57 HydrophobicContact CE2-CD2 4.47Å; Y41-L57 HydrophobicContact CG-CD2 4.13Å; D55-L57 VanDerWaalsContact C-N 3.31Å; D55-L57 PolarHBondContact O-N 3.33Å; D55-L57 PolarHBondContact OD1-N 2.04Å; D55-L57 VanDerWaalsContact OD1-N 3.11Å; L57-T59 PolarHBondContact O-N 3.36Å; L57-C60 WeakPolarHBondContact O-CB 3.5Å; L57-C60 PolarHBondContact O-N 2.85Å; L57-C61 PolarHBondContact O-N 3.42Å; L57-L115 HydrophobicContact CD1-CD2 4.36Å; L57-L115 HydrophobicContact CD2-CD2 3.96Å; L57-L115 HydrophobicContact CG-CD2 3.77Å; L57-C120 HydrophobicContact CD1-CB 3.89Å
58	D	90.9	Very high	86.7	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-34.1	177.3	-161.9	28.4	0	0	0	111.2	Y41 C43 S44 C45 P53 V54 D55 C60 C61 A62	Y41-D58 HydrophobicContact CE1-CB 4.32Å; C43-D58 WeakPolarHBondContact CB-OD2 3.06Å; C43-D58 VanDerWaalsContact N-CG 3.31Å; C43-D58 PolarHBondContact N-OD1 3.33Å; C43-D58 PolarHBondContact N-OD2 3.07Å; S44-D58 VanDerWaalsContact CA-OD1 3.26Å; S44-D58 WeakPolarHBondContact CA-OD1 3.39Å; S44-D58 WeakPolarHBondContact CB-O 3.23Å; S44-D58 WeakPolarHBondContact CB-OD1 3.36Å; S44-D58 PolarHBondContact N-OD1 2.96Å; S44-D58 PolarHBondContact OG-OD1 3.28Å; C45-D58 PolarHBondContact N-OD1 3.32Å; P53-D58 WeakPolarHBondContact CA-OD2 3.32Å; P53-D58 HydrophobicContact CB-CB 4.17Å; V54-D58 HydrophobicContact CG2-CB 4.33Å; V54-D58 WeakPolarHBondContact CG2-OD2 3.33Å; V54-D58 PolarHBondContact N-OD2 2.97Å; D55-D58 PolarHBondContact O-N 3.24Å; D55-D58 WeakPolarHBondContact OD1-CB 3.07Å; D55-D58 PolarHBondContact OD1-N 3.44Å; D58-C60 VanDerWaalsContact C-N 3.31Å; D58-C60 PolarHBondContact O-N 3.31Å; D58-C61 PolarHBondContact O-N 3.21Å; D58-A62 PolarHBondContact O-N 3.41Å
59	T	91.9	Very high	87	Confident	67 Å²	67	42.4 Å²	42.4	41%	0.411	26%	0.257	S	S	.	.	H	α-helix	trans	-62.3	-38.1	171.9	-55	0	0	0	0	111.6	D55 P56 L57 C61 A62 A63	D55-T59 PolarHBondContact O-N 2.03Å; D55-T59 PolarHBondContact O-OG1 2.92Å; P56-T59 WeakPolarHBondContact O-CB 3.09Å; P56-T59 PolarHBondContact O-N 2.96Å; L57-T59 PolarHBondContact O-N 3.36Å; T59-C61 VanDerWaalsContact C-N 3.34Å; T59-C61 PolarHBondContact O-N 3.46Å; T59-A62 PolarHBondContact O-N 3.39Å; T59-A63 WeakPolarHBondContact O-CB 3.31Å; T59-A63 PolarHBondContact O-N 3.26Å
60	C	92.1	Very high	87.3	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.007	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-43.3	174.4	-56.4	0	0	0	0	111.6	P56 L57 D58 A63 H64 C114 L115 S118	P56-C60 PolarHBondContact O-N 3.46Å; P56-C60 PolarHBondContact O-SG 2.99Å; L57-C60 WeakPolarHBondContact O-CB 3.5Å; L57-C60 PolarHBondContact O-N 2.85Å; D58-C60 VanDerWaalsContact C-N 3.31Å; D58-C60 PolarHBondContact O-N 3.31Å; C60-A63 PolarHBondContact O-N 2.94Å; C60-H64 WeakPolarHBondContact O-CB 2.96Å; C60-H64 PolarHBondContact O-N 3.42Å; C60-C114 VanDerWaalsContact CA-SG 3.57Å; C60-C114 HydrophobicContact CB-CB 3.71Å; C60-C114 WeakPolarHBondContact CB-SG 3.46Å; C60-C114 WeakPolarHBondContact SG-CB 3.35Å; C60-C114 PolarHBondContact SG-O 3.38Å; C60-C114 CovalentContact SG-SG 2.03Å; C60-C114 PolarHBondContact SG-SG 3.49Å; C60-L115 HydrophobicContact CB-CD2 3.85Å; C60-L115 HydrophobicContact CB-CG 4.13Å; C60-S118 PolarHBondContact SG-OG 2.79Å
61	C	88.3	Confident	87.3	Confident	5 Å²	5	43 Å²	43	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-41.1	177.9	-67.7	0	0	0	0	112.4	C45 L57 D58 T59 H64 R65	C45-C61 HydrophobicContact CB-CB 3.82Å; C45-C61 WeakPolarHBondContact CB-SG 3.46Å; C45-C61 WeakPolarHBondContact SG-CB 3.15Å; C45-C61 CovalentContact SG-SG 2.02Å; C45-C61 PolarHBondContact SG-SG 2.9Å; L57-C61 PolarHBondContact O-N 3.42Å; D58-C61 PolarHBondContact O-N 3.21Å; T59-C61 VanDerWaalsContact C-N 3.34Å; T59-C61 PolarHBondContact O-N 3.46Å; C61-H64 PolarHBondContact O-N 3Å; C61-R65 PolarHBondContact O-N 3.35Å; C61-R65 VanDerWaalsContact O-N 3.07Å
62	A	89.6	Confident	86.4	Confident	28 Å²	28	43.8 Å²	43.8	23%	0.231	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-47.5	174.5	0	0	0	0	0	111.4	P53 D58 T59 R65 Q66	P53-A62 HydrophobicContact CG-CB 3.71Å; D58-A62 PolarHBondContact O-N 3.41Å; T59-A62 PolarHBondContact O-N 3.39Å; A62-R65 PolarHBondContact O-N 3.47Å; A62-Q66 PolarHBondContact O-N 2.83Å
63	A	90.6	Very high	85.6	Confident	21 Å²	21	43.7 Å²	43.7	17%	0.174	27%	0.266	C	S	.	.	H	α-helix	trans	-66.4	-39.2	-179.8	0	0	0	0	0	112.5	T59 C60 Q66 C67 W149	T59-A63 WeakPolarHBondContact O-CB 3.31Å; T59-A63 PolarHBondContact O-N 3.26Å; C60-A63 PolarHBondContact O-N 2.94Å; A63-Q66 PolarHBondContact O-N 3.44Å; A63-C67 WeakPolarHBondContact O-CB 2.95Å; A63-C67 PolarHBondContact O-N 3.41Å; A63-W149 HydrophobicContact CB-CH2 3.31Å; A63-W149 HydrophobicContact CB-CZ2 3.62Å; A63-W149 HydrophobicContact CB-CZ3 3.81Å
64	H	88.3	Confident	84.8	Confident	3 Å²	3	42.2 Å²	42.2	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-46.6	175.3	-176.1	-136.4	0	0	0	111.6	F14 F23 C60 C61 Q66 C67 Y68 D108 A111	F14-H64 AromaticContact CE2-CE1 3.81Å; F14-H64 AromaticContact CZ-CE1 3.75Å; F23-H64 AromaticContact CE2-CE1 3.82Å; F23-H64 AromaticContact CE2-NE2 3.99Å; F23-H64 AromaticContact CZ-CE1 3.98Å; C60-H64 WeakPolarHBondContact O-CB 2.96Å; C60-H64 PolarHBondContact O-N 3.42Å; C61-H64 PolarHBondContact O-N 3Å; H64-Q66 PolarHBondContact O-N 2.02Å; H64-C67 WeakPolarHBondContact O-CB 3.14Å; H64-C67 PolarHBondContact O-N 2.9Å; H64-Y68 AromaticContact CD2-CD2 3.74Å; H64-Y68 AromaticContact CD2-CE2 3.64Å; H64-Y68 AromaticContact NE2-CD2 3.66Å; H64-Y68 AromaticContact NE2-CE2 3.18Å; H64-Y68 WeakPolarHBondContact NE2-CE2 2.96Å; H64-Y68 WeakPolarHBondContact O-CD2 3.43Å; H64-Y68 PolarHBondContact O-N 3.36Å; H64-Y68 VanDerWaalsContact O-N 3.08Å; H64-D108 IonicContact CE1-OD1 3.89Å; H64-D108 IonicContact NE2-OD1 3.15Å; H64-D108 PolarHBondContact NE2-OD1 2.88Å; H64-D108 VanDerWaalsContact NE2-OD1 3.15Å; H64-A111 HydrophobicContact CB-CB 3.76Å; H64-A111 VanDerWaalsContact CD2-CB 3.42Å; H64-A111 WeakPolarHBondContact CD2-CB 3.27Å
65	R	84.1	Confident	83.2	Confident	22 Å²	22	50.1 Å²	50.1	8%	0.083	28%	0.28	C	S	.	.	H	α-helix	trans	-58.8	-47.9	174.8	179.7	178.8	-68.6	100.4	-1.4	111.5	S44 R46 C61 A62 C67 Y68 Q69	S44-R65 VanDerWaalsContact O-CZ 3.29Å; S44-R65 PolarHBondContact O-NH1 3.43Å; S44-R65 PolarHBondContact O-NH2 3.14Å; R46-R65 PolarHBondContact O-NH2 3.5Å; C61-R65 PolarHBondContact O-N 3.35Å; C61-R65 VanDerWaalsContact O-N 3.07Å; A62-R65 PolarHBondContact O-N 3.47Å; R65-C67 VanDerWaalsContact C-N 3.29Å; R65-C67 PolarHBondContact O-N 3.45Å; R65-Y68 PolarHBondContact O-N 2.07Å; R65-Q69 HydrophobicContact CG-CG 4.39Å; R65-Q69 WeakPolarHBondContact O-CG 3.43Å; R65-Q69 PolarHBondContact O-N 3.35Å
66	Q	87	Confident	81.7	Confident	114 Å²	114	49.9 Å²	49.9	53%	0.533	28%	0.278	S	S	.	.	H	α-helix	trans	-59.9	-41.5	178.9	-175.2	61.5	33.5	0	0	111.6	A62 A63 H64 Y68 Q69 S70	A62-Q66 PolarHBondContact O-N 2.83Å; A63-Q66 PolarHBondContact O-N 3.44Å; H64-Q66 PolarHBondContact O-N 2.02Å; Q66-Y68 PolarHBondContact O-N 2.94Å; Q66-Q69 PolarHBondContact O-N 2.89Å; Q66-S70 WeakPolarHBondContact O-CB 3.18Å; Q66-S70 PolarHBondContact O-N 2.76Å; Q66-S70 PolarHBondContact O-OG 3.03Å
67	C	88.2	Confident	79.8	Confident	17 Å²	17	56.8 Å²	56.8	12%	0.115	29%	0.292	C	S	.	.	H	α-helix	trans	-58.7	-48.1	177.4	-164.5	0	0	0	0	111.1	A63 H64 R65 S70 A71 C107	A63-C67 WeakPolarHBondContact O-CB 2.95Å; A63-C67 PolarHBondContact O-N 3.41Å; H64-C67 WeakPolarHBondContact O-CB 3.14Å; H64-C67 PolarHBondContact O-N 2.9Å; R65-C67 VanDerWaalsContact C-N 3.29Å; R65-C67 PolarHBondContact O-N 3.45Å; C67-S70 PolarHBondContact O-N 3.38Å; C67-S70 PolarHBondContact O-OG 3.45Å; C67-A71 PolarHBondContact O-N 2.88Å; C67-C107 HydrophobicContact CB-CB 3.77Å; C67-C107 WeakPolarHBondContact CB-SG 3.37Å; C67-C107 WeakPolarHBondContact SG-CA 3.34Å; C67-C107 WeakPolarHBondContact SG-CB 3.48Å; C67-C107 CovalentContact SG-SG 2.03Å; C67-C107 PolarHBondContact SG-SG 3.07Å
68	Y	79.9	Confident	78.1	Confident	22 Å²	22	58.3 Å²	58.3	9%	0.086	30%	0.3	C	S	.	.	H	α-helix	trans	-63.5	-41.8	177.3	-91.8	-105.9	0	0	0	113.2	V13 F14 H64 R65 Q66 A71 L104 C107 D108	V13-Y68 HydrophobicContact CG1-CD1 3.9Å; V13-Y68 HydrophobicContact CG1-CD2 3.9Å; V13-Y68 HydrophobicContact CG1-CE1 4.27Å; V13-Y68 HydrophobicContact CG1-CE2 4.31Å; V13-Y68 HydrophobicContact CG1-CG 3.7Å; V13-Y68 WeakPolarHBondContact O-CD1 3.49Å; V13-Y68 WeakPolarHBondContact O-CE1 3.43Å; F14-Y68 AromaticContact CD1-CE1 3.9Å; F14-Y68 HydrophobicContact CD1-CE1 3.9Å; F14-Y68 AromaticContact CE1-CE1 3.83Å; F14-Y68 HydrophobicContact CE1-CE1 3.83Å; F14-Y68 AromaticContact CE1-CZ 3.58Å; F14-Y68 WeakPolarHBondContact CE1-OH 3.46Å; F14-Y68 HydrophobicContact CZ-CE1 4.49Å; H64-Y68 AromaticContact CD2-CD2 3.74Å; H64-Y68 AromaticContact CD2-CE2 3.64Å; H64-Y68 AromaticContact NE2-CD2 3.66Å; H64-Y68 AromaticContact NE2-CE2 3.18Å; H64-Y68 WeakPolarHBondContact NE2-CE2 2.96Å; H64-Y68 WeakPolarHBondContact O-CD2 3.43Å; H64-Y68 PolarHBondContact O-N 3.36Å; H64-Y68 VanDerWaalsContact O-N 3.08Å; R65-Y68 PolarHBondContact O-N 2.07Å; Q66-Y68 PolarHBondContact O-N 2.94Å; Y68-A71 WeakPolarHBondContact O-CB 3.03Å; Y68-A71 PolarHBondContact O-N 3Å; Y68-L104 HydrophobicContact CD1-CD2 3.81Å; Y68-L104 HydrophobicContact CE1-CD2 3.67Å; Y68-L104 HydrophobicContact CE2-CD2 4.43Å; Y68-L104 HydrophobicContact CG-CD2 4.28Å; Y68-L104 PolarHBondContact OH-O 2.71Å; Y68-C107 HydrophobicContact CD2-CB 3.69Å; Y68-C107 HydrophobicContact CE2-CB 3.4Å; Y68-C107 VanDerWaalsContact CE2-CB 3.4Å; Y68-D108 VanDerWaalsContact OH-CG 3.23Å; Y68-D108 PolarHBondContact OH-OD1 3.43Å; Y68-D108 PolarHBondContact OH-OD2 3.24Å
69	Q	81.3	Confident	76	Confident	117 Å²	117	62 Å²	62	55%	0.547	32%	0.324	S	S	.	.	H	α-helix	trans	-64.1	-41	176	-71.4	173	-10	0	0	112	R65 Q66 A71	R65-Q69 HydrophobicContact CG-CG 4.39Å; R65-Q69 WeakPolarHBondContact O-CG 3.43Å; R65-Q69 PolarHBondContact O-N 3.35Å; Q66-Q69 PolarHBondContact O-N 2.89Å; Q69-A71 PolarHBondContact O-N 3.33Å
70	S	83.2	Confident	73.7	Confident	74 Å²	74	63.7 Å²	63.7	52%	0.517	34%	0.336	S	S	.	.	H	α-helix	trans	-73.7	-13.1	178.2	72.3	0	0	0	0	113.9	Q66 C67 A72	Q66-S70 WeakPolarHBondContact O-CB 3.18Å; Q66-S70 PolarHBondContact O-N 2.76Å; Q66-S70 PolarHBondContact O-OG 3.03Å; C67-S70 PolarHBondContact O-N 3.38Å; C67-S70 PolarHBondContact O-OG 3.45Å; S70-A72 PolarHBondContact O-N 3.24Å
71	A	79.1	Confident	71.4	Confident	1 Å²	1	65.2 Å²	65.2	1%	0.008	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-5	179.5	0	0	0	0	0	113.3	C67 Y68 Q69 C74 R103 L104	C67-A71 PolarHBondContact O-N 2.88Å; Y68-A71 WeakPolarHBondContact O-CB 3.03Å; Y68-A71 PolarHBondContact O-N 3Å; Q69-A71 PolarHBondContact O-N 3.33Å; A71-C74 HydrophobicContact CB-CB 4.42Å; A71-C74 WeakPolarHBondContact O-CB 3.24Å; A71-C74 PolarHBondContact O-N 3.44Å; A71-C74 PolarHBondContact O-SG 3.29Å; A71-R103 HydrophobicContact CB-CG 4.17Å; A71-L104 HydrophobicContact CB-CD2 3.77Å
72	A	65.1	Low	69.4	Low	70 Å²	70	69 Å²	69	58%	0.579	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	141.5	176.6	0	0	0	0	0	112.5	S70 C74	S70-A72 PolarHBondContact O-N 3.24Å; A72-C74 VanDerWaalsContact C-N 3.34Å
73	P	69.4	Low	67	Low	124 Å²	124	77.5 Å²	77.5	81%	0.805	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89.5	21.2	8.4	37.7	-36.4	0	0	0	113.9	R75	P73-R75 PolarHBondContact O-N 3.19Å
74	C	72.9	Confident	64.9	Low	20 Å²	20	81 Å²	81	14%	0.135	41%	0.414	C	S	.	.			trans	-56.9	106.8	-178.2	-68.9	0	0	0	0	111.7	A71 A72 C100 L104	A71-C74 HydrophobicContact CB-CB 4.42Å; A71-C74 WeakPolarHBondContact O-CB 3.24Å; A71-C74 PolarHBondContact O-N 3.44Å; A71-C74 PolarHBondContact O-SG 3.29Å; A72-C74 VanDerWaalsContact C-N 3.34Å; C74-C100 WeakPolarHBondContact CA-SG 3.41Å; C74-C100 HydrophobicContact CB-CB 3.49Å; C74-C100 VanDerWaalsContact CB-CB 3.49Å; C74-C100 WeakPolarHBondContact CB-SG 3.47Å; C74-C100 WeakPolarHBondContact SG-CA 3.42Å; C74-C100 WeakPolarHBondContact SG-CB 3.33Å; C74-C100 CovalentContact SG-SG 2.04Å; C74-C100 PolarHBondContact SG-SG 3.47Å; C74-L104 HydrophobicContact CB-CD1 4.5Å
75	R	57.6	Low	63.2	Low	229 Å²	229	86.6 Å²	86.6	86%	0.864	44%	0.438	S	S	*	.			trans	-80.8	133.5	169.5	-74.2	-172.2	170.5	153.8	-1	108.8	P73 R77	P73-R75 PolarHBondContact O-N 3.19Å; R75-R77 PolarHBondContact O-N 2.99Å
76	Q	57.3	Low	61.8	Low	21 Å²	21	89.2 Å²	89.2	10%	0.098	46%	0.46	C	S	.	.			trans	-75.8	51.1	-174.9	-48.7	-163.1	12.6	0	0	114.2	V13 D15 N16 L78 L104	V13-Q76 PolarHBondContact O-NE2 3.15Å; D15-Q76 HydrophobicContact CB-CG 4.48Å; N16-Q76 WeakPolarHBondContact ND2-CB 3.49Å; N16-Q76 PolarHBondContact ND2-O 3.01Å; N16-Q76 PolarHBondContact ND2-OE1 3.46Å; Q76-L78 HydrophobicContact CB-CD1 3.85Å; Q76-L78 PolarHBondContact O-N 3.14Å; Q76-L104 HydrophobicContact CB-CD1 4.46Å; Q76-L104 HydrophobicContact CG-CD1 3.98Å
77	R	50.6	Low	60.7	Low	236 Å²	236	88 Å²	88	89%	0.891	46%	0.463	S	S	*	.			trans	-75.7	66.2	161	-89.6	-172.9	175.4	167	-1	108.5	R75	R75-R77 PolarHBondContact O-N 2.99Å
78	L	52.3	Low	59.1	Low	33 Å²	33	91.6 Å²	91.6	17%	0.173	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-75.2	148.9	170.7	-84.7	83.4	0	0	0	109.6	S19 Q76 L104	S19-L78 WeakPolarHBondContact OG-CB 3.43Å; S19-L78 WeakPolarHBondContact OG-CD1 3.29Å; S19-L78 WeakPolarHBondContact OG-CD2 3.05Å; Q76-L78 HydrophobicContact CB-CD1 3.85Å; Q76-L78 PolarHBondContact O-N 3.14Å; L78-L104 HydrophobicContact CD1-CD1 3.6Å
79	P	48	Very low	57.8	Low	77 Å²	77	94.6 Å²	94.6	50%	0.5	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-61.1	147.5	173.9	-9.6	22.9	0	0	0	110
80	P	43.3	Very low	56.1	Low	103 Å²	103	97.2 Å²	97.2	67%	0.669	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-56.9	143.2	173.7	24.4	-32.6	0	0	0	110.2
81	P	43.6	Very low	54.6	Low	33 Å²	33	98.8 Å²	98.8	21%	0.214	54%	0.537	C	S	.	.	P	Polyproline II helix	trans	-59.1	148.4	179.6	25.6	-35.8	0	0	0	110.5	L21 F85	L21-P81 HydrophobicContact CD2-CG 4.25Å; P81-F85 HydrophobicContact CB-CE1 4.21Å; P81-F85 HydrophobicContact CB-CZ 3.78Å; P81-F85 HydrophobicContact CG-CZ 3.98Å
82	P	45.8	Very low	53.7	Low	84 Å²	84	101.3 Å²	101.3	55%	0.545	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-57.5	142.7	175.3	24.4	-32.5	0	0	0	110.4	N84	P82-N84 PolarHBondContact O-N 2.03Å; P82-N84 VanDerWaalsContact O-N 3.11Å
83	Y	40	Very low	54	Low	207 Å²	207	100.5 Å²	100.5	81%	0.812	55%	0.545	S	S	*	.	S	Bend	trans	-67.1	-10.3	-171.7	62.1	-89.1	0	0	0	114
84	N	46.2	Very low	54.5	Low	95 Å²	95	95.6 Å²	95.6	51%	0.508	51%	0.513	S	S	.	.			trans	-116.2	95.5	-177.7	61.3	-12.8	0	0	0	111.7	P82 S86	P82-N84 PolarHBondContact O-N 2.03Å; P82-N84 VanDerWaalsContact O-N 3.11Å; N84-S86 VanDerWaalsContact C-N 3.34Å; N84-S86 PolarHBondContact O-N 3.46Å
85	F	52.5	Low	54.6	Low	119 Å²	119	100.7 Å²	100.7	52%	0.522	54%	0.539	S	S	.	.			trans	-79.6	82.7	172.9	-66.4	-84.4	0	0	0	110.5	L21 S25 P81	L21-F85 HydrophobicContact CD2-CE2 4.34Å; L21-F85 HydrophobicContact CD2-CZ 3.83Å; L21-F85 HydrophobicContact CG-CE1 4.45Å; L21-F85 HydrophobicContact CG-CZ 4Å; S25-F85 WeakPolarHBondContact OG-CD1 3.45Å; S25-F85 VanDerWaalsContact OG-CE1 3.28Å; S25-F85 WeakPolarHBondContact OG-CE1 3.4Å; P81-F85 HydrophobicContact CB-CE1 4.21Å; P81-F85 HydrophobicContact CB-CZ 3.78Å; P81-F85 HydrophobicContact CG-CZ 3.98Å
86	S	54.5	Low	55.4	Low	78 Å²	78	95.7 Å²	95.7	55%	0.545	53%	0.533	S	S	.	.			trans	-98.2	131.5	165.4	174.9	0	0	0	0	108.7	N84 S88	N84-S86 VanDerWaalsContact C-N 3.34Å; N84-S86 PolarHBondContact O-N 3.46Å; S86-S88 WeakPolarHBondContact CB-OG 3.37Å; S86-S88 PolarHBondContact O-N 3.02Å; S86-S88 PolarHBondContact OG-N 3.16Å; S86-S88 PolarHBondContact OG-OG 3.23Å; S86-S88 VanDerWaalsContact OG-OG 3.07Å
87	C	63.8	Low	56.2	Low	87 Å²	87	96.3 Å²	96.3	59%	0.588	55%	0.546	S	S	*	.			trans	-73.8	38	170.1	-71.6	0	0	0	0	111.6	C29 A89	C29-C87 HydrophobicContact CB-CB 3.85Å; C29-C87 WeakPolarHBondContact CB-SG 3.39Å; C29-C87 VanDerWaalsContact SG-CA 3.54Å; C29-C87 WeakPolarHBondContact SG-CB 3.35Å; C29-C87 CovalentContact SG-SG 2.07Å; C29-C87 PolarHBondContact SG-SG 3.3Å; C87-A89 PolarHBondContact O-N 2.96Å
88	S	55	Low	57.6	Low	94 Å²	94	88.4 Å²	88.4	66%	0.657	52%	0.521	S	S	*	.			trans	-71.6	84.7	162.7	36.3	0	0	0	0	106.9	S86 E90	S86-S88 WeakPolarHBondContact CB-OG 3.37Å; S86-S88 PolarHBondContact O-N 3.02Å; S86-S88 PolarHBondContact OG-N 3.16Å; S86-S88 PolarHBondContact OG-OG 3.23Å; S86-S88 VanDerWaalsContact OG-OG 3.07Å; S88-E90 PolarHBondContact O-N 3.08Å
89	A	52.7	Low	59	Low	84 Å²	84	91.1 Å²	91.1	69%	0.694	54%	0.541	S	S	*	.			trans	-64.3	115.9	168.3	0	0	0	0	0	108.2	C87	C87-A89 PolarHBondContact O-N 2.96Å
90	E	46	Very low	60.6	Low	172 Å²	172	89.2 Å²	89.2	80%	0.804	53%	0.528	S	S	*	.	S	Bend	trans	-155.1	109.6	146.5	-112.6	167.6	-154.6	0	0	106	S88 S92	S88-E90 PolarHBondContact O-N 3.08Å; E90-S92 PolarHBondContact O-N 2.93Å
91	T	52.2	Low	62.3	Low	107 Å²	107	86.2 Å²	86.2	66%	0.656	51%	0.506	S	S	*	.			trans	37.7	76.2	156.8	18.1	0	0	0	0	113	S93	T91-S93 PolarHBondContact O-N 3.4Å
92	S	59	Low	64.2	Low	54 Å²	54	88.2 Å²	88.2	38%	0.378	51%	0.512	S	S	.	.			trans	-63.9	88.9	164.1	63.5	0	0	0	0	106.4	E90 C94 R109	E90-S92 PolarHBondContact O-N 2.93Å; S92-C94 PolarHBondContact O-N 2.9Å; S92-R109 PolarHBondContact O-NH1 3.41Å; S92-R109 VanDerWaalsContact O-NH1 3.08Å
93	S	72.6	Confident	66	Low	54 Å²	54	88.6 Å²	88.6	38%	0.378	50%	0.502	S	S	.	.			trans	-56.1	133.9	167.7	148.2	0	0	0	0	105.9	T91 D95	T91-S93 PolarHBondContact O-N 3.4Å; S93-D95 PolarHBondContact O-N 2.65Å; S93-D95 WeakPolarHBondContact OG-CB 3.46Å; S93-D95 PolarHBondContact OG-N 3.38Å; S93-D95 VanDerWaalsContact OG-N 3.08Å; S93-D95 PolarHBondContact OG-OD2 3.45Å
94	C	77.9	Confident	68	Low	20 Å²	20	78.9 Å²	78.9	14%	0.135	47%	0.465	C	S	.	.	S	Bend	trans	-92.6	23.7	175.7	-64.5	0	0	0	0	110.6	S92 V96 Q102 C105 G106	S92-C94 PolarHBondContact O-N 2.9Å; C94-V96 VanDerWaalsContact C-N 3.32Å; C94-Q102 VanDerWaalsContact O-CB 3.26Å; C94-Q102 WeakPolarHBondContact O-CB 3.29Å; C94-Q102 WeakPolarHBondContact O-CG 3.25Å; C94-C105 WeakPolarHBondContact CA-SG 3.24Å; C94-C105 HydrophobicContact CB-CB 3.65Å; C94-C105 WeakPolarHBondContact CB-SG 3.37Å; C94-C105 WeakPolarHBondContact SG-CB 3.09Å; C94-C105 PolarHBondContact SG-O 3.34Å; C94-C105 CovalentContact SG-SG 2.06Å; C94-C105 PolarHBondContact SG-SG 3.37Å; C94-G106 PolarHBondContact SG-N 3.21Å
95	D	76.9	Confident	69.8	Low	128 Å²	128	75.2 Å²	75.2	68%	0.684	45%	0.446	S	S	*	.			trans	-86.5	-8.9	-177.4	-50.7	-36	0	0	0	111.9	S93 Q102	S93-D95 PolarHBondContact O-N 2.65Å; S93-D95 WeakPolarHBondContact OG-CB 3.46Å; S93-D95 PolarHBondContact OG-N 3.38Å; S93-D95 VanDerWaalsContact OG-N 3.08Å; S93-D95 PolarHBondContact OG-OD2 3.45Å; D95-Q102 PolarHBondContact O-NE2 3Å
96	V	72.4	Confident	71.4	Confident	124 Å²	124	71 Å²	71	75%	0.752	44%	0.437	S	S	*	.	S	Bend	trans	-100.7	128.8	-178.5	-176.1	0	0	0	0	110.2	C94	C94-V96 VanDerWaalsContact C-N 3.32Å
97	G	75.3	Confident	73	Confident	34 Å²	34	67.3 Å²	67.3	35%	0.351	41%	0.411	S	S	.	.	S	Bend	trans	119.1	-178	175.3	0	0	0	0	0	113.5	Q102	G97-Q102 PolarHBondContact O-NE2 3.41Å
98	D	79.5	Confident	74.1	Confident	69 Å²	69	63.2 Å²	63.2	37%	0.369	38%	0.383	S	S	.	.			trans	-70.6	163.7	172.9	70.4	59.8	0	0	0	111.8	C100 Q101 Q102	D98-C100 PolarHBondContact O-N 2.87Å; D98-C100 VanDerWaalsContact OD1-CA 3.3Å; D98-C100 WeakPolarHBondContact OD1-CA 3.45Å; D98-C100 WeakPolarHBondContact OD1-CB 3.49Å; D98-C100 PolarHBondContact OD1-N 3Å; D98-Q101 WeakPolarHBondContact O-CB 3.28Å; D98-Q101 PolarHBondContact O-N 3Å; D98-Q101 PolarHBondContact OD1-N 3.4Å; D98-Q101 VanDerWaalsContact OD2-CG 3.27Å; D98-Q101 WeakPolarHBondContact OD2-CG 3.43Å; D98-Q101 PolarHBondContact OD2-NE2 3.3Å; D98-Q101 VanDerWaalsContact OD2-NE2 3.14Å; D98-Q102 WeakPolarHBondContact O-CG 3.29Å; D98-Q102 PolarHBondContact O-N 3.07Å
99	P	82.4	Confident	75.7	Confident	91 Å²	91	63 Å²	63	59%	0.591	37%	0.368	S	S	*	.	H	α-helix	trans	-55.4	-29.3	-177	-27.5	35.7	0	0	0	114.6	R103	P99-R103 VanDerWaalsContact O-CB 3.28Å; P99-R103 WeakPolarHBondContact O-CB 3.08Å; P99-R103 PolarHBondContact O-N 3.34Å; P99-R103 VanDerWaalsContact O-N 3.08Å
100	C	81.5	Confident	77.5	Confident	36 Å²	36	60.6 Å²	60.6	24%	0.243	35%	0.348	C	S	.	.	H	α-helix	trans	-76.6	-40.7	176.9	-74.8	0	0	0	0	112.1	C74 D98 Q102 R103 L104	C74-C100 WeakPolarHBondContact CA-SG 3.41Å; C74-C100 HydrophobicContact CB-CB 3.49Å; C74-C100 VanDerWaalsContact CB-CB 3.49Å; C74-C100 WeakPolarHBondContact CB-SG 3.47Å; C74-C100 WeakPolarHBondContact SG-CA 3.42Å; C74-C100 WeakPolarHBondContact SG-CB 3.33Å; C74-C100 CovalentContact SG-SG 2.04Å; C74-C100 PolarHBondContact SG-SG 3.47Å; D98-C100 PolarHBondContact O-N 2.87Å; D98-C100 VanDerWaalsContact OD1-CA 3.3Å; D98-C100 WeakPolarHBondContact OD1-CA 3.45Å; D98-C100 WeakPolarHBondContact OD1-CB 3.49Å; D98-C100 PolarHBondContact OD1-N 3Å; C100-Q102 VanDerWaalsContact C-N 3.35Å; C100-R103 PolarHBondContact O-N 3.15Å; C100-L104 WeakPolarHBondContact O-CB 3.25Å; C100-L104 WeakPolarHBondContact O-CG 3.32Å; C100-L104 PolarHBondContact O-N 3.28Å
101	Q	78.3	Confident	79.6	Confident	41 Å²	41	52.4 Å²	52.4	19%	0.192	31%	0.31	C	S	.	.	H	α-helix	trans	-60.3	-45.5	172.6	-70.5	170.9	-6.9	0	0	111.2	D98 C105	D98-Q101 WeakPolarHBondContact O-CB 3.28Å; D98-Q101 PolarHBondContact O-N 3Å; D98-Q101 PolarHBondContact OD1-N 3.4Å; D98-Q101 VanDerWaalsContact OD2-CG 3.27Å; D98-Q101 WeakPolarHBondContact OD2-CG 3.43Å; D98-Q101 PolarHBondContact OD2-NE2 3.3Å; D98-Q101 VanDerWaalsContact OD2-NE2 3.14Å; Q101-C105 WeakPolarHBondContact O-CB 3.09Å; Q101-C105 PolarHBondContact O-N 3.42Å
102	Q	83.3	Confident	81.3	Confident	75 Å²	75	47.9 Å²	47.9	35%	0.35	28%	0.281	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177.8	-61.3	-176.9	10.4	0	0	111.5	C94 D95 G97 D98 C100 C105 G106	C94-Q102 VanDerWaalsContact O-CB 3.26Å; C94-Q102 WeakPolarHBondContact O-CB 3.29Å; C94-Q102 WeakPolarHBondContact O-CG 3.25Å; D95-Q102 PolarHBondContact O-NE2 3Å; G97-Q102 PolarHBondContact O-NE2 3.41Å; D98-Q102 WeakPolarHBondContact O-CG 3.29Å; D98-Q102 PolarHBondContact O-N 3.07Å; C100-Q102 VanDerWaalsContact C-N 3.35Å; Q102-C105 PolarHBondContact O-N 3.08Å; Q102-G106 PolarHBondContact O-N 3.47Å
103	R	84.2	Confident	82.7	Confident	91 Å²	91	48.4 Å²	48.4	34%	0.343	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-49.5	178.7	-175.3	173.9	-66.9	175.9	-2.9	112.6	A71 P99 C100 G106 C107	A71-R103 HydrophobicContact CB-CG 4.17Å; P99-R103 VanDerWaalsContact O-CB 3.28Å; P99-R103 WeakPolarHBondContact O-CB 3.08Å; P99-R103 PolarHBondContact O-N 3.34Å; P99-R103 VanDerWaalsContact O-N 3.08Å; C100-R103 PolarHBondContact O-N 3.15Å; R103-G106 PolarHBondContact O-N 2.76Å; R103-G106 VanDerWaalsContact O-N 3.17Å; R103-C107 PolarHBondContact O-N 2.99Å; R103-C107 PolarHBondContact O-SG 3.04Å; R103-C107 VanDerWaalsContact O-SG 3.41Å
104	L	82.7	Confident	83.6	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-67.7	-37.3	179.3	-65.4	172.3	0	0	0	111.4	Y68 A71 C74 Q76 L78 C100 G106 C107 D108	Y68-L104 HydrophobicContact CD1-CD2 3.81Å; Y68-L104 HydrophobicContact CE1-CD2 3.67Å; Y68-L104 HydrophobicContact CE2-CD2 4.43Å; Y68-L104 HydrophobicContact CG-CD2 4.28Å; Y68-L104 PolarHBondContact OH-O 2.71Å; A71-L104 HydrophobicContact CB-CD2 3.77Å; C74-L104 HydrophobicContact CB-CD1 4.5Å; Q76-L104 HydrophobicContact CB-CD1 4.46Å; Q76-L104 HydrophobicContact CG-CD1 3.98Å; L78-L104 HydrophobicContact CD1-CD1 3.6Å; C100-L104 WeakPolarHBondContact O-CB 3.25Å; C100-L104 WeakPolarHBondContact O-CG 3.32Å; C100-L104 PolarHBondContact O-N 3.28Å; L104-G106 VanDerWaalsContact C-N 3.31Å; L104-G106 PolarHBondContact O-N 2.97Å; L104-C107 WeakPolarHBondContact O-CB 3.38Å; L104-C107 PolarHBondContact O-N 2.86Å; L104-D108 PolarHBondContact O-N 3.32Å
105	C	83.6	Confident	84.1	Confident	18 Å²	18	46.6 Å²	46.6	12%	0.122	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-43	169.6	178.4	0	0	0	0	111.8	C94 Q101 Q102 D108 R109	C94-C105 WeakPolarHBondContact CA-SG 3.24Å; C94-C105 HydrophobicContact CB-CB 3.65Å; C94-C105 WeakPolarHBondContact CB-SG 3.37Å; C94-C105 WeakPolarHBondContact SG-CB 3.09Å; C94-C105 PolarHBondContact SG-O 3.34Å; C94-C105 CovalentContact SG-SG 2.06Å; C94-C105 PolarHBondContact SG-SG 3.37Å; Q101-C105 WeakPolarHBondContact O-CB 3.09Å; Q101-C105 PolarHBondContact O-N 3.42Å; Q102-C105 PolarHBondContact O-N 3.08Å; C105-D108 PolarHBondContact O-N 3.38Å; C105-R109 WeakPolarHBondContact O-CB 3.36Å; C105-R109 PolarHBondContact O-N 2.85Å
106	G	86.7	Confident	84.5	Confident	31 Å²	31	43.3 Å²	43.3	32%	0.32	25%	0.252	S	S	.	.	H	α-helix	trans	-60.7	-44.4	176.4	0	0	0	0	0	112.3	C94 Q102 R103 L104 R109 A110	C94-G106 PolarHBondContact SG-N 3.21Å; Q102-G106 PolarHBondContact O-N 3.47Å; R103-G106 PolarHBondContact O-N 2.76Å; R103-G106 VanDerWaalsContact O-N 3.17Å; L104-G106 VanDerWaalsContact C-N 3.31Å; L104-G106 PolarHBondContact O-N 2.97Å; G106-R109 PolarHBondContact O-N 2.88Å; G106-A110 WeakPolarHBondContact O-CB 3.06Å; G106-A110 PolarHBondContact O-N 3.19Å
107	C	88	Confident	85.3	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-58.4	-48.3	174	-63.9	0	0	0	0	111.6	C67 Y68 R103 L104 A110 A111	C67-C107 HydrophobicContact CB-CB 3.77Å; C67-C107 WeakPolarHBondContact CB-SG 3.37Å; C67-C107 WeakPolarHBondContact SG-CA 3.34Å; C67-C107 WeakPolarHBondContact SG-CB 3.48Å; C67-C107 CovalentContact SG-SG 2.03Å; C67-C107 PolarHBondContact SG-SG 3.07Å; Y68-C107 HydrophobicContact CD2-CB 3.69Å; Y68-C107 HydrophobicContact CE2-CB 3.4Å; Y68-C107 VanDerWaalsContact CE2-CB 3.4Å; R103-C107 PolarHBondContact O-N 2.99Å; R103-C107 PolarHBondContact O-SG 3.04Å; R103-C107 VanDerWaalsContact O-SG 3.41Å; L104-C107 WeakPolarHBondContact O-CB 3.38Å; L104-C107 PolarHBondContact O-N 2.86Å; C107-A110 PolarHBondContact O-N 2.98Å; C107-A111 WeakPolarHBondContact O-CB 3.36Å; C107-A111 PolarHBondContact O-N 3.47Å
108	D	86.4	Confident	85.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.5	-46.4	178.1	-80.9	-14.3	0	0	0	112.4	F14 F23 R26 H64 Y68 L104 C105 A111 I112	F14-D108 VanDerWaalsContact CZ-OD1 3.26Å; F14-D108 WeakPolarHBondContact CZ-OD1 3.45Å; F23-D108 HydrophobicContact CD2-CB 3.99Å; F23-D108 VanDerWaalsContact CD2-OD1 3.32Å; F23-D108 WeakPolarHBondContact CD2-OD1 3.36Å; R26-D108 IonicContact NH2-OD2 2.85Å; R26-D108 PolarHBondContact NH2-OD2 3.37Å; H64-D108 IonicContact CE1-OD1 3.89Å; H64-D108 IonicContact NE2-OD1 3.15Å; H64-D108 PolarHBondContact NE2-OD1 2.88Å; H64-D108 VanDerWaalsContact NE2-OD1 3.15Å; Y68-D108 VanDerWaalsContact OH-CG 3.23Å; Y68-D108 PolarHBondContact OH-OD1 3.43Å; Y68-D108 PolarHBondContact OH-OD2 3.24Å; L104-D108 PolarHBondContact O-N 3.32Å; C105-D108 PolarHBondContact O-N 3.38Å; D108-A111 PolarHBondContact O-N 3Å; D108-I112 WeakPolarHBondContact O-CB 3.39Å; D108-I112 WeakPolarHBondContact O-CD1 3.41Å; D108-I112 VanDerWaalsContact O-CG1 3.24Å; D108-I112 WeakPolarHBondContact O-CG1 3.22Å; D108-I112 PolarHBondContact O-N 3.24Å
109	R	87.5	Confident	86	Confident	90 Å²	90	53 Å²	53	34%	0.34	26%	0.263	S	S	.	.	H	α-helix	trans	-61.5	-48.3	178.9	-179.7	177.3	175.9	139.4	-3.6	111.3	S92 C105 G106 A111 I112 D113	S92-R109 PolarHBondContact O-NH1 3.41Å; S92-R109 VanDerWaalsContact O-NH1 3.08Å; C105-R109 WeakPolarHBondContact O-CB 3.36Å; C105-R109 PolarHBondContact O-N 2.85Å; G106-R109 PolarHBondContact O-N 2.88Å; R109-A111 VanDerWaalsContact C-N 3.31Å; R109-A111 PolarHBondContact O-N 3.18Å; R109-I112 PolarHBondContact O-N 3.2Å; R109-D113 WeakPolarHBondContact O-CB 3.29Å; R109-D113 PolarHBondContact O-N 2.98Å
110	A	90.8	Very high	86	Confident	33 Å²	33	50.9 Å²	50.9	27%	0.273	25%	0.25	S	C	.	.	H	α-helix	trans	-61.1	-41.2	179.1	0	0	0	0	0	111.8	G106 C107 C114 W149	G106-A110 WeakPolarHBondContact O-CB 3.06Å; G106-A110 PolarHBondContact O-N 3.19Å; C107-A110 PolarHBondContact O-N 2.98Å; A110-C114 VanDerWaalsContact O-CB 3.24Å; A110-C114 WeakPolarHBondContact O-CB 3.09Å; A110-C114 PolarHBondContact O-N 2.84Å; A110-W149 HydrophobicContact CB-CH2 4.2Å; A110-W149 HydrophobicContact CB-CZ3 4.24Å
111	A	89.8	Confident	86.1	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.008	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-46.5	176.4	0	0	0	0	0	112	F23 H64 C107 D108 R109 C114 L115	F23-A111 HydrophobicContact CE2-CB 4.06Å; H64-A111 HydrophobicContact CB-CB 3.76Å; H64-A111 VanDerWaalsContact CD2-CB 3.42Å; H64-A111 WeakPolarHBondContact CD2-CB 3.27Å; C107-A111 WeakPolarHBondContact O-CB 3.36Å; C107-A111 PolarHBondContact O-N 3.47Å; D108-A111 PolarHBondContact O-N 3Å; R109-A111 VanDerWaalsContact C-N 3.31Å; R109-A111 PolarHBondContact O-N 3.18Å; A111-C114 PolarHBondContact O-N 3.46Å; A111-L115 WeakPolarHBondContact O-CB 3.26Å; A111-L115 VanDerWaalsContact O-CG 3.23Å; A111-L115 WeakPolarHBondContact O-CG 3.4Å; A111-L115 PolarHBondContact O-N 2.97Å
112	I	87.7	Confident	86.1	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.056	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-45.6	178.1	-68.5	164	0	0	0	110.8	F23 R26 L27 A30 D108 R109 C114 L115 T116	F23-I112 HydrophobicContact CD2-CD1 4.03Å; F23-I112 HydrophobicContact CD2-CG1 4.1Å; F23-I112 HydrophobicContact CE2-CD1 4.18Å; F23-I112 HydrophobicContact CE2-CG1 3.72Å; F23-I112 HydrophobicContact CZ-CG1 4.42Å; R26-I112 HydrophobicContact CB-CD1 3.51Å; L27-I112 HydrophobicContact CB-CG1 4.17Å; L27-I112 HydrophobicContact CD1-CG1 4.28Å; A30-I112 HydrophobicContact CB-CG2 3.58Å; D108-I112 WeakPolarHBondContact O-CB 3.39Å; D108-I112 WeakPolarHBondContact O-CD1 3.41Å; D108-I112 VanDerWaalsContact O-CG1 3.24Å; D108-I112 WeakPolarHBondContact O-CG1 3.22Å; D108-I112 PolarHBondContact O-N 3.24Å; R109-I112 PolarHBondContact O-N 3.2Å; I112-C114 VanDerWaalsContact C-N 3.29Å; I112-C114 PolarHBondContact O-N 3.15Å; I112-L115 PolarHBondContact O-N 2.85Å; I112-T116 VanDerWaalsContact O-CB 3.3Å; I112-T116 WeakPolarHBondContact O-CB 3.22Å; I112-T116 PolarHBondContact O-N 3.44Å; I112-T116 PolarHBondContact O-OG1 3.44Å
113	D	88.9	Confident	86.2	Confident	66 Å²	66	56.2 Å²	56.2	35%	0.353	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-40.6	177.3	-75.6	-17.3	0	0	0	111.4	R109 R117	R109-D113 WeakPolarHBondContact O-CB 3.29Å; R109-D113 PolarHBondContact O-N 2.98Å; D113-R117 WeakPolarHBondContact O-CG 3.06Å; D113-R117 PolarHBondContact O-N 3.08Å
114	C	91.6	Very high	86.1	Confident	32 Å²	32	53.5 Å²	53.5	22%	0.216	28%	0.284	C	S	.	.	H	α-helix	trans	-66.1	-48.5	177.4	-169.5	0	0	0	0	112	C60 A110 A111 I112 T116 R117 S118	C60-C114 VanDerWaalsContact CA-SG 3.57Å; C60-C114 HydrophobicContact CB-CB 3.71Å; C60-C114 WeakPolarHBondContact CB-SG 3.46Å; C60-C114 WeakPolarHBondContact SG-CB 3.35Å; C60-C114 PolarHBondContact SG-O 3.38Å; C60-C114 CovalentContact SG-SG 2.03Å; C60-C114 PolarHBondContact SG-SG 3.49Å; A110-C114 VanDerWaalsContact O-CB 3.24Å; A110-C114 WeakPolarHBondContact O-CB 3.09Å; A110-C114 PolarHBondContact O-N 2.84Å; A111-C114 PolarHBondContact O-N 3.46Å; I112-C114 VanDerWaalsContact C-N 3.29Å; I112-C114 PolarHBondContact O-N 3.15Å; C114-T116 VanDerWaalsContact C-N 3.34Å; C114-T116 PolarHBondContact O-N 2.04Å; C114-R117 PolarHBondContact O-N 3.45Å; C114-S118 WeakPolarHBondContact O-CB 3.48Å; C114-S118 PolarHBondContact O-N 3.25Å; C114-S118 VanDerWaalsContact O-N 3.15Å; C114-S118 PolarHBondContact O-OG 2.81Å
115	L	88	Confident	86.2	Confident	3 Å²	3	58 Å²	58	2%	0.016	30%	0.301	C	S	.	.	H	α-helix	trans	-64	-39	179.2	-70.1	171.2	0	0	0	111.7	F23 L27 L33 L38 L57 C60 A111 I112 R117 S118	F23-L115 HydrophobicContact CZ-CD1 4.29Å; L27-L115 HydrophobicContact CD1-CB 4Å; L27-L115 HydrophobicContact CD1-CD1 3.76Å; L27-L115 HydrophobicContact CD2-CD1 4.29Å; L33-L115 HydrophobicContact CD1-CB 4.42Å; L38-L115 HydrophobicContact CD1-CD1 4.13Å; L38-L115 HydrophobicContact CD1-CD2 4.08Å; L57-L115 HydrophobicContact CD1-CD2 4.36Å; L57-L115 HydrophobicContact CD2-CD2 3.96Å; L57-L115 HydrophobicContact CG-CD2 3.77Å; C60-L115 HydrophobicContact CB-CD2 3.85Å; C60-L115 HydrophobicContact CB-CG 4.13Å; A111-L115 WeakPolarHBondContact O-CB 3.26Å; A111-L115 VanDerWaalsContact O-CG 3.23Å; A111-L115 WeakPolarHBondContact O-CG 3.4Å; A111-L115 PolarHBondContact O-N 2.97Å; I112-L115 PolarHBondContact O-N 2.85Å; L115-R117 VanDerWaalsContact C-N 3.26Å; L115-R117 PolarHBondContact O-N 3.19Å; L115-S118 PolarHBondContact O-N 2.85Å
116	T	86.7	Confident	86.1	Confident	60 Å²	60	59.9 Å²	59.9	37%	0.368	32%	0.324	S	S	.	.	H	α-helix	trans	-62.9	-32.7	178.3	-56.2	0	0	0	0	112.3	I112 C114	I112-T116 VanDerWaalsContact O-CB 3.3Å; I112-T116 WeakPolarHBondContact O-CB 3.22Å; I112-T116 PolarHBondContact O-N 3.44Å; I112-T116 PolarHBondContact O-OG1 3.44Å; C114-T116 VanDerWaalsContact C-N 3.34Å; C114-T116 PolarHBondContact O-N 2.04Å
117	R	88.4	Confident	85.9	Confident	174 Å²	174	60.3 Å²	60.3	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-88.9	-12.8	179.6	-66.3	175.7	-170.6	179	5.7	113.4	D113 C114 L115	D113-R117 WeakPolarHBondContact O-CG 3.06Å; D113-R117 PolarHBondContact O-N 3.08Å; C114-R117 PolarHBondContact O-N 3.45Å; L115-R117 VanDerWaalsContact C-N 3.26Å; L115-R117 PolarHBondContact O-N 3.19Å
118	S	87.1	Confident	85.8	Confident	25 Å²	25	64.8 Å²	64.8	18%	0.175	35%	0.346	C	S	.	.	S	Bend	trans	-91.9	146.7	-177.2	-61.7	0	0	0	0	110.7	C60 C114 L115	C60-S118 PolarHBondContact SG-OG 2.79Å; C114-S118 WeakPolarHBondContact O-CB 3.48Å; C114-S118 PolarHBondContact O-N 3.25Å; C114-S118 VanDerWaalsContact O-N 3.15Å; C114-S118 PolarHBondContact O-OG 2.81Å; L115-S118 PolarHBondContact O-N 2.85Å
119	R	83.4	Confident	85.4	Confident	231 Å²	231	70.9 Å²	70.9	87%	0.872	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-87.7	129.7	174.3	-65.5	-172.3	-178.8	-146.7	0.8	109.2
120	C	81.4	Confident	85	Confident	47 Å²	47	70.3 Å²	70.3	32%	0.318	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-80.9	127.7	172.8	-175.8	0	0	0	0	110.2	L33 L57	L33-C120 HydrophobicContact CD2-CB 4.41Å; L57-C120 HydrophobicContact CD1-CB 3.89Å
121	N	83.1	Confident	84.6	Confident	70 Å²	70	71.4 Å²	71.4	37%	0.374	40%	0.398	S	S	.	.			trans	-109.4	102.1	173.5	-176.3	-4.9	0	0	0	110.7	Y41 S123 L124	Y41-N121 WeakPolarHBondContact CE2-O 3.05Å; Y41-N121 PolarHBondContact OH-N 3.38Å; N121-S123 PolarHBondContact O-N 3.31Å; N121-S123 WeakPolarHBondContact OD1-CB 3.5Å; N121-S123 PolarHBondContact OD1-N 2.92Å; N121-S123 VanDerWaalsContact OD1-N 3.16Å; N121-L124 HydrophobicContact CB-CD1 4.11Å; N121-L124 HydrophobicContact CB-CG 4.2Å; N121-L124 PolarHBondContact O-N 3.19Å
122	P	79.9	Confident	84.3	Confident	95 Å²	95	71.7 Å²	71.7	62%	0.617	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-55.9	-25.2	-177.5	-26.2	34.8	0	0	0	114.7	L124 R125	P122-L124 PolarHBondContact O-N 3.27Å; P122-R125 WeakPolarHBondContact O-CB 3.42Å; P122-R125 PolarHBondContact O-N 3.11Å
123	S	84	Confident	83.5	Confident	99 Å²	99	75.1 Å²	75.1	69%	0.692	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-68.4	-15.9	178.8	-57.6	0	0	0	0	114.1	N121 R125	N121-S123 PolarHBondContact O-N 3.31Å; N121-S123 WeakPolarHBondContact OD1-CB 3.5Å; N121-S123 PolarHBondContact OD1-N 2.92Å; N121-S123 VanDerWaalsContact OD1-N 3.16Å; S123-R125 VanDerWaalsContact C-N 3.31Å
124	L	82.9	Confident	82.1	Confident	33 Å²	33	76.7 Å²	76.7	17%	0.173	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-88.1	2.9	177.2	-61.8	-180	0	0	0	113.1	Y41 G42 V54 D55 N121 P122 L127	Y41-L124 HydrophobicContact CD2-CB 4.48Å; Y41-L124 HydrophobicContact CE1-CB 4.35Å; Y41-L124 HydrophobicContact CE1-CD1 4.31Å; Y41-L124 HydrophobicContact CE2-CB 4.12Å; G42-L124 PolarHBondContact N-O 3.02Å; V54-L124 HydrophobicContact CG2-CD1 4.12Å; V54-L124 HydrophobicContact CG2-CD2 4.46Å; D55-L124 HydrophobicContact CB-CD1 3.98Å; D55-L124 WeakPolarHBondContact OD2-CD1 3.39Å; N121-L124 HydrophobicContact CB-CD1 4.11Å; N121-L124 HydrophobicContact CB-CG 4.2Å; N121-L124 PolarHBondContact O-N 3.19Å; P122-L124 PolarHBondContact O-N 3.27Å; L124-L127 HydrophobicContact CD2-CD1 3.97Å
125	R	83.8	Confident	80	Confident	98 Å²	98	78.7 Å²	78.7	37%	0.37	47%	0.473	S	S	.	.	B	Isolated β-bridge	trans	-79	138.8	174.7	-66.8	-172	67.3	-178	3.8	111.7	R36 D37 E39 D40 Y41 P122 S123 L127	R36-R125 PolarHBondContact O-NH2 3.34Å; D37-R125 WeakPolarHBondContact O-CD 3.35Å; E39-R125 PolarHBondContact O-NE 3.34Å; E39-R125 PolarHBondContact O-NH2 2.98Å; D40-R125 CarbonylContact O-C 3.24Å; D40-R125 WeakPolarHBondContact O-CA 3.1Å; Y41-R125 HydrophobicContact CD2-CG 3.99Å; P122-R125 WeakPolarHBondContact O-CB 3.42Å; P122-R125 PolarHBondContact O-N 3.11Å; S123-R125 VanDerWaalsContact C-N 3.31Å; R125-L127 VanDerWaalsContact C-N 3.29Å
126	G	81.3	Confident	77.7	Confident	58 Å²	58	85.9 Å²	85.9	60%	0.598	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	25.6	179.7	0	0	0	0	0	113.3	D40 T128	D40-G126 PolarHBondContact O-N 2.89Å; G126-T128 PolarHBondContact O-N 2.88Å
127	L	83.8	Confident	75.6	Confident	39 Å²	39	87.9 Å²	87.9	20%	0.204	53%	0.534	C	S	.	.			trans	-60.5	133.7	178.2	-143.7	95.7	0	0	0	110.2	R46 V54 L124 R125 A131	R46-L127 PolarHBondContact NH2-O 2.84Å; V54-L127 HydrophobicContact CG1-CD2 4.27Å; L124-L127 HydrophobicContact CD2-CD1 3.97Å; R125-L127 VanDerWaalsContact C-N 3.29Å; L127-A131 HydrophobicContact CD2-CB 3.6Å; L127-A131 HydrophobicContact CG-CB 3.93Å
128	T	84.4	Confident	73	Confident	95 Å²	95	85.7 Å²	85.7	58%	0.583	54%	0.54	S	S	*	.			trans	-68.6	151	178.1	62.5	0	0	0	0	111.1	G126 A130 A131	G126-T128 PolarHBondContact O-N 2.88Å; T128-A130 PolarHBondContact O-N 2.99Å; T128-A131 WeakPolarHBondContact O-CB 3.13Å; T128-A131 PolarHBondContact O-N 3.11Å; T128-A131 VanDerWaalsContact O-N 3.08Å
129	E	78.5	Confident	70.7	Confident	128 Å²	128	88 Å²	88	60%	0.598	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-58.4	-34.9	177.4	-64.8	-175.4	176.2	0	0	112.4	S50 A131 C132 S133	S50-E129 WeakPolarHBondContact OG-CB 3.1Å; E129-A131 PolarHBondContact O-N 2.87Å; E129-C132 VanDerWaalsContact O-CB 3.31Å; E129-C132 WeakPolarHBondContact O-CB 3.18Å; E129-C132 PolarHBondContact O-N 2.78Å; E129-S133 PolarHBondContact O-OG 3.44Å
130	A	80.6	Confident	68.3	Low	78 Å²	78	80 Å²	80	65%	0.645	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-59.8	-33.9	176.6	0	0	0	0	0	113.1	T128 C132 S133	T128-A130 PolarHBondContact O-N 2.99Å; A130-C132 PolarHBondContact O-N 3.09Å; A130-S133 PolarHBondContact O-N 3.47Å
131	A	81.8	Confident	66	Low	57 Å²	57	86.9 Å²	86.9	47%	0.471	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-72.2	-14.2	177.3	0	0	0	0	0	113	L127 T128 E129	L127-A131 HydrophobicContact CD2-CB 3.6Å; L127-A131 HydrophobicContact CG-CB 3.93Å; T128-A131 WeakPolarHBondContact O-CB 3.13Å; T128-A131 PolarHBondContact O-N 3.11Å; T128-A131 VanDerWaalsContact O-N 3.08Å; E129-A131 PolarHBondContact O-N 2.87Å
132	C	82	Confident	63.8	Low	7 Å²	7	88.8 Å²	88.8	5%	0.047	60%	0.596	C	S	.	*	G	3₁₀ helix	trans	-88.7	-10.2	174.3	-61.4	0	0	0	0	113.4	C43 S50 G51 N52 E129 A130	C43-C132 VanDerWaalsContact CA-SG 3.53Å; C43-C132 HydrophobicContact CB-CB 3.9Å; C43-C132 WeakPolarHBondContact CB-SG 3.22Å; C43-C132 WeakPolarHBondContact SG-CA 3.48Å; C43-C132 WeakPolarHBondContact SG-CB 3.26Å; C43-C132 CovalentContact SG-SG 2.04Å; C43-C132 PolarHBondContact SG-SG 3.4Å; S50-C132 WeakPolarHBondContact O-CB 3.45Å; S50-C132 PolarHBondContact O-SG 3.18Å; S50-C132 VanDerWaalsContact O-SG 3.41Å; G51-C132 WeakPolarHBondContact CA-O 3.35Å; N52-C132 PolarHBondContact N-O 2.98Å; E129-C132 VanDerWaalsContact O-CB 3.31Å; E129-C132 WeakPolarHBondContact O-CB 3.18Å; E129-C132 PolarHBondContact O-N 2.78Å; A130-C132 PolarHBondContact O-N 3.09Å
133	S	72.6	Confident	61.6	Low	83 Å²	83	87.1 Å²	87.1	58%	0.58	59%	0.587	S	S	*	*	S	Bend	trans	-96.1	-21.6	-162.8	-55.6	0	0	0	0	116.1	E129 A130	E129-S133 PolarHBondContact O-OG 3.44Å; A130-S133 PolarHBondContact O-N 3.47Å
134	A	59.2	Low	59.2	Low	99 Å²	99	86.9 Å²	86.9	82%	0.818	59%	0.585	S	S	*	*			trans	-167.3	125.5	176.1	0	0	0	0	0	113.9
135	G	46.3	Very low	56.9	Low	74 Å²	74	91 Å²	91	76%	0.763	60%	0.602	S	S	*	*			trans	177.5	100.8	161.4	0	0	0	0	0	108.5	A137	G135-A137 PolarHBondContact O-N 2.97Å
136	N	39.8	Very low	54.7	Low	154 Å²	154	91.1 Å²	91.1	82%	0.824	61%	0.609	S	S	*	*			trans	1.8	112.2	173.6	-94.9	-21.3	0	0	0	114.5	T138	N136-T138 PolarHBondContact O-N 2.58Å
137	A	43.7	Very low	52.5	Low	101 Å²	101	93.7 Å²	93.7	84%	0.835	61%	0.613	S	S	*	*			trans	-54.2	85.3	150.9	0	0	0	0	0	107.6	G135 G139	G135-A137 PolarHBondContact O-N 2.97Å; A137-G139 VanDerWaalsContact C-N 3.29Å; A137-G139 PolarHBondContact O-N 3.08Å
138	T	34.4	Very low	50.4	Low	128 Å²	128	101.8 Å²	101.8	79%	0.785	64%	0.641	S	S	*	*			trans	-56.5	113	147.3	45.5	0	0	0	0	102.4	N136 G140	N136-T138 PolarHBondContact O-N 2.58Å; T138-G140 PolarHBondContact O-N 3.48Å
139	G	38.8	Very low	48	Very low	73 Å²	73	101.2 Å²	101.2	75%	0.753	63%	0.628	S	S	*	*			trans	-60.8	72.1	177.2	0	0	0	0	0	109.5	A137 K141	A137-G139 VanDerWaalsContact C-N 3.29Å; A137-G139 PolarHBondContact O-N 3.08Å; G139-K141 PolarHBondContact O-N 3.48Å
140	G	33.1	Very low	45.9	Very low	65 Å²	65	102.1 Å²	102.1	67%	0.67	63%	0.633	S	S	*	*			trans	-60.1	100.7	155.2	0	0	0	0	0	103.3	T138 V142	T138-G140 PolarHBondContact O-N 3.48Å; G140-V142 PolarHBondContact O-N 3.17Å
141	K	31.3	Very low	43.8	Very low	190 Å²	190	102.9 Å²	102.9	83%	0.826	63%	0.629	S	S	*	*			trans	-25.4	116.8	176.6	-74.3	173.3	176.6	175.2	0	107.8	G139 S143	G139-K141 PolarHBondContact O-N 3.48Å; K141-S143 WeakPolarHBondContact O-CA 3.26Å; K141-S143 PolarHBondContact O-N 2.99Å
142	V	38.5	Very low	41.3	Very low	110 Å²	110	104.3 Å²	104.3	67%	0.667	63%	0.634	S	S	*	*			trans	-41.9	101.3	159	159.1	0	0	0	0	104.7	G140 S144 L146	G140-V142 PolarHBondContact O-N 3.17Å; V142-S144 PolarHBondContact O-N 3.47Å; V142-L146 HydrophobicContact CB-CD1 4.24Å; V142-L146 HydrophobicContact CG1-CB 3.64Å; V142-L146 HydrophobicContact CG1-CD1 3.24Å; V142-L146 HydrophobicContact CG1-CG 3.8Å; V142-L146 HydrophobicContact CG2-CD1 4.05Å
143	S	33.8	Very low	38.9	Very low	61 Å²	61	108.2 Å²	108.2	43%	0.427	66%	0.658	S	S	.	*			trans	-63.3	145.7	-170.9	-176	0	0	0	0	105.1	K141 F145 L146	K141-S143 WeakPolarHBondContact O-CA 3.26Å; K141-S143 PolarHBondContact O-N 2.99Å; S143-F145 PolarHBondContact O-N 3.41Å; S143-F145 WeakPolarHBondContact OG-CD2 3.14Å; S143-F145 WeakPolarHBondContact OG-CE2 3.44Å; S143-L146 PolarHBondContact O-N 2.86Å; S143-L146 VanDerWaalsContact O-N 3.1Å
144	S	32.8	Very low	37.2	Very low	93 Å²	93	110.7 Å²	110.7	65%	0.65	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47	3.5	178.1	47.3	0	0	0	0	116	V142 T147	V142-S144 PolarHBondContact O-N 3.47Å; S144-T147 PolarHBondContact O-OG1 2.03Å
145	F	33.7	Very low	35.8	Very low	121 Å²	121	114.3 Å²	114.3	53%	0.531	66%	0.656	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	-35.2	168.4	-65.5	-77.3	0	0	0	113.8	S143 T147 R148 W149	S143-F145 PolarHBondContact O-N 3.41Å; S143-F145 WeakPolarHBondContact OG-CD2 3.14Å; S143-F145 WeakPolarHBondContact OG-CE2 3.44Å; F145-T147 PolarHBondContact O-N 3.18Å; F145-R148 PolarHBondContact O-N 3.06Å; F145-W149 VanDerWaalsContact O-CD1 3.31Å
146	L	38.6	Very low	34.9	Very low	100 Å²	100	118 Å²	118	52%	0.524	66%	0.658	S	S	.	*	G	3₁₀ helix	trans	-64.9	-26.2	178.3	-83.2	-180	0	0	0	112.8	V142 S143 R148 W149	V142-L146 HydrophobicContact CB-CD1 4.24Å; V142-L146 HydrophobicContact CG1-CB 3.64Å; V142-L146 HydrophobicContact CG1-CD1 3.24Å; V142-L146 HydrophobicContact CG1-CG 3.8Å; V142-L146 HydrophobicContact CG2-CD1 4.05Å; S143-L146 PolarHBondContact O-N 2.86Å; S143-L146 VanDerWaalsContact O-N 3.1Å; L146-R148 PolarHBondContact O-N 3.32Å; L146-W149 PolarHBondContact O-N 2.82Å
147	T	35.4	Very low	34.4	Very low	111 Å²	111	121.8 Å²	121.8	68%	0.681	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-71.6	-10.7	171.8	35.5	0	0	0	0	114.1	S144 F145	S144-T147 PolarHBondContact O-OG1 2.03Å; F145-T147 PolarHBondContact O-N 3.18Å
148	R	38.5	Very low	33.7	Very low	209 Å²	209	125.9 Å²	125.9	79%	0.789	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-99	-1.7	175.1	-163	161.1	-172.5	160	3.4	113.2	F145 L146 E150	F145-R148 PolarHBondContact O-N 3.06Å; L146-R148 PolarHBondContact O-N 3.32Å; R148-E150 PolarHBondContact O-N 3.39Å; R148-E150 VanDerWaalsContact O-N 3.07Å
149	W	35.8	Very low	33.4	Very low	83 Å²	83	126.2 Å²	126.2	31%	0.314	66%	0.662	S	S	.	*			trans	-79.8	41.2	167	-72.8	74.3	0	0	0	111.1	A63 A110 F145 L146 V151	A63-W149 HydrophobicContact CB-CH2 3.31Å; A63-W149 HydrophobicContact CB-CZ2 3.62Å; A63-W149 HydrophobicContact CB-CZ3 3.81Å; A110-W149 HydrophobicContact CB-CH2 4.2Å; A110-W149 HydrophobicContact CB-CZ3 4.24Å; F145-W149 VanDerWaalsContact O-CD1 3.31Å; L146-W149 PolarHBondContact O-N 2.82Å; W149-V151 PolarHBondContact O-N 3.25Å
150	E	33.5	Very low	33.1	Very low	147 Å²	147	132.1 Å²	132.1	69%	0.687	67%	0.67	S	S	*	*			trans	-73.1	86.3	159.5	-71.6	-176.3	160.4	0	0	106.8	R148	R148-E150 PolarHBondContact O-N 3.39Å; R148-E150 VanDerWaalsContact O-N 3.07Å
151	V	35.8	Very low	32.8	Very low	94 Å²	94	134.4 Å²	134.4	57%	0.57	67%	0.671	S	S	*	*			trans	-50.7	124.8	142.7	-178.1	0	0	0	0	104.6	W149 T153	W149-V151 PolarHBondContact O-N 3.25Å; V151-T153 PolarHBondContact O-N 2.89Å
152	P	30.7	Very low	32.6	Very low	87 Å²	87	129.9 Å²	129.9	57%	0.565	67%	0.669	S	S	*	*			trans	-46.7	118.5	-171.6	-28.6	32.7	0	0	0	110.3	I154	P152-I154 HydrophobicContact CB-CD1 4.4Å; P152-I154 HydrophobicContact CB-CG1 4.39Å; P152-I154 PolarHBondContact O-N 3.32Å
153	T	31.5	Very low	32.1	Very low	90 Å²	90	130.9 Å²	130.9	55%	0.552	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-61.3	6.9	-175.7	-30.6	0	0	0	0	113.2	V151 Y155	V151-T153 PolarHBondContact O-N 2.89Å; T153-Y155 PolarHBondContact O-N 3.47Å
154	I	35.3	Very low	31.9	Very low	134 Å²	134	137 Å²	137	69%	0.687	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-70.4	-18.1	-178.5	-57.9	176.6	0	0	0	111.9	P152	P152-I154 HydrophobicContact CB-CD1 4.4Å; P152-I154 HydrophobicContact CB-CG1 4.39Å; P152-I154 PolarHBondContact O-N 3.32Å
155	Y	31.1	Very low	31.5	Very low	175 Å²	175	140.4 Å²	140.4	69%	0.686	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-113.7	3.4	-176.5	-73.1	-77.8	0	0	0	116.4	T153 R157	T153-Y155 PolarHBondContact O-N 3.47Å; Y155-R157 VanDerWaalsContact C-N 3.27Å; Y155-R157 PolarHBondContact O-N 2.06Å
156	L	27.3	Very low	31.3	Very low	151 Å²	151	140.2 Å²	140.2	79%	0.791	72%	0.717	S	S	*	*			trans	-89.3	22.8	175.2	-74.2	174.9	0	0	0	113.8
157	R	28.8	Very low	30.7	Very low	235 Å²	235	140 Å²	140	89%	0.887	73%	0.73	S	S	*	*			trans	-115.1	43.6	-178	-131.6	-178.1	-168.8	162.6	3.7	114	Y155	Y155-R157 VanDerWaalsContact C-N 3.27Å; Y155-R157 PolarHBondContact O-N 2.06Å
158	M	29.4	Very low	30.4	Very low	187 Å²	187	139.9 Å²	139.9	92%	0.921	74%	0.74	S	S	*	*	S	Bend	trans	-155.6	91.4	154.6	-68.5	-168.3	171.8	0	0	103.4
159	D	28	Very low	29.8	Very low	134 Å²	134	133.5 Å²	133.5	72%	0.717	74%	0.739	S	S	*	*				-174.3	99.4	79.3	-162.9	-4.3	0	0	0	107
160	Q	32.1	Very low	29.3	Very low	197 Å²	197	134.5 Å²	134.5	92%	0.921	77%	0.765	S	S	*	*			trans	-122.1	66.9	167.7	-83	-172.1	2.8	0	0	107.8
161	T	26.3	Very low	29	Very low	114 Å²	114	131.9 Å²	131.9	70%	0.699	77%	0.769	S	S	*	*			trans	-140.9	100.4	161	43.3	0	0	0	0	110.3
162	A	27.8	Very low	28.9	Very low	94 Å²	94	133 Å²	133	78%	0.777	78%	0.778	S	S	*	*			trans	67.4	132.9	156.7	0	0	0	0	0	115.7
163	T	27.4	Very low	28.6	Very low	131 Å²	131	133.9 Å²	133.9	80%	0.804	79%	0.786	S	S	*	*			cis	-163.4	139.1	41.7	15.6	0	0	0	0	109.2
164	Q	29.3	Very low	28.4	Very low	191 Å²	191	135.5 Å²	135.5	89%	0.893	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-62	138	168.4	-65.7	169.3	-14	0	0	110.7
165	I	25.4	Very low	27.9	Very low	163 Å²	163	136.6 Å²	136.6	84%	0.836	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-103.5	118.1	164.8	-60.2	173.6	0	0	0	107
166	P	28.5	Very low	27.5	Very low	117 Å²	117	133.3 Å²	133.3	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-94.3	145.1	160.4	32.6	-24.8	0	0	0	110.7
167	A	26.7	Very low	27.5	Very low	97 Å²	97	132.5 Å²	132.5	80%	0.802	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-84	147.1	-178.8	0	0	0	0	0	113.3
168	A	29	Very low	27.4	Very low	108 Å²	108	125.6 Å²	125.6	89%	0.893	80%	0.795	S	S	*	*			trans	55.4	123.8	151.1	0	0	0	0	0	121.3
169	G	25.4	Very low	27.2	Very low	74 Å²	74	121.6 Å²	121.6	76%	0.763	79%	0.786	S	S	*	*			trans	152.5	110.8	150.2	0	0	0	0	0	116.5
170	A	25.7	Very low	27.2	Very low	104 Å²	104	123.2 Å²	123.2	86%	0.86	79%	0.793	S	S	*	*			trans	61.8	126.7	151.3	0	0	0	0	0	121.2
171	A	27.4	Very low	27.1	Very low	93 Å²	93	123.9 Å²	123.9	77%	0.769	79%	0.787	S	S	*	*			trans	-69.3	154.1	155.6	0	0	0	0	0	109.8
172	P	33.7	Very low	27.3	Very low	118 Å²	118	124 Å²	124	77%	0.766	78%	0.784	S	S	*	*				-152.3	167.1	73.1	36	-13.7	0	0	0	117.9
173	S	25.3	Very low	27.4	Very low	105 Å²	105	125.3 Å²	125.3	73%	0.734	78%	0.783	S	S	*	*			trans	47.5	120.6	141.7	-53.3	0	0	0	0	124.9
174	V	25.8	Very low	27.4	Very low	124 Å²	124	125.6 Å²	125.6	75%	0.752	78%	0.778	S	S	*	*				47.6	119.3	127.3	-170.6	0	0	0	0	119.9
175	L	24.9	Very low	27.4	Very low	157 Å²	157	123.3 Å²	123.3	82%	0.822	77%	0.771	S	S	*	*				-179.5	116.6	118.3	-112.5	117.1	0	0	0	113.8
176	T	24.1	Very low	27.4	Very low	105 Å²	105	122.3 Å²	122.3	64%	0.644	77%	0.768	S	S	*	*			trans	19.2	150.2	133.3	-13.3	0	0	0	0	124.9
177	T	25.9	Very low	27.4	Very low	134 Å²	134	119.6 Å²	119.6	82%	0.822	76%	0.761	S	S	*	*			trans	84.1	143.7	156	68.7	0	0	0	0	117.5
178	A	27.5	Very low	27.5	Very low	90 Å²	90	122.2 Å²	122.2	74%	0.744	77%	0.768	S	S	*	*			cis	-161.1	134.2	-3.8	0	0	0	0	0	107.1
179	S	24.4	Very low	27.4	Very low	104 Å²	104	120.2 Å²	120.2	73%	0.727	76%	0.757	S	S	*	*				59.3	116.3	102.5	-166.6	0	0	0	0	118.5
180	L	29.6	Very low	27.5	Very low	167 Å²	167	122.5 Å²	122.5	87%	0.874	76%	0.762	S	S	*	*			trans	-172.5	93.5	140.2	-96.7	154.6	0	0	0	106.7
181	R	30	Very low	27.6	Very low	211 Å²	211	122.6 Å²	122.6	80%	0.796	76%	0.756	S	S	*	*				37	135.3	89.5	-80.6	-166.1	166.4	164.9	-2.9	114.2
182	N	29.7	Very low	27.5	Very low	116 Å²	116	122.7 Å²	122.7	62%	0.62	76%	0.757	S	S	*	*			cis	-160.6	160.5	9.3	-101.6	-9.4	0	0	0	106.2
183	T	29.3	Very low	27.1	Very low	123 Å²	123	122.7 Å²	122.7	76%	0.755	76%	0.76	S	S	*	*				-174.4	122.1	69.8	37.3	0	0	0	0	108.6
184	L	28.1	Very low	27.2	Very low	136 Å²	136	122.8 Å²	122.8	71%	0.712	77%	0.767	S	S	*	*				58.3	126.5	94.8	-79	156.8	0	0	0	114.1
185	L	29.7	Very low	27.2	Very low	143 Å²	143	120.3 Å²	120.3	75%	0.749	77%	0.766	S	S	*	*				-153.9	144	53.4	-79.1	160.6	0	0	0	114.8
186	D	25.7	Very low	27.3	Very low	142 Å²	142	123.2 Å²	123.2	76%	0.759	77%	0.772	S	S	*	*			trans	54.7	136.5	140.7	-56	-21.3	0	0	0	121.5
187	G	26.8	Very low	27.4	Very low	60 Å²	60	123.9 Å²	123.9	62%	0.619	78%	0.781	S	S	*	*			cis	152.4	118.6	11	0	0	0	0	0	106.5
188	T	29.2	Very low	27.5	Very low	153 Å²	153	122 Å²	122	94%	0.939	78%	0.779	S	S	*	*				150.5	140.5	117.4	46.7	0	0	0	0	105.1
189	G	26.4	Very low	27.9	Very low	66 Å²	66	123.1 Å²	123.1	68%	0.68	78%	0.779	S	S	*	*			cis	161.4	119.3	2.9	0	0	0	0	0	107.7
190	S	27.7	Very low	28.2	Very low	122 Å²	122	125.7 Å²	125.7	85%	0.853	78%	0.783	S	S	*	*			trans	67.9	145.7	150.7	-54.7	0	0	0	0	119.8
191	S	27.8	Very low	28	Very low	106 Å²	106	124.2 Å²	124.2	74%	0.741	78%	0.781	S	S	*	*			cis	-174.8	126.6	-1.1	45	0	0	0	0	106.2
192	A	25.9	Very low	27.9	Very low	95 Å²	95	118.5 Å²	118.5	79%	0.785	78%	0.779	S	S	*	*				81.9	144	85.1	0	0	0	0	0	117.7
193	S	26.4	Very low	27.8	Very low	118 Å²	118	118.9 Å²	118.9	83%	0.825	79%	0.785	S	S	*	*			trans	85.2	115	171.5	76.1	0	0	0	0	116.7
194	A	26.4	Very low	27.8	Very low	107 Å²	107	119.3 Å²	119.3	88%	0.884	79%	0.788	S	S	*	*				80.1	114.8	51.7	0	0	0	0	0	114
195	G	25	Very low	28.1	Very low	71 Å²	71	119 Å²	119	73%	0.732	79%	0.792	S	S	*	*			trans	142.7	110	150.9	0	0	0	0	0	118.5
196	K	27.9	Very low	28.2	Very low	218 Å²	218	117.8 Å²	117.8	95%	0.948	79%	0.792	S	S	*	*			trans	77.9	142.8	134.3	-64.6	177.9	177.9	178.3	0	120.9
197	S	26.7	Very low	28.3	Very low	120 Å²	120	118.9 Å²	118.9	84%	0.839	80%	0.798	S	S	*	*			trans	-93.6	147	-175.1	-40.5	0	0	0	0	113.9
198	A	27.8	Very low	28.2	Very low	95 Å²	95	122.1 Å²	122.1	79%	0.785	81%	0.805	S	S	*	*			trans	73.6	155.9	152.6	0	0	0	0	0	119.4
199	P	36.4	Very low	28.1	Very low	113 Å²	113	119.7 Å²	119.7	73%	0.734	79%	0.794	S	S	*	*			cis	-138.5	175.6	2	43.7	-24.4	0	0	0	117
200	I	29	Very low	28.2	Very low	157 Å²	157	122.9 Å²	122.9	81%	0.805	80%	0.8	S	S	*	*			trans	35.8	124.9	158.1	14.2	165.3	0	0	0	123.3
201	T	26.9	Very low	28.2	Very low	137 Å²	137	123 Å²	123	84%	0.84	80%	0.796	S	S	*	*				-153	127.9	127.4	-31.5	0	0	0	0	111.3
202	A	28.1	Very low	28.3	Very low	90 Å²	90	124.9 Å²	124.9	74%	0.744	80%	0.803	S	S	*	*			trans	-75.4	143.8	170.9	0	0	0	0	0	110.9
203	T	27.4	Very low	28.5	Very low	125 Å²	125	124.8 Å²	124.8	77%	0.767	80%	0.803	S	S	*	*			trans	-135	107	164.8	-50.9	0	0	0	0	109.4
204	T	29.3	Very low	28.6	Very low	132 Å²	132	122.9 Å²	122.9	81%	0.81	80%	0.801	S	S	*	*			trans	-64.3	134.4	169.1	46.4	0	0	0	0	110.8
205	T	33.1	Very low	28.8	Very low	128 Å²	128	125.8 Å²	125.8	79%	0.785	80%	0.8	S	S	*	*			trans	-125.7	150.6	161.8	47.3	0	0	0	0	109.4
206	P	31.9	Very low	28.9	Very low	118 Å²	118	130.4 Å²	130.4	77%	0.766	80%	0.803	S	S	*	*			trans	-89.3	153.5	-142.7	33.3	-34.7	0	0	0	115.1
207	L	27.3	Very low	28.9	Very low	166 Å²	166	129.2 Å²	129.2	87%	0.869	80%	0.803	S	S	*	*			trans	-63.3	122.4	168.2	-146.7	80.1	0	0	0	109.7
208	V	26.6	Very low	28.9	Very low	128 Å²	128	131.1 Å²	131.1	78%	0.776	80%	0.803	S	S	*	*			trans	-98	110.7	166.9	177	0	0	0	0	108.2
209	S	26.3	Very low	28.7	Very low	102 Å²	102	138.6 Å²	138.6	71%	0.713	81%	0.811	S	S	*	*			trans	-72.6	125.7	171.5	-46.8	0	0	0	0	109.8
210	V	27.8	Very low	28.2	Very low	133 Å²	133	136.8 Å²	136.8	81%	0.806	81%	0.812	S	S	*	*			trans	-111.8	122.5	165.8	178.6	0	0	0	0	108.4
211	T	27.2	Very low	28.1	Very low	125 Å²	125	132.8 Å²	132.8	77%	0.767	81%	0.81	S	S	*	*			trans	-73.9	141.8	-177.5	41.5	0	0	0	0	111.7	A213	T211-A213 PolarHBondContact O-N 3.46Å
212	T	30.9	Very low	28	Very low	145 Å²	145	131.5 Å²	131.5	89%	0.89	81%	0.813	S	S	*	*			trans	-74	108.4	170	46.1	0	0	0	0	110
213	A	29.5	Very low	27.8	Very low	93 Å²	93	138.6 Å²	138.6	77%	0.769	82%	0.821	S	S	*	*			trans	-95.2	112.1	162.1	0	0	0	0	0	108.3	T211	T211-A213 PolarHBondContact O-N 3.46Å
214	G	29.5	Very low	27.8	Very low	77 Å²	77	137.7 Å²	137.7	79%	0.794	82%	0.82	S	S	*	*			trans	-68.7	147.5	171.6	0	0	0	0	0	111.4
215	I	30.6	Very low	27.8	Very low	168 Å²	168	140.4 Å²	140.4	86%	0.862	82%	0.823	S	S	*	*			trans	-136.5	133.9	163.7	-61.4	-177.3	0	0	0	108.4
216	E	26.7	Very low	27.6	Very low	169 Å²	169	143.7 Å²	143.7	79%	0.79	83%	0.83	S	S	*	*			trans	-61.4	148.8	-168.3	-63.4	175.4	127.2	0	0	115.7	L218	E216-L218 PolarHBondContact O-N 3.32Å
217	M	26.9	Very low	27.3	Very low	192 Å²	192	141.8 Å²	141.8	95%	0.946	83%	0.832	S	S	*	*			trans	-73.9	107.2	161.7	-73.7	-84.7	-174.5	0	0	109.4
218	L	27.2	Very low	27.1	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	83%	0.829	S	S	*	*			trans	-94.5	101.9	164.8	-76.8	171.5	0	0	0	110	E216	E216-L218 PolarHBondContact O-N 3.32Å
219	W	24.8	Very low	27.2	Very low	252 Å²	252	136.7 Å²	136.7	96%	0.955	83%	0.834	S	S	*	*			trans	-79.3	111.2	164.7	-163	-53	0	0	0	108.5
220	G	24	Very low	27.1	Very low	74 Å²	74	143.6 Å²	143.6	76%	0.763	85%	0.845	S	S	*	*			trans	-125.5	102	173.3	0	0	0	0	0	109.8
221	G	27.6	Very low	27.3	Very low	74 Å²	74	142.3 Å²	142.3	76%	0.763	84%	0.842	S	S	*	*			trans	-69.5	146.6	-179.4	0	0	0	0	0	113.3
222	A	26.1	Very low	27.2	Very low	109 Å²	109	145.6 Å²	145.6	90%	0.901	85%	0.848	S	S	*	*			trans	-124	142.7	161.1	0	0	0	0	0	109.5
223	R	23.8	Very low	27.5	Very low	239 Å²	239	147.8 Å²	147.8	90%	0.902	85%	0.849	S	S	*	*			trans	-79.8	149.2	-154.1	-179.9	176.4	-81.5	-148.3	-5.7	112.9
224	S	27.5	Very low	27.8	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	85%	0.852	S	S	*	*			trans	-67.8	126.1	169.7	-166.1	0	0	0	0	110.7
225	E	27.5	Very low	28.1	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	85%	0.854	S	S	*	*			trans	-133.3	122	154.2	-76	-166.8	112.1	0	0	108.4
226	E	30.3	Very low	28.5	Very low	196 Å²	196	143.8 Å²	143.8	92%	0.916	85%	0.849	S	S	*	*			trans	-70.6	138.3	172.8	-74.8	177	109	0	0	110.5
227	G	25.7	Very low	29.4	Very low	79 Å²	79	139.5 Å²	139.5	81%	0.814	83%	0.834	S	S	*	*			trans	177.5	96	169	0	0	0	0	0	114.6
228	G	23.1	Very low	30.1	Very low	79 Å²	79	135.5 Å²	135.5	81%	0.814	82%	0.816	S	S	*	*			trans	87.7	98	145.5	0	0	0	0	0	117.7	R230	G228-R230 PolarHBondContact O-N 3.29Å
229	A	27.7	Very low	30.6	Very low	107 Å²	107	139 Å²	139	88%	0.884	82%	0.818	S	S	*	*			trans	-59.8	127.6	164.8	0	0	0	0	0	112.1
230	R	24.7	Very low	31.2	Very low	248 Å²	248	132.6 Å²	132.6	94%	0.936	80%	0.802	S	S	*	*			trans	-141.6	123.7	147.6	-107	177.7	-178.4	-173.8	-0.1	108.9	G228 E232	G228-R230 PolarHBondContact O-N 3.29Å; R230-E232 PolarHBondContact O-N 3.45Å
231	S	31.2	Very low	31.8	Very low	106 Å²	106	134 Å²	134	74%	0.741	80%	0.795	S	S	*	*			trans	-66.3	120.7	-176.1	179.6	0	0	0	0	111.3
232	E	26.4	Very low	32.1	Very low	193 Å²	193	133.4 Å²	133.4	90%	0.902	78%	0.779	S	S	*	*			trans	-135.1	87.9	152.9	-78.8	-165.4	128.1	0	0	107.5	R230	R230-E232 PolarHBondContact O-N 3.45Å
233	E	36.3	Very low	32.7	Very low	192 Å²	192	131.5 Å²	131.5	90%	0.897	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	121.3	168.4	-78.4	-169.3	123	0	0	109.7
234	G	36.5	Very low	33.2	Very low	82 Å²	82	129.3 Å²	129.3	85%	0.845	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	139.8	-4.2	164.7	0	0	0	0	0	117.7
235	G	36.2	Very low	33.6	Very low	81 Å²	81	125 Å²	125	84%	0.835	72%	0.722	S	S	*	*			trans	-100.2	4.2	-167.8	0	0	0	0	0	118.5
236	A	38.9	Very low	34.2	Very low	91 Å²	91	120.8 Å²	120.8	75%	0.752	73%	0.729	S	S	*	*	S	Bend	trans	-115.9	18	-158.2	0	0	0	0	0	117.7
237	V	44.7	Very low	34.9	Very low	78 Å²	78	117.1 Å²	117.1	47%	0.473	72%	0.716	S	S	.	*	S	Bend	trans	-128	26	179.9	-150	0	0	0	0	114.7	C268	V237-C268 HydrophobicContact CG1-CB 4.29Å
238	L	41.6	Very low	35.6	Very low	109 Å²	109	116.4 Å²	116.4	57%	0.571	71%	0.708	S	S	*	*			trans	-121	54.2	169	-101.6	134.3	0	0	0	109.5	L240 E259	L238-L240 PolarHBondContact O-N 2.88Å; L238-L240 VanDerWaalsContact O-N 3.12Å; L238-E259 HydrophobicContact CD1-CG 4.12Å; L238-E259 HydrophobicContact CD2-CG 4.42Å
239	R	37.2	Very low	36.4	Very low	234 Å²	234	120.5 Å²	120.5	88%	0.883	70%	0.699	S	S	*	*			trans	-73.3	102.5	162.6	-86.8	-171.7	174.3	178	-0.5	107.6	V241	R239-V241 PolarHBondContact O-N 3.47Å
240	L	38.5	Very low	36.9	Very low	118 Å²	118	118.6 Å²	118.6	62%	0.618	68%	0.68	S	S	*	*			trans	-55.2	102.4	162.4	-78.7	149.8	0	0	0	108.3	L238	L238-L240 PolarHBondContact O-N 2.88Å; L238-L240 VanDerWaalsContact O-N 3.12Å
241	V	37	Very low	37.8	Very low	102 Å²	102	115 Å²	115	62%	0.618	67%	0.666	S	S	*	*			trans	-84.3	115.2	166.3	-179.3	0	0	0	0	106.9	R239 V243	R239-V241 PolarHBondContact O-N 3.47Å; V241-V243 HydrophobicContact CG1-CG2 4.47Å; V241-V243 PolarHBondContact O-N 2.95Å
242	S	34.2	Very low	38.5	Very low	62 Å²	62	117.8 Å²	117.8	43%	0.434	66%	0.66	S	S	.	*			trans	-73.3	106.1	169.2	-69.6	0	0	0	0	108.3
243	V	37.9	Very low	39.7	Very low	69 Å²	69	113.6 Å²	113.6	42%	0.418	64%	0.641	S	S	.	*			trans	-82.3	120.3	169	-176.4	0	0	0	0	108.2	V241 G245	V241-V243 HydrophobicContact CG1-CG2 4.47Å; V241-V243 PolarHBondContact O-N 2.95Å; V243-G245 PolarHBondContact O-N 3.25Å
244	Y	33.1	Very low	40.9	Very low	194 Å²	194	106.7 Å²	106.7	76%	0.761	61%	0.609	S	S	*	*	B	Isolated β-bridge	trans	-82.8	106.4	175.2	-74.8	-92.2	0	0	0	108.9
245	G	36	Very low	42.2	Very low	17 Å²	17	105.5 Å²	105.5	18%	0.175	59%	0.587	C	S	.	*			trans	-72.2	151.7	163.7	0	0	0	0	0	110.6	V243 D247 G248	V243-G245 PolarHBondContact O-N 3.25Å; G245-D247 PolarHBondContact O-N 3.24Å; G245-G248 PolarHBondContact O-N 2.85Å
246	G	41.3	Very low	44.2	Very low	100 Å²	100	101.8 Å²	101.8	100%	1.031	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	1.3	-179.3	0	0	0	0	0	116.1
247	D	45.7	Very low	46.4	Very low	119 Å²	119	98.3 Å²	98.3	64%	0.636	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-0.6	173.5	77.9	-21.6	0	0	0	113.7	G245 R249	G245-D247 PolarHBondContact O-N 3.24Å; D247-R249 VanDerWaalsContact C-N 3.27Å; D247-R249 PolarHBondContact O-N 3.39Å; D247-R249 PolarHBondContact OD1-N 2.83Å
248	G	38.4	Very low	48.1	Very low	63 Å²	63	94.9 Å²	94.9	65%	0.649	50%	0.498	S	S	*	.	S	Bend	trans	73.4	8.1	-179.2	0	0	0	0	0	115.2	G245	G245-G248 PolarHBondContact O-N 2.85Å
249	R	41.2	Very low	50.1	Low	166 Å²	166	92.9 Å²	92.9	63%	0.626	49%	0.485	S	S	*	.			trans	-94.8	122.7	171.9	-84.2	179.7	170	-173.1	-3.9	111	D247 R251	D247-R249 VanDerWaalsContact C-N 3.27Å; D247-R249 PolarHBondContact O-N 3.39Å; D247-R249 PolarHBondContact OD1-N 2.83Å; R249-R251 PolarHBondContact O-N 3.16Å
250	S	37.9	Very low	52.3	Low	67 Å²	67	81.8 Å²	81.8	47%	0.469	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-68.1	99.8	169.2	68.7	0	0	0	0	109.6	R252	S250-R252 PolarHBondContact O-N 3Å
251	R	42.6	Very low	54.5	Low	173 Å²	173	76.3 Å²	76.3	65%	0.653	42%	0.415	S	S	*	.			trans	-78.4	97.6	166.8	-104.3	-178	166.9	167.7	-3	107.5	R249 E253	R249-R251 PolarHBondContact O-N 3.16Å; R251-E253 HydrophobicContact CB-CG 4.18Å; R251-E253 PolarHBondContact O-N 3.35Å
252	R	46.8	Very low	56.8	Low	164 Å²	164	74.6 Å²	74.6	62%	0.619	40%	0.397	S	S	*	.			trans	-72.3	86.2	169	-65	-178.2	-174.4	-171.4	0.9	107.3	S250 L254	S250-R252 PolarHBondContact O-N 3Å; R252-L254 PolarHBondContact O-N 2.89Å
253	E	52.4	Low	59.3	Low	105 Å²	105	72.3 Å²	72.3	49%	0.491	38%	0.381	S	S	.	.			trans	-75.8	110.4	-178.9	-73.7	-173	163.8	0	0	110.2	R251	R251-E253 HydrophobicContact CB-CG 4.18Å; R251-E253 PolarHBondContact O-N 3.35Å
254	L	59.9	Low	61.6	Low	46 Å²	46	70.3 Å²	70.3	24%	0.241	37%	0.368	C	S	.	.			trans	64.9	52	149.6	-65	154.5	0	0	0	119.1	R252 A256 L257 G258 H298 L302 D344	R252-L254 PolarHBondContact O-N 2.89Å; L254-A256 PolarHBondContact O-N 2.81Å; L254-L257 HydrophobicContact CB-CB 4.09Å; L254-L257 HydrophobicContact CD1-CD2 4.35Å; L254-L257 HydrophobicContact CD2-CB 4.27Å; L254-L257 PolarHBondContact O-N 2.91Å; L254-G258 PolarHBondContact O-N 2.83Å; L254-G258 VanDerWaalsContact O-N 3.16Å; L254-H298 VanDerWaalsContact CD2-CE1 3.46Å; L254-H298 WeakPolarHBondContact CD2-CE1 2.98Å; L254-L302 HydrophobicContact CD2-CD1 4.41Å; L254-D344 WeakPolarHBondContact CD2-OD1 3.2Å
255	P	64.9	Low	64.1	Low	58 Å²	58	63.1 Å²	63.1	38%	0.377	34%	0.344	S	S	.	.	H	α-helix	trans	-56.6	-36.7	172.2	22.7	-32.1	0	0	0	113	G258 E259	P255-G258 PolarHBondContact O-N 3.34Å; P255-E259 VanDerWaalsContact O-CG 3.32Å; P255-E259 WeakPolarHBondContact O-CG 3.49Å; P255-E259 PolarHBondContact O-N 3.37Å
256	A	78.8	Confident	66.4	Low	2 Å²	2	64.8 Å²	64.8	2%	0.017	36%	0.362	C	S	.	.	H	α-helix	trans	-71.5	-42.5	-177.9	0	0	0	0	0	114	L254 G258 E259 M260 L316 I320	L254-A256 PolarHBondContact O-N 2.81Å; A256-G258 VanDerWaalsContact C-N 3.32Å; A256-E259 PolarHBondContact O-N 3.38Å; A256-M260 WeakPolarHBondContact O-CE 3.33Å; A256-M260 WeakPolarHBondContact O-CG 3.4Å; A256-M260 PolarHBondContact O-N 3.29Å; A256-M260 VanDerWaalsContact O-N 3.09Å; A256-L316 HydrophobicContact CB-CD2 3.41Å; A256-L316 VanDerWaalsContact CB-CD2 3.41Å; A256-I320 HydrophobicContact CB-CD1 3.68Å; A256-I320 HydrophobicContact CB-CG1 4Å
257	L	83.6	Confident	68.3	Low	18 Å²	18	63.6 Å²	63.6	9%	0.094	33%	0.326	C	S	.	.	H	α-helix	trans	-59.8	-46.4	173.1	172.2	61.8	0	0	0	110.1	L254 E259 M260 L261 D344 T347 A348	L254-L257 HydrophobicContact CB-CB 4.09Å; L254-L257 HydrophobicContact CD1-CD2 4.35Å; L254-L257 HydrophobicContact CD2-CB 4.27Å; L254-L257 PolarHBondContact O-N 2.91Å; L257-E259 PolarHBondContact O-N 3.42Å; L257-M260 PolarHBondContact O-N 3.11Å; L257-L261 VanDerWaalsContact O-CB 3.28Å; L257-L261 WeakPolarHBondContact O-CB 3.27Å; L257-L261 PolarHBondContact O-N 2.89Å; L257-D344 HydrophobicContact CB-CB 4.03Å; L257-D344 WeakPolarHBondContact CD1-O 2.99Å; L257-T347 HydrophobicContact CD1-CG2 3.79Å; L257-T347 HydrophobicContact CD2-CG2 4.08Å; L257-A348 HydrophobicContact CD1-CB 3.93Å
258	G	81.4	Confident	69.8	Low	7 Å²	7	59 Å²	59	7%	0.072	30%	0.303	C	S	.	.	H	α-helix	trans	-59.3	-44.8	179	0	0	0	0	0	113.1	L254 P255 A256 M260 L261 R262 P269	L254-G258 PolarHBondContact O-N 2.83Å; L254-G258 VanDerWaalsContact O-N 3.16Å; P255-G258 PolarHBondContact O-N 3.34Å; A256-G258 VanDerWaalsContact C-N 3.32Å; G258-M260 PolarHBondContact O-N 3.1Å; G258-L261 PolarHBondContact O-N 3.25Å; G258-R262 WeakPolarHBondContact O-CB 3.19Å; G258-R262 PolarHBondContact O-N 3.09Å; G258-P269 VanDerWaalsContact CA-CG 3.49Å
259	E	82.3	Confident	71.5	Confident	67 Å²	67	57.6 Å²	57.6	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-41.3	176.3	-75.4	173.9	-144.4	0	0	112.5	L238 P255 A256 L257 C263 I320	L238-E259 HydrophobicContact CD1-CG 4.12Å; L238-E259 HydrophobicContact CD2-CG 4.42Å; P255-E259 VanDerWaalsContact O-CG 3.32Å; P255-E259 WeakPolarHBondContact O-CG 3.49Å; P255-E259 PolarHBondContact O-N 3.37Å; A256-E259 PolarHBondContact O-N 3.38Å; L257-E259 PolarHBondContact O-N 3.42Å; E259-C263 PolarHBondContact O-N 2.82Å; E259-C263 VanDerWaalsContact O-N 3.11Å; E259-I320 HydrophobicContact CB-CB 4.38Å; E259-I320 HydrophobicContact CB-CG2 3.96Å; E259-I320 WeakPolarHBondContact OE2-CB 3.27Å
260	M	85	Confident	72.9	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-38.5	177.2	-69	-169.3	-79.9	0	0	112.4	A256 L257 G258 C263 L264 I320 P328 C330 D344 K345 A348	A256-M260 WeakPolarHBondContact O-CE 3.33Å; A256-M260 WeakPolarHBondContact O-CG 3.4Å; A256-M260 PolarHBondContact O-N 3.29Å; A256-M260 VanDerWaalsContact O-N 3.09Å; L257-M260 PolarHBondContact O-N 3.11Å; G258-M260 PolarHBondContact O-N 3.1Å; M260-C263 WeakPolarHBondContact O-CB 3.4Å; M260-C263 PolarHBondContact O-N 2.95Å; M260-L264 WeakPolarHBondContact O-CG 3.38Å; M260-L264 PolarHBondContact O-N 3.38Å; M260-I320 HydrophobicContact CG-CG2 3.62Å; M260-P328 HydrophobicContact CB-CB 3.76Å; M260-P328 HydrophobicContact CB-CG 4.25Å; M260-P328 HydrophobicContact CG-CB 3.64Å; M260-P328 HydrophobicContact SD-CB 4.16Å; M260-C330 HydrophobicContact CE-CB 4.22Å; M260-C330 HydrophobicContact SD-CB 3.75Å; M260-D344 VanDerWaalsContact CE-C 3.48Å; M260-D344 HydrophobicContact CE-CB 3.24Å; M260-K345 HydrophobicContact CE-CB 4.21Å; M260-K345 HydrophobicContact SD-CB 3.73Å; M260-K345 HydrophobicContact SD-CG 4.17Å; M260-A348 HydrophobicContact CB-CB 3.84Å
261	L	84.8	Confident	74.6	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-44.5	176.7	-173.5	61.6	0	0	0	110.7	L257 G258 C263 L264 T265 Y272 A348 M351	L257-L261 VanDerWaalsContact O-CB 3.28Å; L257-L261 WeakPolarHBondContact O-CB 3.27Å; L257-L261 PolarHBondContact O-N 2.89Å; G258-L261 PolarHBondContact O-N 3.25Å; L261-C263 VanDerWaalsContact C-N 3.29Å; L261-C263 PolarHBondContact O-N 3.14Å; L261-L264 PolarHBondContact O-N 2.95Å; L261-T265 HydrophobicContact CD1-CG2 3.78Å; L261-T265 HydrophobicContact CG-CG2 4.45Å; L261-T265 PolarHBondContact O-N 3.42Å; L261-T265 PolarHBondContact O-OG1 3.02Å; L261-Y272 HydrophobicContact CD2-CD1 4.13Å; L261-Y272 HydrophobicContact CD2-CD2 3.44Å; L261-Y272 VanDerWaalsContact CD2-CD2 3.44Å; L261-Y272 HydrophobicContact CD2-CE1 4.08Å; L261-Y272 HydrophobicContact CD2-CE2 3.42Å; L261-Y272 VanDerWaalsContact CD2-CE2 3.42Å; L261-Y272 HydrophobicContact CD2-CG 3.8Å; L261-Y272 HydrophobicContact CG-CD2 4.49Å; L261-Y272 HydrophobicContact CG-CE2 4.04Å; L261-A348 HydrophobicContact CB-CB 4.38Å; L261-M351 HydrophobicContact CD1-CB 3.63Å; L261-M351 HydrophobicContact CD1-SD 4.33Å; L261-M351 HydrophobicContact CD2-CE 3.63Å; L261-M351 HydrophobicContact CD2-SD 4.05Å
262	R	83.8	Confident	76.1	Confident	66 Å²	66	46.4 Å²	46.4	25%	0.249	24%	0.236	C	C	.	.	H	α-helix	trans	-53.9	-46.7	172.4	174.2	68	73.5	-175.6	6.5	111.8	G258 L264 G266 R267 C268	G258-R262 WeakPolarHBondContact O-CB 3.19Å; G258-R262 PolarHBondContact O-N 3.09Å; R262-L264 PolarHBondContact O-N 2.77Å; R262-G266 PolarHBondContact NH1-O 2.04Å; R262-G266 VanDerWaalsContact O-CA 3.29Å; R262-G266 WeakPolarHBondContact O-CA 3.38Å; R262-G266 PolarHBondContact O-N 3.11Å; R262-R267 WeakPolarHBondContact CD-O 3.35Å; R262-R267 VanDerWaalsContact CZ-C 3.42Å; R262-R267 PolarHBondContact NE-O 3.14Å; R262-R267 PolarHBondContact NH1-O 3.47Å; R262-C268 VanDerWaalsContact CZ-SG 3.52Å; R262-C268 VanDerWaalsContact NH1-CA 3.26Å; R262-C268 PolarHBondContact NH1-SG 3.49Å; R262-C268 PolarHBondContact NH2-SG 3.39Å
263	C	86.8	Confident	77.3	Confident	14 Å²	14	43 Å²	43	10%	0.095	23%	0.228	C	C	.	.	H	α-helix	trans	-59.3	-33.3	178.7	175.2	0	0	0	0	112.3	E259 M260 L261 C322 N326 P328	E259-C263 PolarHBondContact O-N 2.82Å; E259-C263 VanDerWaalsContact O-N 3.11Å; M260-C263 WeakPolarHBondContact O-CB 3.4Å; M260-C263 PolarHBondContact O-N 2.95Å; L261-C263 VanDerWaalsContact C-N 3.29Å; L261-C263 PolarHBondContact O-N 3.14Å; C263-C322 HydrophobicContact CB-CB 3.72Å; C263-C322 WeakPolarHBondContact CB-SG 3.13Å; C263-C322 VanDerWaalsContact SG-CA 3.55Å; C263-C322 WeakPolarHBondContact SG-CB 3.33Å; C263-C322 CovalentContact SG-SG 2.03Å; C263-C322 PolarHBondContact SG-SG 3.07Å; C263-N326 WeakPolarHBondContact O-CA 3.37Å; C263-N326 PolarHBondContact O-OD1 2.82Å; C263-P328 HydrophobicContact CB-CB 4.35Å
264	L	87.7	Confident	78.1	Confident	27 Å²	27	42.9 Å²	42.9	14%	0.141	23%	0.228	C	C	.	.	H	α-helix	trans	-88.2	-39.2	-176.6	-71.7	168.5	0	0	0	113.7	M260 L261 R262 N326 P328 A348 E349 A352	M260-L264 WeakPolarHBondContact O-CG 3.38Å; M260-L264 PolarHBondContact O-N 3.38Å; L261-L264 PolarHBondContact O-N 2.95Å; R262-L264 PolarHBondContact O-N 2.77Å; L264-N326 HydrophobicContact CD2-CB 4.33Å; L264-N326 VanDerWaalsContact CD2-O 3.24Å; L264-N326 WeakPolarHBondContact CD2-O 3.49Å; L264-N326 PolarHBondContact O-ND2 2.93Å; L264-P328 HydrophobicContact CD1-CG 3.86Å; L264-P328 HydrophobicContact CD2-CG 4.06Å; L264-P328 HydrophobicContact CG-CG 3.82Å; L264-A348 VanDerWaalsContact CD1-C 3.4Å; L264-A348 HydrophobicContact CD1-CB 3.73Å; L264-A348 WeakPolarHBondContact CD1-O 3.44Å; L264-E349 HydrophobicContact CD1-CB 4.49Å; L264-E349 HydrophobicContact CD1-CG 3.96Å; L264-A352 HydrophobicContact CB-CB 3.66Å; L264-A352 HydrophobicContact CD1-CB 4.1Å; L264-A352 HydrophobicContact CG-CB 4.4Å
265	T	84.3	Confident	78.9	Confident	43 Å²	43	40.8 Å²	40.8	26%	0.264	22%	0.217	S	C	.	.	H	α-helix	trans	-110.7	-17	-169.2	66.6	0	0	0	0	113.6	L261 R267 A352	L261-T265 HydrophobicContact CD1-CG2 3.78Å; L261-T265 HydrophobicContact CG-CG2 4.45Å; L261-T265 PolarHBondContact O-N 3.42Å; L261-T265 PolarHBondContact O-OG1 3.02Å; T265-R267 PolarHBondContact O-N 3.05Å; T265-R267 VanDerWaalsContact O-N 3.16Å; T265-R267 WeakPolarHBondContact OG1-CB 3.42Å; T265-R267 PolarHBondContact OG1-N 3.49Å; T265-R267 VanDerWaalsContact OG1-N 3.11Å; T265-A352 HydrophobicContact CG2-CB 3.6Å
266	G	85.1	Confident	79.5	Confident	52 Å²	52	38.9 Å²	38.9	54%	0.536	21%	0.208	S	C	.	.			trans	69.9	-5.1	-168.6	0	0	0	0	0	114.1	R262	R262-G266 PolarHBondContact NH1-O 2.04Å; R262-G266 VanDerWaalsContact O-CA 3.29Å; R262-G266 WeakPolarHBondContact O-CA 3.38Å; R262-G266 PolarHBondContact O-N 3.11Å
267	R	80.9	Confident	79.5	Confident	75 Å²	75	40.4 Å²	40.4	28%	0.283	22%	0.218	S	C	.	.			trans	-87.3	158	-177.4	-70.1	178.9	171.2	-105.5	11.6	113.2	R262 T265 E271 Y272 H358	R262-R267 WeakPolarHBondContact CD-O 3.35Å; R262-R267 VanDerWaalsContact CZ-C 3.42Å; R262-R267 PolarHBondContact NE-O 3.14Å; R262-R267 PolarHBondContact NH1-O 3.47Å; T265-R267 PolarHBondContact O-N 3.05Å; T265-R267 VanDerWaalsContact O-N 3.16Å; T265-R267 WeakPolarHBondContact OG1-CB 3.42Å; T265-R267 PolarHBondContact OG1-N 3.49Å; T265-R267 VanDerWaalsContact OG1-N 3.11Å; R267-E271 IonicContact NH1-OE2 2.98Å; R267-E271 PolarHBondContact NH1-OE2 2.03Å; R267-Y272 HydrophobicContact CB-CE2 3.84Å; R267-Y272 VanDerWaalsContact CD-OH 3.26Å; R267-Y272 WeakPolarHBondContact CD-OH 3.07Å; R267-H358 PolarHBondContact NH2-NE2 3.38Å
268	C	77.3	Confident	79.3	Confident	22 Å²	22	41 Å²	41	15%	0.149	22%	0.22	C	C	.	.			trans	-82	138.3	-173.9	-45	0	0	0	0	113	V237 R262 H270 E271 Y272	V237-C268 HydrophobicContact CG1-CB 4.29Å; R262-C268 VanDerWaalsContact CZ-SG 3.52Å; R262-C268 VanDerWaalsContact NH1-CA 3.26Å; R262-C268 PolarHBondContact NH1-SG 3.49Å; R262-C268 PolarHBondContact NH2-SG 3.39Å; C268-H270 WeakPolarHBondContact CB-CE1 3.5Å; C268-H270 VanDerWaalsContact CB-ND1 3.26Å; C268-H270 WeakPolarHBondContact CB-ND1 3.02Å; C268-H270 PolarHBondContact O-N 2.95Å; C268-H270 VanDerWaalsContact SG-CE1 3.58Å; C268-E271 HydrophobicContact CB-CG 4.18Å; C268-E271 WeakPolarHBondContact CB-OE1 3.43Å; C268-E271 PolarHBondContact N-OE1 2.95Å; C268-E271 VanDerWaalsContact O-CB 3.32Å; C268-E271 WeakPolarHBondContact O-CB 3.4Å; C268-E271 PolarHBondContact O-N 3.18Å; C268-E271 PolarHBondContact SG-OE1 3.35Å; C268-Y272 VanDerWaalsContact O-CD2 3.28Å; C268-Y272 WeakPolarHBondContact O-CD2 3.46Å
269	P	74.8	Confident	78.9	Confident	34 Å²	34	41.1 Å²	41.1	22%	0.221	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-54.8	-38.4	179.6	-28.3	36.4	0	0	0	113.4	G258 E271 Y272	G258-P269 VanDerWaalsContact CA-CG 3.49Å; P269-E271 PolarHBondContact O-N 3.17Å; P269-Y272 WeakPolarHBondContact O-CB 3.05Å; P269-Y272 PolarHBondContact O-N 2.99Å
270	H	69.9	Low	78.2	Confident	103 Å²	103	39 Å²	39	48%	0.477	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-62.9	-23.2	178.6	64.4	-94.4	0	0	0	113.9	C268 Y272 E273	C268-H270 WeakPolarHBondContact CB-CE1 3.5Å; C268-H270 VanDerWaalsContact CB-ND1 3.26Å; C268-H270 WeakPolarHBondContact CB-ND1 3.02Å; C268-H270 PolarHBondContact O-N 2.95Å; C268-H270 VanDerWaalsContact SG-CE1 3.58Å; H270-Y272 PolarHBondContact O-N 3.37Å; H270-Y272 VanDerWaalsContact O-N 3.17Å; H270-E273 PolarHBondContact O-N 3.34Å
271	E	73.4	Confident	76.9	Confident	52 Å²	52	43.7 Å²	43.7	24%	0.243	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-65.9	-14.4	173.9	-64.6	172.5	-118.8	0	0	112.3	R267 C268 P269 F356	R267-E271 IonicContact NH1-OE2 2.98Å; R267-E271 PolarHBondContact NH1-OE2 2.03Å; C268-E271 HydrophobicContact CB-CG 4.18Å; C268-E271 WeakPolarHBondContact CB-OE1 3.43Å; C268-E271 PolarHBondContact N-OE1 2.95Å; C268-E271 VanDerWaalsContact O-CB 3.32Å; C268-E271 WeakPolarHBondContact O-CB 3.4Å; C268-E271 PolarHBondContact O-N 3.18Å; C268-E271 PolarHBondContact SG-OE1 3.35Å; P269-E271 PolarHBondContact O-N 3.17Å; E271-F356 HydrophobicContact CB-CZ 4.3Å; E271-F356 WeakPolarHBondContact O-CZ 2.91Å
272	Y	74.8	Confident	75.5	Confident	15 Å²	15	52 Å²	52	6%	0.059	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-109.9	-4.9	-177.5	-58.1	-90.6	0	0	0	113.4	L261 R267 C268 P269 H270 M274 Y275 C279 L291 M351 F356	L261-Y272 HydrophobicContact CD2-CD1 4.13Å; L261-Y272 HydrophobicContact CD2-CD2 3.44Å; L261-Y272 VanDerWaalsContact CD2-CD2 3.44Å; L261-Y272 HydrophobicContact CD2-CE1 4.08Å; L261-Y272 HydrophobicContact CD2-CE2 3.42Å; L261-Y272 VanDerWaalsContact CD2-CE2 3.42Å; L261-Y272 HydrophobicContact CD2-CG 3.8Å; L261-Y272 HydrophobicContact CG-CD2 4.49Å; L261-Y272 HydrophobicContact CG-CE2 4.04Å; R267-Y272 HydrophobicContact CB-CE2 3.84Å; R267-Y272 VanDerWaalsContact CD-OH 3.26Å; R267-Y272 WeakPolarHBondContact CD-OH 3.07Å; C268-Y272 VanDerWaalsContact O-CD2 3.28Å; C268-Y272 WeakPolarHBondContact O-CD2 3.46Å; P269-Y272 WeakPolarHBondContact O-CB 3.05Å; P269-Y272 PolarHBondContact O-N 2.99Å; H270-Y272 PolarHBondContact O-N 3.37Å; H270-Y272 VanDerWaalsContact O-N 3.17Å; Y272-M274 VanDerWaalsContact C-N 3.27Å; Y272-M274 PolarHBondContact O-N 3.25Å; Y272-Y275 PolarHBondContact O-N 2.96Å; Y272-C279 WeakPolarHBondContact O-CB 3.38Å; Y272-L291 HydrophobicContact CD1-CD2 3.94Å; Y272-L291 HydrophobicContact CE1-CD1 4.27Å; Y272-L291 HydrophobicContact CE1-CD2 3.89Å; Y272-M351 HydrophobicContact CD1-CE 3.27Å; Y272-M351 HydrophobicContact CE1-CE 3.84Å; Y272-M351 HydrophobicContact CG-CE 3.72Å; Y272-F356 AromaticContact CD1-CD2 3.98Å; Y272-F356 HydrophobicContact CD1-CD2 3.98Å; Y272-F356 AromaticContact CD1-CE2 3.77Å; Y272-F356 HydrophobicContact CD1-CE2 3.77Å; Y272-F356 AromaticContact CE1-CD2 3.5Å; Y272-F356 HydrophobicContact CE1-CD2 3.5Å; Y272-F356 AromaticContact CE1-CE2 3.73Å; Y272-F356 HydrophobicContact CE1-CE2 3.73Å; Y272-F356 HydrophobicContact CG-CE2 4.4Å
273	E	70.7	Confident	74.2	Confident	94 Å²	94	49.9 Å²	49.9	44%	0.439	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.1	-169.3	-84.1	175	-164	0	0	114.5	H270 C279 G280	H270-E273 PolarHBondContact O-N 3.34Å; E273-C279 CarbonylContact C-O 3.56Å; E273-C279 VanDerWaalsContact C-O 3.24Å; E273-C279 VanDerWaalsContact O-O 3.1Å; E273-G280 WeakPolarHBondContact O-CA 3.47Å
274	M	70.3	Confident	72.8	Confident	102 Å²	102	53 Å²	53	50%	0.502	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	22.6	172	-49.5	-78.2	-62.5	0	0	112.5	Y272 G276 C279 S362	Y272-M274 VanDerWaalsContact C-N 3.27Å; Y272-M274 PolarHBondContact O-N 3.25Å; M274-G276 PolarHBondContact O-N 3.46Å; M274-G276 VanDerWaalsContact O-N 3.15Å; M274-C279 CarbonylContact C-O 3.51Å; M274-C279 WeakPolarHBondContact CA-O 3.23Å; M274-C279 PolarHBondContact N-O 3.16Å; M274-S362 WeakPolarHBondContact CB-OXT 3.16Å; M274-S362 VanDerWaalsContact CG-OXT 3.29Å; M274-S362 WeakPolarHBondContact CG-OXT 3.3Å
275	Y	76.5	Confident	71.9	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	32%	0.32	C	S	.	.			trans	-66.7	116.4	-179	-174	-79.6	0	0	0	111.3	Y272 C279 D289 L291 D292 F356 N357 L360	Y272-Y275 PolarHBondContact O-N 2.96Å; Y275-C279 PolarHBondContact N-O 3.46Å; Y275-C279 WeakPolarHBondContact O-CB 3.14Å; Y275-C279 PolarHBondContact O-N 3.48Å; Y275-D289 WeakPolarHBondContact CE1-OD1 3.44Å; Y275-D289 PolarHBondContact OH-OD2 2.85Å; Y275-L291 HydrophobicContact CD1-CB 4.33Å; Y275-L291 HydrophobicContact CD1-CD2 3.75Å; Y275-L291 HydrophobicContact CD1-CG 4.01Å; Y275-L291 HydrophobicContact CD2-CD2 3.9Å; Y275-L291 HydrophobicContact CE1-CB 3.64Å; Y275-L291 HydrophobicContact CE1-CD2 3.54Å; Y275-L291 HydrophobicContact CE1-CG 3.78Å; Y275-L291 HydrophobicContact CE2-CD2 3.65Å; Y275-L291 HydrophobicContact CG-CD2 3.91Å; Y275-L291 VanDerWaalsContact CZ-CD2 3.43Å; Y275-D292 HydrophobicContact CD1-CB 4.45Å; Y275-D292 HydrophobicContact CE1-CB 4.3Å; Y275-F356 HydrophobicContact CD2-CD2 4.21Å; Y275-F356 AromaticContact CD2-CE2 3.7Å; Y275-F356 HydrophobicContact CD2-CE2 3.7Å; Y275-F356 HydrophobicContact CD2-CZ 4.04Å; Y275-F356 HydrophobicContact CE2-CD2 4.06Å; Y275-F356 AromaticContact CE2-CE2 3.96Å; Y275-F356 HydrophobicContact CE2-CE2 3.96Å; Y275-F356 HydrophobicContact CE2-CG 4.49Å; Y275-F356 HydrophobicContact CE2-CZ 4.29Å; Y275-N357 HydrophobicContact CE2-CB 4.4Å; Y275-N357 WeakPolarHBondContact CE2-O 3.5Å; Y275-N357 WeakPolarHBondContact OH-CB 3.29Å; Y275-N357 PolarHBondContact OH-N 2.88Å; Y275-L360 HydrophobicContact CE1-CD1 3.82Å; Y275-L360 HydrophobicContact CE2-CB 4.29Å; Y275-L360 HydrophobicContact CE2-CD1 4.45Å
276	G	78.3	Confident	71.3	Confident	19 Å²	19	59.2 Å²	59.2	20%	0.196	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	-148.5	174.8	0	0	0	0	0	113.4	M274	M274-G276 PolarHBondContact O-N 3.46Å; M274-G276 VanDerWaalsContact O-N 3.15Å
277	C	77.4	Confident	71.1	Confident	34 Å²	34	58.4 Å²	58.4	23%	0.23	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-24.3	-177.1	-67.7	0	0	0	0	112.9	G283 D292	C277-G283 WeakPolarHBondContact O-CA 3.5Å; C277-D292 VanDerWaalsContact N-CG 3.33Å; C277-D292 PolarHBondContact N-OD1 2.98Å; C277-D292 VanDerWaalsContact N-OD1 3.09Å; C277-D292 PolarHBondContact N-OD2 3.27Å
278	Y	79.1	Confident	71.2	Confident	30 Å²	30	59.3 Å²	59.3	12%	0.118	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	-21.4	-166.3	-70.8	-81.4	0	0	0	114.6	G280 G285 P287 D292 C295 F296 R299	Y278-G280 VanDerWaalsContact C-N 3.31Å; Y278-G280 PolarHBondContact O-N 3.09Å; Y278-G285 WeakPolarHBondContact CE2-O 3.11Å; Y278-G285 PolarHBondContact OH-O 3.24Å; Y278-P287 HydrophobicContact CD2-CB 4.32Å; Y278-P287 HydrophobicContact CD2-CG 4.13Å; Y278-P287 HydrophobicContact CE2-CB 4.42Å; Y278-P287 HydrophobicContact CE2-CG 3.89Å; Y278-D292 WeakPolarHBondContact CA-OD1 3.29Å; Y278-D292 WeakPolarHBondContact CB-OD1 3.37Å; Y278-D292 PolarHBondContact N-OD1 3.01Å; Y278-C295 VanDerWaalsContact C-CB 3.46Å; Y278-C295 WeakPolarHBondContact O-CB 3.32Å; Y278-F296 HydrophobicContact CD1-CB 4.07Å; Y278-F296 AromaticContact CD1-CD2 3.73Å; Y278-F296 HydrophobicContact CD1-CD2 3.73Å; Y278-F296 HydrophobicContact CD1-CG 4.41Å; Y278-F296 HydrophobicContact CD2-CB 4.06Å; Y278-F296 HydrophobicContact CD2-CD2 4.39Å; Y278-F296 HydrophobicContact CE1-CB 4.48Å; Y278-F296 AromaticContact CE1-CD2 3.36Å; Y278-F296 HydrophobicContact CE1-CD2 3.36Å; Y278-F296 HydrophobicContact CE1-CE2 4.01Å; Y278-F296 HydrophobicContact CE1-CG 4.38Å; Y278-F296 HydrophobicContact CE2-CB 4.46Å; Y278-F296 HydrophobicContact CE2-CD2 4.06Å; Y278-F296 HydrophobicContact CG-CB 3.83Å; Y278-F296 HydrophobicContact CG-CD2 4.22Å; Y278-F296 AromaticContact CZ-CD2 3.51Å; Y278-R299 VanDerWaalsContact CD1-NH2 3.34Å; Y278-R299 VanDerWaalsContact CE1-NH2 3.28Å
279	C	74.7	Confident	71.4	Confident	10 Å²	10	60.2 Å²	60.2	7%	0.068	34%	0.344	C	S	.	.	S	Bend	trans	-85.4	78.3	168.8	-41.2	0	0	0	0	108.2	Y272 E273 M274 Y275 C295	Y272-C279 WeakPolarHBondContact O-CB 3.38Å; E273-C279 CarbonylContact C-O 3.56Å; E273-C279 VanDerWaalsContact C-O 3.24Å; E273-C279 VanDerWaalsContact O-O 3.1Å; M274-C279 CarbonylContact C-O 3.51Å; M274-C279 WeakPolarHBondContact CA-O 3.23Å; M274-C279 PolarHBondContact N-O 3.16Å; Y275-C279 PolarHBondContact N-O 3.46Å; Y275-C279 WeakPolarHBondContact O-CB 3.14Å; Y275-C279 PolarHBondContact O-N 3.48Å; C279-C295 HydrophobicContact CB-CB 3.78Å; C279-C295 WeakPolarHBondContact CB-SG 3.4Å; C279-C295 WeakPolarHBondContact SG-CB 3.48Å; C279-C295 CovalentContact SG-SG 2.01Å; C279-C295 PolarHBondContact SG-SG 3.08Å
280	G	66.6	Low	71.7	Confident	23 Å²	23	64.8 Å²	64.8	24%	0.237	36%	0.362	C	S	.	.	S	Bend	trans	149.4	-161.9	-178.7	0	0	0	0	0	114.9	E273 Y278	E273-G280 WeakPolarHBondContact O-CA 3.47Å; Y278-G280 VanDerWaalsContact C-N 3.31Å; Y278-G280 PolarHBondContact O-N 3.09Å
281	Q	57.7	Low	72.3	Confident	98 Å²	98	59.9 Å²	59.9	46%	0.458	34%	0.339	S	S	.	.	S	Bend	trans	-87.3	127.7	-171.1	-156.4	155.4	-7.6	0	0	113
282	E	56.3	Low	72.8	Confident	178 Å²	178	57.4 Å²	57.4	83%	0.832	33%	0.328	S	S	*	.			trans	58.2	78.6	178.8	-63.1	-166.9	174.8	0	0	115.8	A284	E282-A284 PolarHBondContact O-N 3.45Å
283	G	55.3	Low	73.1	Confident	21 Å²	21	63.3 Å²	63.3	22%	0.216	35%	0.35	C	S	.	.			trans	-78.5	115.5	175.2	0	0	0	0	0	112.7	C277 R299	C277-G283 WeakPolarHBondContact O-CA 3.5Å; G283-R299 PolarHBondContact O-NH2 2.87Å
284	A	58.2	Low	73.7	Confident	80 Å²	80	58.9 Å²	58.9	66%	0.661	33%	0.329	S	S	*	.			trans	-121.1	143.6	167.1	0	0	0	0	0	109	E282	E282-A284 PolarHBondContact O-N 3.45Å
285	G	68.1	Low	74.3	Confident	52 Å²	52	54.4 Å²	54.4	54%	0.536	31%	0.308	S	S	.	.	S	Bend	trans	100.9	-171.7	178.3	0	0	0	0	0	114.9	Y278	Y278-G285 WeakPolarHBondContact CE2-O 3.11Å; Y278-G285 PolarHBondContact OH-O 3.24Å
286	L	71.5	Confident	74.5	Confident	149 Å²	149	57.6 Å²	57.6	78%	0.78	32%	0.322	S	S	*	.	S	Bend	trans	-87.8	148.3	177.5	-70.1	168.4	0	0	0	110.2	L288	L286-L288 PolarHBondContact O-N 3.4Å
287	P	80.8	Confident	74.6	Confident	34 Å²	34	61.1 Å²	61.1	22%	0.221	33%	0.332	C	S	.	.			trans	-56.8	129.9	174	-22.2	32	0	0	0	111.3	Y278 D292 R293 F296	Y278-P287 HydrophobicContact CD2-CB 4.32Å; Y278-P287 HydrophobicContact CD2-CG 4.13Å; Y278-P287 HydrophobicContact CE2-CB 4.42Å; Y278-P287 HydrophobicContact CE2-CG 3.89Å; P287-D292 WeakPolarHBondContact CA-OD2 3.48Å; P287-D292 HydrophobicContact CB-CB 4.43Å; P287-R293 HydrophobicContact CB-CB 3.9Å; P287-R293 HydrophobicContact CB-CG 4.42Å; P287-R293 HydrophobicContact CG-CB 4.41Å; P287-R293 HydrophobicContact CG-CG 4.44Å; P287-F296 HydrophobicContact CG-CB 4.04Å; P287-F296 HydrophobicContact CG-CD1 4.5Å; P287-F296 HydrophobicContact CG-CG 4.13Å
288	L	83.3	Confident	74.7	Confident	95 Å²	95	60 Å²	60	50%	0.497	32%	0.324	S	S	.	.			trans	-73.1	-32.5	-173.5	-60.7	-175.6	0	0	0	112.8	L286 D292 L360	L286-L288 PolarHBondContact O-N 3.4Å; L288-D292 PolarHBondContact N-OD2 3.26Å; L288-L360 HydrophobicContact CB-CD1 4.07Å; L288-L360 HydrophobicContact CB-CD2 4.45Å; L288-L360 HydrophobicContact CD1-CD1 4.38Å; L288-L360 HydrophobicContact CD1-CD2 3.84Å
289	D	82.3	Confident	74.7	Confident	41 Å²	41	62.2 Å²	62.2	22%	0.219	33%	0.332	C	S	.	.	S	Bend	trans	-154.6	-169	177.5	69.1	19.3	0	0	0	112.8	Y275 L291 D292 R293 L360	Y275-D289 WeakPolarHBondContact CE1-OD1 3.44Å; Y275-D289 PolarHBondContact OH-OD2 2.85Å; D289-L291 WeakPolarHBondContact OD1-CA 3.21Å; D289-L291 WeakPolarHBondContact OD1-CB 3.33Å; D289-L291 PolarHBondContact OD1-N 3.02Å; D289-D292 WeakPolarHBondContact OD1-CB 3.28Å; D289-D292 PolarHBondContact OD1-N 3.2Å; D289-R293 VanDerWaalsContact O-CB 3.29Å; D289-R293 WeakPolarHBondContact O-CB 3.39Å; D289-R293 PolarHBondContact O-N 3.11Å; D289-L360 VanDerWaalsContact OD2-CD1 3.23Å; D289-L360 WeakPolarHBondContact OD2-CD1 3.29Å
290	Q	80.8	Confident	74.8	Confident	129 Å²	129	64.4 Å²	64.4	60%	0.603	35%	0.346	S	S	*	.	H	α-helix	trans	-65.5	-35.5	-179.3	-170.4	173	17	0	0	113.1	C294 A354	Q290-C294 PolarHBondContact O-N 3.44Å; Q290-C294 PolarHBondContact O-SG 2.75Å; Q290-A354 HydrophobicContact CB-CB 4.26Å; Q290-A354 HydrophobicContact CG-CB 4.05Å
291	L	82.3	Confident	75.4	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-71.9	-45.3	179.6	-177.7	67.6	0	0	0	110.1	Y272 Y275 D289 R293 C294 C295 M351 A354 F356	Y272-L291 HydrophobicContact CD1-CD2 3.94Å; Y272-L291 HydrophobicContact CE1-CD1 4.27Å; Y272-L291 HydrophobicContact CE1-CD2 3.89Å; Y275-L291 HydrophobicContact CD1-CB 4.33Å; Y275-L291 HydrophobicContact CD1-CD2 3.75Å; Y275-L291 HydrophobicContact CD1-CG 4.01Å; Y275-L291 HydrophobicContact CD2-CD2 3.9Å; Y275-L291 HydrophobicContact CE1-CB 3.64Å; Y275-L291 HydrophobicContact CE1-CD2 3.54Å; Y275-L291 HydrophobicContact CE1-CG 3.78Å; Y275-L291 HydrophobicContact CE2-CD2 3.65Å; Y275-L291 HydrophobicContact CG-CD2 3.91Å; Y275-L291 VanDerWaalsContact CZ-CD2 3.43Å; D289-L291 WeakPolarHBondContact OD1-CA 3.21Å; D289-L291 WeakPolarHBondContact OD1-CB 3.33Å; D289-L291 PolarHBondContact OD1-N 3.02Å; L291-R293 PolarHBondContact O-N 2.51Å; L291-C294 VanDerWaalsContact O-CB 3.23Å; L291-C294 WeakPolarHBondContact O-CB 3.28Å; L291-C294 PolarHBondContact O-N 2.78Å; L291-C295 PolarHBondContact O-N 3.36Å; L291-M351 VanDerWaalsContact CD1-CA 3.48Å; L291-M351 HydrophobicContact CD1-CB 3.47Å; L291-M351 VanDerWaalsContact CD1-CB 3.47Å; L291-M351 HydrophobicContact CD1-CE 3.98Å; L291-M351 HydrophobicContact CD1-CG 3.56Å; L291-A354 HydrophobicContact CB-CB 3.88Å; L291-A354 HydrophobicContact CD1-CB 3.98Å; L291-F356 HydrophobicContact CD2-CD2 3.62Å; L291-F356 HydrophobicContact CD2-CE2 4.23Å; L291-F356 HydrophobicContact CD2-CG 4.49Å
292	D	83.4	Confident	76.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-36.3	176.1	-164	27.7	0	0	0	111.4	Y275 C277 Y278 P287 L288 D289 C294 C295 F296	Y275-D292 HydrophobicContact CD1-CB 4.45Å; Y275-D292 HydrophobicContact CE1-CB 4.3Å; C277-D292 VanDerWaalsContact N-CG 3.33Å; C277-D292 PolarHBondContact N-OD1 2.98Å; C277-D292 VanDerWaalsContact N-OD1 3.09Å; C277-D292 PolarHBondContact N-OD2 3.27Å; Y278-D292 WeakPolarHBondContact CA-OD1 3.29Å; Y278-D292 WeakPolarHBondContact CB-OD1 3.37Å; Y278-D292 PolarHBondContact N-OD1 3.01Å; P287-D292 WeakPolarHBondContact CA-OD2 3.48Å; P287-D292 HydrophobicContact CB-CB 4.43Å; L288-D292 PolarHBondContact N-OD2 3.26Å; D289-D292 WeakPolarHBondContact OD1-CB 3.28Å; D289-D292 PolarHBondContact OD1-N 3.2Å; D292-C294 VanDerWaalsContact C-N 3.29Å; D292-C294 PolarHBondContact O-N 3.35Å; D292-C295 PolarHBondContact O-N 2.87Å; D292-C295 VanDerWaalsContact O-N 3.17Å; D292-F296 PolarHBondContact O-N 3.39Å
293	R	82.3	Confident	77.1	Confident	138 Å²	138	59.3 Å²	59.3	52%	0.521	33%	0.325	S	S	.	.	H	α-helix	trans	-64.5	-30.6	173.3	-168.5	172.2	-179.3	117.2	-2	112.8	P287 D289 L291 F296 F297	P287-R293 HydrophobicContact CB-CB 3.9Å; P287-R293 HydrophobicContact CB-CG 4.42Å; P287-R293 HydrophobicContact CG-CB 4.41Å; P287-R293 HydrophobicContact CG-CG 4.44Å; D289-R293 VanDerWaalsContact O-CB 3.29Å; D289-R293 WeakPolarHBondContact O-CB 3.39Å; D289-R293 PolarHBondContact O-N 3.11Å; L291-R293 PolarHBondContact O-N 2.51Å; R293-F296 WeakPolarHBondContact O-CB 3.23Å; R293-F296 PolarHBondContact O-N 3.02Å; R293-F297 HydrophobicContact CG-CD2 4.05Å; R293-F297 HydrophobicContact CG-CE2 3.61Å; R293-F297 HydrophobicContact CG-CZ 4.37Å; R293-F297 WeakPolarHBondContact O-CD2 3.35Å; R293-F297 PolarHBondContact O-N 3.08Å; R293-F297 VanDerWaalsContact O-N 3.14Å
294	C	83.5	Confident	77.8	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.007	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-41.2	172.9	-60.9	0	0	0	0	111.4	Q290 L291 D292 F297 H298 C350 M351	Q290-C294 PolarHBondContact O-N 3.44Å; Q290-C294 PolarHBondContact O-SG 2.75Å; L291-C294 VanDerWaalsContact O-CB 3.23Å; L291-C294 WeakPolarHBondContact O-CB 3.28Å; L291-C294 PolarHBondContact O-N 2.78Å; D292-C294 VanDerWaalsContact C-N 3.29Å; D292-C294 PolarHBondContact O-N 3.35Å; C294-F297 PolarHBondContact O-N 3.27Å; C294-H298 PolarHBondContact O-N 3.26Å; C294-C350 HydrophobicContact CB-CB 3.72Å; C294-C350 WeakPolarHBondContact CB-SG 3.44Å; C294-C350 WeakPolarHBondContact SG-CB 3.23Å; C294-C350 PolarHBondContact SG-O 3.03Å; C294-C350 CovalentContact SG-SG 2.04Å; C294-C350 PolarHBondContact SG-SG 3Å; C294-M351 HydrophobicContact CB-CG 3.75Å
295	C	81.9	Confident	78.3	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-70.3	-35.3	177	-61.5	0	0	0	0	112.3	Y278 C279 L291 D292 F297 H298 R299	Y278-C295 VanDerWaalsContact C-CB 3.46Å; Y278-C295 WeakPolarHBondContact O-CB 3.32Å; C279-C295 HydrophobicContact CB-CB 3.78Å; C279-C295 WeakPolarHBondContact CB-SG 3.4Å; C279-C295 WeakPolarHBondContact SG-CB 3.48Å; C279-C295 CovalentContact SG-SG 2.01Å; C279-C295 PolarHBondContact SG-SG 3.08Å; L291-C295 PolarHBondContact O-N 3.36Å; D292-C295 PolarHBondContact O-N 2.87Å; D292-C295 VanDerWaalsContact O-N 3.17Å; C295-F297 PolarHBondContact O-N 3.37Å; C295-H298 WeakPolarHBondContact O-CB 3.03Å; C295-H298 PolarHBondContact O-N 2.95Å; C295-R299 PolarHBondContact O-N 2.85Å
296	F	80.4	Confident	78.6	Confident	67 Å²	67	57.7 Å²	57.7	29%	0.294	29%	0.293	S	S	.	.	H	α-helix	trans	-55.5	-50.8	169.5	174.1	-106.1	0	0	0	111.4	Y278 P287 D292 R293 H298 R299 C300	Y278-F296 HydrophobicContact CD1-CB 4.07Å; Y278-F296 AromaticContact CD1-CD2 3.73Å; Y278-F296 HydrophobicContact CD1-CD2 3.73Å; Y278-F296 HydrophobicContact CD1-CG 4.41Å; Y278-F296 HydrophobicContact CD2-CB 4.06Å; Y278-F296 HydrophobicContact CD2-CD2 4.39Å; Y278-F296 HydrophobicContact CE1-CB 4.48Å; Y278-F296 AromaticContact CE1-CD2 3.36Å; Y278-F296 HydrophobicContact CE1-CD2 3.36Å; Y278-F296 HydrophobicContact CE1-CE2 4.01Å; Y278-F296 HydrophobicContact CE1-CG 4.38Å; Y278-F296 HydrophobicContact CE2-CB 4.46Å; Y278-F296 HydrophobicContact CE2-CD2 4.06Å; Y278-F296 HydrophobicContact CG-CB 3.83Å; Y278-F296 HydrophobicContact CG-CD2 4.22Å; Y278-F296 AromaticContact CZ-CD2 3.51Å; P287-F296 HydrophobicContact CG-CB 4.04Å; P287-F296 HydrophobicContact CG-CD1 4.5Å; P287-F296 HydrophobicContact CG-CG 4.13Å; D292-F296 PolarHBondContact O-N 3.39Å; R293-F296 WeakPolarHBondContact O-CB 3.23Å; R293-F296 PolarHBondContact O-N 3.02Å; F296-H298 VanDerWaalsContact C-N 3.32Å; F296-H298 PolarHBondContact O-N 2.96Å; F296-R299 PolarHBondContact O-N 3Å; F296-C300 PolarHBondContact O-N 2.9Å; F296-C300 PolarHBondContact O-SG 3.38Å; F296-C300 VanDerWaalsContact O-SG 3.4Å
297	F	80.3	Confident	78.5	Confident	94 Å²	94	54.8 Å²	54.8	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-65.9	-34.2	178.2	-72.5	-54.6	0	0	0	113.2	R293 C294 C295 R299 C300 C301	R293-F297 HydrophobicContact CG-CD2 4.05Å; R293-F297 HydrophobicContact CG-CE2 3.61Å; R293-F297 HydrophobicContact CG-CZ 4.37Å; R293-F297 WeakPolarHBondContact O-CD2 3.35Å; R293-F297 PolarHBondContact O-N 3.08Å; R293-F297 VanDerWaalsContact O-N 3.14Å; C294-F297 PolarHBondContact O-N 3.27Å; C295-F297 PolarHBondContact O-N 3.37Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 3.13Å; F297-C300 WeakPolarHBondContact O-CB 3.26Å; F297-C300 PolarHBondContact O-N 3.07Å; F297-C301 WeakPolarHBondContact O-CB 3.14Å; F297-C301 PolarHBondContact O-N 3.2Å
298	H	80.9	Confident	77.5	Confident	11 Å²	11	55.7 Å²	55.7	5%	0.051	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-48.4	172.9	-174.6	-132.3	0	0	0	111.4	L254 C294 C295 F296 C300 C301 L302 D344 T347	L254-H298 VanDerWaalsContact CD2-CE1 3.46Å; L254-H298 WeakPolarHBondContact CD2-CE1 2.98Å; C294-H298 PolarHBondContact O-N 3.26Å; C295-H298 WeakPolarHBondContact O-CB 3.03Å; C295-H298 PolarHBondContact O-N 2.95Å; F296-H298 VanDerWaalsContact C-N 3.32Å; F296-H298 PolarHBondContact O-N 2.96Å; H298-C300 VanDerWaalsContact C-N 3.35Å; H298-C300 PolarHBondContact O-N 3.19Å; H298-C301 WeakPolarHBondContact O-CA 3.39Å; H298-C301 WeakPolarHBondContact O-CB 3.36Å; H298-C301 PolarHBondContact O-N 2.9Å; H298-C301 VanDerWaalsContact O-N 3.08Å; H298-L302 WeakPolarHBondContact O-CG 3.26Å; H298-L302 PolarHBondContact O-N 3.48Å; H298-D344 IonicContact CD2-OD1 3.03Å; H298-D344 IonicContact CE1-OD1 2.63Å; H298-D344 IonicContact NE2-OD1 3.18Å; H298-D344 PolarHBondContact NE2-OD1 3.32Å; H298-T347 HydrophobicContact CB-CG2 3.66Å; H298-T347 WeakPolarHBondContact CB-OG1 3.02Å; H298-T347 PolarHBondContact CD2-OG1 3.03Å
299	R	77	Confident	76.8	Confident	75 Å²	75	54.1 Å²	54.1	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-65.2	-38.2	178.7	-162.6	153	76.8	-168	10.9	112.1	Y278 G283 C295 F296 F297 C301 L302 N303	Y278-R299 VanDerWaalsContact CD1-NH2 3.34Å; Y278-R299 VanDerWaalsContact CE1-NH2 3.28Å; G283-R299 PolarHBondContact O-NH2 2.87Å; C295-R299 PolarHBondContact O-N 2.85Å; F296-R299 PolarHBondContact O-N 3Å; F297-R299 VanDerWaalsContact C-N 3.34Å; F297-R299 PolarHBondContact O-N 3.13Å; R299-C301 VanDerWaalsContact C-N 3.33Å; R299-C301 PolarHBondContact O-N 2.97Å; R299-L302 PolarHBondContact O-N 3.08Å; R299-N303 WeakPolarHBondContact O-CB 3.28Å; R299-N303 VanDerWaalsContact O-CG 3.25Å; R299-N303 PolarHBondContact O-N 2.89Å; R299-N303 PolarHBondContact O-ND2 2.95Å
300	C	76.9	Confident	76.6	Confident	56 Å²	56	52.8 Å²	52.8	38%	0.378	29%	0.288	S	S	.	.	H	α-helix	trans	-58.8	-44	170.3	-67.6	0	0	0	0	111.8	F296 F297 H298 N303 Q304	F296-C300 PolarHBondContact O-N 2.9Å; F296-C300 PolarHBondContact O-SG 3.38Å; F296-C300 VanDerWaalsContact O-SG 3.4Å; F297-C300 WeakPolarHBondContact O-CB 3.26Å; F297-C300 PolarHBondContact O-N 3.07Å; H298-C300 VanDerWaalsContact C-N 3.35Å; H298-C300 PolarHBondContact O-N 3.19Å; C300-N303 PolarHBondContact O-N 3.44Å; C300-Q304 WeakPolarHBondContact O-CB 3.43Å; C300-Q304 PolarHBondContact O-N 3.43Å
301	C	79.1	Confident	76.1	Confident	39 Å²	39	55.2 Å²	55.2	26%	0.264	29%	0.291	S	S	.	.	H	α-helix	trans	-62.5	-46.1	177.6	-165.2	0	0	0	0	111.5	F297 H298 R299 Q304 I305 C343	F297-C301 WeakPolarHBondContact O-CB 3.14Å; F297-C301 PolarHBondContact O-N 3.2Å; H298-C301 WeakPolarHBondContact O-CA 3.39Å; H298-C301 WeakPolarHBondContact O-CB 3.36Å; H298-C301 PolarHBondContact O-N 2.9Å; H298-C301 VanDerWaalsContact O-N 3.08Å; R299-C301 VanDerWaalsContact C-N 3.33Å; R299-C301 PolarHBondContact O-N 2.97Å; C301-Q304 PolarHBondContact O-N 3.39Å; C301-I305 PolarHBondContact O-N 3.4Å; C301-C343 HydrophobicContact CB-CB 3.75Å; C301-C343 WeakPolarHBondContact CB-SG 3.27Å; C301-C343 WeakPolarHBondContact SG-CA 3.13Å; C301-C343 WeakPolarHBondContact SG-CB 3.48Å; C301-C343 CovalentContact SG-SG 2.04Å; C301-C343 PolarHBondContact SG-SG 3.24Å
302	L	76.3	Confident	75.1	Confident	43 Å²	43	59.6 Å²	59.6	23%	0.225	33%	0.328	C	S	.	.	H	α-helix	trans	-63.8	-41.5	177.6	-67.4	-178.1	0	0	0	112.5	L254 H298 R299 Q304 I305 G306 Q340 C343	L254-L302 HydrophobicContact CD2-CD1 4.41Å; H298-L302 WeakPolarHBondContact O-CG 3.26Å; H298-L302 PolarHBondContact O-N 3.48Å; R299-L302 PolarHBondContact O-N 3.08Å; L302-Q304 VanDerWaalsContact C-N 3.31Å; L302-Q304 PolarHBondContact O-N 3.43Å; L302-I305 HydrophobicContact CD2-CD1 3.84Å; L302-I305 WeakPolarHBondContact O-CG1 3.45Å; L302-I305 PolarHBondContact O-N 2.85Å; L302-G306 PolarHBondContact O-N 2.57Å; L302-Q340 HydrophobicContact CD2-CG 4.19Å; L302-C343 HydrophobicContact CD2-CB 4.23Å
303	N	74	Confident	74.1	Confident	110 Å²	110	64.8 Å²	64.8	59%	0.588	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-38.9	175	-74.4	-20.4	0	0	0	111.7	R299 C300 G306 S307	R299-N303 WeakPolarHBondContact O-CB 3.28Å; R299-N303 VanDerWaalsContact O-CG 3.25Å; R299-N303 PolarHBondContact O-N 2.89Å; R299-N303 PolarHBondContact O-ND2 2.95Å; C300-N303 PolarHBondContact O-N 3.44Å; N303-G306 WeakPolarHBondContact O-CA 3.33Å; N303-G306 PolarHBondContact O-N 3.33Å; N303-S307 PolarHBondContact O-N 3.15Å
304	Q	70.8	Confident	73.6	Confident	74 Å²	74	61.6 Å²	61.6	35%	0.346	34%	0.343	S	S	.	.	H	α-helix	trans	-66.2	-42.8	177.6	-171.1	66.3	6.5	0	0	111.4	D15 C300 C301 L302 G306 S307 M308	D15-Q304 PolarHBondContact O-NE2 3Å; C300-Q304 WeakPolarHBondContact O-CB 3.43Å; C300-Q304 PolarHBondContact O-N 3.43Å; C301-Q304 PolarHBondContact O-N 3.39Å; L302-Q304 VanDerWaalsContact C-N 3.31Å; L302-Q304 PolarHBondContact O-N 3.43Å; Q304-G306 PolarHBondContact O-N 3.1Å; Q304-S307 PolarHBondContact O-N 3.41Å; Q304-S307 PolarHBondContact O-OG 3.36Å; Q304-M308 VanDerWaalsContact O-CG 3.32Å; Q304-M308 WeakPolarHBondContact O-CG 3.39Å; Q304-M308 PolarHBondContact O-N 3.01Å
305	I	68.8	Low	73.2	Confident	13 Å²	13	69.2 Å²	69.2	7%	0.067	38%	0.376	C	S	.	.	H	α-helix	trans	-67.8	-30.3	173.7	68.8	174.1	0	0	0	111.8	C301 L302 M308 C310 L339 Q340	C301-I305 PolarHBondContact O-N 3.4Å; L302-I305 HydrophobicContact CD2-CD1 3.84Å; L302-I305 WeakPolarHBondContact O-CG1 3.45Å; L302-I305 PolarHBondContact O-N 2.85Å; I305-M308 VanDerWaalsContact CA-CE 3.43Å; I305-M308 HydrophobicContact CB-CE 3.92Å; I305-M308 HydrophobicContact CG2-CE 3.58Å; I305-M308 WeakPolarHBondContact O-CB 3.45Å; I305-M308 PolarHBondContact O-N 3.38Å; I305-C310 HydrophobicContact CB-CB 4.31Å; I305-C310 HydrophobicContact CG1-CB 4.47Å; I305-C310 VanDerWaalsContact O-CB 3.23Å; I305-C310 WeakPolarHBondContact O-CB 3.41Å; I305-C310 PolarHBondContact O-N 3.05Å; I305-C310 VanDerWaalsContact O-N 3.13Å; I305-L339 HydrophobicContact CG2-CB 3.86Å; I305-L339 HydrophobicContact CG2-CD1 4.36Å; I305-Q340 HydrophobicContact CD1-CB 3.99Å; I305-Q340 HydrophobicContact CD1-CG 4.48Å
306	G	73	Confident	73	Confident	32 Å²	32	70.1 Å²	70.1	33%	0.33	38%	0.381	S	S	.	.	H	α-helix	trans	-58.1	-47.9	170.2	0	0	0	0	0	113.2	L302 N303 Q304 M308 G309 C310	L302-G306 PolarHBondContact O-N 2.57Å; N303-G306 WeakPolarHBondContact O-CA 3.33Å; N303-G306 PolarHBondContact O-N 3.33Å; Q304-G306 PolarHBondContact O-N 3.1Å; G306-M308 PolarHBondContact O-N 2.9Å; G306-G309 PolarHBondContact O-N 3.45Å; G306-C310 WeakPolarHBondContact CA-O 3.07Å
307	S	69.5	Low	73.1	Confident	89 Å²	89	70.8 Å²	70.8	62%	0.622	39%	0.387	S	S	*	.	H	α-helix	trans	-64.6	-20.4	178.7	75.6	0	0	0	0	113.1	N303 Q304 G309	N303-S307 PolarHBondContact O-N 3.15Å; Q304-S307 PolarHBondContact O-N 3.41Å; Q304-S307 PolarHBondContact O-OG 3.36Å; S307-G309 VanDerWaalsContact C-N 3.29Å
308	M	60.9	Low	73.3	Confident	53 Å²	53	67.7 Å²	67.7	26%	0.261	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	6.1	175.2	-60.1	-174.8	-65.2	0	0	113.8	F17 P18 Q304 I305 G306 L339	F17-M308 HydrophobicContact CB-CE 3.9Å; F17-M308 HydrophobicContact CB-SD 3.64Å; F17-M308 HydrophobicContact CG-CE 4.48Å; P18-M308 WeakPolarHBondContact CD-SD 3.4Å; P18-M308 HydrophobicContact CG-SD 3.91Å; Q304-M308 VanDerWaalsContact O-CG 3.32Å; Q304-M308 WeakPolarHBondContact O-CG 3.39Å; Q304-M308 PolarHBondContact O-N 3.01Å; I305-M308 VanDerWaalsContact CA-CE 3.43Å; I305-M308 HydrophobicContact CB-CE 3.92Å; I305-M308 HydrophobicContact CG2-CE 3.58Å; I305-M308 WeakPolarHBondContact O-CB 3.45Å; I305-M308 PolarHBondContact O-N 3.38Å; G306-M308 PolarHBondContact O-N 2.9Å; M308-L339 HydrophobicContact CE-CD1 3.98Å
309	G	68.3	Low	73.5	Confident	62 Å²	62	72.7 Å²	72.7	64%	0.639	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	5.9	177.9	0	0	0	0	0	114.4	G306 S307 R311	G306-G309 PolarHBondContact O-N 3.45Å; S307-G309 VanDerWaalsContact C-N 3.29Å; G309-R311 PolarHBondContact O-N 3.31Å
310	C	77.4	Confident	73.9	Confident	12 Å²	12	70.5 Å²	70.5	8%	0.081	40%	0.396	C	S	.	.			trans	-76.4	117.5	170.3	-61.9	0	0	0	0	110	I305 G306 A312 C336	I305-C310 HydrophobicContact CB-CB 4.31Å; I305-C310 HydrophobicContact CG1-CB 4.47Å; I305-C310 VanDerWaalsContact O-CB 3.23Å; I305-C310 WeakPolarHBondContact O-CB 3.41Å; I305-C310 PolarHBondContact O-N 3.05Å; I305-C310 VanDerWaalsContact O-N 3.13Å; G306-C310 WeakPolarHBondContact CA-O 3.07Å; C310-A312 PolarHBondContact O-N 3.49Å; C310-C336 WeakPolarHBondContact CA-SG 3.36Å; C310-C336 HydrophobicContact CB-CB 3.74Å; C310-C336 WeakPolarHBondContact CB-SG 3.48Å; C310-C336 WeakPolarHBondContact SG-CA 3.35Å; C310-C336 WeakPolarHBondContact SG-CB 3.26Å; C310-C336 CovalentContact SG-SG 2.05Å; C310-C336 PolarHBondContact SG-SG 3.15Å
311	R	70.8	Confident	74.5	Confident	181 Å²	181	69.2 Å²	69.2	68%	0.683	39%	0.387	S	S	*	.			trans	-67.6	120.8	178.4	-81.2	-167.3	-170.6	-168.5	3.4	111.8	G309 D313 R314	G309-R311 PolarHBondContact O-N 3.31Å; R311-D313 VanDerWaalsContact C-N 3.27Å; R311-D313 VanDerWaalsContact CB-OD1 3.3Å; R311-D313 WeakPolarHBondContact CB-OD1 3.24Å; R311-D313 PolarHBondContact O-N 3.02Å; R311-R314 HydrophobicContact CB-CB 4.17Å; R311-R314 PolarHBondContact O-N 3.26Å
312	A	61.2	Low	74.9	Confident	93 Å²	93	71.1 Å²	71.1	77%	0.769	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-21.2	177.8	0	0	0	0	0	113.4	C310	C310-A312 PolarHBondContact O-N 3.49Å
313	D	62.5	Low	75.3	Confident	109 Å²	109	72.7 Å²	72.7	58%	0.583	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.8	177.9	63.7	-35.6	0	0	0	113.4	R311	R311-D313 VanDerWaalsContact C-N 3.27Å; R311-D313 VanDerWaalsContact CB-OD1 3.3Å; R311-D313 WeakPolarHBondContact CB-OD1 3.24Å; R311-D313 PolarHBondContact O-N 3.02Å
314	R	72.3	Confident	74.8	Confident	70 Å²	70	72.8 Å²	72.8	26%	0.264	42%	0.415	S	S	.	.	S	Bend	trans	-82.2	145.7	179.8	98.3	178.9	168.8	101	19.6	111.2	R311 L316 T334 D337	R311-R314 HydrophobicContact CB-CB 4.17Å; R311-R314 PolarHBondContact O-N 3.26Å; R314-L316 PolarHBondContact O-N 3.44Å; R314-T334 PolarHBondContact NH1-OG1 3.32Å; R314-T334 PolarHBondContact NH2-OG1 3.22Å; R314-D337 IonicContact CZ-OD1 3.97Å; R314-D337 IonicContact CZ-OD2 2.8Å; R314-D337 IonicContact NH1-OD1 3.33Å; R314-D337 PolarHBondContact NH1-OD1 3.25Å; R314-D337 IonicContact NH1-OD2 3.84Å; R314-D337 PolarHBondContact NH1-OD2 3.39Å; R314-D337 IonicContact NH2-OD1 3.64Å; R314-D337 PolarHBondContact NH2-OD1 2.93Å; R314-D337 IonicContact NH2-OD2 3.64Å
315	K	75.5	Confident	74.4	Confident	161 Å²	161	80.5 Å²	80.5	70%	0.7	44%	0.441	S	S	*	.	P	Polyproline II helix	trans	-63.6	126.1	170	-171.1	-179.4	179.2	-173	0	110.2	N317	K315-N317 PolarHBondContact O-N 3.46Å
316	L	78	Confident	74.9	Confident	29 Å²	29	84.9 Å²	84.9	15%	0.152	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-65.2	122.9	172.1	178.2	61.9	0	0	0	109.8	A256 R314 A318 D337 Q340	A256-L316 HydrophobicContact CB-CD2 3.41Å; A256-L316 VanDerWaalsContact CB-CD2 3.41Å; R314-L316 PolarHBondContact O-N 3.44Å; L316-A318 HydrophobicContact CD1-CB 4.1Å; L316-A318 HydrophobicContact CD2-CB 4.2Å; L316-A318 HydrophobicContact CG-CB 3.88Å; L316-D337 HydrophobicContact CD1-CB 3.86Å; L316-D337 WeakPolarHBondContact CD1-OD1 3.46Å; L316-Q340 HydrophobicContact CD1-CB 3.89Å; L316-Q340 HydrophobicContact CD1-CG 4.03Å; L316-Q340 HydrophobicContact CD2-CG 4.08Å
317	N	82.5	Confident	75.5	Confident	81 Å²	81	88.4 Å²	88.4	43%	0.433	47%	0.471	S	S	.	.			trans	-100.7	84.7	173.5	-68.2	-35	0	0	0	108.8	K315 V333 D337	K315-N317 PolarHBondContact O-N 3.46Å; N317-V333 HydrophobicContact CB-CG2 4.36Å; N317-V333 PolarHBondContact O-N 3.09Å; N317-V333 VanDerWaalsContact O-N 3.1Å; N317-D337 PolarHBondContact N-OD1 3.12Å; N317-D337 WeakPolarHBondContact O-CB 3.46Å
318	A	82.9	Confident	76.3	Confident	28 Å²	28	84.2 Å²	84.2	23%	0.231	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	146.9	179.6	0	0	0	0	0	111.6	L316 R331	L316-A318 HydrophobicContact CD1-CB 4.1Å; L316-A318 HydrophobicContact CD2-CB 4.2Å; L316-A318 HydrophobicContact CG-CB 3.88Å; A318-R331 VanDerWaalsContact CA-O 3.29Å; A318-R331 WeakPolarHBondContact CA-O 3.39Å
319	H	85.8	Confident	77.5	Confident	117 Å²	117	86.1 Å²	86.1	54%	0.542	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	122.4	168.3	-176.9	-38.5	0	0	0	109.1	R331	H319-R331 PolarHBondContact N-O 2.83Å; H319-R331 PolarHBondContact O-N 3.02Å
320	I	86	Confident	78.2	Confident	29 Å²	29	84.4 Å²	84.4	15%	0.149	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	137.9	173.7	-54.5	90.8	0	0	0	108.8	A256 E259 M260 R329	A256-I320 HydrophobicContact CB-CD1 3.68Å; A256-I320 HydrophobicContact CB-CG1 4Å; E259-I320 HydrophobicContact CB-CB 4.38Å; E259-I320 HydrophobicContact CB-CG2 3.96Å; E259-I320 WeakPolarHBondContact OE2-CB 3.27Å; M260-I320 HydrophobicContact CG-CG2 3.62Å; I320-R329 CarbonylContact C-O 3.59Å; I320-R329 VanDerWaalsContact CA-O 3.27Å; I320-R329 WeakPolarHBondContact CA-O 3.31Å
321	S	89	Confident	78.4	Confident	29 Å²	29	91.5 Å²	91.5	20%	0.203	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	142.9	174.7	45.8	0	0	0	0	109.5	R329	S321-R329 PolarHBondContact N-O 2.01Å; S321-R329 PolarHBondContact O-N 2.8Å; S321-R329 WeakPolarHBondContact OG-CB 3.46Å
322	C	87.6	Confident	78.8	Confident	78 Å²	78	83.3 Å²	83.3	53%	0.527	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	103.1	174.5	-169	0	0	0	0	107.8	C263	C263-C322 HydrophobicContact CB-CB 3.72Å; C263-C322 WeakPolarHBondContact CB-SG 3.13Å; C263-C322 VanDerWaalsContact SG-CA 3.55Å; C263-C322 WeakPolarHBondContact SG-CB 3.33Å; C263-C322 CovalentContact SG-SG 2.03Å; C263-C322 PolarHBondContact SG-SG 3.07Å
323	E	84.6	Confident	79.7	Confident	76 Å²	76	84.2 Å²	84.2	36%	0.355	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	153.1	173.5	-70.4	171.3	178.8	0	0	109.2	R325 K327 R329	E323-R325 PolarHBondContact O-N 3.36Å; E323-K327 PolarHBondContact N-O 3.38Å; E323-K327 VanDerWaalsContact N-O 3.14Å; E323-R329 HydrophobicContact CG-CG 4.12Å; E323-R329 WeakPolarHBondContact OE1-CG 3.24Å; E323-R329 IonicContact OE1-NE 3.59Å; E323-R329 IonicContact OE2-CZ 3.67Å; E323-R329 IonicContact OE2-NE 2.99Å; E323-R329 PolarHBondContact OE2-NE 3.18Å; E323-R329 IonicContact OE2-NH2 3.42Å; E323-R329 PolarHBondContact OE2-NH2 3.18Å
324	S	64.6	Low	80.3	Confident	112 Å²	112	81.8 Å²	81.8	78%	0.783	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.8	121.2	-172.8	52.6	0	0	0	0	113.7
325	R	61.4	Low	80.4	Confident	236 Å²	236	82.9 Å²	82.9	89%	0.891	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	72.5	179.6	-62.4	-173.4	-88.9	-165.6	-7.2	116	E323	E323-R325 PolarHBondContact O-N 3.36Å
326	N	79.2	Confident	80.5	Confident	106 Å²	106	76.5 Å²	76.5	57%	0.567	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	45.6	164.4	-57.9	0.8	0	0	0	114.7	C263 L264	C263-N326 WeakPolarHBondContact O-CA 3.37Å; C263-N326 PolarHBondContact O-OD1 2.82Å; L264-N326 HydrophobicContact CD2-CB 4.33Å; L264-N326 VanDerWaalsContact CD2-O 3.24Å; L264-N326 WeakPolarHBondContact CD2-O 3.49Å; L264-N326 PolarHBondContact O-ND2 2.93Å
327	K	84.6	Confident	80.7	Confident	106 Å²	106	75.1 Å²	75.1	46%	0.461	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	90.8	177.9	-165.6	174.6	-176.1	175.4	0	111.4	E323	E323-K327 PolarHBondContact N-O 3.38Å; E323-K327 VanDerWaalsContact N-O 3.14Å
328	P	86.6	Confident	80.4	Confident	1 Å²	1	77 Å²	77	1%	0.006	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	139.2	178	27.5	-32.9	0	0	0	111.6	M260 C263 L264	M260-P328 HydrophobicContact CB-CB 3.76Å; M260-P328 HydrophobicContact CB-CG 4.25Å; M260-P328 HydrophobicContact CG-CB 3.64Å; M260-P328 HydrophobicContact SD-CB 4.16Å; C263-P328 HydrophobicContact CB-CB 4.35Å; L264-P328 HydrophobicContact CD1-CG 3.86Å; L264-P328 HydrophobicContact CD2-CG 4.06Å; L264-P328 HydrophobicContact CG-CG 3.82Å
329	R	86.1	Confident	80.2	Confident	93 Å²	93	76.7 Å²	76.7	35%	0.351	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.6	170.5	-64.7	-63.7	-167.7	165	4.4	108.9	I320 S321 E323	I320-R329 CarbonylContact C-O 3.59Å; I320-R329 VanDerWaalsContact CA-O 3.27Å; I320-R329 WeakPolarHBondContact CA-O 3.31Å; S321-R329 PolarHBondContact N-O 2.01Å; S321-R329 PolarHBondContact O-N 2.8Å; S321-R329 WeakPolarHBondContact OG-CB 3.46Å; E323-R329 HydrophobicContact CG-CG 4.12Å; E323-R329 WeakPolarHBondContact OE1-CG 3.24Å; E323-R329 IonicContact OE1-NE 3.59Å; E323-R329 IonicContact OE2-CZ 3.67Å; E323-R329 IonicContact OE2-NE 2.99Å; E323-R329 PolarHBondContact OE2-NE 3.18Å; E323-R329 IonicContact OE2-NH2 3.42Å; E323-R329 PolarHBondContact OE2-NH2 3.18Å
330	C	83.5	Confident	80.1	Confident	26 Å²	26	72.7 Å²	72.7	18%	0.176	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123.7	173.6	-168.8	0	0	0	0	108.8	M260 C341	M260-C330 HydrophobicContact CE-CB 4.22Å; M260-C330 HydrophobicContact SD-CB 3.75Å; C330-C341 VanDerWaalsContact C-SG 3.55Å; C330-C341 HydrophobicContact CB-CB 3.54Å; C330-C341 WeakPolarHBondContact CB-SG 3.33Å; C330-C341 WeakPolarHBondContact SG-CA 3.32Å; C330-C341 WeakPolarHBondContact SG-CB 3.42Å; C330-C341 CovalentContact SG-SG 2.03Å; C330-C341 PolarHBondContact SG-SG 3Å
331	R	82.5	Confident	80.1	Confident	160 Å²	160	71.6 Å²	71.6	60%	0.604	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	96.8	179.1	-59.8	-174.5	-145	166.4	7.1	109.3	A318 H319	A318-R331 VanDerWaalsContact CA-O 3.29Å; A318-R331 WeakPolarHBondContact CA-O 3.39Å; H319-R331 PolarHBondContact N-O 2.83Å; H319-R331 PolarHBondContact O-N 3.02Å
332	G	79.5	Confident	79.9	Confident	10 Å²	10	73.2 Å²	73.2	10%	0.103	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	144.2	173.9	0	0	0	0	0	112.6	D337 K338	G332-D337 VanDerWaalsContact CA-CB 3.42Å; G332-K338 WeakPolarHBondContact O-CE 3.05Å; G332-K338 WeakPolarHBondContact O-CG 3.1Å
333	V	78.6	Confident	79.7	Confident	112 Å²	112	69.5 Å²	69.5	68%	0.679	35%	0.347	S	S	*	.	S	Bend	trans	-76.8	-55.8	178.1	179.6	0	0	0	0	110.9	N317	N317-V333 HydrophobicContact CB-CG2 4.36Å; N317-V333 PolarHBondContact O-N 3.09Å; N317-V333 VanDerWaalsContact O-N 3.1Å
334	T	75.4	Confident	79.7	Confident	57 Å²	57	65.9 Å²	65.9	35%	0.35	33%	0.33	S	S	.	.	S	Bend	trans	-90.2	170.5	180	70.5	0	0	0	0	112.2	R314 C336 D337 K338	R314-T334 PolarHBondContact NH1-OG1 3.32Å; R314-T334 PolarHBondContact NH2-OG1 3.22Å; T334-C336 VanDerWaalsContact C-N 3.29Å; T334-C336 PolarHBondContact O-N 3.31Å; T334-C336 PolarHBondContact OG1-N 3.26Å; T334-D337 VanDerWaalsContact CB-OD2 3.24Å; T334-D337 WeakPolarHBondContact CB-OD2 3.47Å; T334-D337 VanDerWaalsContact CG2-OD2 3.31Å; T334-D337 WeakPolarHBondContact CG2-OD2 3.32Å; T334-D337 PolarHBondContact N-OD2 2.72Å; T334-D337 PolarHBondContact O-N 3.21Å; T334-D337 VanDerWaalsContact O-N 3.15Å; T334-D337 PolarHBondContact OG1-N 2.98Å; T334-D337 VanDerWaalsContact OG1-N 3.1Å; T334-D337 PolarHBondContact OG1-OD2 3.13Å; T334-K338 WeakPolarHBondContact O-CG 3.34Å; T334-K338 PolarHBondContact O-N 2.98Å
335	V	74.4	Confident	80.7	Confident	93 Å²	93	62.9 Å²	62.9	56%	0.564	30%	0.303	S	S	*	.	H	α-helix	trans	-56.2	-46.2	171.5	177.2	0	0	0	0	110.6	D337 K338 L339	V335-D337 VanDerWaalsContact C-N 3.31Å; V335-D337 PolarHBondContact O-N 3Å; V335-K338 PolarHBondContact O-N 2.87Å; V335-L339 HydrophobicContact CG1-CD1 3.94Å; V335-L339 HydrophobicContact CG1-CG 4.27Å; V335-L339 VanDerWaalsContact O-CG 3.27Å; V335-L339 WeakPolarHBondContact O-CG 3.49Å; V335-L339 PolarHBondContact O-N 3.27Å
336	C	78.8	Confident	81.7	Confident	28 Å²	28	54.4 Å²	54.4	19%	0.189	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-35.9	177.2	-70.2	0	0	0	0	112.6	C310 T334 Q340	C310-C336 WeakPolarHBondContact CA-SG 3.36Å; C310-C336 HydrophobicContact CB-CB 3.74Å; C310-C336 WeakPolarHBondContact CB-SG 3.48Å; C310-C336 WeakPolarHBondContact SG-CA 3.35Å; C310-C336 WeakPolarHBondContact SG-CB 3.26Å; C310-C336 CovalentContact SG-SG 2.05Å; C310-C336 PolarHBondContact SG-SG 3.15Å; T334-C336 VanDerWaalsContact C-N 3.29Å; T334-C336 PolarHBondContact O-N 3.31Å; T334-C336 PolarHBondContact OG1-N 3.26Å; C336-Q340 WeakPolarHBondContact O-CB 3.5Å; C336-Q340 PolarHBondContact O-N 3.04Å
337	D	80.8	Confident	81.9	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-67.3	-40.5	176.3	-60.7	-51.9	0	0	0	110.9	R314 L316 N317 G332 T334 V335 C341	R314-D337 IonicContact CZ-OD1 3.97Å; R314-D337 IonicContact CZ-OD2 2.8Å; R314-D337 IonicContact NH1-OD1 3.33Å; R314-D337 PolarHBondContact NH1-OD1 3.25Å; R314-D337 IonicContact NH1-OD2 3.84Å; R314-D337 PolarHBondContact NH1-OD2 3.39Å; R314-D337 IonicContact NH2-OD1 3.64Å; R314-D337 PolarHBondContact NH2-OD1 2.93Å; R314-D337 IonicContact NH2-OD2 3.64Å; L316-D337 HydrophobicContact CD1-CB 3.86Å; L316-D337 WeakPolarHBondContact CD1-OD1 3.46Å; N317-D337 PolarHBondContact N-OD1 3.12Å; N317-D337 WeakPolarHBondContact O-CB 3.46Å; G332-D337 VanDerWaalsContact CA-CB 3.42Å; T334-D337 VanDerWaalsContact CB-OD2 3.24Å; T334-D337 WeakPolarHBondContact CB-OD2 3.47Å; T334-D337 VanDerWaalsContact CG2-OD2 3.31Å; T334-D337 WeakPolarHBondContact CG2-OD2 3.32Å; T334-D337 PolarHBondContact N-OD2 2.72Å; T334-D337 PolarHBondContact O-N 3.21Å; T334-D337 VanDerWaalsContact O-N 3.15Å; T334-D337 PolarHBondContact OG1-N 2.98Å; T334-D337 VanDerWaalsContact OG1-N 3.1Å; T334-D337 PolarHBondContact OG1-OD2 3.13Å; V335-D337 VanDerWaalsContact C-N 3.31Å; V335-D337 PolarHBondContact O-N 3Å; D337-C341 WeakPolarHBondContact O-CB 3.41Å; D337-C341 PolarHBondContact O-N 3.37Å; D337-C341 PolarHBondContact O-SG 3.17Å; D337-C341 VanDerWaalsContact O-SG 3.38Å
338	K	77.4	Confident	81.9	Confident	119 Å²	119	44.5 Å²	44.5	52%	0.517	23%	0.23	S	C	.	.	H	α-helix	trans	-66.8	-40.8	177.9	-69.1	171.8	-174.4	178.6	0	111.7	G332 T334 V335 C341 V342	G332-K338 WeakPolarHBondContact O-CE 3.05Å; G332-K338 WeakPolarHBondContact O-CG 3.1Å; T334-K338 WeakPolarHBondContact O-CG 3.34Å; T334-K338 PolarHBondContact O-N 2.98Å; V335-K338 PolarHBondContact O-N 2.87Å; K338-C341 WeakPolarHBondContact O-CB 3.32Å; K338-C341 PolarHBondContact O-N 2.9Å; K338-V342 WeakPolarHBondContact O-CG2 3.18Å; K338-V342 PolarHBondContact O-N 3.18Å; K338-V342 VanDerWaalsContact O-N 3.11Å
339	L	78.6	Confident	81.8	Confident	23 Å²	23	47.9 Å²	47.9	12%	0.12	25%	0.246	C	C	.	.	H	α-helix	trans	-65.1	-44.8	176.8	-69.5	174.2	0	0	0	111.4	F17 I305 M308 V335 C341 V342 C343	F17-L339 HydrophobicContact CD1-CD2 3.55Å; F17-L339 HydrophobicContact CE1-CD2 3.19Å; F17-L339 HydrophobicContact CZ-CD2 4.04Å; I305-L339 HydrophobicContact CG2-CB 3.86Å; I305-L339 HydrophobicContact CG2-CD1 4.36Å; M308-L339 HydrophobicContact CE-CD1 3.98Å; V335-L339 HydrophobicContact CG1-CD1 3.94Å; V335-L339 HydrophobicContact CG1-CG 4.27Å; V335-L339 VanDerWaalsContact O-CG 3.27Å; V335-L339 WeakPolarHBondContact O-CG 3.49Å; V335-L339 PolarHBondContact O-N 3.27Å; L339-C341 VanDerWaalsContact C-N 3.34Å; L339-C341 PolarHBondContact O-N 2.9Å; L339-V342 WeakPolarHBondContact O-CB 3.09Å; L339-V342 PolarHBondContact O-N 3.23Å; L339-V342 VanDerWaalsContact O-N 3.09Å; L339-C343 PolarHBondContact O-N 3.14Å; L339-C343 VanDerWaalsContact O-N 3.07Å
340	Q	83.9	Confident	81.7	Confident	32 Å²	32	45.8 Å²	45.8	15%	0.15	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-39.5	175.3	-174.3	168.7	-9.4	0	0	111.8	L302 I305 L316 C336 V342 C343 D344	L302-Q340 HydrophobicContact CD2-CG 4.19Å; I305-Q340 HydrophobicContact CD1-CB 3.99Å; I305-Q340 HydrophobicContact CD1-CG 4.48Å; L316-Q340 HydrophobicContact CD1-CB 3.89Å; L316-Q340 HydrophobicContact CD1-CG 4.03Å; L316-Q340 HydrophobicContact CD2-CG 4.08Å; C336-Q340 WeakPolarHBondContact O-CB 3.5Å; C336-Q340 PolarHBondContact O-N 3.04Å; Q340-V342 PolarHBondContact O-N 3.39Å; Q340-C343 PolarHBondContact O-N 2.04Å; Q340-C343 VanDerWaalsContact O-N 3.14Å; Q340-D344 WeakPolarHBondContact O-CB 2.98Å; Q340-D344 VanDerWaalsContact O-CG 3.31Å; Q340-D344 PolarHBondContact O-N 2.85Å
341	C	84.3	Confident	81.8	Confident	7 Å²	7	44.9 Å²	44.9	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-54.8	-37	170.4	-84.9	0	0	0	0	112.9	C330 D337 K338 L339 K345	C330-C341 VanDerWaalsContact C-SG 3.55Å; C330-C341 HydrophobicContact CB-CB 3.54Å; C330-C341 WeakPolarHBondContact CB-SG 3.33Å; C330-C341 WeakPolarHBondContact SG-CA 3.32Å; C330-C341 WeakPolarHBondContact SG-CB 3.42Å; C330-C341 CovalentContact SG-SG 2.03Å; C330-C341 PolarHBondContact SG-SG 3Å; D337-C341 WeakPolarHBondContact O-CB 3.41Å; D337-C341 PolarHBondContact O-N 3.37Å; D337-C341 PolarHBondContact O-SG 3.17Å; D337-C341 VanDerWaalsContact O-SG 3.38Å; K338-C341 WeakPolarHBondContact O-CB 3.32Å; K338-C341 PolarHBondContact O-N 2.9Å; L339-C341 VanDerWaalsContact C-N 3.34Å; L339-C341 PolarHBondContact O-N 2.9Å; C341-K345 WeakPolarHBondContact O-CB 2.97Å; C341-K345 PolarHBondContact O-N 2.81Å
342	V	85.9	Confident	82.1	Confident	62 Å²	62	39.1 Å²	39.1	38%	0.376	23%	0.225	S	C	.	.	H	α-helix	trans	-68.8	-47.6	176.2	173	0	0	0	0	110.3	K338 L339 Q340 K345 T346	K338-V342 WeakPolarHBondContact O-CG2 3.18Å; K338-V342 PolarHBondContact O-N 3.18Å; K338-V342 VanDerWaalsContact O-N 3.11Å; L339-V342 WeakPolarHBondContact O-CB 3.09Å; L339-V342 PolarHBondContact O-N 3.23Å; L339-V342 VanDerWaalsContact O-N 3.09Å; Q340-V342 PolarHBondContact O-N 3.39Å; V342-K345 PolarHBondContact O-N 2.84Å; V342-T346 HydrophobicContact CG1-CG2 4.28Å; V342-T346 WeakPolarHBondContact O-CB 3.3Å; V342-T346 VanDerWaalsContact O-CG2 3.25Å; V342-T346 WeakPolarHBondContact O-CG2 3.32Å; V342-T346 PolarHBondContact O-N 2.91Å; V342-T346 PolarHBondContact O-OG1 2.9Å
343	C	82.6	Confident	82.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-56.1	-53.9	175.4	-62.5	0	0	0	0	110.9	C301 L302 L339 Q340 K345 T346 T347	C301-C343 HydrophobicContact CB-CB 3.75Å; C301-C343 WeakPolarHBondContact CB-SG 3.27Å; C301-C343 WeakPolarHBondContact SG-CA 3.13Å; C301-C343 WeakPolarHBondContact SG-CB 3.48Å; C301-C343 CovalentContact SG-SG 2.04Å; C301-C343 PolarHBondContact SG-SG 3.24Å; L302-C343 HydrophobicContact CD2-CB 4.23Å; L339-C343 PolarHBondContact O-N 3.14Å; L339-C343 VanDerWaalsContact O-N 3.07Å; Q340-C343 PolarHBondContact O-N 2.04Å; Q340-C343 VanDerWaalsContact O-N 3.14Å; C343-K345 PolarHBondContact O-N 2.05Å; C343-T346 PolarHBondContact O-N 3.47Å; C343-T346 PolarHBondContact O-OG1 3.37Å; C343-T347 WeakPolarHBondContact O-CB 3.03Å; C343-T347 PolarHBondContact O-N 3.34Å; C343-T347 PolarHBondContact O-OG1 3.13Å; C343-T347 VanDerWaalsContact O-OG1 3.05Å
344	D	85.8	Confident	82.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.7	-41	-175.8	-66.3	-13.1	0	0	0	111.6	L254 L257 M260 H298 Q340 A348	L254-D344 WeakPolarHBondContact CD2-OD1 3.2Å; L257-D344 HydrophobicContact CB-CB 4.03Å; L257-D344 WeakPolarHBondContact CD1-O 2.99Å; M260-D344 VanDerWaalsContact CE-C 3.48Å; M260-D344 HydrophobicContact CE-CB 3.24Å; H298-D344 IonicContact CD2-OD1 3.03Å; H298-D344 IonicContact CE1-OD1 2.63Å; H298-D344 IonicContact NE2-OD1 3.18Å; H298-D344 PolarHBondContact NE2-OD1 3.32Å; Q340-D344 WeakPolarHBondContact O-CB 2.98Å; Q340-D344 VanDerWaalsContact O-CG 3.31Å; Q340-D344 PolarHBondContact O-N 2.85Å; D344-A348 WeakPolarHBondContact O-CB 3.37Å; D344-A348 PolarHBondContact O-N 3.39Å
345	K	84.1	Confident	83.1	Confident	49 Å²	49	45.8 Å²	45.8	21%	0.213	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-46.2	178.9	-176.2	-178.3	170.8	-168.9	0	112.1	M260 C341 V342 C343 T347 A348 E349	M260-K345 HydrophobicContact CE-CB 4.21Å; M260-K345 HydrophobicContact SD-CB 3.73Å; M260-K345 HydrophobicContact SD-CG 4.17Å; C341-K345 WeakPolarHBondContact O-CB 2.97Å; C341-K345 PolarHBondContact O-N 2.81Å; V342-K345 PolarHBondContact O-N 2.84Å; C343-K345 PolarHBondContact O-N 2.05Å; K345-T347 VanDerWaalsContact C-N 3.31Å; K345-T347 PolarHBondContact O-N 2.92Å; K345-A348 PolarHBondContact O-N 3.42Å; K345-E349 WeakPolarHBondContact CE-OE1 3.37Å; K345-E349 IonicContact NZ-OE1 3.63Å; K345-E349 WeakPolarHBondContact O-CG 3.46Å; K345-E349 PolarHBondContact O-N 3.21Å
346	T	82.8	Confident	83.5	Confident	57 Å²	57	43.2 Å²	43.2	35%	0.35	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-38.6	-179	52.3	0	0	0	0	111.5	V342 C343 E349 C350	V342-T346 HydrophobicContact CG1-CG2 4.28Å; V342-T346 WeakPolarHBondContact O-CB 3.3Å; V342-T346 VanDerWaalsContact O-CG2 3.25Å; V342-T346 WeakPolarHBondContact O-CG2 3.32Å; V342-T346 PolarHBondContact O-N 2.91Å; V342-T346 PolarHBondContact O-OG1 2.9Å; C343-T346 PolarHBondContact O-N 3.47Å; C343-T346 PolarHBondContact O-OG1 3.37Å; T346-E349 PolarHBondContact O-N 3Å; T346-C350 WeakPolarHBondContact O-CB 3.36Å; T346-C350 PolarHBondContact O-N 2.96Å
347	T	83.1	Confident	83.7	Confident	5 Å²	5	45 Å²	45	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-63.7	-45.9	172.5	-63.8	0	0	0	0	111.5	L257 H298 C343 K345 E349 C350 M351	L257-T347 HydrophobicContact CD1-CG2 3.79Å; L257-T347 HydrophobicContact CD2-CG2 4.08Å; H298-T347 HydrophobicContact CB-CG2 3.66Å; H298-T347 WeakPolarHBondContact CB-OG1 3.02Å; H298-T347 PolarHBondContact CD2-OG1 3.03Å; C343-T347 WeakPolarHBondContact O-CB 3.03Å; C343-T347 PolarHBondContact O-N 3.34Å; C343-T347 PolarHBondContact O-OG1 3.13Å; C343-T347 VanDerWaalsContact O-OG1 3.05Å; K345-T347 VanDerWaalsContact C-N 3.31Å; K345-T347 PolarHBondContact O-N 2.92Å; T347-E349 VanDerWaalsContact C-N 3.34Å; T347-E349 PolarHBondContact O-N 2.59Å; T347-C350 WeakPolarHBondContact O-CB 3.48Å; T347-C350 PolarHBondContact O-N 3.25Å; T347-M351 HydrophobicContact CG2-CG 4.14Å; T347-M351 HydrophobicContact CG2-SD 3.64Å; T347-M351 WeakPolarHBondContact O-CB 3.05Å; T347-M351 VanDerWaalsContact O-CG 3.22Å; T347-M351 WeakPolarHBondContact O-CG 3.44Å; T347-M351 PolarHBondContact O-N 2.63Å
348	A	85.9	Confident	83.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-58.8	-43.7	177.8	0	0	0	0	0	112.3	L257 M260 L261 L264 D344 K345 M351 A352	L257-A348 HydrophobicContact CD1-CB 3.93Å; M260-A348 HydrophobicContact CB-CB 3.84Å; L261-A348 HydrophobicContact CB-CB 4.38Å; L264-A348 VanDerWaalsContact CD1-C 3.4Å; L264-A348 HydrophobicContact CD1-CB 3.73Å; L264-A348 WeakPolarHBondContact CD1-O 3.44Å; D344-A348 WeakPolarHBondContact O-CB 3.37Å; D344-A348 PolarHBondContact O-N 3.39Å; K345-A348 PolarHBondContact O-N 3.42Å; A348-M351 PolarHBondContact O-N 3.45Å; A348-A352 VanDerWaalsContact O-CB 3.29Å; A348-A352 WeakPolarHBondContact O-CB 3.38Å; A348-A352 PolarHBondContact O-N 3.46Å
349	E	84.1	Confident	83.6	Confident	71 Å²	71	51.1 Å²	51.1	33%	0.332	28%	0.28	S	S	.	.	H	α-helix	trans	-65	-41.3	176.6	-71.4	175	168.7	0	0	112	L264 K345 T346 T347 A352 A353	L264-E349 HydrophobicContact CD1-CB 4.49Å; L264-E349 HydrophobicContact CD1-CG 3.96Å; K345-E349 WeakPolarHBondContact CE-OE1 3.37Å; K345-E349 IonicContact NZ-OE1 3.63Å; K345-E349 WeakPolarHBondContact O-CG 3.46Å; K345-E349 PolarHBondContact O-N 3.21Å; T346-E349 PolarHBondContact O-N 3Å; T347-E349 VanDerWaalsContact C-N 3.34Å; T347-E349 PolarHBondContact O-N 2.59Å; E349-A352 PolarHBondContact O-N 3.36Å; E349-A353 PolarHBondContact O-N 3.2Å; E349-A353 VanDerWaalsContact O-N 3.15Å
350	C	84.6	Confident	83.1	Confident	50 Å²	50	51.8 Å²	51.8	34%	0.338	28%	0.283	S	S	.	.	H	α-helix	trans	-61.2	-48.7	174.8	-174.7	0	0	0	0	111.4	C294 T346 T347 A352 A353 A354	C294-C350 HydrophobicContact CB-CB 3.72Å; C294-C350 WeakPolarHBondContact CB-SG 3.44Å; C294-C350 WeakPolarHBondContact SG-CB 3.23Å; C294-C350 PolarHBondContact SG-O 3.03Å; C294-C350 CovalentContact SG-SG 2.04Å; C294-C350 PolarHBondContact SG-SG 3Å; T346-C350 WeakPolarHBondContact O-CB 3.36Å; T346-C350 PolarHBondContact O-N 2.96Å; T347-C350 WeakPolarHBondContact O-CB 3.48Å; T347-C350 PolarHBondContact O-N 3.25Å; C350-A352 VanDerWaalsContact C-N 3.32Å; C350-A352 PolarHBondContact O-N 3.38Å; C350-A353 PolarHBondContact O-N 3.3Å; C350-A354 PolarHBondContact O-N 3.19Å; C350-A354 VanDerWaalsContact O-N 3.08Å
351	M	85.3	Confident	81.9	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-65	-37	-179.4	-69.2	175.6	78.2	0	0	112	L261 Y272 L291 C294 T347 A348 A353 A354	L261-M351 HydrophobicContact CD1-CB 3.63Å; L261-M351 HydrophobicContact CD1-SD 4.33Å; L261-M351 HydrophobicContact CD2-CE 3.63Å; L261-M351 HydrophobicContact CD2-SD 4.05Å; Y272-M351 HydrophobicContact CD1-CE 3.27Å; Y272-M351 HydrophobicContact CE1-CE 3.84Å; Y272-M351 HydrophobicContact CG-CE 3.72Å; L291-M351 VanDerWaalsContact CD1-CA 3.48Å; L291-M351 HydrophobicContact CD1-CB 3.47Å; L291-M351 VanDerWaalsContact CD1-CB 3.47Å; L291-M351 HydrophobicContact CD1-CE 3.98Å; L291-M351 HydrophobicContact CD1-CG 3.56Å; C294-M351 HydrophobicContact CB-CG 3.75Å; T347-M351 HydrophobicContact CG2-CG 4.14Å; T347-M351 HydrophobicContact CG2-SD 3.64Å; T347-M351 WeakPolarHBondContact O-CB 3.05Å; T347-M351 VanDerWaalsContact O-CG 3.22Å; T347-M351 WeakPolarHBondContact O-CG 3.44Å; T347-M351 PolarHBondContact O-N 2.63Å; A348-M351 PolarHBondContact O-N 3.45Å; M351-A353 VanDerWaalsContact C-N 3.3Å; M351-A353 PolarHBondContact O-N 2.95Å; M351-A354 PolarHBondContact O-N 3.35Å
352	A	88.3	Confident	80.3	Confident	39 Å²	39	59.5 Å²	59.5	32%	0.322	34%	0.338	S	S	.	.	H	α-helix	trans	-67.7	-29	176	0	0	0	0	0	113.5	L264 T265 A348 E349 C350	L264-A352 HydrophobicContact CB-CB 3.66Å; L264-A352 HydrophobicContact CD1-CB 4.1Å; L264-A352 HydrophobicContact CG-CB 4.4Å; T265-A352 HydrophobicContact CG2-CB 3.6Å; A348-A352 VanDerWaalsContact O-CB 3.29Å; A348-A352 WeakPolarHBondContact O-CB 3.38Å; A348-A352 PolarHBondContact O-N 3.46Å; E349-A352 PolarHBondContact O-N 3.36Å; C350-A352 VanDerWaalsContact C-N 3.32Å; C350-A352 PolarHBondContact O-N 3.38Å
353	A	85.3	Confident	80.1	Confident	81 Å²	81	59.4 Å²	59.4	67%	0.669	34%	0.337	S	S	*	.	H	α-helix	trans	-82.2	-20.1	174.7	0	0	0	0	0	113.1	E349 C350 M351	E349-A353 PolarHBondContact O-N 3.2Å; E349-A353 VanDerWaalsContact O-N 3.15Å; C350-A353 PolarHBondContact O-N 3.3Å; M351-A353 VanDerWaalsContact C-N 3.3Å; M351-A353 PolarHBondContact O-N 2.95Å
354	A	84.5	Confident	79.9	Confident	13 Å²	13	62.5 Å²	62.5	11%	0.107	35%	0.354	C	S	.	.	S	Bend	trans	-82.3	151.1	179.1	0	0	0	0	0	111.7	Q290 L291 C350 M351	Q290-A354 HydrophobicContact CB-CB 4.26Å; Q290-A354 HydrophobicContact CG-CB 4.05Å; L291-A354 HydrophobicContact CB-CB 3.88Å; L291-A354 HydrophobicContact CD1-CB 3.98Å; C350-A354 PolarHBondContact O-N 3.19Å; C350-A354 VanDerWaalsContact O-N 3.08Å; M351-A354 PolarHBondContact O-N 3.35Å
355	R	83.9	Confident	79.6	Confident	226 Å²	226	65.9 Å²	65.9	85%	0.853	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-76.8	130.1	172.7	-68	-175.4	177.4	-175.9	-0.7	109.5
356	F	83.9	Confident	79.3	Confident	38 Å²	38	66.9 Å²	66.9	17%	0.167	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-79.4	117.6	172.2	-171.5	-91	0	0	0	110	E271 Y272 Y275 L291 H358	E271-F356 HydrophobicContact CB-CZ 4.3Å; E271-F356 WeakPolarHBondContact O-CZ 2.91Å; Y272-F356 AromaticContact CD1-CD2 3.98Å; Y272-F356 HydrophobicContact CD1-CD2 3.98Å; Y272-F356 AromaticContact CD1-CE2 3.77Å; Y272-F356 HydrophobicContact CD1-CE2 3.77Å; Y272-F356 AromaticContact CE1-CD2 3.5Å; Y272-F356 HydrophobicContact CE1-CD2 3.5Å; Y272-F356 AromaticContact CE1-CE2 3.73Å; Y272-F356 HydrophobicContact CE1-CE2 3.73Å; Y272-F356 HydrophobicContact CG-CE2 4.4Å; Y275-F356 HydrophobicContact CD2-CD2 4.21Å; Y275-F356 AromaticContact CD2-CE2 3.7Å; Y275-F356 HydrophobicContact CD2-CE2 3.7Å; Y275-F356 HydrophobicContact CD2-CZ 4.04Å; Y275-F356 HydrophobicContact CE2-CD2 4.06Å; Y275-F356 AromaticContact CE2-CE2 3.96Å; Y275-F356 HydrophobicContact CE2-CE2 3.96Å; Y275-F356 HydrophobicContact CE2-CG 4.49Å; Y275-F356 HydrophobicContact CE2-CZ 4.29Å; L291-F356 HydrophobicContact CD2-CD2 3.62Å; L291-F356 HydrophobicContact CD2-CE2 4.23Å; L291-F356 HydrophobicContact CD2-CG 4.49Å; F356-H358 AromaticContact CD1-CE1 3.72Å; F356-H358 AromaticContact CD1-ND1 3.86Å; F356-H358 AromaticContact CD1-NE2 3.85Å; F356-H358 AromaticContact CE1-CE1 3.79Å; F356-H358 AromaticContact CE1-ND1 3.63Å
357	N	82.8	Confident	79.1	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.353	39%	0.385	S	S	.	.			trans	-96.8	106.7	179.4	-169.8	-5.7	0	0	0	111.4	Y275 S359 L360	Y275-N357 HydrophobicContact CE2-CB 4.4Å; Y275-N357 WeakPolarHBondContact CE2-O 3.5Å; Y275-N357 WeakPolarHBondContact OH-CB 3.29Å; Y275-N357 PolarHBondContact OH-N 2.88Å; N357-S359 PolarHBondContact O-N 3.01Å; N357-S359 VanDerWaalsContact O-N 3.11Å; N357-S359 WeakPolarHBondContact OD1-CB 2.97Å; N357-S359 PolarHBondContact OD1-N 3.34Å; N357-L360 HydrophobicContact CB-CD1 4.34Å; N357-L360 HydrophobicContact CB-CG 4.3Å; N357-L360 PolarHBondContact O-N 2.88Å
358	H	80	Confident	78.8	Confident	139 Å²	139	71.7 Å²	71.7	64%	0.644	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-11.4	177.7	-66.1	-81.7	0	0	0	114.3	R267 F356	R267-H358 PolarHBondContact NH2-NE2 3.38Å; F356-H358 AromaticContact CD1-CE1 3.72Å; F356-H358 AromaticContact CD1-ND1 3.86Å; F356-H358 AromaticContact CD1-NE2 3.85Å; F356-H358 AromaticContact CE1-CE1 3.79Å; F356-H358 AromaticContact CE1-ND1 3.63Å
359	S	76	Confident	78.3	Confident	109 Å²	109	76.9 Å²	76.9	76%	0.762	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-9.6	179.9	-54.1	0	0	0	0	113.8	N357	N357-S359 PolarHBondContact O-N 3.01Å; N357-S359 VanDerWaalsContact O-N 3.11Å; N357-S359 WeakPolarHBondContact OD1-CB 2.97Å; N357-S359 PolarHBondContact OD1-N 3.34Å
360	L	67.4	Low	77.9	Confident	36 Å²	36	77.3 Å²	77.3	19%	0.188	45%	0.446	C	S	.	.	S	Bend	trans	-85.1	140.6	170.3	-66.9	-179.5	0	0	0	109	Y275 L288 D289 N357	Y275-L360 HydrophobicContact CE1-CD1 3.82Å; Y275-L360 HydrophobicContact CE2-CB 4.29Å; Y275-L360 HydrophobicContact CE2-CD1 4.45Å; L288-L360 HydrophobicContact CB-CD1 4.07Å; L288-L360 HydrophobicContact CB-CD2 4.45Å; L288-L360 HydrophobicContact CD1-CD1 4.38Å; L288-L360 HydrophobicContact CD1-CD2 3.84Å; D289-L360 VanDerWaalsContact OD2-CD1 3.23Å; D289-L360 WeakPolarHBondContact OD2-CD1 3.29Å; N357-L360 HydrophobicContact CB-CD1 4.34Å; N357-L360 HydrophobicContact CB-CG 4.3Å; N357-L360 PolarHBondContact O-N 2.88Å
361	P	58.7	Low	77.3	Confident	93 Å²	93	79.6 Å²	79.6	60%	0.604	46%	0.455	S	S	*	.			trans	-58.8	146.7	179.4	22.9	-30.3	0	0	0	110.7
362	S	51.9	Low	76.6	Confident	109 Å²	109	86.3 Å²	86.3	76%	0.762	49%	0.494	S	S	*	.			trans	-135.4	0	176.8	56.7	0	0	0	0	109.6	M274	M274-S362 WeakPolarHBondContact CB-OXT 3.16Å; M274-S362 VanDerWaalsContact CG-OXT 3.29Å; M274-S362 WeakPolarHBondContact CG-OXT 3.3Å

Retrieved 362 of 362 residues in 393.8 ms (Link to these results)

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