A0A087XL08_POEFO Loading...

Activated CDC42 kinase 1

AlphaFold DB , UniProt , Accession A0A087XL08, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,028 aa.

						>A0A087XL08_POEFO|A0A087XL08
IQYSQCTEWLLELLTDVQLQQYFLRIRDELNVTRLSHFDYVKNEDLEKIGMGRPGSGQRRLWEAVKRRRALYKRKSWMSKVFPVKRSDTDPQQGASSGPPAASSEPGDSLTCLIKESEMQLFERLGDGTFGVVRRGEWTAPNGRVLSVAVKCLKAGVLDSDGLDDFIREVNAMHSLSHPNLISLYGVVLTQPMKMVTELAPLGSLLDRLRKRQGHILISILCNYAVQVASGMAYLEQRRFLHRDLAARNVLLSTNETVKIGDFGLMRALPTHTDQYIMEEGHKIPFPWCAPESLKSRTFSHASDTWMFGVTLWEMFSHGQEPWLGLNGSQILHKVDVEAERLCKPDDCPQDIYNVMLQCWSPKPDDRPTFIALRDFLLEMLPTDMKALQDFEEEEKLQIQMNDVITIIEGRAEHYWWRGQNRRTLRVGQFPRHVVTSVAGLSAQDISRPLKHSFIHTGHGDTDPHRSWGHADRIDSLYLGNPMDPPDILGFDSGSARPTKLPNRAKKKPPPRPPKPAVLLKKPLYDSVMDDYDDEDDFSTSSGLKKLGASLGLKLRPWEGSGVRSAKSEVSLIDFTDDSFSSTTPSPLTETHQPDEDTLKVDSDSPISFDKHINAATGLFAQDTPSILDWPLPQPAYDEVTADFDDQSEDQEVRSINKGPPEETLGPPLSSMAGRSESQSADLFQELQREVMVKLQVPMATGRSLPSSPTPMPLAPFGAHRQIYLPPPSPSSSSTSITSCFEDRPVSKQSYATRGAQQGARSSSISLGDEDNAPPQIPPRDHAFSQPGSRSSSPLPLAPALSSTLVVLPPPPLLVSPRRAAGLLGPLLSSSSSSVSRPAASSYSSTALLEPLAFREGRGLSAMMDSPQSSAPNPLPERPAFLERYGAANMAAVKPMMQQQQQTGGAKPNSSYNNNNGGTAAPSMQQEQSITQLVNKYPKIFTLEIRIKYLVQGAVHGVTTEECKAALQSHNWSVPQAVNFLKVEQLFRLGLRSRAECEELLQRHRWDLEQASTVMLDAYGPHCNRKLT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	I	34.3	Very low	60.6	Low	197 Å²	197	104.9 Å²	104.9	100%	1.01	52%	0.515	S	S	*	.				0	-49.8	0	-57.5	-179.4	0	0	0	111.9	Y3 S4	I1-Y3 PolarHBondContact O-N 3Å; I1-S4 PolarHBondContact O-N 3.13Å; I1-S4 PolarHBondContact O-OG 3.18Å
2	Q	32.4	Very low	62.7	Low	174 Å²	174	104.2 Å²	104.2	81%	0.813	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-15.1	-171.7	-147.4	160	1.1	0	0	116.8
3	Y	36.3	Very low	64.8	Low	222 Å²	222	96.2 Å²	96.2	87%	0.871	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-22.5	176.2	-95.6	-94	0	0	0	115.1	I1	I1-Y3 PolarHBondContact O-N 3Å
4	S	39.3	Very low	66.5	Low	71 Å²	71	89.4 Å²	89.4	50%	0.497	44%	0.437	S	S	.	.	S	Bend	trans	-73.5	-34.7	-174.1	50.9	0	0	0	0	113.5	I1 C6 T7	I1-S4 PolarHBondContact O-N 3.13Å; I1-S4 PolarHBondContact O-OG 3.18Å; S4-C6 PolarHBondContact O-N 3.16Å; S4-T7 PolarHBondContact O-N 2.68Å; S4-T7 PolarHBondContact O-OG1 3.35Å
5	Q	47.9	Very low	68.1	Low	140 Å²	140	88.3 Å²	88.3	65%	0.654	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-61.8	-26.9	-176.2	-70.3	177.4	-27.2	0	0	113.8	T7	Q5-T7 PolarHBondContact O-N 2.66Å
6	C	56.8	Low	69.1	Low	87 Å²	87	89.2 Å²	89.2	59%	0.588	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-70.8	-12.3	-176.3	-162.7	0	0	0	0	114.1	S4 W9	S4-C6 PolarHBondContact O-N 3.16Å; C6-W9 PolarHBondContact O-NE1 3.38Å
7	T	75.4	Confident	70.3	Confident	8 Å²	8	84.4 Å²	84.4	5%	0.049	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-127.1	8	-172.8	59.3	0	0	0	0	114.4	S4 Q5 W9 L10 L11 R27 T33	S4-T7 PolarHBondContact O-N 2.68Å; S4-T7 PolarHBondContact O-OG1 3.35Å; Q5-T7 PolarHBondContact O-N 2.66Å; T7-W9 VanDerWaalsContact C-N 3.28Å; T7-W9 PolarHBondContact O-N 3.13Å; T7-L10 WeakPolarHBondContact O-CB 3.3Å; T7-L10 PolarHBondContact O-N 3.38Å; T7-L11 PolarHBondContact O-N 3.12Å; T7-R27 HydrophobicContact CG2-CG 3.97Å; T7-R27 WeakPolarHBondContact OG1-CD 3.45Å; T7-T33 HydrophobicContact CG2-CG2 4.12Å
8	E	81.1	Confident	71.3	Confident	124 Å²	124	87.6 Å²	87.6	58%	0.579	44%	0.435	S	S	*	.	H	α-helix	trans	-58.2	-38.8	178.5	-170.3	163.5	-149.2	0	0	112.3	L10 L11 E12	E8-L10 PolarHBondContact O-N 3.48Å; E8-L10 VanDerWaalsContact O-N 3.16Å; E8-L11 PolarHBondContact O-N 3.35Å; E8-L11 VanDerWaalsContact O-N 3.09Å; E8-E12 PolarHBondContact O-N 3.49Å
9	W	87.5	Confident	72.2	Confident	59 Å²	59	83.2 Å²	83.2	22%	0.223	41%	0.413	C	S	.	.	H	α-helix	trans	-57.5	-29.1	174.4	75.4	-92.8	0	0	0	114	C6 T7 L13 V32 T33 L35 F38	C6-W9 PolarHBondContact O-NE1 3.38Å; T7-W9 VanDerWaalsContact C-N 3.28Å; T7-W9 PolarHBondContact O-N 3.13Å; W9-L13 HydrophobicContact CZ3-CD1 4.22Å; W9-L13 VanDerWaalsContact O-CB 3.27Å; W9-L13 WeakPolarHBondContact O-CB 3.23Å; W9-L13 PolarHBondContact O-N 3.11Å; W9-L13 VanDerWaalsContact O-N 3.11Å; W9-V32 HydrophobicContact CH2-CG1 4.36Å; W9-T33 PolarHBondContact NE1-O 3.25Å; W9-T33 VanDerWaalsContact NE1-O 3.09Å; W9-L35 HydrophobicContact CH2-CB 4.12Å; W9-L35 HydrophobicContact CH2-CD1 4.27Å; W9-L35 HydrophobicContact CZ3-CB 4.19Å; W9-L35 HydrophobicContact CZ3-CD1 3.8Å; W9-F38 HydrophobicContact CH2-CD2 4.46Å; W9-F38 AromaticContact CH2-CE2 3.96Å; W9-F38 HydrophobicContact CH2-CE2 3.96Å; W9-F38 HydrophobicContact CZ3-CE2 4.29Å
10	L	87.4	Confident	73	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-81.5	-36.5	179.3	175.4	67	0	0	0	110.4	T7 E8 L13 L14 F23 I26 R27 V32 F38	T7-L10 WeakPolarHBondContact O-CB 3.3Å; T7-L10 PolarHBondContact O-N 3.38Å; E8-L10 PolarHBondContact O-N 3.48Å; E8-L10 VanDerWaalsContact O-N 3.16Å; L10-L13 HydrophobicContact CD1-CD2 4.43Å; L10-L13 PolarHBondContact O-N 3.25Å; L10-L14 HydrophobicContact CD1-CD1 4.04Å; L10-L14 HydrophobicContact CD1-CG 4.19Å; L10-L14 HydrophobicContact CG-CD1 4.03Å; L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.32Å; L10-L14 PolarHBondContact O-N 3.26Å; L10-F23 HydrophobicContact CB-CD2 4.46Å; L10-F23 HydrophobicContact CB-CE2 4.15Å; L10-F23 HydrophobicContact CD2-CD2 4.13Å; L10-F23 HydrophobicContact CD2-CE2 4.09Å; L10-F23 HydrophobicContact CG-CD2 4.02Å; L10-F23 HydrophobicContact CG-CE2 4.13Å; L10-I26 HydrophobicContact CD1-CG2 4.14Å; L10-I26 HydrophobicContact CD2-CG2 4.09Å; L10-R27 HydrophobicContact CD2-CB 4.25Å; L10-V32 HydrophobicContact CD1-CG1 4.39Å; L10-V32 HydrophobicContact CD2-CG1 4.35Å; L10-V32 WeakPolarHBondContact CD2-O 3.41Å; L10-F38 HydrophobicContact CD1-CE2 3.98Å; L10-F38 HydrophobicContact CD1-CZ 3.8Å
11	L	87.9	Confident	73.6	Confident	72 Å²	72	85 Å²	85	38%	0.377	42%	0.419	S	S	.	.	H	α-helix	trans	-65.8	-42.9	173.7	-176	59.9	0	0	0	111.1	T7 E8 L14 T15 Q20 F23	T7-L11 PolarHBondContact O-N 3.12Å; E8-L11 PolarHBondContact O-N 3.35Å; E8-L11 VanDerWaalsContact O-N 3.09Å; L11-L14 PolarHBondContact O-N 2.97Å; L11-T15 WeakPolarHBondContact O-CB 3.39Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 3.41Å; L11-Q20 HydrophobicContact CD1-CB 4.22Å; L11-F23 HydrophobicContact CB-CD2 3.87Å; L11-F23 HydrophobicContact CB-CE2 3.74Å; L11-F23 HydrophobicContact CB-CG 4.42Å; L11-F23 HydrophobicContact CB-CZ 4.18Å; L11-F23 HydrophobicContact CD1-CB 4.03Å; L11-F23 HydrophobicContact CD1-CD1 4.14Å; L11-F23 HydrophobicContact CD1-CD2 4.09Å; L11-F23 HydrophobicContact CD1-CG 3.82Å
12	E	86.3	Confident	76.2	Confident	96 Å²	96	77.9 Å²	77.9	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-54.2	-57.1	168.2	-72.8	-176	-169.8	0	0	111	E8 L14 T15 D16 R68	E8-E12 PolarHBondContact O-N 3.49Å; E12-L14 PolarHBondContact O-N 3.44Å; E12-T15 WeakPolarHBondContact O-CA 3.32Å; E12-T15 WeakPolarHBondContact O-CB 3.45Å; E12-T15 PolarHBondContact O-N 2.88Å; E12-D16 PolarHBondContact O-N 2.9Å; E12-R68 IonicContact OE2-CZ 2.72Å; E12-R68 IonicContact OE2-NH1 3.46Å; E12-R68 PolarHBondContact OE2-NH1 3.15Å; E12-R68 IonicContact OE2-NH2 3.56Å; E12-R68 PolarHBondContact OE2-NH2 2.71Å
13	L	89.7	Confident	78.9	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-32.4	-175	176.2	144.4	0	0	0	113.2	W9 L10 V17 L35 L61 A64 V65 R68	W9-L13 HydrophobicContact CZ3-CD1 4.22Å; W9-L13 VanDerWaalsContact O-CB 3.27Å; W9-L13 WeakPolarHBondContact O-CB 3.23Å; W9-L13 PolarHBondContact O-N 3.11Å; W9-L13 VanDerWaalsContact O-N 3.11Å; L10-L13 HydrophobicContact CD1-CD2 4.43Å; L10-L13 PolarHBondContact O-N 3.25Å; L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L13-L35 HydrophobicContact CD1-CD1 4.34Å; L13-L61 HydrophobicContact CD2-CD1 4.03Å; L13-A64 HydrophobicContact CD2-CB 4.38Å; L13-A64 HydrophobicContact CG-CB 4.19Å; L13-V65 HydrophobicContact CD1-CG2 4.41Å; L13-V65 HydrophobicContact CD2-CG2 4.23Å; L13-R68 HydrophobicContact CD1-CB 3.59Å; L13-R68 HydrophobicContact CD1-CG 3.73Å
14	L	89.3	Confident	81.3	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-80.8	-31.8	175.7	-68.8	172.1	0	0	0	112.3	L10 L11 E12 V17 Q18 L19 Q20 F23 I26 L61	L10-L14 HydrophobicContact CD1-CD1 4.04Å; L10-L14 HydrophobicContact CD1-CG 4.19Å; L10-L14 HydrophobicContact CG-CD1 4.03Å; L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 VanDerWaalsContact O-CG 3.27Å; L10-L14 WeakPolarHBondContact O-CG 3.32Å; L10-L14 PolarHBondContact O-N 3.26Å; L11-L14 PolarHBondContact O-N 2.97Å; E12-L14 PolarHBondContact O-N 3.44Å; L14-V17 WeakPolarHBondContact O-CG2 3.3Å; L14-V17 PolarHBondContact O-N 2.92Å; L14-Q18 PolarHBondContact O-N 3.35Å; L14-Q18 VanDerWaalsContact O-N 3.17Å; L14-L19 HydrophobicContact CB-CB 4.45Å; L14-L19 HydrophobicContact CD2-CB 3.96Å; L14-L19 PolarHBondContact O-N 2.83Å; L14-Q20 PolarHBondContact O-N 3.44Å; L14-F23 HydrophobicContact CD1-CB 3.94Å; L14-F23 HydrophobicContact CD1-CD2 4.19Å; L14-I26 HydrophobicContact CD1-CD1 3.92Å; L14-I26 HydrophobicContact CD2-CD1 3.69Å; L14-I26 HydrophobicContact CG-CD1 4.48Å; L14-L61 HydrophobicContact CD2-CD1 3.62Å
15	T	89.4	Confident	83.6	Confident	73 Å²	73	66.9 Å²	66.9	45%	0.448	33%	0.326	S	S	.	.	H	α-helix	trans	-67.9	-40.2	173.7	-55.1	0	0	0	0	111	L11 E12 V17 Q18	L11-T15 WeakPolarHBondContact O-CB 3.39Å; L11-T15 PolarHBondContact O-N 2.89Å; L11-T15 PolarHBondContact O-OG1 3.41Å; E12-T15 WeakPolarHBondContact O-CA 3.32Å; E12-T15 WeakPolarHBondContact O-CB 3.45Å; E12-T15 PolarHBondContact O-N 2.88Å; T15-V17 PolarHBondContact O-N 3.25Å; T15-Q18 PolarHBondContact O-N 2.75Å; T15-Q18 VanDerWaalsContact O-N 3.09Å
16	D	85.1	Confident	85.5	Confident	103 Å²	103	60.2 Å²	60.2	55%	0.551	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-16.1	173.1	-74.9	-23.7	0	0	0	113.8	E12 R68	E12-D16 PolarHBondContact O-N 2.9Å; D16-R68 IonicContact OD2-NH1 2.67Å; D16-R68 PolarHBondContact OD2-NH1 3Å
17	V	89.9	Confident	87.2	Confident	8 Å²	8	59.1 Å²	59.1	5%	0.048	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.2	7.1	-178.9	-70.8	0	0	0	0	115.2	L13 L14 T15 L19 R60 A64	L13-V17 WeakPolarHBondContact O-CG2 3.44Å; L14-V17 WeakPolarHBondContact O-CG2 3.3Å; L14-V17 PolarHBondContact O-N 2.92Å; T15-V17 PolarHBondContact O-N 3.25Å; V17-L19 HydrophobicContact CB-CD1 4.43Å; V17-L19 HydrophobicContact CB-CG 4.46Å; V17-L19 HydrophobicContact CG2-CB 4.06Å; V17-L19 HydrophobicContact CG2-CD1 3.7Å; V17-L19 HydrophobicContact CG2-CG 3.86Å; V17-R60 HydrophobicContact CB-CB 4.01Å; V17-R60 HydrophobicContact CG1-CB 4.09Å; V17-R60 PolarHBondContact O-NH1 3.45Å; V17-A64 HydrophobicContact CG1-CB 3.58Å; V17-A64 HydrophobicContact CG2-CB 4.41Å
18	Q	86.9	Confident	87.7	Confident	141 Å²	141	62.8 Å²	62.8	66%	0.659	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	42.4	-178.8	-51.5	166.9	-23.3	0	0	113.3	L14 T15 Q20 Q21	L14-Q18 PolarHBondContact O-N 3.35Å; L14-Q18 VanDerWaalsContact O-N 3.17Å; T15-Q18 PolarHBondContact O-N 2.75Å; T15-Q18 VanDerWaalsContact O-N 3.09Å; Q18-Q20 VanDerWaalsContact CA-OE1 3.31Å; Q18-Q21 PolarHBondContact O-NE2 2.92Å
19	L	89.3	Confident	87.9	Confident	4 Å²	4	62.3 Å²	62.3	2%	0.021	30%	0.296	C	S	.	.			trans	-123	14	178.4	-61.5	177.5	0	0	0	112.7	L14 V17 Q21 Y22 M51 G57 L61	L14-L19 HydrophobicContact CB-CB 4.45Å; L14-L19 HydrophobicContact CD2-CB 3.96Å; L14-L19 PolarHBondContact O-N 2.83Å; V17-L19 HydrophobicContact CB-CD1 4.43Å; V17-L19 HydrophobicContact CB-CG 4.46Å; V17-L19 HydrophobicContact CG2-CB 4.06Å; V17-L19 HydrophobicContact CG2-CD1 3.7Å; V17-L19 HydrophobicContact CG2-CG 3.86Å; L19-Q21 PolarHBondContact O-N 3.12Å; L19-Q21 VanDerWaalsContact O-N 3.11Å; L19-Y22 HydrophobicContact CB-CD2 4.13Å; L19-Y22 HydrophobicContact CD2-CD2 4.03Å; L19-Y22 HydrophobicContact CD2-CE2 3.95Å; L19-Y22 WeakPolarHBondContact O-CB 3.27Å; L19-Y22 PolarHBondContact O-N 2.59Å; L19-M51 HydrophobicContact CD1-CE 4.11Å; L19-M51 HydrophobicContact CD1-SD 4.27Å; L19-G57 WeakPolarHBondContact CD1-O 3.32Å; L19-L61 HydrophobicContact CD1-CB 3.81Å
20	Q	88.4	Confident	87.8	Confident	87 Å²	87	61.3 Å²	61.3	41%	0.407	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-58.2	-25.6	-177.3	66.6	-79.4	5.8	0	0	113.8	L11 L14 Q18 Y22 F23	L11-Q20 HydrophobicContact CD1-CB 4.22Å; L14-Q20 PolarHBondContact O-N 3.44Å; Q18-Q20 VanDerWaalsContact CA-OE1 3.31Å; Q20-Y22 PolarHBondContact O-N 3.19Å; Q20-Y22 VanDerWaalsContact O-N 3.17Å; Q20-F23 WeakPolarHBondContact O-CB 3.42Å; Q20-F23 PolarHBondContact O-N 2.94Å
21	Q	85.7	Confident	87.7	Confident	119 Å²	119	66.6 Å²	66.6	56%	0.556	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-61.4	-17.9	171.3	67	-79.4	9.2	0	0	114.1	Q18 L19	Q18-Q21 PolarHBondContact O-NE2 2.92Å; L19-Q21 PolarHBondContact O-N 3.12Å; L19-Q21 VanDerWaalsContact O-N 3.11Å
22	Y	88.3	Confident	87.5	Confident	46 Å²	46	63.1 Å²	63.1	18%	0.18	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-94.5	-1.1	174	-61.9	-80.7	0	0	0	113.4	L19 Q20 L24 R25 I26 I49 G50 M51	L19-Y22 HydrophobicContact CB-CD2 4.13Å; L19-Y22 HydrophobicContact CD2-CD2 4.03Å; L19-Y22 HydrophobicContact CD2-CE2 3.95Å; L19-Y22 WeakPolarHBondContact O-CB 3.27Å; L19-Y22 PolarHBondContact O-N 2.59Å; Q20-Y22 PolarHBondContact O-N 3.19Å; Q20-Y22 VanDerWaalsContact O-N 3.17Å; Y22-L24 PolarHBondContact O-N 3.11Å; Y22-R25 PolarHBondContact O-N 3.4Å; Y22-I26 WeakPolarHBondContact O-CG1 3.48Å; Y22-I26 PolarHBondContact O-N 3.19Å; Y22-I49 HydrophobicContact CD1-CD1 4.39Å; Y22-G50 PolarHBondContact OH-O 3.46Å; Y22-M51 HydrophobicContact CD1-CB 4.35Å; Y22-M51 HydrophobicContact CD1-CE 4.19Å; Y22-M51 HydrophobicContact CD2-CE 3.71Å; Y22-M51 HydrophobicContact CE1-CB 3.97Å; Y22-M51 HydrophobicContact CE2-CE 4.19Å; Y22-M51 HydrophobicContact CG-CE 3.7Å
23	F	89.9	Confident	87.3	Confident	23 Å²	23	61 Å²	61	10%	0.101	30%	0.298	C	S	.	.	H	α-helix	trans	-54.4	-50.8	-174.4	170.4	-108.1	0	0	0	113.3	L10 L11 L14 Q20 R25 I26 R27	L10-F23 HydrophobicContact CB-CD2 4.46Å; L10-F23 HydrophobicContact CB-CE2 4.15Å; L10-F23 HydrophobicContact CD2-CD2 4.13Å; L10-F23 HydrophobicContact CD2-CE2 4.09Å; L10-F23 HydrophobicContact CG-CD2 4.02Å; L10-F23 HydrophobicContact CG-CE2 4.13Å; L11-F23 HydrophobicContact CB-CD2 3.87Å; L11-F23 HydrophobicContact CB-CE2 3.74Å; L11-F23 HydrophobicContact CB-CG 4.42Å; L11-F23 HydrophobicContact CB-CZ 4.18Å; L11-F23 HydrophobicContact CD1-CB 4.03Å; L11-F23 HydrophobicContact CD1-CD1 4.14Å; L11-F23 HydrophobicContact CD1-CD2 4.09Å; L11-F23 HydrophobicContact CD1-CG 3.82Å; L14-F23 HydrophobicContact CD1-CB 3.94Å; L14-F23 HydrophobicContact CD1-CD2 4.19Å; Q20-F23 WeakPolarHBondContact O-CB 3.42Å; Q20-F23 PolarHBondContact O-N 2.94Å; F23-R25 PolarHBondContact O-N 2.84Å; F23-I26 PolarHBondContact O-N 2.91Å; F23-R27 VanDerWaalsContact O-CB 3.25Å; F23-R27 WeakPolarHBondContact O-CB 3.49Å; F23-R27 PolarHBondContact O-N 2.83Å
24	L	85.5	Confident	86.9	Confident	104 Å²	104	67.4 Å²	67.4	55%	0.545	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-41.8	179.5	-63.8	177.5	0	0	0	111.5	Y22 R27 D28	Y22-L24 PolarHBondContact O-N 3.11Å; L24-R27 PolarHBondContact O-N 2.96Å; L24-D28 WeakPolarHBondContact O-CA 3.31Å; L24-D28 WeakPolarHBondContact O-CB 3.45Å; L24-D28 PolarHBondContact O-N 3.25Å
25	R	87.6	Confident	86.6	Confident	110 Å²	110	68.8 Å²	68.8	42%	0.415	33%	0.329	S	S	.	.	I	π-helix	trans	-66.4	-44.8	178.3	-55.2	-158.4	168.8	140.8	4.2	112.6	Y22 F23 R27 E29 L30 I49	Y22-R25 PolarHBondContact O-N 3.4Å; F23-R25 PolarHBondContact O-N 2.84Å; R25-R27 VanDerWaalsContact C-N 3.28Å; R25-R27 PolarHBondContact O-N 2.59Å; R25-E29 HydrophobicContact CB-CB 4.48Å; R25-E29 HydrophobicContact CB-CG 4.29Å; R25-E29 WeakPolarHBondContact CD-OE1 3.48Å; R25-E29 WeakPolarHBondContact CD-OE2 3.4Å; R25-E29 VanDerWaalsContact CG-OE1 3.26Å; R25-E29 WeakPolarHBondContact CG-OE1 3.44Å; R25-E29 IonicContact NE-OE1 3Å; R25-E29 PolarHBondContact NE-OE1 3.06Å; R25-E29 CarbonylContact O-C 3.49Å; R25-E29 WeakPolarHBondContact O-CA 3.31Å; R25-E29 VanDerWaalsContact O-CB 3.25Å; R25-E29 WeakPolarHBondContact O-CB 3.38Å; R25-E29 PolarHBondContact O-N 3.23Å; R25-L30 PolarHBondContact O-N 2.93Å; R25-I49 HydrophobicContact CB-CB 3.89Å; R25-I49 HydrophobicContact CB-CD1 4.14Å; R25-I49 HydrophobicContact CB-CG2 4.04Å; R25-I49 VanDerWaalsContact CD-O 3.29Å; R25-I49 WeakPolarHBondContact CD-O 3.45Å; R25-I49 PolarHBondContact NH1-O 3.33Å
26	I	88.9	Confident	86.1	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.32	C	S	.	.	I	π-helix	trans	-65	-36.3	178.7	-66.6	170.3	0	0	0	110.6	L10 L14 Y22 F23 V32 F38 I49 M51 L61	L10-I26 HydrophobicContact CD1-CG2 4.14Å; L10-I26 HydrophobicContact CD2-CG2 4.09Å; L14-I26 HydrophobicContact CD1-CD1 3.92Å; L14-I26 HydrophobicContact CD2-CD1 3.69Å; L14-I26 HydrophobicContact CG-CD1 4.48Å; Y22-I26 WeakPolarHBondContact O-CG1 3.48Å; Y22-I26 PolarHBondContact O-N 3.19Å; F23-I26 PolarHBondContact O-N 2.91Å; I26-V32 HydrophobicContact CG2-CB 3.78Å; I26-V32 HydrophobicContact CG2-CG1 4.19Å; I26-V32 HydrophobicContact CG2-CG2 3.9Å; I26-V32 VanDerWaalsContact O-CB 3.23Å; I26-V32 WeakPolarHBondContact O-CB 3.09Å; I26-V32 WeakPolarHBondContact O-CG2 3.3Å; I26-V32 PolarHBondContact O-N 2.89Å; I26-F38 HydrophobicContact CG2-CE1 4.15Å; I26-F38 HydrophobicContact CG2-CZ 4.08Å; I26-I49 HydrophobicContact CD1-CD1 4.23Å; I26-I49 HydrophobicContact CG1-CD1 3.46Å; I26-I49 VanDerWaalsContact CG1-CD1 3.46Å; I26-M51 HydrophobicContact CD1-CE 3.94Å; I26-L61 HydrophobicContact CD1-CD2 4.34Å
27	R	90.9	Very high	86.2	Confident	64 Å²	64	64.8 Å²	64.8	24%	0.242	31%	0.306	C	S	.	.	I	π-helix	trans	-76.6	-43.9	178.2	-167.6	-171	69.2	-169.6	-3.8	113.8	T7 L10 F23 L24 R25 N31	T7-R27 HydrophobicContact CG2-CG 3.97Å; T7-R27 WeakPolarHBondContact OG1-CD 3.45Å; L10-R27 HydrophobicContact CD2-CB 4.25Å; F23-R27 VanDerWaalsContact O-CB 3.25Å; F23-R27 WeakPolarHBondContact O-CB 3.49Å; F23-R27 PolarHBondContact O-N 2.83Å; L24-R27 PolarHBondContact O-N 2.96Å; R25-R27 VanDerWaalsContact C-N 3.28Å; R25-R27 PolarHBondContact O-N 2.59Å; R27-N31 CarbonylContact O-C 3.58Å; R27-N31 WeakPolarHBondContact O-CA 3.49Å; R27-N31 PolarHBondContact O-N 2.99Å
28	D	86.1	Confident	86.2	Confident	85 Å²	85	64.6 Å²	64.6	46%	0.455	31%	0.305	S	S	.	.	I	π-helix	trans	-111	-24.6	-164.4	-53.6	-33.8	0	0	0	114	L24 N31	L24-D28 WeakPolarHBondContact O-CA 3.31Å; L24-D28 WeakPolarHBondContact O-CB 3.45Å; L24-D28 PolarHBondContact O-N 3.25Å; D28-N31 PolarHBondContact O-OD1 3.35Å
29	E	85.4	Confident	86	Confident	114 Å²	114	62.5 Å²	62.5	53%	0.533	30%	0.298	S	S	.	.	I	π-helix	trans	-97.5	-29.5	174	-57.1	171.9	-163.9	0	0	111.6	R25 I49	R25-E29 HydrophobicContact CB-CB 4.48Å; R25-E29 HydrophobicContact CB-CG 4.29Å; R25-E29 WeakPolarHBondContact CD-OE1 3.48Å; R25-E29 WeakPolarHBondContact CD-OE2 3.4Å; R25-E29 VanDerWaalsContact CG-OE1 3.26Å; R25-E29 WeakPolarHBondContact CG-OE1 3.44Å; R25-E29 IonicContact NE-OE1 3Å; R25-E29 PolarHBondContact NE-OE1 3.06Å; R25-E29 CarbonylContact O-C 3.49Å; R25-E29 WeakPolarHBondContact O-CA 3.31Å; R25-E29 VanDerWaalsContact O-CB 3.25Å; R25-E29 WeakPolarHBondContact O-CB 3.38Å; R25-E29 PolarHBondContact O-N 3.23Å; E29-I49 HydrophobicContact CB-CG2 4.25Å; E29-I49 WeakPolarHBondContact OE2-CG2 3.3Å
30	L	86.9	Confident	85.6	Confident	37 Å²	37	71.6 Å²	71.6	19%	0.194	33%	0.334	C	S	.	.	S	Bend	trans	-108.7	5.1	176.3	-55.2	-176.1	0	0	0	114	R25 V32 V41 D45 L46 I49	R25-L30 PolarHBondContact O-N 2.93Å; L30-V32 HydrophobicContact CB-CG2 4.14Å; L30-V32 PolarHBondContact O-N 3.11Å; L30-V41 HydrophobicContact CB-CG2 4.44Å; L30-V41 HydrophobicContact CD1-CG1 4Å; L30-V41 HydrophobicContact CD1-CG2 4.47Å; L30-D45 HydrophobicContact CD2-CB 3.84Å; L30-L46 HydrophobicContact CD1-CD2 4.12Å; L30-I49 HydrophobicContact CD1-CD1 3.81Å; L30-I49 HydrophobicContact CD1-CG1 4.36Å; L30-I49 HydrophobicContact CD1-CG2 4.08Å; L30-I49 HydrophobicContact CD2-CG2 3.95Å; L30-I49 HydrophobicContact CG-CG2 3.85Å
31	N	83.6	Confident	85.5	Confident	111 Å²	111	68.1 Å²	68.1	59%	0.594	32%	0.318	S	S	*	.			trans	51.9	26.4	177.9	-67	18.1	0	0	0	115.4	R27 D28 T33 H37	R27-N31 CarbonylContact O-C 3.58Å; R27-N31 WeakPolarHBondContact O-CA 3.49Å; R27-N31 PolarHBondContact O-N 2.99Å; D28-N31 PolarHBondContact O-OD1 3.35Å; N31-T33 PolarHBondContact O-N 3.31Å; N31-T33 VanDerWaalsContact O-N 3.08Å; N31-H37 PolarHBondContact O-ND1 2.94Å
32	V	85.3	Confident	85.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	32%	0.315	C	S	.	.			trans	-77.7	98.6	-179.2	-179.2	0	0	0	0	110	W9 L10 I26 L30 H37 F38 V41	W9-V32 HydrophobicContact CH2-CG1 4.36Å; L10-V32 HydrophobicContact CD1-CG1 4.39Å; L10-V32 HydrophobicContact CD2-CG1 4.35Å; L10-V32 WeakPolarHBondContact CD2-O 3.41Å; I26-V32 HydrophobicContact CG2-CB 3.78Å; I26-V32 HydrophobicContact CG2-CG1 4.19Å; I26-V32 HydrophobicContact CG2-CG2 3.9Å; I26-V32 VanDerWaalsContact O-CB 3.23Å; I26-V32 WeakPolarHBondContact O-CB 3.09Å; I26-V32 WeakPolarHBondContact O-CG2 3.3Å; I26-V32 PolarHBondContact O-N 2.89Å; L30-V32 HydrophobicContact CB-CG2 4.14Å; L30-V32 PolarHBondContact O-N 3.11Å; V32-H37 HydrophobicContact CB-CB 4.31Å; V32-H37 HydrophobicContact CG1-CB 4.17Å; V32-H37 HydrophobicContact CG2-CB 4.25Å; V32-F38 HydrophobicContact CG1-CD2 3.95Å; V32-F38 HydrophobicContact CG1-CE1 4.3Å; V32-F38 HydrophobicContact CG1-CE2 3.68Å; V32-F38 HydrophobicContact CG1-CG 4.39Å; V32-F38 HydrophobicContact CG1-CZ 3.88Å; V32-V41 HydrophobicContact CG2-CG2 3.73Å
33	T	81.9	Confident	85.3	Confident	51 Å²	51	69.1 Å²	69.1	31%	0.313	33%	0.325	S	S	.	.			trans	-110.4	-16.4	173.2	57.5	0	0	0	0	113.1	T7 W9 N31 H37	T7-T33 HydrophobicContact CG2-CG2 4.12Å; W9-T33 PolarHBondContact NE1-O 3.25Å; W9-T33 VanDerWaalsContact NE1-O 3.09Å; N31-T33 PolarHBondContact O-N 3.31Å; N31-T33 VanDerWaalsContact O-N 3.08Å; T33-H37 PolarHBondContact N-ND1 2.91Å; T33-H37 PolarHBondContact OG1-CE1 3.29Å
34	R	81.4	Confident	84.9	Confident	136 Å²	136	73.3 Å²	73.3	51%	0.513	35%	0.345	S	S	.	.	S	Bend	trans	-128.9	156	176.6	-49.7	180	-178.9	-168.7	0.8	111.7	S36 H37	R34-S36 PolarHBondContact O-N 3.19Å; R34-H37 WeakPolarHBondContact O-CB 3.37Å; R34-H37 PolarHBondContact O-N 3.25Å
35	L	83.3	Confident	85	Confident	28 Å²	28	69.9 Å²	69.9	15%	0.147	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-21	-178.6	-172.9	63.2	0	0	0	113.8	W9 L13 F38 V65 R68 R69 Y72	W9-L35 HydrophobicContact CH2-CB 4.12Å; W9-L35 HydrophobicContact CH2-CD1 4.27Å; W9-L35 HydrophobicContact CZ3-CB 4.19Å; W9-L35 HydrophobicContact CZ3-CD1 3.8Å; L13-L35 HydrophobicContact CD1-CD1 4.34Å; L35-F38 HydrophobicContact CD1-CD2 4.29Å; L35-V65 HydrophobicContact CD1-CG1 4.13Å; L35-R68 HydrophobicContact CD1-CB 4.41Å; L35-R68 HydrophobicContact CD2-CB 4.47Å; L35-R69 HydrophobicContact CD1-CG 4.38Å; L35-R69 HydrophobicContact CD2-CG 3.78Å; L35-R69 HydrophobicContact CG-CG 3.96Å; L35-R69 PolarHBondContact O-NH2 3.48Å; L35-Y72 HydrophobicContact CD2-CD2 4.09Å
36	S	78.4	Confident	84.9	Confident	36 Å²	36	64.6 Å²	64.6	25%	0.252	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-18	171.8	47.2	0	0	0	0	113.9	R34 F38 D39	R34-S36 PolarHBondContact O-N 3.19Å; S36-F38 PolarHBondContact O-N 2.75Å; S36-D39 WeakPolarHBondContact CA-OD2 3.45Å; S36-D39 WeakPolarHBondContact O-CB 3.33Å; S36-D39 PolarHBondContact O-N 2.94Å; S36-D39 VanDerWaalsContact O-OD2 3.05Å
37	H	86.9	Confident	84.6	Confident	57 Å²	57	67.3 Å²	67.3	26%	0.264	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-66.3	-24.7	178	-66.6	-159.2	0	0	0	111.3	N31 V32 T33 R34 D39 Y40	N31-H37 PolarHBondContact O-ND1 2.94Å; V32-H37 HydrophobicContact CB-CB 4.31Å; V32-H37 HydrophobicContact CG1-CB 4.17Å; V32-H37 HydrophobicContact CG2-CB 4.25Å; T33-H37 PolarHBondContact N-ND1 2.91Å; T33-H37 PolarHBondContact OG1-CE1 3.29Å; R34-H37 WeakPolarHBondContact O-CB 3.37Å; R34-H37 PolarHBondContact O-N 3.25Å; H37-D39 PolarHBondContact O-N 3.41Å; H37-Y40 PolarHBondContact O-N 2.98Å; H37-Y40 VanDerWaalsContact O-N 3.1Å
38	F	88.8	Confident	84.1	Confident	3 Å²	3	71.3 Å²	71.3	1%	0.013	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-60.6	-18.4	170.1	-76.7	-67.4	0	0	0	114.3	W9 L10 I26 V32 L35 S36 Y40 V41 L61 W62 V65	W9-F38 HydrophobicContact CH2-CD2 4.46Å; W9-F38 AromaticContact CH2-CE2 3.96Å; W9-F38 HydrophobicContact CH2-CE2 3.96Å; W9-F38 HydrophobicContact CZ3-CE2 4.29Å; L10-F38 HydrophobicContact CD1-CE2 3.98Å; L10-F38 HydrophobicContact CD1-CZ 3.8Å; I26-F38 HydrophobicContact CG2-CE1 4.15Å; I26-F38 HydrophobicContact CG2-CZ 4.08Å; V32-F38 HydrophobicContact CG1-CD2 3.95Å; V32-F38 HydrophobicContact CG1-CE1 4.3Å; V32-F38 HydrophobicContact CG1-CE2 3.68Å; V32-F38 HydrophobicContact CG1-CG 4.39Å; V32-F38 HydrophobicContact CG1-CZ 3.88Å; L35-F38 HydrophobicContact CD1-CD2 4.29Å; S36-F38 PolarHBondContact O-N 2.75Å; F38-Y40 PolarHBondContact O-N 3.43Å; F38-V41 HydrophobicContact CD1-CB 4.49Å; F38-V41 HydrophobicContact CD1-CG2 4.46Å; F38-V41 PolarHBondContact O-N 2.91Å; F38-L61 HydrophobicContact CE1-CD1 4.15Å; F38-L61 HydrophobicContact CE1-CD2 4.2Å; F38-L61 HydrophobicContact CE1-CG 4.42Å; F38-L61 HydrophobicContact CZ-CD1 4.1Å; F38-W62 HydrophobicContact CB-CZ3 4.24Å; F38-W62 WeakPolarHBondContact O-CH2 3.49Å; F38-V65 HydrophobicContact CB-CG1 4.15Å; F38-V65 HydrophobicContact CD1-CG2 4.16Å; F38-V65 HydrophobicContact CD2-CG1 4.13Å; F38-V65 HydrophobicContact CD2-CG2 3.69Å; F38-V65 HydrophobicContact CE1-CG2 4.14Å; F38-V65 HydrophobicContact CE2-CG2 3.63Å; F38-V65 HydrophobicContact CG-CG1 4.21Å; F38-V65 HydrophobicContact CG-CG2 3.95Å; F38-V65 HydrophobicContact CZ-CG2 3.87Å
39	D	82.7	Confident	84.1	Confident	98 Å²	98	67.5 Å²	67.5	52%	0.524	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-69.8	-16.9	174.1	-64.7	-62.8	0	0	0	113	S36 H37 R69	S36-D39 WeakPolarHBondContact CA-OD2 3.45Å; S36-D39 WeakPolarHBondContact O-CB 3.33Å; S36-D39 PolarHBondContact O-N 2.94Å; S36-D39 VanDerWaalsContact O-OD2 3.05Å; H37-D39 PolarHBondContact O-N 3.41Å; D39-R69 IonicContact OD1-CZ 3.32Å; D39-R69 IonicContact OD1-NH1 3.74Å; D39-R69 PolarHBondContact OD1-NH1 3.2Å; D39-R69 IonicContact OD1-NH2 2.73Å; D39-R69 PolarHBondContact OD1-NH2 2.83Å; D39-R69 IonicContact OD2-CZ 3.45Å; D39-R69 IonicContact OD2-NH1 2.74Å; D39-R69 PolarHBondContact OD2-NH1 2.67Å; D39-R69 IonicContact OD2-NH2 3.47Å; D39-R69 PolarHBondContact OD2-NH2 3.31Å
40	Y	81.6	Confident	83.8	Confident	195 Å²	195	64.1 Å²	64.1	77%	0.765	31%	0.314	S	S	*	.	S	Bend	trans	-102.7	-8.3	177.9	-53	-78	0	0	0	113.2	H37 F38	H37-Y40 PolarHBondContact O-N 2.98Å; H37-Y40 VanDerWaalsContact O-N 3.1Å; F38-Y40 PolarHBondContact O-N 3.43Å
41	V	87.2	Confident	83.4	Confident	13 Å²	13	62.4 Å²	62.4	8%	0.079	31%	0.305	C	S	.	.			trans	-86.2	115.2	179.9	173.5	0	0	0	0	109.9	L30 V32 F38 L46 W62	L30-V41 HydrophobicContact CB-CG2 4.44Å; L30-V41 HydrophobicContact CD1-CG1 4Å; L30-V41 HydrophobicContact CD1-CG2 4.47Å; V32-V41 HydrophobicContact CG2-CG2 3.73Å; F38-V41 HydrophobicContact CD1-CB 4.49Å; F38-V41 HydrophobicContact CD1-CG2 4.46Å; F38-V41 PolarHBondContact O-N 2.91Å; V41-L46 HydrophobicContact CG1-CD1 4.44Å; V41-L46 HydrophobicContact CG1-CD2 3.79Å; V41-L46 HydrophobicContact CG1-CG 3.82Å; V41-W62 WeakPolarHBondContact O-CH2 3.41Å; V41-W62 WeakPolarHBondContact O-CZ2 3.22Å
42	K	86.1	Confident	82.7	Confident	112 Å²	112	59.2 Å²	59.2	49%	0.487	30%	0.299	S	S	.	.			trans	-87.5	162.6	174.5	-55.9	178.8	-178.7	178.4	0	111.4	E44 D45 L46	K42-E44 HydrophobicContact CB-CB 4.27Å; K42-E44 IonicContact NZ-OE2 3.38Å; K42-E44 PolarHBondContact O-N 3.24Å; K42-D45 VanDerWaalsContact CB-OD2 3.27Å; K42-D45 WeakPolarHBondContact CB-OD2 3.44Å; K42-D45 PolarHBondContact N-OD2 2.89Å; K42-D45 PolarHBondContact O-N 3.14Å; K42-L46 PolarHBondContact O-N 3.29Å; K42-L46 VanDerWaalsContact O-N 3.13Å
43	N	83.4	Confident	81.6	Confident	75 Å²	75	68.3 Å²	68.3	40%	0.401	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-30.8	170.3	-65.4	-31.7	0	0	0	111.9	D45 L46 E47 Q58 W62	N43-D45 VanDerWaalsContact C-N 3.27Å; N43-D45 PolarHBondContact O-N 3.4Å; N43-L46 PolarHBondContact O-N 2.94Å; N43-E47 WeakPolarHBondContact O-CG 3.44Å; N43-E47 PolarHBondContact O-N 2.89Å; N43-Q58 PolarHBondContact O-NE2 3.29Å; N43-W62 PolarHBondContact OD1-NE1 3.31Å
44	E	82.1	Confident	80.3	Confident	110 Å²	110	70.7 Å²	70.7	51%	0.514	35%	0.35	S	S	.	.	H	α-helix	trans	-58	-37.2	171	-65.2	142.7	-127.4	0	0	112.7	K42 E47 K48	K42-E44 HydrophobicContact CB-CB 4.27Å; K42-E44 IonicContact NZ-OE2 3.38Å; K42-E44 PolarHBondContact O-N 3.24Å; E44-E47 PolarHBondContact O-N 3.03Å; E44-K48 WeakPolarHBondContact O-CE 3.22Å; E44-K48 VanDerWaalsContact O-CG 3.31Å; E44-K48 WeakPolarHBondContact O-CG 3.3Å; E44-K48 PolarHBondContact O-N 2.97Å; E44-K48 VanDerWaalsContact O-N 3.13Å
45	D	85.6	Confident	79.2	Confident	32 Å²	32	67.3 Å²	67.3	17%	0.171	36%	0.357	C	S	.	.	H	α-helix	trans	-80.9	-34.3	-178.1	-52.2	-52	0	0	0	111.2	L30 K42 N43 E47 K48 I49	L30-D45 HydrophobicContact CD2-CB 3.84Å; K42-D45 VanDerWaalsContact CB-OD2 3.27Å; K42-D45 WeakPolarHBondContact CB-OD2 3.44Å; K42-D45 PolarHBondContact N-OD2 2.89Å; K42-D45 PolarHBondContact O-N 3.14Å; N43-D45 VanDerWaalsContact C-N 3.27Å; N43-D45 PolarHBondContact O-N 3.4Å; D45-E47 VanDerWaalsContact C-N 3.32Å; D45-K48 PolarHBondContact O-N 2.99Å; D45-K48 IonicContact OD1-NZ 2.73Å; D45-K48 PolarHBondContact OD1-NZ 3.3Å; D45-I49 PolarHBondContact O-N 3.06Å
46	L	85.9	Confident	78.3	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.4	-39.8	167.1	-63.6	176.8	0	0	0	111.6	L30 V41 K42 N43 I49 M51 Q58 L61 W62	L30-L46 HydrophobicContact CD1-CD2 4.12Å; V41-L46 HydrophobicContact CG1-CD1 4.44Å; V41-L46 HydrophobicContact CG1-CD2 3.79Å; V41-L46 HydrophobicContact CG1-CG 3.82Å; K42-L46 PolarHBondContact O-N 3.29Å; K42-L46 VanDerWaalsContact O-N 3.13Å; N43-L46 PolarHBondContact O-N 2.94Å; L46-I49 HydrophobicContact CD2-CD1 4.27Å; L46-I49 WeakPolarHBondContact O-CG1 3.42Å; L46-I49 PolarHBondContact O-N 2.94Å; L46-M51 CarbonylContact C-O 3.12Å; L46-M51 HydrophobicContact CB-CB 4.35Å; L46-M51 HydrophobicContact CD2-SD 4.43Å; L46-M51 CarbonylContact O-C 3.57Å; L46-M51 WeakPolarHBondContact O-CA 3.3Å; L46-M51 VanDerWaalsContact O-CB 3.25Å; L46-M51 WeakPolarHBondContact O-CB 3.43Å; L46-M51 PolarHBondContact O-N 3.48Å; L46-Q58 HydrophobicContact CB-CG 4.21Å; L46-Q58 HydrophobicContact CD1-CB 4.41Å; L46-Q58 HydrophobicContact CD1-CG 4.17Å; L46-L61 HydrophobicContact CD1-CD2 3.99Å; L46-L61 HydrophobicContact CD2-CD2 3.69Å; L46-W62 HydrophobicContact CD1-CZ2 4.25Å
47	E	82.4	Confident	78.2	Confident	56 Å²	56	67.9 Å²	67.9	26%	0.262	37%	0.366	S	S	.	.	H	α-helix	trans	-62.3	-43.4	173.2	-76.2	176.7	-150.8	0	0	112.1	N43 E44 D45 I49 G50 R53	N43-E47 WeakPolarHBondContact O-CG 3.44Å; N43-E47 PolarHBondContact O-N 2.89Å; E44-E47 PolarHBondContact O-N 3.03Å; D45-E47 VanDerWaalsContact C-N 3.32Å; E47-I49 PolarHBondContact O-N 2.67Å; E47-G50 PolarHBondContact O-N 3.27Å; E47-R53 VanDerWaalsContact CD-CG 3.49Å; E47-R53 VanDerWaalsContact CD-NE 3.3Å; E47-R53 HydrophobicContact CG-CG 4.24Å; E47-R53 WeakPolarHBondContact OE1-CG 3.33Å; E47-R53 IonicContact OE1-CZ 2.7Å; E47-R53 IonicContact OE1-NE 3.13Å; E47-R53 PolarHBondContact OE1-NE 3.21Å; E47-R53 IonicContact OE1-NH2 3.68Å; E47-R53 IonicContact OE2-CZ 2.74Å; E47-R53 VanDerWaalsContact OE2-CZ 3.23Å; E47-R53 IonicContact OE2-NE 3.3Å; E47-R53 PolarHBondContact OE2-NE 3.28Å; E47-R53 IonicContact OE2-NH2 3.36Å; E47-R53 PolarHBondContact OE2-NH2 3.18Å
48	K	82.2	Confident	78	Confident	149 Å²	149	65.4 Å²	65.4	65%	0.648	35%	0.354	S	S	*	.	H	α-helix	trans	-58.8	-41.8	178.3	-69.9	163.7	-153.3	165.2	0	112.7	E44 D45 G50	E44-K48 WeakPolarHBondContact O-CE 3.22Å; E44-K48 VanDerWaalsContact O-CG 3.31Å; E44-K48 WeakPolarHBondContact O-CG 3.3Å; E44-K48 PolarHBondContact O-N 2.97Å; E44-K48 VanDerWaalsContact O-N 3.13Å; D45-K48 PolarHBondContact O-N 2.99Å; D45-K48 IonicContact OD1-NZ 2.73Å; D45-K48 PolarHBondContact OD1-NZ 3.3Å; K48-G50 PolarHBondContact O-N 3.36Å; K48-G50 VanDerWaalsContact O-N 3.14Å
49	I	85.6	Confident	77.6	Confident	5 Å²	5	74 Å²	74	3%	0.026	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	6.9	176.7	68.2	163	0	0	0	113.9	Y22 R25 I26 E29 L30 D45 L46 E47 M51	Y22-I49 HydrophobicContact CD1-CD1 4.39Å; R25-I49 HydrophobicContact CB-CB 3.89Å; R25-I49 HydrophobicContact CB-CD1 4.14Å; R25-I49 HydrophobicContact CB-CG2 4.04Å; R25-I49 VanDerWaalsContact CD-O 3.29Å; R25-I49 WeakPolarHBondContact CD-O 3.45Å; R25-I49 PolarHBondContact NH1-O 3.33Å; I26-I49 HydrophobicContact CD1-CD1 4.23Å; I26-I49 HydrophobicContact CG1-CD1 3.46Å; I26-I49 VanDerWaalsContact CG1-CD1 3.46Å; E29-I49 HydrophobicContact CB-CG2 4.25Å; E29-I49 WeakPolarHBondContact OE2-CG2 3.3Å; L30-I49 HydrophobicContact CD1-CD1 3.81Å; L30-I49 HydrophobicContact CD1-CG1 4.36Å; L30-I49 HydrophobicContact CD1-CG2 4.08Å; L30-I49 HydrophobicContact CD2-CG2 3.95Å; L30-I49 HydrophobicContact CG-CG2 3.85Å; D45-I49 PolarHBondContact O-N 3.06Å; L46-I49 HydrophobicContact CD2-CD1 4.27Å; L46-I49 WeakPolarHBondContact O-CG1 3.42Å; L46-I49 PolarHBondContact O-N 2.94Å; E47-I49 PolarHBondContact O-N 2.67Å; I49-M51 HydrophobicContact CG1-CB 4.44Å
50	G	78.3	Confident	77.7	Confident	42 Å²	42	73.3 Å²	73.3	43%	0.433	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	14.6	178.8	0	0	0	0	0	114.8	Y22 E47 K48 G52	Y22-G50 PolarHBondContact OH-O 3.46Å; E47-G50 PolarHBondContact O-N 3.27Å; K48-G50 PolarHBondContact O-N 3.36Å; K48-G50 VanDerWaalsContact O-N 3.14Å; G50-G52 PolarHBondContact O-N 2.84Å
51	M	79.4	Confident	78.1	Confident	1 Å²	1	64 Å²	64	1%	0.005	34%	0.34	C	S	.	.			trans	-92.1	83.4	171.7	-167	-177.2	-59.1	0	0	109.2	L19 Y22 I26 L46 I49 Q58 L61	L19-M51 HydrophobicContact CD1-CE 4.11Å; L19-M51 HydrophobicContact CD1-SD 4.27Å; Y22-M51 HydrophobicContact CD1-CB 4.35Å; Y22-M51 HydrophobicContact CD1-CE 4.19Å; Y22-M51 HydrophobicContact CD2-CE 3.71Å; Y22-M51 HydrophobicContact CE1-CB 3.97Å; Y22-M51 HydrophobicContact CE2-CE 4.19Å; Y22-M51 HydrophobicContact CG-CE 3.7Å; I26-M51 HydrophobicContact CD1-CE 3.94Å; L46-M51 CarbonylContact C-O 3.12Å; L46-M51 HydrophobicContact CB-CB 4.35Å; L46-M51 HydrophobicContact CD2-SD 4.43Å; L46-M51 CarbonylContact O-C 3.57Å; L46-M51 WeakPolarHBondContact O-CA 3.3Å; L46-M51 VanDerWaalsContact O-CB 3.25Å; L46-M51 WeakPolarHBondContact O-CB 3.43Å; L46-M51 PolarHBondContact O-N 3.48Å; I49-M51 HydrophobicContact CG1-CB 4.44Å; M51-Q58 HydrophobicContact CG-CG 3.95Å; M51-Q58 PolarHBondContact O-NE2 3.43Å; M51-Q58 HydrophobicContact SD-CG 4.08Å; M51-L61 HydrophobicContact CE-CD2 4.03Å; M51-L61 HydrophobicContact SD-CB 4.36Å; M51-L61 HydrophobicContact SD-CD2 3.92Å
52	G	69.3	Low	78.2	Confident	45 Å²	45	67 Å²	67	46%	0.464	35%	0.35	S	S	.	.			trans	-62.2	173.7	-167.6	0	0	0	0	0	117.5	G50 Q58	G50-G52 PolarHBondContact O-N 2.84Å; G52-Q58 PolarHBondContact O-NE2 3.02Å
53	R	62.2	Low	78.1	Confident	191 Å²	191	65.4 Å²	65.4	72%	0.721	34%	0.344	S	S	*	.	S	Bend	trans	-49.5	156.7	-172.7	-83.4	178.9	-171.8	-147.9	-7.3	115.1	E47 G55	E47-R53 VanDerWaalsContact CD-CG 3.49Å; E47-R53 VanDerWaalsContact CD-NE 3.3Å; E47-R53 HydrophobicContact CG-CG 4.24Å; E47-R53 WeakPolarHBondContact OE1-CG 3.33Å; E47-R53 IonicContact OE1-CZ 2.7Å; E47-R53 IonicContact OE1-NE 3.13Å; E47-R53 PolarHBondContact OE1-NE 3.21Å; E47-R53 IonicContact OE1-NH2 3.68Å; E47-R53 IonicContact OE2-CZ 2.74Å; E47-R53 VanDerWaalsContact OE2-CZ 3.23Å; E47-R53 IonicContact OE2-NE 3.3Å; E47-R53 PolarHBondContact OE2-NE 3.28Å; E47-R53 IonicContact OE2-NH2 3.36Å; E47-R53 PolarHBondContact OE2-NH2 3.18Å; R53-G55 VanDerWaalsContact C-N 3.32Å; R53-G55 PolarHBondContact O-N 2.89Å
54	P	53.3	Low	78.4	Confident	101 Å²	101	62 Å²	62	66%	0.656	33%	0.327	S	S	*	.	S	Bend	trans	-80.4	63.8	-137.2	31.1	-38.8	0	0	0	115.8
55	G	58.8	Low	78.7	Confident	64 Å²	64	56.9 Å²	56.9	66%	0.66	30%	0.303	S	S	*	.	S	Bend	trans	-80.5	-63.1	172.2	0	0	0	0	0	113.2	R53	R53-G55 VanDerWaalsContact C-N 3.32Å; R53-G55 PolarHBondContact O-N 2.89Å
56	S	64	Low	78.7	Confident	62 Å²	62	61.3 Å²	61.3	43%	0.434	32%	0.321	S	S	.	.	S	Bend	trans	-148.7	-28.8	-176.5	75.1	0	0	0	0	116.7	R60	S56-R60 VanDerWaalsContact O-CB 3.3Å; S56-R60 WeakPolarHBondContact O-CB 3.43Å; S56-R60 VanDerWaalsContact O-CG 3.26Å; S56-R60 WeakPolarHBondContact O-CG 3.35Å; S56-R60 PolarHBondContact O-N 3.22Å; S56-R60 PolarHBondContact O-NE 3.4Å; S56-R60 PolarHBondContact OG-NH2 3.01Å
57	G	75.8	Confident	78.6	Confident	15 Å²	15	67.6 Å²	67.6	16%	0.155	34%	0.344	C	S	.	.	H	α-helix	trans	-65.3	-67.7	-176.3	0	0	0	0	0	112.2	L19 R59 R60 L61	L19-G57 WeakPolarHBondContact CD1-O 3.32Å; G57-R59 PolarHBondContact O-N 3.25Å; G57-R60 PolarHBondContact O-N 2.98Å; G57-R60 VanDerWaalsContact O-N 3.1Å; G57-L61 PolarHBondContact O-N 3.38Å
58	Q	82.9	Confident	78.5	Confident	5 Å²	5	67.5 Å²	67.5	2%	0.023	34%	0.342	C	S	.	.	H	α-helix	trans	-52.6	-40.9	177.3	-59.2	-178.4	-9.3	0	0	112.4	N43 L46 M51 G52 L61 W62	N43-Q58 PolarHBondContact O-NE2 3.29Å; L46-Q58 HydrophobicContact CB-CG 4.21Å; L46-Q58 HydrophobicContact CD1-CB 4.41Å; L46-Q58 HydrophobicContact CD1-CG 4.17Å; M51-Q58 HydrophobicContact CG-CG 3.95Å; M51-Q58 PolarHBondContact O-NE2 3.43Å; M51-Q58 HydrophobicContact SD-CG 4.08Å; G52-Q58 PolarHBondContact O-NE2 3.02Å; Q58-L61 WeakPolarHBondContact O-CB 3.27Å; Q58-L61 PolarHBondContact O-N 2.8Å; Q58-W62 PolarHBondContact O-N 3.33Å
59	R	81.1	Confident	78.5	Confident	182 Å²	182	64 Å²	64	69%	0.687	32%	0.324	S	S	*	.	H	α-helix	trans	-66.2	-40.5	-180	-165.8	174.4	-171.4	163.9	3.4	112.6	G57 E63	G57-R59 PolarHBondContact O-N 3.25Å; R59-E63 WeakPolarHBondContact O-CB 2.98Å; R59-E63 PolarHBondContact O-N 3.42Å
60	R	85.6	Confident	77.9	Confident	84 Å²	84	65.8 Å²	65.8	32%	0.317	34%	0.34	S	S	.	.	H	α-helix	trans	-65.3	-42.9	172.5	-79.5	179.6	-74.7	167.8	-16.5	111.5	V17 S56 G57 E63 A64	V17-R60 HydrophobicContact CB-CB 4.01Å; V17-R60 HydrophobicContact CG1-CB 4.09Å; V17-R60 PolarHBondContact O-NH1 3.45Å; S56-R60 VanDerWaalsContact O-CB 3.3Å; S56-R60 WeakPolarHBondContact O-CB 3.43Å; S56-R60 VanDerWaalsContact O-CG 3.26Å; S56-R60 WeakPolarHBondContact O-CG 3.35Å; S56-R60 PolarHBondContact O-N 3.22Å; S56-R60 PolarHBondContact O-NE 3.4Å; S56-R60 PolarHBondContact OG-NH2 3.01Å; G57-R60 PolarHBondContact O-N 2.98Å; G57-R60 VanDerWaalsContact O-N 3.1Å; R60-E63 PolarHBondContact O-N 3.27Å; R60-A64 WeakPolarHBondContact O-CB 3.34Å; R60-A64 PolarHBondContact O-N 2.66Å
61	L	89.8	Confident	77.3	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57	-53.1	175.2	178.1	60.5	0	0	0	111	L13 L14 L19 I26 F38 L46 M51 G57 Q58 E63 A64 V65	L13-L61 HydrophobicContact CD2-CD1 4.03Å; L14-L61 HydrophobicContact CD2-CD1 3.62Å; L19-L61 HydrophobicContact CD1-CB 3.81Å; I26-L61 HydrophobicContact CD1-CD2 4.34Å; F38-L61 HydrophobicContact CE1-CD1 4.15Å; F38-L61 HydrophobicContact CE1-CD2 4.2Å; F38-L61 HydrophobicContact CE1-CG 4.42Å; F38-L61 HydrophobicContact CZ-CD1 4.1Å; L46-L61 HydrophobicContact CD1-CD2 3.99Å; L46-L61 HydrophobicContact CD2-CD2 3.69Å; M51-L61 HydrophobicContact CE-CD2 4.03Å; M51-L61 HydrophobicContact SD-CB 4.36Å; M51-L61 HydrophobicContact SD-CD2 3.92Å; G57-L61 PolarHBondContact O-N 3.38Å; Q58-L61 WeakPolarHBondContact O-CB 3.27Å; Q58-L61 PolarHBondContact O-N 2.8Å; L61-E63 PolarHBondContact O-N 3.31Å; L61-A64 CarbonylContact O-C 3.58Å; L61-A64 PolarHBondContact O-N 3.33Å; L61-A64 VanDerWaalsContact O-N 3.1Å; L61-V65 HydrophobicContact CD1-CG2 4.15Å; L61-V65 HydrophobicContact CG-CG2 4.48Å; L61-V65 WeakPolarHBondContact O-CG2 3.15Å; L61-V65 PolarHBondContact O-N 3.37Å
62	W	87.6	Confident	76.4	Confident	77 Å²	77	75.1 Å²	75.1	29%	0.292	37%	0.368	S	S	.	.	H	α-helix	trans	-63.3	-38.8	179.5	-73.4	122.9	0	0	0	112.9	F38 V41 N43 L46 Q58 V65 K66	F38-W62 HydrophobicContact CB-CZ3 4.24Å; F38-W62 WeakPolarHBondContact O-CH2 3.49Å; V41-W62 WeakPolarHBondContact O-CH2 3.41Å; V41-W62 WeakPolarHBondContact O-CZ2 3.22Å; N43-W62 PolarHBondContact OD1-NE1 3.31Å; L46-W62 HydrophobicContact CD1-CZ2 4.25Å; Q58-W62 PolarHBondContact O-N 3.33Å; W62-V65 HydrophobicContact CE3-CB 4.49Å; W62-V65 HydrophobicContact CE3-CG1 4.48Å; W62-V65 PolarHBondContact O-N 2.99Å; W62-K66 WeakPolarHBondContact O-CB 3.34Å; W62-K66 PolarHBondContact O-N 3.38Å
63	E	85.9	Confident	75.6	Confident	77 Å²	77	81.2 Å²	81.2	36%	0.36	38%	0.382	S	S	.	.	H	α-helix	trans	-69.8	-27.8	172.7	-78.1	-62	155.2	0	0	113.2	R59 R60 L61 K66 R67	R59-E63 WeakPolarHBondContact O-CB 2.98Å; R59-E63 PolarHBondContact O-N 3.42Å; R60-E63 PolarHBondContact O-N 3.27Å; L61-E63 PolarHBondContact O-N 3.31Å; E63-K66 IonicContact OE1-NZ 3.41Å; E63-K66 PolarHBondContact OE1-NZ 2.84Å; E63-K66 IonicContact OE2-NZ 3.83Å; E63-R67 VanDerWaalsContact O-CB 3.23Å; E63-R67 WeakPolarHBondContact O-CB 3.3Å; E63-R67 WeakPolarHBondContact O-CG 3.43Å; E63-R67 PolarHBondContact O-N 2.86Å; E63-R67 PolarHBondContact O-NE 3Å
64	A	87.8	Confident	74.9	Confident	5 Å²	5	78.3 Å²	78.3	4%	0.041	37%	0.371	C	S	.	.	H	α-helix	trans	-71.7	-47	168.7	0	0	0	0	0	112.2	L13 V17 R60 L61 K66 R67 R68	L13-A64 HydrophobicContact CD2-CB 4.38Å; L13-A64 HydrophobicContact CG-CB 4.19Å; V17-A64 HydrophobicContact CG1-CB 3.58Å; V17-A64 HydrophobicContact CG2-CB 4.41Å; R60-A64 WeakPolarHBondContact O-CB 3.34Å; R60-A64 PolarHBondContact O-N 2.66Å; L61-A64 CarbonylContact O-C 3.58Å; L61-A64 PolarHBondContact O-N 3.33Å; L61-A64 VanDerWaalsContact O-N 3.1Å; A64-K66 VanDerWaalsContact C-N 3.32Å; A64-K66 PolarHBondContact O-N 2.92Å; A64-R67 PolarHBondContact O-N 2.85Å; A64-R68 VanDerWaalsContact O-CB 3.28Å; A64-R68 WeakPolarHBondContact O-CB 3.29Å; A64-R68 PolarHBondContact O-N 3.34Å
65	V	88.5	Confident	74.3	Confident	2 Å²	2	80.3 Å²	80.3	1%	0.012	37%	0.369	C	S	.	.	H	α-helix	trans	-58.3	-44.9	175.2	171.9	0	0	0	0	110.5	L13 L35 F38 L61 W62 R68 R69	L13-V65 HydrophobicContact CD1-CG2 4.41Å; L13-V65 HydrophobicContact CD2-CG2 4.23Å; L35-V65 HydrophobicContact CD1-CG1 4.13Å; F38-V65 HydrophobicContact CB-CG1 4.15Å; F38-V65 HydrophobicContact CD1-CG2 4.16Å; F38-V65 HydrophobicContact CD2-CG1 4.13Å; F38-V65 HydrophobicContact CD2-CG2 3.69Å; F38-V65 HydrophobicContact CE1-CG2 4.14Å; F38-V65 HydrophobicContact CE2-CG2 3.63Å; F38-V65 HydrophobicContact CG-CG1 4.21Å; F38-V65 HydrophobicContact CG-CG2 3.95Å; F38-V65 HydrophobicContact CZ-CG2 3.87Å; L61-V65 HydrophobicContact CD1-CG2 4.15Å; L61-V65 HydrophobicContact CG-CG2 4.48Å; L61-V65 WeakPolarHBondContact O-CG2 3.15Å; L61-V65 PolarHBondContact O-N 3.37Å; W62-V65 HydrophobicContact CE3-CB 4.49Å; W62-V65 HydrophobicContact CE3-CG1 4.48Å; W62-V65 PolarHBondContact O-N 2.99Å; V65-R68 PolarHBondContact O-N 2.81Å; V65-R69 HydrophobicContact CG1-CG 4.48Å; V65-R69 WeakPolarHBondContact O-CB 3.35Å; V65-R69 VanDerWaalsContact O-CG 3.24Å; V65-R69 WeakPolarHBondContact O-CG 3.49Å; V65-R69 PolarHBondContact O-N 3.03Å
66	K	86.1	Confident	73.4	Confident	124 Å²	124	80.4 Å²	80.4	54%	0.539	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-46.3	175.1	-177.8	177	165.1	-163	0	112.5	W62 E63 A64 R69 A70	W62-K66 WeakPolarHBondContact O-CB 3.34Å; W62-K66 PolarHBondContact O-N 3.38Å; E63-K66 IonicContact OE1-NZ 3.41Å; E63-K66 PolarHBondContact OE1-NZ 2.84Å; E63-K66 IonicContact OE2-NZ 3.83Å; A64-K66 VanDerWaalsContact C-N 3.32Å; A64-K66 PolarHBondContact O-N 2.92Å; K66-R69 PolarHBondContact O-N 2.82Å; K66-A70 WeakPolarHBondContact O-CB 3.31Å; K66-A70 PolarHBondContact O-N 3.26Å
67	R	83.1	Confident	72	Confident	132 Å²	132	86 Å²	86	50%	0.498	37%	0.372	S	S	.	.	H	α-helix	trans	-62.9	-40.1	173.5	-76.7	178.5	-63.3	154.5	3.8	112.3	E63 A64 A70 L71	E63-R67 VanDerWaalsContact O-CB 3.23Å; E63-R67 WeakPolarHBondContact O-CB 3.3Å; E63-R67 WeakPolarHBondContact O-CG 3.43Å; E63-R67 PolarHBondContact O-N 2.86Å; E63-R67 PolarHBondContact O-NE 3Å; A64-R67 PolarHBondContact O-N 2.85Å; R67-A70 PolarHBondContact O-N 2.88Å; R67-L71 WeakPolarHBondContact O-CB 3.18Å; R67-L71 VanDerWaalsContact O-CG 3.3Å; R67-L71 WeakPolarHBondContact O-CG 3.35Å; R67-L71 PolarHBondContact O-N 2.84Å
68	R	80.8	Confident	69.8	Low	54 Å²	54	90.7 Å²	90.7	20%	0.204	39%	0.391	C	S	.	.	H	α-helix	trans	-71	-35.6	179.1	-150.5	88.4	178.2	-160.5	0.1	111.7	E12 L13 D16 L35 A64 V65 L71 Y72	E12-R68 IonicContact OE2-CZ 2.72Å; E12-R68 IonicContact OE2-NH1 3.46Å; E12-R68 PolarHBondContact OE2-NH1 3.15Å; E12-R68 IonicContact OE2-NH2 3.56Å; E12-R68 PolarHBondContact OE2-NH2 2.71Å; L13-R68 HydrophobicContact CD1-CB 3.59Å; L13-R68 HydrophobicContact CD1-CG 3.73Å; D16-R68 IonicContact OD2-NH1 2.67Å; D16-R68 PolarHBondContact OD2-NH1 3Å; L35-R68 HydrophobicContact CD1-CB 4.41Å; L35-R68 HydrophobicContact CD2-CB 4.47Å; A64-R68 VanDerWaalsContact O-CB 3.28Å; A64-R68 WeakPolarHBondContact O-CB 3.29Å; A64-R68 PolarHBondContact O-N 3.34Å; V65-R68 PolarHBondContact O-N 2.81Å; R68-L71 CarbonylContact O-C 3.48Å; R68-L71 PolarHBondContact O-N 2.96Å; R68-Y72 WeakPolarHBondContact O-CB 3.31Å; R68-Y72 PolarHBondContact O-N 3.35Å
69	R	81.7	Confident	67.5	Low	76 Å²	76	94.1 Å²	94.1	29%	0.287	42%	0.416	S	S	.	.	H	α-helix	trans	-64.7	-45.2	169.3	-75.2	173.5	-179.8	-144.3	-8.6	111.9	L35 D39 V65 K66 L71 Y72 K73	L35-R69 HydrophobicContact CD1-CG 4.38Å; L35-R69 HydrophobicContact CD2-CG 3.78Å; L35-R69 HydrophobicContact CG-CG 3.96Å; L35-R69 PolarHBondContact O-NH2 3.48Å; D39-R69 IonicContact OD1-CZ 3.32Å; D39-R69 IonicContact OD1-NH1 3.74Å; D39-R69 PolarHBondContact OD1-NH1 3.2Å; D39-R69 IonicContact OD1-NH2 2.73Å; D39-R69 PolarHBondContact OD1-NH2 2.83Å; D39-R69 IonicContact OD2-CZ 3.45Å; D39-R69 IonicContact OD2-NH1 2.74Å; D39-R69 PolarHBondContact OD2-NH1 2.67Å; D39-R69 IonicContact OD2-NH2 3.47Å; D39-R69 PolarHBondContact OD2-NH2 3.31Å; V65-R69 HydrophobicContact CG1-CG 4.48Å; V65-R69 WeakPolarHBondContact O-CB 3.35Å; V65-R69 VanDerWaalsContact O-CG 3.24Å; V65-R69 WeakPolarHBondContact O-CG 3.49Å; V65-R69 PolarHBondContact O-N 3.03Å; K66-R69 PolarHBondContact O-N 2.82Å; R69-L71 VanDerWaalsContact C-N 3.3Å; R69-L71 PolarHBondContact O-N 2.89Å; R69-Y72 PolarHBondContact O-N 2.85Å; R69-Y72 VanDerWaalsContact O-N 3.13Å; R69-K73 PolarHBondContact O-N 2.83Å
70	A	73.3	Confident	65.8	Low	43 Å²	43	91.2 Å²	91.2	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-62	-38.2	173.3	0	0	0	0	0	111.9	K66 R67 R74	K66-A70 WeakPolarHBondContact O-CB 3.31Å; K66-A70 PolarHBondContact O-N 3.26Å; R67-A70 PolarHBondContact O-N 2.88Å; A70-R74 WeakPolarHBondContact O-CB 3.32Å; A70-R74 PolarHBondContact O-N 3.33Å
71	L	65.9	Low	63.2	Low	75 Å²	75	90.4 Å²	90.4	39%	0.393	41%	0.412	S	S	.	.	H	α-helix	trans	-68.9	-31.3	172	-76.9	164.6	0	0	0	112.9	R67 R68 R69 R74 K75	R67-L71 WeakPolarHBondContact O-CB 3.18Å; R67-L71 VanDerWaalsContact O-CG 3.3Å; R67-L71 WeakPolarHBondContact O-CG 3.35Å; R67-L71 PolarHBondContact O-N 2.84Å; R68-L71 CarbonylContact O-C 3.48Å; R68-L71 PolarHBondContact O-N 2.96Å; R69-L71 VanDerWaalsContact C-N 3.3Å; R69-L71 PolarHBondContact O-N 2.89Å; L71-R74 CarbonylContact O-C 3.56Å; L71-K75 VanDerWaalsContact O-CB 3.28Å; L71-K75 WeakPolarHBondContact O-CB 3.39Å; L71-K75 VanDerWaalsContact O-CG 3.28Å; L71-K75 WeakPolarHBondContact O-CG 3.49Å; L71-K75 PolarHBondContact O-N 3.38Å
72	Y	60.5	Low	60.3	Low	163 Å²	163	98.3 Å²	98.3	64%	0.639	45%	0.447	S	S	*	.	H	α-helix	trans	-71.1	-46.3	174.4	-121.7	-87.5	0	0	0	111.4	L35 R68 R69 R74 K75 S76	L35-Y72 HydrophobicContact CD2-CD2 4.09Å; R68-Y72 WeakPolarHBondContact O-CB 3.31Å; R68-Y72 PolarHBondContact O-N 3.35Å; R69-Y72 PolarHBondContact O-N 2.85Å; R69-Y72 VanDerWaalsContact O-N 3.13Å; Y72-R74 VanDerWaalsContact C-N 3.3Å; Y72-R74 PolarHBondContact O-N 2.55Å; Y72-K75 PolarHBondContact O-N 3.49Å; Y72-K75 VanDerWaalsContact O-N 3.12Å; Y72-S76 PolarHBondContact O-N 2.92Å
73	K	54	Low	57.6	Low	173 Å²	173	100.8 Å²	100.8	75%	0.752	47%	0.473	S	S	*	.	H	α-helix	trans	-57.1	-43.9	170	-70.1	-165	172.2	-161.5	0	111.1	R69 K75 S76 W77	R69-K73 PolarHBondContact O-N 2.83Å; K73-K75 PolarHBondContact O-N 3.31Å; K73-S76 WeakPolarHBondContact O-CB 2.86Å; K73-S76 PolarHBondContact O-N 2.79Å; K73-W77 PolarHBondContact O-N 3.44Å
74	R	46.6	Very low	54.7	Low	131 Å²	131	102.2 Å²	102.2	49%	0.494	49%	0.487	S	S	.	.	H	α-helix	trans	-70.2	-25.6	176	-161.2	-178.1	-58.8	128	3.8	113.9	A70 L71 Y72 W77 M78	A70-R74 WeakPolarHBondContact O-CB 3.32Å; A70-R74 PolarHBondContact O-N 3.33Å; L71-R74 CarbonylContact O-C 3.56Å; Y72-R74 VanDerWaalsContact C-N 3.3Å; Y72-R74 PolarHBondContact O-N 2.55Å; R74-W77 WeakPolarHBondContact O-CB 3.34Å; R74-W77 PolarHBondContact O-N 3.11Å; R74-M78 HydrophobicContact CG-CG 4.36Å; R74-M78 HydrophobicContact CG-SD 4.11Å; R74-M78 WeakPolarHBondContact O-CB 3.43Å; R74-M78 VanDerWaalsContact O-CG 3.22Å; R74-M78 WeakPolarHBondContact O-CG 3.5Å; R74-M78 PolarHBondContact O-N 3.37Å
75	K	40.2	Very low	52	Low	142 Å²	142	110.9 Å²	110.9	62%	0.617	52%	0.524	S	S	*	.	H	α-helix	trans	-78.9	-32.6	173	-81	-177.5	176.7	-170	0	112.2	L71 Y72 K73 W77 M78 S79	L71-K75 VanDerWaalsContact O-CB 3.28Å; L71-K75 WeakPolarHBondContact O-CB 3.39Å; L71-K75 VanDerWaalsContact O-CG 3.28Å; L71-K75 WeakPolarHBondContact O-CG 3.49Å; L71-K75 PolarHBondContact O-N 3.38Å; Y72-K75 PolarHBondContact O-N 3.49Å; Y72-K75 VanDerWaalsContact O-N 3.12Å; K73-K75 PolarHBondContact O-N 3.31Å; K75-W77 PolarHBondContact O-N 2.91Å; K75-M78 PolarHBondContact O-N 2.87Å; K75-S79 PolarHBondContact O-N 2.98Å; K75-S79 PolarHBondContact O-OG 3.23Å; K75-S79 VanDerWaalsContact O-OG 3.1Å
76	S	39.3	Very low	49	Very low	67 Å²	67	121.1 Å²	121.1	47%	0.469	56%	0.562	S	S	.	*	H	α-helix	trans	-62.6	-33.4	166.1	-167.4	0	0	0	0	111.9	Y72 K73 S79	Y72-S76 PolarHBondContact O-N 2.92Å; K73-S76 WeakPolarHBondContact O-CB 2.86Å; K73-S76 PolarHBondContact O-N 2.79Å; S76-S79 PolarHBondContact O-OG 2.84Å; S76-S79 VanDerWaalsContact O-OG 3.13Å
77	W	35.2	Very low	46.3	Very low	179 Å²	179	119.8 Å²	119.8	68%	0.678	57%	0.568	S	S	*	*	H	α-helix	trans	-72.4	-47.8	170.5	-176.1	-77.9	0	0	0	113	K73 R74 K75 S79 K80 V81	K73-W77 PolarHBondContact O-N 3.44Å; R74-W77 WeakPolarHBondContact O-CB 3.34Å; R74-W77 PolarHBondContact O-N 3.11Å; K75-W77 PolarHBondContact O-N 2.91Å; W77-S79 VanDerWaalsContact C-N 3.31Å; W77-S79 PolarHBondContact O-N 3.09Å; W77-K80 WeakPolarHBondContact O-CA 3.28Å; W77-K80 WeakPolarHBondContact O-CB 3.22Å; W77-K80 PolarHBondContact O-N 2.73Å; W77-V81 PolarHBondContact O-N 2.84Å
78	M	30.4	Very low	43.6	Very low	113 Å²	113	120.3 Å²	120.3	56%	0.557	58%	0.581	S	S	*	*	H	α-helix	trans	-75.3	-13.5	-175.5	-71.3	178.8	77.6	0	0	114.2	R74 K75 K80	R74-M78 HydrophobicContact CG-CG 4.36Å; R74-M78 HydrophobicContact CG-SD 4.11Å; R74-M78 WeakPolarHBondContact O-CB 3.43Å; R74-M78 VanDerWaalsContact O-CG 3.22Å; R74-M78 WeakPolarHBondContact O-CG 3.5Å; R74-M78 PolarHBondContact O-N 3.37Å; K75-M78 PolarHBondContact O-N 2.87Å; M78-K80 VanDerWaalsContact C-N 3.29Å
79	S	33.6	Very low	41.2	Very low	77 Å²	77	123.9 Å²	123.9	54%	0.538	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-12	163	55.2	0	0	0	0	113.4	K75 S76 W77	K75-S79 PolarHBondContact O-N 2.98Å; K75-S79 PolarHBondContact O-OG 3.23Å; K75-S79 VanDerWaalsContact O-OG 3.1Å; S76-S79 PolarHBondContact O-OG 2.84Å; S76-S79 VanDerWaalsContact O-OG 3.13Å; W77-S79 VanDerWaalsContact C-N 3.31Å; W77-S79 PolarHBondContact O-N 3.09Å
80	K	46.2	Very low	38.7	Very low	122 Å²	122	127.7 Å²	127.7	53%	0.53	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.2	-12.5	173.4	-74.4	-174.6	172.9	-174.9	0	114	W77 M78 D165	W77-K80 WeakPolarHBondContact O-CA 3.28Å; W77-K80 WeakPolarHBondContact O-CB 3.22Å; W77-K80 PolarHBondContact O-N 2.73Å; M78-K80 VanDerWaalsContact C-N 3.29Å; K80-D165 IonicContact NZ-OD1 3.33Å; K80-D165 PolarHBondContact NZ-OD1 2.85Å; K80-D165 IonicContact NZ-OD2 2.72Å; K80-D165 PolarHBondContact NZ-OD2 2.85Å
81	V	31.1	Very low	37	Very low	66 Å²	66	131.1 Å²	131.1	40%	0.4	65%	0.653	S	S	.	*	S	Bend	trans	-141.8	101.2	-175.1	-165.8	0	0	0	0	113.5	W77	W77-V81 PolarHBondContact O-N 2.84Å
82	F	28.6	Very low	35.2	Very low	166 Å²	166	136.6 Å²	136.6	73%	0.728	68%	0.677	S	S	*	*			trans	161.1	111.1	135.8	-88.8	-57.6	0	0	0	111.8	V84	F82-V84 HydrophobicContact CB-CG2 4.24Å; F82-V84 PolarHBondContact O-N 2.72Å; F82-V84 VanDerWaalsContact O-N 3.12Å
83	P	30.3	Very low	33.9	Very low	130 Å²	130	137.8 Å²	137.8	84%	0.844	69%	0.689	S	S	*	*			trans	-81.4	85.2	170.1	32.9	-32.7	0	0	0	110.8	K85	P83-K85 PolarHBondContact O-N 3.46Å
84	V	25.7	Very low	32.7	Very low	106 Å²	106	133.6 Å²	133.6	64%	0.642	70%	0.695	S	S	*	*			trans	-75.8	86.2	177.6	-178.6	0	0	0	0	110.6	F82 R86	F82-V84 HydrophobicContact CB-CG2 4.24Å; F82-V84 PolarHBondContact O-N 2.72Å; F82-V84 VanDerWaalsContact O-N 3.12Å; V84-R86 HydrophobicContact CG1-CG 4.09Å; V84-R86 PolarHBondContact O-N 2.67Å
85	K	30.9	Very low	32.1	Very low	188 Å²	188	132.4 Å²	132.4	82%	0.817	71%	0.712	S	S	*	*			trans	-69.3	103.7	164.1	-178	-173.7	176.6	-175	0	108.8	P83	P83-K85 PolarHBondContact O-N 3.46Å
86	R	26.3	Very low	31.6	Very low	217 Å²	217	131.6 Å²	131.6	82%	0.819	73%	0.725	S	S	*	*			trans	-95	124	162.3	-79.5	179.5	-176.8	175.4	0.1	109.7	V84	V84-R86 HydrophobicContact CG1-CG 4.09Å; V84-R86 PolarHBondContact O-N 2.67Å
87	S	28.1	Very low	31.5	Very low	96 Å²	96	134.5 Å²	134.5	67%	0.671	75%	0.745	S	S	*	*			trans	-130.7	124.9	160.6	48.4	0	0	0	0	105.5
88	D	27.3	Very low	31.2	Very low	142 Å²	142	129 Å²	129	76%	0.759	74%	0.744	S	S	*	*			trans	-81.1	168.7	-170.1	-72.9	-58.3	0	0	0	114
89	T	29.9	Very low	31.6	Very low	130 Å²	130	129.9 Å²	129.9	80%	0.798	76%	0.758	S	S	*	*			trans	72.2	109.2	164.5	45.3	0	0	0	0	120.3
90	D	28.6	Very low	31.5	Very low	155 Å²	155	132.1 Å²	132.1	83%	0.829	77%	0.771	S	S	*	*			trans	87.3	146.6	132.5	-76.2	18.8	0	0	0	123.9
91	P	38.4	Very low	30.7	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	78%	0.782	S	S	*	*			trans	-123	145.2	-162	38.1	-20.6	0	0	0	114.7
92	Q	28.9	Very low	30.7	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	80%	0.803	S	S	*	*			trans	-145.2	156.1	157.9	-135.8	170.6	6.8	0	0	114.5
93	Q	32.2	Very low	30.8	Very low	189 Å²	189	129.7 Å²	129.7	88%	0.883	80%	0.804	S	S	*	*			trans	-68.5	154.9	-165.5	-59.2	150.2	-12.6	0	0	113.8
94	G	29.6	Very low	30.9	Very low	85 Å²	85	128.3 Å²	128.3	88%	0.876	80%	0.798	S	S	*	*			trans	166	122.2	163	0	0	0	0	0	112.7
95	A	33.4	Very low	31.2	Very low	105 Å²	105	131.2 Å²	131.2	87%	0.868	80%	0.804	S	S	*	*			trans	-121.8	129.6	178.3	0	0	0	0	0	111.2
96	S	29.6	Very low	31.6	Very low	126 Å²	126	127.7 Å²	127.7	88%	0.881	80%	0.801	S	S	*	*			trans	-161.3	151.4	163.5	56.2	0	0	0	0	111.2
97	S	36.2	Very low	32.3	Very low	128 Å²	128	120.3 Å²	120.3	90%	0.895	79%	0.792	S	S	*	*			trans	-88.5	147.3	-173.5	45.8	0	0	0	0	114.3
98	G	30.6	Very low	33.2	Very low	63 Å²	63	123 Å²	123	65%	0.649	80%	0.799	S	S	*	*			trans	173.6	131.6	167.2	0	0	0	0	0	112
99	P	38.4	Very low	34.8	Very low	131 Å²	131	118.8 Å²	118.8	85%	0.851	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85.9	124.8	179.7	32.1	-31.8	0	0	0	111.8
100	P	31.8	Very low	36.4	Very low	124 Å²	124	113.7 Å²	113.7	81%	0.805	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-75	144.3	164.2	31.8	-32.4	0	0	0	110.3
101	A	28.1	Very low	38.4	Very low	94 Å²	94	111 Å²	111	78%	0.777	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-68.6	150.1	177.8	0	0	0	0	0	111.9	S103	A101-S103 PolarHBondContact O-N 3.04Å
102	A	32.4	Very low	40.6	Very low	102 Å²	102	106 Å²	106	84%	0.843	71%	0.706	S	S	*	*			trans	-74.5	90.2	176.2	0	0	0	0	0	111.3	S104	A102-S104 VanDerWaalsContact C-N 3.33Å; A102-S104 PolarHBondContact O-N 3.41Å; A102-S104 VanDerWaalsContact O-N 3.13Å
103	S	29.7	Very low	43.5	Very low	107 Å²	107	101.4 Å²	101.4	75%	0.748	69%	0.687	S	S	*	*			trans	-75.3	87.4	159.3	56.2	0	0	0	0	108.9	A101 E105	A101-S103 PolarHBondContact O-N 3.04Å; S103-E105 PolarHBondContact O-N 3.21Å
104	S	32	Very low	46.3	Very low	101 Å²	101	92.7 Å²	92.7	71%	0.706	65%	0.646	S	S	*	*			trans	-70.6	104.8	169.3	53.7	0	0	0	0	109.4	A102	A102-S104 VanDerWaalsContact C-N 3.33Å; A102-S104 PolarHBondContact O-N 3.41Å; A102-S104 VanDerWaalsContact O-N 3.13Å
105	E	32.7	Very low	49.2	Very low	167 Å²	167	94 Å²	94	78%	0.78	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-53.1	132.4	162.8	-68.6	-66.7	128.2	0	0	108.9	S103 G107	S103-E105 PolarHBondContact O-N 3.21Å; E105-G107 PolarHBondContact O-N 3.4Å
106	P	40.3	Very low	51.9	Low	114 Å²	114	93 Å²	93	74%	0.74	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-68.4	130.8	179	28.5	-33.4	0	0	0	110
107	G	40	Very low	54.8	Low	62 Å²	62	92.3 Å²	92.3	64%	0.639	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-65.1	154.7	177.5	0	0	0	0	0	113	E105 S109	E105-G107 PolarHBondContact O-N 3.4Å; G107-S109 VanDerWaalsContact C-N 3.27Å; G107-S109 PolarHBondContact O-N 2.97Å
108	D	46.5	Very low	57.5	Low	152 Å²	152	88.4 Å²	88.4	81%	0.813	57%	0.568	S	S	*	*			trans	-63.8	75.3	-178.6	-83.1	-46.3	0	0	0	113
109	S	60.5	Low	60.5	Low	55 Å²	55	86.5 Å²	86.5	39%	0.385	54%	0.542	S	S	.	.			trans	-75.9	154.5	174.9	-165	0	0	0	0	111.7	G107 T111 N171	G107-S109 VanDerWaalsContact C-N 3.27Å; G107-S109 PolarHBondContact O-N 2.97Å; S109-T111 PolarHBondContact O-N 2.78Å; S109-N171 PolarHBondContact O-ND2 3.14Å
110	L	64.4	Low	63.2	Low	22 Å²	22	85.7 Å²	85.7	12%	0.115	53%	0.527	C	S	.	.			trans	-71.4	115.5	177.1	-87.9	173	0	0	0	110.9	C112 L113 I167 V170 V187 L189	L110-C112 PolarHBondContact O-N 3.11Å; L110-L113 HydrophobicContact CB-CB 4.19Å; L110-L113 HydrophobicContact CD1-CD1 4.16Å; L110-I167 HydrophobicContact CD1-CD1 4.47Å; L110-I167 HydrophobicContact CD1-CG1 4.06Å; L110-I167 HydrophobicContact CD2-CB 4.3Å; L110-I167 HydrophobicContact CD2-CG1 4.19Å; L110-I167 HydrophobicContact CD2-CG2 3.91Å; L110-I167 HydrophobicContact CG-CB 4.47Å; L110-I167 HydrophobicContact CG-CG1 4.01Å; L110-I167 HydrophobicContact CG-CG2 3.95Å; L110-V170 HydrophobicContact CD2-CB 4.28Å; L110-V170 HydrophobicContact CD2-CG1 3.81Å; L110-V187 HydrophobicContact CD1-CG2 4Å; L110-V187 HydrophobicContact CD2-CG2 4.3Å; L110-L189 HydrophobicContact CD1-CD1 3.72Å; L110-L189 HydrophobicContact CD1-CD2 4.15Å; L110-L189 HydrophobicContact CD1-CG 4.1Å
111	T	71.2	Confident	66.2	Low	99 Å²	99	82.2 Å²	82.2	61%	0.607	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-10.9	179.5	58	0	0	0	0	114.1	S109 N171 H174	S109-T111 PolarHBondContact O-N 2.78Å; T111-N171 PolarHBondContact N-OD1 2.98Å; T111-N171 PolarHBondContact OG1-OD1 2.86Å; T111-H174 PolarHBondContact OG1-ND1 2.91Å
112	C	83.6	Confident	69.4	Low	10 Å²	10	80.1 Å²	80.1	7%	0.068	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.7	38.1	-169.5	57.7	0	0	0	0	113.4	L110 I114 G186 V187	L110-C112 PolarHBondContact O-N 3.11Å; C112-I114 PolarHBondContact O-N 3.09Å; C112-G186 CarbonylContact O-C 3.59Å; C112-G186 WeakPolarHBondContact O-CA 3.23Å; C112-V187 PolarHBondContact O-N 3.11Å
113	L	89.8	Confident	72.3	Confident	94 Å²	94	79.5 Å²	79.5	49%	0.492	45%	0.454	S	S	.	.	B	Isolated β-bridge	trans	-77.5	121.3	176.2	-166	155.3	0	0	0	110.8	L110 L189	L110-L113 HydrophobicContact CB-CB 4.19Å; L110-L113 HydrophobicContact CD1-CD1 4.16Å; L113-L189 HydrophobicContact CD1-CD1 3.93Å; L113-L189 HydrophobicContact CD1-CG 4.24Å
114	I	91.3	Very high	75.4	Confident	6 Å²	6	81.5 Å²	81.5	3%	0.031	45%	0.446	C	S	.	.			trans	-104.5	138.7	178.8	-65.1	169.9	0	0	0	109.2	C112 E118 W138 V187 V188 V196	C112-I114 PolarHBondContact O-N 3.09Å; I114-E118 HydrophobicContact CG2-CB 4.43Å; I114-W138 HydrophobicContact CD1-CD2 4.16Å; I114-W138 HydrophobicContact CD1-CZ2 3.94Å; I114-W138 HydrophobicContact CG1-CZ2 4Å; I114-V187 PolarHBondContact N-O 2.77Å; I114-V188 HydrophobicContact CB-CG2 4Å; I114-V188 HydrophobicContact CG2-CG2 4Å; I114-V196 HydrophobicContact CD1-CB 3.88Å; I114-V196 HydrophobicContact CD1-CG1 4.12Å; I114-V196 HydrophobicContact CD1-CG2 4.01Å
115	K	91.1	Very high	78.1	Confident	113 Å²	113	80.9 Å²	80.9	49%	0.491	43%	0.434	S	S	.	.			trans	-82.1	144.4	174.3	-52.2	-176	-162.4	67.8	0	110.4	S117 E118	K115-S117 PolarHBondContact O-N 3.17Å; K115-E118 HydrophobicContact CB-CG 4.01Å; K115-E118 WeakPolarHBondContact CB-OE2 3.33Å; K115-E118 WeakPolarHBondContact CD-OE1 3.39Å; K115-E118 PolarHBondContact N-OE2 3.46Å; K115-E118 IonicContact NZ-OE1 3.42Å; K115-E118 PolarHBondContact NZ-OE1 3.48Å; K115-E118 WeakPolarHBondContact O-CB 3.3Å; K115-E118 PolarHBondContact O-N 3.1Å
116	E	90.2	Very high	80.5	Confident	83 Å²	83	74.2 Å²	74.2	39%	0.388	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-62.6	-28.9	177	-173.4	150.5	-148.1	0	0	112.8	E118 M119 V188 T190 K194	E116-E118 PolarHBondContact O-N 3.13Å; E116-M119 PolarHBondContact O-N 3.06Å; E116-V188 HydrophobicContact CB-CG1 4.08Å; E116-T190 VanDerWaalsContact OE2-CB 3.3Å; E116-T190 WeakPolarHBondContact OE2-CB 3.45Å; E116-T190 PolarHBondContact OE2-OG1 3.25Å; E116-K194 WeakPolarHBondContact OE1-CE 3.28Å; E116-K194 IonicContact OE1-NZ 3.38Å; E116-K194 PolarHBondContact OE1-NZ 3.47Å; E116-K194 IonicContact OE2-NZ 3.72Å; E116-K194 PolarHBondContact OE2-NZ 3.21Å
117	S	91.1	Very high	82.3	Confident	111 Å²	111	72.9 Å²	72.9	78%	0.776	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-70.6	-10.9	173.2	60.9	0	0	0	0	114.9	K115	K115-S117 PolarHBondContact O-N 3.17Å
118	E	92.3	Very high	83.6	Confident	46 Å²	46	71.6 Å²	71.6	22%	0.215	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-92.4	1	177.8	-66.5	160.5	174.6	0	0	111.8	I114 K115 E116 W138 T139	I114-E118 HydrophobicContact CG2-CB 4.43Å; K115-E118 HydrophobicContact CB-CG 4.01Å; K115-E118 WeakPolarHBondContact CB-OE2 3.33Å; K115-E118 WeakPolarHBondContact CD-OE1 3.39Å; K115-E118 PolarHBondContact N-OE2 3.46Å; K115-E118 IonicContact NZ-OE1 3.42Å; K115-E118 PolarHBondContact NZ-OE1 3.48Å; K115-E118 WeakPolarHBondContact O-CB 3.3Å; K115-E118 PolarHBondContact O-N 3.1Å; E116-E118 PolarHBondContact O-N 3.13Å; E118-W138 WeakPolarHBondContact O-CA 3.37Å; E118-T139 PolarHBondContact O-N 2.94Å
119	M	93.3	Very high	84.4	Confident	23 Å²	23	68.3 Å²	68.3	11%	0.113	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	133.4	-169.9	-174.4	176.9	64.8	0	0	113.1	E116 L121 E137 V150 V188 K194 V196	E116-M119 PolarHBondContact O-N 3.06Å; M119-L121 HydrophobicContact CE-CD2 4.06Å; M119-L121 HydrophobicContact CG-CD2 4.41Å; M119-L121 HydrophobicContact SD-CD2 4.24Å; M119-E137 CarbonylContact C-O 3.59Å; M119-E137 VanDerWaalsContact CA-O 3.32Å; M119-E137 WeakPolarHBondContact CA-O 3.37Å; M119-V150 HydrophobicContact CE-CG1 3.98Å; M119-V150 HydrophobicContact SD-CB 4.39Å; M119-V150 HydrophobicContact SD-CG1 3.9Å; M119-V150 HydrophobicContact SD-CG2 3.57Å; M119-V150 VanDerWaalsContact SD-CG2 3.57Å; M119-V188 HydrophobicContact CE-CG2 3.95Å; M119-K194 HydrophobicContact CE-CD 3.58Å; M119-V196 HydrophobicContact SD-CG2 3.68Å
120	Q	94.8	Very high	84.7	Confident	115 Å²	115	68 Å²	68	54%	0.537	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.5	172.3	-172.8	168.6	-8.5	0	0	110.2	F122 G136 E137	Q120-F122 HydrophobicContact CB-CE2 4.1Å; Q120-F122 HydrophobicContact CB-CZ 4.16Å; Q120-F122 VanDerWaalsContact CD-CZ 3.49Å; Q120-F122 HydrophobicContact CG-CE1 4.12Å; Q120-F122 HydrophobicContact CG-CE2 3.94Å; Q120-F122 HydrophobicContact CG-CZ 3.65Å; Q120-G136 CarbonylContact O-C 3.56Å; Q120-G136 WeakPolarHBondContact O-CA 3.42Å; Q120-E137 PolarHBondContact N-O 3.02Å; Q120-E137 PolarHBondContact O-N 3.4Å
121	L	94.9	Very high	85.3	Confident	50 Å²	50	67 Å²	67	26%	0.262	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	128.1	-179.4	-62.7	179.8	0	0	0	111.6	M119 V150	M119-L121 HydrophobicContact CE-CD2 4.06Å; M119-L121 HydrophobicContact CG-CD2 4.41Å; M119-L121 HydrophobicContact SD-CD2 4.24Å; L121-V150 HydrophobicContact CD2-CB 3.75Å; L121-V150 HydrophobicContact CD2-CG1 3.85Å; L121-V150 HydrophobicContact CD2-CG2 3.72Å
122	F	95	Very high	86.1	Confident	50 Å²	50	64.3 Å²	64.3	22%	0.219	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-140.4	-178.3	-55.2	-88.3	0	0	0	110.7	Q120 R134 R135 E137	Q120-F122 HydrophobicContact CB-CE2 4.1Å; Q120-F122 HydrophobicContact CB-CZ 4.16Å; Q120-F122 VanDerWaalsContact CD-CZ 3.49Å; Q120-F122 HydrophobicContact CG-CE1 4.12Å; Q120-F122 HydrophobicContact CG-CE2 3.94Å; Q120-F122 HydrophobicContact CG-CZ 3.65Å; F122-R134 VanDerWaalsContact O-CZ 3.25Å; F122-R134 PolarHBondContact O-NE 3.37Å; F122-R134 PolarHBondContact O-NH2 2.74Å; F122-R135 HydrophobicContact CB-CB 4.39Å; F122-R135 PolarHBondContact N-O 2.89Å; F122-E137 HydrophobicContact CE2-CB 3.8Å; F122-E137 HydrophobicContact CE2-CG 3.69Å; F122-E137 HydrophobicContact CZ-CB 4.44Å; F122-E137 HydrophobicContact CZ-CG 4.31Å
123	E	94.2	Very high	86.5	Confident	89 Å²	89	65.6 Å²	65.6	42%	0.416	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	161.3	-174.2	72.9	-78.8	-174.5	0	0	114.2	L125 R134 R135	E123-L125 HydrophobicContact CG-CD2 4.49Å; E123-R134 CarbonylContact O-C 3.56Å; E123-R134 WeakPolarHBondContact O-CA 3.34Å; E123-R134 WeakPolarHBondContact O-CB 3Å; E123-R135 VanDerWaalsContact CD-NH1 3.25Å; E123-R135 PolarHBondContact O-N 2.83Å; E123-R135 WeakPolarHBondContact OE1-CD 3.39Å; E123-R135 IonicContact OE1-CZ 3.23Å; E123-R135 IonicContact OE1-NE 3.21Å; E123-R135 IonicContact OE1-NH1 3.63Å; E123-R135 PolarHBondContact OE1-NH1 2.92Å; E123-R135 IonicContact OE2-CZ 3.17Å; E123-R135 IonicContact OE2-NE 2.78Å; E123-R135 IonicContact OE2-NH1 3.57Å; E123-R135 PolarHBondContact OE2-NH1 2.95Å
124	R	93.7	Very high	86.7	Confident	150 Å²	150	65.6 Å²	65.6	57%	0.566	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	119.5	175.5	171.1	172.2	155	137.8	-5.4	109.4	D127 V132	R124-D127 IonicContact CZ-OD2 2.77Å; R124-D127 IonicContact NH1-OD2 2.78Å; R124-D127 PolarHBondContact NH1-OD2 3.12Å; R124-D127 IonicContact NH2-OD2 3.23Å; R124-D127 PolarHBondContact NH2-OD2 2.77Å; R124-V132 HydrophobicContact CG-CG1 3.87Å
125	L	89.6	Confident	86.9	Confident	87 Å²	87	68.5 Å²	68.5	46%	0.455	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-30.5	178.3	-63	174.3	0	0	0	112.1	E123 V133 R135 L199	E123-L125 HydrophobicContact CG-CD2 4.49Å; L125-V133 HydrophobicContact CB-CG1 4.34Å; L125-V133 HydrophobicContact CD1-CG1 4.49Å; L125-V133 PolarHBondContact N-O 3.37Å; L125-R135 HydrophobicContact CD1-CB 4.03Å; L125-R135 HydrophobicContact CD2-CB 4.28Å; L125-R135 HydrophobicContact CG-CB 4.17Å; L125-L199 HydrophobicContact CD1-CD1 3.6Å
126	G	83	Confident	87.2	Confident	28 Å²	28	63.1 Å²	63.1	29%	0.289	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.6	176.3	-178.3	0	0	0	0	0	113.3	V133	G126-V133 PolarHBondContact N-O 3.47Å; G126-V133 VanDerWaalsContact N-O 3.15Å; G126-V133 PolarHBondContact O-N 3.48Å
127	D	78.3	Confident	87.5	Confident	86 Å²	86	62 Å²	62	46%	0.46	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	142.9	176.7	-166.5	-8.9	0	0	0	108.7	R124	R124-D127 IonicContact CZ-OD2 2.77Å; R124-D127 IonicContact NH1-OD2 2.78Å; R124-D127 PolarHBondContact NH1-OD2 3.12Å; R124-D127 IonicContact NH2-OD2 3.23Å; R124-D127 PolarHBondContact NH2-OD2 2.77Å
128	G	67.1	Low	87.8	Confident	35 Å²	35	58 Å²	58	36%	0.361	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	179.3	-172.4	0	0	0	0	0	113.2	F130 G131 K154	G128-F130 PolarHBondContact O-N 3.4Å; G128-F130 VanDerWaalsContact O-N 3.15Å; G128-G131 PolarHBondContact N-O 2.82Å; G128-G131 PolarHBondContact O-N 2.88Å; G128-K154 PolarHBondContact O-NZ 2.88Å
129	T	63.7	Low	87.9	Confident	82 Å²	82	58.9 Å²	58.9	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-44.1	174.1	40.9	0	0	0	0	111.8	K154 K283	T129-K154 PolarHBondContact O-NZ 2.95Å; T129-K283 HydrophobicContact CG2-CD 4.41Å
130	F	66.1	Low	87.8	Confident	49 Å²	49	58.1 Å²	58.1	22%	0.215	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.4	-173.7	-54.6	-62.8	0	0	0	115.8	G128 K151 L265	G128-F130 PolarHBondContact O-N 3.4Å; G128-F130 VanDerWaalsContact O-N 3.15Å; F130-K151 VanDerWaalsContact CB-CE 3.5Å; F130-K151 VanDerWaalsContact CB-NZ 3.31Å; F130-L265 HydrophobicContact CE1-CD2 3.78Å; F130-L265 HydrophobicContact CE1-CG 4.04Å; F130-L265 HydrophobicContact CE2-CD1 4.41Å; F130-L265 HydrophobicContact CE2-CG 4.06Å; F130-L265 HydrophobicContact CZ-CD1 3.77Å; F130-L265 HydrophobicContact CZ-CD2 3.63Å; F130-L265 HydrophobicContact CZ-CG 3.4Å
131	G	78.2	Confident	87.4	Confident	2 Å²	2	58.6 Å²	58.6	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.1	-178.5	-174.9	0	0	0	0	0	114.5	G128 C152	G128-G131 PolarHBondContact N-O 2.82Å; G128-G131 PolarHBondContact O-N 2.88Å; G131-C152 VanDerWaalsContact CA-O 3.31Å; G131-C152 WeakPolarHBondContact CA-O 3.19Å
132	V	87.7	Confident	87.1	Confident	41 Å²	41	62.4 Å²	62.4	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.6	178.3	-176.8	0	0	0	0	109.4	R124 R134 C152	R124-V132 HydrophobicContact CG-CG1 3.87Å; V132-R134 HydrophobicContact CG1-CG 4.29Å; V132-C152 PolarHBondContact N-O 2.92Å; V132-C152 PolarHBondContact O-N 2.88Å
133	V	91.4	Very high	86.8	Confident	38 Å²	38	62.8 Å²	62.8	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.6	173.1	-174.5	0	0	0	0	109.2	L125 G126 A149 V150 K151	L125-V133 HydrophobicContact CB-CG1 4.34Å; L125-V133 HydrophobicContact CD1-CG1 4.49Å; L125-V133 PolarHBondContact N-O 3.37Å; G126-V133 PolarHBondContact N-O 3.47Å; G126-V133 VanDerWaalsContact N-O 3.15Å; G126-V133 PolarHBondContact O-N 3.48Å; V133-A149 HydrophobicContact CG1-CB 4.32Å; V133-V150 CarbonylContact C-O 3.55Å; V133-V150 WeakPolarHBondContact CA-O 3.25Å; V133-K151 HydrophobicContact CG2-CB 4.34Å; V133-K151 HydrophobicContact CG2-CG 4.14Å
134	R	94.1	Very high	86.8	Confident	93 Å²	93	66.4 Å²	66.4	35%	0.351	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	155.7	177.1	-61.8	-179.1	70.8	166	-1.7	110.7	F122 E123 V132 V150	F122-R134 VanDerWaalsContact O-CZ 3.25Å; F122-R134 PolarHBondContact O-NE 3.37Å; F122-R134 PolarHBondContact O-NH2 2.74Å; E123-R134 CarbonylContact O-C 3.56Å; E123-R134 WeakPolarHBondContact O-CA 3.34Å; E123-R134 WeakPolarHBondContact O-CB 3Å; V132-R134 HydrophobicContact CG1-CG 4.29Å; R134-V150 PolarHBondContact N-O 3.31Å; R134-V150 PolarHBondContact O-N 3.39Å
135	R	96.2	Very high	86.8	Confident	67 Å²	67	63 Å²	63	25%	0.253	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	142.4	161.1	-158.4	-174.6	87.7	-143.6	14	107.7	F122 E123 L125 E137 L199	F122-R135 HydrophobicContact CB-CB 4.39Å; F122-R135 PolarHBondContact N-O 2.89Å; E123-R135 VanDerWaalsContact CD-NH1 3.25Å; E123-R135 PolarHBondContact O-N 2.83Å; E123-R135 WeakPolarHBondContact OE1-CD 3.39Å; E123-R135 IonicContact OE1-CZ 3.23Å; E123-R135 IonicContact OE1-NE 3.21Å; E123-R135 IonicContact OE1-NH1 3.63Å; E123-R135 PolarHBondContact OE1-NH1 2.92Å; E123-R135 IonicContact OE2-CZ 3.17Å; E123-R135 IonicContact OE2-NE 2.78Å; E123-R135 IonicContact OE2-NH1 3.57Å; E123-R135 PolarHBondContact OE2-NH1 2.95Å; L125-R135 HydrophobicContact CD1-CB 4.03Å; L125-R135 HydrophobicContact CD2-CB 4.28Å; L125-R135 HydrophobicContact CG-CB 4.17Å; R135-E137 IonicContact NH2-OE1 3.14Å; R135-L199 HydrophobicContact CG-CD2 3.84Å
136	G	96.3	Very high	87.1	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	171	171.1	0	0	0	0	0	111.5	Q120 S147 V148	Q120-G136 CarbonylContact O-C 3.56Å; Q120-G136 WeakPolarHBondContact O-CA 3.42Å; G136-S147 PolarHBondContact O-OG 3.06Å; G136-V148 VanDerWaalsContact C-CG2 3.43Å; G136-V148 PolarHBondContact N-O 3.49Å; G136-V148 WeakPolarHBondContact O-CG2 3.45Å; G136-V148 PolarHBondContact O-N 3.29Å
137	E	97.1	Very high	87.8	Confident	60 Å²	60	61.9 Å²	61.9	28%	0.28	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	135.3	161.3	-76.3	161.2	-147.2	0	0	108	M119 Q120 F122 R135 V145 L146	M119-E137 CarbonylContact C-O 3.59Å; M119-E137 VanDerWaalsContact CA-O 3.32Å; M119-E137 WeakPolarHBondContact CA-O 3.37Å; Q120-E137 PolarHBondContact N-O 3.02Å; Q120-E137 PolarHBondContact O-N 3.4Å; F122-E137 HydrophobicContact CE2-CB 3.8Å; F122-E137 HydrophobicContact CE2-CG 3.69Å; F122-E137 HydrophobicContact CZ-CB 4.44Å; F122-E137 HydrophobicContact CZ-CG 4.31Å; R135-E137 IonicContact NH2-OE1 3.14Å; E137-V145 HydrophobicContact CB-CG1 3.84Å; E137-V145 HydrophobicContact CG-CG1 4.17Å; E137-L146 CarbonylContact C-O 3.52Å; E137-L146 VanDerWaalsContact CA-O 3.3Å; E137-L146 WeakPolarHBondContact CA-O 3.13Å
138	W	96.5	Very high	88.6	Confident	26 Å²	26	57.8 Å²	57.8	10%	0.098	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.7	179.9	169	51.5	0	0	0	109.3	I114 E118 A140 V145 L146 V148 Y185	I114-W138 HydrophobicContact CD1-CD2 4.16Å; I114-W138 HydrophobicContact CD1-CZ2 3.94Å; I114-W138 HydrophobicContact CG1-CZ2 4Å; E118-W138 WeakPolarHBondContact O-CA 3.37Å; W138-A140 HydrophobicContact CD2-CB 4.41Å; W138-A140 HydrophobicContact CE3-CB 4.24Å; W138-A140 HydrophobicContact CH2-CB 3.9Å; W138-A140 HydrophobicContact CZ2-CB 4.06Å; W138-A140 HydrophobicContact CZ3-CB 3.98Å; W138-A140 PolarHBondContact O-N 3.13Å; W138-V145 CarbonylContact O-C 3.6Å; W138-V145 WeakPolarHBondContact O-CA 3.42Å; W138-L146 HydrophobicContact CE3-CD1 3.91Å; W138-L146 HydrophobicContact CZ3-CD1 3.87Å; W138-L146 PolarHBondContact N-O 2.95Å; W138-L146 PolarHBondContact O-N 3.31Å; W138-V148 HydrophobicContact CB-CG1 3.95Å; W138-V148 HydrophobicContact CB-CG2 4.13Å; W138-Y185 HydrophobicContact CE3-CD2 4.26Å; W138-Y185 HydrophobicContact CE3-CG 4.3Å; W138-Y185 HydrophobicContact CZ3-CD1 4.43Å; W138-Y185 HydrophobicContact CZ3-CD2 4.31Å; W138-Y185 AromaticContact CZ3-CG 3.92Å; W138-Y185 HydrophobicContact CZ3-CG 3.92Å
139	T	95.3	Very high	90	Very high	65 Å²	65	56.7 Å²	56.7	40%	0.399	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	101.6	172	-55.6	0	0	0	0	108.2	E118	E118-T139 PolarHBondContact O-N 2.94Å
140	A	89.8	Confident	91.4	Very high	8 Å²	8	52.8 Å²	52.8	7%	0.066	29%	0.288	C	S	.	.			trans	-67.1	158.7	179.4	0	0	0	0	0	111.6	W138 N142 G143 R144 L146	W138-A140 HydrophobicContact CD2-CB 4.41Å; W138-A140 HydrophobicContact CE3-CB 4.24Å; W138-A140 HydrophobicContact CH2-CB 3.9Å; W138-A140 HydrophobicContact CZ2-CB 4.06Å; W138-A140 HydrophobicContact CZ3-CB 3.98Å; W138-A140 PolarHBondContact O-N 3.13Å; A140-N142 WeakPolarHBondContact CB-OD1 3.05Å; A140-N142 PolarHBondContact O-N 3.42Å; A140-G143 PolarHBondContact O-N 3.1Å; A140-R144 PolarHBondContact N-O 2.86Å; A140-L146 HydrophobicContact CB-CD1 4.23Å
141	P	86.8	Confident	92.6	Very high	124 Å²	124	51.4 Å²	51.4	81%	0.805	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-12.3	-176.2	-27.7	36	0	0	0	116.4	G143	P141-G143 VanDerWaalsContact C-N 3.34Å
142	N	88.9	Confident	93	Very high	130 Å²	130	52.5 Å²	52.5	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	9.9	172.9	62.6	5.2	0	0	0	113.5	A140 R144	A140-N142 WeakPolarHBondContact CB-OD1 3.05Å; A140-N142 PolarHBondContact O-N 3.42Å; N142-R144 VanDerWaalsContact C-N 3.28Å; N142-R144 PolarHBondContact O-N 2.91Å; N142-R144 VanDerWaalsContact OD1-CB 3.27Å; N142-R144 WeakPolarHBondContact OD1-CB 3.42Å; N142-R144 PolarHBondContact OD1-N 2.9Å; N142-R144 VanDerWaalsContact OD1-N 3.11Å
143	G	88.9	Confident	92.7	Very high	58 Å²	58	51.9 Å²	51.9	60%	0.598	28%	0.284	S	S	*	.	S	Bend	trans	78.7	0.5	-178.2	0	0	0	0	0	115	A140 P141	A140-G143 PolarHBondContact O-N 3.1Å; P141-G143 VanDerWaalsContact C-N 3.34Å
144	R	94.1	Very high	91.8	Very high	165 Å²	165	54.9 Å²	54.9	62%	0.623	29%	0.294	S	S	*	.			trans	-81.4	124	179	-176.2	176.2	177.3	-174	-1	110.8	A140 N142 L146	A140-R144 PolarHBondContact N-O 2.86Å; N142-R144 VanDerWaalsContact C-N 3.28Å; N142-R144 PolarHBondContact O-N 2.91Å; N142-R144 VanDerWaalsContact OD1-CB 3.27Å; N142-R144 WeakPolarHBondContact OD1-CB 3.42Å; N142-R144 PolarHBondContact OD1-N 2.9Å; N142-R144 VanDerWaalsContact OD1-N 3.11Å; R144-L146 HydrophobicContact CG-CD2 4.04Å; R144-L146 HydrophobicContact CG-CG 4.4Å
145	V	94.6	Very high	90.5	Very high	80 Å²	80	54.4 Å²	54.4	49%	0.485	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	131	166.2	-173.9	0	0	0	0	109.6	E137 W138	E137-V145 HydrophobicContact CB-CG1 3.84Å; E137-V145 HydrophobicContact CG-CG1 4.17Å; W138-V145 CarbonylContact O-C 3.6Å; W138-V145 WeakPolarHBondContact O-CA 3.42Å
146	L	95.4	Very high	88.7	Confident	34 Å²	34	54.9 Å²	54.9	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.5	177.6	-65.4	176.4	0	0	0	109.5	E137 W138 A140 R144 V148	E137-L146 CarbonylContact C-O 3.52Å; E137-L146 VanDerWaalsContact CA-O 3.3Å; E137-L146 WeakPolarHBondContact CA-O 3.13Å; W138-L146 HydrophobicContact CE3-CD1 3.91Å; W138-L146 HydrophobicContact CZ3-CD1 3.87Å; W138-L146 PolarHBondContact N-O 2.95Å; W138-L146 PolarHBondContact O-N 3.31Å; A140-L146 HydrophobicContact CB-CD1 4.23Å; R144-L146 HydrophobicContact CG-CD2 4.04Å; R144-L146 HydrophobicContact CG-CG 4.4Å; L146-V148 HydrophobicContact CB-CG1 4.43Å
147	S	96.7	Very high	86.6	Confident	56 Å²	56	59.4 Å²	59.4	39%	0.392	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.7	169.8	-159.8	0	0	0	0	109.9	G136 L199	G136-S147 PolarHBondContact O-OG 3.06Å; S147-L199 WeakPolarHBondContact OG-CD2 3.44Å
148	V	96.6	Very high	84.7	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	154.3	-168	-66.8	0	0	0	0	111.3	G136 W138 L146 V150 Y185 V196 T197	G136-V148 VanDerWaalsContact C-CG2 3.43Å; G136-V148 PolarHBondContact N-O 3.49Å; G136-V148 WeakPolarHBondContact O-CG2 3.45Å; G136-V148 PolarHBondContact O-N 3.29Å; W138-V148 HydrophobicContact CB-CG1 3.95Å; W138-V148 HydrophobicContact CB-CG2 4.13Å; L146-V148 HydrophobicContact CB-CG1 4.43Å; V148-V150 HydrophobicContact CG2-CG2 3.72Å; V148-Y185 HydrophobicContact CG1-CD2 3.69Å; V148-Y185 HydrophobicContact CG1-CE2 3.85Å; V148-V196 HydrophobicContact CB-CG1 3.85Å; V148-V196 HydrophobicContact CG1-CG1 3.87Å; V148-V196 HydrophobicContact CG2-CG1 3.97Å; V148-T197 WeakPolarHBondContact CA-O 3.32Å; V148-T197 WeakPolarHBondContact CB-O 3.47Å
149	A	95.4	Very high	82.8	Confident	13 Å²	13	64.3 Å²	64.3	11%	0.107	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	130	161.8	0	0	0	0	0	108.4	V133 T197 L199	V133-A149 HydrophobicContact CG1-CB 4.32Å; A149-T197 PolarHBondContact N-O 3.26Å; A149-T197 PolarHBondContact O-N 3.43Å; A149-L199 HydrophobicContact CB-CD1 4.09Å
150	V	93.5	Very high	80.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115	-177.6	-170.8	0	0	0	0	109.5	M119 L121 V133 R134 V148 K194 M195 V196	M119-V150 HydrophobicContact CE-CG1 3.98Å; M119-V150 HydrophobicContact SD-CB 4.39Å; M119-V150 HydrophobicContact SD-CG1 3.9Å; M119-V150 HydrophobicContact SD-CG2 3.57Å; M119-V150 VanDerWaalsContact SD-CG2 3.57Å; L121-V150 HydrophobicContact CD2-CB 3.75Å; L121-V150 HydrophobicContact CD2-CG1 3.85Å; L121-V150 HydrophobicContact CD2-CG2 3.72Å; V133-V150 CarbonylContact C-O 3.55Å; V133-V150 WeakPolarHBondContact CA-O 3.25Å; R134-V150 PolarHBondContact N-O 3.31Å; R134-V150 PolarHBondContact O-N 3.39Å; V148-V150 HydrophobicContact CG2-CG2 3.72Å; V150-K194 HydrophobicContact CG1-CB 3.86Å; V150-K194 HydrophobicContact CG1-CD 4.49Å; V150-M195 WeakPolarHBondContact CA-O 3.47Å; V150-V196 HydrophobicContact CG1-CG2 4.42Å
151	K	90.7	Very high	79.1	Confident	19 Å²	19	71.8 Å²	71.8	8%	0.083	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	104.5	178.2	-171.8	179.6	-165.1	-176.3	0	109.5	F130 V133 L153 K194 M195 D262	F130-K151 VanDerWaalsContact CB-CE 3.5Å; F130-K151 VanDerWaalsContact CB-NZ 3.31Å; V133-K151 HydrophobicContact CG2-CB 4.34Å; V133-K151 HydrophobicContact CG2-CG 4.14Å; K151-L153 HydrophobicContact CD-CD2 4.49Å; K151-L153 HydrophobicContact CG-CD2 4.42Å; K151-L153 PolarHBondContact O-N 2.87Å; K151-K194 WeakPolarHBondContact O-CA 3.38Å; K151-M195 HydrophobicContact CB-CB 4.38Å; K151-M195 PolarHBondContact N-O 2.75Å; K151-M195 PolarHBondContact O-N 2.85Å; K151-D262 IonicContact NZ-OD1 2.71Å; K151-D262 PolarHBondContact NZ-OD1 2.79Å; K151-D262 IonicContact NZ-OD2 3.68Å; K151-D262 PolarHBondContact NZ-OD2 2.95Å
152	C	88.1	Confident	78.1	Confident	25 Å²	25	67.1 Å²	67.1	17%	0.169	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114.1	175.3	-63.1	0	0	0	0	109.5	G131 V132	G131-C152 VanDerWaalsContact CA-O 3.31Å; G131-C152 WeakPolarHBondContact CA-O 3.19Å; V132-C152 PolarHBondContact N-O 2.92Å; V132-C152 PolarHBondContact O-N 2.88Å
153	L	80.6	Confident	77.2	Confident	29 Å²	29	63.8 Å²	63.8	15%	0.152	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	149	179.8	-55.9	179.4	0	0	0	110.3	K151 F166 M193	K151-L153 HydrophobicContact CD-CD2 4.49Å; K151-L153 HydrophobicContact CG-CD2 4.42Å; K151-L153 PolarHBondContact O-N 2.87Å; L153-F166 HydrophobicContact CD1-CE2 4.1Å; L153-F166 HydrophobicContact CD1-CZ 4.06Å; L153-M193 HydrophobicContact CB-CB 4.41Å; L153-M193 WeakPolarHBondContact CB-O 3.34Å; L153-M193 HydrophobicContact CD1-CB 4.18Å; L153-M193 PolarHBondContact N-O 3.28Å
154	K	72.1	Confident	76.3	Confident	100 Å²	100	66.5 Å²	66.5	44%	0.435	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-71.9	142.5	177.6	-72.3	165.7	-178.4	161.6	0	110.2	G128 T129 V157	G128-K154 PolarHBondContact O-NZ 2.88Å; T129-K154 PolarHBondContact O-NZ 2.95Å; K154-V157 VanDerWaalsContact O-CG2 3.23Å; K154-V157 WeakPolarHBondContact O-CG2 3.39Å
155	A	66.1	Low	75.1	Confident	83 Å²	83	60.3 Å²	60.3	69%	0.686	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	150.7	177.6	0	0	0	0	0	111.4
156	G	58.7	Low	74.2	Confident	77 Å²	77	57.6 Å²	57.6	79%	0.794	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	17.3	179.1	0	0	0	0	0	115.7
157	V	53.7	Low	73.4	Confident	96 Å²	96	57.3 Å²	57.3	58%	0.582	35%	0.353	S	S	*	.	S	Bend	trans	-83.3	-20.9	178.4	170.2	0	0	0	0	113.3	K154	K154-V157 VanDerWaalsContact O-CG2 3.23Å; K154-V157 WeakPolarHBondContact O-CG2 3.39Å
158	L	55.8	Low	72.4	Confident	48 Å²	48	61.6 Å²	61.6	25%	0.251	36%	0.36	S	S	.	.			trans	-128.3	108.6	-178.6	-56.9	176.4	0	0	0	110.6	L163 F166 M193	L158-L163 HydrophobicContact CD1-CD1 3.83Å; L158-F166 HydrophobicContact CD1-CB 3.9Å; L158-F166 HydrophobicContact CD1-CD1 3.68Å; L158-F166 HydrophobicContact CD1-CD2 4.39Å; L158-F166 HydrophobicContact CD1-CE1 4.28Å; L158-F166 HydrophobicContact CD1-CG 3.74Å; L158-F166 HydrophobicContact CD2-CB 3.81Å; L158-F166 HydrophobicContact CD2-CG 4.28Å; L158-M193 HydrophobicContact CD1-CE 3.7Å; L158-M193 HydrophobicContact CD1-SD 3.8Å; L158-M193 HydrophobicContact CG-CE 4.04Å
159	D	57.6	Low	71.5	Confident	141 Å²	141	63.8 Å²	63.8	75%	0.754	37%	0.371	S	S	*	.			trans	-68.9	168.7	151.7	-69.2	-38.6	0	0	0	109.4	D161 G162 L163	D159-D161 PolarHBondContact O-N 3.4Å; D159-D161 VanDerWaalsContact O-N 3.14Å; D159-G162 PolarHBondContact O-N 3.23Å; D159-L163 PolarHBondContact O-N 3.33Å
160	S	53.4	Low	70.8	Confident	92 Å²	92	63.2 Å²	63.2	64%	0.643	37%	0.366	S	S	*	.	H	α-helix	trans	-47.4	-46.2	-179.9	47.7	0	0	0	0	113.2	G162 L163	S160-G162 PolarHBondContact O-N 2.83Å; S160-L163 PolarHBondContact O-N 2.96Å
161	D	54.4	Low	70.3	Confident	138 Å²	138	64.6 Å²	64.6	74%	0.738	37%	0.373	S	S	*	.	H	α-helix	trans	-75	-15.1	-173.3	-57.2	16.3	0	0	0	112.3	D159	D159-D161 PolarHBondContact O-N 3.4Å; D159-D161 VanDerWaalsContact O-N 3.14Å
162	G	64.2	Low	69.9	Low	25 Å²	25	65 Å²	65	26%	0.258	38%	0.38	S	S	.	.	H	α-helix	trans	-87.4	-23.2	175.2	0	0	0	0	0	113.5	D159 S160 D164 D165 F166	D159-G162 PolarHBondContact O-N 3.23Å; S160-G162 PolarHBondContact O-N 2.83Å; G162-D164 PolarHBondContact O-N 3.48Å; G162-D165 PolarHBondContact O-N 3.33Å; G162-F166 PolarHBondContact O-N 3.29Å
163	L	70.5	Confident	69.6	Low	61 Å²	61	64.3 Å²	64.3	32%	0.319	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-40.3	-174.8	-177.2	59.6	0	0	0	112.3	L158 D159 S160 F166 I167	L158-L163 HydrophobicContact CD1-CD1 3.83Å; D159-L163 PolarHBondContact O-N 3.33Å; S160-L163 PolarHBondContact O-N 2.96Å; L163-F166 HydrophobicContact CD1-CD1 4.36Å; L163-F166 PolarHBondContact O-N 3.36Å; L163-I167 HydrophobicContact CD1-CD1 4.14Å; L163-I167 HydrophobicContact CD1-CG1 4.26Å; L163-I167 HydrophobicContact CG-CD1 3.88Å; L163-I167 HydrophobicContact CG-CG1 4.41Å; L163-I167 WeakPolarHBondContact O-CB 3.35Å; L163-I167 VanDerWaalsContact O-CG1 3.3Å; L163-I167 WeakPolarHBondContact O-CG1 3.13Å; L163-I167 PolarHBondContact O-N 3.5Å
164	D	70.9	Confident	70	Confident	115 Å²	115	66.1 Å²	66.1	62%	0.615	38%	0.382	S	S	*	.	H	α-helix	trans	-68.8	-37.8	178.4	-67.4	-10.6	0	0	0	112.5	G162 F166 R168	G162-D164 PolarHBondContact O-N 3.48Å; D164-F166 VanDerWaalsContact C-N 3.33Å; D164-R168 VanDerWaalsContact O-CB 3.3Å; D164-R168 WeakPolarHBondContact O-CB 3.47Å; D164-R168 PolarHBondContact O-N 3.06Å
165	D	69.1	Low	70.8	Confident	34 Å²	34	64.8 Å²	64.8	18%	0.182	39%	0.385	C	S	.	.	H	α-helix	trans	-65.5	-39.4	175	-120.3	47.9	0	0	0	109.8	K80 G162 R168 E169 R267	K80-D165 IonicContact NZ-OD1 3.33Å; K80-D165 PolarHBondContact NZ-OD1 2.85Å; K80-D165 IonicContact NZ-OD2 2.72Å; K80-D165 PolarHBondContact NZ-OD2 2.85Å; G162-D165 PolarHBondContact O-N 3.33Å; D165-R168 IonicContact OD1-CZ 2.59Å; D165-R168 IonicContact OD1-NH2 2.59Å; D165-R168 PolarHBondContact OD1-NH2 3.2Å; D165-E169 WeakPolarHBondContact O-CG 3.45Å; D165-E169 PolarHBondContact O-N 3.36Å; D165-R267 IonicContact OD2-CZ 3.33Å; D165-R267 IonicContact OD2-NH1 3.23Å; D165-R267 PolarHBondContact OD2-NH1 2.99Å; D165-R267 IonicContact OD2-NH2 3.77Å; D165-R267 PolarHBondContact OD2-NH2 3.05Å
166	F	75.3	Confident	72	Confident	24 Å²	24	61.5 Å²	61.5	11%	0.105	36%	0.356	C	S	.	.	H	α-helix	trans	-67.7	-44.8	174	173.8	-101.2	0	0	0	113.3	L153 L158 G162 L163 D164 R168 E169 V170 V187 L189	L153-F166 HydrophobicContact CD1-CE2 4.1Å; L153-F166 HydrophobicContact CD1-CZ 4.06Å; L158-F166 HydrophobicContact CD1-CB 3.9Å; L158-F166 HydrophobicContact CD1-CD1 3.68Å; L158-F166 HydrophobicContact CD1-CD2 4.39Å; L158-F166 HydrophobicContact CD1-CE1 4.28Å; L158-F166 HydrophobicContact CD1-CG 3.74Å; L158-F166 HydrophobicContact CD2-CB 3.81Å; L158-F166 HydrophobicContact CD2-CG 4.28Å; G162-F166 PolarHBondContact O-N 3.29Å; L163-F166 HydrophobicContact CD1-CD1 4.36Å; L163-F166 PolarHBondContact O-N 3.36Å; D164-F166 VanDerWaalsContact C-N 3.33Å; F166-R168 VanDerWaalsContact C-N 3.28Å; F166-R168 PolarHBondContact O-N 2.89Å; F166-E169 PolarHBondContact O-N 2.89Å; F166-V170 HydrophobicContact CD1-CG2 4.25Å; F166-V170 HydrophobicContact CD2-CG2 4.17Å; F166-V170 HydrophobicContact CE1-CG2 3.9Å; F166-V170 HydrophobicContact CE2-CG2 3.8Å; F166-V170 HydrophobicContact CG-CG2 4.39Å; F166-V170 HydrophobicContact CZ-CG2 3.66Å; F166-V170 WeakPolarHBondContact O-CB 3.29Å; F166-V170 VanDerWaalsContact O-CG2 3.31Å; F166-V170 WeakPolarHBondContact O-CG2 3.36Å; F166-V170 PolarHBondContact O-N 2.75Å; F166-V187 HydrophobicContact CZ-CG1 4.42Å; F166-L189 HydrophobicContact CE1-CD2 4.25Å
167	I	77.9	Confident	73.6	Confident	28 Å²	28	62.2 Å²	62.2	14%	0.144	35%	0.349	C	S	.	.	H	α-helix	trans	-58.5	-43.9	176.1	-77	171.7	0	0	0	110.3	L110 L163 V170 N171	L110-I167 HydrophobicContact CD1-CD1 4.47Å; L110-I167 HydrophobicContact CD1-CG1 4.06Å; L110-I167 HydrophobicContact CD2-CB 4.3Å; L110-I167 HydrophobicContact CD2-CG1 4.19Å; L110-I167 HydrophobicContact CD2-CG2 3.91Å; L110-I167 HydrophobicContact CG-CB 4.47Å; L110-I167 HydrophobicContact CG-CG1 4.01Å; L110-I167 HydrophobicContact CG-CG2 3.95Å; L163-I167 HydrophobicContact CD1-CD1 4.14Å; L163-I167 HydrophobicContact CD1-CG1 4.26Å; L163-I167 HydrophobicContact CG-CD1 3.88Å; L163-I167 HydrophobicContact CG-CG1 4.41Å; L163-I167 WeakPolarHBondContact O-CB 3.35Å; L163-I167 VanDerWaalsContact O-CG1 3.3Å; L163-I167 WeakPolarHBondContact O-CG1 3.13Å; L163-I167 PolarHBondContact O-N 3.5Å; I167-V170 PolarHBondContact O-N 3.12Å; I167-N171 WeakPolarHBondContact O-CB 3.45Å; I167-N171 PolarHBondContact O-N 3.31Å
168	R	76.2	Confident	75.7	Confident	146 Å²	146	59.2 Å²	59.2	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-64.7	-42.7	176	176.1	164.4	56.8	-166.2	-6.1	112.5	D164 D165 F166 A172	D164-R168 VanDerWaalsContact O-CB 3.3Å; D164-R168 WeakPolarHBondContact O-CB 3.47Å; D164-R168 PolarHBondContact O-N 3.06Å; D165-R168 IonicContact OD1-CZ 2.59Å; D165-R168 IonicContact OD1-NH2 2.59Å; D165-R168 PolarHBondContact OD1-NH2 3.2Å; F166-R168 VanDerWaalsContact C-N 3.28Å; F166-R168 PolarHBondContact O-N 2.89Å; R168-A172 VanDerWaalsContact O-CB 3.22Å; R168-A172 WeakPolarHBondContact O-CB 3.46Å; R168-A172 PolarHBondContact O-N 3.4Å
169	E	77.3	Confident	77.6	Confident	46 Å²	46	61.1 Å²	61.1	22%	0.215	34%	0.344	C	S	.	.	H	α-helix	trans	-59.9	-47.8	172.9	-78.4	178.6	143.3	0	0	111.5	D165 F166 A172 M173 R267	D165-E169 WeakPolarHBondContact O-CG 3.45Å; D165-E169 PolarHBondContact O-N 3.36Å; F166-E169 PolarHBondContact O-N 2.89Å; E169-A172 PolarHBondContact O-N 2.89Å; E169-M173 WeakPolarHBondContact O-CB 3.28Å; E169-M173 WeakPolarHBondContact O-CG 3.23Å; E169-M173 PolarHBondContact O-N 2.89Å; E169-R267 VanDerWaalsContact CD-NH1 3.3Å; E169-R267 WeakPolarHBondContact OE1-CD 3.49Å; E169-R267 IonicContact OE1-CZ 2.67Å; E169-R267 VanDerWaalsContact OE1-CZ 3.32Å; E169-R267 IonicContact OE1-NE 3.32Å; E169-R267 PolarHBondContact OE1-NE 3.02Å; E169-R267 IonicContact OE1-NH1 2.73Å; E169-R267 PolarHBondContact OE1-NH1 2.81Å; E169-R267 IonicContact OE2-NH1 3.58Å
170	V	81.4	Confident	79.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-62.4	-47.9	-179.8	166.2	0	0	0	0	112.2	L110 F166 I167 A172 M173 H174 L184 V187	L110-V170 HydrophobicContact CD2-CB 4.28Å; L110-V170 HydrophobicContact CD2-CG1 3.81Å; F166-V170 HydrophobicContact CD1-CG2 4.25Å; F166-V170 HydrophobicContact CD2-CG2 4.17Å; F166-V170 HydrophobicContact CE1-CG2 3.9Å; F166-V170 HydrophobicContact CE2-CG2 3.8Å; F166-V170 HydrophobicContact CG-CG2 4.39Å; F166-V170 HydrophobicContact CZ-CG2 3.66Å; F166-V170 WeakPolarHBondContact O-CB 3.29Å; F166-V170 VanDerWaalsContact O-CG2 3.31Å; F166-V170 WeakPolarHBondContact O-CG2 3.36Å; F166-V170 PolarHBondContact O-N 2.75Å; I167-V170 PolarHBondContact O-N 3.12Å; V170-A172 VanDerWaalsContact C-N 3.31Å; V170-A172 PolarHBondContact O-N 2.68Å; V170-M173 PolarHBondContact O-N 3.14Å; V170-H174 WeakPolarHBondContact O-CB 3.3Å; V170-H174 PolarHBondContact O-N 2.97Å; V170-L184 HydrophobicContact CG1-CD2 4.44Å; V170-V187 HydrophobicContact CB-CG1 4.44Å; V170-V187 HydrophobicContact CG1-CB 4.38Å; V170-V187 HydrophobicContact CG1-CG1 3.63Å; V170-V187 HydrophobicContact CG1-CG2 3.82Å; V170-V187 HydrophobicContact CG2-CG1 3.86Å
171	N	82.4	Confident	81.6	Confident	29 Å²	29	50.9 Å²	50.9	16%	0.155	28%	0.282	C	S	.	.	H	α-helix	trans	-61.2	-40.4	175.4	-91.5	-21.6	0	0	0	111.3	S109 T111 I167 H174 S175	S109-N171 PolarHBondContact O-ND2 3.14Å; T111-N171 PolarHBondContact N-OD1 2.98Å; T111-N171 PolarHBondContact OG1-OD1 2.86Å; I167-N171 WeakPolarHBondContact O-CB 3.45Å; I167-N171 PolarHBondContact O-N 3.31Å; N171-H174 PolarHBondContact O-N 3.27Å; N171-S175 PolarHBondContact O-N 3.45Å
172	A	81.6	Confident	83.6	Confident	27 Å²	27	44.7 Å²	44.7	22%	0.223	25%	0.248	C	C	.	.	H	α-helix	trans	-67.5	-40.5	177	0	0	0	0	0	111.8	R168 E169 V170 S175 F240	R168-A172 VanDerWaalsContact O-CB 3.22Å; R168-A172 WeakPolarHBondContact O-CB 3.46Å; R168-A172 PolarHBondContact O-N 3.4Å; E169-A172 PolarHBondContact O-N 2.89Å; V170-A172 VanDerWaalsContact C-N 3.31Å; V170-A172 PolarHBondContact O-N 2.68Å; A172-S175 PolarHBondContact O-N 3.13Å; A172-S175 PolarHBondContact O-OG 3.39Å; A172-F240 HydrophobicContact CB-CE1 4.25Å; A172-F240 HydrophobicContact CB-CZ 3.76Å; A172-F240 WeakPolarHBondContact O-CZ 3.19Å
173	M	83	Confident	84.9	Confident	10 Å²	10	45 Å²	45	5%	0.049	25%	0.247	C	C	.	.	H	α-helix	trans	-65	-39.3	174.6	-74	169.3	48.8	0	0	112.6	E169 V170 S175 L176 L184 M195 F240 F263 M266	E169-M173 WeakPolarHBondContact O-CB 3.28Å; E169-M173 WeakPolarHBondContact O-CG 3.23Å; E169-M173 PolarHBondContact O-N 2.89Å; V170-M173 PolarHBondContact O-N 3.14Å; M173-S175 PolarHBondContact O-N 2.81Å; M173-L176 VanDerWaalsContact O-CB 3.31Å; M173-L176 WeakPolarHBondContact O-CB 3.23Å; M173-L176 WeakPolarHBondContact O-CG 3.46Å; M173-L176 PolarHBondContact O-N 2.9Å; M173-L184 HydrophobicContact CB-CD2 3.8Å; M173-L184 HydrophobicContact CE-CD2 4.27Å; M173-M195 HydrophobicContact CE-CE 3.7Å; M173-M195 HydrophobicContact CE-SD 3.96Å; M173-F240 HydrophobicContact CG-CE1 4.26Å; M173-F263 HydrophobicContact CE-CB 3.44Å; M173-F263 VanDerWaalsContact CE-CB 3.44Å; M173-F263 HydrophobicContact CE-CD2 4.13Å; M173-F263 HydrophobicContact CE-CG 4.13Å; M173-F263 HydrophobicContact SD-CB 4.38Å; M173-M266 HydrophobicContact CG-CE 3.72Å
174	H	88.3	Confident	86	Confident	68 Å²	68	42.7 Å²	42.7	32%	0.315	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-27.1	177	179.3	-133.8	0	0	0	112.2	T111 V170 N171 L176 L184	T111-H174 PolarHBondContact OG1-ND1 2.91Å; V170-H174 WeakPolarHBondContact O-CB 3.3Å; V170-H174 PolarHBondContact O-N 2.97Å; N171-H174 PolarHBondContact O-N 3.27Å; H174-L176 PolarHBondContact O-N 2.85Å; H174-L184 HydrophobicContact CB-CD2 4.18Å
175	S	88.3	Confident	87	Confident	71 Å²	71	40.4 Å²	40.4	50%	0.497	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-6.2	174.7	81.6	0	0	0	0	115	N171 A172 M173	N171-S175 PolarHBondContact O-N 3.45Å; A172-S175 PolarHBondContact O-N 3.13Å; A172-S175 PolarHBondContact O-OG 3.39Å; M173-S175 PolarHBondContact O-N 2.81Å
176	L	91.3	Very high	88	Confident	14 Å²	14	38.8 Å²	38.8	7%	0.073	21%	0.209	C	C	.	.			trans	-87.4	116.9	-177.4	-59.5	173.4	0	0	0	111.3	M173 H174 Y234 L235 R238 F240 M266	M173-L176 VanDerWaalsContact O-CB 3.31Å; M173-L176 WeakPolarHBondContact O-CB 3.23Å; M173-L176 WeakPolarHBondContact O-CG 3.46Å; M173-L176 PolarHBondContact O-N 2.9Å; H174-L176 PolarHBondContact O-N 2.85Å; L176-Y234 HydrophobicContact CB-CE1 4.28Å; L176-Y234 HydrophobicContact CD2-CE1 3.8Å; L176-L235 HydrophobicContact CD1-CD2 3.88Å; L176-L235 HydrophobicContact CD2-CD2 4.43Å; L176-R238 HydrophobicContact CD2-CB 3.94Å; L176-R238 HydrophobicContact CD2-CG 3.88Å; L176-F240 HydrophobicContact CD1-CD1 4.15Å; L176-F240 HydrophobicContact CD1-CD2 4.3Å; L176-F240 HydrophobicContact CD1-CE1 4.04Å; L176-F240 HydrophobicContact CD1-CE2 4.23Å; L176-F240 HydrophobicContact CD1-CG 4.25Å; L176-F240 HydrophobicContact CD1-CZ 4.07Å; L176-F240 HydrophobicContact CD2-CD2 3.93Å; L176-F240 HydrophobicContact CD2-CE2 3.72Å; L176-F240 HydrophobicContact CD2-CZ 4.23Å; L176-F240 HydrophobicContact CG-CE2 4.28Å; L176-F240 HydrophobicContact CG-CZ 4.29Å; L176-M266 HydrophobicContact CD1-CE 3.33Å; L176-M266 HydrophobicContact CD1-SD 4.29Å
177	S	93.4	Very high	88.7	Confident	92 Å²	92	37.7 Å²	37.7	64%	0.643	20%	0.204	S	C	*	.			trans	-135.3	119.8	173.9	-170.9	0	0	0	0	110	Y234	S177-Y234 PolarHBondContact N-OH 3.44Å; S177-Y234 PolarHBondContact O-OH 2.82Å
178	H	96.6	Very high	89.3	Confident	33 Å²	33	36.4 Å²	36.4	15%	0.153	20%	0.198	C	C	.	.			trans	-159.3	141	179	178.8	-92.7	0	0	0	108.6	N180 L181 S230 Y234	H178-N180 PolarHBondContact CE1-OD1 2.8Å; H178-N180 PolarHBondContact ND1-N 3.26Å; H178-N180 VanDerWaalsContact ND1-N 3.13Å; H178-N180 PolarHBondContact O-N 2.64Å; H178-N180 VanDerWaalsContact O-N 3.15Å; H178-L181 HydrophobicContact CB-CB 4.37Å; H178-L181 HydrophobicContact CB-CD1 3.98Å; H178-L181 HydrophobicContact CB-CG 3.99Å; H178-L181 PolarHBondContact O-N 3.23Å; H178-S230 PolarHBondContact NE2-OG 3.24Å; H178-Y234 HydrophobicContact CB-CD1 3.82Å; H178-Y234 HydrophobicContact CB-CD2 4.13Å; H178-Y234 HydrophobicContact CB-CE1 4.14Å; H178-Y234 HydrophobicContact CB-CE2 4.44Å; H178-Y234 HydrophobicContact CB-CG 3.81Å; H178-Y234 AromaticContact CD2-CD2 3.9Å; H178-Y234 AromaticContact CD2-CG 3.86Å; H178-Y234 AromaticContact CG-CG 3.94Å
179	P	97.2	Very high	89.7	Confident	89 Å²	89	32.1 Å²	32.1	58%	0.578	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-34	-175.3	20	-34	0	0	0	114.2	K259	P179-K259 WeakPolarHBondContact O-CE 3.27Å; P179-K259 WeakPolarHBondContact O-CG 3.44Å; P179-K259 PolarHBondContact O-NZ 2.76Å
180	N	97.9	Very high	90.2	Very high	15 Å²	15	32.4 Å²	32.4	8%	0.08	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	21.8	178.1	-50.5	107.9	0	0	0	114.4	H178 Q227 V258 K259 I260	H178-N180 PolarHBondContact CE1-OD1 2.8Å; H178-N180 PolarHBondContact ND1-N 3.26Å; H178-N180 VanDerWaalsContact ND1-N 3.13Å; H178-N180 PolarHBondContact O-N 2.64Å; H178-N180 VanDerWaalsContact O-N 3.15Å; N180-Q227 HydrophobicContact CB-CB 4.48Å; N180-Q227 WeakPolarHBondContact CB-O 3.45Å; N180-Q227 WeakPolarHBondContact ND2-CB 3.3Å; N180-Q227 WeakPolarHBondContact ND2-CG 3.41Å; N180-Q227 PolarHBondContact ND2-OE1 3.42Å; N180-V258 PolarHBondContact ND2-O 3.02Å; N180-K259 CarbonylContact O-C 3.58Å; N180-K259 WeakPolarHBondContact O-CA 3.4Å; N180-I260 PolarHBondContact O-N 2.96Å
181	L	96.7	Very high	90.2	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-116.4	149	166.4	-62.9	-178.5	0	0	0	109.8	H178 Y234 L235 K259 I260	H178-L181 HydrophobicContact CB-CB 4.37Å; H178-L181 HydrophobicContact CB-CD1 3.98Å; H178-L181 HydrophobicContact CB-CG 3.99Å; H178-L181 PolarHBondContact O-N 3.23Å; L181-Y234 HydrophobicContact CD1-CD1 3.69Å; L181-Y234 HydrophobicContact CD1-CE1 4.12Å; L181-L235 HydrophobicContact CD1-CD2 3.72Å; L181-L235 HydrophobicContact CD1-CG 4.1Å; L181-L235 HydrophobicContact CD2-CD1 4.08Å; L181-L235 HydrophobicContact CD2-CD2 4.48Å; L181-L235 HydrophobicContact CD2-CG 4.18Å; L181-K259 WeakPolarHBondContact O-CD 3.47Å; L181-K259 PolarHBondContact O-NZ 2.57Å; L181-K259 VanDerWaalsContact O-NZ 3.1Å; L181-I260 HydrophobicContact CD2-CB 3.88Å; L181-I260 HydrophobicContact CD2-CD1 4.16Å; L181-I260 HydrophobicContact CD2-CG1 4.28Å
182	I	95.2	Very high	90.3	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.036	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-70	128.4	166.2	-69.2	-66.7	0	0	0	108.5	T197 E198 A200 L251 K259 I260 F263	I182-T197 HydrophobicContact CG2-CG2 4.38Å; I182-E198 HydrophobicContact CG2-CB 4.23Å; I182-A200 HydrophobicContact CD1-CB 4.06Å; I182-L251 HydrophobicContact CD1-CB 4.38Å; I182-L251 HydrophobicContact CD1-CD1 4.04Å; I182-L251 HydrophobicContact CG1-CD1 4.1Å; I182-K259 HydrophobicContact CD1-CB 3.73Å; I182-K259 HydrophobicContact CD1-CD 3.97Å; I182-K259 HydrophobicContact CG1-CB 3.93Å; I182-I260 WeakPolarHBondContact CG1-O 3.34Å; I182-I260 PolarHBondContact N-O 2.86Å; I182-F263 HydrophobicContact CB-CE2 4.2Å; I182-F263 HydrophobicContact CB-CZ 4.15Å; I182-F263 HydrophobicContact CG2-CE2 4.36Å; I182-F263 WeakPolarHBondContact O-CE2 3.5Å; I182-F263 VanDerWaalsContact O-CZ 3.25Å; I182-F263 WeakPolarHBondContact O-CZ 3.22Å
183	S	93	Very high	90.5	Very high	33 Å²	33	39 Å²	39	23%	0.231	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-75.1	131.1	179.2	-44.8	0	0	0	0	110.9	T197 E198	S183-T197 CarbonylContact O-C 3.56Å; S183-T197 VanDerWaalsContact O-CA 3.27Å; S183-T197 WeakPolarHBondContact O-CA 3.1Å; S183-T197 WeakPolarHBondContact O-CB 3.28Å; S183-E198 WeakPolarHBondContact CB-OE2 3.41Å; S183-E198 PolarHBondContact N-OE2 2.83Å; S183-E198 PolarHBondContact O-N 2.87Å; S183-E198 PolarHBondContact OG-OE2 2.79Å
184	L	92.3	Very high	90.8	Very high	11 Å²	11	38.7 Å²	38.7	6%	0.058	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.9	164.3	178	65.6	0	0	0	108.5	V170 M173 H174 M195 T197	V170-L184 HydrophobicContact CG1-CD2 4.44Å; M173-L184 HydrophobicContact CB-CD2 3.8Å; M173-L184 HydrophobicContact CE-CD2 4.27Å; H174-L184 HydrophobicContact CB-CD2 4.18Å; L184-M195 HydrophobicContact CD1-CG 3.48Å; L184-M195 VanDerWaalsContact CD1-CG 3.48Å; L184-M195 HydrophobicContact CD1-SD 4.15Å; L184-T197 HydrophobicContact CD1-CG2 3.99Å
185	Y	91.9	Very high	90.9	Very high	67 Å²	67	36.2 Å²	36.2	26%	0.263	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-30.4	174.5	-62	-41.3	0	0	0	112.4	W138 V148 V196 E198	W138-Y185 HydrophobicContact CE3-CD2 4.26Å; W138-Y185 HydrophobicContact CE3-CG 4.3Å; W138-Y185 HydrophobicContact CZ3-CD1 4.43Å; W138-Y185 HydrophobicContact CZ3-CD2 4.31Å; W138-Y185 AromaticContact CZ3-CG 3.92Å; W138-Y185 HydrophobicContact CZ3-CG 3.92Å; V148-Y185 HydrophobicContact CG1-CD2 3.69Å; V148-Y185 HydrophobicContact CG1-CE2 3.85Å; Y185-V196 PolarHBondContact N-O 3.07Å; Y185-E198 HydrophobicContact CE2-CB 4.19Å
186	G	90.6	Very high	91.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.4	-167	173.3	0	0	0	0	0	115.3	C112 V196	C112-G186 CarbonylContact O-C 3.59Å; C112-G186 WeakPolarHBondContact O-CA 3.23Å; G186-V196 PolarHBondContact N-O 3.36Å; G186-V196 PolarHBondContact O-N 2.92Å
187	V	90.8	Very high	91.3	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.1	179.9	-66.1	0	0	0	0	112.2	L110 C112 I114 F166 V170 L189 K194 M195	L110-V187 HydrophobicContact CD1-CG2 4Å; L110-V187 HydrophobicContact CD2-CG2 4.3Å; C112-V187 PolarHBondContact O-N 3.11Å; I114-V187 PolarHBondContact N-O 2.77Å; F166-V187 HydrophobicContact CZ-CG1 4.42Å; V170-V187 HydrophobicContact CB-CG1 4.44Å; V170-V187 HydrophobicContact CG1-CB 4.38Å; V170-V187 HydrophobicContact CG1-CG1 3.63Å; V170-V187 HydrophobicContact CG1-CG2 3.82Å; V170-V187 HydrophobicContact CG2-CG1 3.86Å; V187-L189 HydrophobicContact CG2-CD2 4.26Å; V187-K194 CarbonylContact C-O 3.56Å; V187-K194 WeakPolarHBondContact CA-O 3.19Å; V187-M195 HydrophobicContact CG1-CG 4.5Å
188	V	90.1	Very high	91.3	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	117.1	171.4	-178.4	0	0	0	0	107.5	I114 E116 M119 T190 M193 K194 V196	I114-V188 HydrophobicContact CB-CG2 4Å; I114-V188 HydrophobicContact CG2-CG2 4Å; E116-V188 HydrophobicContact CB-CG1 4.08Å; M119-V188 HydrophobicContact CE-CG2 3.95Å; V188-T190 WeakPolarHBondContact CG1-OG1 3.35Å; V188-M193 WeakPolarHBondContact O-CA 3.15Å; V188-K194 HydrophobicContact CB-CB 4Å; V188-K194 HydrophobicContact CB-CD 4.34Å; V188-K194 HydrophobicContact CB-CG 4.2Å; V188-K194 HydrophobicContact CG1-CD 4.36Å; V188-K194 HydrophobicContact CG2-CB 4.36Å; V188-K194 PolarHBondContact N-O 3.27Å; V188-K194 PolarHBondContact O-N 2.93Å; V188-V196 HydrophobicContact CG2-CG2 4.2Å
189	L	85.6	Confident	91.3	Very high	56 Å²	56	30.3 Å²	30.3	29%	0.293	17%	0.165	S	C	.	.			trans	-86.4	-13.9	-177.6	-64.9	-169.6	0	0	0	114.4	L110 L113 F166 V187 Q191	L110-L189 HydrophobicContact CD1-CD1 3.72Å; L110-L189 HydrophobicContact CD1-CD2 4.15Å; L110-L189 HydrophobicContact CD1-CG 4.1Å; L113-L189 HydrophobicContact CD1-CD1 3.93Å; L113-L189 HydrophobicContact CD1-CG 4.24Å; F166-L189 HydrophobicContact CE1-CD2 4.25Å; V187-L189 HydrophobicContact CG2-CD2 4.26Å; L189-Q191 PolarHBondContact O-N 2.98Å
190	T	86	Confident	91.2	Very high	53 Å²	53	26.6 Å²	26.6	33%	0.325	14%	0.142	S	C	.	.	S	Bend	trans	-63.9	132.6	174.3	49.1	0	0	0	0	110.1	E116 V188 P192 M193 K194	E116-T190 VanDerWaalsContact OE2-CB 3.3Å; E116-T190 WeakPolarHBondContact OE2-CB 3.45Å; E116-T190 PolarHBondContact OE2-OG1 3.25Å; V188-T190 WeakPolarHBondContact CG1-OG1 3.35Å; T190-P192 CarbonylContact O-C 3.53Å; T190-M193 PolarHBondContact O-N 2.83Å; T190-K194 PolarHBondContact O-NZ 3.3Å
191	Q	82.3	Confident	91	Very high	120 Å²	120	30.3 Å²	30.3	56%	0.561	17%	0.167	S	C	*	.	S	Bend	trans	-73.3	135.3	-174.7	-67	-64.3	-12.5	0	0	111.4	L189	L189-Q191 PolarHBondContact O-N 2.98Å
192	P	84.6	Confident	90.9	Very high	66 Å²	66	33.9 Å²	33.9	43%	0.429	19%	0.186	S	C	.	.	S	Bend	cis	-72.9	132.4	-3	30.4	-34.4	0	0	0	111.7	T190 K194	T190-P192 CarbonylContact O-C 3.53Å; P192-K194 WeakPolarHBondContact O-CE 3.31Å; P192-K194 WeakPolarHBondContact O-CG 3.5Å; P192-K194 PolarHBondContact O-NZ 2.84Å
193	M	85.8	Confident	90.8	Very high	8 Å²	8	35 Å²	35	4%	0.039	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-59.3	150	-178.3	-64.8	175.3	-59.7	0	0	112.5	L153 L158 V188 T190	L153-M193 HydrophobicContact CB-CB 4.41Å; L153-M193 WeakPolarHBondContact CB-O 3.34Å; L153-M193 HydrophobicContact CD1-CB 4.18Å; L153-M193 PolarHBondContact N-O 3.28Å; L158-M193 HydrophobicContact CD1-CE 3.7Å; L158-M193 HydrophobicContact CD1-SD 3.8Å; L158-M193 HydrophobicContact CG-CE 4.04Å; V188-M193 WeakPolarHBondContact O-CA 3.15Å; T190-M193 PolarHBondContact O-N 2.83Å
194	K	89.5	Confident	90.9	Very high	5 Å²	5	34 Å²	34	2%	0.022	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	135.4	-170.7	-37.2	175	-177.3	63.5	0	110.5	E116 M119 V150 K151 V187 V188 T190 P192	E116-K194 WeakPolarHBondContact OE1-CE 3.28Å; E116-K194 IonicContact OE1-NZ 3.38Å; E116-K194 PolarHBondContact OE1-NZ 3.47Å; E116-K194 IonicContact OE2-NZ 3.72Å; E116-K194 PolarHBondContact OE2-NZ 3.21Å; M119-K194 HydrophobicContact CE-CD 3.58Å; V150-K194 HydrophobicContact CG1-CB 3.86Å; V150-K194 HydrophobicContact CG1-CD 4.49Å; K151-K194 WeakPolarHBondContact O-CA 3.38Å; V187-K194 CarbonylContact C-O 3.56Å; V187-K194 WeakPolarHBondContact CA-O 3.19Å; V188-K194 HydrophobicContact CB-CB 4Å; V188-K194 HydrophobicContact CB-CD 4.34Å; V188-K194 HydrophobicContact CB-CG 4.2Å; V188-K194 HydrophobicContact CG1-CD 4.36Å; V188-K194 HydrophobicContact CG2-CB 4.36Å; V188-K194 PolarHBondContact N-O 3.27Å; V188-K194 PolarHBondContact O-N 2.93Å; T190-K194 PolarHBondContact O-NZ 3.3Å; P192-K194 WeakPolarHBondContact O-CE 3.31Å; P192-K194 WeakPolarHBondContact O-CG 3.5Å; P192-K194 PolarHBondContact O-NZ 2.84Å
195	M	89.7	Confident	91	Very high	15 Å²	15	33.5 Å²	33.5	7%	0.074	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	128.4	171.6	-175.2	-179.3	-74.7	0	0	108.9	V150 K151 M173 L184 V187 T197	V150-M195 WeakPolarHBondContact CA-O 3.47Å; K151-M195 HydrophobicContact CB-CB 4.38Å; K151-M195 PolarHBondContact N-O 2.75Å; K151-M195 PolarHBondContact O-N 2.85Å; M173-M195 HydrophobicContact CE-CE 3.7Å; M173-M195 HydrophobicContact CE-SD 3.96Å; L184-M195 HydrophobicContact CD1-CG 3.48Å; L184-M195 VanDerWaalsContact CD1-CG 3.48Å; L184-M195 HydrophobicContact CD1-SD 4.15Å; V187-M195 HydrophobicContact CG1-CG 4.5Å; M195-T197 HydrophobicContact CG-CG2 4.25Å
196	V	92.9	Very high	91.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	116	-172	-174.8	0	0	0	0	109.2	I114 M119 V148 V150 Y185 G186 V188	I114-V196 HydrophobicContact CD1-CB 3.88Å; I114-V196 HydrophobicContact CD1-CG1 4.12Å; I114-V196 HydrophobicContact CD1-CG2 4.01Å; M119-V196 HydrophobicContact SD-CG2 3.68Å; V148-V196 HydrophobicContact CB-CG1 3.85Å; V148-V196 HydrophobicContact CG1-CG1 3.87Å; V148-V196 HydrophobicContact CG2-CG1 3.97Å; V150-V196 HydrophobicContact CG1-CG2 4.42Å; Y185-V196 PolarHBondContact N-O 3.07Å; G186-V196 PolarHBondContact N-O 3.36Å; G186-V196 PolarHBondContact O-N 2.92Å; V188-V196 HydrophobicContact CG2-CG2 4.2Å
197	T	94.4	Very high	91.2	Very high	22 Å²	22	34.6 Å²	34.6	14%	0.135	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	167.7	-175.8	69.9	0	0	0	0	112.3	V148 A149 I182 S183 L184 M195	V148-T197 WeakPolarHBondContact CA-O 3.32Å; V148-T197 WeakPolarHBondContact CB-O 3.47Å; A149-T197 PolarHBondContact N-O 3.26Å; A149-T197 PolarHBondContact O-N 3.43Å; I182-T197 HydrophobicContact CG2-CG2 4.38Å; S183-T197 CarbonylContact O-C 3.56Å; S183-T197 VanDerWaalsContact O-CA 3.27Å; S183-T197 WeakPolarHBondContact O-CA 3.1Å; S183-T197 WeakPolarHBondContact O-CB 3.28Å; L184-T197 HydrophobicContact CD1-CG2 3.99Å; M195-T197 HydrophobicContact CG-CG2 4.25Å
198	E	94.9	Very high	91.3	Very high	27 Å²	27	37.1 Å²	37.1	13%	0.126	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	137	164.6	-176.1	-176	165	0	0	111.6	I182 S183 Y185 K259	I182-E198 HydrophobicContact CG2-CB 4.23Å; S183-E198 WeakPolarHBondContact CB-OE2 3.41Å; S183-E198 PolarHBondContact N-OE2 2.83Å; S183-E198 PolarHBondContact O-N 2.87Å; S183-E198 PolarHBondContact OG-OE2 2.79Å; Y185-E198 HydrophobicContact CE2-CB 4.19Å; E198-K259 WeakPolarHBondContact OE1-CD 3.4Å; E198-K259 WeakPolarHBondContact OE1-CE 3.34Å; E198-K259 IonicContact OE1-NZ 2.7Å; E198-K259 PolarHBondContact OE1-NZ 3.13Å; E198-K259 IonicContact OE2-NZ 3.17Å; E198-K259 PolarHBondContact OE2-NZ 2.87Å
199	L	95.6	Very high	91.4	Very high	37 Å²	37	37.1 Å²	37.1	19%	0.194	21%	0.21	C	C	.	.			trans	-89.4	123.4	174.4	-178.8	64.2	0	0	0	110.4	L125 R135 S147 A149 P201	L125-L199 HydrophobicContact CD1-CD1 3.6Å; R135-L199 HydrophobicContact CG-CD2 3.84Å; S147-L199 WeakPolarHBondContact OG-CD2 3.44Å; A149-L199 HydrophobicContact CB-CD1 4.09Å; L199-P201 WeakPolarHBondContact O-CD 3.39Å
200	A	95.9	Very high	91.6	Very high	11 Å²	11	40.5 Å²	40.5	9%	0.091	22%	0.218	C	C	.	.			trans	-92	104.3	168.2	0	0	0	0	0	109.5	I182 L202 G203 L251 L252	I182-A200 HydrophobicContact CD1-CB 4.06Å; A200-L202 VanDerWaalsContact C-N 3.27Å; A200-L202 PolarHBondContact O-N 2.83Å; A200-G203 PolarHBondContact O-N 2.87Å; A200-L251 HydrophobicContact CB-CB 3.55Å; A200-L251 HydrophobicContact CB-CD1 4.11Å; A200-L251 HydrophobicContact CB-CG 4.48Å; A200-L252 CarbonylContact C-O 3.45Å
201	P	94.3	Very high	91.4	Very high	94 Å²	94	45.6 Å²	45.6	61%	0.61	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-17.1	-164.5	28	-36.3	0	0	0	114.6	L199	L199-P201 WeakPolarHBondContact O-CD 3.39Å
202	L	93.5	Very high	90.6	Very high	77 Å²	77	46 Å²	46	40%	0.403	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.6	-179.2	-58.2	179.5	0	0	0	113.6	A200 L252 T254	A200-L202 VanDerWaalsContact C-N 3.27Å; A200-L202 PolarHBondContact O-N 2.83Å; L202-L252 HydrophobicContact CB-CB 3.64Å; L202-L252 HydrophobicContact CD1-CB 4.42Å; L202-L252 PolarHBondContact N-O 3.1Å; L202-T254 VanDerWaalsContact CD1-C 3.41Å
203	G	93.6	Very high	89	Confident	31 Å²	31	52.6 Å²	52.6	32%	0.32	26%	0.257	S	S	.	.			trans	76	-154.7	176.7	0	0	0	0	0	114.1	A200 L251 L252	A200-G203 PolarHBondContact O-N 2.87Å; G203-L251 WeakPolarHBondContact O-CA 3.3Å; G203-L252 PolarHBondContact O-N 2.97Å
204	S	94.4	Very high	87.4	Confident	12 Å²	12	53.9 Å²	53.9	8%	0.084	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-79.5	152.3	-177.8	81.7	0	0	0	0	113.3	L206 D207 R208 R248	S204-L206 VanDerWaalsContact C-N 3.32Å; S204-D207 WeakPolarHBondContact O-CB 3.38Å; S204-D207 PolarHBondContact O-N 3.34Å; S204-D207 WeakPolarHBondContact OG-CB 3.47Å; S204-D207 VanDerWaalsContact OG-CG 3.24Å; S204-D207 PolarHBondContact OG-N 2.98Å; S204-D207 PolarHBondContact OG-OD2 3.15Å; S204-R208 PolarHBondContact O-N 2.93Å; S204-R208 VanDerWaalsContact O-N 3.09Å; S204-R248 WeakPolarHBondContact CB-O 3.44Å
205	L	95.3	Very high	86.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-37.8	172.3	179.1	56.9	0	0	0	111	D207 R208 L209 Y224 V250 L252 M315	L205-D207 VanDerWaalsContact C-N 3.35Å; L205-D207 PolarHBondContact O-N 3.36Å; L205-R208 PolarHBondContact O-N 2.93Å; L205-R208 VanDerWaalsContact O-N 3.12Å; L205-L209 HydrophobicContact CD1-CD1 4.38Å; L205-L209 HydrophobicContact CD1-CG 4.28Å; L205-L209 HydrophobicContact CG-CD1 4.02Å; L205-L209 HydrophobicContact CG-CG 4.43Å; L205-L209 WeakPolarHBondContact O-CD1 3.45Å; L205-L209 VanDerWaalsContact O-CG 3.26Å; L205-L209 WeakPolarHBondContact O-CG 3.31Å; L205-L209 PolarHBondContact O-N 3.49Å; L205-Y224 HydrophobicContact CD1-CD2 3.63Å; L205-Y224 HydrophobicContact CD1-CE2 3.51Å; L205-Y224 HydrophobicContact CD2-CD2 4.02Å; L205-V250 HydrophobicContact CB-CB 4.11Å; L205-V250 HydrophobicContact CB-CG1 4.1Å; L205-V250 WeakPolarHBondContact CB-O 3.37Å; L205-V250 HydrophobicContact CD2-CB 4.22Å; L205-V250 HydrophobicContact CD2-CG1 3.8Å; L205-V250 PolarHBondContact N-O 3.3Å; L205-L252 HydrophobicContact CD1-CD1 4.33Å; L205-M315 HydrophobicContact CD2-CE 4.43Å; L205-M315 HydrophobicContact CD2-CG 3.92Å; L205-M315 HydrophobicContact CD2-SD 4.02Å
206	L	94.4	Very high	86.2	Confident	22 Å²	22	57 Å²	57	12%	0.115	29%	0.287	C	S	.	.	H	α-helix	trans	-59.7	-42.4	174.6	-174.7	62.5	0	0	0	112.5	S204 L209 R210 A247 R248	S204-L206 VanDerWaalsContact C-N 3.32Å; L206-L209 PolarHBondContact O-N 2.92Å; L206-R210 HydrophobicContact CD1-CG 4.45Å; L206-R210 WeakPolarHBondContact O-CB 3.45Å; L206-R210 WeakPolarHBondContact O-CG 3.39Å; L206-R210 PolarHBondContact O-N 3.07Å; L206-A247 HydrophobicContact CB-CB 4.1Å; L206-A247 HydrophobicContact CD1-CB 4.45Å; L206-A247 PolarHBondContact N-O 3.23Å; L206-A247 VanDerWaalsContact N-O 3.1Å; L206-R248 HydrophobicContact CD2-CB 4.04Å
207	D	92.6	Very high	86.2	Confident	69 Å²	69	58 Å²	58	37%	0.369	29%	0.293	S	S	.	.	H	α-helix	trans	-61.7	-43.8	172	-79.8	-68.2	0	0	0	111.7	S204 L205 L209 R210 K211	S204-D207 WeakPolarHBondContact O-CB 3.38Å; S204-D207 PolarHBondContact O-N 3.34Å; S204-D207 WeakPolarHBondContact OG-CB 3.47Å; S204-D207 VanDerWaalsContact OG-CG 3.24Å; S204-D207 PolarHBondContact OG-N 2.98Å; S204-D207 PolarHBondContact OG-OD2 3.15Å; L205-D207 VanDerWaalsContact C-N 3.35Å; L205-D207 PolarHBondContact O-N 3.36Å; D207-L209 VanDerWaalsContact C-N 3.34Å; D207-L209 PolarHBondContact O-N 3.33Å; D207-R210 PolarHBondContact O-N 2.91Å; D207-K211 HydrophobicContact CB-CD 4.22Å; D207-K211 WeakPolarHBondContact O-CB 3.34Å; D207-K211 WeakPolarHBondContact O-CD 3.33Å; D207-K211 WeakPolarHBondContact O-CG 3.4Å; D207-K211 PolarHBondContact O-N 3.35Å; D207-K211 WeakPolarHBondContact OD1-CE 3.36Å; D207-K211 IonicContact OD1-NZ 3.63Å; D207-K211 PolarHBondContact OD1-NZ 3.29Å
208	R	91.3	Very high	86.1	Confident	53 Å²	53	57.1 Å²	57.1	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-36.3	-179.9	174.8	56.4	175	-108.9	-10.4	112.5	S204 L205 I216 L252 N255	S204-R208 PolarHBondContact O-N 2.93Å; S204-R208 VanDerWaalsContact O-N 3.09Å; L205-R208 PolarHBondContact O-N 2.93Å; L205-R208 VanDerWaalsContact O-N 3.12Å; R208-I216 HydrophobicContact CG-CD1 4.08Å; R208-L252 HydrophobicContact CB-CD1 3.39Å; R208-L252 HydrophobicContact CG-CD1 3.65Å; R208-N255 VanDerWaalsContact CZ-OD1 3.31Å; R208-N255 PolarHBondContact NH1-OD1 3.5Å; R208-N255 PolarHBondContact NH2-OD1 2.84Å
209	L	92.1	Very high	86	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-55.5	172.6	-69.4	160.2	0	0	0	109.8	L205 L206 D207 K211 R212 I216 L221 M315	L205-L209 HydrophobicContact CD1-CD1 4.38Å; L205-L209 HydrophobicContact CD1-CG 4.28Å; L205-L209 HydrophobicContact CG-CD1 4.02Å; L205-L209 HydrophobicContact CG-CG 4.43Å; L205-L209 WeakPolarHBondContact O-CD1 3.45Å; L205-L209 VanDerWaalsContact O-CG 3.26Å; L205-L209 WeakPolarHBondContact O-CG 3.31Å; L205-L209 PolarHBondContact O-N 3.49Å; L206-L209 PolarHBondContact O-N 2.92Å; D207-L209 VanDerWaalsContact C-N 3.34Å; D207-L209 PolarHBondContact O-N 3.33Å; L209-K211 PolarHBondContact O-N 3.49Å; L209-R212 PolarHBondContact O-N 3.23Å; L209-I216 HydrophobicContact CD2-CD1 3.99Å; L209-L221 HydrophobicContact CD2-CD2 3.97Å; L209-M315 HydrophobicContact CD1-CG 4.47Å
210	R	90.8	Very high	86	Confident	127 Å²	127	57.1 Å²	57.1	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-68.8	-30.5	-175.6	-69.1	177	174.3	-171	-4.2	114.9	L206 D207 R212 G319	L206-R210 HydrophobicContact CD1-CG 4.45Å; L206-R210 WeakPolarHBondContact O-CB 3.45Å; L206-R210 WeakPolarHBondContact O-CG 3.39Å; L206-R210 PolarHBondContact O-N 3.07Å; D207-R210 PolarHBondContact O-N 2.91Å; R210-R212 PolarHBondContact O-N 3.46Å; R210-G319 VanDerWaalsContact CZ-O 3.23Å; R210-G319 PolarHBondContact NE-O 3.2Å; R210-G319 PolarHBondContact NH2-O 3.48Å
211	K	82.5	Confident	85.9	Confident	159 Å²	159	56.6 Å²	56.6	69%	0.691	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-6.5	-179.6	-73.2	167.8	-173.5	167.9	0	113.9	D207 L209	D207-K211 HydrophobicContact CB-CD 4.22Å; D207-K211 WeakPolarHBondContact O-CB 3.34Å; D207-K211 WeakPolarHBondContact O-CD 3.33Å; D207-K211 WeakPolarHBondContact O-CG 3.4Å; D207-K211 PolarHBondContact O-N 3.35Å; D207-K211 WeakPolarHBondContact OD1-CE 3.36Å; D207-K211 IonicContact OD1-NZ 3.63Å; D207-K211 PolarHBondContact OD1-NZ 3.29Å; L209-K211 PolarHBondContact O-N 3.49Å
212	R	63.7	Low	86	Confident	130 Å²	130	52.2 Å²	52.2	49%	0.491	26%	0.256	S	S	.	.	S	Bend	trans	-118.1	99.6	176.8	-71.2	-171.2	171.8	-133.3	-5.6	110.3	L209 R210 G214	L209-R212 PolarHBondContact O-N 3.23Å; R210-R212 PolarHBondContact O-N 3.46Å; R212-G214 PolarHBondContact O-N 2.83Å
213	Q	51.4	Low	86.2	Confident	203 Å²	203	52 Å²	52	95%	0.949	26%	0.255	S	S	*	.	S	Bend	trans	-60.3	117.8	166.6	-66.9	178.2	-7.6	0	0	108.7
214	G	53	Low	86.4	Confident	35 Å²	35	50.7 Å²	50.7	36%	0.361	24%	0.24	S	C	.	.	S	Bend	trans	100.2	-108.4	-175.8	0	0	0	0	0	112.7	R212	R212-G214 PolarHBondContact O-N 2.83Å
215	H	68.4	Low	86.6	Confident	73 Å²	73	50.1 Å²	50.1	34%	0.338	24%	0.236	S	C	.	.			trans	-123.9	121.1	-144.2	-45.6	-66.9	0	0	0	115	L425	H215-L425 HydrophobicContact CB-CB 3.39Å; H215-L425 HydrophobicContact CB-CD1 4.13Å; H215-L425 HydrophobicContact CB-CG 4.38Å; H215-L425 PolarHBondContact ND1-O 3.48Å
216	I	85.9	Confident	86.7	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.062	24%	0.241	C	C	.	.			trans	-103.5	149.7	152.9	-64.1	-177.4	0	0	0	106.3	R208 L209 I218 I220 L221 Q420	R208-I216 HydrophobicContact CG-CD1 4.08Å; L209-I216 HydrophobicContact CD2-CD1 3.99Å; I216-I218 PolarHBondContact O-N 2.91Å; I216-I220 HydrophobicContact CG2-CB 4.21Å; I216-I220 HydrophobicContact CG2-CG2 4.26Å; I216-L221 HydrophobicContact CB-CD2 4.48Å; I216-L221 HydrophobicContact CG2-CD2 3.95Å; I216-L221 HydrophobicContact CG2-CG 4.23Å; I216-Q420 PolarHBondContact O-NE2 2.84Å
217	L	91.6	Very high	86.9	Confident	23 Å²	23	51.3 Å²	51.3	12%	0.12	24%	0.242	C	C	.	.			trans	-67.6	132.9	175.5	-68	177.8	0	0	0	110.7	S219 I220 L221 Q420 R422 L425	L217-S219 PolarHBondContact O-N 3.49Å; L217-I220 HydrophobicContact CB-CB 4.39Å; L217-I220 HydrophobicContact CB-CD1 3.99Å; L217-I220 HydrophobicContact CB-CG1 3.96Å; L217-I220 HydrophobicContact CD1-CD1 4.24Å; L217-I220 HydrophobicContact CG-CD1 4.43Å; L217-I220 WeakPolarHBondContact O-CA 3.29Å; L217-I220 WeakPolarHBondContact O-CB 3.37Å; L217-I220 PolarHBondContact O-N 2.93Å; L217-L221 PolarHBondContact O-N 3.42Å; L217-L221 VanDerWaalsContact O-N 3.15Å; L217-Q420 VanDerWaalsContact CA-OE1 3.29Å; L217-Q420 HydrophobicContact CD2-CG 4.48Å; L217-R422 HydrophobicContact CD1-CG 4.49Å; L217-R422 HydrophobicContact CD2-CB 4.33Å; L217-R422 HydrophobicContact CD2-CG 4Å; L217-L425 HydrophobicContact CD2-CD2 3.54Å; L217-L425 HydrophobicContact CG-CD2 4.17Å
218	I	92.6	Very high	87.2	Confident	3 Å²	3	48 Å²	48	2%	0.015	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-36.5	177.8	-72	164.4	0	0	0	110.7	I216 I220 L221 C222 F316 D347 P349 I408 Q420 V427	I216-I218 PolarHBondContact O-N 2.91Å; I218-I220 VanDerWaalsContact C-N 3.26Å; I218-I220 PolarHBondContact O-N 2.98Å; I218-L221 WeakPolarHBondContact O-CB 3.43Å; I218-L221 PolarHBondContact O-N 3.22Å; I218-L221 VanDerWaalsContact O-N 3.08Å; I218-C222 PolarHBondContact O-N 3.45Å; I218-C222 PolarHBondContact O-SG 2.56Å; I218-C222 VanDerWaalsContact O-SG 3.34Å; I218-F316 HydrophobicContact CG2-CE1 4.27Å; I218-D347 HydrophobicContact CD1-CB 4.14Å; I218-D347 WeakPolarHBondContact CD1-O 3.43Å; I218-P349 HydrophobicContact CG2-CG 4.16Å; I218-I408 HydrophobicContact CD1-CD1 3.38Å; I218-I408 HydrophobicContact CD1-CG1 3.83Å; I218-Q420 HydrophobicContact CD1-CB 4.38Å; I218-V427 HydrophobicContact CD1-CG2 3.72Å
219	S	93.4	Very high	87.6	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-34.8	171.2	54.1	0	0	0	0	113.1	L217 N223 R422	L217-S219 PolarHBondContact O-N 3.49Å; S219-N223 WeakPolarHBondContact O-CB 3.46Å; S219-N223 PolarHBondContact O-N 3.43Å; S219-N223 PolarHBondContact O-ND2 2.78Å; S219-R422 PolarHBondContact OG-NH1 2.77Å
220	I	94.6	Very high	87.9	Confident	54 Å²	54	46.7 Å²	46.7	28%	0.277	22%	0.224	S	C	.	.	H	α-helix	trans	-71.8	-40.7	174.1	-62.7	175.4	0	0	0	110.6	I216 L217 I218 C222 N223 Y224	I216-I220 HydrophobicContact CG2-CB 4.21Å; I216-I220 HydrophobicContact CG2-CG2 4.26Å; L217-I220 HydrophobicContact CB-CB 4.39Å; L217-I220 HydrophobicContact CB-CD1 3.99Å; L217-I220 HydrophobicContact CB-CG1 3.96Å; L217-I220 HydrophobicContact CD1-CD1 4.24Å; L217-I220 HydrophobicContact CG-CD1 4.43Å; L217-I220 WeakPolarHBondContact O-CA 3.29Å; L217-I220 WeakPolarHBondContact O-CB 3.37Å; L217-I220 PolarHBondContact O-N 2.93Å; I218-I220 VanDerWaalsContact C-N 3.26Å; I218-I220 PolarHBondContact O-N 2.98Å; I220-C222 PolarHBondContact O-N 3.44Å; I220-N223 PolarHBondContact O-N 3.19Å; I220-Y224 HydrophobicContact CG2-CD1 4.21Å; I220-Y224 HydrophobicContact CG2-CD2 4.15Å; I220-Y224 HydrophobicContact CG2-CE1 3.69Å; I220-Y224 HydrophobicContact CG2-CE2 3.61Å; I220-Y224 HydrophobicContact CG2-CG 4.43Å; I220-Y224 PolarHBondContact O-N 2.96Å
221	L	95.4	Very high	88.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-42.7	175.8	-59.5	179.9	0	0	0	111.8	L209 I216 L217 I218 Y224 A225 M315 F316	L209-L221 HydrophobicContact CD2-CD2 3.97Å; I216-L221 HydrophobicContact CB-CD2 4.48Å; I216-L221 HydrophobicContact CG2-CD2 3.95Å; I216-L221 HydrophobicContact CG2-CG 4.23Å; L217-L221 PolarHBondContact O-N 3.42Å; L217-L221 VanDerWaalsContact O-N 3.15Å; I218-L221 WeakPolarHBondContact O-CB 3.43Å; I218-L221 PolarHBondContact O-N 3.22Å; I218-L221 VanDerWaalsContact O-N 3.08Å; L221-Y224 PolarHBondContact O-N 3.43Å; L221-A225 WeakPolarHBondContact O-CB 3.48Å; L221-A225 PolarHBondContact O-N 3.24Å; L221-M315 WeakPolarHBondContact O-CE 3.36Å; L221-F316 HydrophobicContact CB-CE1 3.9Å; L221-F316 HydrophobicContact CB-CE2 4.37Å; L221-F316 HydrophobicContact CB-CZ 3.81Å; L221-F316 HydrophobicContact CD1-CD1 4.14Å; L221-F316 HydrophobicContact CD1-CE1 4.27Å
222	C	96.1	Very high	89	Confident	2 Å²	2	33.1 Å²	33.1	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-42.6	173.2	-64.5	0	0	0	0	112	I218 I220 Y224 A225 V226 L381 P382	I218-C222 PolarHBondContact O-N 3.45Å; I218-C222 PolarHBondContact O-SG 2.56Å; I218-C222 VanDerWaalsContact O-SG 3.34Å; I220-C222 PolarHBondContact O-N 3.44Å; C222-Y224 PolarHBondContact O-N 2.81Å; C222-A225 WeakPolarHBondContact O-CB 3.24Å; C222-A225 PolarHBondContact O-N 3.04Å; C222-V226 PolarHBondContact O-N 2.93Å; C222-L381 HydrophobicContact CB-CD2 3.87Å; C222-P382 HydrophobicContact CB-CG 4.4Å
223	N	97	Very high	90.6	Very high	73 Å²	73	27.3 Å²	27.3	39%	0.39	15%	0.148	S	C	.	.	H	α-helix	trans	-64.4	-37.4	175.4	-87.7	-80.6	0	0	0	112.9	S219 I220 Q227	S219-N223 WeakPolarHBondContact O-CB 3.46Å; S219-N223 PolarHBondContact O-N 3.43Å; S219-N223 PolarHBondContact O-ND2 2.78Å; I220-N223 PolarHBondContact O-N 3.19Å; N223-Q227 VanDerWaalsContact O-CG 3.31Å; N223-Q227 WeakPolarHBondContact O-CG 3.44Å; N223-Q227 PolarHBondContact O-N 2.86Å; N223-Q227 VanDerWaalsContact O-N 3.13Å; N223-Q227 PolarHBondContact O-NE2 2.71Å
224	Y	98.2	Very high	92.8	Very high	3 Å²	3	19 Å²	19	1%	0.012	11%	0.108	C	C	.	.	H	α-helix	trans	-66.1	-38.1	171.9	-67.2	-14	0	0	0	111.9	L205 I220 L221 C222 Q227 V228 L252 N255 V258	L205-Y224 HydrophobicContact CD1-CD2 3.63Å; L205-Y224 HydrophobicContact CD1-CE2 3.51Å; L205-Y224 HydrophobicContact CD2-CD2 4.02Å; I220-Y224 HydrophobicContact CG2-CD1 4.21Å; I220-Y224 HydrophobicContact CG2-CD2 4.15Å; I220-Y224 HydrophobicContact CG2-CE1 3.69Å; I220-Y224 HydrophobicContact CG2-CE2 3.61Å; I220-Y224 HydrophobicContact CG2-CG 4.43Å; I220-Y224 PolarHBondContact O-N 2.96Å; L221-Y224 PolarHBondContact O-N 3.43Å; C222-Y224 PolarHBondContact O-N 2.81Å; Y224-Q227 PolarHBondContact O-N 2.9Å; Y224-V228 WeakPolarHBondContact O-CG2 3.36Å; Y224-V228 PolarHBondContact O-N 3.04Å; Y224-L252 HydrophobicContact CE1-CD2 4.18Å; Y224-L252 HydrophobicContact CE2-CD2 4.09Å; Y224-L252 VanDerWaalsContact OH-CD2 3.27Å; Y224-L252 WeakPolarHBondContact OH-CD2 3.2Å; Y224-N255 PolarHBondContact OH-O 2.9Å; Y224-V258 HydrophobicContact CD1-CB 4.35Å; Y224-V258 HydrophobicContact CD1-CG1 3.56Å; Y224-V258 HydrophobicContact CD1-CG2 3.91Å; Y224-V258 HydrophobicContact CD2-CG1 4.11Å; Y224-V258 HydrophobicContact CE1-CG1 3.75Å; Y224-V258 HydrophobicContact CE2-CG1 4.27Å; Y224-V258 HydrophobicContact CG-CG1 3.75Å; Y224-V258 HydrophobicContact CG-CG2 4.15Å
225	A	98.4	Very high	94.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.3	-45	177.6	0	0	0	0	0	111.7	L221 C222 Q227 V228 A229 L312 M315 L377	L221-A225 WeakPolarHBondContact O-CB 3.48Å; L221-A225 PolarHBondContact O-N 3.24Å; C222-A225 WeakPolarHBondContact O-CB 3.24Å; C222-A225 PolarHBondContact O-N 3.04Å; A225-Q227 PolarHBondContact O-N 2.85Å; A225-V228 PolarHBondContact O-N 2.91Å; A225-A229 WeakPolarHBondContact O-CB 3.48Å; A225-A229 PolarHBondContact O-N 3.22Å; A225-L312 HydrophobicContact CB-CD2 3.43Å; A225-L312 VanDerWaalsContact CB-CD2 3.43Å; A225-M315 HydrophobicContact CB-CE 4.16Å; A225-L377 HydrophobicContact CB-CD1 4.25Å
226	V	98.5	Very high	96.1	Very high	16 Å²	16	15.2 Å²	15.2	10%	0.097	8%	0.081	C	C	.	.	H	α-helix	trans	-57.1	-46.3	171.8	168.3	0	0	0	0	111.6	C222 A229 S230 L377 L378 L381	C222-V226 PolarHBondContact O-N 2.93Å; V226-A229 PolarHBondContact O-N 2.81Å; V226-S230 PolarHBondContact O-N 2.83Å; V226-L377 HydrophobicContact CG2-CB 3.67Å; V226-L377 WeakPolarHBondContact CG2-O 3.37Å; V226-L378 HydrophobicContact CG1-CD2 3.63Å; V226-L378 HydrophobicContact CG1-CG 3.84Å; V226-L378 HydrophobicContact CG2-CD2 4.21Å; V226-L378 HydrophobicContact CG2-CG 4.17Å; V226-L381 HydrophobicContact CG2-CD2 4.12Å
227	Q	98.6	Very high	96.6	Very high	30 Å²	30	22 Å²	22	14%	0.14	11%	0.113	C	C	.	.	H	α-helix	trans	-65.6	-43.1	-178.5	-77.5	177.2	66.5	0	0	113	N180 N223 Y224 A225 S230 G231 E256 V258	N180-Q227 HydrophobicContact CB-CB 4.48Å; N180-Q227 WeakPolarHBondContact CB-O 3.45Å; N180-Q227 WeakPolarHBondContact ND2-CB 3.3Å; N180-Q227 WeakPolarHBondContact ND2-CG 3.41Å; N180-Q227 PolarHBondContact ND2-OE1 3.42Å; N223-Q227 VanDerWaalsContact O-CG 3.31Å; N223-Q227 WeakPolarHBondContact O-CG 3.44Å; N223-Q227 PolarHBondContact O-N 2.86Å; N223-Q227 VanDerWaalsContact O-N 3.13Å; N223-Q227 PolarHBondContact O-NE2 2.71Å; Y224-Q227 PolarHBondContact O-N 2.9Å; A225-Q227 PolarHBondContact O-N 2.85Å; Q227-S230 PolarHBondContact O-N 3.17Å; Q227-G231 PolarHBondContact O-N 3.07Å; Q227-E256 PolarHBondContact NE2-O 3.34Å; Q227-V258 HydrophobicContact CB-CG2 3.54Å; Q227-V258 HydrophobicContact CG-CG2 4.36Å
228	V	98.7	Very high	96.6	Very high	1 Å²	1	27 Å²	27	1%	0.006	13%	0.13	C	C	.	.	H	α-helix	trans	-65.6	-42	174.3	175.5	0	0	0	0	110.4	Y224 A225 S230 G231 M232 L245 V250 V258 I260 F308	Y224-V228 WeakPolarHBondContact O-CG2 3.36Å; Y224-V228 PolarHBondContact O-N 3.04Å; A225-V228 PolarHBondContact O-N 2.91Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 3.06Å; V228-G231 PolarHBondContact O-N 3.07Å; V228-M232 HydrophobicContact CG1-CG 4.44Å; V228-M232 WeakPolarHBondContact O-CB 3.22Å; V228-M232 WeakPolarHBondContact O-CG 3.5Å; V228-M232 PolarHBondContact O-N 2.97Å; V228-L245 HydrophobicContact CG1-CD1 4.18Å; V228-V250 HydrophobicContact CG2-CG1 3.81Å; V228-V250 HydrophobicContact CG2-CG2 3.83Å; V228-V258 HydrophobicContact CG2-CG2 4.23Å; V228-I260 HydrophobicContact CG1-CD1 4.02Å; V228-I260 HydrophobicContact CG1-CG1 4.36Å; V228-F308 HydrophobicContact CB-CE2 4.05Å; V228-F308 HydrophobicContact CG1-CD2 3.78Å; V228-F308 HydrophobicContact CG1-CE2 3.74Å
229	A	98.6	Very high	96.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.3	-39.3	174	0	0	0	0	0	112.2	A225 V226 M232 A233 F308 L373 R374 L377	A225-A229 WeakPolarHBondContact O-CB 3.48Å; A225-A229 PolarHBondContact O-N 3.22Å; V226-A229 PolarHBondContact O-N 2.81Å; A229-M232 PolarHBondContact O-N 2.85Å; A229-A233 VanDerWaalsContact O-CB 3.29Å; A229-A233 WeakPolarHBondContact O-CB 3.24Å; A229-A233 PolarHBondContact O-N 3.33Å; A229-F308 HydrophobicContact CB-CE2 4.27Å; A229-F308 HydrophobicContact CB-CZ 3.87Å; A229-L373 HydrophobicContact CB-CB 4.47Å; A229-R374 HydrophobicContact CB-CB 3.97Å; A229-L377 HydrophobicContact CB-CD1 4.11Å
230	S	98.6	Very high	96.6	Very high	27 Å²	27	30.3 Å²	30.3	19%	0.189	14%	0.141	C	C	.	.	H	α-helix	trans	-67.5	-43.2	176	-162.1	0	0	0	0	112.6	H178 V226 Q227 V228 M232 A233 Y234	H178-S230 PolarHBondContact NE2-OG 3.24Å; V226-S230 PolarHBondContact O-N 2.83Å; Q227-S230 PolarHBondContact O-N 3.17Å; V228-S230 VanDerWaalsContact C-N 3.31Å; V228-S230 PolarHBondContact O-N 3.06Å; S230-M232 PolarHBondContact O-N 3.25Å; S230-A233 PolarHBondContact O-N 3.25Å; S230-Y234 PolarHBondContact O-N 3.32Å
231	G	98.1	Very high	96.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-43.9	174.1	0	0	0	0	0	112.4	Q227 V228 Y234 L235	Q227-G231 PolarHBondContact O-N 3.07Å; V228-G231 PolarHBondContact O-N 3.07Å; G231-Y234 PolarHBondContact O-N 3.33Å; G231-L235 PolarHBondContact O-N 2.8Å; G231-L235 VanDerWaalsContact O-N 3.12Å
232	M	98.3	Very high	96.4	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-69.9	-33.1	176	-70.3	-56.3	-57.1	0	0	113.4	V228 A229 S230 Y234 L235 E236 H242 L245 I260 D304 F370	V228-M232 HydrophobicContact CG1-CG 4.44Å; V228-M232 WeakPolarHBondContact O-CB 3.22Å; V228-M232 WeakPolarHBondContact O-CG 3.5Å; V228-M232 PolarHBondContact O-N 2.97Å; A229-M232 PolarHBondContact O-N 2.85Å; S230-M232 PolarHBondContact O-N 3.25Å; M232-Y234 VanDerWaalsContact C-N 3.31Å; M232-Y234 PolarHBondContact O-N 3.3Å; M232-L235 PolarHBondContact O-N 2.92Å; M232-L235 HydrophobicContact SD-CD1 3.94Å; M232-E236 WeakPolarHBondContact O-CB 3.44Å; M232-E236 PolarHBondContact O-N 2.9Å; M232-H242 HydrophobicContact CE-CB 3.84Å; M232-H242 HydrophobicContact SD-CB 4.04Å; M232-L245 HydrophobicContact CE-CD2 4.18Å; M232-L245 HydrophobicContact CG-CD2 3.83Å; M232-L245 HydrophobicContact SD-CD1 4.19Å; M232-L245 HydrophobicContact SD-CD2 3.85Å; M232-I260 HydrophobicContact CG-CD1 3.64Å; M232-I260 HydrophobicContact SD-CD1 3.73Å; M232-D304 HydrophobicContact CE-CB 3.73Å; M232-F370 HydrophobicContact CB-CB 4.26Å; M232-F370 HydrophobicContact CB-CD1 3.34Å; M232-F370 HydrophobicContact CB-CD2 3.83Å; M232-F370 HydrophobicContact CB-CE1 3.41Å; M232-F370 VanDerWaalsContact CB-CE1 3.41Å; M232-F370 HydrophobicContact CB-CE2 3.9Å; M232-F370 HydrophobicContact CB-CG 3.54Å; M232-F370 HydrophobicContact CB-CZ 3.69Å; M232-F370 HydrophobicContact CE-CE1 4.5Å; M232-F370 HydrophobicContact CE-CE2 3.73Å; M232-F370 HydrophobicContact CE-CZ 3.71Å; M232-F370 HydrophobicContact CG-CD1 4.2Å; M232-F370 HydrophobicContact CG-CE1 3.78Å; M232-F370 HydrophobicContact CG-CE2 4.49Å; M232-F370 HydrophobicContact CG-CZ 3.93Å
233	A	97.9	Very high	96.2	Very high	7 Å²	7	28.2 Å²	28.2	6%	0.058	13%	0.129	C	C	.	.	H	α-helix	trans	-63.7	-37	172.6	0	0	0	0	0	112	A229 S230 Q237 F370 I371	A229-A233 VanDerWaalsContact O-CB 3.29Å; A229-A233 WeakPolarHBondContact O-CB 3.24Å; A229-A233 PolarHBondContact O-N 3.33Å; S230-A233 PolarHBondContact O-N 3.25Å; A233-Q237 WeakPolarHBondContact O-CB 3.27Å; A233-Q237 PolarHBondContact O-N 3.15Å; A233-F370 HydrophobicContact CB-CB 3.81Å; A233-I371 HydrophobicContact CB-CG1 4.05Å
234	Y	97.6	Very high	96	Very high	28 Å²	28	25.4 Å²	25.4	11%	0.11	11%	0.114	C	C	.	.	H	α-helix	trans	-65.9	-44.5	172.3	-178.7	-91.9	0	0	0	112	L176 S177 H178 L181 S230 G231 M232 E236 Q237 R238	L176-Y234 HydrophobicContact CB-CE1 4.28Å; L176-Y234 HydrophobicContact CD2-CE1 3.8Å; S177-Y234 PolarHBondContact N-OH 3.44Å; S177-Y234 PolarHBondContact O-OH 2.82Å; H178-Y234 HydrophobicContact CB-CD1 3.82Å; H178-Y234 HydrophobicContact CB-CD2 4.13Å; H178-Y234 HydrophobicContact CB-CE1 4.14Å; H178-Y234 HydrophobicContact CB-CE2 4.44Å; H178-Y234 HydrophobicContact CB-CG 3.81Å; H178-Y234 AromaticContact CD2-CD2 3.9Å; H178-Y234 AromaticContact CD2-CG 3.86Å; H178-Y234 AromaticContact CG-CG 3.94Å; L181-Y234 HydrophobicContact CD1-CD1 3.69Å; L181-Y234 HydrophobicContact CD1-CE1 4.12Å; S230-Y234 PolarHBondContact O-N 3.32Å; G231-Y234 PolarHBondContact O-N 3.33Å; M232-Y234 VanDerWaalsContact C-N 3.31Å; M232-Y234 PolarHBondContact O-N 3.3Å; Y234-E236 PolarHBondContact O-N 3.3Å; Y234-Q237 PolarHBondContact O-N 2.8Å; Y234-R238 HydrophobicContact CD1-CG 4.1Å; Y234-R238 HydrophobicContact CE1-CG 3.73Å; Y234-R238 HydrophobicContact CE2-CG 4.3Å; Y234-R238 WeakPolarHBondContact O-CB 3.4Å; Y234-R238 VanDerWaalsContact O-CG 3.29Å; Y234-R238 WeakPolarHBondContact O-CG 3.43Å; Y234-R238 PolarHBondContact O-N 2.97Å; Y234-R238 PolarHBondContact OH-NE 3.16Å; Y234-R238 PolarHBondContact OH-NH2 3.11Å
235	L	95.4	Very high	95.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.5	-41.5	175.2	-66.9	179.6	0	0	0	112.1	L176 L181 G231 M232 R238 R239 F240 H242 M266	L176-L235 HydrophobicContact CD1-CD2 3.88Å; L176-L235 HydrophobicContact CD2-CD2 4.43Å; L181-L235 HydrophobicContact CD1-CD2 3.72Å; L181-L235 HydrophobicContact CD1-CG 4.1Å; L181-L235 HydrophobicContact CD2-CD1 4.08Å; L181-L235 HydrophobicContact CD2-CD2 4.48Å; L181-L235 HydrophobicContact CD2-CG 4.18Å; G231-L235 PolarHBondContact O-N 2.8Å; G231-L235 VanDerWaalsContact O-N 3.12Å; M232-L235 PolarHBondContact O-N 2.92Å; M232-L235 HydrophobicContact SD-CD1 3.94Å; L235-R238 CarbonylContact O-C 3.6Å; L235-R238 PolarHBondContact O-N 3.01Å; L235-R239 PolarHBondContact O-N 3.31Å; L235-F240 HydrophobicContact CB-CB 4.3Å; L235-F240 HydrophobicContact CD2-CB 4.09Å; L235-F240 PolarHBondContact O-N 2.83Å; L235-H242 HydrophobicContact CD1-CB 4.49Å; L235-M266 HydrophobicContact CD1-SD 3.99Å; L235-M266 HydrophobicContact CD2-SD 3.77Å
236	E	95.4	Very high	95.8	Very high	30 Å²	30	25.2 Å²	25.2	14%	0.14	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-46	173.5	177	160.7	-118.6	0	0	111.7	M232 Y234 R238 R239 H301 F370 R504	M232-E236 WeakPolarHBondContact O-CB 3.44Å; M232-E236 PolarHBondContact O-N 2.9Å; Y234-E236 PolarHBondContact O-N 3.3Å; E236-R238 VanDerWaalsContact C-N 3.29Å; E236-R238 PolarHBondContact O-N 2.8Å; E236-R239 PolarHBondContact O-N 2.83Å; E236-R239 VanDerWaalsContact O-N 3.09Å; E236-H301 HydrophobicContact CG-CB 4.31Å; E236-H301 WeakPolarHBondContact OE1-CB 3.47Å; E236-H301 IonicContact OE1-CG 3.89Å; E236-F370 HydrophobicContact CB-CD2 4.36Å; E236-F370 PolarHBondContact OE2-N 3.34Å; E236-R504 IonicContact OE1-CZ 3.72Å; E236-R504 IonicContact OE1-NH1 2.63Å; E236-R504 PolarHBondContact OE1-NH1 3.38Å; E236-R504 IonicContact OE1-NH2 2.66Å; E236-R504 PolarHBondContact OE1-NH2 2.69Å; E236-R504 IonicContact OE2-NH2 3.62Å
237	Q	94.8	Very high	95.7	Very high	154 Å²	154	24.5 Å²	24.5	72%	0.72	11%	0.109	S	C	*	.	H	α-helix	trans	-61.9	-35.4	174.7	-172.6	-177.7	14	0	0	112.7	A233 Y234 R239	A233-Q237 WeakPolarHBondContact O-CB 3.27Å; A233-Q237 PolarHBondContact O-N 3.15Å; Y234-Q237 PolarHBondContact O-N 2.8Å; Q237-R239 VanDerWaalsContact C-N 3.31Å
238	R	92.9	Very high	95.6	Very high	129 Å²	129	26.2 Å²	26.2	49%	0.487	11%	0.114	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	0	176.2	-65.1	-63.5	-165.9	170.5	9.1	113.9	L176 Y234 L235 E236 F240	L176-R238 HydrophobicContact CD2-CB 3.94Å; L176-R238 HydrophobicContact CD2-CG 3.88Å; Y234-R238 HydrophobicContact CD1-CG 4.1Å; Y234-R238 HydrophobicContact CE1-CG 3.73Å; Y234-R238 HydrophobicContact CE2-CG 4.3Å; Y234-R238 WeakPolarHBondContact O-CB 3.4Å; Y234-R238 VanDerWaalsContact O-CG 3.29Å; Y234-R238 WeakPolarHBondContact O-CG 3.43Å; Y234-R238 PolarHBondContact O-N 2.97Å; Y234-R238 PolarHBondContact OH-NE 3.16Å; Y234-R238 PolarHBondContact OH-NH2 3.11Å; L235-R238 CarbonylContact O-C 3.6Å; L235-R238 PolarHBondContact O-N 3.01Å; E236-R238 VanDerWaalsContact C-N 3.29Å; E236-R238 PolarHBondContact O-N 2.8Å; R238-F240 HydrophobicContact CB-CD2 3.77Å; R238-F240 HydrophobicContact CB-CE2 4.16Å; R238-F240 VanDerWaalsContact O-CD2 3.32Å; R238-F240 WeakPolarHBondContact O-CD2 3.48Å
239	R	92.8	Very high	95.4	Very high	69 Å²	69	27 Å²	27	26%	0.26	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	38	-175.9	-60	-175.5	61.5	79.2	-4.5	114.7	L235 E236 Q237 L269 P270 T273 D274	L235-R239 PolarHBondContact O-N 3.31Å; E236-R239 PolarHBondContact O-N 2.83Å; E236-R239 VanDerWaalsContact O-N 3.09Å; Q237-R239 VanDerWaalsContact C-N 3.31Å; R239-L269 HydrophobicContact CB-CB 4.38Å; R239-L269 WeakPolarHBondContact O-CB 3.48Å; R239-L269 PolarHBondContact O-N 3.45Å; R239-P270 PolarHBondContact NH2-O 2.99Å; R239-P270 VanDerWaalsContact NH2-O 3.09Å; R239-T273 PolarHBondContact NH2-O 3.18Å; R239-D274 IonicContact CZ-OD1 2.82Å; R239-D274 VanDerWaalsContact CZ-OD1 3.23Å; R239-D274 IonicContact NH1-OD1 2.66Å; R239-D274 PolarHBondContact NH1-OD1 2.82Å; R239-D274 IonicContact NH2-OD1 3.86Å; R239-D274 PolarHBondContact NH2-OD1 3.48Å
240	F	92.4	Very high	95.4	Very high	13 Å²	13	27 Å²	27	6%	0.057	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	140	169.3	-75.6	-102.8	0	0	0	111.4	A172 M173 L176 L235 R238 M266 A268 H301	A172-F240 HydrophobicContact CB-CE1 4.25Å; A172-F240 HydrophobicContact CB-CZ 3.76Å; A172-F240 WeakPolarHBondContact O-CZ 3.19Å; M173-F240 HydrophobicContact CG-CE1 4.26Å; L176-F240 HydrophobicContact CD1-CD1 4.15Å; L176-F240 HydrophobicContact CD1-CD2 4.3Å; L176-F240 HydrophobicContact CD1-CE1 4.04Å; L176-F240 HydrophobicContact CD1-CE2 4.23Å; L176-F240 HydrophobicContact CD1-CG 4.25Å; L176-F240 HydrophobicContact CD1-CZ 4.07Å; L176-F240 HydrophobicContact CD2-CD2 3.93Å; L176-F240 HydrophobicContact CD2-CE2 3.72Å; L176-F240 HydrophobicContact CD2-CZ 4.23Å; L176-F240 HydrophobicContact CG-CE2 4.28Å; L176-F240 HydrophobicContact CG-CZ 4.29Å; L235-F240 HydrophobicContact CB-CB 4.3Å; L235-F240 HydrophobicContact CD2-CB 4.09Å; L235-F240 PolarHBondContact O-N 2.83Å; R238-F240 HydrophobicContact CB-CD2 3.77Å; R238-F240 HydrophobicContact CB-CE2 4.16Å; R238-F240 VanDerWaalsContact O-CD2 3.32Å; R238-F240 WeakPolarHBondContact O-CD2 3.48Å; F240-M266 HydrophobicContact CB-CG 4.24Å; F240-M266 HydrophobicContact CB-SD 4.25Å; F240-M266 HydrophobicContact CD1-CE 3.96Å; F240-M266 HydrophobicContact CD1-CG 4.01Å; F240-M266 HydrophobicContact CD1-SD 4.22Å; F240-M266 HydrophobicContact CE1-CE 4.35Å; F240-A268 HydrophobicContact CD1-CB 4.13Å; F240-A268 HydrophobicContact CE1-CB 3.81Å; F240-A268 HydrophobicContact CE2-CB 4.45Å; F240-A268 HydrophobicContact CZ-CB 4Å; F240-H301 PolarHBondContact O-CE1 2.83Å; F240-H301 PolarHBondContact O-ND1 3.1Å
241	L	92.9	Very high	95.3	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.1	168.8	-60.1	-176.1	0	0	0	110	R243 M266 R267 L269 F299 H301 D304	L241-R243 HydrophobicContact CB-CG 3.85Å; L241-M266 CarbonylContact O-C 3.1Å; L241-M266 VanDerWaalsContact O-CA 3.23Å; L241-M266 WeakPolarHBondContact O-CA 3.43Å; L241-M266 VanDerWaalsContact O-CG 3.28Å; L241-M266 WeakPolarHBondContact O-CG 3.13Å; L241-R267 PolarHBondContact N-O 3.43Å; L241-R267 PolarHBondContact O-N 3.29Å; L241-L269 HydrophobicContact CD1-CD1 4.07Å; L241-L269 HydrophobicContact CD1-CD2 3.89Å; L241-L269 HydrophobicContact CD1-CG 3.98Å; L241-L269 HydrophobicContact CD2-CD1 3.8Å; L241-L269 HydrophobicContact CD2-CG 4.4Å; L241-L269 HydrophobicContact CG-CD1 3.82Å; L241-L269 HydrophobicContact CG-CD2 4.34Å; L241-L269 HydrophobicContact CG-CG 3.86Å; L241-F299 HydrophobicContact CD1-CB 3.99Å; L241-F299 WeakPolarHBondContact CD1-O 3.37Å; L241-H301 HydrophobicContact CD2-CB 4.44Å; L241-H301 WeakPolarHBondContact CD2-ND1 3.32Å; L241-D304 VanDerWaalsContact CA-OD2 3.3Å; L241-D304 WeakPolarHBondContact CA-OD2 3.35Å
242	H	93.4	Very high	95.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	12%	0.12	C	C	.	.			trans	-77.3	-42.9	-179.1	-164.2	-87	0	0	0	112.5	M232 L235 D244 L245 I260 G261 D304	M232-H242 HydrophobicContact CE-CB 3.84Å; M232-H242 HydrophobicContact SD-CB 4.04Å; L235-H242 HydrophobicContact CD1-CB 4.49Å; H242-D244 PolarHBondContact CE1-O 2.89Å; H242-D244 VanDerWaalsContact ND1-C 3.32Å; H242-D244 PolarHBondContact ND1-O 3.38Å; H242-D244 PolarHBondContact O-N 2.97Å; H242-L245 PolarHBondContact ND1-N 2.99Å; H242-I260 VanDerWaalsContact NE2-CG2 3.33Å; H242-I260 WeakPolarHBondContact NE2-CG2 3.42Å; H242-G261 PolarHBondContact CE1-O 2.67Å; H242-G261 PolarHBondContact NE2-O 2.97Å; H242-D304 PolarHBondContact N-OD2 3.46Å
243	R	92.1	Very high	95	Very high	12 Å²	12	29 Å²	29	5%	0.045	13%	0.129	C	C	.	.	S	Bend	trans	62.8	-13.6	173.7	-59.9	169.5	47.3	-145.2	0.4	117.4	L241 L265 M278 F299 D304 M307	L241-R243 HydrophobicContact CB-CG 3.85Å; R243-L265 HydrophobicContact CB-CB 4.06Å; R243-L265 VanDerWaalsContact CD-O 3.29Å; R243-L265 WeakPolarHBondContact CD-O 3.4Å; R243-L265 VanDerWaalsContact CZ-O 3.3Å; R243-L265 PolarHBondContact NH1-O 2.9Å; R243-M278 VanDerWaalsContact NH2-CG 3.26Å; R243-M278 PolarHBondContact NH2-SD 2.88Å; R243-F299 HydrophobicContact CB-CD1 4.06Å; R243-F299 HydrophobicContact CB-CE1 4.29Å; R243-F299 HydrophobicContact CG-CB 3.94Å; R243-F299 HydrophobicContact CG-CD1 3.75Å; R243-F299 HydrophobicContact CG-CE1 4.43Å; R243-F299 HydrophobicContact CG-CG 3.86Å; R243-D304 PolarHBondContact N-OD1 3.16Å; R243-M307 VanDerWaalsContact O-CE 3.24Å; R243-M307 WeakPolarHBondContact O-CE 3.32Å
244	D	92.2	Very high	94.8	Very high	13 Å²	13	31.4 Å²	31.4	7%	0.07	14%	0.143	C	C	.	.			trans	-134.7	46.4	172.8	-164	25.4	0	0	0	111.7	H242 A246 R248 N249 L265 P285	H242-D244 PolarHBondContact CE1-O 2.89Å; H242-D244 VanDerWaalsContact ND1-C 3.32Å; H242-D244 PolarHBondContact ND1-O 3.38Å; H242-D244 PolarHBondContact O-N 2.97Å; D244-A246 PolarHBondContact O-N 3.18Å; D244-R248 IonicContact OD1-CZ 2.98Å; D244-R248 IonicContact OD1-NE 2.93Å; D244-R248 IonicContact OD1-NH2 3.58Å; D244-R248 PolarHBondContact OD1-NH2 3.38Å; D244-R248 IonicContact OD2-NE 2.76Å; D244-N249 PolarHBondContact O-ND2 3.09Å; D244-N249 PolarHBondContact OD2-ND2 2.7Å; D244-L265 HydrophobicContact CB-CD1 4.2Å; D244-P285 WeakPolarHBondContact OD1-CG 3.43Å
245	L	96.5	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.159	C	C	.	.			trans	-78.5	119.1	178.1	-178.6	65.2	0	0	0	110.2	V228 M232 H242 I260 M307 F308 T311	V228-L245 HydrophobicContact CG1-CD1 4.18Å; M232-L245 HydrophobicContact CE-CD2 4.18Å; M232-L245 HydrophobicContact CG-CD2 3.83Å; M232-L245 HydrophobicContact SD-CD1 4.19Å; M232-L245 HydrophobicContact SD-CD2 3.85Å; H242-L245 PolarHBondContact ND1-N 2.99Å; L245-I260 HydrophobicContact CD1-CD1 4.5Å; L245-I260 HydrophobicContact CD1-CG2 4Å; L245-M307 HydrophobicContact CB-CB 3.88Å; L245-M307 HydrophobicContact CB-SD 4.45Å; L245-F308 HydrophobicContact CD2-CB 3.77Å; L245-F308 HydrophobicContact CD2-CD2 4.32Å; L245-T311 PolarHBondContact O-OG1 3.4Å
246	A	96.6	Very high	94.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.193	C	C	.	.	S	Bend	trans	-163	160.5	-177.5	0	0	0	0	0	110.1	D244 R248 N249 V250 W288 T311	D244-A246 PolarHBondContact O-N 3.18Å; A246-R248 HydrophobicContact CB-CG 3.72Å; A246-R248 PolarHBondContact O-N 3.5Å; A246-R248 VanDerWaalsContact O-N 3.13Å; A246-N249 PolarHBondContact O-N 2.99Å; A246-V250 PolarHBondContact O-N 2.97Å; A246-W288 HydrophobicContact CB-CD2 4.25Å; A246-W288 HydrophobicContact CB-CG 4.21Å; A246-W288 HydrophobicContact CB-CZ2 4.36Å; A246-W288 VanDerWaalsContact CB-NE1 3.3Å; A246-T311 WeakPolarHBondContact CA-OG1 3.44Å
247	A	96.7	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.4	-177.7	0	0	0	0	0	113.9	L206 N249 T311 E314	L206-A247 HydrophobicContact CB-CB 4.1Å; L206-A247 HydrophobicContact CD1-CB 4.45Å; L206-A247 PolarHBondContact N-O 3.23Å; L206-A247 VanDerWaalsContact N-O 3.1Å; A247-N249 VanDerWaalsContact C-N 3.28Å; A247-N249 PolarHBondContact O-N 2.86Å; A247-T311 HydrophobicContact CB-CG2 4.47Å; A247-E314 HydrophobicContact CB-CB 3.8Å; A247-E314 HydrophobicContact CB-CG 4.32Å; A247-E314 WeakPolarHBondContact CB-OE1 3.26Å; A247-E314 PolarHBondContact N-OE2 2.96Å
248	R	94.6	Very high	94.6	Very high	67 Å²	67	34.8 Å²	34.8	25%	0.253	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.1	168.4	53.6	163.9	177.4	-71.7	-8.4	113.6	S204 L206 D244 A246 P285	S204-R248 WeakPolarHBondContact CB-O 3.44Å; L206-R248 HydrophobicContact CD2-CB 4.04Å; D244-R248 IonicContact OD1-CZ 2.98Å; D244-R248 IonicContact OD1-NE 2.93Å; D244-R248 IonicContact OD1-NH2 3.58Å; D244-R248 PolarHBondContact OD1-NH2 3.38Å; D244-R248 IonicContact OD2-NE 2.76Å; A246-R248 HydrophobicContact CB-CG 3.72Å; A246-R248 PolarHBondContact O-N 3.5Å; A246-R248 VanDerWaalsContact O-N 3.13Å; R248-P285 VanDerWaalsContact NH2-CB 3.25Å
249	N	95.6	Very high	94.9	Very high	16 Å²	16	29.6 Å²	29.6	9%	0.086	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-2	-173.7	-67.5	-8.2	0	0	0	111.8	D244 A246 A247 G261	D244-N249 PolarHBondContact O-ND2 3.09Å; D244-N249 PolarHBondContact OD2-ND2 2.7Å; A246-N249 PolarHBondContact O-N 2.99Å; A247-N249 VanDerWaalsContact C-N 3.28Å; A247-N249 PolarHBondContact O-N 2.86Å; N249-G261 PolarHBondContact O-N 3.12Å
250	V	97.6	Very high	95.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118.2	163.1	-178.7	0	0	0	0	107.6	L205 V228 A246 V258 T311	L205-V250 HydrophobicContact CB-CB 4.11Å; L205-V250 HydrophobicContact CB-CG1 4.1Å; L205-V250 WeakPolarHBondContact CB-O 3.37Å; L205-V250 HydrophobicContact CD2-CB 4.22Å; L205-V250 HydrophobicContact CD2-CG1 3.8Å; L205-V250 PolarHBondContact N-O 3.3Å; V228-V250 HydrophobicContact CG2-CG1 3.81Å; V228-V250 HydrophobicContact CG2-CG2 3.83Å; A246-V250 PolarHBondContact O-N 2.97Å; V250-V258 HydrophobicContact CG1-CB 3.73Å; V250-V258 HydrophobicContact CG1-CG1 3.97Å; V250-V258 HydrophobicContact CG1-CG2 4.31Å; V250-T311 HydrophobicContact CG2-CG2 4.26Å
251	L	96.8	Very high	95	Very high	42 Å²	42	25.7 Å²	25.7	22%	0.22	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.6	-175.6	-51.9	-174.7	0	0	0	111.6	I182 A200 G203 V258 K259	I182-L251 HydrophobicContact CD1-CB 4.38Å; I182-L251 HydrophobicContact CD1-CD1 4.04Å; I182-L251 HydrophobicContact CG1-CD1 4.1Å; A200-L251 HydrophobicContact CB-CB 3.55Å; A200-L251 HydrophobicContact CB-CD1 4.11Å; A200-L251 HydrophobicContact CB-CG 4.48Å; G203-L251 WeakPolarHBondContact O-CA 3.3Å; L251-V258 CarbonylContact O-C 3.57Å; L251-V258 WeakPolarHBondContact O-CA 3.5Å; L251-K259 PolarHBondContact N-O 3.3Å; L251-K259 PolarHBondContact O-N 3.03Å
252	L	95.9	Very high	94.2	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	109	-177.3	-74.4	156.9	0	0	0	110.7	A200 L202 G203 L205 R208 Y224 V258	A200-L252 CarbonylContact C-O 3.45Å; L202-L252 HydrophobicContact CB-CB 3.64Å; L202-L252 HydrophobicContact CD1-CB 4.42Å; L202-L252 PolarHBondContact N-O 3.1Å; G203-L252 PolarHBondContact O-N 2.97Å; L205-L252 HydrophobicContact CD1-CD1 4.33Å; R208-L252 HydrophobicContact CB-CD1 3.39Å; R208-L252 HydrophobicContact CG-CD1 3.65Å; Y224-L252 HydrophobicContact CE1-CD2 4.18Å; Y224-L252 HydrophobicContact CE2-CD2 4.09Å; Y224-L252 VanDerWaalsContact OH-CD2 3.27Å; Y224-L252 WeakPolarHBondContact OH-CD2 3.2Å; L252-V258 HydrophobicContact CD2-CG1 3.52Å; L252-V258 HydrophobicContact CG-CG1 4.21Å
253	S	94.5	Very high	92.9	Very high	29 Å²	29	28.8 Å²	28.8	20%	0.203	15%	0.147	C	C	.	.	S	Bend	trans	-77.2	-40.7	173.1	-174.8	0	0	0	0	110.4	T257	S253-T257 PolarHBondContact N-O 2.83Å
254	T	95	Very high	91.5	Very high	58 Å²	58	29.7 Å²	29.7	36%	0.356	16%	0.16	S	C	.	.	S	Bend	trans	-138.5	-177.3	171.3	73.6	0	0	0	0	109.5	L202 E256 T257	L202-T254 VanDerWaalsContact CD1-C 3.41Å; T254-E256 PolarHBondContact O-N 3.17Å; T254-E256 PolarHBondContact OG1-N 3.03Å; T254-E256 VanDerWaalsContact OG1-N 3.07Å; T254-T257 PolarHBondContact N-O 2.98Å; T254-T257 WeakPolarHBondContact OG1-CB 3.45Å; T254-T257 PolarHBondContact OG1-N 3.2Å; T254-T257 PolarHBondContact OG1-OG1 3.09Å; T254-T257 VanDerWaalsContact OG1-OG1 3.11Å
255	N	91.3	Very high	90.3	Very high	82 Å²	82	29.7 Å²	29.7	44%	0.439	16%	0.16	S	C	.	.	S	Bend	trans	-71	-3	170.9	-73.5	-69.8	0	0	0	113.6	R208 Y224	R208-N255 VanDerWaalsContact CZ-OD1 3.31Å; R208-N255 PolarHBondContact NH1-OD1 3.5Å; R208-N255 PolarHBondContact NH2-OD1 2.84Å; Y224-N255 PolarHBondContact OH-O 2.9Å
256	E	92.8	Very high	89.6	Confident	154 Å²	154	29.9 Å²	29.9	72%	0.72	16%	0.161	S	C	*	.	S	Bend	trans	-125.8	-22.7	-176.9	-63.8	175.7	172.7	0	0	112	Q227 T254	Q227-E256 PolarHBondContact NE2-O 3.34Å; T254-E256 PolarHBondContact O-N 3.17Å; T254-E256 PolarHBondContact OG1-N 3.03Å; T254-E256 VanDerWaalsContact OG1-N 3.07Å
257	T	96.3	Very high	89	Confident	46 Å²	46	32.1 Å²	32.1	28%	0.282	17%	0.17	S	C	.	.			trans	-111.7	115.9	-174.3	-47.5	0	0	0	0	111.8	S253 T254	S253-T257 PolarHBondContact N-O 2.83Å; T254-T257 PolarHBondContact N-O 2.98Å; T254-T257 WeakPolarHBondContact OG1-CB 3.45Å; T254-T257 PolarHBondContact OG1-N 3.2Å; T254-T257 PolarHBondContact OG1-OG1 3.09Å; T254-T257 VanDerWaalsContact OG1-OG1 3.11Å
258	V	98.2	Very high	88.3	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	147.6	171.2	-72.1	0	0	0	0	112.1	N180 Y224 Q227 V228 V250 L251 L252	N180-V258 PolarHBondContact ND2-O 3.02Å; Y224-V258 HydrophobicContact CD1-CB 4.35Å; Y224-V258 HydrophobicContact CD1-CG1 3.56Å; Y224-V258 HydrophobicContact CD1-CG2 3.91Å; Y224-V258 HydrophobicContact CD2-CG1 4.11Å; Y224-V258 HydrophobicContact CE1-CG1 3.75Å; Y224-V258 HydrophobicContact CE2-CG1 4.27Å; Y224-V258 HydrophobicContact CG-CG1 3.75Å; Y224-V258 HydrophobicContact CG-CG2 4.15Å; Q227-V258 HydrophobicContact CB-CG2 3.54Å; Q227-V258 HydrophobicContact CG-CG2 4.36Å; V228-V258 HydrophobicContact CG2-CG2 4.23Å; V250-V258 HydrophobicContact CG1-CB 3.73Å; V250-V258 HydrophobicContact CG1-CG1 3.97Å; V250-V258 HydrophobicContact CG1-CG2 4.31Å; L251-V258 CarbonylContact O-C 3.57Å; L251-V258 WeakPolarHBondContact O-CA 3.5Å; L252-V258 HydrophobicContact CD2-CG1 3.52Å; L252-V258 HydrophobicContact CG-CG1 4.21Å
259	K	98.3	Very high	87.7	Confident	20 Å²	20	31.4 Å²	31.4	9%	0.087	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.2	179.7	-69.1	-175.2	166.1	-123.1	0	110.6	P179 N180 L181 I182 E198 L251	P179-K259 WeakPolarHBondContact O-CE 3.27Å; P179-K259 WeakPolarHBondContact O-CG 3.44Å; P179-K259 PolarHBondContact O-NZ 2.76Å; N180-K259 CarbonylContact O-C 3.58Å; N180-K259 WeakPolarHBondContact O-CA 3.4Å; L181-K259 WeakPolarHBondContact O-CD 3.47Å; L181-K259 PolarHBondContact O-NZ 2.57Å; L181-K259 VanDerWaalsContact O-NZ 3.1Å; I182-K259 HydrophobicContact CD1-CB 3.73Å; I182-K259 HydrophobicContact CD1-CD 3.97Å; I182-K259 HydrophobicContact CG1-CB 3.93Å; E198-K259 WeakPolarHBondContact OE1-CD 3.4Å; E198-K259 WeakPolarHBondContact OE1-CE 3.34Å; E198-K259 IonicContact OE1-NZ 2.7Å; E198-K259 PolarHBondContact OE1-NZ 3.13Å; E198-K259 IonicContact OE2-NZ 3.17Å; E198-K259 PolarHBondContact OE2-NZ 2.87Å; L251-K259 PolarHBondContact N-O 3.3Å; L251-K259 PolarHBondContact O-N 3.03Å
260	I	97.3	Very high	87	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	133.6	174.4	-44.5	174.3	0	0	0	109	N180 L181 I182 V228 M232 H242 L245	N180-I260 PolarHBondContact O-N 2.96Å; L181-I260 HydrophobicContact CD2-CB 3.88Å; L181-I260 HydrophobicContact CD2-CD1 4.16Å; L181-I260 HydrophobicContact CD2-CG1 4.28Å; I182-I260 WeakPolarHBondContact CG1-O 3.34Å; I182-I260 PolarHBondContact N-O 2.86Å; V228-I260 HydrophobicContact CG1-CD1 4.02Å; V228-I260 HydrophobicContact CG1-CG1 4.36Å; M232-I260 HydrophobicContact CG-CD1 3.64Å; M232-I260 HydrophobicContact SD-CD1 3.73Å; H242-I260 VanDerWaalsContact NE2-CG2 3.33Å; H242-I260 WeakPolarHBondContact NE2-CG2 3.42Å; L245-I260 HydrophobicContact CD1-CD1 4.5Å; L245-I260 HydrophobicContact CD1-CG2 4Å
261	G	90.4	Very high	86	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.229	C	C	.	.			trans	-140	-164.4	179.9	0	0	0	0	0	113.1	H242 N249	H242-G261 PolarHBondContact CE1-O 2.67Å; H242-G261 PolarHBondContact NE2-O 2.97Å; N249-G261 PolarHBondContact O-N 3.12Å
262	D	76.8	Confident	85.1	Confident	50 Å²	50	44.7 Å²	44.7	27%	0.267	25%	0.251	S	S	.	.			trans	43.2	74.9	-160.4	-157.7	-9	0	0	0	115.5	K151 G264	K151-D262 IonicContact NZ-OD1 2.71Å; K151-D262 PolarHBondContact NZ-OD1 2.79Å; K151-D262 IonicContact NZ-OD2 3.68Å; K151-D262 PolarHBondContact NZ-OD2 2.95Å; D262-G264 PolarHBondContact O-N 3.48Å; D262-G264 WeakPolarHBondContact OD1-CA 3.25Å; D262-G264 PolarHBondContact OD1-N 3.34Å
263	F	65.8	Low	84.5	Confident	14 Å²	14	46.9 Å²	46.9	6%	0.061	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-70.7	12.2	170.7	-49.8	-51.9	0	0	0	114.9	M173 I182 L265 M266	M173-F263 HydrophobicContact CE-CB 3.44Å; M173-F263 VanDerWaalsContact CE-CB 3.44Å; M173-F263 HydrophobicContact CE-CD2 4.13Å; M173-F263 HydrophobicContact CE-CG 4.13Å; M173-F263 HydrophobicContact SD-CB 4.38Å; I182-F263 HydrophobicContact CB-CE2 4.2Å; I182-F263 HydrophobicContact CB-CZ 4.15Å; I182-F263 HydrophobicContact CG2-CE2 4.36Å; I182-F263 WeakPolarHBondContact O-CE2 3.5Å; I182-F263 VanDerWaalsContact O-CZ 3.25Å; I182-F263 WeakPolarHBondContact O-CZ 3.22Å; F263-L265 PolarHBondContact O-N 3.02Å; F263-M266 HydrophobicContact CB-CB 3.91Å; F263-M266 HydrophobicContact CB-CE 3.96Å; F263-M266 HydrophobicContact CD1-CB 4.39Å; F263-M266 HydrophobicContact CD1-CE 3.47Å; F263-M266 VanDerWaalsContact CD1-CE 3.47Å; F263-M266 HydrophobicContact CD1-SD 3.53Å; F263-M266 VanDerWaalsContact CD1-SD 3.53Å; F263-M266 HydrophobicContact CE1-CE 4.1Å; F263-M266 HydrophobicContact CE1-SD 4.09Å; F263-M266 HydrophobicContact CG-CE 3.72Å; F263-M266 HydrophobicContact CG-SD 4.31Å; F263-M266 WeakPolarHBondContact O-CB 3.47Å; F263-M266 PolarHBondContact O-N 2.93Å
264	G	63.2	Low	84	Confident	31 Å²	31	50 Å²	50	32%	0.32	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-63.5	-11.2	-175.9	0	0	0	0	0	115.9	D262	D262-G264 PolarHBondContact O-N 3.48Å; D262-G264 WeakPolarHBondContact OD1-CA 3.25Å; D262-G264 PolarHBondContact OD1-N 3.34Å
265	L	66.8	Low	83.7	Confident	13 Å²	13	52.7 Å²	52.7	7%	0.068	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-121.7	6	167.1	-69.1	179.8	0	0	0	113.1	F130 R243 D244 F263 R267	F130-L265 HydrophobicContact CE1-CD2 3.78Å; F130-L265 HydrophobicContact CE1-CG 4.04Å; F130-L265 HydrophobicContact CE2-CD1 4.41Å; F130-L265 HydrophobicContact CE2-CG 4.06Å; F130-L265 HydrophobicContact CZ-CD1 3.77Å; F130-L265 HydrophobicContact CZ-CD2 3.63Å; F130-L265 HydrophobicContact CZ-CG 3.4Å; R243-L265 HydrophobicContact CB-CB 4.06Å; R243-L265 VanDerWaalsContact CD-O 3.29Å; R243-L265 WeakPolarHBondContact CD-O 3.4Å; R243-L265 VanDerWaalsContact CZ-O 3.3Å; R243-L265 PolarHBondContact NH1-O 2.9Å; D244-L265 HydrophobicContact CB-CD1 4.2Å; F263-L265 PolarHBondContact O-N 3.02Å; L265-R267 PolarHBondContact O-N 3.2Å
266	M	82.3	Confident	83.5	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.025	28%	0.276	C	S	.	.			trans	-71.8	128.7	-174.7	-166.1	171.5	66.7	0	0	110.5	M173 L176 L235 F240 L241 F263	M173-M266 HydrophobicContact CG-CE 3.72Å; L176-M266 HydrophobicContact CD1-CE 3.33Å; L176-M266 HydrophobicContact CD1-SD 4.29Å; L235-M266 HydrophobicContact CD1-SD 3.99Å; L235-M266 HydrophobicContact CD2-SD 3.77Å; F240-M266 HydrophobicContact CB-CG 4.24Å; F240-M266 HydrophobicContact CB-SD 4.25Å; F240-M266 HydrophobicContact CD1-CE 3.96Å; F240-M266 HydrophobicContact CD1-CG 4.01Å; F240-M266 HydrophobicContact CD1-SD 4.22Å; F240-M266 HydrophobicContact CE1-CE 4.35Å; L241-M266 CarbonylContact O-C 3.1Å; L241-M266 VanDerWaalsContact O-CA 3.23Å; L241-M266 WeakPolarHBondContact O-CA 3.43Å; L241-M266 VanDerWaalsContact O-CG 3.28Å; L241-M266 WeakPolarHBondContact O-CG 3.13Å; F263-M266 HydrophobicContact CB-CB 3.91Å; F263-M266 HydrophobicContact CB-CE 3.96Å; F263-M266 HydrophobicContact CD1-CB 4.39Å; F263-M266 HydrophobicContact CD1-CE 3.47Å; F263-M266 VanDerWaalsContact CD1-CE 3.47Å; F263-M266 HydrophobicContact CD1-SD 3.53Å; F263-M266 VanDerWaalsContact CD1-SD 3.53Å; F263-M266 HydrophobicContact CE1-CE 4.1Å; F263-M266 HydrophobicContact CE1-SD 4.09Å; F263-M266 HydrophobicContact CG-CE 3.72Å; F263-M266 HydrophobicContact CG-SD 4.31Å; F263-M266 WeakPolarHBondContact O-CB 3.47Å; F263-M266 PolarHBondContact O-N 2.93Å
267	R	82.3	Confident	83.3	Confident	47 Å²	47	48.9 Å²	48.9	18%	0.177	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.3	-175	-171.3	67.5	-177.9	-157.2	5.4	111.2	D165 E169 L241 L265 Y276	D165-R267 IonicContact OD2-CZ 3.33Å; D165-R267 IonicContact OD2-NH1 3.23Å; D165-R267 PolarHBondContact OD2-NH1 2.99Å; D165-R267 IonicContact OD2-NH2 3.77Å; D165-R267 PolarHBondContact OD2-NH2 3.05Å; E169-R267 VanDerWaalsContact CD-NH1 3.3Å; E169-R267 WeakPolarHBondContact OE1-CD 3.49Å; E169-R267 IonicContact OE1-CZ 2.67Å; E169-R267 VanDerWaalsContact OE1-CZ 3.32Å; E169-R267 IonicContact OE1-NE 3.32Å; E169-R267 PolarHBondContact OE1-NE 3.02Å; E169-R267 IonicContact OE1-NH1 2.73Å; E169-R267 PolarHBondContact OE1-NH1 2.81Å; E169-R267 IonicContact OE2-NH1 3.58Å; L241-R267 PolarHBondContact N-O 3.43Å; L241-R267 PolarHBondContact O-N 3.29Å; L265-R267 PolarHBondContact O-N 3.2Å; R267-Y276 HydrophobicContact CG-CD2 4.25Å; R267-Y276 HydrophobicContact CG-CE2 4.36Å; R267-Y276 HydrophobicContact CG-CG 4.41Å
268	A	83.4	Confident	82.6	Confident	36 Å²	36	46.9 Å²	46.9	30%	0.298	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	130.9	168.5	0	0	0	0	0	110.4	F240	F240-A268 HydrophobicContact CD1-CB 4.13Å; F240-A268 HydrophobicContact CE1-CB 3.81Å; F240-A268 HydrophobicContact CE2-CB 4.45Å; F240-A268 HydrophobicContact CZ-CB 4Å
269	L	81.8	Confident	81.6	Confident	15 Å²	15	53 Å²	53	8%	0.079	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-83.3	131.6	175.8	-81.1	172.3	0	0	0	111.5	R239 L241	R239-L269 HydrophobicContact CB-CB 4.38Å; R239-L269 WeakPolarHBondContact O-CB 3.48Å; R239-L269 PolarHBondContact O-N 3.45Å; L241-L269 HydrophobicContact CD1-CD1 4.07Å; L241-L269 HydrophobicContact CD1-CD2 3.89Å; L241-L269 HydrophobicContact CD1-CG 3.98Å; L241-L269 HydrophobicContact CD2-CD1 3.8Å; L241-L269 HydrophobicContact CD2-CG 4.4Å; L241-L269 HydrophobicContact CG-CD1 3.82Å; L241-L269 HydrophobicContact CG-CD2 4.34Å; L241-L269 HydrophobicContact CG-CG 3.86Å
270	P	80	Confident	80.2	Confident	60 Å²	60	59.2 Å²	59.2	39%	0.39	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-51.9	147.2	166.5	-24.1	31.5	0	0	0	112.5	R239 H272 T273	R239-P270 PolarHBondContact NH2-O 2.99Å; R239-P270 VanDerWaalsContact NH2-O 3.09Å; P270-H272 PolarHBondContact O-N 3.24Å; P270-T273 WeakPolarHBondContact CB-OG1 3.38Å; P270-T273 WeakPolarHBondContact CD-OG1 3.32Å; P270-T273 PolarHBondContact O-N 3.03Å; P270-T273 VanDerWaalsContact O-N 3.11Å; P270-T273 VanDerWaalsContact O-O 3.13Å; P270-T273 PolarHBondContact O-OG1 2.83Å
271	T	77	Confident	78.6	Confident	134 Å²	134	62 Å²	62	82%	0.822	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.2	-176.3	-36	0	0	0	0	113.8
272	H	77	Confident	77.7	Confident	144 Å²	144	66.8 Å²	66.8	67%	0.667	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	8.8	-175.6	54.6	-93.4	0	0	0	113.8	P270	P270-H272 PolarHBondContact O-N 3.24Å
273	T	83.8	Confident	77.6	Confident	46 Å²	46	72.4 Å²	72.4	28%	0.282	39%	0.386	S	S	.	.			trans	-138.4	123.6	178.2	55.7	0	0	0	0	111.9	R239 P270 Q275	R239-T273 PolarHBondContact NH2-O 3.18Å; P270-T273 WeakPolarHBondContact CB-OG1 3.38Å; P270-T273 WeakPolarHBondContact CD-OG1 3.32Å; P270-T273 PolarHBondContact O-N 3.03Å; P270-T273 VanDerWaalsContact O-N 3.11Å; P270-T273 VanDerWaalsContact O-O 3.13Å; P270-T273 PolarHBondContact O-OG1 2.83Å; T273-Q275 VanDerWaalsContact C-N 3.32Å
274	D	84.3	Confident	78.4	Confident	95 Å²	95	72.7 Å²	72.7	51%	0.508	39%	0.388	S	S	.	.	S	Bend	trans	-90.9	7.1	174.9	-65.9	-34	0	0	0	113.6	R239 S300	R239-D274 IonicContact CZ-OD1 2.82Å; R239-D274 VanDerWaalsContact CZ-OD1 3.23Å; R239-D274 IonicContact NH1-OD1 2.66Å; R239-D274 PolarHBondContact NH1-OD1 2.82Å; R239-D274 IonicContact NH2-OD1 3.86Å; R239-D274 PolarHBondContact NH2-OD1 3.48Å; D274-S300 WeakPolarHBondContact O-CB 3.4Å
275	Q	89	Confident	79.6	Confident	114 Å²	114	72.1 Å²	72.1	53%	0.533	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151	178.1	65.5	178.9	2.6	0	0	111.7	T273 T298 F299	T273-Q275 VanDerWaalsContact C-N 3.32Å; Q275-T298 HydrophobicContact CB-CG2 4.07Å; Q275-F299 CarbonylContact C-O 3.44Å; Q275-F299 VanDerWaalsContact CA-O 3.3Å; Q275-F299 WeakPolarHBondContact CA-O 3.44Å
276	Y	87.4	Confident	80.8	Confident	50 Å²	50	76.4 Å²	76.4	20%	0.196	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.3	172.8	169.2	-102.7	0	0	0	109.3	R267 M278 F299	R267-Y276 HydrophobicContact CG-CD2 4.25Å; R267-Y276 HydrophobicContact CG-CE2 4.36Å; R267-Y276 HydrophobicContact CG-CG 4.41Å; Y276-M278 HydrophobicContact CD1-CB 4.39Å; Y276-M278 HydrophobicContact CE1-CB 3.7Å; Y276-M278 HydrophobicContact CE1-CG 4.08Å; Y276-F299 HydrophobicContact CD1-CD2 4.49Å; Y276-F299 PolarHBondContact N-O 3.34Å; Y276-F299 PolarHBondContact O-N 3.02Å
277	I	87.9	Confident	81.5	Confident	105 Å²	105	77.3 Å²	77.3	54%	0.538	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	121.4	175.4	-57.4	177.5	0	0	0	107.6	R297	I277-R297 WeakPolarHBondContact CA-O 3.45Å
278	M	82.7	Confident	82.2	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.02	40%	0.399	C	S	.	.			trans	-89.5	138.2	-175.1	-171.5	-163.5	74.2	0	0	112.1	R243 Y276 H282 I284 R297 F299	R243-M278 VanDerWaalsContact NH2-CG 3.26Å; R243-M278 PolarHBondContact NH2-SD 2.88Å; Y276-M278 HydrophobicContact CD1-CB 4.39Å; Y276-M278 HydrophobicContact CE1-CB 3.7Å; Y276-M278 HydrophobicContact CE1-CG 4.08Å; M278-H282 HydrophobicContact CE-CB 3.7Å; M278-H282 WeakPolarHBondContact CE-O 3.29Å; M278-H282 HydrophobicContact CG-CB 4.23Å; M278-H282 HydrophobicContact SD-CB 3.6Å; M278-H282 VanDerWaalsContact SD-CB 3.6Å; M278-I284 HydrophobicContact CE-CG2 3.29Å; M278-I284 HydrophobicContact SD-CG2 3.86Å; M278-R297 HydrophobicContact CB-CB 4.21Å; M278-R297 HydrophobicContact CE-CG 4.37Å; M278-R297 PolarHBondContact N-O 3.45Å; M278-R297 WeakPolarHBondContact O-CB 3.43Å; M278-R297 WeakPolarHBondContact O-CD 3.15Å; M278-F299 HydrophobicContact CB-CD2 4.02Å; M278-F299 HydrophobicContact CB-CE2 3.69Å; M278-F299 HydrophobicContact CE-CE2 4.46Å; M278-F299 HydrophobicContact CG-CE2 4.45Å; M278-F299 HydrophobicContact SD-CE2 4Å; M278-F299 HydrophobicContact SD-CZ 4.41Å
279	E	76.7	Confident	82.8	Confident	130 Å²	130	74.7 Å²	74.7	61%	0.607	39%	0.386	S	S	*	.			trans	-71.5	168.5	-168.3	-59.8	-158.4	162.4	0	0	116.8	G281 R297	E279-G281 PolarHBondContact O-N 2.93Å; E279-R297 PolarHBondContact O-NH1 3.49Å
280	E	69.1	Low	83.5	Confident	150 Å²	150	74 Å²	74	70%	0.701	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	40.3	172.6	53	161.7	92.6	0	0	119.1
281	G	63.7	Low	84.3	Confident	60 Å²	60	71.3 Å²	71.3	62%	0.619	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	177.3	-19.4	174.8	0	0	0	0	0	118.7	E279	E279-G281 PolarHBondContact O-N 2.93Å
282	H	70.1	Confident	85.2	Confident	99 Å²	99	66.3 Å²	66.3	46%	0.458	33%	0.332	S	S	.	.			trans	-68.1	139.9	-178.8	-62.5	-89.9	0	0	0	112	M278	M278-H282 HydrophobicContact CE-CB 3.7Å; M278-H282 WeakPolarHBondContact CE-O 3.29Å; M278-H282 HydrophobicContact CG-CB 4.23Å; M278-H282 HydrophobicContact SD-CB 3.6Å; M278-H282 VanDerWaalsContact SD-CB 3.6Å
283	K	74.8	Confident	86	Confident	169 Å²	169	59.4 Å²	59.4	74%	0.735	30%	0.3	S	S	*	.			trans	-73.9	143.5	173.3	-63.9	-173.2	177.7	-173	0	110.2	T129	T129-K283 HydrophobicContact CG2-CD 4.41Å
284	I	82.6	Confident	86.4	Confident	20 Å²	20	58.6 Å²	58.6	10%	0.103	29%	0.294	C	S	.	.			trans	-126.8	151.2	178.9	67.3	179.8	0	0	0	111	M278 F286 F299	M278-I284 HydrophobicContact CE-CG2 3.29Å; M278-I284 HydrophobicContact SD-CG2 3.86Å; I284-F286 VanDerWaalsContact C-N 3.34Å; I284-F286 HydrophobicContact CD1-CD1 3.85Å; I284-F286 HydrophobicContact CD1-CE1 3.75Å; I284-F286 HydrophobicContact CG1-CD1 3.65Å; I284-F286 HydrophobicContact CG1-CE1 3.55Å; I284-F286 HydrophobicContact CG1-CG 4.29Å; I284-F286 HydrophobicContact CG1-CZ 4.13Å; I284-F286 PolarHBondContact O-N 2.89Å; I284-F299 HydrophobicContact CG2-CZ 4.07Å
285	P	89.3	Confident	86.7	Confident	19 Å²	19	59.2 Å²	59.2	12%	0.123	29%	0.292	C	S	.	.			trans	-79.8	75.8	-179.9	35.2	-39.2	0	0	0	111.1	D244 R248 P287 W288 C289	D244-P285 WeakPolarHBondContact OD1-CG 3.43Å; R248-P285 VanDerWaalsContact NH2-CB 3.25Å; P285-P287 VanDerWaalsContact C-CD 3.45Å; P285-P287 VanDerWaalsContact C-N 3.34Å; P285-W288 HydrophobicContact CB-CB 4.41Å; P285-W288 HydrophobicContact CB-CE3 3.9Å; P285-W288 HydrophobicContact CG-CB 4.38Å; P285-W288 PolarHBondContact O-N 3.28Å; P285-C289 PolarHBondContact O-N 2.8Å; P285-C289 PolarHBondContact O-SG 2.89Å
286	F	92.6	Very high	86.8	Confident	103 Å²	103	56.7 Å²	56.7	45%	0.452	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-43.7	-44.1	-168.9	-58.8	-74.1	0	0	0	116.1	I284 W288 C289 L294 I331	I284-F286 VanDerWaalsContact C-N 3.34Å; I284-F286 HydrophobicContact CD1-CD1 3.85Å; I284-F286 HydrophobicContact CD1-CE1 3.75Å; I284-F286 HydrophobicContact CG1-CD1 3.65Å; I284-F286 HydrophobicContact CG1-CE1 3.55Å; I284-F286 HydrophobicContact CG1-CG 4.29Å; I284-F286 HydrophobicContact CG1-CZ 4.13Å; I284-F286 PolarHBondContact O-N 2.89Å; F286-W288 VanDerWaalsContact C-N 3.26Å; F286-W288 PolarHBondContact O-N 3.48Å; F286-C289 PolarHBondContact O-N 2.89Å; F286-L294 HydrophobicContact CB-CD2 4.29Å; F286-L294 HydrophobicContact CD1-CD2 3.75Å; F286-I331 HydrophobicContact CB-CD1 4.4Å
287	P	96.3	Very high	87	Confident	23 Å²	23	57.8 Å²	57.8	15%	0.149	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65.5	-19.7	178.7	-23.2	35.4	0	0	0	116.3	P285 P322 I331	P285-P287 VanDerWaalsContact C-CD 3.45Å; P285-P287 VanDerWaalsContact C-N 3.34Å; P287-P322 HydrophobicContact CB-CB 4.34Å; P287-P322 HydrophobicContact CB-CG 3.94Å; P287-P322 WeakPolarHBondContact CB-O 3.42Å; P287-I331 HydrophobicContact CB-CD1 4.32Å; P287-I331 HydrophobicContact CG-CD1 3.99Å
288	W	97.1	Very high	87.2	Confident	26 Å²	26	53.6 Å²	53.6	10%	0.098	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-97.3	-14.3	176.9	-67.2	-101.1	0	0	0	112.7	A246 P285 F286 W306 M307 V310 E314 P322	A246-W288 HydrophobicContact CB-CD2 4.25Å; A246-W288 HydrophobicContact CB-CG 4.21Å; A246-W288 HydrophobicContact CB-CZ2 4.36Å; A246-W288 VanDerWaalsContact CB-NE1 3.3Å; P285-W288 HydrophobicContact CB-CB 4.41Å; P285-W288 HydrophobicContact CB-CE3 3.9Å; P285-W288 HydrophobicContact CG-CB 4.38Å; P285-W288 PolarHBondContact O-N 3.28Å; F286-W288 VanDerWaalsContact C-N 3.26Å; F286-W288 PolarHBondContact O-N 3.48Å; W288-W306 VanDerWaalsContact O-CD1 3.32Å; W288-M307 HydrophobicContact CB-CG 4.27Å; W288-M307 WeakPolarHBondContact O-CG 3.48Å; W288-V310 HydrophobicContact CG-CB 4.45Å; W288-V310 HydrophobicContact CG-CG1 4.01Å; W288-E314 HydrophobicContact CZ2-CG 4.48Å; W288-E314 WeakPolarHBondContact CZ2-OE1 3.47Å; W288-E314 VanDerWaalsContact NE1-CD 3.34Å; W288-E314 PolarHBondContact NE1-OE2 3.17Å; W288-P322 HydrophobicContact CD2-CG 4.37Å; W288-P322 HydrophobicContact CH2-CG 3.99Å; W288-P322 HydrophobicContact CZ2-CG 3.68Å; W288-P322 HydrophobicContact CZ3-CG 4.48Å
289	C	96.1	Very high	87.8	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.02	27%	0.269	C	S	.	.			trans	-72.3	139.1	-174.4	-73.5	0	0	0	0	112.7	P285 F286 L294 W306	P285-C289 PolarHBondContact O-N 2.8Å; P285-C289 PolarHBondContact O-SG 2.89Å; F286-C289 PolarHBondContact O-N 2.89Å; C289-L294 HydrophobicContact CB-CD2 3.61Å; C289-L294 HydrophobicContact CB-CG 3.75Å; C289-W306 PolarHBondContact O-NE1 3.24Å
290	A	97.1	Very high	88.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.246	C	C	.	.			trans	-70	158.3	170.2	0	0	0	0	0	111.7	E292 S293 L294 W306	A290-E292 VanDerWaalsContact C-N 3.28Å; A290-E292 VanDerWaalsContact CB-CD 3.48Å; A290-E292 VanDerWaalsContact CB-OE1 3.32Å; A290-E292 WeakPolarHBondContact CB-OE1 3.43Å; A290-E292 WeakPolarHBondContact CB-OE2 3.43Å; A290-E292 PolarHBondContact O-N 2.83Å; A290-S293 WeakPolarHBondContact O-CA 3.47Å; A290-S293 WeakPolarHBondContact O-CB 3.37Å; A290-S293 PolarHBondContact O-N 3.11Å; A290-L294 PolarHBondContact O-N 3.13Å; A290-W306 HydrophobicContact CB-CB 3.74Å; A290-W306 HydrophobicContact CB-CD2 3.92Å; A290-W306 HydrophobicContact CB-CE3 4.26Å; A290-W306 HydrophobicContact CB-CG 3.66Å
291	P	95.9	Very high	90	Very high	4 Å²	4	41.8 Å²	41.8	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-54.2	-38.8	179.9	-29.5	37.6	0	0	0	114.2	S293 L294 K295 W306 L332 V335 D336	P291-S293 VanDerWaalsContact C-N 3.34Å; P291-L294 PolarHBondContact O-N 2.99Å; P291-K295 WeakPolarHBondContact O-CB 3.49Å; P291-K295 VanDerWaalsContact O-CG 3.25Å; P291-K295 WeakPolarHBondContact O-CG 3.37Å; P291-K295 PolarHBondContact O-N 2.75Å; P291-W306 HydrophobicContact CG-CH2 4.02Å; P291-W306 HydrophobicContact CG-CZ2 4.5Å; P291-W306 HydrophobicContact CG-CZ3 4.09Å; P291-L332 HydrophobicContact CB-CD1 4.37Å; P291-V335 HydrophobicContact CG-CG1 3.7Å; P291-D336 HydrophobicContact CB-CB 4.43Å
292	E	95	Very high	91.6	Very high	28 Å²	28	39.3 Å²	39.3	13%	0.131	19%	0.19	C	C	.	.	H	α-helix	trans	-68.5	-31.5	175.6	70	-79.6	-173.1	0	0	113.2	A290 S296 R297 T298 P364 R367	A290-E292 VanDerWaalsContact C-N 3.28Å; A290-E292 VanDerWaalsContact CB-CD 3.48Å; A290-E292 VanDerWaalsContact CB-OE1 3.32Å; A290-E292 WeakPolarHBondContact CB-OE1 3.43Å; A290-E292 WeakPolarHBondContact CB-OE2 3.43Å; A290-E292 PolarHBondContact O-N 2.83Å; E292-S296 PolarHBondContact O-N 2.84Å; E292-S296 PolarHBondContact O-OG 3.39Å; E292-S296 VanDerWaalsContact O-OG 3.07Å; E292-R297 PolarHBondContact O-N 2.83Å; E292-T298 PolarHBondContact O-N 2.78Å; E292-P364 HydrophobicContact CG-CG 4.41Å; E292-R367 IonicContact OE1-CZ 2.64Å; E292-R367 IonicContact OE1-NH1 3.23Å; E292-R367 PolarHBondContact OE1-NH1 3.08Å; E292-R367 IonicContact OE1-NH2 3.7Å; E292-R367 PolarHBondContact OE1-NH2 3.46Å; E292-R367 IonicContact OE2-CZ 3.76Å; E292-R367 IonicContact OE2-NH1 3.39Å; E292-R367 IonicContact OE2-NH2 3.24Å; E292-R367 PolarHBondContact OE2-NH2 3.22Å
293	S	94.6	Very high	93	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-73.6	-34.1	174.9	-48.9	0	0	0	0	111.6	A290 P291 R297 T298 S303	A290-S293 WeakPolarHBondContact O-CA 3.47Å; A290-S293 WeakPolarHBondContact O-CB 3.37Å; A290-S293 PolarHBondContact O-N 3.11Å; P291-S293 VanDerWaalsContact C-N 3.34Å; S293-R297 VanDerWaalsContact O-CA 3.24Å; S293-R297 WeakPolarHBondContact O-CA 3.15Å; S293-R297 PolarHBondContact O-N 3.26Å; S293-T298 VanDerWaalsContact CA-O 3.26Å; S293-T298 WeakPolarHBondContact CA-O 3.47Å; S293-T298 WeakPolarHBondContact CB-O 3.24Å; S293-T298 PolarHBondContact N-O 3.15Å; S293-T298 PolarHBondContact OG-O 2.8Å; S293-S303 WeakPolarHBondContact OG-CB 3.44Å
294	L	92.3	Very high	94.1	Very high	29 Å²	29	26.5 Å²	26.5	15%	0.152	13%	0.133	C	C	.	.	H	α-helix	trans	-71.5	-44.1	173.2	-67.3	175.1	0	0	0	112.2	F286 C289 A290 P291 I331 L332	F286-L294 HydrophobicContact CB-CD2 4.29Å; F286-L294 HydrophobicContact CD1-CD2 3.75Å; C289-L294 HydrophobicContact CB-CD2 3.61Å; C289-L294 HydrophobicContact CB-CG 3.75Å; A290-L294 PolarHBondContact O-N 3.13Å; P291-L294 PolarHBondContact O-N 2.99Å; L294-I331 HydrophobicContact CD1-CG2 4.17Å; L294-L332 HydrophobicContact CB-CB 4.42Å; L294-L332 HydrophobicContact CB-CD1 4.05Å; L294-L332 HydrophobicContact CB-CD2 4.37Å; L294-L332 HydrophobicContact CD1-CB 4.06Å; L294-L332 HydrophobicContact CD1-CD1 4.29Å
295	K	91.6	Very high	94.8	Very high	107 Å²	107	25.6 Å²	25.6	47%	0.465	13%	0.128	S	C	.	.	H	α-helix	trans	-71.7	-45.6	-177	-76.7	170.1	169.3	175.6	0	114.5	P291 L332 D336	P291-K295 WeakPolarHBondContact O-CB 3.49Å; P291-K295 VanDerWaalsContact O-CG 3.25Å; P291-K295 WeakPolarHBondContact O-CG 3.37Å; P291-K295 PolarHBondContact O-N 2.75Å; K295-L332 HydrophobicContact CD-CD1 4.47Å; K295-L332 HydrophobicContact CG-CD1 3.94Å; K295-L332 HydrophobicContact CG-CD2 3.92Å; K295-D336 VanDerWaalsContact CE-CG 3.44Å; K295-D336 WeakPolarHBondContact CE-OD1 3.17Å; K295-D336 WeakPolarHBondContact CE-OD2 3.4Å; K295-D336 IonicContact NZ-OD1 3.58Å; K295-D336 PolarHBondContact NZ-OD1 3.41Å; K295-D336 IonicContact NZ-OD2 2.56Å; K295-D336 PolarHBondContact NZ-OD2 3.43Å
296	S	89.9	Confident	95.3	Very high	61 Å²	61	24.9 Å²	24.9	43%	0.427	12%	0.123	S	C	.	.	H	α-helix	trans	-136.4	10.6	-167.7	56	0	0	0	0	114.1	E292 T298	E292-S296 PolarHBondContact O-N 2.84Å; E292-S296 PolarHBondContact O-OG 3.39Å; E292-S296 VanDerWaalsContact O-OG 3.07Å; S296-T298 PolarHBondContact O-N 2.85Å; S296-T298 VanDerWaalsContact O-N 3.15Å; S296-T298 PolarHBondContact OG-OG1 2.81Å
297	R	90.9	Very high	95.6	Very high	74 Å²	74	20 Å²	20	28%	0.279	10%	0.102	S	C	.	.			trans	54.4	29.7	-176.4	-59	-177.5	-177.1	-169.5	6.1	113.1	I277 M278 E279 E292 S293 F299	I277-R297 WeakPolarHBondContact CA-O 3.45Å; M278-R297 HydrophobicContact CB-CB 4.21Å; M278-R297 HydrophobicContact CE-CG 4.37Å; M278-R297 PolarHBondContact N-O 3.45Å; M278-R297 WeakPolarHBondContact O-CB 3.43Å; M278-R297 WeakPolarHBondContact O-CD 3.15Å; E279-R297 PolarHBondContact O-NH1 3.49Å; E292-R297 PolarHBondContact O-N 2.83Å; S293-R297 VanDerWaalsContact O-CA 3.24Å; S293-R297 WeakPolarHBondContact O-CA 3.15Å; S293-R297 PolarHBondContact O-N 3.26Å; R297-F299 VanDerWaalsContact O-CD2 3.22Å; R297-F299 WeakPolarHBondContact O-CD2 3.38Å; R297-F299 WeakPolarHBondContact O-CE2 3.14Å
298	T	93.1	Very high	95.7	Very high	16 Å²	16	18.9 Å²	18.9	10%	0.098	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	127.9	175.1	-51.5	0	0	0	0	109.3	Q275 E292 S293 S296	Q275-T298 HydrophobicContact CB-CG2 4.07Å; E292-T298 PolarHBondContact O-N 2.78Å; S293-T298 VanDerWaalsContact CA-O 3.26Å; S293-T298 WeakPolarHBondContact CA-O 3.47Å; S293-T298 WeakPolarHBondContact CB-O 3.24Å; S293-T298 PolarHBondContact N-O 3.15Å; S293-T298 PolarHBondContact OG-O 2.8Å; S296-T298 PolarHBondContact O-N 2.85Å; S296-T298 VanDerWaalsContact O-N 3.15Å; S296-T298 PolarHBondContact OG-OG1 2.81Å
299	F	94.4	Very high	95.7	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.009	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143	174.1	-63.6	-90	0	0	0	109.9	L241 R243 Q275 Y276 M278 I284 R297 S303 M307	L241-F299 HydrophobicContact CD1-CB 3.99Å; L241-F299 WeakPolarHBondContact CD1-O 3.37Å; R243-F299 HydrophobicContact CB-CD1 4.06Å; R243-F299 HydrophobicContact CB-CE1 4.29Å; R243-F299 HydrophobicContact CG-CB 3.94Å; R243-F299 HydrophobicContact CG-CD1 3.75Å; R243-F299 HydrophobicContact CG-CE1 4.43Å; R243-F299 HydrophobicContact CG-CG 3.86Å; Q275-F299 CarbonylContact C-O 3.44Å; Q275-F299 VanDerWaalsContact CA-O 3.3Å; Q275-F299 WeakPolarHBondContact CA-O 3.44Å; Y276-F299 HydrophobicContact CD1-CD2 4.49Å; Y276-F299 PolarHBondContact N-O 3.34Å; Y276-F299 PolarHBondContact O-N 3.02Å; M278-F299 HydrophobicContact CB-CD2 4.02Å; M278-F299 HydrophobicContact CB-CE2 3.69Å; M278-F299 HydrophobicContact CE-CE2 4.46Å; M278-F299 HydrophobicContact CG-CE2 4.45Å; M278-F299 HydrophobicContact SD-CE2 4Å; M278-F299 HydrophobicContact SD-CZ 4.41Å; I284-F299 HydrophobicContact CG2-CZ 4.07Å; R297-F299 VanDerWaalsContact O-CD2 3.22Å; R297-F299 WeakPolarHBondContact O-CD2 3.38Å; R297-F299 WeakPolarHBondContact O-CE2 3.14Å; F299-S303 WeakPolarHBondContact CA-OG 3.44Å; F299-M307 HydrophobicContact CD1-CE 4.14Å; F299-M307 HydrophobicContact CE1-CE 3.85Å
300	S	95.9	Very high	95.9	Very high	18 Å²	18	17.6 Å²	17.6	13%	0.126	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	171.3	178.6	66	0	0	0	0	109.4	D274 A302 S303 D304	D274-S300 WeakPolarHBondContact O-CB 3.4Å; S300-A302 PolarHBondContact O-N 3.3Å; S300-A302 PolarHBondContact OG-N 2.96Å; S300-S303 PolarHBondContact N-OG 3.16Å; S300-S303 PolarHBondContact O-N 3.06Å; S300-S303 PolarHBondContact O-OG 3.04Å; S300-S303 PolarHBondContact OG-N 3.38Å; S300-D304 PolarHBondContact O-N 3.24Å
301	H	96.9	Very high	95.9	Very high	17 Å²	17	17.6 Å²	17.6	8%	0.079	9%	0.089	C	C	.	.	H	α-helix	trans	-59.9	-23.4	175.2	-57.2	-66.4	0	0	0	112.1	E236 F240 L241 T305 R504	E236-H301 HydrophobicContact CG-CB 4.31Å; E236-H301 WeakPolarHBondContact OE1-CB 3.47Å; E236-H301 IonicContact OE1-CG 3.89Å; F240-H301 PolarHBondContact O-CE1 2.83Å; F240-H301 PolarHBondContact O-ND1 3.1Å; L241-H301 HydrophobicContact CD2-CB 4.44Å; L241-H301 WeakPolarHBondContact CD2-ND1 3.32Å; H301-T305 PolarHBondContact O-N 3.42Å; H301-T305 PolarHBondContact O-OG1 3.28Å; H301-R504 PolarHBondContact O-NH2 3.13Å
302	A	97.9	Very high	96.1	Very high	7 Å²	7	17.4 Å²	17.4	6%	0.058	9%	0.088	C	C	.	.	H	α-helix	trans	-75.9	-27.2	172.8	0	0	0	0	0	113.7	S300 T305 W306 P364 R367	S300-A302 PolarHBondContact O-N 3.3Å; S300-A302 PolarHBondContact OG-N 2.96Å; A302-T305 WeakPolarHBondContact O-CB 3.27Å; A302-W306 PolarHBondContact O-N 3.28Å; A302-P364 HydrophobicContact CB-CB 3.72Å; A302-P364 WeakPolarHBondContact CB-O 3.46Å; A302-R367 VanDerWaalsContact O-CD 3.24Å; A302-R367 WeakPolarHBondContact O-CD 3.32Å; A302-R367 PolarHBondContact O-NH1 2.89Å
303	S	97.8	Very high	96.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-75.9	-35.8	169.4	68.8	0	0	0	0	111.2	S293 F299 S300 T305 W306 M307	S293-S303 WeakPolarHBondContact OG-CB 3.44Å; F299-S303 WeakPolarHBondContact CA-OG 3.44Å; S300-S303 PolarHBondContact N-OG 3.16Å; S300-S303 PolarHBondContact O-N 3.06Å; S300-S303 PolarHBondContact O-OG 3.04Å; S300-S303 PolarHBondContact OG-N 3.38Å; S303-T305 VanDerWaalsContact C-N 3.26Å; S303-T305 PolarHBondContact O-N 2.89Å; S303-W306 WeakPolarHBondContact O-CB 3.24Å; S303-W306 PolarHBondContact O-N 3.05Å; S303-W306 VanDerWaalsContact O-N 3.16Å; S303-M307 WeakPolarHBondContact O-CG 3.38Å; S303-M307 PolarHBondContact O-N 3.39Å; S303-M307 VanDerWaalsContact O-N 3.08Å
304	D	97.9	Very high	96.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.4	-34.5	170.1	-70.2	-18	0	0	0	111.2	M232 L241 H242 R243 S300 W306 M307 F308 F370	M232-D304 HydrophobicContact CE-CB 3.73Å; L241-D304 VanDerWaalsContact CA-OD2 3.3Å; L241-D304 WeakPolarHBondContact CA-OD2 3.35Å; H242-D304 PolarHBondContact N-OD2 3.46Å; R243-D304 PolarHBondContact N-OD1 3.16Å; S300-D304 PolarHBondContact O-N 3.24Å; D304-W306 VanDerWaalsContact C-N 3.32Å; D304-W306 PolarHBondContact O-N 2.75Å; D304-M307 WeakPolarHBondContact O-CB 3.32Å; D304-M307 PolarHBondContact O-N 2.83Å; D304-F308 PolarHBondContact O-N 3.45Å; D304-F370 HydrophobicContact CB-CE2 4.05Å; D304-F370 HydrophobicContact CB-CZ 4.18Å
305	T	98.6	Very high	96.5	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-62.5	-37.2	172.8	-58.7	0	0	0	0	112.1	H301 A302 S303 F308 G309 C359 R367 P368 L373 R504	H301-T305 PolarHBondContact O-N 3.42Å; H301-T305 PolarHBondContact O-OG1 3.28Å; A302-T305 WeakPolarHBondContact O-CB 3.27Å; S303-T305 VanDerWaalsContact C-N 3.26Å; S303-T305 PolarHBondContact O-N 2.89Å; T305-F308 WeakPolarHBondContact O-CB 3.49Å; T305-F308 PolarHBondContact O-N 3.35Å; T305-G309 PolarHBondContact O-N 3.2Å; T305-G309 VanDerWaalsContact O-N 3.16Å; T305-C359 HydrophobicContact CG2-CB 4.24Å; T305-C359 WeakPolarHBondContact O-CB 3.43Å; T305-R367 HydrophobicContact CG2-CB 4.01Å; T305-P368 HydrophobicContact CG2-CG 4.21Å; T305-L373 HydrophobicContact CG2-CD1 4Å; T305-R504 PolarHBondContact OG1-NH2 3.08Å
306	W	98.6	Very high	96.7	Very high	4 Å²	4	10.3 Å²	10.3	2%	0.015	6%	0.055	C	C	.	.	H	α-helix	trans	-63.8	-47.8	173	-177.7	-72.7	0	0	0	111.5	W288 C289 A290 P291 A302 S303 D304 F308 G309 V310 V335 W360	W288-W306 VanDerWaalsContact O-CD1 3.32Å; C289-W306 PolarHBondContact O-NE1 3.24Å; A290-W306 HydrophobicContact CB-CB 3.74Å; A290-W306 HydrophobicContact CB-CD2 3.92Å; A290-W306 HydrophobicContact CB-CE3 4.26Å; A290-W306 HydrophobicContact CB-CG 3.66Å; P291-W306 HydrophobicContact CG-CH2 4.02Å; P291-W306 HydrophobicContact CG-CZ2 4.5Å; P291-W306 HydrophobicContact CG-CZ3 4.09Å; A302-W306 PolarHBondContact O-N 3.28Å; S303-W306 WeakPolarHBondContact O-CB 3.24Å; S303-W306 PolarHBondContact O-N 3.05Å; S303-W306 VanDerWaalsContact O-N 3.16Å; D304-W306 VanDerWaalsContact C-N 3.32Å; D304-W306 PolarHBondContact O-N 2.75Å; W306-F308 VanDerWaalsContact C-N 3.26Å; W306-F308 PolarHBondContact O-N 2.73Å; W306-G309 WeakPolarHBondContact O-CA 3.4Å; W306-G309 PolarHBondContact O-N 3.44Å; W306-V310 PolarHBondContact O-N 2.82Å; W306-V310 VanDerWaalsContact O-N 3.13Å; W306-V335 HydrophobicContact CH2-CG1 3.26Å; W306-V335 HydrophobicContact CZ2-CG1 3.3Å; W306-V335 HydrophobicContact CZ3-CG1 4.45Å; W306-W360 AromaticContact CD2-CD1 3.74Å; W306-W360 HydrophobicContact CD2-CG 4.49Å; W306-W360 AromaticContact CE2-CD1 3.63Å; W306-W360 HydrophobicContact CE3-CB 4.2Å; W306-W360 HydrophobicContact CH2-CB 3.77Å; W306-W360 HydrophobicContact CH2-CG 4.34Å; W306-W360 HydrophobicContact CZ2-CB 4.13Å; W306-W360 AromaticContact CZ2-CD1 3.96Å; W306-W360 HydrophobicContact CZ2-CG 4.2Å; W306-W360 VanDerWaalsContact CZ3-C 3.45Å; W306-W360 VanDerWaalsContact CZ3-CA 3.44Å; W306-W360 HydrophobicContact CZ3-CB 3.84Å; W306-W360 VanDerWaalsContact CZ3-O 3.26Å; W306-W360 WeakPolarHBondContact CZ3-O 3.44Å; W306-W360 AromaticContact NE1-CD1 3.95Å; W306-W360 PolarHBondContact O-NE1 3.07Å
307	M	98.5	Very high	96.9	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-58.8	-37	176.5	-68	171.2	-179	0	0	112	R243 L245 W288 F299 S303 D304 V310 T311	R243-M307 VanDerWaalsContact O-CE 3.24Å; R243-M307 WeakPolarHBondContact O-CE 3.32Å; L245-M307 HydrophobicContact CB-CB 3.88Å; L245-M307 HydrophobicContact CB-SD 4.45Å; W288-M307 HydrophobicContact CB-CG 4.27Å; W288-M307 WeakPolarHBondContact O-CG 3.48Å; F299-M307 HydrophobicContact CD1-CE 4.14Å; F299-M307 HydrophobicContact CE1-CE 3.85Å; S303-M307 WeakPolarHBondContact O-CG 3.38Å; S303-M307 PolarHBondContact O-N 3.39Å; S303-M307 VanDerWaalsContact O-N 3.08Å; D304-M307 WeakPolarHBondContact O-CB 3.32Å; D304-M307 PolarHBondContact O-N 2.83Å; M307-V310 PolarHBondContact O-N 2.7Å; M307-T311 WeakPolarHBondContact O-CB 3.39Å; M307-T311 PolarHBondContact O-N 2.85Å; M307-T311 PolarHBondContact O-OG1 3.15Å
308	F	98.8	Very high	97	Very high	1 Å²	1	6.6 Å²	6.6	0%	0.004	4%	0.035	C	C	.	.	H	α-helix	trans	-62.4	-42.7	172.7	178.3	-109.4	0	0	0	112	V228 A229 L245 D304 T305 W306 V310 T311 L312 F370 L373 L377	V228-F308 HydrophobicContact CB-CE2 4.05Å; V228-F308 HydrophobicContact CG1-CD2 3.78Å; V228-F308 HydrophobicContact CG1-CE2 3.74Å; A229-F308 HydrophobicContact CB-CE2 4.27Å; A229-F308 HydrophobicContact CB-CZ 3.87Å; L245-F308 HydrophobicContact CD2-CB 3.77Å; L245-F308 HydrophobicContact CD2-CD2 4.32Å; D304-F308 PolarHBondContact O-N 3.45Å; T305-F308 WeakPolarHBondContact O-CB 3.49Å; T305-F308 PolarHBondContact O-N 3.35Å; W306-F308 VanDerWaalsContact C-N 3.26Å; W306-F308 PolarHBondContact O-N 2.73Å; F308-V310 VanDerWaalsContact C-N 3.31Å; F308-V310 PolarHBondContact O-N 3.42Å; F308-T311 WeakPolarHBondContact O-CB 3.4Å; F308-T311 PolarHBondContact O-N 2.79Å; F308-T311 VanDerWaalsContact O-N 3.11Å; F308-L312 HydrophobicContact CD1-CD1 4.14Å; F308-L312 HydrophobicContact CD1-CG 4.36Å; F308-L312 HydrophobicContact CE1-CD1 3.63Å; F308-L312 HydrophobicContact CE1-CD2 4.3Å; F308-L312 HydrophobicContact CE1-CG 4Å; F308-L312 HydrophobicContact CE2-CD2 4.05Å; F308-L312 HydrophobicContact CE2-CG 4.26Å; F308-L312 HydrophobicContact CZ-CD1 3.96Å; F308-L312 HydrophobicContact CZ-CD2 3.77Å; F308-L312 HydrophobicContact CZ-CG 3.94Å; F308-L312 WeakPolarHBondContact O-CG 3.36Å; F308-L312 PolarHBondContact O-N 3.16Å; F308-F370 HydrophobicContact CB-CE1 3.67Å; F308-F370 HydrophobicContact CB-CZ 4.05Å; F308-F370 HydrophobicContact CD1-CE1 4.13Å; F308-F370 HydrophobicContact CD2-CE1 4.21Å; F308-F370 AromaticContact CG-CE1 3.75Å; F308-F370 HydrophobicContact CG-CE1 3.75Å; F308-L373 HydrophobicContact CD1-CD1 3.73Å; F308-L373 HydrophobicContact CE1-CB 4.35Å; F308-L373 HydrophobicContact CE1-CD1 3.91Å; F308-L373 HydrophobicContact CE1-CD2 4.23Å; F308-L373 HydrophobicContact CE1-CG 4.41Å; F308-L377 HydrophobicContact CE1-CD1 4.06Å; F308-L377 HydrophobicContact CZ-CD1 3.74Å
309	G	98.6	Very high	97	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-56.9	-42.5	172.4	0	0	0	0	0	112.9	T305 W306 L312 W313 W360	T305-G309 PolarHBondContact O-N 3.2Å; T305-G309 VanDerWaalsContact O-N 3.16Å; W306-G309 WeakPolarHBondContact O-CA 3.4Å; W306-G309 PolarHBondContact O-N 3.44Å; G309-L312 PolarHBondContact O-N 3.17Å; G309-W313 PolarHBondContact O-N 3.06Å; G309-W313 VanDerWaalsContact O-N 3.08Å; G309-W360 WeakPolarHBondContact O-CZ2 3.26Å
310	V	98.7	Very high	97	Very high	1 Å²	1	11.1 Å²	11.1	1%	0.006	6%	0.056	C	C	.	.	H	α-helix	trans	-68.6	-36.3	174.7	-174.5	0	0	0	0	111.8	W288 W306 M307 F308 W313 E314 P322 L342 W360	W288-V310 HydrophobicContact CG-CB 4.45Å; W288-V310 HydrophobicContact CG-CG1 4.01Å; W306-V310 PolarHBondContact O-N 2.82Å; W306-V310 VanDerWaalsContact O-N 3.13Å; M307-V310 PolarHBondContact O-N 2.7Å; F308-V310 VanDerWaalsContact C-N 3.31Å; F308-V310 PolarHBondContact O-N 3.42Å; V310-W313 WeakPolarHBondContact O-CB 3.24Å; V310-W313 PolarHBondContact O-N 2.69Å; V310-W313 VanDerWaalsContact O-N 3.16Å; V310-E314 PolarHBondContact O-N 3.46Å; V310-P322 HydrophobicContact CG1-CB 3.77Å; V310-P322 HydrophobicContact CG1-CG 3.74Å; V310-L342 HydrophobicContact CG1-CD1 4.21Å; V310-W360 HydrophobicContact CG2-CZ2 4.35Å
311	T	98.6	Very high	96.9	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-65.2	-40.4	175.8	-55.3	0	0	0	0	111.7	L245 A246 A247 V250 M307 F308 W313 E314 M315	L245-T311 PolarHBondContact O-OG1 3.4Å; A246-T311 WeakPolarHBondContact CA-OG1 3.44Å; A247-T311 HydrophobicContact CB-CG2 4.47Å; V250-T311 HydrophobicContact CG2-CG2 4.26Å; M307-T311 WeakPolarHBondContact O-CB 3.39Å; M307-T311 PolarHBondContact O-N 2.85Å; M307-T311 PolarHBondContact O-OG1 3.15Å; F308-T311 WeakPolarHBondContact O-CB 3.4Å; F308-T311 PolarHBondContact O-N 2.79Å; F308-T311 VanDerWaalsContact O-N 3.11Å; T311-W313 VanDerWaalsContact C-N 3.33Å; T311-E314 PolarHBondContact O-N 3.46Å; T311-M315 HydrophobicContact CG2-SD 4.39Å; T311-M315 VanDerWaalsContact O-CG 3.29Å; T311-M315 WeakPolarHBondContact O-CG 3.4Å; T311-M315 PolarHBondContact O-N 3.09Å; T311-M315 VanDerWaalsContact O-N 3.08Å
312	L	98.4	Very high	96.9	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.9	-44.2	170.6	-67.1	-179.6	0	0	0	110.5	A225 F308 G309 E314 M315 F316 V355 M356	A225-L312 HydrophobicContact CB-CD2 3.43Å; A225-L312 VanDerWaalsContact CB-CD2 3.43Å; F308-L312 HydrophobicContact CD1-CD1 4.14Å; F308-L312 HydrophobicContact CD1-CG 4.36Å; F308-L312 HydrophobicContact CE1-CD1 3.63Å; F308-L312 HydrophobicContact CE1-CD2 4.3Å; F308-L312 HydrophobicContact CE1-CG 4Å; F308-L312 HydrophobicContact CE2-CD2 4.05Å; F308-L312 HydrophobicContact CE2-CG 4.26Å; F308-L312 HydrophobicContact CZ-CD1 3.96Å; F308-L312 HydrophobicContact CZ-CD2 3.77Å; F308-L312 HydrophobicContact CZ-CG 3.94Å; F308-L312 WeakPolarHBondContact O-CG 3.36Å; F308-L312 PolarHBondContact O-N 3.16Å; G309-L312 PolarHBondContact O-N 3.17Å; L312-E314 PolarHBondContact O-N 3.47Å; L312-M315 HydrophobicContact CD2-SD 4.47Å; L312-M315 WeakPolarHBondContact O-CB 3.39Å; L312-M315 PolarHBondContact O-N 2.93Å; L312-F316 WeakPolarHBondContact O-CD2 3.42Å; L312-F316 PolarHBondContact O-N 3.07Å; L312-V355 HydrophobicContact CD1-CG1 4.02Å; L312-M356 HydrophobicContact CB-CE 3.91Å; L312-M356 HydrophobicContact CB-CG 4.04Å; L312-M356 HydrophobicContact CD1-CG 4.34Å
313	W	98.3	Very high	96.9	Very high	11 Å²	11	14.9 Å²	14.9	4%	0.042	7%	0.069	C	C	.	.	H	α-helix	trans	-60.8	-42.8	177.1	-173.5	89.5	0	0	0	112.3	G309 V310 T311 M315 F316 S317 Q320 P322 L342 C343 M356 W360	G309-W313 PolarHBondContact O-N 3.06Å; G309-W313 VanDerWaalsContact O-N 3.08Å; V310-W313 WeakPolarHBondContact O-CB 3.24Å; V310-W313 PolarHBondContact O-N 2.69Å; V310-W313 VanDerWaalsContact O-N 3.16Å; T311-W313 VanDerWaalsContact C-N 3.33Å; W313-M315 VanDerWaalsContact C-N 3.27Å; W313-M315 PolarHBondContact O-N 2.96Å; W313-F316 PolarHBondContact O-N 2.83Å; W313-S317 WeakPolarHBondContact O-CB 3.37Å; W313-S317 PolarHBondContact O-N 3.21Å; W313-S317 PolarHBondContact O-OG 2.97Å; W313-Q320 HydrophobicContact CH2-CB 3.6Å; W313-Q320 HydrophobicContact CZ3-CB 3.87Å; W313-P322 HydrophobicContact CE3-CB 4.09Å; W313-P322 HydrophobicContact CZ3-CB 4Å; W313-L342 HydrophobicContact CB-CD1 4.22Å; W313-L342 HydrophobicContact CD2-CB 4.12Å; W313-L342 HydrophobicContact CD2-CD1 3.81Å; W313-L342 HydrophobicContact CD2-CG 4.43Å; W313-L342 HydrophobicContact CE3-CD1 4.04Å; W313-L342 HydrophobicContact CG-CB 4.02Å; W313-L342 HydrophobicContact CG-CD1 3.88Å; W313-C343 VanDerWaalsContact CD1-O 3.3Å; W313-C343 PolarHBondContact NE1-O 3.21Å; W313-M356 HydrophobicContact CB-SD 3.98Å; W313-W360 HydrophobicContact CB-CH2 4.09Å; W313-W360 HydrophobicContact CB-CZ2 4.08Å; W313-W360 HydrophobicContact CG-CH2 4.33Å
314	E	97.4	Very high	96.7	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-56.1	-40.5	170.9	-72.5	177.9	96.2	0	0	111.9	A247 W288 V310 T311 L312 S317 H318 G319	A247-E314 HydrophobicContact CB-CB 3.8Å; A247-E314 HydrophobicContact CB-CG 4.32Å; A247-E314 WeakPolarHBondContact CB-OE1 3.26Å; A247-E314 PolarHBondContact N-OE2 2.96Å; W288-E314 HydrophobicContact CZ2-CG 4.48Å; W288-E314 WeakPolarHBondContact CZ2-OE1 3.47Å; W288-E314 VanDerWaalsContact NE1-CD 3.34Å; W288-E314 PolarHBondContact NE1-OE2 3.17Å; V310-E314 PolarHBondContact O-N 3.46Å; T311-E314 PolarHBondContact O-N 3.46Å; L312-E314 PolarHBondContact O-N 3.47Å; E314-S317 PolarHBondContact O-OG 3.38Å; E314-H318 PolarHBondContact O-N 3.33Å; E314-G319 WeakPolarHBondContact O-CA 3.34Å; E314-G319 PolarHBondContact O-N 3.18Å
315	M	96.1	Very high	96.3	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-68.3	-48.5	-178.5	-70.4	167.4	53.8	0	0	112.6	L205 L209 L221 A225 T311 L312 W313 H318	L205-M315 HydrophobicContact CD2-CE 4.43Å; L205-M315 HydrophobicContact CD2-CG 3.92Å; L205-M315 HydrophobicContact CD2-SD 4.02Å; L209-M315 HydrophobicContact CD1-CG 4.47Å; L221-M315 WeakPolarHBondContact O-CE 3.36Å; A225-M315 HydrophobicContact CB-CE 4.16Å; T311-M315 HydrophobicContact CG2-SD 4.39Å; T311-M315 VanDerWaalsContact O-CG 3.29Å; T311-M315 WeakPolarHBondContact O-CG 3.4Å; T311-M315 PolarHBondContact O-N 3.09Å; T311-M315 VanDerWaalsContact O-N 3.08Å; L312-M315 HydrophobicContact CD2-SD 4.47Å; L312-M315 WeakPolarHBondContact O-CB 3.39Å; L312-M315 PolarHBondContact O-N 2.93Å; W313-M315 VanDerWaalsContact C-N 3.27Å; W313-M315 PolarHBondContact O-N 2.96Å; M315-H318 PolarHBondContact O-N 3.19Å
316	F	94.8	Very high	96.1	Very high	3 Å²	3	27.4 Å²	27.4	1%	0.013	15%	0.153	C	C	.	.	H	α-helix	trans	-82.2	-13.5	-177.8	-71	-86.3	0	0	0	113.7	I218 L221 L312 W313 H318 P345 C348 I352 M356	I218-F316 HydrophobicContact CG2-CE1 4.27Å; L221-F316 HydrophobicContact CB-CE1 3.9Å; L221-F316 HydrophobicContact CB-CE2 4.37Å; L221-F316 HydrophobicContact CB-CZ 3.81Å; L221-F316 HydrophobicContact CD1-CD1 4.14Å; L221-F316 HydrophobicContact CD1-CE1 4.27Å; L312-F316 WeakPolarHBondContact O-CD2 3.42Å; L312-F316 PolarHBondContact O-N 3.07Å; W313-F316 PolarHBondContact O-N 2.83Å; F316-H318 VanDerWaalsContact C-N 3.33Å; F316-P345 HydrophobicContact CB-CB 4.35Å; F316-P345 HydrophobicContact CB-CG 4.12Å; F316-P345 WeakPolarHBondContact O-CB 3.35Å; F316-C348 HydrophobicContact CB-CB 3.97Å; F316-C348 HydrophobicContact CD1-CB 4.32Å; F316-C348 HydrophobicContact CG-CB 4.32Å; F316-I352 HydrophobicContact CD2-CG2 4Å; F316-I352 HydrophobicContact CE2-CG2 3.58Å; F316-I352 HydrophobicContact CZ-CG2 3.91Å; F316-M356 HydrophobicContact CB-CE 4.22Å; F316-M356 HydrophobicContact CD2-CE 3.96Å; F316-M356 HydrophobicContact CG-CE 4.36Å
317	S	94.4	Very high	95.7	Very high	5 Å²	5	31.4 Å²	31.4	4%	0.035	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	7.9	167.9	65.3	0	0	0	0	113.7	W313 E314 G319 Q320	W313-S317 WeakPolarHBondContact O-CB 3.37Å; W313-S317 PolarHBondContact O-N 3.21Å; W313-S317 PolarHBondContact O-OG 2.97Å; E314-S317 PolarHBondContact O-OG 3.38Å; S317-G319 PolarHBondContact O-N 3.33Å; S317-Q320 WeakPolarHBondContact O-CG 3.27Å; S317-Q320 PolarHBondContact O-NE2 3.33Å; S317-Q320 PolarHBondContact OG-N 3.47Å
318	H	92.7	Very high	95.3	Very high	53 Å²	53	32 Å²	32	25%	0.245	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	32.5	-176.8	-59.8	-93	0	0	0	114.1	E314 M315 F316	E314-H318 PolarHBondContact O-N 3.33Å; M315-H318 PolarHBondContact O-N 3.19Å; F316-H318 VanDerWaalsContact C-N 3.33Å
319	G	93.6	Very high	95	Very high	3 Å²	3	36.2 Å²	36.2	3%	0.031	21%	0.21	C	C	.	.	S	Bend	trans	87.6	26.1	174.7	0	0	0	0	0	114.5	R210 E314 S317	R210-G319 VanDerWaalsContact CZ-O 3.23Å; R210-G319 PolarHBondContact NE-O 3.2Å; R210-G319 PolarHBondContact NH2-O 3.48Å; E314-G319 WeakPolarHBondContact O-CA 3.34Å; E314-G319 PolarHBondContact O-N 3.18Å; S317-G319 PolarHBondContact O-N 3.33Å
320	Q	94.3	Very high	94.8	Very high	109 Å²	109	40.3 Å²	40.3	51%	0.509	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-59	160.3	168	-71.4	174.8	36.8	0	0	111.3	W313 S317	W313-Q320 HydrophobicContact CH2-CB 3.6Å; W313-Q320 HydrophobicContact CZ3-CB 3.87Å; S317-Q320 WeakPolarHBondContact O-CG 3.27Å; S317-Q320 PolarHBondContact O-NE2 3.33Å; S317-Q320 PolarHBondContact OG-N 3.47Å
321	E	95	Very high	94.7	Very high	97 Å²	97	40.3 Å²	40.3	45%	0.453	23%	0.229	S	C	.	.	P	Polyproline II helix	trans	-91.5	117.4	179.9	-168.6	166.1	138.5	0	0	110.2	W323 L324	E321-W323 PolarHBondContact O-N 2.88Å; E321-L324 HydrophobicContact CB-CB 4.41Å; E321-L324 HydrophobicContact CB-CD1 4.09Å; E321-L324 HydrophobicContact CG-CD1 4.29Å; E321-L324 PolarHBondContact O-N 2.98Å
322	P	96.9	Very high	94.6	Very high	1 Å²	1	42 Å²	42	1%	0.006	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	135.5	-179.5	25.8	-33.3	0	0	0	110.1	P287 W288 V310 W313 L324 L342	P287-P322 HydrophobicContact CB-CB 4.34Å; P287-P322 HydrophobicContact CB-CG 3.94Å; P287-P322 WeakPolarHBondContact CB-O 3.42Å; W288-P322 HydrophobicContact CD2-CG 4.37Å; W288-P322 HydrophobicContact CH2-CG 3.99Å; W288-P322 HydrophobicContact CZ2-CG 3.68Å; W288-P322 HydrophobicContact CZ3-CG 4.48Å; V310-P322 HydrophobicContact CG1-CB 3.77Å; V310-P322 HydrophobicContact CG1-CG 3.74Å; W313-P322 HydrophobicContact CE3-CB 4.09Å; W313-P322 HydrophobicContact CZ3-CB 4Å; P322-L324 VanDerWaalsContact C-N 3.25Å; P322-L324 PolarHBondContact O-N 3.11Å; P322-L342 HydrophobicContact CB-CD1 3.76Å; P322-L342 HydrophobicContact CB-CD2 4.16Å
323	W	95.9	Very high	94.4	Very high	24 Å²	24	46.4 Å²	46.4	9%	0.091	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	35.9	-179.1	-49	106.6	0	0	0	114.4	E321 G325 L326 I331 K334 V335 E340 L342	E321-W323 PolarHBondContact O-N 2.88Å; W323-G325 PolarHBondContact O-N 3Å; W323-L326 HydrophobicContact CB-CB 4.41Å; W323-L326 HydrophobicContact CB-CD1 4.31Å; W323-L326 HydrophobicContact CE3-CD1 4.24Å; W323-L326 WeakPolarHBondContact O-CB 3.48Å; W323-L326 PolarHBondContact O-N 3.17Å; W323-I331 HydrophobicContact CB-CD1 3.95Å; W323-I331 HydrophobicContact CB-CG1 3.78Å; W323-I331 HydrophobicContact CG-CD1 4.43Å; W323-I331 HydrophobicContact CG-CG1 4.06Å; W323-I331 HydrophobicContact CG-CG2 4.22Å; W323-K334 HydrophobicContact CE3-CD 4.37Å; W323-K334 HydrophobicContact CZ3-CB 4.25Å; W323-K334 HydrophobicContact CZ3-CD 4.1Å; W323-V335 HydrophobicContact CH2-CG2 3.89Å; W323-V335 HydrophobicContact CZ2-CG2 3.45Å; W323-V335 VanDerWaalsContact CZ2-CG2 3.45Å; W323-E340 HydrophobicContact CH2-CB 4.49Å; W323-E340 HydrophobicContact CH2-CG 4.27Å; W323-E340 HydrophobicContact CZ3-CG 4.28Å; W323-L342 HydrophobicContact CD2-CD2 3.68Å; W323-L342 HydrophobicContact CD2-CG 4.45Å; W323-L342 HydrophobicContact CE3-CD2 4.12Å; W323-L342 HydrophobicContact CG-CD2 4.04Å; W323-L342 HydrophobicContact CH2-CD2 4.36Å; W323-L342 HydrophobicContact CH2-CG 4.47Å; W323-L342 HydrophobicContact CZ2-CD2 3.94Å; W323-L342 HydrophobicContact CZ2-CG 3.84Å; W323-L342 HydrophobicContact CZ3-CD2 4.44Å
324	L	93.7	Very high	94.3	Very high	130 Å²	130	48.1 Å²	48.1	68%	0.681	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.3	122.8	-176.8	178.1	62.3	0	0	0	113.3	E321 P322 L326	E321-L324 HydrophobicContact CB-CB 4.41Å; E321-L324 HydrophobicContact CB-CD1 4.09Å; E321-L324 HydrophobicContact CG-CD1 4.29Å; E321-L324 PolarHBondContact O-N 2.98Å; P322-L324 VanDerWaalsContact C-N 3.25Å; P322-L324 PolarHBondContact O-N 3.11Å; L324-L326 VanDerWaalsContact C-N 3.31Å; L324-L326 PolarHBondContact O-N 2.89Å
325	G	91.3	Very high	94.2	Very high	74 Å²	74	48.3 Å²	48.3	76%	0.763	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-7.5	177.4	0	0	0	0	0	115.9	W323	W323-G325 PolarHBondContact O-N 3Å
326	L	93.1	Very high	94.1	Very high	58 Å²	58	51.2 Å²	51.2	30%	0.304	28%	0.283	S	S	.	.			trans	-89.2	142.1	179	-57.1	-176.5	0	0	0	112.5	W323 L324 Q330 I331 K334	W323-L326 HydrophobicContact CB-CB 4.41Å; W323-L326 HydrophobicContact CB-CD1 4.31Å; W323-L326 HydrophobicContact CE3-CD1 4.24Å; W323-L326 WeakPolarHBondContact O-CB 3.48Å; W323-L326 PolarHBondContact O-N 3.17Å; L324-L326 VanDerWaalsContact C-N 3.31Å; L324-L326 PolarHBondContact O-N 2.89Å; L326-Q330 HydrophobicContact CB-CB 4.15Å; L326-Q330 HydrophobicContact CD2-CB 4.31Å; L326-I331 HydrophobicContact CB-CD1 4.29Å; L326-I331 HydrophobicContact CB-CG1 3.74Å; L326-K334 HydrophobicContact CD1-CD 3.81Å
327	N	91.5	Very high	94.1	Very high	88 Å²	88	55.7 Å²	55.7	47%	0.471	31%	0.31	S	S	.	.			trans	-86	163.9	171.5	75.9	58	0	0	0	112	S329 Q330 I331	N327-S329 PolarHBondContact O-N 2.75Å; N327-S329 WeakPolarHBondContact OD1-CA 3.18Å; N327-S329 VanDerWaalsContact OD1-CB 3.3Å; N327-S329 WeakPolarHBondContact OD1-CB 3.44Å; N327-S329 PolarHBondContact OD1-N 3.38Å; N327-Q330 VanDerWaalsContact CG-OE1 3.32Å; N327-Q330 PolarHBondContact ND2-OE1 3.43Å; N327-Q330 WeakPolarHBondContact O-CB 3.5Å; N327-Q330 PolarHBondContact O-N 2.73Å; N327-Q330 PolarHBondContact OD1-N 2.87Å; N327-I331 WeakPolarHBondContact O-CG1 3.4Å; N327-I331 PolarHBondContact O-N 2.77Å
328	G	89.4	Confident	94.1	Very high	13 Å²	13	59.8 Å²	59.8	13%	0.134	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-24.1	-176.2	0	0	0	0	0	115.9	L332	G328-L332 WeakPolarHBondContact O-CB 3Å; G328-L332 PolarHBondContact O-N 3.16Å; G328-L332 VanDerWaalsContact O-N 3.1Å
329	S	91.7	Very high	94.2	Very high	89 Å²	89	60.3 Å²	60.3	62%	0.622	34%	0.342	S	S	*	.	H	α-helix	trans	-78.6	-38.4	173.8	-166.4	0	0	0	0	112.2	N327 L332 H333	N327-S329 PolarHBondContact O-N 2.75Å; N327-S329 WeakPolarHBondContact OD1-CA 3.18Å; N327-S329 VanDerWaalsContact OD1-CB 3.3Å; N327-S329 WeakPolarHBondContact OD1-CB 3.44Å; N327-S329 PolarHBondContact OD1-N 3.38Å; S329-L332 PolarHBondContact O-N 3.4Å; S329-H333 PolarHBondContact O-N 3.27Å
330	Q	96	Very high	94.3	Very high	86 Å²	86	64 Å²	64	40%	0.402	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-43.2	174.7	-68	167.8	-52.1	0	0	110.7	L326 N327 L332 H333 K334	L326-Q330 HydrophobicContact CB-CB 4.15Å; L326-Q330 HydrophobicContact CD2-CB 4.31Å; N327-Q330 VanDerWaalsContact CG-OE1 3.32Å; N327-Q330 PolarHBondContact ND2-OE1 3.43Å; N327-Q330 WeakPolarHBondContact O-CB 3.5Å; N327-Q330 PolarHBondContact O-N 2.73Å; N327-Q330 PolarHBondContact OD1-N 2.87Å; Q330-L332 VanDerWaalsContact C-N 3.33Å; Q330-L332 PolarHBondContact O-N 2.84Å; Q330-H333 WeakPolarHBondContact O-CB 3.48Å; Q330-H333 PolarHBondContact O-N 2.87Å; Q330-K334 PolarHBondContact O-N 3.32Å
331	I	96.2	Very high	94.4	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-59.4	-45.3	174.5	-63.9	164.6	0	0	0	110.1	F286 P287 L294 W323 L326 N327 H333 K334 V335	F286-I331 HydrophobicContact CB-CD1 4.4Å; P287-I331 HydrophobicContact CB-CD1 4.32Å; P287-I331 HydrophobicContact CG-CD1 3.99Å; L294-I331 HydrophobicContact CD1-CG2 4.17Å; W323-I331 HydrophobicContact CB-CD1 3.95Å; W323-I331 HydrophobicContact CB-CG1 3.78Å; W323-I331 HydrophobicContact CG-CD1 4.43Å; W323-I331 HydrophobicContact CG-CG1 4.06Å; W323-I331 HydrophobicContact CG-CG2 4.22Å; L326-I331 HydrophobicContact CB-CD1 4.29Å; L326-I331 HydrophobicContact CB-CG1 3.74Å; N327-I331 WeakPolarHBondContact O-CG1 3.4Å; N327-I331 PolarHBondContact O-N 2.77Å; I331-H333 PolarHBondContact O-N 2.72Å; I331-K334 PolarHBondContact O-N 3.19Å; I331-V335 HydrophobicContact CG2-CG2 4.19Å; I331-V335 WeakPolarHBondContact O-CB 3.33Å; I331-V335 VanDerWaalsContact O-CG2 3.22Å; I331-V335 WeakPolarHBondContact O-CG2 3.49Å; I331-V335 PolarHBondContact O-N 3.15Å
332	L	95.1	Very high	94.6	Very high	36 Å²	36	56.8 Å²	56.8	19%	0.188	32%	0.324	C	S	.	.	H	α-helix	trans	-60.4	-43.6	175.3	-179.9	57.9	0	0	0	112	P291 L294 K295 G328 S329 Q330 V335 D336	P291-L332 HydrophobicContact CB-CD1 4.37Å; L294-L332 HydrophobicContact CB-CB 4.42Å; L294-L332 HydrophobicContact CB-CD1 4.05Å; L294-L332 HydrophobicContact CB-CD2 4.37Å; L294-L332 HydrophobicContact CD1-CB 4.06Å; L294-L332 HydrophobicContact CD1-CD1 4.29Å; K295-L332 HydrophobicContact CD-CD1 4.47Å; K295-L332 HydrophobicContact CG-CD1 3.94Å; K295-L332 HydrophobicContact CG-CD2 3.92Å; G328-L332 WeakPolarHBondContact O-CB 3Å; G328-L332 PolarHBondContact O-N 3.16Å; G328-L332 VanDerWaalsContact O-N 3.1Å; S329-L332 PolarHBondContact O-N 3.4Å; Q330-L332 VanDerWaalsContact C-N 3.33Å; Q330-L332 PolarHBondContact O-N 2.84Å; L332-V335 PolarHBondContact O-N 3.12Å; L332-D336 HydrophobicContact CD1-CB 3.82Å; L332-D336 WeakPolarHBondContact O-CB 3.34Å; L332-D336 PolarHBondContact O-N 2.85Å
333	H	95.5	Very high	94.5	Very high	92 Å²	92	60.8 Å²	60.8	43%	0.426	35%	0.351	S	S	.	.	I	π-helix	trans	-59.4	-51.3	177.2	-167.3	-91.1	0	0	0	111.7	S329 Q330 I331 V335 V337 E338	S329-H333 PolarHBondContact O-N 3.27Å; Q330-H333 WeakPolarHBondContact O-CB 3.48Å; Q330-H333 PolarHBondContact O-N 2.87Å; I331-H333 PolarHBondContact O-N 2.72Å; H333-V335 PolarHBondContact O-N 3.09Å; H333-V337 WeakPolarHBondContact O-CA 3.36Å; H333-V337 VanDerWaalsContact O-CB 3.27Å; H333-V337 WeakPolarHBondContact O-CB 3.28Å; H333-V337 PolarHBondContact O-N 2.92Å; H333-E338 IonicContact CE1-OE1 3.27Å; H333-E338 PolarHBondContact CE1-OE1 3.33Å; H333-E338 VanDerWaalsContact CE1-OE1 3.28Å; H333-E338 IonicContact CG-OE1 3.73Å; H333-E338 IonicContact ND1-OE1 3.68Å; H333-E338 PolarHBondContact ND1-OE1 3.3Å; H333-E338 PolarHBondContact O-N 3.49Å; H333-E338 VanDerWaalsContact O-N 3.07Å
334	K	96.1	Very high	94.5	Very high	47 Å²	47	62.5 Å²	62.5	20%	0.204	36%	0.359	C	S	.	.	I	π-helix	trans	-58.1	-49.5	178.1	-70.3	-153.9	142.5	-68.4	0	112.5	W323 L326 Q330 I331 E338 A339 E340	W323-K334 HydrophobicContact CE3-CD 4.37Å; W323-K334 HydrophobicContact CZ3-CB 4.25Å; W323-K334 HydrophobicContact CZ3-CD 4.1Å; L326-K334 HydrophobicContact CD1-CD 3.81Å; Q330-K334 PolarHBondContact O-N 3.32Å; I331-K334 PolarHBondContact O-N 3.19Å; K334-E338 WeakPolarHBondContact CG-OE2 3.38Å; K334-E338 IonicContact NZ-OE2 3.82Å; K334-E338 PolarHBondContact NZ-OE2 3.48Å; K334-E338 CarbonylContact O-C 3.56Å; K334-E338 WeakPolarHBondContact O-CB 3.14Å; K334-A339 PolarHBondContact O-N 3.29Å; K334-E340 HydrophobicContact CB-CB 4.29Å; K334-E340 VanDerWaalsContact CD-OE1 3.3Å; K334-E340 WeakPolarHBondContact CD-OE1 3.42Å; K334-E340 WeakPolarHBondContact CE-OE1 3.47Å; K334-E340 IonicContact NZ-OE1 3.24Å; K334-E340 PolarHBondContact NZ-OE1 3.34Å; K334-E340 VanDerWaalsContact NZ-OE1 3.13Å; K334-E340 IonicContact NZ-OE2 2.75Å; K334-E340 PolarHBondContact NZ-OE2 2.9Å; K334-E340 PolarHBondContact O-N 3Å
335	V	95.6	Very high	94.5	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.024	33%	0.33	C	S	.	.	I	π-helix	trans	-76	-32.2	-171.2	176.7	0	0	0	0	113.1	P291 W306 W323 I331 L332 H333 R341	P291-V335 HydrophobicContact CG-CG1 3.7Å; W306-V335 HydrophobicContact CH2-CG1 3.26Å; W306-V335 HydrophobicContact CZ2-CG1 3.3Å; W306-V335 HydrophobicContact CZ3-CG1 4.45Å; W323-V335 HydrophobicContact CH2-CG2 3.89Å; W323-V335 HydrophobicContact CZ2-CG2 3.45Å; W323-V335 VanDerWaalsContact CZ2-CG2 3.45Å; I331-V335 HydrophobicContact CG2-CG2 4.19Å; I331-V335 WeakPolarHBondContact O-CB 3.33Å; I331-V335 VanDerWaalsContact O-CG2 3.22Å; I331-V335 WeakPolarHBondContact O-CG2 3.49Å; I331-V335 PolarHBondContact O-N 3.15Å; L332-V335 PolarHBondContact O-N 3.12Å; H333-V335 PolarHBondContact O-N 3.09Å; V335-R341 PolarHBondContact O-NH1 3.08Å
336	D	93.8	Very high	94.2	Very high	61 Å²	61	59.6 Å²	59.6	33%	0.326	33%	0.327	S	S	.	.	I	π-helix	trans	-108.8	-31.4	-170.8	-169.2	87.8	0	0	0	114.4	P291 K295 L332	P291-D336 HydrophobicContact CB-CB 4.43Å; K295-D336 VanDerWaalsContact CE-CG 3.44Å; K295-D336 WeakPolarHBondContact CE-OD1 3.17Å; K295-D336 WeakPolarHBondContact CE-OD2 3.4Å; K295-D336 IonicContact NZ-OD1 3.58Å; K295-D336 PolarHBondContact NZ-OD1 3.41Å; K295-D336 IonicContact NZ-OD2 2.56Å; K295-D336 PolarHBondContact NZ-OD2 3.43Å; L332-D336 HydrophobicContact CD1-CB 3.82Å; L332-D336 WeakPolarHBondContact O-CB 3.34Å; L332-D336 PolarHBondContact O-N 2.85Å
337	V	93.5	Very high	93.9	Very high	97 Å²	97	58.6 Å²	58.6	59%	0.588	32%	0.322	S	S	*	.	I	π-helix	trans	-98.8	-49.8	180	-172.6	0	0	0	0	111	H333 A339	H333-V337 WeakPolarHBondContact O-CA 3.36Å; H333-V337 VanDerWaalsContact O-CB 3.27Å; H333-V337 WeakPolarHBondContact O-CB 3.28Å; H333-V337 PolarHBondContact O-N 2.92Å; V337-A339 VanDerWaalsContact C-N 3.3Å
338	E	95.7	Very high	93.8	Very high	91 Å²	91	54.5 Å²	54.5	43%	0.425	30%	0.3	S	S	.	.	S	Bend	trans	-81.7	-11.4	177.6	-57.4	163.7	-151.9	0	0	112.4	H333 K334 E340	H333-E338 IonicContact CE1-OE1 3.27Å; H333-E338 PolarHBondContact CE1-OE1 3.33Å; H333-E338 VanDerWaalsContact CE1-OE1 3.28Å; H333-E338 IonicContact CG-OE1 3.73Å; H333-E338 IonicContact ND1-OE1 3.68Å; H333-E338 PolarHBondContact ND1-OE1 3.3Å; H333-E338 PolarHBondContact O-N 3.49Å; H333-E338 VanDerWaalsContact O-N 3.07Å; K334-E338 WeakPolarHBondContact CG-OE2 3.38Å; K334-E338 IonicContact NZ-OE2 3.82Å; K334-E338 PolarHBondContact NZ-OE2 3.48Å; K334-E338 CarbonylContact O-C 3.56Å; K334-E338 WeakPolarHBondContact O-CB 3.14Å; E338-E340 HydrophobicContact CB-CB 4.49Å; E338-E340 PolarHBondContact O-N 2.86Å; E338-E340 VanDerWaalsContact O-N 3.14Å
339	A	94.3	Very high	93.9	Very high	64 Å²	64	54.4 Å²	54.4	53%	0.529	30%	0.297	S	S	.	.			trans	56.1	17.9	-173.2	0	0	0	0	0	115.3	K334 V337 R341	K334-A339 PolarHBondContact O-N 3.29Å; V337-A339 VanDerWaalsContact C-N 3.3Å; A339-R341 VanDerWaalsContact C-NH1 3.34Å; A339-R341 PolarHBondContact O-NH1 3.46Å; A339-R341 VanDerWaalsContact O-NH1 3.09Å
340	E	96.1	Very high	93.8	Very high	80 Å²	80	53.6 Å²	53.6	37%	0.374	28%	0.284	S	S	.	.			trans	-64	150.8	-178.9	-170.2	173	111.6	0	0	112	W323 K334 E338	W323-E340 HydrophobicContact CH2-CB 4.49Å; W323-E340 HydrophobicContact CH2-CG 4.27Å; W323-E340 HydrophobicContact CZ3-CG 4.28Å; K334-E340 HydrophobicContact CB-CB 4.29Å; K334-E340 VanDerWaalsContact CD-OE1 3.3Å; K334-E340 WeakPolarHBondContact CD-OE1 3.42Å; K334-E340 WeakPolarHBondContact CE-OE1 3.47Å; K334-E340 IonicContact NZ-OE1 3.24Å; K334-E340 PolarHBondContact NZ-OE1 3.34Å; K334-E340 VanDerWaalsContact NZ-OE1 3.13Å; K334-E340 IonicContact NZ-OE2 2.75Å; K334-E340 PolarHBondContact NZ-OE2 2.9Å; K334-E340 PolarHBondContact O-N 3Å; E338-E340 HydrophobicContact CB-CB 4.49Å; E338-E340 PolarHBondContact O-N 2.86Å; E338-E340 VanDerWaalsContact O-N 3.14Å
341	R	97.1	Very high	93.5	Very high	42 Å²	42	51.8 Å²	51.8	16%	0.158	28%	0.277	C	S	.	.			trans	-133.5	156.4	177.5	-61.8	-62.3	179.1	-98.1	9.7	109.7	V335 A339 C343 L357 W360	V335-R341 PolarHBondContact O-NH1 3.08Å; A339-R341 VanDerWaalsContact C-NH1 3.34Å; A339-R341 PolarHBondContact O-NH1 3.46Å; A339-R341 VanDerWaalsContact O-NH1 3.09Å; R341-C343 PolarHBondContact O-N 2.87Å; R341-L357 HydrophobicContact CB-CD2 4.26Å; R341-L357 HydrophobicContact CG-CD2 4.26Å; R341-W360 HydrophobicContact CB-CE3 3.95Å; R341-W360 HydrophobicContact CB-CZ3 4.21Å; R341-W360 HydrophobicContact CG-CE3 4.22Å; R341-W360 PolarHBondContact NE-O 2.97Å; R341-W360 VanDerWaalsContact NE-O 3.08Å; R341-W360 PolarHBondContact NH2-O 2.96Å
342	L	97.3	Very high	93.4	Very high	13 Å²	13	51.8 Å²	51.8	7%	0.068	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59	135.4	172.7	-60.7	167.9	0	0	0	109.1	V310 W313 P322 W323 Y353 W360	V310-L342 HydrophobicContact CG1-CD1 4.21Å; W313-L342 HydrophobicContact CB-CD1 4.22Å; W313-L342 HydrophobicContact CD2-CB 4.12Å; W313-L342 HydrophobicContact CD2-CD1 3.81Å; W313-L342 HydrophobicContact CD2-CG 4.43Å; W313-L342 HydrophobicContact CE3-CD1 4.04Å; W313-L342 HydrophobicContact CG-CB 4.02Å; W313-L342 HydrophobicContact CG-CD1 3.88Å; P322-L342 HydrophobicContact CB-CD1 3.76Å; P322-L342 HydrophobicContact CB-CD2 4.16Å; W323-L342 HydrophobicContact CD2-CD2 3.68Å; W323-L342 HydrophobicContact CD2-CG 4.45Å; W323-L342 HydrophobicContact CE3-CD2 4.12Å; W323-L342 HydrophobicContact CG-CD2 4.04Å; W323-L342 HydrophobicContact CH2-CD2 4.36Å; W323-L342 HydrophobicContact CH2-CG 4.47Å; W323-L342 HydrophobicContact CZ2-CD2 3.94Å; W323-L342 HydrophobicContact CZ2-CG 3.84Å; W323-L342 HydrophobicContact CZ3-CD2 4.44Å; L342-Y353 WeakPolarHBondContact O-CE2 3.26Å; L342-Y353 PolarHBondContact O-OH 2.83Å; L342-W360 HydrophobicContact CB-CH2 3.8Å; L342-W360 HydrophobicContact CB-CZ2 4.44Å; L342-W360 HydrophobicContact CB-CZ3 4.26Å; L342-W360 HydrophobicContact CD1-CH2 4.19Å; L342-W360 HydrophobicContact CD1-CZ2 4Å; L342-W360 HydrophobicContact CG-CH2 4.43Å
343	C	96.1	Very high	93.4	Very high	85 Å²	85	51.7 Å²	51.7	57%	0.574	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-63.5	158.2	-176.6	53.3	0	0	0	0	113.1	W313 R341 P345	W313-C343 VanDerWaalsContact CD1-O 3.3Å; W313-C343 PolarHBondContact NE1-O 3.21Å; R341-C343 PolarHBondContact O-N 2.87Å; C343-P345 VanDerWaalsContact O-CD 3.29Å; C343-P345 WeakPolarHBondContact O-CD 3.24Å
344	K	95.6	Very high	93.3	Very high	61 Å²	61	48.2 Å²	48.2	27%	0.265	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-62.9	122.3	170.4	-177.4	-177.4	177.7	-177.5	0	108.8	C348 Y353 E409	K344-C348 WeakPolarHBondContact CE-O 3.49Å; K344-C348 HydrophobicContact CG-CB 4.28Å; K344-C348 PolarHBondContact NZ-O 3.4Å; K344-Y353 VanDerWaalsContact CA-CE2 3.48Å; K344-Y353 HydrophobicContact CB-CD1 3.86Å; K344-Y353 HydrophobicContact CB-CD2 3.89Å; K344-Y353 HydrophobicContact CB-CE1 3.88Å; K344-Y353 HydrophobicContact CB-CE2 3.92Å; K344-Y353 HydrophobicContact CB-CG 3.85Å; K344-Y353 HydrophobicContact CD-CD1 4.36Å; K344-Y353 HydrophobicContact CD-CG 4.45Å; K344-Y353 HydrophobicContact CG-CD1 4.13Å; K344-Y353 HydrophobicContact CG-CD2 4.21Å; K344-Y353 HydrophobicContact CG-CG 3.88Å; K344-E409 IonicContact NZ-OE1 2.7Å; K344-E409 PolarHBondContact NZ-OE1 2.71Å
345	P	93.1	Very high	93.3	Very high	11 Å²	11	46 Å²	46	7%	0.071	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-66.4	143.7	169.1	-18.1	32	0	0	0	110.8	F316 C343 D347 C348	F316-P345 HydrophobicContact CB-CB 4.35Å; F316-P345 HydrophobicContact CB-CG 4.12Å; F316-P345 WeakPolarHBondContact O-CB 3.35Å; C343-P345 VanDerWaalsContact O-CD 3.29Å; C343-P345 WeakPolarHBondContact O-CD 3.24Å; P345-D347 VanDerWaalsContact C-N 3.28Å; P345-D347 PolarHBondContact O-N 3.45Å; P345-D347 VanDerWaalsContact O-N 3.13Å; P345-C348 HydrophobicContact CB-CB 4.11Å; P345-C348 HydrophobicContact CG-CB 4.24Å; P345-C348 WeakPolarHBondContact O-CB 3.1Å; P345-C348 PolarHBondContact O-N 2.96Å
346	D	85.8	Confident	93.4	Very high	131 Å²	131	45.8 Å²	45.8	70%	0.701	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-38.1	-166.2	-53.9	-65.6	0	0	0	114.4	R418	D346-R418 PolarHBondContact O-NH2 3.46Å
347	D	86	Confident	93.6	Very high	38 Å²	38	46 Å²	46	20%	0.203	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	10.7	-178.4	-72.8	-21.5	0	0	0	113.6	I218 P345 R418 V427	I218-D347 HydrophobicContact CD1-CB 4.14Å; I218-D347 WeakPolarHBondContact CD1-O 3.43Å; P345-D347 VanDerWaalsContact C-N 3.28Å; P345-D347 PolarHBondContact O-N 3.45Å; P345-D347 VanDerWaalsContact O-N 3.13Å; D347-R418 IonicContact OD1-CZ 3.94Å; D347-R418 IonicContact OD1-NE 3.93Å; D347-R418 IonicContact OD1-NH2 3.76Å; D347-R418 PolarHBondContact OD1-NH2 3.15Å; D347-V427 HydrophobicContact CB-CG1 4.47Å; D347-V427 HydrophobicContact CB-CG2 4.27Å; D347-V427 WeakPolarHBondContact OD1-CB 3.25Å; D347-V427 WeakPolarHBondContact OD1-CG1 3.33Å; D347-V427 WeakPolarHBondContact OD2-CG2 3.48Å
348	C	90.9	Very high	93.8	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.007	23%	0.228	C	C	.	.	S	Bend	trans	-76.2	126.5	174.5	-171.3	0	0	0	0	110.8	F316 K344 P345 Q350 M356	F316-C348 HydrophobicContact CB-CB 3.97Å; F316-C348 HydrophobicContact CD1-CB 4.32Å; F316-C348 HydrophobicContact CG-CB 4.32Å; K344-C348 WeakPolarHBondContact CE-O 3.49Å; K344-C348 HydrophobicContact CG-CB 4.28Å; K344-C348 PolarHBondContact NZ-O 3.4Å; P345-C348 HydrophobicContact CB-CB 4.11Å; P345-C348 HydrophobicContact CG-CB 4.24Å; P345-C348 WeakPolarHBondContact O-CB 3.1Å; P345-C348 PolarHBondContact O-N 2.96Å; C348-Q350 PolarHBondContact O-N 3.29Å; C348-M356 VanDerWaalsContact SG-CE 3.57Å
349	P	90.5	Very high	93.9	Very high	12 Å²	12	38.6 Å²	38.6	8%	0.078	21%	0.207	C	C	.	.			trans	-60.4	136.2	172.1	-13	22.6	0	0	0	110.9	I218 D351 I352 Y353 I408	I218-P349 HydrophobicContact CG2-CG 4.16Å; P349-D351 PolarHBondContact O-N 3Å; P349-D351 VanDerWaalsContact O-N 3.1Å; P349-I352 HydrophobicContact CB-CG1 3.95Å; P349-I352 HydrophobicContact CG-CB 4.49Å; P349-I352 HydrophobicContact CG-CG1 3.81Å; P349-I352 WeakPolarHBondContact O-CB 3.49Å; P349-I352 PolarHBondContact O-N 3.1Å; P349-Y353 PolarHBondContact O-N 2.62Å; P349-I408 HydrophobicContact CB-CG2 3.98Å; P349-I408 HydrophobicContact CG-CG2 3.87Å
350	Q	89.1	Confident	94.1	Very high	72 Å²	72	35.8 Å²	35.8	34%	0.336	18%	0.183	S	C	.	.	H	α-helix	trans	-50.8	-40.8	-175.6	-174.9	57.3	39.6	0	0	113.5	C348 I352 Y353 N354 E409	C348-Q350 PolarHBondContact O-N 3.29Å; Q350-I352 VanDerWaalsContact C-N 3.34Å; Q350-I352 PolarHBondContact O-N 3.08Å; Q350-Y353 CarbonylContact O-C 3.6Å; Q350-Y353 PolarHBondContact O-N 3.38Å; Q350-N354 PolarHBondContact NE2-OD1 3.45Å; Q350-N354 PolarHBondContact O-N 2.88Å; Q350-N354 PolarHBondContact O-ND2 3.22Å; Q350-N354 PolarHBondContact O-OD1 2.99Å; Q350-E409 WeakPolarHBondContact CB-OE1 3.48Å; Q350-E409 PolarHBondContact N-OE1 3.36Å
351	D	89.7	Confident	94.1	Very high	47 Å²	47	33.1 Å²	33.1	25%	0.251	17%	0.174	S	C	.	.	H	α-helix	trans	-72	-25.3	-179.1	-72.6	-55	0	0	0	114.2	P349 N354 V355 F376 M380	P349-D351 PolarHBondContact O-N 3Å; P349-D351 VanDerWaalsContact O-N 3.1Å; D351-N354 PolarHBondContact O-N 3.06Å; D351-N354 PolarHBondContact OD1-ND2 3.06Å; D351-V355 WeakPolarHBondContact O-CG2 3.45Å; D351-V355 PolarHBondContact O-N 3.43Å; D351-F376 HydrophobicContact CB-CE1 4.45Å; D351-F376 HydrophobicContact CB-CZ 4.21Å; D351-M380 HydrophobicContact CB-CE 3.89Å
352	I	93.9	Very high	94	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-71.7	-37.9	170.4	-54.9	-62.6	0	0	0	110.1	F316 P349 Q350 V355 M356 L377	F316-I352 HydrophobicContact CD2-CG2 4Å; F316-I352 HydrophobicContact CE2-CG2 3.58Å; F316-I352 HydrophobicContact CZ-CG2 3.91Å; P349-I352 HydrophobicContact CB-CG1 3.95Å; P349-I352 HydrophobicContact CG-CB 4.49Å; P349-I352 HydrophobicContact CG-CG1 3.81Å; P349-I352 WeakPolarHBondContact O-CB 3.49Å; P349-I352 PolarHBondContact O-N 3.1Å; Q350-I352 VanDerWaalsContact C-N 3.34Å; Q350-I352 PolarHBondContact O-N 3.08Å; I352-V355 WeakPolarHBondContact O-CB 3.38Å; I352-V355 PolarHBondContact O-N 2.82Å; I352-M356 HydrophobicContact CG2-CE 4.19Å; I352-M356 WeakPolarHBondContact O-CG 3.49Å; I352-M356 PolarHBondContact O-N 3.34Å; I352-L377 HydrophobicContact CD1-CD2 3.52Å
353	Y	95.9	Very high	93.9	Very high	34 Å²	34	41.4 Å²	41.4	13%	0.133	22%	0.219	C	C	.	.	H	α-helix	trans	-68.1	-37	171.1	-174.4	-112.9	0	0	0	112.4	L342 K344 P349 Q350 V355 M356 L357 W360	L342-Y353 WeakPolarHBondContact O-CE2 3.26Å; L342-Y353 PolarHBondContact O-OH 2.83Å; K344-Y353 VanDerWaalsContact CA-CE2 3.48Å; K344-Y353 HydrophobicContact CB-CD1 3.86Å; K344-Y353 HydrophobicContact CB-CD2 3.89Å; K344-Y353 HydrophobicContact CB-CE1 3.88Å; K344-Y353 HydrophobicContact CB-CE2 3.92Å; K344-Y353 HydrophobicContact CB-CG 3.85Å; K344-Y353 HydrophobicContact CD-CD1 4.36Å; K344-Y353 HydrophobicContact CD-CG 4.45Å; K344-Y353 HydrophobicContact CG-CD1 4.13Å; K344-Y353 HydrophobicContact CG-CD2 4.21Å; K344-Y353 HydrophobicContact CG-CG 3.88Å; P349-Y353 PolarHBondContact O-N 2.62Å; Q350-Y353 CarbonylContact O-C 3.6Å; Q350-Y353 PolarHBondContact O-N 3.38Å; Y353-V355 PolarHBondContact O-N 3.46Å; Y353-M356 HydrophobicContact CD2-CB 4.42Å; Y353-M356 HydrophobicContact CD2-SD 3.86Å; Y353-M356 WeakPolarHBondContact O-CB 3.35Å; Y353-M356 PolarHBondContact O-N 3.2Å; Y353-M356 VanDerWaalsContact O-N 3.07Å; Y353-L357 HydrophobicContact CD1-CD1 3.99Å; Y353-L357 HydrophobicContact CD1-CG 4.32Å; Y353-L357 HydrophobicContact CE1-CD1 3.69Å; Y353-L357 HydrophobicContact CE1-CD2 4.25Å; Y353-L357 HydrophobicContact CE1-CG 4.01Å; Y353-L357 WeakPolarHBondContact O-CG 3.45Å; Y353-L357 PolarHBondContact O-N 3.08Å; Y353-W360 HydrophobicContact CE2-CZ3 4.31Å
354	N	94.2	Very high	93.9	Very high	18 Å²	18	39.4 Å²	39.4	10%	0.096	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-30	171.4	-64.1	-24.5	0	0	0	111.8	Q350 D351 Q358 P498	Q350-N354 PolarHBondContact NE2-OD1 3.45Å; Q350-N354 PolarHBondContact O-N 2.88Å; Q350-N354 PolarHBondContact O-ND2 3.22Å; Q350-N354 PolarHBondContact O-OD1 2.99Å; D351-N354 PolarHBondContact O-N 3.06Å; D351-N354 PolarHBondContact OD1-ND2 3.06Å; N354-Q358 WeakPolarHBondContact O-CG 3.29Å; N354-Q358 PolarHBondContact O-N 3.25Å; N354-Q358 PolarHBondContact O-NE2 3.31Å; N354-Q358 VanDerWaalsContact O-NE2 3.13Å; N354-P498 HydrophobicContact CB-CB 4.03Å
355	V	95.8	Very high	93.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-72.6	-44.7	170.7	167.1	0	0	0	0	112	L312 D351 I352 Y353 L357 Q358 C359 L373 F376 L501	L312-V355 HydrophobicContact CD1-CG1 4.02Å; D351-V355 WeakPolarHBondContact O-CG2 3.45Å; D351-V355 PolarHBondContact O-N 3.43Å; I352-V355 WeakPolarHBondContact O-CB 3.38Å; I352-V355 PolarHBondContact O-N 2.82Å; Y353-V355 PolarHBondContact O-N 3.46Å; V355-L357 VanDerWaalsContact C-N 3.32Å; V355-L357 PolarHBondContact O-N 3.16Å; V355-Q358 PolarHBondContact O-N 3.47Å; V355-Q358 VanDerWaalsContact O-N 3.13Å; V355-C359 PolarHBondContact O-N 3.18Å; V355-C359 PolarHBondContact O-SG 3.13Å; V355-C359 VanDerWaalsContact O-SG 3.38Å; V355-L373 HydrophobicContact CG1-CD2 3.43Å; V355-L373 VanDerWaalsContact CG1-CD2 3.43Å; V355-F376 HydrophobicContact CG2-CD1 3.38Å; V355-F376 HydrophobicContact CG2-CE1 3.32Å; V355-F376 HydrophobicContact CG2-CZ 4.46Å; V355-L501 HydrophobicContact CG2-CD1 4.38Å
356	M	98.1	Very high	94	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.4	-47.2	175.4	-61.9	177.7	-162.7	0	0	111.3	L312 W313 F316 C348 I352 Y353 Q358 C359 W360	L312-M356 HydrophobicContact CB-CE 3.91Å; L312-M356 HydrophobicContact CB-CG 4.04Å; L312-M356 HydrophobicContact CD1-CG 4.34Å; W313-M356 HydrophobicContact CB-SD 3.98Å; F316-M356 HydrophobicContact CB-CE 4.22Å; F316-M356 HydrophobicContact CD2-CE 3.96Å; F316-M356 HydrophobicContact CG-CE 4.36Å; C348-M356 VanDerWaalsContact SG-CE 3.57Å; I352-M356 HydrophobicContact CG2-CE 4.19Å; I352-M356 WeakPolarHBondContact O-CG 3.49Å; I352-M356 PolarHBondContact O-N 3.34Å; Y353-M356 HydrophobicContact CD2-CB 4.42Å; Y353-M356 HydrophobicContact CD2-SD 3.86Å; Y353-M356 WeakPolarHBondContact O-CB 3.35Å; Y353-M356 PolarHBondContact O-N 3.2Å; Y353-M356 VanDerWaalsContact O-N 3.07Å; M356-Q358 VanDerWaalsContact C-N 3.33Å; M356-Q358 PolarHBondContact O-N 2.76Å; M356-C359 WeakPolarHBondContact O-CB 3.47Å; M356-C359 PolarHBondContact O-N 2.91Å; M356-W360 HydrophobicContact CB-CD2 4.49Å; M356-W360 HydrophobicContact CB-CE3 4.15Å; M356-W360 HydrophobicContact CB-CH2 3.72Å; M356-W360 HydrophobicContact CB-CZ2 4.07Å; M356-W360 HydrophobicContact CB-CZ3 3.77Å; M356-W360 HydrophobicContact CG-CH2 4.32Å; M356-W360 VanDerWaalsContact O-CD2 3.23Å; M356-W360 VanDerWaalsContact O-CG 3.29Å; M356-W360 PolarHBondContact O-N 3.06Å; M356-W360 HydrophobicContact SD-CH2 4.05Å
357	L	97.4	Very high	94.5	Very high	67 Å²	67	37.6 Å²	37.6	35%	0.351	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-39.3	176.9	-67.9	176.1	0	0	0	112.7	R341 Y353 V355 W360 S361	R341-L357 HydrophobicContact CB-CD2 4.26Å; R341-L357 HydrophobicContact CG-CD2 4.26Å; Y353-L357 HydrophobicContact CD1-CD1 3.99Å; Y353-L357 HydrophobicContact CD1-CG 4.32Å; Y353-L357 HydrophobicContact CE1-CD1 3.69Å; Y353-L357 HydrophobicContact CE1-CD2 4.25Å; Y353-L357 HydrophobicContact CE1-CG 4.01Å; Y353-L357 WeakPolarHBondContact O-CG 3.45Å; Y353-L357 PolarHBondContact O-N 3.08Å; V355-L357 VanDerWaalsContact C-N 3.32Å; V355-L357 PolarHBondContact O-N 3.16Å; L357-W360 HydrophobicContact CD2-CE3 4.26Å; L357-W360 CarbonylContact O-C 3.58Å; L357-W360 PolarHBondContact O-N 3.39Å; L357-S361 PolarHBondContact O-N 3.47Å
358	Q	96.9	Very high	95.1	Very high	31 Å²	31	35.8 Å²	35.8	15%	0.145	19%	0.188	C	C	.	.	H	α-helix	trans	-68.6	-39	175.5	-74.7	178.4	85.1	0	0	112.4	N354 V355 M356 W360 S361 T499	N354-Q358 WeakPolarHBondContact O-CG 3.29Å; N354-Q358 PolarHBondContact O-N 3.25Å; N354-Q358 PolarHBondContact O-NE2 3.31Å; N354-Q358 VanDerWaalsContact O-NE2 3.13Å; V355-Q358 PolarHBondContact O-N 3.47Å; V355-Q358 VanDerWaalsContact O-N 3.13Å; M356-Q358 VanDerWaalsContact C-N 3.33Å; M356-Q358 PolarHBondContact O-N 2.76Å; Q358-W360 PolarHBondContact O-N 2.89Å; Q358-S361 WeakPolarHBondContact O-CB 3.33Å; Q358-S361 PolarHBondContact O-N 2.7Å; Q358-S361 PolarHBondContact O-OG 3.13Å; Q358-T499 PolarHBondContact NE2-O 2.89Å
359	C	98.4	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-33.6	170.5	-70.1	0	0	0	0	112.3	T305 V355 M356 S361 R367	T305-C359 HydrophobicContact CG2-CB 4.24Å; T305-C359 WeakPolarHBondContact O-CB 3.43Å; V355-C359 PolarHBondContact O-N 3.18Å; V355-C359 PolarHBondContact O-SG 3.13Å; V355-C359 VanDerWaalsContact O-SG 3.38Å; M356-C359 WeakPolarHBondContact O-CB 3.47Å; M356-C359 PolarHBondContact O-N 2.91Å; C359-S361 VanDerWaalsContact C-N 3.32Å; C359-S361 PolarHBondContact O-N 3.37Å; C359-R367 VanDerWaalsContact O-CD 3.27Å; C359-R367 WeakPolarHBondContact O-CD 3.43Å; C359-R367 WeakPolarHBondContact O-CG 3.38Å
360	W	98.1	Very high	95.7	Very high	5 Å²	5	37.2 Å²	37.2	2%	0.019	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	23.8	177.3	-52.8	-38.6	0	0	0	114.6	W306 G309 V310 W313 R341 L342 Y353 M356 L357 Q358	W306-W360 AromaticContact CD2-CD1 3.74Å; W306-W360 HydrophobicContact CD2-CG 4.49Å; W306-W360 AromaticContact CE2-CD1 3.63Å; W306-W360 HydrophobicContact CE3-CB 4.2Å; W306-W360 HydrophobicContact CH2-CB 3.77Å; W306-W360 HydrophobicContact CH2-CG 4.34Å; W306-W360 HydrophobicContact CZ2-CB 4.13Å; W306-W360 AromaticContact CZ2-CD1 3.96Å; W306-W360 HydrophobicContact CZ2-CG 4.2Å; W306-W360 VanDerWaalsContact CZ3-C 3.45Å; W306-W360 VanDerWaalsContact CZ3-CA 3.44Å; W306-W360 HydrophobicContact CZ3-CB 3.84Å; W306-W360 VanDerWaalsContact CZ3-O 3.26Å; W306-W360 WeakPolarHBondContact CZ3-O 3.44Å; W306-W360 AromaticContact NE1-CD1 3.95Å; W306-W360 PolarHBondContact O-NE1 3.07Å; G309-W360 WeakPolarHBondContact O-CZ2 3.26Å; V310-W360 HydrophobicContact CG2-CZ2 4.35Å; W313-W360 HydrophobicContact CB-CH2 4.09Å; W313-W360 HydrophobicContact CB-CZ2 4.08Å; W313-W360 HydrophobicContact CG-CH2 4.33Å; R341-W360 HydrophobicContact CB-CE3 3.95Å; R341-W360 HydrophobicContact CB-CZ3 4.21Å; R341-W360 HydrophobicContact CG-CE3 4.22Å; R341-W360 PolarHBondContact NE-O 2.97Å; R341-W360 VanDerWaalsContact NE-O 3.08Å; R341-W360 PolarHBondContact NH2-O 2.96Å; L342-W360 HydrophobicContact CB-CH2 3.8Å; L342-W360 HydrophobicContact CB-CZ2 4.44Å; L342-W360 HydrophobicContact CB-CZ3 4.26Å; L342-W360 HydrophobicContact CD1-CH2 4.19Å; L342-W360 HydrophobicContact CD1-CZ2 4Å; L342-W360 HydrophobicContact CG-CH2 4.43Å; Y353-W360 HydrophobicContact CE2-CZ3 4.31Å; M356-W360 HydrophobicContact CB-CD2 4.49Å; M356-W360 HydrophobicContact CB-CE3 4.15Å; M356-W360 HydrophobicContact CB-CH2 3.72Å; M356-W360 HydrophobicContact CB-CZ2 4.07Å; M356-W360 HydrophobicContact CB-CZ3 3.77Å; M356-W360 HydrophobicContact CG-CH2 4.32Å; M356-W360 VanDerWaalsContact O-CD2 3.23Å; M356-W360 VanDerWaalsContact O-CG 3.29Å; M356-W360 PolarHBondContact O-N 3.06Å; M356-W360 HydrophobicContact SD-CH2 4.05Å; L357-W360 HydrophobicContact CD2-CE3 4.26Å; L357-W360 CarbonylContact O-C 3.58Å; L357-W360 PolarHBondContact O-N 3.39Å; Q358-W360 PolarHBondContact O-N 2.89Å
361	S	97.1	Very high	96.1	Very high	25 Å²	25	37.6 Å²	37.6	18%	0.175	20%	0.2	C	C	.	.			trans	-58	130.9	170.7	-63	0	0	0	0	110.2	L357 Q358 C359 K363 R367	L357-S361 PolarHBondContact O-N 3.47Å; Q358-S361 WeakPolarHBondContact O-CB 3.33Å; Q358-S361 PolarHBondContact O-N 2.7Å; Q358-S361 PolarHBondContact O-OG 3.13Å; C359-S361 VanDerWaalsContact C-N 3.32Å; C359-S361 PolarHBondContact O-N 3.37Å; S361-K363 VanDerWaalsContact C-N 3.33Å; S361-K363 PolarHBondContact O-N 3.13Å; S361-R367 PolarHBondContact O-NE 3.25Å; S361-R367 PolarHBondContact O-NH2 2.99Å
362	P	93.9	Very high	96.4	Very high	89 Å²	89	36 Å²	36	58%	0.578	19%	0.193	S	C	*	.	S	Bend	trans	-56.7	-45	-177.1	-26	32.9	0	0	0	113	R367	P362-R367 PolarHBondContact O-NH2 3.32Å
363	K	95.1	Very high	96.6	Very high	140 Å²	140	35.9 Å²	35.9	61%	0.609	19%	0.193	S	C	*	.	S	Bend	trans	-78.2	127.2	176.2	-68.5	175.1	179.4	175	0	110.6	S361 D365 D366	S361-K363 VanDerWaalsContact C-N 3.33Å; S361-K363 PolarHBondContact O-N 3.13Å; K363-D365 VanDerWaalsContact C-N 3.29Å; K363-D365 PolarHBondContact O-N 3.26Å; K363-D366 HydrophobicContact CB-CB 4.23Å; K363-D366 WeakPolarHBondContact CD-OD2 3.48Å; K363-D366 PolarHBondContact O-N 3.45Å; K363-D366 VanDerWaalsContact O-N 3.16Å
364	P	96	Very high	96.6	Very high	42 Å²	42	37.7 Å²	37.7	27%	0.273	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-56.2	-38.7	177	-28.2	36.4	0	0	0	114.1	E292 A302 D366 R367	E292-P364 HydrophobicContact CG-CG 4.41Å; A302-P364 HydrophobicContact CB-CB 3.72Å; A302-P364 WeakPolarHBondContact CB-O 3.46Å; P364-D366 PolarHBondContact O-N 2.87Å; P364-R367 WeakPolarHBondContact O-CB 3.45Å; P364-R367 PolarHBondContact O-N 3.39Å
365	D	95.3	Very high	96.6	Very high	107 Å²	107	39.7 Å²	39.7	57%	0.572	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-68.7	-19.6	-179.2	-62.8	-50.9	0	0	0	114.4	K363 R504 A505	K363-D365 VanDerWaalsContact C-N 3.29Å; K363-D365 PolarHBondContact O-N 3.26Å; D365-R504 PolarHBondContact O-N 3Å; D365-A505 HydrophobicContact CB-CB 4.43Å; D365-A505 PolarHBondContact O-N 3.48Å
366	D	95.6	Very high	96.5	Very high	58 Å²	58	40 Å²	40	31%	0.31	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-85.6	-17	178.8	-82.2	-48.3	0	0	0	113.2	K363 P364 N503	K363-D366 HydrophobicContact CB-CB 4.23Å; K363-D366 WeakPolarHBondContact CD-OD2 3.48Å; K363-D366 PolarHBondContact O-N 3.45Å; K363-D366 VanDerWaalsContact O-N 3.16Å; P364-D366 PolarHBondContact O-N 2.87Å; D366-N503 WeakPolarHBondContact CA-ND2 3.49Å; D366-N503 PolarHBondContact O-ND2 3.33Å; D366-N503 PolarHBondContact OD1-ND2 3.02Å
367	R	97.6	Very high	96.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-68.4	149.6	174.2	-56.1	174.6	-162.9	155.7	10.4	109.8	E292 A302 T305 C359 S361 P362 P364 R504	E292-R367 IonicContact OE1-CZ 2.64Å; E292-R367 IonicContact OE1-NH1 3.23Å; E292-R367 PolarHBondContact OE1-NH1 3.08Å; E292-R367 IonicContact OE1-NH2 3.7Å; E292-R367 PolarHBondContact OE1-NH2 3.46Å; E292-R367 IonicContact OE2-CZ 3.76Å; E292-R367 IonicContact OE2-NH1 3.39Å; E292-R367 IonicContact OE2-NH2 3.24Å; E292-R367 PolarHBondContact OE2-NH2 3.22Å; A302-R367 VanDerWaalsContact O-CD 3.24Å; A302-R367 WeakPolarHBondContact O-CD 3.32Å; A302-R367 PolarHBondContact O-NH1 2.89Å; T305-R367 HydrophobicContact CG2-CB 4.01Å; C359-R367 VanDerWaalsContact O-CD 3.27Å; C359-R367 WeakPolarHBondContact O-CD 3.43Å; C359-R367 WeakPolarHBondContact O-CG 3.38Å; S361-R367 PolarHBondContact O-NE 3.25Å; S361-R367 PolarHBondContact O-NH2 2.99Å; P362-R367 PolarHBondContact O-NH2 3.32Å; P364-R367 WeakPolarHBondContact O-CB 3.45Å; P364-R367 PolarHBondContact O-N 3.39Å; R367-R504 WeakPolarHBondContact O-CD 3.27Å; R367-R504 VanDerWaalsContact O-CG 3.24Å; R367-R504 WeakPolarHBondContact O-CG 3.44Å; R367-R504 PolarHBondContact O-N 3.34Å; R367-R504 VanDerWaalsContact O-N 3.17Å
368	P	97.1	Very high	96	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-71.1	169.5	177.3	29.3	-35.4	0	0	0	112.8	T305 A372 L373 L501 R504	T305-P368 HydrophobicContact CG2-CG 4.21Å; P368-A372 HydrophobicContact CB-CB 4.4Å; P368-L373 HydrophobicContact CB-CD2 4.32Å; P368-L373 HydrophobicContact CB-CG 4.08Å; P368-L373 HydrophobicContact CG-CD1 4.05Å; P368-L373 HydrophobicContact CG-CD2 3.62Å; P368-L373 HydrophobicContact CG-CG 3.72Å; P368-L501 HydrophobicContact CB-CB 3.99Å; P368-L501 HydrophobicContact CB-CD1 4Å; P368-L501 HydrophobicContact CG-CD1 4.16Å; P368-R504 PolarHBondContact O-NE 3.23Å; P368-R504 PolarHBondContact O-NH2 3.21Å
369	T	97.6	Very high	95.6	Very high	42 Å²	42	46.8 Å²	46.8	26%	0.258	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-86.7	160.6	166.2	56.5	0	0	0	0	110.8	I371 A372 L373 R504	T369-I371 VanDerWaalsContact C-N 3.26Å; T369-I371 PolarHBondContact O-N 2.89Å; T369-A372 PolarHBondContact O-N 2.63Å; T369-A372 WeakPolarHBondContact OG1-CB 3.32Å; T369-A372 PolarHBondContact OG1-N 3.14Å; T369-L373 WeakPolarHBondContact O-CG 3.26Å; T369-L373 PolarHBondContact O-N 3.39Å; T369-R504 HydrophobicContact CG2-CG 3.8Å
370	F	98.1	Very high	95	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-68.3	-26	178.9	-78.8	-71.9	0	0	0	113.5	M232 A233 E236 D304 F308 L373 R374	M232-F370 HydrophobicContact CB-CB 4.26Å; M232-F370 HydrophobicContact CB-CD1 3.34Å; M232-F370 HydrophobicContact CB-CD2 3.83Å; M232-F370 HydrophobicContact CB-CE1 3.41Å; M232-F370 VanDerWaalsContact CB-CE1 3.41Å; M232-F370 HydrophobicContact CB-CE2 3.9Å; M232-F370 HydrophobicContact CB-CG 3.54Å; M232-F370 HydrophobicContact CB-CZ 3.69Å; M232-F370 HydrophobicContact CE-CE1 4.5Å; M232-F370 HydrophobicContact CE-CE2 3.73Å; M232-F370 HydrophobicContact CE-CZ 3.71Å; M232-F370 HydrophobicContact CG-CD1 4.2Å; M232-F370 HydrophobicContact CG-CE1 3.78Å; M232-F370 HydrophobicContact CG-CE2 4.49Å; M232-F370 HydrophobicContact CG-CZ 3.93Å; A233-F370 HydrophobicContact CB-CB 3.81Å; E236-F370 HydrophobicContact CB-CD2 4.36Å; E236-F370 PolarHBondContact OE2-N 3.34Å; D304-F370 HydrophobicContact CB-CE2 4.05Å; D304-F370 HydrophobicContact CB-CZ 4.18Å; F308-F370 HydrophobicContact CB-CE1 3.67Å; F308-F370 HydrophobicContact CB-CZ 4.05Å; F308-F370 HydrophobicContact CD1-CE1 4.13Å; F308-F370 HydrophobicContact CD2-CE1 4.21Å; F308-F370 AromaticContact CG-CE1 3.75Å; F308-F370 HydrophobicContact CG-CE1 3.75Å; F370-L373 HydrophobicContact CD1-CD1 3.87Å; F370-L373 HydrophobicContact CE1-CD1 4.17Å; F370-R374 WeakPolarHBondContact O-CB 3.25Å; F370-R374 PolarHBondContact O-N 2.83Å
371	I	96.8	Very high	94.6	Very high	81 Å²	81	52.6 Å²	52.6	42%	0.415	27%	0.273	S	S	.	.	H	α-helix	trans	-63.8	-51.2	169.7	-65.8	175.9	0	0	0	110.2	A233 T369 L373 R374 D375	A233-I371 HydrophobicContact CB-CG1 4.05Å; T369-I371 VanDerWaalsContact C-N 3.26Å; T369-I371 PolarHBondContact O-N 2.89Å; I371-L373 VanDerWaalsContact C-N 3.27Å; I371-L373 PolarHBondContact O-N 3.36Å; I371-R374 PolarHBondContact O-N 2.96Å; I371-D375 WeakPolarHBondContact CG2-OD2 3.38Å; I371-D375 WeakPolarHBondContact O-CB 3.32Å; I371-D375 PolarHBondContact O-N 2.66Å
372	A	95.8	Very high	94.1	Very high	13 Å²	13	52.6 Å²	52.6	11%	0.107	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-35	178.1	0	0	0	0	0	113	P368 T369 F376 P502	P368-A372 HydrophobicContact CB-CB 4.4Å; T369-A372 PolarHBondContact O-N 2.63Å; T369-A372 WeakPolarHBondContact OG1-CB 3.32Å; T369-A372 PolarHBondContact OG1-N 3.14Å; A372-F376 WeakPolarHBondContact O-CB 3.48Å; A372-F376 PolarHBondContact O-N 3.1Å; A372-P502 HydrophobicContact CB-CG 4.47Å
373	L	97.9	Very high	94	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-50.1	173.3	-74.1	167.7	0	0	0	112.1	A229 T305 F308 V355 P368 T369 F370 I371 D375 F376 L377 L501	A229-L373 HydrophobicContact CB-CB 4.47Å; T305-L373 HydrophobicContact CG2-CD1 4Å; F308-L373 HydrophobicContact CD1-CD1 3.73Å; F308-L373 HydrophobicContact CE1-CB 4.35Å; F308-L373 HydrophobicContact CE1-CD1 3.91Å; F308-L373 HydrophobicContact CE1-CD2 4.23Å; F308-L373 HydrophobicContact CE1-CG 4.41Å; V355-L373 HydrophobicContact CG1-CD2 3.43Å; V355-L373 VanDerWaalsContact CG1-CD2 3.43Å; P368-L373 HydrophobicContact CB-CD2 4.32Å; P368-L373 HydrophobicContact CB-CG 4.08Å; P368-L373 HydrophobicContact CG-CD1 4.05Å; P368-L373 HydrophobicContact CG-CD2 3.62Å; P368-L373 HydrophobicContact CG-CG 3.72Å; T369-L373 WeakPolarHBondContact O-CG 3.26Å; T369-L373 PolarHBondContact O-N 3.39Å; F370-L373 HydrophobicContact CD1-CD1 3.87Å; F370-L373 HydrophobicContact CE1-CD1 4.17Å; I371-L373 VanDerWaalsContact C-N 3.27Å; I371-L373 PolarHBondContact O-N 3.36Å; L373-D375 VanDerWaalsContact C-N 3.32Å; L373-D375 PolarHBondContact O-N 3.08Å; L373-F376 PolarHBondContact O-N 3.25Å; L373-L377 VanDerWaalsContact O-CB 3.29Å; L373-L377 WeakPolarHBondContact O-CB 3.09Å; L373-L377 WeakPolarHBondContact O-CD1 3.48Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.04Å; L373-L501 HydrophobicContact CD2-CD1 3.96Å
374	R	97.2	Very high	93.9	Very high	72 Å²	72	49.6 Å²	49.6	27%	0.272	26%	0.262	S	S	.	.	H	α-helix	trans	-56.8	-47.5	178.1	179.6	-158.5	66.3	-161.1	-4	111.2	A229 F370 I371 L377 L378	A229-R374 HydrophobicContact CB-CB 3.97Å; F370-R374 WeakPolarHBondContact O-CB 3.25Å; F370-R374 PolarHBondContact O-N 2.83Å; I371-R374 PolarHBondContact O-N 2.96Å; R374-L377 PolarHBondContact O-N 3.01Å; R374-L378 HydrophobicContact CG-CD1 4.1Å; R374-L378 WeakPolarHBondContact O-CG 3.27Å; R374-L378 PolarHBondContact O-N 3.04Å
375	D	92.9	Very high	93.7	Very high	60 Å²	60	50.1 Å²	50.1	32%	0.321	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-42.9	-174	-64.3	-15.3	0	0	0	111	I371 L373 L378 E379	I371-D375 WeakPolarHBondContact CG2-OD2 3.38Å; I371-D375 WeakPolarHBondContact O-CB 3.32Å; I371-D375 PolarHBondContact O-N 2.66Å; L373-D375 VanDerWaalsContact C-N 3.32Å; L373-D375 PolarHBondContact O-N 3.08Å; D375-L378 WeakPolarHBondContact O-CB 3.23Å; D375-L378 PolarHBondContact O-N 2.98Å; D375-E379 WeakPolarHBondContact O-CG 3.25Å; D375-E379 PolarHBondContact O-N 2.93Å; D375-E379 VanDerWaalsContact O-N 3.07Å
376	F	93.2	Very high	93.7	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.035	26%	0.257	C	S	.	.	H	α-helix	trans	-67.1	-39	173.3	-177.3	-97.1	0	0	0	113.3	D351 V355 A372 L373 L378 E379 M380 T499 L501	D351-F376 HydrophobicContact CB-CE1 4.45Å; D351-F376 HydrophobicContact CB-CZ 4.21Å; V355-F376 HydrophobicContact CG2-CD1 3.38Å; V355-F376 HydrophobicContact CG2-CE1 3.32Å; V355-F376 HydrophobicContact CG2-CZ 4.46Å; A372-F376 WeakPolarHBondContact O-CB 3.48Å; A372-F376 PolarHBondContact O-N 3.1Å; L373-F376 PolarHBondContact O-N 3.25Å; F376-L378 PolarHBondContact O-N 3.13Å; F376-E379 PolarHBondContact O-N 3.4Å; F376-M380 HydrophobicContact CD1-CG 3.97Å; F376-M380 HydrophobicContact CD2-CG 4.22Å; F376-M380 HydrophobicContact CE1-CB 4.4Å; F376-M380 HydrophobicContact CE1-CG 3.51Å; F376-M380 HydrophobicContact CE2-CG 3.78Å; F376-M380 HydrophobicContact CE2-SD 4.24Å; F376-M380 HydrophobicContact CG-CG 4.32Å; F376-M380 HydrophobicContact CZ-CG 3.42Å; F376-M380 VanDerWaalsContact CZ-CG 3.42Å; F376-M380 HydrophobicContact CZ-SD 4.13Å; F376-M380 WeakPolarHBondContact O-CB 3.38Å; F376-M380 WeakPolarHBondContact O-CG 3.21Å; F376-M380 PolarHBondContact O-N 3.38Å; F376-T499 HydrophobicContact CD2-CG2 4.23Å; F376-T499 HydrophobicContact CE2-CG2 3.77Å; F376-L501 HydrophobicContact CB-CD1 4.44Å; F376-L501 HydrophobicContact CB-CD2 3.62Å; F376-L501 HydrophobicContact CD1-CD2 4.4Å; F376-L501 HydrophobicContact CD2-CD2 3.72Å; F376-L501 HydrophobicContact CE2-CD2 4.48Å; F376-L501 HydrophobicContact CG-CD2 3.65Å
377	L	94.5	Very high	93.7	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-68.2	-23.3	177.4	-71	168.3	0	0	0	112.7	A225 V226 A229 F308 I352 L373 R374	A225-L377 HydrophobicContact CB-CD1 4.25Å; V226-L377 HydrophobicContact CG2-CB 3.67Å; V226-L377 WeakPolarHBondContact CG2-O 3.37Å; A229-L377 HydrophobicContact CB-CD1 4.11Å; F308-L377 HydrophobicContact CE1-CD1 4.06Å; F308-L377 HydrophobicContact CZ-CD1 3.74Å; I352-L377 HydrophobicContact CD1-CD2 3.52Å; L373-L377 VanDerWaalsContact O-CB 3.29Å; L373-L377 WeakPolarHBondContact O-CB 3.09Å; L373-L377 WeakPolarHBondContact O-CD1 3.48Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.04Å; R374-L377 PolarHBondContact O-N 3.01Å
378	L	91.7	Very high	93.5	Very high	82 Å²	82	51.4 Å²	51.4	43%	0.429	26%	0.263	S	S	.	.	H	α-helix	trans	-74.9	-44.4	169.1	-78	165.8	0	0	0	111.7	V226 R374 D375 F376 M380 L381	V226-L378 HydrophobicContact CG1-CD2 3.63Å; V226-L378 HydrophobicContact CG1-CG 3.84Å; V226-L378 HydrophobicContact CG2-CD2 4.21Å; V226-L378 HydrophobicContact CG2-CG 4.17Å; R374-L378 HydrophobicContact CG-CD1 4.1Å; R374-L378 WeakPolarHBondContact O-CG 3.27Å; R374-L378 PolarHBondContact O-N 3.04Å; D375-L378 WeakPolarHBondContact O-CB 3.23Å; D375-L378 PolarHBondContact O-N 2.98Å; F376-L378 PolarHBondContact O-N 3.13Å; L378-M380 VanDerWaalsContact C-N 3.28Å; L378-M380 PolarHBondContact O-N 3.27Å; L378-L381 HydrophobicContact CD2-CD1 4.19Å; L378-L381 WeakPolarHBondContact O-CG 3.43Å; L378-L381 PolarHBondContact O-N 2.99Å
379	E	88.6	Confident	93.2	Very high	155 Å²	155	55.2 Å²	55.2	72%	0.724	28%	0.281	S	S	*	.	H	α-helix	trans	-63.5	-32.7	176	-71.6	173.9	175.5	0	0	112.4	D375 F376	D375-E379 WeakPolarHBondContact O-CG 3.25Å; D375-E379 PolarHBondContact O-N 2.93Å; D375-E379 VanDerWaalsContact O-N 3.07Å; F376-E379 PolarHBondContact O-N 3.4Å
380	M	84.9	Confident	93.1	Very high	71 Å²	71	58.2 Å²	58.2	35%	0.35	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	23.4	178.5	-59.6	-52.1	-54.5	0	0	114.2	D351 F376 L378	D351-M380 HydrophobicContact CB-CE 3.89Å; F376-M380 HydrophobicContact CD1-CG 3.97Å; F376-M380 HydrophobicContact CD2-CG 4.22Å; F376-M380 HydrophobicContact CE1-CB 4.4Å; F376-M380 HydrophobicContact CE1-CG 3.51Å; F376-M380 HydrophobicContact CE2-CG 3.78Å; F376-M380 HydrophobicContact CE2-SD 4.24Å; F376-M380 HydrophobicContact CG-CG 4.32Å; F376-M380 HydrophobicContact CZ-CG 3.42Å; F376-M380 VanDerWaalsContact CZ-CG 3.42Å; F376-M380 HydrophobicContact CZ-SD 4.13Å; F376-M380 WeakPolarHBondContact O-CB 3.38Å; F376-M380 WeakPolarHBondContact O-CG 3.21Å; F376-M380 PolarHBondContact O-N 3.38Å; L378-M380 VanDerWaalsContact C-N 3.28Å; L378-M380 PolarHBondContact O-N 3.27Å
381	L	88.9	Confident	93	Very high	57 Å²	57	59.5 Å²	59.5	30%	0.298	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-65.1	128.8	170.1	-76.3	177.7	0	0	0	110.2	C222 V226 L378	C222-L381 HydrophobicContact CB-CD2 3.87Å; V226-L381 HydrophobicContact CG2-CD2 4.12Å; L378-L381 HydrophobicContact CD2-CD1 4.19Å; L378-L381 WeakPolarHBondContact O-CG 3.43Å; L378-L381 PolarHBondContact O-N 2.99Å
382	P	88.6	Confident	92.9	Very high	25 Å²	25	62.7 Å²	62.7	16%	0.162	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-68.4	138.1	-176.7	28.4	-35.5	0	0	0	111.2	C222 T406 I407	C222-P382 HydrophobicContact CB-CG 4.4Å; P382-T406 HydrophobicContact CB-CG2 3.79Å; P382-T406 HydrophobicContact CG-CG2 3.9Å; P382-I407 WeakPolarHBondContact CB-O 3.43Å
383	T	89.8	Confident	92.7	Very high	93 Å²	93	66.1 Å²	66.1	57%	0.571	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-84.5	135.7	179.9	-61.9	0	0	0	0	110.8	M385 I407	T383-M385 HydrophobicContact CG2-CG 4.14Å; T383-I407 WeakPolarHBondContact O-CG1 3.25Å; T383-I407 PolarHBondContact O-N 3.36Å
384	D	93.1	Very high	92.2	Very high	73 Å²	73	74.7 Å²	74.7	39%	0.39	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	125	168.9	-75.1	-36.3	0	0	0	109.9	V404 T406 R422	D384-V404 HydrophobicContact CB-CG1 3.78Å; D384-T406 PolarHBondContact OD1-OG1 3.41Å; D384-R422 WeakPolarHBondContact OD1-CD 3.18Å; D384-R422 IonicContact OD1-CZ 2.8Å; D384-R422 IonicContact OD1-NE 3.99Å; D384-R422 IonicContact OD1-NH1 3.78Å; D384-R422 PolarHBondContact OD1-NH1 3.09Å; D384-R422 IonicContact OD2-CZ 3.73Å; D384-R422 VanDerWaalsContact OD2-CZ 3.25Å; D384-R422 IonicContact OD2-NE 3.95Å; D384-R422 IonicContact OD2-NH1 2.74Å; D384-R422 PolarHBondContact OD2-NH1 2.89Å; D384-R422 IonicContact OD2-NH2 2.77Å
385	M	93.3	Very high	91.9	Very high	52 Å²	52	80.9 Å²	80.9	26%	0.256	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	150.5	176.1	-63.8	-170.4	71.1	0	0	111.2	T383 V404 I405 I407 W417 V435 T436	T383-M385 HydrophobicContact CG2-CG 4.14Å; M385-V404 CarbonylContact O-C 3.5Å; M385-V404 WeakPolarHBondContact O-CA 3.14Å; M385-I405 PolarHBondContact N-O 2.82Å; M385-I405 PolarHBondContact O-N 3.45Å; M385-I407 HydrophobicContact CB-CD1 4.24Å; M385-I407 HydrophobicContact CB-CG1 4.27Å; M385-I407 HydrophobicContact CG-CD1 4.27Å; M385-I407 HydrophobicContact CG-CG1 3.81Å; M385-I407 HydrophobicContact SD-CD1 4.17Å; M385-I407 HydrophobicContact SD-CG1 3.78Å; M385-W417 HydrophobicContact SD-CZ3 3.84Å; M385-V435 HydrophobicContact CB-CB 4.07Å; M385-V435 HydrophobicContact CB-CG1 4.43Å; M385-V435 HydrophobicContact CB-CG2 4.37Å; M385-V435 HydrophobicContact CE-CB 4.31Å; M385-V435 HydrophobicContact CE-CG2 4.04Å; M385-V435 WeakPolarHBondContact CE-O 3.37Å; M385-V435 HydrophobicContact SD-CG2 4.05Å; M385-T436 HydrophobicContact CE-CG2 4.04Å
386	K	95.3	Very high	91.9	Very high	111 Å²	111	80.7 Å²	80.7	48%	0.483	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	131.4	-178.7	-172	-177.5	174.8	-169.8	0	110.7	N402 D403	K386-N402 VanDerWaalsContact CE-CA 3.48Å; K386-N402 VanDerWaalsContact CE-CB 3.46Å; K386-N402 WeakPolarHBondContact CE-OD1 3.1Å; K386-N402 PolarHBondContact NZ-OD1 3.17Å; K386-D403 WeakPolarHBondContact CA-O 3.35Å
387	A	95.3	Very high	92	Very high	1 Å²	1	80.5 Å²	80.5	1%	0.008	40%	0.395	C	S	.	.			trans	-65.4	129.7	172.8	0	0	0	0	0	111.2	I399 Q400 N402 D403 V434	A387-I399 HydrophobicContact CB-CG2 3.35Å; A387-Q400 WeakPolarHBondContact CB-O 3.41Å; A387-N402 PolarHBondContact O-N 2.94Å; A387-D403 HydrophobicContact CB-CB 4.34Å; A387-D403 PolarHBondContact N-O 2.72Å; A387-V434 WeakPolarHBondContact CA-O 3.41Å; A387-V434 HydrophobicContact CB-CG1 4.38Å
388	L	93.4	Very high	92	Very high	80 Å²	80	84.5 Å²	84.5	42%	0.419	41%	0.414	S	S	.	.	S	Bend	trans	-95.4	-17	-177.7	-55.7	-179.4	0	0	0	112.6	M401 V434 S437	L388-M401 WeakPolarHBondContact O-CE 3.28Å; L388-V434 PolarHBondContact N-O 3.37Å; L388-S437 VanDerWaalsContact CD1-N 3.32Å
389	Q	91.3	Very high	92.3	Very high	82 Å²	82	80.8 Å²	80.8	38%	0.383	40%	0.395	S	S	.	.	S	Bend	trans	-148.5	165.6	-179.5	55.9	178.4	79.6	0	0	109.2	H433 V434	Q389-H433 PolarHBondContact NE2-NE2 3.48Å; Q389-V434 HydrophobicContact CG-CB 4.35Å; Q389-V434 HydrophobicContact CG-CG1 4.2Å; Q389-V434 HydrophobicContact CG-CG2 4.35Å
390	D	94.6	Very high	92.7	Very high	105 Å²	105	78.3 Å²	78.3	56%	0.561	38%	0.383	S	S	*	.			trans	-72.4	155.4	167.2	-55.9	-63	0	0	0	111.1	Q400 M401	D390-Q400 VanDerWaalsContact OD1-CA 3.26Å; D390-Q400 WeakPolarHBondContact OD1-CA 3.39Å; D390-M401 PolarHBondContact OD1-N 3.37Å
391	F	95.3	Very high	93.2	Very high	27 Å²	27	79.7 Å²	79.7	12%	0.118	39%	0.39	C	S	.	.	B	Isolated β-bridge	trans	-153.4	128.5	170.1	168.8	-102.9	0	0	0	111	E393 K396 L397 I399 W416 F430 P431 V434	F391-E393 HydrophobicContact CE1-CB 4.44Å; F391-E393 HydrophobicContact CE2-CB 3.89Å; F391-E393 WeakPolarHBondContact CE2-OE2 3.47Å; F391-E393 HydrophobicContact CZ-CB 3.59Å; F391-K396 HydrophobicContact CE1-CB 3.74Å; F391-K396 HydrophobicContact CE1-CG 4.43Å; F391-K396 HydrophobicContact CZ-CB 3.87Å; F391-K396 HydrophobicContact CZ-CG 4.07Å; F391-L397 WeakPolarHBondContact CD1-O 3.48Å; F391-I399 HydrophobicContact CB-CB 4.36Å; F391-I399 HydrophobicContact CD1-CD1 4.5Å; F391-I399 PolarHBondContact N-O 2.83Å; F391-I399 PolarHBondContact O-N 3.46Å; F391-W416 HydrophobicContact CZ-CZ3 4.16Å; F391-F430 HydrophobicContact CD1-CB 3.96Å; F391-F430 HydrophobicContact CE1-CB 3.91Å; F391-P431 HydrophobicContact CD2-CG 3.99Å; F391-P431 HydrophobicContact CE2-CG 3.68Å; F391-P431 VanDerWaalsContact CZ-CD 3.42Å; F391-P431 HydrophobicContact CZ-CG 4.01Å; F391-V434 HydrophobicContact CB-CG1 4.11Å; F391-V434 HydrophobicContact CB-CG2 3.68Å; F391-V434 HydrophobicContact CD2-CG2 4.44Å; F391-V434 HydrophobicContact CG-CG2 4.03Å
392	E	94.7	Very high	93.4	Very high	147 Å²	147	81 Å²	81	69%	0.687	40%	0.397	S	S	*	.			trans	-145.8	126.2	178.9	177.9	155.5	-129.2	0	0	109.6	Q398	E392-Q398 HydrophobicContact CG-CG 4.34Å; E392-Q398 PolarHBondContact OE1-NE2 3.38Å
393	E	92.3	Very high	93.8	Very high	86 Å²	86	80.4 Å²	80.4	40%	0.402	39%	0.393	S	S	.	.			trans	-156.1	147.3	-179.2	-176.2	-175.3	132.7	0	0	107.4	F391 K396 W416	F391-E393 HydrophobicContact CE1-CB 4.44Å; F391-E393 HydrophobicContact CE2-CB 3.89Å; F391-E393 WeakPolarHBondContact CE2-OE2 3.47Å; F391-E393 HydrophobicContact CZ-CB 3.59Å; E393-K396 HydrophobicContact CB-CB 4.01Å; E393-K396 HydrophobicContact CB-CG 3.73Å; E393-K396 HydrophobicContact CG-CG 3.75Å; E393-K396 PolarHBondContact O-N 2.91Å; E393-K396 WeakPolarHBondContact OE1-CE 3.44Å; E393-K396 WeakPolarHBondContact OE1-CG 3.23Å; E393-W416 WeakPolarHBondContact OE1-CH2 3.15Å; E393-W416 WeakPolarHBondContact OE2-CH2 3.43Å
394	E	88.3	Confident	94.2	Very high	179 Å²	179	78.7 Å²	78.7	84%	0.836	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	142.3	-178	-63.6	-168.2	150.6	0	0	111.8	K396	E394-K396 PolarHBondContact O-N 3.5Å
395	E	89.3	Confident	94.3	Very high	203 Å²	203	75.2 Å²	75.2	95%	0.949	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.4	-0.5	-173.7	-51.3	-165.3	151.5	0	0	116.4
396	K	93.9	Very high	94.4	Very high	56 Å²	56	72.8 Å²	72.8	24%	0.243	35%	0.351	C	S	.	.	S	Bend	trans	-93.1	174.2	176.3	-55.1	-50.7	-172.9	-170.6	0	112.8	F391 E393 E394 Q398 W416 Q429	F391-K396 HydrophobicContact CE1-CB 3.74Å; F391-K396 HydrophobicContact CE1-CG 4.43Å; F391-K396 HydrophobicContact CZ-CB 3.87Å; F391-K396 HydrophobicContact CZ-CG 4.07Å; E393-K396 HydrophobicContact CB-CB 4.01Å; E393-K396 HydrophobicContact CB-CG 3.73Å; E393-K396 HydrophobicContact CG-CG 3.75Å; E393-K396 PolarHBondContact O-N 2.91Å; E393-K396 WeakPolarHBondContact OE1-CE 3.44Å; E393-K396 WeakPolarHBondContact OE1-CG 3.23Å; E394-K396 PolarHBondContact O-N 3.5Å; K396-Q398 PolarHBondContact O-N 2.88Å; K396-W416 HydrophobicContact CD-CH2 4.28Å; K396-W416 HydrophobicContact CD-CZ3 3.99Å; K396-W416 HydrophobicContact CG-CH2 4.4Å; K396-W416 HydrophobicContact CG-CZ3 4.22Å; K396-Q429 WeakPolarHBondContact CB-O 3.38Å; K396-Q429 HydrophobicContact CD-CB 4.12Å
397	L	94.5	Very high	94.2	Very high	4 Å²	4	68.4 Å²	68.4	2%	0.021	33%	0.333	C	S	.	.			trans	-77.1	108.8	175.4	-176.8	63	0	0	0	110.4	F391 I399 I405 G419 N421 R426 Q429 F430	F391-L397 WeakPolarHBondContact CD1-O 3.48Å; L397-I399 HydrophobicContact CD2-CD1 4.19Å; L397-I399 HydrophobicContact CD2-CG1 4.26Å; L397-I399 HydrophobicContact CG-CD1 4.37Å; L397-I399 HydrophobicContact CG-CG1 4.05Å; L397-I399 WeakPolarHBondContact O-CG1 3.41Å; L397-I399 PolarHBondContact O-N 3.5Å; L397-I405 HydrophobicContact CD2-CG2 4.2Å; L397-G419 WeakPolarHBondContact CD2-O 3.37Å; L397-N421 HydrophobicContact CD1-CB 3.87Å; L397-N421 HydrophobicContact CD2-CB 4.23Å; L397-N421 HydrophobicContact CG-CB 4.26Å; L397-R426 HydrophobicContact CD1-CB 4.04Å; L397-R426 WeakPolarHBondContact CD1-O 3.35Å; L397-Q429 WeakPolarHBondContact CB-O 3.44Å; L397-Q429 PolarHBondContact N-O 2.77Å; L397-F430 HydrophobicContact CB-CB 4.39Å; L397-F430 HydrophobicContact CD2-CD1 4.02Å
398	Q	95.7	Very high	94	Very high	85 Å²	85	69.1 Å²	69.1	40%	0.397	34%	0.336	S	S	.	.			trans	-60.2	126.1	168.6	-71.2	168.5	-44.9	0	0	110.8	E392 K396 N421	E392-Q398 HydrophobicContact CG-CG 4.34Å; E392-Q398 PolarHBondContact OE1-NE2 3.38Å; K396-Q398 PolarHBondContact O-N 2.88Å; Q398-N421 PolarHBondContact O-ND2 3.4Å
399	I	97.1	Very high	93.6	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.026	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-132.5	132.7	-177.6	-66.7	171.9	0	0	0	109	A387 F391 L397 D403 I405 F430 V434	A387-I399 HydrophobicContact CB-CG2 3.35Å; F391-I399 HydrophobicContact CB-CB 4.36Å; F391-I399 HydrophobicContact CD1-CD1 4.5Å; F391-I399 PolarHBondContact N-O 2.83Å; F391-I399 PolarHBondContact O-N 3.46Å; L397-I399 HydrophobicContact CD2-CD1 4.19Å; L397-I399 HydrophobicContact CD2-CG1 4.26Å; L397-I399 HydrophobicContact CG-CD1 4.37Å; L397-I399 HydrophobicContact CG-CG1 4.05Å; L397-I399 WeakPolarHBondContact O-CG1 3.41Å; L397-I399 PolarHBondContact O-N 3.5Å; I399-D403 HydrophobicContact CG2-CB 4.38Å; I399-I405 HydrophobicContact CD1-CD1 4.04Å; I399-I405 HydrophobicContact CD1-CG1 4.19Å; I399-I405 HydrophobicContact CG1-CD1 3.82Å; I399-I405 HydrophobicContact CG1-CG1 4.49Å; I399-I405 HydrophobicContact CG2-CD1 4.23Å; I399-F430 HydrophobicContact CD1-CB 3.61Å; I399-F430 HydrophobicContact CD1-CD1 4.18Å; I399-F430 HydrophobicContact CD1-CD2 3.69Å; I399-F430 HydrophobicContact CD1-CE2 4.43Å; I399-F430 HydrophobicContact CD1-CG 3.54Å; I399-V434 HydrophobicContact CB-CG1 4.37Å; I399-V434 HydrophobicContact CD1-CG1 4Å; I399-V434 HydrophobicContact CG2-CG1 3.8Å
400	Q	97.1	Very high	93	Very high	103 Å²	103	66.2 Å²	66.2	48%	0.481	33%	0.33	S	S	.	.			trans	-103.2	149	168.3	-71.7	174.9	-22	0	0	110.2	A387 D390 N402 D403	A387-Q400 WeakPolarHBondContact CB-O 3.41Å; D390-Q400 VanDerWaalsContact OD1-CA 3.26Å; D390-Q400 WeakPolarHBondContact OD1-CA 3.39Å; Q400-N402 PolarHBondContact O-N 3.33Å; Q400-D403 PolarHBondContact N-OD2 3.23Å; Q400-D403 VanDerWaalsContact O-CB 3.23Å; Q400-D403 WeakPolarHBondContact O-CB 3.09Å; Q400-D403 PolarHBondContact O-N 2.91Å
401	M	94.7	Very high	92.1	Very high	100 Å²	100	65.9 Å²	65.9	49%	0.493	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	133.6	174.6	-166.7	-150.9	-170.7	0	0	109.6	L388 D390 D403	L388-M401 WeakPolarHBondContact O-CE 3.28Å; D390-M401 PolarHBondContact OD1-N 3.37Å; M401-D403 VanDerWaalsContact C-N 3.33Å
402	N	94.9	Very high	91.1	Very high	83 Å²	83	68 Å²	68	44%	0.444	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-1.9	-172.8	-45.1	-92.3	0	0	0	117	K386 A387 Q400	K386-N402 VanDerWaalsContact CE-CA 3.48Å; K386-N402 VanDerWaalsContact CE-CB 3.46Å; K386-N402 WeakPolarHBondContact CE-OD1 3.1Å; K386-N402 PolarHBondContact NZ-OD1 3.17Å; A387-N402 PolarHBondContact O-N 2.94Å; Q400-N402 PolarHBondContact O-N 3.33Å
403	D	96.9	Very high	89.9	Confident	14 Å²	14	64.9 Å²	64.9	8%	0.075	33%	0.329	C	S	.	.			trans	-57.6	146.9	166.5	-85.1	-26	0	0	0	111	K386 A387 I399 Q400 M401 I405 N421 R423	K386-D403 WeakPolarHBondContact CA-O 3.35Å; A387-D403 HydrophobicContact CB-CB 4.34Å; A387-D403 PolarHBondContact N-O 2.72Å; I399-D403 HydrophobicContact CG2-CB 4.38Å; Q400-D403 PolarHBondContact N-OD2 3.23Å; Q400-D403 VanDerWaalsContact O-CB 3.23Å; Q400-D403 WeakPolarHBondContact O-CB 3.09Å; Q400-D403 PolarHBondContact O-N 2.91Å; M401-D403 VanDerWaalsContact C-N 3.33Å; D403-I405 HydrophobicContact CB-CD1 3.97Å; D403-N421 PolarHBondContact OD2-ND2 3.43Å; D403-R423 WeakPolarHBondContact OD1-CB 3.31Å; D403-R423 WeakPolarHBondContact OD1-CD 3.33Å; D403-R423 IonicContact OD1-CZ 2.7Å; D403-R423 IonicContact OD1-NE 2.69Å; D403-R423 PolarHBondContact OD1-NE 3.34Å; D403-R423 IonicContact OD1-NH2 2.67Å; D403-R423 IonicContact OD2-CZ 2.69Å; D403-R423 IonicContact OD2-NE 2.67Å; D403-R423 PolarHBondContact OD2-NE 2.83Å; D403-R423 IonicContact OD2-NH2 3.25Å; D403-R423 PolarHBondContact OD2-NH2 3.36Å
404	V	96.7	Very high	89.2	Confident	57 Å²	57	62.2 Å²	62.2	35%	0.345	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.1	173.1	-173.9	0	0	0	0	108.8	D384 M385 R422	D384-V404 HydrophobicContact CB-CG1 3.78Å; M385-V404 CarbonylContact O-C 3.5Å; M385-V404 WeakPolarHBondContact O-CA 3.14Å; V404-R422 VanDerWaalsContact O-CB 3.28Å; V404-R422 WeakPolarHBondContact O-CB 3.38Å; V404-R422 VanDerWaalsContact O-CG 3.28Å; V404-R422 WeakPolarHBondContact O-CG 3.32Å; V404-R422 PolarHBondContact O-N 3.49Å
405	I	96.2	Very high	88.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.7	-176.8	-44.4	-56.3	0	0	0	108.7	M385 L397 I399 D403 I407 Q420 N421 F430 V435	M385-I405 PolarHBondContact N-O 2.82Å; M385-I405 PolarHBondContact O-N 3.45Å; L397-I405 HydrophobicContact CD2-CG2 4.2Å; I399-I405 HydrophobicContact CD1-CD1 4.04Å; I399-I405 HydrophobicContact CD1-CG1 4.19Å; I399-I405 HydrophobicContact CG1-CD1 3.82Å; I399-I405 HydrophobicContact CG1-CG1 4.49Å; I399-I405 HydrophobicContact CG2-CD1 4.23Å; D403-I405 HydrophobicContact CB-CD1 3.97Å; I405-I407 HydrophobicContact CG2-CD1 4.27Å; I405-I407 PolarHBondContact O-N 2.81Å; I405-Q420 CarbonylContact C-O 3.46Å; I405-Q420 WeakPolarHBondContact CA-O 3.44Å; I405-N421 HydrophobicContact CD1-CB 3.79Å; I405-F430 HydrophobicContact CG2-CE1 3.86Å; I405-F430 HydrophobicContact CG2-CZ 4.07Å; I405-V435 HydrophobicContact CB-CG1 4.49Å; I405-V435 HydrophobicContact CG1-CG1 4.14Å
406	T	94.8	Very high	88.9	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	115.6	170.5	-48.3	0	0	0	0	107.4	P382 D384 I408 G419 Q420 R422	P382-T406 HydrophobicContact CB-CG2 3.79Å; P382-T406 HydrophobicContact CG-CG2 3.9Å; D384-T406 PolarHBondContact OD1-OG1 3.41Å; T406-I408 PolarHBondContact O-N 2.92Å; T406-G419 CarbonylContact O-C 3.57Å; T406-G419 WeakPolarHBondContact O-CA 3.35Å; T406-Q420 PolarHBondContact N-O 3.32Å; T406-Q420 PolarHBondContact O-N 3.49Å; T406-R422 WeakPolarHBondContact OG1-CG 3.36Å
407	I	92.3	Very high	88.8	Confident	19 Å²	19	48.8 Å²	48.8	10%	0.097	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	124.7	-180	-52.1	-52.7	0	0	0	109.7	P382 T383 M385 I405 W417 F430 V435	P382-I407 WeakPolarHBondContact CB-O 3.43Å; T383-I407 WeakPolarHBondContact O-CG1 3.25Å; T383-I407 PolarHBondContact O-N 3.36Å; M385-I407 HydrophobicContact CB-CD1 4.24Å; M385-I407 HydrophobicContact CB-CG1 4.27Å; M385-I407 HydrophobicContact CG-CD1 4.27Å; M385-I407 HydrophobicContact CG-CG1 3.81Å; M385-I407 HydrophobicContact SD-CD1 4.17Å; M385-I407 HydrophobicContact SD-CG1 3.78Å; I405-I407 HydrophobicContact CG2-CD1 4.27Å; I405-I407 PolarHBondContact O-N 2.81Å; I407-W417 HydrophobicContact CD1-CE3 4.03Å; I407-W417 HydrophobicContact CD1-CZ3 4.32Å; I407-W417 HydrophobicContact CG1-CE3 4.45Å; I407-W417 HydrophobicContact CG1-CZ3 4.38Å; I407-W417 HydrophobicContact CG2-CE3 4.09Å; I407-W417 HydrophobicContact CG2-CZ3 4.34Å; I407-F430 HydrophobicContact CD1-CE1 4.37Å; I407-F430 HydrophobicContact CD1-CZ 3.77Å; I407-V435 HydrophobicContact CD1-CG2 4.45Å
408	I	90	Very high	88.7	Confident	17 Å²	17	52.1 Å²	52.1	9%	0.087	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	-51.8	-177.4	-56.3	163.9	0	0	0	109.4	I218 P349 T406 R418 G419 Q420 V427	I218-I408 HydrophobicContact CD1-CD1 3.38Å; I218-I408 HydrophobicContact CD1-CG1 3.83Å; P349-I408 HydrophobicContact CB-CG2 3.98Å; P349-I408 HydrophobicContact CG-CG2 3.87Å; T406-I408 PolarHBondContact O-N 2.92Å; I408-R418 WeakPolarHBondContact CB-O 3.21Å; I408-R418 HydrophobicContact CD1-CG 4.31Å; I408-R418 PolarHBondContact N-O 2.78Å; I408-G419 VanDerWaalsContact CD1-C 3.44Å; I408-Q420 HydrophobicContact CD1-CB 4.27Å; I408-V427 HydrophobicContact CD1-CB 4.37Å; I408-V427 HydrophobicContact CD1-CG1 3.4Å; I408-V427 HydrophobicContact CD1-CG2 4.12Å
409	E	85	Confident	88.6	Confident	65 Å²	65	48.1 Å²	48.1	30%	0.304	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	110.2	178	-68.4	172.7	172.2	0	0	107.7	K344 Q350 W417 R418	K344-E409 IonicContact NZ-OE1 2.7Å; K344-E409 PolarHBondContact NZ-OE1 2.71Å; Q350-E409 WeakPolarHBondContact CB-OE1 3.48Å; Q350-E409 PolarHBondContact N-OE1 3.36Å; E409-W417 WeakPolarHBondContact O-CA 3.48Å; E409-R418 HydrophobicContact CB-CB 4.17Å; E409-R418 PolarHBondContact N-O 3.21Å; E409-R418 VanDerWaalsContact N-O 3.09Å; E409-R418 PolarHBondContact O-N 2.94Å
410	G	78.9	Confident	88.5	Confident	36 Å²	36	48 Å²	48	37%	0.371	24%	0.242	S	C	.	.			trans	-148.8	125.2	-177.5	0	0	0	0	0	111.7
411	R	76.8	Confident	88.4	Confident	98 Å²	98	43.1 Å²	43.1	37%	0.37	22%	0.219	S	C	.	.			trans	-125.4	138.3	179.1	-68.9	168.3	167.4	-87.1	-14	109.4	E413 H414 W417	R411-E413 HydrophobicContact CB-CG 3.95Å; R411-E413 WeakPolarHBondContact CD-OE1 3.45Å; R411-E413 IonicContact CZ-OE1 3.28Å; R411-E413 IonicContact NE-OE1 3.17Å; R411-E413 IonicContact NH1-OE1 3.93Å; R411-E413 PolarHBondContact NH1-OE1 3.24Å; R411-E413 PolarHBondContact O-N 3.17Å; R411-H414 HydrophobicContact CB-CB 4.31Å; R411-H414 PolarHBondContact O-N 3.22Å; R411-W417 VanDerWaalsContact N-NE1 3.17Å; R411-W417 PolarHBondContact O-NE1 3.34Å
412	A	72.3	Confident	88.3	Confident	72 Å²	72	42.4 Å²	42.4	60%	0.595	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.7	177.8	0	0	0	0	0	112.6	H414 R432	A412-H414 VanDerWaalsContact C-N 3.33Å; A412-H414 PolarHBondContact O-N 3.41Å; A412-R432 PolarHBondContact O-NE 2.94Å
413	E	69.4	Low	88.2	Confident	80 Å²	80	44.4 Å²	44.4	37%	0.374	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-12.5	177.6	69.2	-133.3	175	0	0	114.9	R411 L450 P486	R411-E413 HydrophobicContact CB-CG 3.95Å; R411-E413 WeakPolarHBondContact CD-OE1 3.45Å; R411-E413 IonicContact CZ-OE1 3.28Å; R411-E413 IonicContact NE-OE1 3.17Å; R411-E413 IonicContact NH1-OE1 3.93Å; R411-E413 PolarHBondContact NH1-OE1 3.24Å; R411-E413 PolarHBondContact O-N 3.17Å; E413-L450 HydrophobicContact CB-CD2 3.81Å; E413-P486 VanDerWaalsContact O-CD 3.22Å; E413-P486 WeakPolarHBondContact O-CD 3.45Å
414	H	77.9	Confident	88	Confident	30 Å²	30	45.8 Å²	45.8	14%	0.139	22%	0.221	C	C	.	.			trans	-101.1	150	179.7	-68.4	-162.5	0	0	0	112	R411 A412 R432 D487 S493	R411-H414 HydrophobicContact CB-CB 4.31Å; R411-H414 PolarHBondContact O-N 3.22Å; A412-H414 VanDerWaalsContact C-N 3.33Å; A412-H414 PolarHBondContact O-N 3.41Å; H414-R432 PolarHBondContact O-NE 3.18Å; H414-D487 VanDerWaalsContact CA-OD1 3.28Å; H414-D487 WeakPolarHBondContact CA-OD1 3.35Å; H414-S493 VanDerWaalsContact CE1-CB 3.45Å; H414-S493 WeakPolarHBondContact CE1-CB 3.32Å; H414-S493 PolarHBondContact CE1-OG 3.3Å; H414-S493 VanDerWaalsContact CE1-OG 3.23Å; H414-S493 WeakPolarHBondContact NE2-CB 2.85Å; H414-S493 PolarHBondContact NE2-OG 3.33Å
415	Y	83.1	Confident	87.7	Confident	76 Å²	76	45.7 Å²	45.7	30%	0.298	22%	0.218	S	C	.	.	S	Bend	trans	-79.6	-49.4	167.2	-177.1	-95	0	0	0	111.6	P431 R432 H433 D487 I488	Y415-P431 HydrophobicContact CD1-CB 4.38Å; Y415-P431 HydrophobicContact CE1-CB 3.71Å; Y415-P431 HydrophobicContact CE1-CG 3.83Å; Y415-P431 HydrophobicContact CE2-CB 4.29Å; Y415-P431 CarbonylContact O-C 3.47Å; Y415-P431 WeakPolarHBondContact O-CA 3.26Å; Y415-R432 WeakPolarHBondContact O-CB 3.44Å; Y415-R432 PolarHBondContact O-N 3.1Å; Y415-H433 AromaticContact CE2-ND1 3.91Å; Y415-H433 PolarHBondContact OH-CE1 2.96Å; Y415-D487 PolarHBondContact N-OD1 2.87Å; Y415-D487 PolarHBondContact N-OD2 2.96Å; Y415-I488 HydrophobicContact CD1-CD1 4.04Å; Y415-I488 HydrophobicContact CD2-CD1 4.01Å; Y415-I488 HydrophobicContact CG-CD1 3.68Å; Y415-I488 HydrophobicContact CG-CG1 4.33Å
416	W	88.4	Confident	87.5	Confident	55 Å²	55	53 Å²	53	21%	0.208	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.8	-178	-65.5	106.1	0	0	0	111.6	F391 E393 K396 Q429 P431 D487	F391-W416 HydrophobicContact CZ-CZ3 4.16Å; E393-W416 WeakPolarHBondContact OE1-CH2 3.15Å; E393-W416 WeakPolarHBondContact OE2-CH2 3.43Å; K396-W416 HydrophobicContact CD-CH2 4.28Å; K396-W416 HydrophobicContact CD-CZ3 3.99Å; K396-W416 HydrophobicContact CG-CH2 4.4Å; K396-W416 HydrophobicContact CG-CZ3 4.22Å; W416-Q429 HydrophobicContact CE3-CB 4.07Å; W416-P431 HydrophobicContact CH2-CG 4.34Å; W416-P431 HydrophobicContact CZ3-CG 3.95Å; W416-D487 PolarHBondContact N-OD2 3.35Å
417	W	91.8	Very high	87.3	Confident	25 Å²	25	54.3 Å²	54.3	10%	0.095	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	144.6	171.1	-76.6	18.4	0	0	0	109.6	M385 I407 E409 R411 Q429 F430 R432 V435 T436	M385-W417 HydrophobicContact SD-CZ3 3.84Å; I407-W417 HydrophobicContact CD1-CE3 4.03Å; I407-W417 HydrophobicContact CD1-CZ3 4.32Å; I407-W417 HydrophobicContact CG1-CE3 4.45Å; I407-W417 HydrophobicContact CG1-CZ3 4.38Å; I407-W417 HydrophobicContact CG2-CE3 4.09Å; I407-W417 HydrophobicContact CG2-CZ3 4.34Å; E409-W417 WeakPolarHBondContact O-CA 3.48Å; R411-W417 VanDerWaalsContact N-NE1 3.17Å; R411-W417 PolarHBondContact O-NE1 3.34Å; W417-Q429 CarbonylContact O-C 3.6Å; W417-Q429 VanDerWaalsContact O-CA 3.28Å; W417-Q429 WeakPolarHBondContact O-CA 3.18Å; W417-F430 HydrophobicContact CB-CD1 4.5Å; W417-F430 HydrophobicContact CB-CE1 3.93Å; W417-F430 HydrophobicContact CB-CE2 4.37Å; W417-F430 HydrophobicContact CB-CZ 3.87Å; W417-F430 HydrophobicContact CE3-CZ 4.35Å; W417-F430 PolarHBondContact N-O 3.44Å; W417-F430 VanDerWaalsContact O-CD1 3.31Å; W417-F430 WeakPolarHBondContact O-CD1 3.31Å; W417-F430 PolarHBondContact O-N 2.82Å; W417-R432 HydrophobicContact CD2-CB 4.09Å; W417-R432 HydrophobicContact CD2-CG 3.93Å; W417-R432 VanDerWaalsContact CE2-CD 3.46Å; W417-R432 VanDerWaalsContact CE2-CG 3.44Å; W417-R432 HydrophobicContact CE3-CG 4.41Å; W417-R432 HydrophobicContact CG-CB 4.13Å; W417-R432 HydrophobicContact CG-CG 4.47Å; W417-R432 HydrophobicContact CH2-CG 4.12Å; W417-R432 HydrophobicContact CZ2-CG 3.58Å; W417-R432 HydrophobicContact CZ3-CG 4.49Å; W417-V435 HydrophobicContact CE3-CG2 4.13Å; W417-V435 HydrophobicContact CZ3-CG2 4.09Å; W417-T436 HydrophobicContact CH2-CG2 4.39Å
418	R	92.2	Very high	87.4	Confident	75 Å²	75	54 Å²	54	28%	0.283	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.7	170.5	-162	-177.4	-177.7	126.8	-0.8	109.2	D346 D347 I408 E409 V427 G428	D346-R418 PolarHBondContact O-NH2 3.46Å; D347-R418 IonicContact OD1-CZ 3.94Å; D347-R418 IonicContact OD1-NE 3.93Å; D347-R418 IonicContact OD1-NH2 3.76Å; D347-R418 PolarHBondContact OD1-NH2 3.15Å; I408-R418 WeakPolarHBondContact CB-O 3.21Å; I408-R418 HydrophobicContact CD1-CG 4.31Å; I408-R418 PolarHBondContact N-O 2.78Å; E409-R418 HydrophobicContact CB-CB 4.17Å; E409-R418 PolarHBondContact N-O 3.21Å; E409-R418 VanDerWaalsContact N-O 3.09Å; E409-R418 PolarHBondContact O-N 2.94Å; R418-V427 HydrophobicContact CG-CG1 4.12Å; R418-G428 WeakPolarHBondContact CA-O 3.36Å
419	G	93.7	Very high	87.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	169.4	179.7	0	0	0	0	0	113.2	L397 T406 I408 V427 G428	L397-G419 WeakPolarHBondContact CD2-O 3.37Å; T406-G419 CarbonylContact O-C 3.57Å; T406-G419 WeakPolarHBondContact O-CA 3.35Å; I408-G419 VanDerWaalsContact CD1-C 3.44Å; G419-V427 WeakPolarHBondContact O-CA 3.21Å; G419-G428 PolarHBondContact N-O 2.77Å; G419-G428 PolarHBondContact O-N 2.84Å
420	Q	94.8	Very high	88	Confident	3 Å²	3	54.1 Å²	54.1	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.6	171.1	-167.3	177.1	25	0	0	110	I216 L217 I218 I405 T406 I408 R422 L425 R426 V427	I216-Q420 PolarHBondContact O-NE2 2.84Å; L217-Q420 VanDerWaalsContact CA-OE1 3.29Å; L217-Q420 HydrophobicContact CD2-CG 4.48Å; I218-Q420 HydrophobicContact CD1-CB 4.38Å; I405-Q420 CarbonylContact C-O 3.46Å; I405-Q420 WeakPolarHBondContact CA-O 3.44Å; T406-Q420 PolarHBondContact N-O 3.32Å; T406-Q420 PolarHBondContact O-N 3.49Å; I408-Q420 HydrophobicContact CD1-CB 4.27Å; Q420-R422 PolarHBondContact O-N 3.03Å; Q420-L425 WeakPolarHBondContact CG-O 3.2Å; Q420-L425 PolarHBondContact NE2-O 3.14Å; Q420-R426 CarbonylContact C-O 3.59Å; Q420-R426 VanDerWaalsContact CA-O 3.31Å; Q420-R426 WeakPolarHBondContact CA-O 3.49Å; Q420-R426 WeakPolarHBondContact CG-O 3.29Å; Q420-V427 HydrophobicContact CB-CG2 3.92Å; Q420-V427 HydrophobicContact CG-CG2 3.74Å
421	N	95	Very high	88.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	119.4	172.8	178.5	-27.2	0	0	0	108.8	L397 Q398 D403 I405 R423 T424 L425 R426	L397-N421 HydrophobicContact CD1-CB 3.87Å; L397-N421 HydrophobicContact CD2-CB 4.23Å; L397-N421 HydrophobicContact CG-CB 4.26Å; Q398-N421 PolarHBondContact O-ND2 3.4Å; D403-N421 PolarHBondContact OD2-ND2 3.43Å; I405-N421 HydrophobicContact CD1-CB 3.79Å; N421-R423 VanDerWaalsContact C-N 3.29Å; N421-R423 PolarHBondContact O-N 2.91Å; N421-R423 WeakPolarHBondContact OD1-CB 3.47Å; N421-R423 PolarHBondContact OD1-N 3.36Å; N421-T424 WeakPolarHBondContact CB-OG1 3.49Å; N421-T424 PolarHBondContact OD1-N 3.18Å; N421-L425 WeakPolarHBondContact O-CA 3.45Å; N421-L425 PolarHBondContact O-N 3.18Å; N421-R426 PolarHBondContact N-O 3.49Å
422	R	93.9	Very high	89.3	Confident	85 Å²	85	51.8 Å²	51.8	32%	0.321	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-16	-174	-63.9	174.7	74.3	114	-11.4	114.1	L217 S219 D384 V404 T406 Q420 L425	L217-R422 HydrophobicContact CD1-CG 4.49Å; L217-R422 HydrophobicContact CD2-CB 4.33Å; L217-R422 HydrophobicContact CD2-CG 4Å; S219-R422 PolarHBondContact OG-NH1 2.77Å; D384-R422 WeakPolarHBondContact OD1-CD 3.18Å; D384-R422 IonicContact OD1-CZ 2.8Å; D384-R422 IonicContact OD1-NE 3.99Å; D384-R422 IonicContact OD1-NH1 3.78Å; D384-R422 PolarHBondContact OD1-NH1 3.09Å; D384-R422 IonicContact OD2-CZ 3.73Å; D384-R422 VanDerWaalsContact OD2-CZ 3.25Å; D384-R422 IonicContact OD2-NE 3.95Å; D384-R422 IonicContact OD2-NH1 2.74Å; D384-R422 PolarHBondContact OD2-NH1 2.89Å; D384-R422 IonicContact OD2-NH2 2.77Å; V404-R422 VanDerWaalsContact O-CB 3.28Å; V404-R422 WeakPolarHBondContact O-CB 3.38Å; V404-R422 VanDerWaalsContact O-CG 3.28Å; V404-R422 WeakPolarHBondContact O-CG 3.32Å; V404-R422 PolarHBondContact O-N 3.49Å; T406-R422 WeakPolarHBondContact OG1-CG 3.36Å; Q420-R422 PolarHBondContact O-N 3.03Å; R422-L425 WeakPolarHBondContact O-CD2 3.22Å
423	R	93.1	Very high	89.9	Confident	125 Å²	125	51 Å²	51	47%	0.472	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-48.4	174.5	177.6	-178.1	55.8	86.3	6.1	111.3	D403 N421	D403-R423 WeakPolarHBondContact OD1-CB 3.31Å; D403-R423 WeakPolarHBondContact OD1-CD 3.33Å; D403-R423 IonicContact OD1-CZ 2.7Å; D403-R423 IonicContact OD1-NE 2.69Å; D403-R423 PolarHBondContact OD1-NE 3.34Å; D403-R423 IonicContact OD1-NH2 2.67Å; D403-R423 IonicContact OD2-CZ 2.69Å; D403-R423 IonicContact OD2-NE 2.67Å; D403-R423 PolarHBondContact OD2-NE 2.83Å; D403-R423 IonicContact OD2-NH2 3.25Å; D403-R423 PolarHBondContact OD2-NH2 3.36Å; N421-R423 VanDerWaalsContact C-N 3.29Å; N421-R423 PolarHBondContact O-N 2.91Å; N421-R423 WeakPolarHBondContact OD1-CB 3.47Å; N421-R423 PolarHBondContact OD1-N 3.36Å
424	T	91.6	Very high	91	Very high	43 Å²	43	47.2 Å²	47.2	26%	0.264	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-14.7	-179.1	66.6	0	0	0	0	113.1	N421 R426	N421-T424 WeakPolarHBondContact CB-OG1 3.49Å; N421-T424 PolarHBondContact OD1-N 3.18Å; T424-R426 PolarHBondContact O-N 3.3Å; T424-R426 VanDerWaalsContact O-N 3.07Å; T424-R426 PolarHBondContact OG1-N 2.74Å
425	L	90.8	Very high	91.5	Very high	56 Å²	56	46.1 Å²	46.1	29%	0.293	20%	0.197	S	C	.	.			trans	60.6	1.5	-172.2	-49.6	175	0	0	0	115.2	H215 L217 Q420 N421 R422	H215-L425 HydrophobicContact CB-CB 3.39Å; H215-L425 HydrophobicContact CB-CD1 4.13Å; H215-L425 HydrophobicContact CB-CG 4.38Å; H215-L425 PolarHBondContact ND1-O 3.48Å; L217-L425 HydrophobicContact CD2-CD2 3.54Å; L217-L425 HydrophobicContact CG-CD2 4.17Å; Q420-L425 WeakPolarHBondContact CG-O 3.2Å; Q420-L425 PolarHBondContact NE2-O 3.14Å; N421-L425 WeakPolarHBondContact O-CA 3.45Å; N421-L425 PolarHBondContact O-N 3.18Å; R422-L425 WeakPolarHBondContact O-CD2 3.22Å
426	R	91.3	Very high	91.5	Very high	152 Å²	152	43.9 Å²	43.9	57%	0.574	19%	0.192	S	C	*	.			trans	-72.3	148.4	177.8	-68	-171.5	172.8	-144.7	-1.5	111.5	L397 Q420 N421 T424	L397-R426 HydrophobicContact CD1-CB 4.04Å; L397-R426 WeakPolarHBondContact CD1-O 3.35Å; Q420-R426 CarbonylContact C-O 3.59Å; Q420-R426 VanDerWaalsContact CA-O 3.31Å; Q420-R426 WeakPolarHBondContact CA-O 3.49Å; Q420-R426 WeakPolarHBondContact CG-O 3.29Å; N421-R426 PolarHBondContact N-O 3.49Å; T424-R426 PolarHBondContact O-N 3.3Å; T424-R426 VanDerWaalsContact O-N 3.07Å; T424-R426 PolarHBondContact OG1-N 2.74Å
427	V	91.6	Very high	90.5	Very high	28 Å²	28	44.7 Å²	44.7	17%	0.17	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.5	170.3	-179.8	0	0	0	0	109.1	I218 D347 I408 R418 G419 Q420	I218-V427 HydrophobicContact CD1-CG2 3.72Å; D347-V427 HydrophobicContact CB-CG1 4.47Å; D347-V427 HydrophobicContact CB-CG2 4.27Å; D347-V427 WeakPolarHBondContact OD1-CB 3.25Å; D347-V427 WeakPolarHBondContact OD1-CG1 3.33Å; D347-V427 WeakPolarHBondContact OD2-CG2 3.48Å; I408-V427 HydrophobicContact CD1-CB 4.37Å; I408-V427 HydrophobicContact CD1-CG1 3.4Å; I408-V427 HydrophobicContact CD1-CG2 4.12Å; R418-V427 HydrophobicContact CG-CG1 4.12Å; G419-V427 WeakPolarHBondContact O-CA 3.21Å; Q420-V427 HydrophobicContact CB-CG2 3.92Å; Q420-V427 HydrophobicContact CG-CG2 3.74Å
428	G	92.8	Very high	88.7	Confident	12 Å²	12	48.9 Å²	48.9	12%	0.124	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-179.1	172.3	0	0	0	0	0	112.7	R418 G419	R418-G428 WeakPolarHBondContact CA-O 3.36Å; G419-G428 PolarHBondContact N-O 2.77Å; G419-G428 PolarHBondContact O-N 2.84Å
429	Q	94.7	Very high	86.5	Confident	85 Å²	85	49.1 Å²	49.1	40%	0.397	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	147.9	171.1	-73.8	179.3	-24.9	0	0	111.3	K396 L397 W416 W417	K396-Q429 WeakPolarHBondContact CB-O 3.38Å; K396-Q429 HydrophobicContact CD-CB 4.12Å; L397-Q429 WeakPolarHBondContact CB-O 3.44Å; L397-Q429 PolarHBondContact N-O 2.77Å; W416-Q429 HydrophobicContact CE3-CB 4.07Å; W417-Q429 CarbonylContact O-C 3.6Å; W417-Q429 VanDerWaalsContact O-CA 3.28Å; W417-Q429 WeakPolarHBondContact O-CA 3.18Å
430	F	94.8	Very high	84.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	159.3	170.4	69.4	-80.2	0	0	0	110.8	F391 L397 I399 I405 I407 W417 V434 V435	F391-F430 HydrophobicContact CD1-CB 3.96Å; F391-F430 HydrophobicContact CE1-CB 3.91Å; L397-F430 HydrophobicContact CB-CB 4.39Å; L397-F430 HydrophobicContact CD2-CD1 4.02Å; I399-F430 HydrophobicContact CD1-CB 3.61Å; I399-F430 HydrophobicContact CD1-CD1 4.18Å; I399-F430 HydrophobicContact CD1-CD2 3.69Å; I399-F430 HydrophobicContact CD1-CE2 4.43Å; I399-F430 HydrophobicContact CD1-CG 3.54Å; I405-F430 HydrophobicContact CG2-CE1 3.86Å; I405-F430 HydrophobicContact CG2-CZ 4.07Å; I407-F430 HydrophobicContact CD1-CE1 4.37Å; I407-F430 HydrophobicContact CD1-CZ 3.77Å; W417-F430 HydrophobicContact CB-CD1 4.5Å; W417-F430 HydrophobicContact CB-CE1 3.93Å; W417-F430 HydrophobicContact CB-CE2 4.37Å; W417-F430 HydrophobicContact CB-CZ 3.87Å; W417-F430 HydrophobicContact CE3-CZ 4.35Å; W417-F430 PolarHBondContact N-O 3.44Å; W417-F430 VanDerWaalsContact O-CD1 3.31Å; W417-F430 WeakPolarHBondContact O-CD1 3.31Å; W417-F430 PolarHBondContact O-N 2.82Å; F430-V434 HydrophobicContact CD2-CB 4.1Å; F430-V435 HydrophobicContact CE2-CB 4.38Å; F430-V435 HydrophobicContact CE2-CG1 3.72Å; F430-V435 HydrophobicContact CE2-CG2 3.81Å; F430-V435 HydrophobicContact CZ-CG1 4.21Å; F430-V435 HydrophobicContact CZ-CG2 4.17Å
431	P	92.1	Very high	81.9	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.3	178.1	-21.2	33.4	0	0	0	112.8	F391 Y415 W416 H433 V434	F391-P431 HydrophobicContact CD2-CG 3.99Å; F391-P431 HydrophobicContact CE2-CG 3.68Å; F391-P431 VanDerWaalsContact CZ-CD 3.42Å; F391-P431 HydrophobicContact CZ-CG 4.01Å; Y415-P431 HydrophobicContact CD1-CB 4.38Å; Y415-P431 HydrophobicContact CE1-CB 3.71Å; Y415-P431 HydrophobicContact CE1-CG 3.83Å; Y415-P431 HydrophobicContact CE2-CB 4.29Å; Y415-P431 CarbonylContact O-C 3.47Å; Y415-P431 WeakPolarHBondContact O-CA 3.26Å; W416-P431 HydrophobicContact CH2-CG 4.34Å; W416-P431 HydrophobicContact CZ3-CG 3.95Å; P431-H433 WeakPolarHBondContact CB-CE1 3.29Å; P431-H433 PolarHBondContact O-N 3.47Å; P431-V434 HydrophobicContact CB-CG2 4.16Å; P431-V434 HydrophobicContact CG-CG2 4.32Å; P431-V434 WeakPolarHBondContact O-CB 3.26Å; P431-V434 WeakPolarHBondContact O-CG2 3.41Å; P431-V434 PolarHBondContact O-N 2.92Å
432	R	89.1	Confident	79.4	Confident	84 Å²	84	61 Å²	61	32%	0.317	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-49.8	-35.9	178.5	179.1	176.7	62.1	69.9	-11.1	113.5	A412 H414 Y415 W417 V434 V435 T436	A412-R432 PolarHBondContact O-NE 2.94Å; H414-R432 PolarHBondContact O-NE 3.18Å; Y415-R432 WeakPolarHBondContact O-CB 3.44Å; Y415-R432 PolarHBondContact O-N 3.1Å; W417-R432 HydrophobicContact CD2-CB 4.09Å; W417-R432 HydrophobicContact CD2-CG 3.93Å; W417-R432 VanDerWaalsContact CE2-CD 3.46Å; W417-R432 VanDerWaalsContact CE2-CG 3.44Å; W417-R432 HydrophobicContact CE3-CG 4.41Å; W417-R432 HydrophobicContact CG-CB 4.13Å; W417-R432 HydrophobicContact CG-CG 4.47Å; W417-R432 HydrophobicContact CH2-CG 4.12Å; W417-R432 HydrophobicContact CZ2-CG 3.58Å; W417-R432 HydrophobicContact CZ3-CG 4.49Å; R432-V434 PolarHBondContact O-N 3.48Å; R432-V435 PolarHBondContact O-N 2.66Å; R432-T436 HydrophobicContact CG-CG2 4.14Å; R432-T436 PolarHBondContact NH1-OG1 2.85Å; R432-T436 VanDerWaalsContact NH1-OG1 3.15Å; R432-T436 PolarHBondContact O-N 2.78Å; R432-T436 VanDerWaalsContact O-N 3.17Å; R432-T436 PolarHBondContact O-OG1 3.3Å
433	H	86.3	Confident	77.2	Confident	56 Å²	56	61.1 Å²	61.1	26%	0.259	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19.5	-177.2	69.1	-105.8	0	0	0	113.5	Q389 Y415 P431 V435 T436 V438	Q389-H433 PolarHBondContact NE2-NE2 3.48Å; Y415-H433 AromaticContact CE2-ND1 3.91Å; Y415-H433 PolarHBondContact OH-CE1 2.96Å; P431-H433 WeakPolarHBondContact CB-CE1 3.29Å; P431-H433 PolarHBondContact O-N 3.47Å; H433-V435 PolarHBondContact O-N 3.41Å; H433-T436 PolarHBondContact O-N 3.3Å; H433-T436 VanDerWaalsContact O-O 3.07Å; H433-V438 HydrophobicContact CB-CG2 4.34Å
434	V	91.2	Very high	74.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-63.1	-27.2	176.3	178.4	0	0	0	0	112.1	A387 L388 Q389 F391 I399 F430 P431 R432	A387-V434 WeakPolarHBondContact CA-O 3.41Å; A387-V434 HydrophobicContact CB-CG1 4.38Å; L388-V434 PolarHBondContact N-O 3.37Å; Q389-V434 HydrophobicContact CG-CB 4.35Å; Q389-V434 HydrophobicContact CG-CG1 4.2Å; Q389-V434 HydrophobicContact CG-CG2 4.35Å; F391-V434 HydrophobicContact CB-CG1 4.11Å; F391-V434 HydrophobicContact CB-CG2 3.68Å; F391-V434 HydrophobicContact CD2-CG2 4.44Å; F391-V434 HydrophobicContact CG-CG2 4.03Å; I399-V434 HydrophobicContact CB-CG1 4.37Å; I399-V434 HydrophobicContact CD1-CG1 4Å; I399-V434 HydrophobicContact CG2-CG1 3.8Å; F430-V434 HydrophobicContact CD2-CB 4.1Å; P431-V434 HydrophobicContact CB-CG2 4.16Å; P431-V434 HydrophobicContact CG-CG2 4.32Å; P431-V434 WeakPolarHBondContact O-CB 3.26Å; P431-V434 WeakPolarHBondContact O-CG2 3.41Å; P431-V434 PolarHBondContact O-N 2.92Å; R432-V434 PolarHBondContact O-N 3.48Å
435	V	89.6	Confident	72.4	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.042	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-2.1	177.9	-57.1	0	0	0	0	113.9	M385 I405 I407 W417 F430 R432 H433	M385-V435 HydrophobicContact CB-CB 4.07Å; M385-V435 HydrophobicContact CB-CG1 4.43Å; M385-V435 HydrophobicContact CB-CG2 4.37Å; M385-V435 HydrophobicContact CE-CB 4.31Å; M385-V435 HydrophobicContact CE-CG2 4.04Å; M385-V435 WeakPolarHBondContact CE-O 3.37Å; M385-V435 HydrophobicContact SD-CG2 4.05Å; I405-V435 HydrophobicContact CB-CG1 4.49Å; I405-V435 HydrophobicContact CG1-CG1 4.14Å; I407-V435 HydrophobicContact CD1-CG2 4.45Å; W417-V435 HydrophobicContact CE3-CG2 4.13Å; W417-V435 HydrophobicContact CZ3-CG2 4.09Å; F430-V435 HydrophobicContact CE2-CB 4.38Å; F430-V435 HydrophobicContact CE2-CG1 3.72Å; F430-V435 HydrophobicContact CE2-CG2 3.81Å; F430-V435 HydrophobicContact CZ-CG1 4.21Å; F430-V435 HydrophobicContact CZ-CG2 4.17Å; R432-V435 PolarHBondContact O-N 2.66Å; H433-V435 PolarHBondContact O-N 3.41Å
436	T	82.9	Confident	70.4	Confident	30 Å²	30	67.1 Å²	67.1	18%	0.184	39%	0.39	C	S	.	.	S	Bend	trans	-125.2	118.7	179.7	57.8	0	0	0	0	110.8	M385 W417 R432 H433 V438	M385-T436 HydrophobicContact CE-CG2 4.04Å; W417-T436 HydrophobicContact CH2-CG2 4.39Å; R432-T436 HydrophobicContact CG-CG2 4.14Å; R432-T436 PolarHBondContact NH1-OG1 2.85Å; R432-T436 VanDerWaalsContact NH1-OG1 3.15Å; R432-T436 PolarHBondContact O-N 2.78Å; R432-T436 VanDerWaalsContact O-N 3.17Å; R432-T436 PolarHBondContact O-OG1 3.3Å; H433-T436 PolarHBondContact O-N 3.3Å; H433-T436 VanDerWaalsContact O-O 3.07Å; T436-V438 PolarHBondContact O-N 2.88Å
437	S	66.5	Low	68.2	Low	72 Å²	72	63.8 Å²	63.8	50%	0.503	39%	0.39	S	S	.	.			trans	-67.4	126.3	175.2	-170.2	0	0	0	0	109.8	L388 A439	L388-S437 VanDerWaalsContact CD1-N 3.32Å; S437-A439 PolarHBondContact OG-N 2.77Å; S437-A439 PolarHBondContact OG-O 3.23Å
438	V	55.8	Low	66	Low	113 Å²	113	73.4 Å²	73.4	69%	0.685	42%	0.423	S	S	*	.	S	Bend	trans	-79.5	-26	170.4	-167.3	0	0	0	0	110.6	H433 T436	H433-V438 HydrophobicContact CB-CG2 4.34Å; T436-V438 PolarHBondContact O-N 2.88Å
439	A	44.9	Very low	63.9	Low	80 Å²	80	76.5 Å²	76.5	66%	0.661	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	129.2	173.7	0	0	0	0	0	111	S437	S437-A439 PolarHBondContact OG-N 2.77Å; S437-A439 PolarHBondContact OG-O 3.23Å
440	G	45.6	Very low	61.6	Low	80 Å²	80	77.1 Å²	77.1	83%	0.825	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	105.8	5.2	172	0	0	0	0	0	116.8	S442	G440-S442 PolarHBondContact O-N 3.36Å
441	L	45.9	Very low	59.1	Low	121 Å²	121	85.9 Å²	85.9	63%	0.634	49%	0.485	S	S	*	.			trans	-63.6	124.8	165.8	-64.9	174.5	0	0	0	109.5	D445	L441-D445 HydrophobicContact CB-CB 4.36Å; L441-D445 HydrophobicContact CD2-CB 3.88Å
442	S	44.1	Very low	56.7	Low	52 Å²	52	94.2 Å²	94.2	36%	0.364	52%	0.524	S	S	.	.			trans	-80.4	169.1	170	80.1	0	0	0	0	110.6	G440 Q444 D445	G440-S442 PolarHBondContact O-N 3.36Å; S442-Q444 PolarHBondContact O-N 3.35Å; S442-Q444 PolarHBondContact OG-N 2.97Å; S442-Q444 VanDerWaalsContact OG-N 3.12Å; S442-D445 WeakPolarHBondContact CA-OD2 3.49Å; S442-D445 WeakPolarHBondContact CB-OD2 3.42Å; S442-D445 PolarHBondContact N-OD2 3.37Å; S442-D445 PolarHBondContact O-N 2.81Å; S442-D445 PolarHBondContact OG-OD2 3.29Å
443	A	46.2	Very low	54.6	Low	87 Å²	87	92.6 Å²	92.6	72%	0.719	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-8.2	172.3	0	0	0	0	0	114
444	Q	41.3	Very low	52.5	Low	187 Å²	187	99.9 Å²	99.9	87%	0.874	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	-13.7	177.3	-61.1	163.9	17.1	0	0	112.3	S442	S442-Q444 PolarHBondContact O-N 3.35Å; S442-Q444 PolarHBondContact OG-N 2.97Å; S442-Q444 VanDerWaalsContact OG-N 3.12Å
445	D	43.6	Very low	50.6	Low	94 Å²	94	102.4 Å²	102.4	50%	0.503	57%	0.569	S	S	.	*	S	Bend	trans	-95.3	6.6	180	-55.8	-69.1	0	0	0	113	L441 S442 S447	L441-D445 HydrophobicContact CB-CB 4.36Å; L441-D445 HydrophobicContact CD2-CB 3.88Å; S442-D445 WeakPolarHBondContact CA-OD2 3.49Å; S442-D445 WeakPolarHBondContact CB-OD2 3.42Å; S442-D445 PolarHBondContact N-OD2 3.37Å; S442-D445 PolarHBondContact O-N 2.81Å; S442-D445 PolarHBondContact OG-OD2 3.29Å; D445-S447 PolarHBondContact O-N 2.98Å
446	I	49.2	Very low	48.7	Very low	69 Å²	69	106.1 Å²	106.1	35%	0.354	59%	0.586	S	S	.	*	P	Polyproline II helix	trans	-65.6	121.9	-179	-56.3	178	0	0	0	109.2
447	S	45.1	Very low	47.1	Very low	82 Å²	82	108.3 Å²	108.3	57%	0.573	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-58	149.1	175.4	55.6	0	0	0	0	111.6	D445	D445-S447 PolarHBondContact O-N 2.98Å
448	R	45.2	Very low	46.3	Very low	229 Å²	229	106 Å²	106	86%	0.864	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-49.6	141.9	168.8	-67.3	-176.8	178.9	-176.1	-0.4	110.2	L450	R448-L450 PolarHBondContact O-N 3.09Å
449	P	47.5	Very low	45.9	Very low	78 Å²	78	106.7 Å²	106.7	51%	0.506	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-50.1	130.7	-177.9	-30.1	36.2	0	0	0	112.2	K451	P449-K451 PolarHBondContact O-N 2.81Å
450	L	47.6	Very low	46.1	Very low	97 Å²	97	106.7 Å²	106.7	51%	0.508	59%	0.59	S	S	.	*	P	Polyproline II helix	trans	-54.7	130.8	173.6	-73.3	173.1	0	0	0	108.6	E413 R448 H452 S453	E413-L450 HydrophobicContact CB-CD2 3.81Å; R448-L450 PolarHBondContact O-N 3.09Å; L450-H452 PolarHBondContact O-N 2.97Å; L450-S453 VanDerWaalsContact O-CB 3.29Å; L450-S453 WeakPolarHBondContact O-CB 3.45Å; L450-S453 PolarHBondContact O-N 3.49Å
451	K	40.9	Very low	46	Very low	184 Å²	184	106.3 Å²	106.3	80%	0.8	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	126.2	-176.8	-155.9	-177.7	-178.6	-171.2	0	108.6	P449 S453	P449-K451 PolarHBondContact O-N 2.81Å; K451-S453 VanDerWaalsContact C-N 3.32Å
452	H	41.8	Very low	46.2	Very low	177 Å²	177	107.7 Å²	107.7	82%	0.819	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.4	5.2	-171	-45.4	-83.4	0	0	0	116.2	L450	L450-H452 PolarHBondContact O-N 2.97Å
453	S	45.6	Very low	46.4	Very low	49 Å²	49	107.6 Å²	107.6	34%	0.343	58%	0.578	S	S	.	*			trans	-76.2	130	161.5	179.1	0	0	0	0	110.4	L450 K451 I455	L450-S453 VanDerWaalsContact O-CB 3.29Å; L450-S453 WeakPolarHBondContact O-CB 3.45Å; L450-S453 PolarHBondContact O-N 3.49Å; K451-S453 VanDerWaalsContact C-N 3.32Å; S453-I455 VanDerWaalsContact C-N 3.3Å; S453-I455 PolarHBondContact OG-N 2.96Å; S453-I455 PolarHBondContact OG-O 3.45Å; S453-I455 VanDerWaalsContact OG-O 3.14Å
454	F	41.8	Very low	46.8	Very low	210 Å²	210	107.5 Å²	107.5	92%	0.921	57%	0.57	S	S	*	*			trans	-86.7	-0.8	167.9	-114.6	-88.2	0	0	0	112.9
455	I	51.5	Low	47.4	Very low	53 Å²	53	107.2 Å²	107.2	27%	0.272	57%	0.568	S	S	.	*			trans	-105.4	119.8	-172.7	-50.6	-177.8	0	0	0	109.2	S453 Y478 N481	S453-I455 VanDerWaalsContact C-N 3.3Å; S453-I455 PolarHBondContact OG-N 2.96Å; S453-I455 PolarHBondContact OG-O 3.45Å; S453-I455 VanDerWaalsContact OG-O 3.14Å; I455-Y478 HydrophobicContact CB-CD1 4.3Å; I455-Y478 HydrophobicContact CD1-CD1 4.03Å; I455-Y478 HydrophobicContact CG1-CD1 3.82Å; I455-Y478 HydrophobicContact CG1-CE1 4.24Å; I455-Y478 HydrophobicContact CG2-CD1 3.77Å; I455-Y478 HydrophobicContact CG2-CE1 4.46Å; I455-Y478 HydrophobicContact CG2-CG 4.32Å; I455-N481 WeakPolarHBondContact CD1-O 3.28Å
456	H	49.7	Very low	47.8	Very low	85 Å²	85	111.1 Å²	111.1	39%	0.394	58%	0.576	S	S	.	*			trans	-117.9	113.2	174.4	-157	-44.5	0	0	0	108.6	H459	H456-H459 AromaticContact CE1-CE1 3.5Å; H456-H459 AromaticContact CE1-ND1 3.79Å; H456-H459 AromaticContact NE2-CE1 3.74Å
457	T	48.5	Very low	47.9	Very low	76 Å²	76	108.8 Å²	108.8	47%	0.466	57%	0.566	S	S	.	*			trans	-79.3	141.6	170.9	44.3	0	0	0	0	109.8
458	G	49.9	Very low	47.9	Very low	23 Å²	23	112.8 Å²	112.8	24%	0.237	57%	0.568	C	S	.	*			trans	58.8	109.4	169.1	0	0	0	0	0	117.8	W468 G469	G458-W468 CarbonylContact C-O 3.6Å; G458-W468 WeakPolarHBondContact CA-O 3.39Å; G458-G469 PolarHBondContact N-O 2.87Å
459	H	48	Very low	48.1	Very low	128 Å²	128	103.2 Å²	103.2	59%	0.593	54%	0.54	S	S	*	.	B	Isolated β-bridge	trans	-126.9	119	146.8	-91.2	39.5	0	0	0	108.6	H456 S467 W468	H456-H459 AromaticContact CE1-CE1 3.5Å; H456-H459 AromaticContact CE1-ND1 3.79Å; H456-H459 AromaticContact NE2-CE1 3.74Å; H459-S467 CarbonylContact O-C 3.48Å; H459-S467 VanDerWaalsContact O-CA 3.24Å; H459-S467 WeakPolarHBondContact O-CA 3.28Å; H459-W468 PolarHBondContact N-O 3.4Å; H459-W468 PolarHBondContact O-N 3.01Å
460	G	48.5	Very low	48.2	Very low	79 Å²	79	103.4 Å²	103.4	81%	0.814	54%	0.535	S	S	*	.			trans	-88.5	121.5	174.3	0	0	0	0	0	111.3
461	D	44.3	Very low	48.1	Very low	73 Å²	73	102.8 Å²	102.8	39%	0.39	54%	0.544	S	S	.	.			trans	-95.1	153.9	164.8	-169	-35.1	0	0	0	108.8	D463 R466 S467	D461-D463 PolarHBondContact O-N 3.46Å; D461-D463 PolarHBondContact OD1-N 3.1Å; D461-R466 HydrophobicContact CB-CB 3.81Å; D461-R466 VanDerWaalsContact OD2-CB 3.22Å; D461-R466 WeakPolarHBondContact OD2-CB 3.34Å; D461-R466 VanDerWaalsContact OD2-CD 3.25Å; D461-R466 WeakPolarHBondContact OD2-CD 3.5Å; D461-S467 PolarHBondContact N-OG 3.43Å; D461-S467 PolarHBondContact O-OG 3.42Å
462	T	49	Very low	48.4	Very low	149 Å²	149	101.2 Å²	101.2	91%	0.914	54%	0.544	S	S	*	.	S	Bend	trans	-52.9	-26.7	162.5	36.3	0	0	0	0	114.4	P464	T462-P464 WeakPolarHBondContact O-CD 3.5Å
463	D	49.3	Very low	48.8	Very low	50 Å²	50	103.2 Å²	103.2	27%	0.267	54%	0.544	S	S	.	.	S	Bend	trans	-93.8	111.6	168.9	-178.9	-9.4	0	0	0	110.1	D461 H465 R466 S467	D461-D463 PolarHBondContact O-N 3.46Å; D461-D463 PolarHBondContact OD1-N 3.1Å; D463-H465 PolarHBondContact O-N 3.46Å; D463-H465 WeakPolarHBondContact OD1-CB 3.44Å; D463-H465 IonicContact OD1-CD2 2.67Å; D463-H465 IonicContact OD1-CG 3.99Å; D463-H465 PolarHBondContact OD1-N 3.15Å; D463-R466 HydrophobicContact CB-CB 4.2Å; D463-R466 HydrophobicContact CB-CG 3.93Å; D463-R466 PolarHBondContact O-N 3.47Å; D463-R466 WeakPolarHBondContact OD2-CD 3.31Å; D463-R466 WeakPolarHBondContact OD2-CG 3.48Å; D463-R466 IonicContact OD2-CZ 3.15Å; D463-R466 IonicContact OD2-NE 2.68Å; D463-R466 PolarHBondContact OD2-NE 3.45Å; D463-R466 IonicContact OD2-NH2 2.75Å; D463-S467 PolarHBondContact O-N 2.9Å; D463-S467 PolarHBondContact O-OG 3.22Å
464	P	54.6	Low	49.1	Very low	86 Å²	86	104.2 Å²	104.2	56%	0.558	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-22.6	179.2	-26.5	35.6	0	0	0	114.5	T462	T462-P464 WeakPolarHBondContact O-CD 3.5Å
465	H	53.5	Low	49.3	Very low	181 Å²	181	98.9 Å²	98.9	84%	0.838	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-9.4	178.2	-62.1	-74.6	0	0	0	113.9	D463	D463-H465 PolarHBondContact O-N 3.46Å; D463-H465 WeakPolarHBondContact OD1-CB 3.44Å; D463-H465 IonicContact OD1-CD2 2.67Å; D463-H465 IonicContact OD1-CG 3.99Å; D463-H465 PolarHBondContact OD1-N 3.15Å
466	R	52.8	Low	49.3	Very low	176 Å²	176	100.9 Å²	100.9	66%	0.664	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-21.3	174.8	-63.9	177	-166.4	-111.5	-8	113.3	D461 D463 W468	D461-R466 HydrophobicContact CB-CB 3.81Å; D461-R466 VanDerWaalsContact OD2-CB 3.22Å; D461-R466 WeakPolarHBondContact OD2-CB 3.34Å; D461-R466 VanDerWaalsContact OD2-CD 3.25Å; D461-R466 WeakPolarHBondContact OD2-CD 3.5Å; D463-R466 HydrophobicContact CB-CB 4.2Å; D463-R466 HydrophobicContact CB-CG 3.93Å; D463-R466 PolarHBondContact O-N 3.47Å; D463-R466 WeakPolarHBondContact OD2-CD 3.31Å; D463-R466 WeakPolarHBondContact OD2-CG 3.48Å; D463-R466 IonicContact OD2-CZ 3.15Å; D463-R466 IonicContact OD2-NE 2.68Å; D463-R466 PolarHBondContact OD2-NE 3.45Å; D463-R466 IonicContact OD2-NH2 2.75Å; R466-W468 PolarHBondContact O-N 2.67Å
467	S	51.4	Low	49	Very low	19 Å²	19	103.2 Å²	103.2	13%	0.133	56%	0.559	C	S	.	*			trans	-60	117.2	176.6	-66.6	0	0	0	0	112.6	H459 D461 D463 H470	H459-S467 CarbonylContact O-C 3.48Å; H459-S467 VanDerWaalsContact O-CA 3.24Å; H459-S467 WeakPolarHBondContact O-CA 3.28Å; D461-S467 PolarHBondContact N-OG 3.43Å; D461-S467 PolarHBondContact O-OG 3.42Å; D463-S467 PolarHBondContact O-N 2.9Å; D463-S467 PolarHBondContact O-OG 3.22Å; S467-H470 WeakPolarHBondContact CB-CE1 3.43Å; S467-H470 PolarHBondContact O-ND1 3.2Å
468	W	44.6	Very low	48.9	Very low	167 Å²	167	103.7 Å²	103.7	63%	0.633	55%	0.553	S	S	*	*	B	Isolated β-bridge	trans	-101.5	139.9	-175.4	-149.7	56.8	0	0	0	111.6	G458 H459 R466 Y478	G458-W468 CarbonylContact C-O 3.6Å; G458-W468 WeakPolarHBondContact CA-O 3.39Å; H459-W468 PolarHBondContact N-O 3.4Å; H459-W468 PolarHBondContact O-N 3.01Å; R466-W468 PolarHBondContact O-N 2.67Å; W468-Y478 HydrophobicContact CH2-CE2 4.4Å; W468-Y478 WeakPolarHBondContact CH2-OH 3.33Å; W468-Y478 HydrophobicContact CZ2-CE2 4.47Å
469	G	48.9	Very low	48.9	Very low	27 Å²	27	108.1 Å²	108.1	28%	0.278	57%	0.571	S	S	.	*	S	Bend	trans	70	40.7	-177.6	0	0	0	0	0	114.6	G458	G458-G469 PolarHBondContact N-O 2.87Å
470	H	49.2	Very low	48.7	Very low	83 Å²	83	105 Å²	105	38%	0.384	57%	0.574	S	S	.	*			trans	-56.3	140.5	165.4	-94.9	99.7	0	0	0	110.9	S467 D472 R473 I474	S467-H470 WeakPolarHBondContact CB-CE1 3.43Å; S467-H470 PolarHBondContact O-ND1 3.2Å; H470-D472 PolarHBondContact O-N 3.41Å; H470-R473 HydrophobicContact CB-CB 4.49Å; H470-R473 CarbonylContact O-C 3.55Å; H470-R473 PolarHBondContact O-N 3.29Å; H470-I474 PolarHBondContact O-N 2.78Å
471	A	46.4	Very low	48.5	Very low	84 Å²	84	105.6 Å²	105.6	69%	0.694	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-57.4	-35.9	179.6	0	0	0	0	0	113	R473	A471-R473 PolarHBondContact O-N 3.13Å
472	D	47.6	Very low	48.8	Very low	150 Å²	150	106.8 Å²	106.8	80%	0.802	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-77.2	-7.8	-179.9	-39.7	-42.7	0	0	0	113.3	H470	H470-D472 PolarHBondContact O-N 3.41Å
473	R	49.1	Very low	49	Very low	220 Å²	220	105.9 Å²	105.9	83%	0.83	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-146.4	53.8	-176.5	-87.4	-171.4	166.9	-174.2	-3.8	111.5	H470 A471	H470-R473 HydrophobicContact CB-CB 4.49Å; H470-R473 CarbonylContact O-C 3.55Å; H470-R473 PolarHBondContact O-N 3.29Å; A471-R473 PolarHBondContact O-N 3.13Å
474	I	51.6	Low	49.5	Very low	69 Å²	69	107.6 Å²	107.6	35%	0.354	57%	0.566	S	S	.	*			trans	-75.7	125.3	161.5	-53.6	178.3	0	0	0	107.3	H470 L479	H470-I474 PolarHBondContact O-N 2.78Å; I474-L479 HydrophobicContact CB-CD1 4.21Å; I474-L479 HydrophobicContact CB-CG 4.24Å; I474-L479 HydrophobicContact CG2-CD1 4.3Å; I474-L479 HydrophobicContact CG2-CD2 4.41Å; I474-L479 HydrophobicContact CG2-CG 3.83Å
475	D	47.7	Very low	49.9	Very low	98 Å²	98	105.4 Å²	105.4	52%	0.524	55%	0.552	S	S	.	*			trans	-65.9	144.9	-178.2	-149.5	-29.8	0	0	0	111.1	L477 Y478 L479	D475-L477 PolarHBondContact O-N 2.85Å; D475-L477 VanDerWaalsContact O-N 3.13Å; D475-Y478 HydrophobicContact CB-CD2 3.74Å; D475-Y478 HydrophobicContact CB-CE2 4.27Å; D475-Y478 PolarHBondContact O-N 3.14Å; D475-L479 PolarHBondContact O-N 2.78Å
476	S	50.2	Low	50.5	Low	95 Å²	95	99.2 Å²	99.2	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-60.9	-27.1	-176	58.7	0	0	0	0	112.7	L479 G480	S476-L479 PolarHBondContact O-N 2.76Å; S476-G480 PolarHBondContact O-N 3.47Å
477	L	44.4	Very low	51.3	Low	135 Å²	135	92.7 Å²	92.7	71%	0.707	51%	0.506	S	S	*	.	H	α-helix	trans	-71.3	-26.8	175.4	-152.5	150.5	0	0	0	112.8	D475	D475-L477 PolarHBondContact O-N 2.85Å; D475-L477 VanDerWaalsContact O-N 3.13Å
478	Y	45.8	Very low	52.4	Low	86 Å²	86	95.4 Å²	95.4	34%	0.337	52%	0.518	S	S	.	.	H	α-helix	trans	-86.3	-32.4	172.6	-64.9	-62	0	0	0	112.6	I455 W468 D475 G480	I455-Y478 HydrophobicContact CB-CD1 4.3Å; I455-Y478 HydrophobicContact CD1-CD1 4.03Å; I455-Y478 HydrophobicContact CG1-CD1 3.82Å; I455-Y478 HydrophobicContact CG1-CE1 4.24Å; I455-Y478 HydrophobicContact CG2-CD1 3.77Å; I455-Y478 HydrophobicContact CG2-CE1 4.46Å; I455-Y478 HydrophobicContact CG2-CG 4.32Å; W468-Y478 HydrophobicContact CH2-CE2 4.4Å; W468-Y478 WeakPolarHBondContact CH2-OH 3.33Å; W468-Y478 HydrophobicContact CZ2-CE2 4.47Å; D475-Y478 HydrophobicContact CB-CD2 3.74Å; D475-Y478 HydrophobicContact CB-CE2 4.27Å; D475-Y478 PolarHBondContact O-N 3.14Å; Y478-G480 VanDerWaalsContact C-N 3.31Å
479	L	51	Low	53.6	Low	115 Å²	115	90.9 Å²	90.9	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-69.2	-28.1	170.5	-78.8	162.2	0	0	0	112.9	I474 D475 S476 N481 P482	I474-L479 HydrophobicContact CB-CD1 4.21Å; I474-L479 HydrophobicContact CB-CG 4.24Å; I474-L479 HydrophobicContact CG2-CD1 4.3Å; I474-L479 HydrophobicContact CG2-CD2 4.41Å; I474-L479 HydrophobicContact CG2-CG 3.83Å; D475-L479 PolarHBondContact O-N 2.78Å; S476-L479 PolarHBondContact O-N 2.76Å; L479-N481 VanDerWaalsContact C-N 3.32Å; L479-N481 PolarHBondContact O-N 3Å; L479-P482 WeakPolarHBondContact O-CD 3.35Å
480	G	43.3	Very low	54.3	Low	64 Å²	64	92.6 Å²	92.6	66%	0.66	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	0.4	179.3	0	0	0	0	0	115.4	S476 Y478	S476-G480 PolarHBondContact O-N 3.47Å; Y478-G480 VanDerWaalsContact C-N 3.31Å
481	N	44	Very low	54.9	Low	91 Å²	91	95 Å²	95	49%	0.487	53%	0.533	S	S	.	.			trans	-140.5	58	179.1	-162	12.9	0	0	0	113.8	I455 L479 M483	I455-N481 WeakPolarHBondContact CD1-O 3.28Å; L479-N481 VanDerWaalsContact C-N 3.32Å; L479-N481 PolarHBondContact O-N 3Å; N481-M483 PolarHBondContact O-N 2.76Å
482	P	50.3	Low	55.3	Low	97 Å²	97	98.9 Å²	98.9	63%	0.63	54%	0.543	S	S	*	.			trans	-65.7	102.8	156.7	30.9	-30.6	0	0	0	107.3	L479 D484	L479-P482 WeakPolarHBondContact O-CD 3.35Å; P482-D484 PolarHBondContact O-N 2.91Å
483	M	52.8	Low	55.6	Low	131 Å²	131	94 Å²	94	65%	0.645	52%	0.52	S	S	*	.			trans	-57.5	115.1	162.7	-80.1	-74.3	-68.8	0	0	107.2	N481 L489	N481-M483 PolarHBondContact O-N 2.76Å; M483-L489 HydrophobicContact CE-CD1 3.66Å; M483-L489 HydrophobicContact SD-CD1 4.44Å
484	D	59.8	Low	55.6	Low	86 Å²	86	87.1 Å²	87.1	46%	0.46	52%	0.518	S	S	.	.			trans	-53.6	144.5	175.8	-78.7	-54.9	0	0	0	109.8	P482 I488 L489	P482-D484 PolarHBondContact O-N 2.91Å; D484-I488 HydrophobicContact CB-CB 4.25Å; D484-I488 HydrophobicContact CB-CG2 4.02Å; D484-L489 HydrophobicContact CB-CD1 4.34Å; D484-L489 HydrophobicContact CB-CD2 3.85Å; D484-L489 HydrophobicContact CB-CG 3.77Å; D484-L489 WeakPolarHBondContact O-CD1 3.29Å; D484-L489 WeakPolarHBondContact O-CG 3.06Å
485	P	63.1	Low	55.2	Low	40 Å²	40	89 Å²	89	26%	0.26	54%	0.537	S	S	.	.			trans	-46.6	142.2	178.1	-34.6	39.2	0	0	0	112.7	D487 I488 L489	P485-D487 WeakPolarHBondContact CB-OD1 3.22Å; P485-D487 PolarHBondContact O-N 2.98Å; P485-I488 HydrophobicContact CB-CG1 4.45Å; P485-I488 HydrophobicContact CG-CD1 4.48Å; P485-I488 WeakPolarHBondContact O-CA 3.35Å; P485-I488 WeakPolarHBondContact O-CB 3.39Å; P485-I488 PolarHBondContact O-N 2.98Å; P485-L489 PolarHBondContact O-N 2.89Å; P485-L489 VanDerWaalsContact O-N 3.09Å
486	P	66.9	Low	55.3	Low	50 Å²	50	86.7 Å²	86.7	33%	0.325	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-29.8	-170.8	-26.8	36.3	0	0	0	113.8	E413 L489 G490 F491	E413-P486 VanDerWaalsContact O-CD 3.22Å; E413-P486 WeakPolarHBondContact O-CD 3.45Å; P486-L489 PolarHBondContact O-N 2.73Å; P486-G490 PolarHBondContact O-N 3.32Å; P486-G490 VanDerWaalsContact O-N 3.17Å; P486-F491 HydrophobicContact CB-CB 4.05Å; P486-F491 PolarHBondContact O-N 2.8Å
487	D	70.1	Confident	55.4	Low	40 Å²	40	93.3 Å²	93.3	21%	0.214	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.4	175.3	59.7	-52	0	0	0	114.3	H414 Y415 W416 P485	H414-D487 VanDerWaalsContact CA-OD1 3.28Å; H414-D487 WeakPolarHBondContact CA-OD1 3.35Å; Y415-D487 PolarHBondContact N-OD1 2.87Å; Y415-D487 PolarHBondContact N-OD2 2.96Å; W416-D487 PolarHBondContact N-OD2 3.35Å; P485-D487 WeakPolarHBondContact CB-OD1 3.22Å; P485-D487 PolarHBondContact O-N 2.98Å
488	I	74.8	Confident	56.3	Low	75 Å²	75	90.5 Å²	90.5	39%	0.385	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-39.6	168.9	-63.4	-172.6	0	0	0	110.6	Y415 D484 P485 G490	Y415-I488 HydrophobicContact CD1-CD1 4.04Å; Y415-I488 HydrophobicContact CD2-CD1 4.01Å; Y415-I488 HydrophobicContact CG-CD1 3.68Å; Y415-I488 HydrophobicContact CG-CG1 4.33Å; D484-I488 HydrophobicContact CB-CB 4.25Å; D484-I488 HydrophobicContact CB-CG2 4.02Å; P485-I488 HydrophobicContact CB-CG1 4.45Å; P485-I488 HydrophobicContact CG-CD1 4.48Å; P485-I488 WeakPolarHBondContact O-CA 3.35Å; P485-I488 WeakPolarHBondContact O-CB 3.39Å; P485-I488 PolarHBondContact O-N 2.98Å; I488-G490 PolarHBondContact O-N 2.99Å
489	L	68.9	Low	57.3	Low	72 Å²	72	90.2 Å²	90.2	38%	0.377	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-1.5	177.3	-68.6	-179.8	0	0	0	114.5	M483 D484 P485 P486 F491	M483-L489 HydrophobicContact CE-CD1 3.66Å; M483-L489 HydrophobicContact SD-CD1 4.44Å; D484-L489 HydrophobicContact CB-CD1 4.34Å; D484-L489 HydrophobicContact CB-CD2 3.85Å; D484-L489 HydrophobicContact CB-CG 3.77Å; D484-L489 WeakPolarHBondContact O-CD1 3.29Å; D484-L489 WeakPolarHBondContact O-CG 3.06Å; P485-L489 PolarHBondContact O-N 2.89Å; P485-L489 VanDerWaalsContact O-N 3.09Å; P486-L489 PolarHBondContact O-N 2.73Å; L489-F491 VanDerWaalsContact C-N 3.32Å; L489-F491 HydrophobicContact CB-CD2 3.62Å; L489-F491 HydrophobicContact CB-CE2 3.84Å; L489-F491 HydrophobicContact CD1-CD2 4.22Å; L489-F491 HydrophobicContact CD1-CE2 3.9Å; L489-F491 PolarHBondContact O-N 3.29Å
490	G	63.1	Low	58.7	Low	64 Å²	64	91.4 Å²	91.4	66%	0.66	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.2	19	-179.6	0	0	0	0	0	114.6	P486 I488 D492	P486-G490 PolarHBondContact O-N 3.32Å; P486-G490 VanDerWaalsContact O-N 3.17Å; I488-G490 PolarHBondContact O-N 2.99Å; G490-D492 PolarHBondContact O-N 3.07Å
491	F	62.1	Low	60.6	Low	132 Å²	132	88.9 Å²	88.9	58%	0.579	51%	0.51	S	S	*	.			trans	-80.9	110.5	173.3	-71.7	-63.4	0	0	0	110.9	P486 L489 S493	P486-F491 HydrophobicContact CB-CB 4.05Å; P486-F491 PolarHBondContact O-N 2.8Å; L489-F491 VanDerWaalsContact C-N 3.32Å; L489-F491 HydrophobicContact CB-CD2 3.62Å; L489-F491 HydrophobicContact CB-CE2 3.84Å; L489-F491 HydrophobicContact CD1-CD2 4.22Å; L489-F491 HydrophobicContact CD1-CE2 3.9Å; L489-F491 PolarHBondContact O-N 3.29Å; F491-S493 PolarHBondContact O-N 3.44Å
492	D	54.8	Low	62.3	Low	167 Å²	167	87.9 Å²	87.9	89%	0.893	51%	0.509	S	S	*	.			trans	-52.5	111.4	176.3	-93	-36.1	0	0	0	112.2	G490 G494	G490-D492 PolarHBondContact O-N 3.07Å; D492-G494 PolarHBondContact O-N 3.42Å
493	S	53.9	Low	63.9	Low	47 Å²	47	83.7 Å²	83.7	33%	0.329	48%	0.481	S	S	.	.			trans	-75.7	14	-172.5	-20	0	0	0	0	114	H414 F491 S495	H414-S493 VanDerWaalsContact CE1-CB 3.45Å; H414-S493 WeakPolarHBondContact CE1-CB 3.32Å; H414-S493 PolarHBondContact CE1-OG 3.3Å; H414-S493 VanDerWaalsContact CE1-OG 3.23Å; H414-S493 WeakPolarHBondContact NE2-CB 2.85Å; H414-S493 PolarHBondContact NE2-OG 3.33Å; F491-S493 PolarHBondContact O-N 3.44Å; S493-S495 PolarHBondContact O-N 2.9Å
494	G	48.3	Very low	65.3	Low	76 Å²	76	79.7 Å²	79.7	78%	0.784	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	9.5	-170.9	0	0	0	0	0	116.6	D492 A496	D492-G494 PolarHBondContact O-N 3.42Å; G494-A496 VanDerWaalsContact C-N 3.28Å; G494-A496 PolarHBondContact O-N 3.04Å
495	S	43.1	Very low	65.6	Low	109 Å²	109	79 Å²	79	76%	0.762	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-8.5	-176.7	73.8	0	0	0	0	114.8	S493 R497	S493-S495 PolarHBondContact O-N 2.9Å; S495-R497 PolarHBondContact O-N 2.81Å
496	A	49.6	Very low	65.3	Low	48 Å²	48	83.5 Å²	83.5	40%	0.397	48%	0.481	S	S	.	.			trans	-69.8	94.8	178.4	0	0	0	0	0	111.6	G494 P498	G494-A496 VanDerWaalsContact C-N 3.28Å; G494-A496 PolarHBondContact O-N 3.04Å; A496-P498 WeakPolarHBondContact O-CD 3.36Å
497	R	54.2	Low	64.2	Low	235 Å²	235	90.2 Å²	90.2	89%	0.887	51%	0.505	S	S	*	.			trans	-55.9	120.7	172.7	-70.4	-177.5	174.8	179.8	-1.5	109.6	S495	S495-R497 PolarHBondContact O-N 2.81Å
498	P	61.7	Low	62.5	Low	75 Å²	75	97.2 Å²	97.2	49%	0.487	53%	0.533	S	S	.	.			trans	-63.3	138.7	-177.1	25.2	-34.5	0	0	0	110.9	N354 A496 K500	N354-P498 HydrophobicContact CB-CB 4.03Å; A496-P498 WeakPolarHBondContact O-CD 3.36Å; P498-K500 PolarHBondContact O-N 3.01Å
499	T	68.1	Low	60.6	Low	80 Å²	80	99 Å²	99	49%	0.491	55%	0.55	S	S	.	.			trans	-62.1	105.1	-178.7	-59.5	0	0	0	0	110.3	Q358 F376 L501	Q358-T499 PolarHBondContact NE2-O 2.89Å; F376-T499 HydrophobicContact CD2-CG2 4.23Å; F376-T499 HydrophobicContact CE2-CG2 3.77Å; T499-L501 PolarHBondContact O-N 2.86Å
500	K	80	Confident	59.2	Low	141 Å²	141	100.7 Å²	100.7	61%	0.613	57%	0.565	S	S	*	*			trans	-78.4	110.8	-179.1	-175.1	166.4	-179.1	170.3	0	110.7	P498 N503	P498-K500 PolarHBondContact O-N 3.01Å; K500-N503 VanDerWaalsContact CE-ND2 3.32Å; K500-N503 WeakPolarHBondContact CE-ND2 3.3Å; K500-N503 WeakPolarHBondContact CE-OD1 3.49Å; K500-N503 PolarHBondContact NZ-ND2 2.7Å
501	L	82.7	Confident	57.9	Low	11 Å²	11	103.6 Å²	103.6	6%	0.058	57%	0.572	C	S	.	*			trans	-66.6	160	179.8	-60.7	-177.4	0	0	0	112.3	V355 P368 L373 F376 T499 N503	V355-L501 HydrophobicContact CG2-CD1 4.38Å; P368-L501 HydrophobicContact CB-CB 3.99Å; P368-L501 HydrophobicContact CB-CD1 4Å; P368-L501 HydrophobicContact CG-CD1 4.16Å; L373-L501 HydrophobicContact CD2-CD1 3.96Å; F376-L501 HydrophobicContact CB-CD1 4.44Å; F376-L501 HydrophobicContact CB-CD2 3.62Å; F376-L501 HydrophobicContact CD1-CD2 4.4Å; F376-L501 HydrophobicContact CD2-CD2 3.72Å; F376-L501 HydrophobicContact CE2-CD2 4.48Å; F376-L501 HydrophobicContact CG-CD2 3.65Å; T499-L501 PolarHBondContact O-N 2.86Å; L501-N503 PolarHBondContact O-N 3.2Å; L501-N503 PolarHBondContact O-OD1 3.06Å
502	P	80.7	Confident	56.5	Low	69 Å²	69	107.4 Å²	107.4	45%	0.448	58%	0.583	S	S	.	*			trans	-59.2	101.7	172	-26.2	35.5	0	0	0	113.7	A372	A372-P502 HydrophobicContact CB-CG 4.47Å
503	N	82.8	Confident	55.7	Low	10 Å²	10	104.3 Å²	104.3	5%	0.053	57%	0.572	C	S	.	*	B	Isolated β-bridge	trans	-51.3	140.2	167.9	-52.9	64.4	0	0	0	110.6	D366 K500 L501 A505 K506	D366-N503 WeakPolarHBondContact CA-ND2 3.49Å; D366-N503 PolarHBondContact O-ND2 3.33Å; D366-N503 PolarHBondContact OD1-ND2 3.02Å; K500-N503 VanDerWaalsContact CE-ND2 3.32Å; K500-N503 WeakPolarHBondContact CE-ND2 3.3Å; K500-N503 WeakPolarHBondContact CE-OD1 3.49Å; K500-N503 PolarHBondContact NZ-ND2 2.7Å; L501-N503 PolarHBondContact O-N 3.2Å; L501-N503 PolarHBondContact O-OD1 3.06Å; N503-A505 PolarHBondContact O-N 2.98Å; N503-K506 WeakPolarHBondContact O-CB 3.4Å; N503-K506 PolarHBondContact O-N 3.05Å
504	R	82.8	Confident	54.9	Low	46 Å²	46	108.1 Å²	108.1	17%	0.174	60%	0.595	C	S	.	*	T	Hydrogen-bonded Turn	trans	-51.4	-30.5	179.2	-76.5	159.5	175.6	-71.8	-8.8	114.5	E236 H301 T305 D365 R367 P368 T369 K506	E236-R504 IonicContact OE1-CZ 3.72Å; E236-R504 IonicContact OE1-NH1 2.63Å; E236-R504 PolarHBondContact OE1-NH1 3.38Å; E236-R504 IonicContact OE1-NH2 2.66Å; E236-R504 PolarHBondContact OE1-NH2 2.69Å; E236-R504 IonicContact OE2-NH2 3.62Å; H301-R504 PolarHBondContact O-NH2 3.13Å; T305-R504 PolarHBondContact OG1-NH2 3.08Å; D365-R504 PolarHBondContact O-N 3Å; R367-R504 WeakPolarHBondContact O-CD 3.27Å; R367-R504 VanDerWaalsContact O-CG 3.24Å; R367-R504 WeakPolarHBondContact O-CG 3.44Å; R367-R504 PolarHBondContact O-N 3.34Å; R367-R504 VanDerWaalsContact O-N 3.17Å; P368-R504 PolarHBondContact O-NE 3.23Å; P368-R504 PolarHBondContact O-NH2 3.21Å; T369-R504 HydrophobicContact CG2-CG 3.8Å; R504-K506 PolarHBondContact O-N 3.46Å
505	A	66.1	Low	54.1	Low	71 Å²	71	113 Å²	113	59%	0.587	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-24.5	174.6	0	0	0	0	0	114.8	D365 N503 K507	D365-A505 HydrophobicContact CB-CB 4.43Å; D365-A505 PolarHBondContact O-N 3.48Å; N503-A505 PolarHBondContact O-N 2.98Å; A505-K507 VanDerWaalsContact C-N 3.32Å; A505-K507 PolarHBondContact O-N 2.9Å
506	K	56.2	Low	53.5	Low	136 Å²	136	113.2 Å²	113.2	59%	0.591	59%	0.594	S	S	*	*			trans	-83.1	67.1	-174.5	-67.1	-179.3	177.8	174.2	0	112.3	N503 R504 K508	N503-K506 WeakPolarHBondContact O-CB 3.4Å; N503-K506 PolarHBondContact O-N 3.05Å; R504-K506 PolarHBondContact O-N 3.46Å; K506-K508 PolarHBondContact O-N 2.94Å
507	K	45	Very low	52.6	Low	191 Å²	191	115.3 Å²	115.3	83%	0.83	61%	0.611	S	S	*	*			trans	-63.6	9.9	177.7	-91.8	-177.1	176.8	174.3	0	116.5	A505	A505-K507 VanDerWaalsContact C-N 3.32Å; A505-K507 PolarHBondContact O-N 2.9Å
508	K	32.8	Very low	51.6	Low	187 Å²	187	109.8 Å²	109.8	81%	0.813	60%	0.603	S	S	*	*	S	Bend	trans	-102.8	125.7	168.7	-73.7	-172.4	177	-177.6	0	109	K506	K506-K508 PolarHBondContact O-N 2.94Å
509	P	36.1	Very low	50.2	Low	113 Å²	113	114.3 Å²	114.3	73%	0.734	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-61.5	150.4	171.3	28.6	-34.6	0	0	0	109.9
510	P	38.7	Very low	48.7	Very low	106 Å²	106	117.6 Å²	117.6	69%	0.688	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-58.3	148.6	170.2	26.8	-34.1	0	0	0	109.8	R512	P510-R512 PolarHBondContact O-N 3.4Å; P510-R512 VanDerWaalsContact O-N 3.11Å
511	P	35.3	Very low	46.4	Very low	126 Å²	126	120.3 Å²	120.3	82%	0.818	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-58.1	121.2	173.3	25.8	-33.2	0	0	0	108.5
512	R	34.3	Very low	43.8	Very low	211 Å²	211	129.2 Å²	129.2	80%	0.796	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.7	127.2	178.6	-175.7	-173.3	-67.7	163	-2.5	108.1	P510	P510-R512 PolarHBondContact O-N 3.4Å; P510-R512 VanDerWaalsContact O-N 3.11Å
513	P	36.7	Very low	41.5	Very low	103 Å²	103	132 Å²	132	67%	0.669	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-56.9	143.9	175.4	24.1	-33.4	0	0	0	109.4	K515	P513-K515 PolarHBondContact O-N 3.45Å
514	P	37.5	Very low	38.9	Very low	126 Å²	126	139.6 Å²	139.6	82%	0.818	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-58.2	125.6	178.7	24.8	-33.1	0	0	0	108.7
515	K	31	Very low	36.2	Very low	178 Å²	178	147.4 Å²	147.4	77%	0.774	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.1	172.3	-73.5	-171.3	172.6	-169.2	0	108	P513 A517	P513-K515 PolarHBondContact O-N 3.45Å; K515-A517 PolarHBondContact O-N 3.2Å
516	P	30.4	Very low	34.4	Very low	115 Å²	115	151.2 Å²	151.2	75%	0.747	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-57.3	131.5	169.9	25.2	-33.1	0	0	0	108.8	V518	P516-V518 PolarHBondContact O-N 3.46Å; P516-V518 VanDerWaalsContact O-N 3.14Å
517	A	32.3	Very low	33.2	Very low	92 Å²	92	148.2 Å²	148.2	76%	0.76	78%	0.782	S	S	*	*			trans	-68.1	112.4	177.1	0	0	0	0	0	108.6	K515 L519	K515-A517 PolarHBondContact O-N 3.2Å; A517-L519 PolarHBondContact O-N 2.99Å
518	V	31.9	Very low	32.4	Very low	119 Å²	119	145 Å²	145	72%	0.721	78%	0.778	S	S	*	*			trans	-70.5	98.8	177.9	178	0	0	0	0	108.4	P516 L520	P516-V518 PolarHBondContact O-N 3.46Å; P516-V518 VanDerWaalsContact O-N 3.14Å; V518-L520 HydrophobicContact CG1-CB 4.43Å; V518-L520 HydrophobicContact CG1-CD1 3.82Å; V518-L520 HydrophobicContact CG1-CG 3.83Å; V518-L520 PolarHBondContact O-N 3.43Å
519	L	33.8	Very low	32.2	Very low	169 Å²	169	143.9 Å²	143.9	89%	0.885	78%	0.778	S	S	*	*			trans	-71	71.3	176.6	-90.8	165.9	0	0	0	111.3	A517 K521	A517-L519 PolarHBondContact O-N 2.99Å; L519-K521 VanDerWaalsContact C-N 3.35Å; L519-K521 PolarHBondContact O-N 3.26Å
520	L	35	Very low	32.1	Very low	150 Å²	150	145.4 Å²	145.4	79%	0.785	78%	0.779	S	S	*	*			trans	-85.9	73.9	171.3	-91.5	169	0	0	0	111.3	V518	V518-L520 HydrophobicContact CG1-CB 4.43Å; V518-L520 HydrophobicContact CG1-CD1 3.82Å; V518-L520 HydrophobicContact CG1-CG 3.83Å; V518-L520 PolarHBondContact O-N 3.43Å
521	K	31.4	Very low	31.7	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	79%	0.786	S	S	*	*			trans	-133	119.2	151.6	-78.5	-165.1	174.2	-174.7	0	109.2	L519	L519-K521 VanDerWaalsContact C-N 3.35Å; L519-K521 PolarHBondContact O-N 3.26Å
522	K	29.9	Very low	31.5	Very low	197 Å²	197	151.3 Å²	151.3	86%	0.857	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-66.9	143.4	166.8	-63.7	178.4	178	-178.5	0	108.4	L524	K522-L524 PolarHBondContact O-N 3.13Å
523	P	31	Very low	31.5	Very low	128 Å²	128	147.9 Å²	147.9	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-65.3	127.1	162.4	29.1	-32.1	0	0	0	108.4
524	L	27.8	Very low	31.3	Very low	169 Å²	169	150.5 Å²	150.5	89%	0.885	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-96.2	122.1	159.8	-173.6	71.1	0	0	0	105.7	K522	K522-L524 PolarHBondContact O-N 3.13Å
525	Y	27.8	Very low	31.1	Very low	210 Å²	210	152.8 Å²	152.8	82%	0.824	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-97.6	118	177.6	-157.4	-84.9	0	0	0	107.7
526	D	28	Very low	31.2	Very low	152 Å²	152	151.1 Å²	151.1	81%	0.813	79%	0.79	S	S	*	*			trans	-142.1	160.2	164.6	-151.7	-10.9	0	0	0	108.5
527	S	31.1	Very low	31.3	Very low	73 Å²	73	151.7 Å²	151.7	51%	0.51	79%	0.787	S	S	.	*			trans	-130.2	171.6	-144.6	-51.9	0	0	0	0	115.8
528	V	27	Very low	31.1	Very low	122 Å²	122	155.1 Å²	155.1	74%	0.739	79%	0.785	S	S	*	*			trans	80.8	140	155.5	-129.5	0	0	0	0	120.3
529	M	30.2	Very low	30.9	Very low	165 Å²	165	153.3 Å²	153.3	81%	0.813	78%	0.777	S	S	*	*			trans	83.6	130.4	159.4	-59.1	-50.8	-176.9	0	0	120.5
530	D	32.4	Very low	30.8	Very low	144 Å²	144	151.6 Å²	151.6	77%	0.77	77%	0.774	S	S	*	*			trans	-67.8	152.6	160.8	-39.2	-103.6	0	0	0	111
531	D	30.8	Very low	30.7	Very low	157 Å²	157	149.8 Å²	149.8	84%	0.84	77%	0.774	S	S	*	*				-167.1	-177.5	121.5	-119.3	-34.5	0	0	0	112.1
532	Y	32.1	Very low	30.6	Very low	200 Å²	200	145.7 Å²	145.7	78%	0.784	77%	0.77	S	S	*	*			trans	-87.1	164.2	-161.9	-88.4	-107.5	0	0	0	118.4
533	D	32.6	Very low	30.5	Very low	138 Å²	138	139.6 Å²	139.6	74%	0.738	76%	0.763	S	S	*	*			trans	79.7	138.9	142.8	-68.2	-25.4	0	0	0	125.3
534	D	33.5	Very low	30.5	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	76%	0.761	S	S	*	*			trans	82.4	156.7	143.8	-96.9	-37.3	0	0	0	125.1
535	E	33.6	Very low	30.7	Very low	174 Å²	174	141.3 Å²	141.3	81%	0.813	76%	0.757	S	S	*	*			trans	-103.2	-167.7	-163.2	-76.4	-91.3	167.4	0	0	114.5
536	D	32.4	Very low	30.8	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	76%	0.758	S	S	*	*			trans	81.5	95.6	156.8	-77.4	-25.1	0	0	0	122.7
537	D	31.9	Very low	30.8	Very low	127 Å²	127	141.9 Å²	141.9	68%	0.679	76%	0.764	S	S	*	*				82.3	170.2	110	-148.6	9.7	0	0	0	122.5
538	F	28.7	Very low	30.7	Very low	164 Å²	164	141.9 Å²	141.9	72%	0.719	78%	0.776	S	S	*	*			trans	73.8	67.1	167.9	-87	-82.5	0	0	0	122.3
539	S	28.3	Very low	30.8	Very low	80 Å²	80	141.5 Å²	141.5	56%	0.559	79%	0.785	S	S	*	*				24.9	160.7	111.7	79.2	0	0	0	0	124
540	T	32	Very low	31	Very low	133 Å²	133	138.8 Å²	138.8	82%	0.816	78%	0.782	S	S	*	*			trans	86.4	145.7	164.3	73.6	0	0	0	0	119.1
541	S	32	Very low	31.1	Very low	113 Å²	113	140.8 Å²	140.8	79%	0.79	79%	0.792	S	S	*	*			cis	-142.7	-98.5	-2.3	46.1	0	0	0	0	115.3
542	S	29.1	Very low	31	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	78%	0.781	S	S	*	*			trans	-165.5	171.4	-159.8	62.2	0	0	0	0	112.7
543	G	27.4	Very low	30.8	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	79%	0.786	S	S	*	*			cis	122.5	121.3	-2.6	0	0	0	0	0	113.5
544	L	32.1	Very low	30.6	Very low	149 Å²	149	136.8 Å²	136.8	78%	0.78	79%	0.789	S	S	*	*			trans	-133.8	127.6	-175	-83.1	164.7	0	0	0	114.8
545	K	30.9	Very low	30.5	Very low	184 Å²	184	137.1 Å²	137.1	80%	0.8	79%	0.79	S	S	*	*			trans	36.9	120.8	145.9	-59.4	166.7	-174.6	173.7	0	117.9
546	K	30.8	Very low	30.2	Very low	197 Å²	197	137.9 Å²	137.9	86%	0.857	79%	0.785	S	S	*	*			cis	67.5	98.9	18.2	-161.2	176.9	-177.9	176.9	0	118.2
547	L	28.2	Very low	30.6	Very low	177 Å²	177	136.2 Å²	136.2	93%	0.927	78%	0.782	S	S	*	*			trans	-130.7	157.4	137.3	-67.2	172.3	0	0	0	104.9
548	G	27.9	Very low	30.5	Very low	74 Å²	74	139.1 Å²	139.1	76%	0.763	78%	0.784	S	S	*	*			cis	128.5	132.3	17.7	0	0	0	0	0	107.5
549	A	29.1	Very low	30.4	Very low	113 Å²	113	139.7 Å²	139.7	93%	0.934	79%	0.788	S	S	*	*			cis	-154.7	176.7	-1.5	0	0	0	0	0	110.8
550	S	36.1	Very low	30.3	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	79%	0.791	S	S	*	*			trans	-140.8	133.9	179.6	58.3	0	0	0	0	111.6
551	L	33.5	Very low	30.1	Very low	186 Å²	186	138.6 Å²	138.6	97%	0.974	80%	0.795	S	S	*	*			trans	-174	151.3	165.1	-96.6	140.9	0	0	0	108
552	G	29.3	Very low	29.8	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	79%	0.792	S	S	*	*			cis	167.3	-154.8	-2.4	0	0	0	0	0	111.6
553	L	28.3	Very low	29.8	Very low	167 Å²	167	136.8 Å²	136.8	87%	0.874	79%	0.789	S	S	*	*			trans	85.1	142	174.7	-53.3	169.8	0	0	0	117
554	K	27.6	Very low	29.8	Very low	184 Å²	184	144.9 Å²	144.9	80%	0.8	80%	0.798	S	S	*	*			cis	-166.3	149.5	-22.1	-172.2	167.4	178	179.3	0	110.5
555	L	31.4	Very low	29.6	Very low	166 Å²	166	143 Å²	143	87%	0.869	80%	0.797	S	S	*	*			trans	-147.1	154.4	167.2	-88.3	173.8	0	0	0	109.9
556	R	27.3	Very low	29.6	Very low	190 Å²	190	137.9 Å²	137.9	72%	0.717	79%	0.789	S	S	*	*			trans	142.2	158.6	165	-91.7	-160.9	176.7	-136.1	0.2	113.3	W558	R556-W558 VanDerWaalsContact NH1-CE2 3.27Å
557	P	41.2	Very low	29.5	Very low	108 Å²	108	138.3 Å²	138.3	70%	0.701	79%	0.791	S	S	*	*			cis	-120.2	-95	29.8	37.1	-19.9	0	0	0	120.9
558	W	28.8	Very low	29.5	Very low	189 Å²	189	133.9 Å²	133.9	72%	0.716	78%	0.775	S	S	*	*			trans	-145	-173.7	-143.1	-94	-60.7	0	0	0	111.9	R556	R556-W558 VanDerWaalsContact NH1-CE2 3.27Å
559	E	26.1	Very low	29.5	Very low	175 Å²	175	138.8 Å²	138.8	82%	0.818	78%	0.778	S	S	*	*			cis	-158.3	169.2	19.1	-143.2	136	-85.1	0	0	110
560	G	27.8	Very low	29.8	Very low	59 Å²	59	139.9 Å²	139.9	61%	0.608	77%	0.773	S	S	*	*			cis	179.2	160.3	-8.1	0	0	0	0	0	114.3
561	S	26.3	Very low	29.4	Very low	131 Å²	131	139.9 Å²	139.9	92%	0.916	77%	0.773	S	S	*	*			trans	63.2	143.1	169.8	-150.1	0	0	0	0	120.3
562	G	27.5	Very low	29.1	Very low	69 Å²	69	138.8 Å²	138.8	71%	0.711	77%	0.767	S	S	*	*			trans	-174.1	-23.5	-176.2	0	0	0	0	0	123.4
563	V	28.3	Very low	29.2	Very low	117 Å²	117	142.9 Å²	142.9	71%	0.709	77%	0.773	S	S	*	*			trans	65.2	125.8	163.3	-179.3	0	0	0	0	120.7
564	R	28.3	Very low	29.1	Very low	239 Å²	239	141.9 Å²	141.9	90%	0.902	77%	0.769	S	S	*	*			trans	67.9	165.6	163.6	-69.6	165.8	-166.9	-165.3	3.9	119.1
565	S	27.5	Very low	29.4	Very low	109 Å²	109	142 Å²	142	76%	0.762	77%	0.769	S	S	*	*			cis	-171.5	142.8	-47.5	-162.4	0	0	0	0	111.9
566	A	29.6	Very low	29.3	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	77%	0.765	S	S	*	*			trans	64.6	131.6	152.6	0	0	0	0	0	122.5
567	K	28.5	Very low	29.6	Very low	205 Å²	205	138.2 Å²	138.2	89%	0.891	77%	0.769	S	S	*	*			trans	67.6	156.7	140.4	-72.4	-179.6	-179	-170.2	0	118.3
568	S	28.7	Very low	29	Very low	84 Å²	84	139.5 Å²	139.5	59%	0.587	77%	0.77	S	S	*	*			cis	-165.8	179.3	-20.7	-169	0	0	0	0	108.9
569	E	28.6	Very low	29.1	Very low	177 Å²	177	134.3 Å²	134.3	83%	0.827	76%	0.763	S	S	*	*			trans	68.3	171.4	158.5	-84.2	122.5	-100.7	0	0	120.8
570	V	34.3	Very low	29.1	Very low	137 Å²	137	135.6 Å²	135.6	83%	0.83	77%	0.766	S	S	*	*			trans	-132.8	131.5	-166.2	173.7	0	0	0	0	109.2
571	S	28.4	Very low	29.1	Very low	107 Å²	107	137.3 Å²	137.3	75%	0.748	77%	0.769	S	S	*	*			trans	-148.9	124.8	157.4	-84.3	0	0	0	0	106.7
572	L	26.9	Very low	29.1	Very low	164 Å²	164	136.7 Å²	136.7	86%	0.859	76%	0.764	S	S	*	*				67.3	130	83.6	-91.6	167.4	0	0	0	113.2
573	I	32	Very low	29.1	Very low	146 Å²	146	139.9 Å²	139.9	75%	0.749	77%	0.77	S	S	*	*			trans	-83.6	136.8	-175.9	-61.6	163	0	0	0	108.7	F575	I573-F575 HydrophobicContact CG2-CD2 3.78Å; I573-F575 HydrophobicContact CG2-CE2 3.71Å
574	D	26.7	Very low	29.1	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	77%	0.77	S	S	*	*			trans	-128.2	151.8	161.5	-162.1	3	0	0	0	109
575	F	33.1	Very low	29.2	Very low	186 Å²	186	134.6 Å²	134.6	82%	0.816	77%	0.768	S	S	*	*			trans	-123.8	114.5	-176.9	-90.4	-89.4	0	0	0	109.6	I573	I573-F575 HydrophobicContact CG2-CD2 3.78Å; I573-F575 HydrophobicContact CG2-CE2 3.71Å
576	T	30	Very low	29.2	Very low	127 Å²	127	134.1 Å²	134.1	78%	0.779	76%	0.764	S	S	*	*			trans	-134.7	130.8	167.1	58.3	0	0	0	0	110.5
577	D	32.3	Very low	29.6	Very low	151 Å²	151	136 Å²	136	81%	0.807	77%	0.77	S	S	*	*			trans	-56.5	167.4	159	-62.2	-65.5	0	0	0	110.5
578	D	29.2	Very low	29.5	Very low	134 Å²	134	133.8 Å²	133.8	72%	0.717	77%	0.767	S	S	*	*			cis	-154.6	169.7	24.9	-153.1	-32.5	0	0	0	111.4
579	S	32.1	Very low	29.5	Very low	81 Å²	81	134.7 Å²	134.7	57%	0.566	77%	0.769	S	S	*	*			trans	17.8	134.1	152.2	-66.6	0	0	0	0	120.4
580	F	25.8	Very low	29.5	Very low	202 Å²	202	134.5 Å²	134.5	89%	0.886	77%	0.768	S	S	*	*				-175.3	165	107.6	-102.4	-67.7	0	0	0	115.1
581	S	26.3	Very low	29.1	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	76%	0.761	S	S	*	*			trans	-45.7	148.9	-176.7	53.4	0	0	0	0	118.9
582	S	27.6	Very low	29	Very low	118 Å²	118	137 Å²	137	83%	0.825	77%	0.766	S	S	*	*			trans	-69.1	139.8	161.4	56.3	0	0	0	0	113.7
583	T	26.9	Very low	29	Very low	136 Å²	136	137.4 Å²	137.4	83%	0.834	76%	0.764	S	S	*	*			trans	-137.2	156.2	161.3	33.4	0	0	0	0	112.9
584	T	27.7	Very low	29.6	Very low	116 Å²	116	135.1 Å²	135.1	71%	0.712	76%	0.758	S	S	*	*			trans	-68.9	179.8	-168.2	50.7	0	0	0	0	115.3
585	P	31.7	Very low	29.7	Very low	130 Å²	130	134.8 Å²	134.8	84%	0.844	76%	0.757	S	S	*	*				-130.6	153.4	97.4	38.1	-31.9	0	0	0	114.9
586	S	26.4	Very low	29.6	Very low	98 Å²	98	134 Å²	134	69%	0.685	76%	0.755	S	S	*	*			trans	-89.1	-179	178	-46	0	0	0	0	112.7
587	P	38.5	Very low	29.6	Very low	119 Å²	119	134 Å²	134	77%	0.773	75%	0.751	S	S	*	*				-136.3	153.3	108.6	38.2	-29.6	0	0	0	115.9
588	L	26.2	Very low	29.6	Very low	158 Å²	158	131.2 Å²	131.2	83%	0.827	74%	0.739	S	S	*	*			trans	10.1	145.9	141.1	-53.4	177.1	0	0	0	119.1
589	T	28.3	Very low	29.7	Very low	103 Å²	103	131.2 Å²	131.2	63%	0.632	74%	0.739	S	S	*	*			cis	-165.2	152.7	21.4	-11.6	0	0	0	0	110.9
590	E	28.3	Very low	29.6	Very low	173 Å²	173	135.1 Å²	135.1	81%	0.808	75%	0.745	S	S	*	*			trans	55.6	152	150.7	-72.1	167.8	-161.8	0	0	120.2
591	T	26.5	Very low	29.7	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	74%	0.735	S	S	*	*			cis	-153.3	168.4	-3	-1.2	0	0	0	0	111.5
592	H	27.6	Very low	29.8	Very low	183 Å²	183	132.9 Å²	132.9	85%	0.847	74%	0.739	S	S	*	*			trans	77.1	124.3	155.2	-89.1	-77.3	0	0	0	122.9
593	Q	25.3	Very low	29.8	Very low	174 Å²	174	131.7 Å²	131.7	81%	0.813	73%	0.73	S	S	*	*			trans	-94.5	-176.5	160.3	-112.2	-177.2	-31.4	0	0	109.4
594	P	45.4	Very low	29.8	Very low	97 Å²	97	132.3 Å²	132.3	63%	0.63	73%	0.729	S	S	*	*			cis	-124.2	-158.2	3.3	25.9	2	0	0	0	111.2
595	D	28.3	Very low	29.9	Very low	139 Å²	139	131.7 Å²	131.7	74%	0.743	73%	0.729	S	S	*	*			cis	-152	179.5	33.7	-90.8	-55.9	0	0	0	114.9
596	E	32.3	Very low	30.5	Very low	169 Å²	169	130.5 Å²	130.5	79%	0.79	72%	0.722	S	S	*	*			trans	-60.1	175.4	-174.5	-51.9	-179.7	125.5	0	0	114.1
597	D	28.7	Very low	30.6	Very low	128 Å²	128	133.6 Å²	133.6	68%	0.684	73%	0.729	S	S	*	*			cis	-163.4	155.3	27	-157.4	7.4	0	0	0	116.6
598	T	32.8	Very low	30.1	Very low	92 Å²	92	132.7 Å²	132.7	56%	0.564	73%	0.725	S	S	*	*			trans	63.2	109.9	137.9	-84.8	0	0	0	0	124.8
599	L	32	Very low	30.1	Very low	134 Å²	134	134.4 Å²	134.4	70%	0.702	73%	0.726	S	S	*	*				54.4	153.8	124.1	-43.4	-177.4	0	0	0	120.9
600	K	29	Very low	30.1	Very low	163 Å²	163	135 Å²	135	71%	0.709	73%	0.726	S	S	*	*			cis	-177.2	166.5	-8.6	-115.2	178.5	176.3	171.8	0	110.1
601	V	29.1	Very low	30.1	Very low	110 Å²	110	134.2 Å²	134.2	67%	0.667	72%	0.72	S	S	*	*			trans	64.8	137.9	139.2	160.9	0	0	0	0	118.3
602	D	26.6	Very low	30.3	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	73%	0.726	S	S	*	*			cis	-157.1	-175.9	-6.8	-110	-5.1	0	0	0	111.6
603	S	29	Very low	30.3	Very low	92 Å²	92	135.6 Å²	135.6	64%	0.643	72%	0.721	S	S	*	*			trans	-63.1	179.2	167.7	60.5	0	0	0	0	113.1
604	D	26.5	Very low	30.4	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	72%	0.721	S	S	*	*			cis	-157	-175.4	32	-118.6	-52.8	0	0	0	114.3
605	S	29.8	Very low	29.5	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	72%	0.722	S	S	*	*			trans	-114.7	-161.2	179.7	-43.6	0	0	0	0	111.7
606	P	44.8	Very low	29.5	Very low	106 Å²	106	132 Å²	132	69%	0.688	73%	0.728	S	S	*	*			cis	-137.7	-179.1	-23.5	40.7	-22.9	0	0	0	116.1
607	I	29	Very low	29.3	Very low	163 Å²	163	130.6 Å²	130.6	84%	0.836	73%	0.731	S	S	*	*			trans	75.9	136.7	144.6	-78.5	159.4	0	0	0	123.5
608	S	26.3	Very low	29.1	Very low	100 Å²	100	127.4 Å²	127.4	70%	0.699	73%	0.729	S	S	*	*			trans	103.1	103.4	147.7	-166.1	0	0	0	0	123.9
609	F	27.7	Very low	28.8	Very low	194 Å²	194	129.7 Å²	129.7	85%	0.851	74%	0.737	S	S	*	*			trans	46	111.1	134.3	-85.4	-99.2	0	0	0	124.6
610	D	28.3	Very low	28.5	Very low	115 Å²	115	132.6 Å²	132.6	62%	0.615	74%	0.744	S	S	*	*				103.4	142.9	113.1	-145.7	19.6	0	0	0	124.1
611	K	28.5	Very low	28.3	Very low	157 Å²	157	128.7 Å²	128.7	68%	0.683	74%	0.742	S	S	*	*			trans	75	90.8	158.3	-83.1	172.7	-175.5	81	0	125.3
612	H	29.9	Very low	28.2	Very low	177 Å²	177	132 Å²	132	82%	0.819	75%	0.751	S	S	*	*				80.5	167.5	109.7	-94.5	-92.7	0	0	0	124.3
613	I	27.8	Very low	28.1	Very low	147 Å²	147	132.8 Å²	132.8	75%	0.754	75%	0.754	S	S	*	*			trans	82.9	123	-175.7	-56.3	177.2	0	0	0	112.1
614	N	27.3	Very low	28.2	Very low	150 Å²	150	134.7 Å²	134.7	80%	0.802	76%	0.762	S	S	*	*			cis	-155.4	169.4	-0.3	-106.3	-6.6	0	0	0	107.2
615	A	26.7	Very low	28.4	Very low	80 Å²	80	133 Å²	133	66%	0.661	76%	0.76	S	S	*	*			cis	168.9	111.1	-25.4	0	0	0	0	0	106.7
616	A	27.8	Very low	28.1	Very low	104 Å²	104	133.3 Å²	133.3	86%	0.86	76%	0.762	S	S	*	*			trans	-162.5	124.5	164.1	0	0	0	0	0	108.2
617	T	28.2	Very low	27.2	Very low	139 Å²	139	134.8 Å²	134.8	85%	0.853	76%	0.763	S	S	*	*			trans	-147.8	146.4	-157.6	-38.8	0	0	0	0	113.8
618	G	24.8	Very low	27.1	Very low	62 Å²	62	133.9 Å²	133.9	64%	0.639	76%	0.759	S	S	*	*			trans	143	103.4	171.4	0	0	0	0	0	110.2
619	L	25.9	Very low	27.1	Very low	140 Å²	140	136.5 Å²	136.5	73%	0.733	77%	0.765	S	S	*	*				64.1	135.4	64.5	-56.6	170.5	0	0	0	111.6
620	F	24.9	Very low	27.1	Very low	194 Å²	194	136.5 Å²	136.5	85%	0.851	76%	0.759	S	S	*	*			cis	-138.9	-180	33.9	-87	-92.4	0	0	0	115
621	A	26.4	Very low	27	Very low	81 Å²	81	136.7 Å²	136.7	67%	0.669	77%	0.767	S	S	*	*			trans	-123.9	164.1	168.9	0	0	0	0	0	111.3
622	Q	26.7	Very low	27.5	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	76%	0.762	S	S	*	*			trans	64.4	171.1	158.3	-83.5	177.2	-38	0	0	120.7
623	D	23.4	Very low	27.3	Very low	154 Å²	154	131.9 Å²	131.9	82%	0.824	76%	0.761	S	S	*	*			trans	78.2	135.9	166.5	-61.1	-17.7	0	0	0	122.7
624	T	32.1	Very low	27.2	Very low	132 Å²	132	133.4 Å²	133.4	81%	0.81	77%	0.765	S	S	*	*			trans	-112.8	156	161.8	65.2	0	0	0	0	107.7
625	P	31.3	Very low	28.2	Very low	114 Å²	114	132.1 Å²	132.1	74%	0.74	76%	0.764	S	S	*	*				-158.8	173.7	102.1	40.3	-21.8	0	0	0	116.7
626	S	23.4	Very low	28	Very low	109 Å²	109	132.9 Å²	132.9	76%	0.762	77%	0.771	S	S	*	*			trans	49	146.8	140.5	-74.9	0	0	0	0	123
627	I	26	Very low	28	Very low	138 Å²	138	138.2 Å²	138.2	71%	0.708	77%	0.77	S	S	*	*			cis	-171.2	157.5	-7.5	-169.7	166	0	0	0	109.2
628	L	25.7	Very low	28	Very low	144 Å²	144	138.1 Å²	138.1	75%	0.754	76%	0.764	S	S	*	*			trans	60.8	136.4	170.5	-74	145.9	0	0	0	116.1
629	D	25.6	Very low	28	Very low	154 Å²	154	143.8 Å²	143.8	82%	0.824	77%	0.774	S	S	*	*			cis	-144.8	173.5	47.3	-122.1	-24	0	0	0	114.5
630	W	27.7	Very low	28.3	Very low	195 Å²	195	143.5 Å²	143.5	74%	0.739	78%	0.778	S	S	*	*			trans	-127.5	154.1	-175.9	-165.7	-127.8	0	0	0	110.9	L632	W630-L632 HydrophobicContact CH2-CG 4.33Å; W630-L632 HydrophobicContact CZ2-CB 4.31Å; W630-L632 HydrophobicContact CZ2-CD1 3.55Å; W630-L632 HydrophobicContact CZ2-CG 3.48Å; W630-L632 VanDerWaalsContact CZ2-CG 3.48Å
631	P	27.4	Very low	28.4	Very low	119 Å²	119	140.4 Å²	140.4	77%	0.773	78%	0.775	S	S	*	*				-149.3	138.1	102.2	35.5	-18.2	0	0	0	116.5
632	L	38.6	Very low	28.6	Very low	112 Å²	112	140.2 Å²	140.2	59%	0.586	77%	0.773	S	S	*	*			trans	-76	157.4	148.3	-88.2	173.5	0	0	0	110.6	W630	W630-L632 HydrophobicContact CH2-CG 4.33Å; W630-L632 HydrophobicContact CZ2-CB 4.31Å; W630-L632 HydrophobicContact CZ2-CD1 3.55Å; W630-L632 HydrophobicContact CZ2-CG 3.48Å; W630-L632 VanDerWaalsContact CZ2-CG 3.48Å
633	P	26.3	Very low	28.6	Very low	121 Å²	121	138.5 Å²	138.5	79%	0.786	77%	0.77	S	S	*	*				-108.9	162.6	115.1	-17.6	34	0	0	0	115.8
634	Q	26.3	Very low	28.9	Very low	179 Å²	179	139.7 Å²	139.7	84%	0.836	77%	0.768	S	S	*	*			trans	-85.3	179.7	-174.6	-108.6	-177.6	-14.1	0	0	113.3
635	P	46.7	Very low	28.8	Very low	122 Å²	122	139.7 Å²	139.7	79%	0.792	76%	0.763	S	S	*	*			trans	-84.5	171.8	-162.7	36	-38.8	0	0	0	114.8
636	A	23.5	Very low	28.8	Very low	97 Å²	97	140.4 Å²	140.4	80%	0.802	76%	0.761	S	S	*	*			trans	-114.7	154.4	164.5	0	0	0	0	0	110.8
637	Y	28.4	Very low	28.9	Very low	215 Å²	215	143 Å²	143	84%	0.843	76%	0.761	S	S	*	*			trans	-99.5	-161	170.3	-126.8	-108.2	0	0	0	108.9
638	D	27	Very low	29.2	Very low	137 Å²	137	141.4 Å²	141.4	73%	0.733	76%	0.762	S	S	*	*			trans	76.5	141.3	167.1	-48	-23.8	0	0	0	115.9
639	E	26.1	Very low	29.4	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	77%	0.767	S	S	*	*			cis	-151	-175.9	-10.5	-131.2	-175.4	172.2	0	0	112
640	V	31.5	Very low	29.7	Very low	133 Å²	133	144.2 Å²	144.2	81%	0.806	77%	0.772	S	S	*	*			trans	-109.5	116.3	-178.3	177.6	0	0	0	0	111.8
641	T	26.1	Very low	29.7	Very low	130 Å²	130	142.5 Å²	142.5	80%	0.798	77%	0.772	S	S	*	*			trans	-171.9	135.5	149.2	31.8	0	0	0	0	107
642	A	31.1	Very low	30.2	Very low	76 Å²	76	143.9 Å²	143.9	63%	0.628	77%	0.768	S	S	*	*			cis	78.6	103.1	40.7	0	0	0	0	0	113.8
643	D	26.5	Very low	29.8	Very low	146 Å²	146	144.9 Å²	144.9	78%	0.781	78%	0.778	S	S	*	*			trans	-172.9	128.9	143.8	-84.4	-22	0	0	0	105
644	F	30.6	Very low	30	Very low	178 Å²	178	149.5 Å²	149.5	78%	0.781	78%	0.78	S	S	*	*				60.4	127.4	69.5	-61.3	-57.7	0	0	0	111.8
645	D	30.2	Very low	30.2	Very low	133 Å²	133	146 Å²	146	71%	0.711	78%	0.776	S	S	*	*			cis	-151	143.9	5.8	-99.9	-31.8	0	0	0	107.6
646	D	29.9	Very low	29.5	Very low	128 Å²	128	148.4 Å²	148.4	68%	0.684	78%	0.78	S	S	*	*				101.6	163.9	60.8	-171	39.4	0	0	0	112.1
647	Q	26.6	Very low	29.8	Very low	164 Å²	164	151.2 Å²	151.2	77%	0.766	78%	0.781	S	S	*	*			trans	75.5	135.9	172.4	-54.3	175.6	23	0	0	115.9
648	S	30.8	Very low	29.7	Very low	104 Å²	104	151.3 Å²	151.3	73%	0.727	79%	0.786	S	S	*	*			cis	-160.7	175.7	-7.5	53.7	0	0	0	0	107.9
649	E	30.8	Very low	29.7	Very low	186 Å²	186	148.2 Å²	148.2	87%	0.869	79%	0.787	S	S	*	*			cis	-141.1	145.9	15.1	-58.2	170.2	118.6	0	0	110.7
650	D	32.9	Very low	31.1	Very low	171 Å²	171	145.7 Å²	145.7	91%	0.914	79%	0.786	S	S	*	*			trans	-158.4	115.5	155.9	-154.1	0.7	0	0	0	108
651	Q	27.7	Very low	31.6	Very low	160 Å²	160	144.4 Å²	144.4	75%	0.748	78%	0.781	S	S	*	*			trans	-147.6	97.2	-173	-167.9	154.1	31.4	0	0	116.4
652	E	36.5	Very low	31.9	Very low	148 Å²	148	146.2 Å²	146.2	69%	0.692	78%	0.78	S	S	*	*			trans	69.9	168.2	132.7	-74.2	-164.1	103.4	0	0	119.8
653	V	30.7	Very low	31.8	Very low	132 Å²	132	150.7 Å²	150.7	80%	0.8	79%	0.788	S	S	*	*			cis	-137.8	156	27.4	-178.1	0	0	0	0	113.5
654	R	30.5	Very low	32	Very low	219 Å²	219	149 Å²	149	83%	0.826	78%	0.783	S	S	*	*			trans	-97.1	143	176.4	-74.7	175.8	167.4	166.8	-3.2	114
655	S	31.2	Very low	31.9	Very low	105 Å²	105	148.6 Å²	148.6	73%	0.734	79%	0.788	S	S	*	*			trans	40.7	132.9	136	-51	0	0	0	0	122.3
656	I	30.7	Very low	31.8	Very low	172 Å²	172	145.9 Å²	145.9	88%	0.882	79%	0.791	S	S	*	*				179.5	152.1	118.9	-94.5	158	0	0	0	111.7
657	N	30	Very low	32.5	Very low	156 Å²	156	145.7 Å²	145.7	83%	0.834	80%	0.797	S	S	*	*			trans	-83.7	141	177.1	-75.6	-47.6	0	0	0	114
658	K	27.6	Very low	33.5	Very low	217 Å²	217	143.1 Å²	143.1	94%	0.943	80%	0.795	S	S	*	*			trans	-159.3	164.2	149.2	-112.3	172.6	-176.6	179.2	0	111
659	G	27	Very low	33.4	Very low	73 Å²	73	145.5 Å²	145.5	75%	0.753	80%	0.798	S	S	*	*			trans	-88.4	179.5	-165.4	0	0	0	0	0	117.7
660	P	53.9	Low	33.4	Very low	129 Å²	129	141.7 Å²	141.7	84%	0.838	79%	0.792	S	S	*	*			trans	-94.8	176.4	-167.6	42.1	-39.9	0	0	0	114
661	P	43.3	Very low	33.2	Very low	106 Å²	106	139.5 Å²	139.5	69%	0.688	79%	0.79	S	S	*	*				-149.4	174.5	90.2	40.8	-23.2	0	0	0	117.2
662	E	31.1	Very low	33.4	Very low	167 Å²	167	141 Å²	141	78%	0.78	80%	0.8	S	S	*	*			trans	52.7	116	146.8	-71	161.4	175.1	0	0	121.5
663	E	29.8	Very low	33.1	Very low	171 Å²	171	139 Å²	139	80%	0.799	81%	0.809	S	S	*	*				82.7	149.7	101.8	-71.8	-154.8	176.1	0	0	115.7
664	T	29.8	Very low	33	Very low	109 Å²	109	136.4 Å²	136.4	67%	0.669	81%	0.809	S	S	*	*			cis	-150.8	172	3.4	-11.7	0	0	0	0	112.2
665	L	29.9	Very low	33.5	Very low	171 Å²	171	137 Å²	137	90%	0.895	81%	0.811	S	S	*	*			trans	72.7	126.3	153.5	-68.7	161.9	0	0	0	123.3
666	G	27.3	Very low	33.8	Very low	75 Å²	75	136.2 Å²	136.2	77%	0.773	81%	0.805	S	S	*	*			trans	119.4	116.9	133.7	0	0	0	0	0	120.6
667	P	43.9	Very low	34.2	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	80%	0.802	S	S	*	*			trans	-114.2	-168.7	174.1	44.1	-34.9	0	0	0	112.8
668	P	48.1	Very low	34.8	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	79%	0.789	S	S	*	*			cis	-123.9	179.9	-7.7	27.8	-2.9	0	0	0	112.7
669	L	28.8	Very low	35.3	Very low	153 Å²	153	128 Å²	128	80%	0.801	77%	0.77	S	S	*	*				-173.6	139.9	65.5	-105	168.6	0	0	0	113.7
670	S	30.4	Very low	36	Very low	106 Å²	106	128.4 Å²	128.4	74%	0.741	76%	0.761	S	S	*	*			trans	24.6	124.9	151.3	62.9	0	0	0	0	123.9
671	S	28.2	Very low	35.5	Very low	125 Å²	125	124.8 Å²	124.8	87%	0.874	74%	0.742	S	S	*	*				-165	169.2	109.9	60.6	0	0	0	0	111.7
672	M	32.2	Very low	35.7	Very low	191 Å²	191	124.4 Å²	124.4	94%	0.941	74%	0.735	S	S	*	*			trans	-114.5	124.5	-173.8	-71.4	172.2	57.2	0	0	113.4
673	A	29.9	Very low	36.4	Very low	108 Å²	108	121.7 Å²	121.7	89%	0.893	73%	0.725	S	S	*	*			trans	-164.1	138.2	150.6	0	0	0	0	0	109.2
674	G	30.4	Very low	37.1	Very low	77 Å²	77	119.4 Å²	119.4	79%	0.794	71%	0.713	S	S	*	*			trans	155.1	42.6	178.4	0	0	0	0	0	118.4
675	R	39.9	Very low	37.9	Very low	231 Å²	231	119.8 Å²	119.8	87%	0.872	71%	0.707	S	S	*	*			trans	-144.9	114.5	165.7	-72.3	-170.3	177.3	-179.2	-1.6	110
676	S	38.1	Very low	39.1	Very low	88 Å²	88	116.2 Å²	116.2	62%	0.615	69%	0.686	S	S	*	*	S	Bend	trans	-163.6	-53.7	169.8	-170	0	0	0	0	111.2	S678 Q679	S676-S678 PolarHBondContact O-N 2.92Å; S676-Q679 PolarHBondContact O-N 2.98Å
677	E	38.7	Very low	40.2	Very low	175 Å²	175	117.2 Å²	117.2	82%	0.818	67%	0.673	S	S	*	*	H	α-helix	trans	-74.3	-18.8	-162.2	-61.1	-177.1	135.9	0	0	116	S680	E677-S680 PolarHBondContact O-OG 2.86Å
678	S	41.9	Very low	40.3	Very low	78 Å²	78	115.8 Å²	115.8	55%	0.545	66%	0.655	S	S	.	*	H	α-helix	trans	-78.1	-35	173.4	68.8	0	0	0	0	112.6	S676 S680 A681 D682	S676-S678 PolarHBondContact O-N 2.92Å; S678-S680 VanDerWaalsContact C-N 3.29Å; S678-S680 PolarHBondContact O-N 2.98Å; S678-A681 PolarHBondContact O-N 3.06Å; S678-D682 PolarHBondContact O-N 3.07Å; S678-D682 VanDerWaalsContact O-N 3.11Å
679	Q	38	Very low	40.4	Very low	120 Å²	120	116 Å²	116	56%	0.561	64%	0.642	S	S	*	*	H	α-helix	trans	-68.3	-28.6	-170.7	-66.8	-172	-51.2	0	0	112.7	S676 L683	S676-Q679 PolarHBondContact O-N 2.98Å; Q679-L683 VanDerWaalsContact O-CB 3.31Å; Q679-L683 WeakPolarHBondContact O-CB 3.4Å; Q679-L683 PolarHBondContact O-N 2.9Å
680	S	42.4	Very low	41.6	Very low	81 Å²	81	113.3 Å²	113.3	57%	0.566	63%	0.625	S	S	*	*	H	α-helix	trans	-71.4	-37.2	175.2	50.1	0	0	0	0	112.8	E677 S678 F684	E677-S680 PolarHBondContact O-OG 2.86Å; S678-S680 VanDerWaalsContact C-N 3.29Å; S678-S680 PolarHBondContact O-N 2.98Å; S680-F684 WeakPolarHBondContact O-CB 3.3Å; S680-F684 PolarHBondContact O-N 3.14Å
681	A	42.7	Very low	42.5	Very low	53 Å²	53	111.9 Å²	111.9	44%	0.438	61%	0.612	S	S	.	*	H	α-helix	trans	-66.6	-44.4	173.5	0	0	0	0	0	111.7	S678 F684 Q685	S678-A681 PolarHBondContact O-N 3.06Å; A681-F684 PolarHBondContact O-N 3.06Å; A681-Q685 PolarHBondContact O-N 3Å
682	D	47.3	Very low	43.6	Very low	98 Å²	98	109.4 Å²	109.4	52%	0.524	59%	0.587	S	S	.	*	H	α-helix	trans	-63.6	-46.6	176.9	-64.3	-35.3	0	0	0	111.4	S678 F684 Q685 E686	S678-D682 PolarHBondContact O-N 3.07Å; S678-D682 VanDerWaalsContact O-N 3.11Å; D682-F684 VanDerWaalsContact C-N 3.3Å; D682-F684 PolarHBondContact O-N 2.96Å; D682-Q685 PolarHBondContact O-N 3.19Å; D682-E686 WeakPolarHBondContact O-CB 3.48Å; D682-E686 PolarHBondContact O-N 2.7Å
683	L	47	Very low	44.9	Very low	111 Å²	111	105 Å²	105	58%	0.581	57%	0.571	S	S	*	*	H	α-helix	trans	-59.2	-37.3	174.6	-102.3	150.5	0	0	0	113	Q679 E686 L687	Q679-L683 VanDerWaalsContact O-CB 3.31Å; Q679-L683 WeakPolarHBondContact O-CB 3.4Å; Q679-L683 PolarHBondContact O-N 2.9Å; L683-E686 PolarHBondContact O-N 3.46Å; L683-L687 WeakPolarHBondContact O-CB 3.49Å; L683-L687 PolarHBondContact O-N 2.89Å
684	F	44.5	Very low	45.7	Very low	123 Å²	123	106.7 Å²	106.7	54%	0.539	56%	0.558	S	S	.	*	H	α-helix	trans	-68.1	-41.6	177.5	-170.5	-93.3	0	0	0	111.6	S680 A681 D682 Q688	S680-F684 WeakPolarHBondContact O-CB 3.3Å; S680-F684 PolarHBondContact O-N 3.14Å; A681-F684 PolarHBondContact O-N 3.06Å; D682-F684 VanDerWaalsContact C-N 3.3Å; D682-F684 PolarHBondContact O-N 2.96Å; F684-Q688 VanDerWaalsContact O-CB 3.3Å; F684-Q688 WeakPolarHBondContact O-CB 3.47Å; F684-Q688 PolarHBondContact O-N 3.18Å
685	Q	46.8	Very low	46.2	Very low	117 Å²	117	107.4 Å²	107.4	55%	0.547	54%	0.543	S	S	.	.	H	α-helix	trans	-66.5	-36.9	173.3	-70.2	-166.7	19.8	0	0	112.5	A681 D682 Q688 R689	A681-Q685 PolarHBondContact O-N 3Å; D682-Q685 PolarHBondContact O-N 3.19Å; Q685-Q688 PolarHBondContact O-N 3.47Å; Q685-R689 VanDerWaalsContact O-CB 3.23Å; Q685-R689 WeakPolarHBondContact O-CB 3.44Å; Q685-R689 PolarHBondContact O-N 2.89Å
686	E	54.6	Low	45.9	Very low	96 Å²	96	104 Å²	104	45%	0.449	54%	0.537	S	S	.	.	H	α-helix	trans	-67.7	-44.2	177.6	-151.6	63.4	-124.2	0	0	111.3	D682 L683 R689 E690	D682-E686 WeakPolarHBondContact O-CB 3.48Å; D682-E686 PolarHBondContact O-N 2.7Å; L683-E686 PolarHBondContact O-N 3.46Å; E686-R689 WeakPolarHBondContact O-CB 3.48Å; E686-R689 PolarHBondContact O-N 3.37Å; E686-R689 IonicContact OE1-CZ 3.47Å; E686-R689 IonicContact OE1-NE 3.89Å; E686-R689 IonicContact OE1-NH1 2.68Å; E686-R689 PolarHBondContact OE1-NH1 3.31Å; E686-R689 IonicContact OE2-CZ 3.39Å; E686-R689 IonicContact OE2-NH1 2.66Å; E686-R689 PolarHBondContact OE2-NH1 3.5Å; E686-R689 IonicContact OE2-NH2 3.61Å; E686-E690 WeakPolarHBondContact O-CB 3.39Å; E686-E690 PolarHBondContact O-N 2.87Å
687	L	51.4	Low	46	Very low	95 Å²	95	102.9 Å²	102.9	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-61.5	-44.1	172.4	-84.6	162.8	0	0	0	112.2	L683 R689 E690 V691	L683-L687 WeakPolarHBondContact O-CB 3.49Å; L683-L687 PolarHBondContact O-N 2.89Å; L687-R689 VanDerWaalsContact C-N 3.3Å; L687-R689 PolarHBondContact O-N 3.49Å; L687-E690 PolarHBondContact O-N 3.22Å; L687-V691 WeakPolarHBondContact O-CB 3.43Å; L687-V691 VanDerWaalsContact O-CG2 3.31Å; L687-V691 WeakPolarHBondContact O-CG2 3.33Å; L687-V691 PolarHBondContact O-N 3.13Å
688	Q	45.1	Very low	45.7	Very low	94 Å²	94	100.6 Å²	100.6	44%	0.439	53%	0.527	S	S	.	.	H	α-helix	trans	-62.8	-38.5	176.2	-175	178.2	-16	0	0	111.5	F684 Q685 M692	F684-Q688 VanDerWaalsContact O-CB 3.3Å; F684-Q688 WeakPolarHBondContact O-CB 3.47Å; F684-Q688 PolarHBondContact O-N 3.18Å; Q685-Q688 PolarHBondContact O-N 3.47Å; Q688-M692 WeakPolarHBondContact O-CG 3.18Å; Q688-M692 PolarHBondContact O-N 3.06Å
689	R	49	Very low	45.5	Very low	117 Å²	117	103.7 Å²	103.7	44%	0.442	53%	0.534	S	S	.	.	H	α-helix	trans	-66.2	-46.3	175.1	-169.6	-174.2	-54.5	147.8	10.2	111.4	Q685 E686 L687 V691 M692 V693	Q685-R689 VanDerWaalsContact O-CB 3.23Å; Q685-R689 WeakPolarHBondContact O-CB 3.44Å; Q685-R689 PolarHBondContact O-N 2.89Å; E686-R689 WeakPolarHBondContact O-CB 3.48Å; E686-R689 PolarHBondContact O-N 3.37Å; E686-R689 IonicContact OE1-CZ 3.47Å; E686-R689 IonicContact OE1-NE 3.89Å; E686-R689 IonicContact OE1-NH1 2.68Å; E686-R689 PolarHBondContact OE1-NH1 3.31Å; E686-R689 IonicContact OE2-CZ 3.39Å; E686-R689 IonicContact OE2-NH1 2.66Å; E686-R689 PolarHBondContact OE2-NH1 3.5Å; E686-R689 IonicContact OE2-NH2 3.61Å; L687-R689 VanDerWaalsContact C-N 3.3Å; L687-R689 PolarHBondContact O-N 3.49Å; R689-V691 VanDerWaalsContact C-N 3.33Å; R689-V691 PolarHBondContact O-N 2.91Å; R689-M692 PolarHBondContact O-N 3.06Å; R689-V693 WeakPolarHBondContact O-CB 3.16Å; R689-V693 VanDerWaalsContact O-CG2 3.3Å; R689-V693 WeakPolarHBondContact O-CG2 3.44Å; R689-V693 PolarHBondContact O-N 2.8Å
690	E	54.2	Low	45.5	Very low	95 Å²	95	102.8 Å²	102.8	44%	0.444	55%	0.548	S	S	.	.	H	α-helix	trans	-62.3	-40	178	-161.4	-169.1	147.2	0	0	111.6	E686 L687 V693 K694	E686-E690 WeakPolarHBondContact O-CB 3.39Å; E686-E690 PolarHBondContact O-N 2.87Å; L687-E690 PolarHBondContact O-N 3.22Å; E690-V693 PolarHBondContact O-N 3.27Å; E690-K694 HydrophobicContact CG-CD 4.37Å; E690-K694 WeakPolarHBondContact O-CB 3.44Å; E690-K694 VanDerWaalsContact O-CG 3.32Å; E690-K694 WeakPolarHBondContact O-CG 3.37Å; E690-K694 PolarHBondContact O-N 3.17Å; E690-K694 VanDerWaalsContact OE1-CE 3.3Å; E690-K694 WeakPolarHBondContact OE1-CE 3.48Å; E690-K694 IonicContact OE1-NZ 2.69Å; E690-K694 PolarHBondContact OE1-NZ 2.92Å
691	V	49.4	Very low	45.1	Very low	77 Å²	77	105.6 Å²	105.6	47%	0.467	56%	0.562	S	S	.	*	H	α-helix	trans	-64.9	-46.6	173.4	169.1	0	0	0	0	111.5	L687 R689 V693 K694 L695	L687-V691 WeakPolarHBondContact O-CB 3.43Å; L687-V691 VanDerWaalsContact O-CG2 3.31Å; L687-V691 WeakPolarHBondContact O-CG2 3.33Å; L687-V691 PolarHBondContact O-N 3.13Å; R689-V691 VanDerWaalsContact C-N 3.33Å; R689-V691 PolarHBondContact O-N 2.91Å; V691-V693 VanDerWaalsContact C-N 3.31Å; V691-V693 PolarHBondContact O-N 2.8Å; V691-K694 PolarHBondContact O-N 3.48Å; V691-L695 HydrophobicContact CG1-CD1 3.76Å; V691-L695 HydrophobicContact CG1-CG 4.44Å; V691-L695 WeakPolarHBondContact O-CB 3.45Å; V691-L695 WeakPolarHBondContact O-CG 3.47Å; V691-L695 PolarHBondContact O-N 3.07Å
692	M	52.8	Low	44.5	Very low	72 Å²	72	107 Å²	107	36%	0.355	58%	0.581	S	S	.	*	H	α-helix	trans	-68.2	-28.7	178.4	-69.2	-153.2	-62	0	0	113.5	Q688 R689 L695 Q696 V697	Q688-M692 WeakPolarHBondContact O-CG 3.18Å; Q688-M692 PolarHBondContact O-N 3.06Å; R689-M692 PolarHBondContact O-N 3.06Å; M692-L695 CarbonylContact O-C 3.56Å; M692-Q696 PolarHBondContact O-N 3.43Å; M692-Q696 VanDerWaalsContact O-N 3.13Å; M692-V697 PolarHBondContact O-N 3.09Å
693	V	58.2	Low	43.8	Very low	100 Å²	100	113.9 Å²	113.9	61%	0.606	60%	0.6	S	S	*	*	H	α-helix	trans	-69.7	-44.3	170.4	168.1	0	0	0	0	111.2	R689 E690 V691 L695 Q696	R689-V693 WeakPolarHBondContact O-CB 3.16Å; R689-V693 VanDerWaalsContact O-CG2 3.3Å; R689-V693 WeakPolarHBondContact O-CG2 3.44Å; R689-V693 PolarHBondContact O-N 2.8Å; E690-V693 PolarHBondContact O-N 3.27Å; V691-V693 VanDerWaalsContact C-N 3.31Å; V691-V693 PolarHBondContact O-N 2.8Å; V693-L695 VanDerWaalsContact C-N 3.26Å; V693-L695 PolarHBondContact O-N 3.02Å; V693-Q696 PolarHBondContact O-N 2.86Å; V693-Q696 VanDerWaalsContact O-N 3.11Å
694	K	48.4	Very low	42.9	Very low	142 Å²	142	114.3 Å²	114.3	62%	0.617	61%	0.611	S	S	*	*	H	α-helix	trans	-63.4	-30.3	174.5	-77.9	168.7	170.3	171.8	0	113	E690 V691	E690-K694 HydrophobicContact CG-CD 4.37Å; E690-K694 WeakPolarHBondContact O-CB 3.44Å; E690-K694 VanDerWaalsContact O-CG 3.32Å; E690-K694 WeakPolarHBondContact O-CG 3.37Å; E690-K694 PolarHBondContact O-N 3.17Å; E690-K694 VanDerWaalsContact OE1-CE 3.3Å; E690-K694 WeakPolarHBondContact OE1-CE 3.48Å; E690-K694 IonicContact OE1-NZ 2.69Å; E690-K694 PolarHBondContact OE1-NZ 2.92Å; V691-K694 PolarHBondContact O-N 3.48Å
695	L	38.8	Very low	42.2	Very low	92 Å²	92	116.2 Å²	116.2	48%	0.482	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.4	3.5	175	-66	173	0	0	0	114.1	V691 M692 V693 V697	V691-L695 HydrophobicContact CG1-CD1 3.76Å; V691-L695 HydrophobicContact CG1-CG 4.44Å; V691-L695 WeakPolarHBondContact O-CB 3.45Å; V691-L695 WeakPolarHBondContact O-CG 3.47Å; V691-L695 PolarHBondContact O-N 3.07Å; M692-L695 CarbonylContact O-C 3.56Å; V693-L695 VanDerWaalsContact C-N 3.26Å; V693-L695 PolarHBondContact O-N 3.02Å; L695-V697 HydrophobicContact CB-CG2 4.14Å; L695-V697 PolarHBondContact O-N 3.04Å; L695-V697 VanDerWaalsContact O-N 3.12Å
696	Q	33.9	Very low	41.7	Very low	159 Å²	159	116.6 Å²	116.6	74%	0.743	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.5	34.8	169.2	-62.1	172	-13.2	0	0	114.6	M692 V693	M692-Q696 PolarHBondContact O-N 3.43Å; M692-Q696 VanDerWaalsContact O-N 3.13Å; V693-Q696 PolarHBondContact O-N 2.86Å; V693-Q696 VanDerWaalsContact O-N 3.11Å
697	V	40.2	Very low	40.6	Very low	65 Å²	65	117.3 Å²	117.3	39%	0.394	66%	0.655	S	S	.	*			trans	-73.1	128.9	-177.6	-174.7	0	0	0	0	110.9	M692 L695 M699	M692-V697 PolarHBondContact O-N 3.09Å; L695-V697 HydrophobicContact CB-CG2 4.14Å; L695-V697 PolarHBondContact O-N 3.04Å; L695-V697 VanDerWaalsContact O-N 3.12Å; V697-M699 PolarHBondContact O-N 3.42Å; V697-M699 VanDerWaalsContact O-N 3.16Å
698	P	33.9	Very low	39.5	Very low	128 Å²	128	118.1 Å²	118.1	83%	0.831	67%	0.669	S	S	*	*			trans	-64.1	113.8	178.1	-23.1	34.3	0	0	0	112.7
699	M	37.8	Very low	39.3	Very low	142 Å²	142	119.5 Å²	119.5	70%	0.7	69%	0.685	S	S	*	*			trans	-95.3	122.2	176.1	-67.1	-167.5	71.9	0	0	111.7	V697	V697-M699 PolarHBondContact O-N 3.42Å; V697-M699 VanDerWaalsContact O-N 3.16Å
700	A	36.3	Very low	38.3	Very low	102 Å²	102	120.7 Å²	120.7	84%	0.843	71%	0.706	S	S	*	*			trans	-74.8	128.2	171.1	0	0	0	0	0	111	G702	A700-G702 PolarHBondContact O-N 2.67Å
701	T	35	Very low	37.6	Very low	140 Å²	140	121.9 Å²	121.9	86%	0.859	72%	0.722	S	S	*	*			trans	-91.1	93.7	-172.3	37.5	0	0	0	0	113
702	G	30.9	Very low	36.8	Very low	81 Å²	81	126.4 Å²	126.4	84%	0.835	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-73.8	122.5	169.1	0	0	0	0	0	112.1	A700	A700-G702 PolarHBondContact O-N 2.67Å
703	R	31.8	Very low	36.1	Very low	244 Å²	244	128 Å²	128	92%	0.921	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-82.8	133.5	171.8	-73.5	178.9	171.1	174.1	-3.6	111
704	S	28.7	Very low	34.6	Very low	119 Å²	119	131 Å²	131	83%	0.832	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-90.5	151.9	157.1	48.2	0	0	0	0	110.6
705	L	30	Very low	33.5	Very low	163 Å²	163	128.4 Å²	128.4	85%	0.853	77%	0.772	S	S	*	*			trans	-124.2	145.7	176.9	-80.6	168	0	0	0	110.1
706	P	35.6	Very low	33.7	Very low	125 Å²	125	128.5 Å²	128.5	81%	0.812	78%	0.779	S	S	*	*			trans	-78.8	169	172.9	34.4	-35.3	0	0	0	112.2
707	S	30.5	Very low	33.5	Very low	111 Å²	111	130.5 Å²	130.5	78%	0.776	79%	0.785	S	S	*	*			trans	-106.5	162	-167	44	0	0	0	0	115.5
708	S	28.9	Very low	32.9	Very low	113 Å²	113	131 Å²	131	79%	0.79	80%	0.803	S	S	*	*			trans	77.8	115.8	161	-54.5	0	0	0	0	119.4
709	P	41.8	Very low	32.7	Very low	122 Å²	122	129.3 Å²	129.3	79%	0.792	80%	0.8	S	S	*	*			trans	-124.3	143.5	174.7	39.1	-26.8	0	0	0	115.9
710	T	28.5	Very low	32.4	Very low	142 Å²	142	131.1 Å²	131.1	87%	0.871	81%	0.806	S	S	*	*			trans	-163.4	159.8	156.8	41.5	0	0	0	0	109.9
711	P	39.3	Very low	32.2	Very low	121 Å²	121	137.6 Å²	137.6	79%	0.786	81%	0.809	S	S	*	*			cis	-126.3	173.6	-36	37.9	-23.1	0	0	0	113.7
712	M	31.4	Very low	31.9	Very low	171 Å²	171	138.3 Å²	138.3	84%	0.842	80%	0.803	S	S	*	*			trans	-60.2	156.2	173.2	-89.3	-98.5	-76.9	0	0	113.9
713	P	37.9	Very low	31.7	Very low	106 Å²	106	142.2 Å²	142.2	69%	0.688	80%	0.803	S	S	*	*				-156.4	172.7	86	43.8	-24.8	0	0	0	119.8
714	L	26.5	Very low	31.4	Very low	164 Å²	164	138.8 Å²	138.8	86%	0.859	79%	0.791	S	S	*	*			trans	83.6	130.1	156.7	-72.4	160.8	0	0	0	121.7
715	A	25.2	Very low	31.3	Very low	86 Å²	86	141 Å²	141	71%	0.711	79%	0.793	S	S	*	*			trans	-115.1	-163.9	165.5	0	0	0	0	0	107.6
716	P	43.8	Very low	31.2	Very low	95 Å²	95	137.8 Å²	137.8	62%	0.617	78%	0.781	S	S	*	*			cis	-142.8	-148.5	15.1	44.3	-21.5	0	0	0	115.4
717	F	29.8	Very low	32	Very low	201 Å²	201	137.4 Å²	137.4	88%	0.882	78%	0.779	S	S	*	*			trans	79.1	138.4	177.2	-46.8	-70.8	0	0	0	116.7
718	G	27.4	Very low	32.5	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	78%	0.779	S	S	*	*			cis	177.3	132.3	-10.8	0	0	0	0	0	116
719	A	30.8	Very low	33.2	Very low	93 Å²	93	137.5 Å²	137.5	77%	0.769	78%	0.777	S	S	*	*			trans	54.2	103.6	153.6	0	0	0	0	0	124.3
720	H	30.9	Very low	33.2	Very low	180 Å²	180	137.5 Å²	137.5	83%	0.833	78%	0.777	S	S	*	*				54.3	116.8	127.4	-66.4	-75.1	0	0	0	125.1
721	R	31.6	Very low	33.1	Very low	239 Å²	239	135.6 Å²	135.6	90%	0.902	77%	0.769	S	S	*	*				-156.8	114.3	112.6	-97.8	-180	-179.5	-154.5	-1.4	107.6
722	Q	29.5	Very low	32.6	Very low	154 Å²	154	134.8 Å²	134.8	72%	0.72	77%	0.766	S	S	*	*				44.2	128.9	96.9	-76.2	-177.1	-19.8	0	0	114.1
723	I	25.7	Very low	32.4	Very low	163 Å²	163	132 Å²	132	84%	0.836	76%	0.764	S	S	*	*				-125.9	162.1	52.7	-70.8	170.4	0	0	0	114.8
724	Y	25.4	Very low	31.8	Very low	172 Å²	172	132.1 Å²	132.1	68%	0.675	77%	0.767	S	S	*	*			trans	-33.5	158.1	171.9	-81.5	-107.5	0	0	0	117.7	P726	Y724-P726 HydrophobicContact CD1-CG 4.49Å
725	L	27.4	Very low	31.7	Very low	167 Å²	167	130 Å²	130	87%	0.874	76%	0.761	S	S	*	*			cis	-130.9	149.1	33.7	-74.5	156.7	0	0	0	115.2
726	P	27.6	Very low	31.6	Very low	94 Å²	94	130.4 Å²	130.4	61%	0.61	76%	0.759	S	S	*	*			trans	-105.4	155.9	175.9	39	-34.1	0	0	0	115.9	Y724	Y724-P726 HydrophobicContact CD1-CG 4.49Å
727	P	51.7	Low	30.7	Very low	117 Å²	117	132.6 Å²	132.6	76%	0.76	76%	0.764	S	S	*	*			trans	-87.4	-156.2	162.1	42.1	-37.9	0	0	0	109.8
728	P	41.6	Very low	30.4	Very low	119 Å²	119	129.3 Å²	129.3	77%	0.773	76%	0.76	S	S	*	*			cis	-143.9	-173.4	5.7	42.8	-21.1	0	0	0	118.2
729	S	43.8	Very low	30.2	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	76%	0.758	S	S	*	*			trans	-62.1	167.5	160.8	-29.9	0	0	0	0	112.8
730	P	41.3	Very low	29.9	Very low	121 Å²	121	131.4 Å²	131.4	79%	0.786	76%	0.756	S	S	*	*				-156.1	168.9	97.9	40.9	-23.8	0	0	0	117.4
731	S	26.6	Very low	29.7	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	76%	0.756	S	S	*	*			trans	141.2	103.7	138.7	72.9	0	0	0	0	111.3
732	S	29.2	Very low	29.6	Very low	103 Å²	103	128 Å²	128	72%	0.72	75%	0.749	S	S	*	*				59.7	107	71.6	74.9	0	0	0	0	113
733	S	25.9	Very low	29.4	Very low	113 Å²	113	127.5 Å²	127.5	79%	0.79	75%	0.751	S	S	*	*			cis	105.2	110.8	36.2	65.4	0	0	0	0	113
734	S	26.3	Very low	29.3	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	75%	0.751	S	S	*	*			trans	-176.6	126.9	148.5	54.2	0	0	0	0	112.6
735	T	24	Very low	30.6	Very low	120 Å²	120	127 Å²	127	74%	0.736	75%	0.751	S	S	*	*			trans	28.9	143.7	130.8	3.7	0	0	0	0	120.7
736	S	23.8	Very low	30.5	Very low	95 Å²	95	125.9 Å²	125.9	66%	0.664	75%	0.751	S	S	*	*			cis	-160.1	146.2	21.8	-43	0	0	0	0	115
737	I	23.9	Very low	30.4	Very low	141 Å²	141	125.7 Å²	125.7	72%	0.723	75%	0.752	S	S	*	*				41.1	139	121.7	-50.1	174.3	0	0	0	121.1
738	T	23	Very low	29.1	Very low	131 Å²	131	130.1 Å²	130.1	80%	0.804	76%	0.759	S	S	*	*			trans	67.5	152.8	163.4	40.8	0	0	0	0	118.7
739	S	24.1	Very low	28.4	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	76%	0.76	S	S	*	*			cis	-161.5	158.4	-10.2	44	0	0	0	0	113.4
740	C	23.8	Very low	27.7	Very low	110 Å²	110	131.9 Å²	131.9	74%	0.743	76%	0.756	S	S	*	*			trans	8.5	137.8	142.9	-69.8	0	0	0	0	123.3
741	F	26.9	Very low	27.1	Very low	187 Å²	187	136.7 Å²	136.7	82%	0.82	76%	0.76	S	S	*	*			trans	77.2	171.4	142	-87.2	-80.9	0	0	0	121.3
742	E	29.5	Very low	27.2	Very low	161 Å²	161	135.8 Å²	135.8	75%	0.752	76%	0.758	S	S	*	*			trans	-67	169.4	-168.1	-66	156	119.8	0	0	112.8
743	D	24.8	Very low	27.4	Very low	144 Å²	144	137.5 Å²	137.5	77%	0.77	76%	0.764	S	S	*	*			cis	-159.5	-170.7	31.2	-158.6	-7	0	0	0	113
744	R	25.4	Very low	27.4	Very low	219 Å²	219	144.1 Å²	144.1	83%	0.826	77%	0.772	S	S	*	*			trans	-49.4	-179.7	165.9	-104.3	176.9	164.7	-174.1	-2.7	115.5
745	P	51.8	Low	27.5	Very low	105 Å²	105	142.5 Å²	142.5	68%	0.682	77%	0.772	S	S	*	*			cis	-137.7	-159.9	-12.3	27	-1.7	0	0	0	114.5
746	V	25.7	Very low	28	Very low	143 Å²	143	141.4 Å²	141.4	87%	0.867	78%	0.775	S	S	*	*			trans	106.9	140	151.4	-169.4	0	0	0	0	117.9
747	S	25.6	Very low	28.3	Very low	90 Å²	90	145.6 Å²	145.6	63%	0.629	78%	0.784	S	S	*	*			trans	-101.8	154	-172.9	166.2	0	0	0	0	113.4
748	K	24.8	Very low	28.6	Very low	211 Å²	211	147.4 Å²	147.4	92%	0.917	79%	0.79	S	S	*	*			trans	-160.7	162.2	134	-108.6	159.8	-171.8	176	0	113
749	Q	26.6	Very low	28.9	Very low	169 Å²	169	144.9 Å²	144.9	79%	0.79	79%	0.79	S	S	*	*			trans	-114.2	175.1	-166.7	-59.7	159.2	-77.3	0	0	112.9
750	S	28	Very low	29.1	Very low	95 Å²	95	144.5 Å²	144.5	66%	0.664	79%	0.793	S	S	*	*			trans	88.1	160.1	142.3	92.2	0	0	0	0	118.3
751	Y	29.5	Very low	29.3	Very low	222 Å²	222	150.9 Å²	150.9	87%	0.871	80%	0.802	S	S	*	*			cis	-156	171.2	2.6	-116.5	-37.1	0	0	0	112.3
752	A	28.5	Very low	29.2	Very low	84 Å²	84	146.6 Å²	146.6	69%	0.694	80%	0.795	S	S	*	*			trans	67	135	162.6	0	0	0	0	0	118.4
753	T	33.2	Very low	29.1	Very low	138 Å²	138	144.3 Å²	144.3	85%	0.847	80%	0.797	S	S	*	*			cis	87	118.9	15.4	-44.5	0	0	0	0	116.8
754	R	26.5	Very low	29.2	Very low	253 Å²	253	142.3 Å²	142.3	96%	0.955	79%	0.794	S	S	*	*			trans	-158.7	135	158.5	-121	177.6	-177.4	-176.6	0.3	112.5
755	G	27.9	Very low	29.4	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	79%	0.794	S	S	*	*			trans	-110.9	-151.3	164.7	0	0	0	0	0	110.6
756	A	35.6	Very low	28.4	Very low	97 Å²	97	139.2 Å²	139.2	80%	0.802	79%	0.794	S	S	*	*			cis	-170.7	166.2	-3	0	0	0	0	0	109
757	Q	29.3	Very low	28.7	Very low	183 Å²	183	140.1 Å²	140.1	86%	0.855	79%	0.793	S	S	*	*			trans	177.1	155.2	161.6	-102.6	165.7	6.2	0	0	110.9
758	Q	31.1	Very low	28.8	Very low	179 Å²	179	139 Å²	139	84%	0.836	80%	0.795	S	S	*	*			cis	-168	123.7	-40.5	-124	178.6	3.5	0	0	113
759	G	27.6	Very low	29.1	Very low	79 Å²	79	136.5 Å²	136.5	81%	0.814	79%	0.792	S	S	*	*			trans	67.9	168	155	0	0	0	0	0	120.6
760	A	29.8	Very low	29.4	Very low	93 Å²	93	136.6 Å²	136.6	77%	0.769	79%	0.792	S	S	*	*			cis	-171.9	167.3	-21	0	0	0	0	0	111.4
761	R	27.1	Very low	29.6	Very low	244 Å²	244	139 Å²	139	92%	0.921	80%	0.797	S	S	*	*			trans	83.8	145.4	176.5	-55.7	174.3	175	-176.5	-2.5	116.6
762	S	25.4	Very low	29.7	Very low	97 Å²	97	136.1 Å²	136.1	68%	0.678	80%	0.798	S	S	*	*			cis	-168.4	146.1	-19	-86.4	0	0	0	0	111.4
763	S	26.4	Very low	30	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	79%	0.793	S	S	*	*			trans	54.4	153	148.5	54.5	0	0	0	0	122.5
764	S	28.2	Very low	30.7	Very low	101 Å²	101	135.1 Å²	135.1	71%	0.706	79%	0.792	S	S	*	*			cis	171.8	134.8	-33.6	50.4	0	0	0	0	109.8
765	I	29.4	Very low	31	Very low	164 Å²	164	129 Å²	129	84%	0.841	79%	0.786	S	S	*	*			trans	157.8	134.8	161.7	-92.2	155	0	0	0	107
766	S	30.7	Very low	31.1	Very low	96 Å²	96	133.4 Å²	133.4	67%	0.671	79%	0.787	S	S	*	*			cis	-172.1	162.6	-12.8	-85.1	0	0	0	0	107.1
767	L	31.6	Very low	30.9	Very low	162 Å²	162	135.4 Å²	135.4	85%	0.848	78%	0.782	S	S	*	*			cis	-161.1	133.5	-4.3	-123	167.9	0	0	0	109.7
768	G	28.3	Very low	31.5	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	78%	0.777	S	S	*	*			trans	71.6	157.9	155.8	0	0	0	0	0	119.5
769	D	31.4	Very low	32.1	Very low	160 Å²	160	128.6 Å²	128.6	86%	0.856	77%	0.769	S	S	*	*			cis	-158	-170.1	-18.1	-134.8	-11.7	0	0	0	112
770	E	32.3	Very low	32.3	Very low	170 Å²	170	135.4 Å²	135.4	79%	0.794	77%	0.77	S	S	*	*			trans	-59.1	154.1	-162.3	-58.6	-172.7	127.7	0	0	120.6
771	D	32.6	Very low	32.5	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	76%	0.763	S	S	*	*			trans	25.2	118.8	146.5	-70.9	-0.2	0	0	0	121.8
772	N	30.3	Very low	32.9	Very low	163 Å²	163	132.5 Å²	132.5	87%	0.872	75%	0.754	S	S	*	*				-165.3	172.5	116.9	-116.9	-81.7	0	0	0	115.3
773	A	34.3	Very low	33.2	Very low	73 Å²	73	131.2 Å²	131.2	60%	0.603	75%	0.75	S	S	*	*	S	Bend	trans	-67.8	166.1	169.5	0	0	0	0	0	111.7	P775	A773-P775 WeakPolarHBondContact O-CD 3.49Å
774	P	49	Very low	33.5	Very low	127 Å²	127	135.4 Å²	135.4	83%	0.825	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.8	119.4	-148.9	25.9	-34.9	0	0	0	114.5
775	P	33	Very low	33.7	Very low	126 Å²	126	135.7 Å²	135.7	82%	0.818	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-86.2	171.8	-178.9	34.4	-35.4	0	0	0	114	A773	A773-P775 WeakPolarHBondContact O-CD 3.49Å
776	Q	29.7	Very low	34.1	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	75%	0.754	S	S	*	*			trans	-141.6	145.4	-168.9	-103.1	-171.1	-2.3	0	0	111.7
777	I	32.4	Very low	34.9	Very low	139 Å²	139	137.2 Å²	137.2	71%	0.713	76%	0.76	S	S	*	*			trans	69.7	164.3	146.4	-62.2	168.3	0	0	0	115
778	P	41.4	Very low	35	Very low	113 Å²	113	132.6 Å²	132.6	73%	0.734	75%	0.752	S	S	*	*			cis	-116.1	-122.5	-37.6	36.7	-16.9	0	0	0	110.5
779	P	44.3	Very low	35.5	Very low	105 Å²	105	135 Å²	135	68%	0.682	76%	0.758	S	S	*	*				-125.7	146.9	-51.2	35.4	-19.2	0	0	0	117
780	R	30.7	Very low	35.6	Very low	223 Å²	223	138.1 Å²	138.1	84%	0.842	76%	0.758	S	S	*	*				52.5	157.9	129.8	-131.5	177	-166.9	144.1	6.6	125.1
781	D	34.7	Very low	35.6	Very low	113 Å²	113	135 Å²	135	60%	0.604	75%	0.754	S	S	*	*			trans	83.5	146.8	150.3	-74.9	-46	0	0	0	120.3
782	H	33.8	Very low	35.5	Very low	162 Å²	162	133.3 Å²	133.3	75%	0.75	75%	0.754	S	S	*	*			cis	-146.4	155.2	10	-104.5	-22.6	0	0	0	114.2
783	A	31.9	Very low	35.8	Very low	71 Å²	71	131.4 Å²	131.4	59%	0.587	75%	0.754	S	S	*	*			trans	54.8	135.8	148.1	0	0	0	0	0	120.9
784	F	33.6	Very low	36.7	Very low	201 Å²	201	133.7 Å²	133.7	88%	0.882	76%	0.763	S	S	*	*			cis	-127.7	-173.6	12.1	-67.1	-92.7	0	0	0	109.9
785	S	32.3	Very low	36.3	Very low	107 Å²	107	135.7 Å²	135.7	75%	0.748	77%	0.765	S	S	*	*			cis	-152.7	-159.6	12.8	-158.1	0	0	0	0	112.7
786	Q	36.9	Very low	37.2	Very low	167 Å²	167	135.1 Å²	135.1	78%	0.78	76%	0.762	S	S	*	*			trans	-148.6	174.4	-172.4	-80.5	-71.9	-43.2	0	0	109.9
787	P	49	Very low	37.2	Very low	125 Å²	125	135.3 Å²	135.3	81%	0.812	77%	0.767	S	S	*	*			cis	-136.4	175.8	8.9	41.8	-25.1	0	0	0	117.4
788	G	32.9	Very low	37.1	Very low	65 Å²	65	132.7 Å²	132.7	67%	0.67	77%	0.766	S	S	*	*			trans	141.4	67.5	143.8	0	0	0	0	0	122
789	S	37.8	Very low	37.4	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	77%	0.771	S	S	*	*			trans	5.5	154.8	149.4	-39.6	0	0	0	0	122.3
790	R	34.5	Very low	36.7	Very low	227 Å²	227	132.3 Å²	132.3	86%	0.857	77%	0.77	S	S	*	*			cis	-161.2	155.7	37.7	-61.4	176	167.8	-150.3	-5	114.5
791	S	32.3	Very low	36.6	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	77%	0.77	S	S	*	*			trans	53.4	148.2	140.5	58.5	0	0	0	0	123.4
792	S	31.2	Very low	36.4	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	78%	0.781	S	S	*	*			cis	172.3	141.8	-34.6	46.3	0	0	0	0	110.5
793	S	36.5	Very low	36.4	Very low	123 Å²	123	126.8 Å²	126.8	86%	0.86	78%	0.78	S	S	*	*			trans	-126.2	150.6	173.1	-53.4	0	0	0	0	112
794	P	51.6	Low	36.6	Very low	122 Å²	122	129.2 Å²	129.2	79%	0.792	79%	0.788	S	S	*	*			trans	-125.9	138.7	170	37.3	-24.2	0	0	0	115.8
795	L	41	Very low	36.5	Very low	169 Å²	169	127.7 Å²	127.7	89%	0.885	79%	0.787	S	S	*	*			trans	-120.4	156.7	146.3	-71.3	173.2	0	0	0	107.1
796	P	53	Low	36.6	Very low	114 Å²	114	128.4 Å²	128.4	74%	0.74	79%	0.787	S	S	*	*				-146.8	-179.8	119.8	42.2	-26.8	0	0	0	111.6
797	L	30.2	Very low	36.3	Very low	169 Å²	169	126 Å²	126	89%	0.885	78%	0.784	S	S	*	*			cis	-153.2	172.6	33.9	-104.9	171.3	0	0	0	111.6
798	A	29.1	Very low	35.3	Very low	84 Å²	84	127.3 Å²	127.3	69%	0.694	78%	0.783	S	S	*	*			trans	-127	-167.9	174.8	0	0	0	0	0	109.9
799	P	47.1	Very low	36	Very low	128 Å²	128	129.6 Å²	129.6	83%	0.831	79%	0.786	S	S	*	*			cis	-124.8	-141.3	16.5	29.9	-2.1	0	0	0	112.1
800	A	29.8	Very low	37.1	Very low	81 Å²	81	129.5 Å²	129.5	67%	0.669	78%	0.783	S	S	*	*			cis	-167.1	161.6	10.4	0	0	0	0	0	116.6
801	L	30	Very low	38.5	Very low	160 Å²	160	124.1 Å²	124.1	84%	0.838	78%	0.777	S	S	*	*			trans	64.1	119.6	147.9	-66.3	176.9	0	0	0	125.1
802	S	29.7	Very low	40	Very low	118 Å²	118	123.9 Å²	123.9	83%	0.825	77%	0.773	S	S	*	*			trans	75.4	163.4	133.3	-64.8	0	0	0	0	122
803	S	34.2	Very low	40.4	Very low	105 Å²	105	126 Å²	126	73%	0.734	78%	0.775	S	S	*	*			trans	-150	147.2	-146.2	60.4	0	0	0	0	116.8
804	T	36.4	Very low	40.4	Very low	122 Å²	122	127 Å²	127	75%	0.748	77%	0.77	S	S	*	*			trans	70.1	114.1	151.8	-28.4	0	0	0	0	120.5
805	L	29.9	Very low	39.4	Very low	168 Å²	168	127.5 Å²	127.5	88%	0.88	77%	0.77	S	S	*	*				-173.9	-174.4	121.9	-99.6	170.1	0	0	0	111.6
806	V	35.2	Very low	39.1	Very low	122 Å²	122	124.6 Å²	124.6	74%	0.739	76%	0.764	S	S	*	*			trans	-139.1	151.6	-149.9	172.9	0	0	0	0	114.3
807	V	31	Very low	39.5	Very low	118 Å²	118	124.1 Å²	124.1	72%	0.715	76%	0.761	S	S	*	*			trans	95.3	116.5	153.9	135.1	0	0	0	0	122.6
808	L	27.6	Very low	39.7	Very low	152 Å²	152	126 Å²	126	80%	0.796	76%	0.756	S	S	*	*			trans	64	167.7	142.9	-61.5	175.7	0	0	0	122.8
809	P	48	Very low	39.8	Very low	112 Å²	112	132.5 Å²	132.5	73%	0.727	76%	0.763	S	S	*	*				-138.7	-137	-51	48.6	-30.4	0	0	0	115.5
810	P	60.2	Low	39	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	77%	0.765	S	S	*	*			trans	-122.1	-141.9	-146.6	39.2	-11.9	0	0	0	113.3
811	P	64.3	Low	39	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	77%	0.774	S	S	*	*			cis	-120.1	-108.1	-15.9	22.7	6.1	0	0	0	112.7
812	P	63.9	Low	38.9	Very low	98 Å²	98	128.2 Å²	128.2	64%	0.636	77%	0.768	S	S	*	*			cis	-141.9	-178.1	-28.7	38.3	-15.8	0	0	0	119
813	L	39.5	Very low	39	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	77%	0.769	S	S	*	*			trans	78.5	160.4	158.6	-52.6	-166.7	0	0	0	120
814	L	36.1	Very low	38.8	Very low	145 Å²	145	133.1 Å²	133.1	76%	0.759	78%	0.775	S	S	*	*			cis	-167.4	168.7	-12.9	-115.6	-176.6	0	0	0	116.4
815	V	32	Very low	38.3	Very low	132 Å²	132	130.7 Å²	130.7	80%	0.8	78%	0.775	S	S	*	*			trans	75.2	154.8	153.9	175.8	0	0	0	0	122.4
816	S	33.2	Very low	39.5	Very low	108 Å²	108	128.3 Å²	128.3	76%	0.755	77%	0.769	S	S	*	*			trans	-151.8	-163	-172.1	-152.8	0	0	0	0	109.4
817	P	62.2	Low	39.4	Very low	104 Å²	104	129.4 Å²	129.4	68%	0.675	77%	0.77	S	S	*	*			cis	-147.8	-162.4	0.6	44.3	-21.6	0	0	0	118.2
818	R	33.6	Very low	39.6	Very low	208 Å²	208	130.9 Å²	130.9	79%	0.785	77%	0.773	S	S	*	*			trans	96.9	117.1	143.3	-90.6	-179.3	-177.1	-159	3.2	125.3
819	R	32.3	Very low	40	Very low	222 Å²	222	128.5 Å²	128.5	84%	0.838	77%	0.769	S	S	*	*				73.5	147.3	124.9	-96.2	-171.7	-179.6	-178.7	0.3	125.3
820	A	30.3	Very low	39.5	Very low	104 Å²	104	128.1 Å²	128.1	86%	0.86	77%	0.769	S	S	*	*			trans	92.6	166.9	149.1	0	0	0	0	0	119.3
821	A	29.9	Very low	38.2	Very low	106 Å²	106	128.4 Å²	128.4	88%	0.876	77%	0.774	S	S	*	*			trans	-150.8	159.8	-158.7	0	0	0	0	0	114
822	G	27.2	Very low	36.9	Very low	69 Å²	69	127.9 Å²	127.9	71%	0.711	77%	0.773	S	S	*	*			trans	125.4	128.6	147.3	0	0	0	0	0	119
823	L	32	Very low	35.5	Very low	160 Å²	160	128.2 Å²	128.2	84%	0.838	78%	0.778	S	S	*	*			trans	71.4	125.7	141.1	-62.3	169.4	0	0	0	122.4
824	L	30	Very low	35.3	Very low	166 Å²	166	125.9 Å²	125.9	87%	0.869	77%	0.774	S	S	*	*			trans	58.7	135.9	134	-61.2	170.2	0	0	0	121.9
825	G	25.3	Very low	35.2	Very low	71 Å²	71	125.4 Å²	125.4	73%	0.732	78%	0.777	S	S	*	*			trans	141.2	142.3	137.8	0	0	0	0	0	116.2
826	P	56.6	Low	35.1	Very low	118 Å²	118	124.6 Å²	124.6	77%	0.766	78%	0.777	S	S	*	*			trans	-141.2	-178	-158.6	45.8	-27	0	0	0	118.3
827	L	31.7	Very low	35.1	Very low	144 Å²	144	130.8 Å²	130.8	75%	0.754	78%	0.784	S	S	*	*			trans	85.3	128.9	150.1	-73.9	171.7	0	0	0	123
828	L	36.9	Very low	34.4	Very low	149 Å²	149	131 Å²	131	78%	0.78	79%	0.786	S	S	*	*			trans	73.9	161.4	143.1	-63.3	169	0	0	0	119
829	S	35.8	Very low	34.1	Very low	102 Å²	102	125.8 Å²	125.8	71%	0.713	79%	0.787	S	S	*	*			cis	-124.7	-157.1	11.1	-52.9	0	0	0	0	111.9
830	S	37.6	Very low	33.8	Very low	105 Å²	105	119.1 Å²	119.1	73%	0.734	78%	0.779	S	S	*	*			cis	-169	178.2	7.5	13.2	0	0	0	0	110.6
831	S	32.7	Very low	33.6	Very low	117 Å²	117	119.3 Å²	119.3	82%	0.818	77%	0.774	S	S	*	*			trans	73	164.6	167.2	83.7	0	0	0	0	115.8
832	S	35.5	Very low	33.4	Very low	104 Å²	104	119.6 Å²	119.6	73%	0.727	77%	0.77	S	S	*	*			cis	-176.9	164	-18.5	43.1	0	0	0	0	107.9
833	S	35.6	Very low	33.5	Very low	106 Å²	106	127.2 Å²	127.2	74%	0.741	78%	0.779	S	S	*	*			cis	-177.9	153.9	-12.5	46.6	0	0	0	0	108.1
834	S	35.8	Very low	33.1	Very low	103 Å²	103	124.8 Å²	124.8	72%	0.72	78%	0.775	S	S	*	*			cis	-174	130.4	-16	50.9	0	0	0	0	112.5
835	V	33.9	Very low	32.9	Very low	136 Å²	136	121.7 Å²	121.7	82%	0.824	77%	0.768	S	S	*	*			trans	67.7	119	146.8	-177.5	0	0	0	0	121.5
836	S	29	Very low	32.9	Very low	115 Å²	115	124.9 Å²	124.9	80%	0.804	77%	0.773	S	S	*	*				-169.8	161.4	123.7	-82.8	0	0	0	0	112.9
837	R	34.3	Very low	31.5	Very low	237 Å²	237	123.7 Å²	123.7	89%	0.894	77%	0.773	S	S	*	*			trans	-131	178	-178.6	-71.3	-177.6	76.4	-170	4.7	108.7
838	P	46.7	Very low	31.3	Very low	110 Å²	110	124.2 Å²	124.2	71%	0.714	78%	0.776	S	S	*	*			cis	-140.4	-177.3	9	44.1	-26.1	0	0	0	117.6
839	A	27.2	Very low	30.9	Very low	97 Å²	97	124.3 Å²	124.3	80%	0.802	78%	0.776	S	S	*	*			trans	68	158.4	153.2	0	0	0	0	0	119.1
840	A	25.4	Very low	30.3	Very low	83 Å²	83	128 Å²	128	69%	0.686	78%	0.782	S	S	*	*			cis	-168.3	-177.7	-28.8	0	0	0	0	0	109.5
841	S	26.7	Very low	30.5	Very low	107 Å²	107	127.5 Å²	127.5	75%	0.748	78%	0.777	S	S	*	*			trans	23.8	150.2	141.1	59.8	0	0	0	0	122.3
842	S	25.7	Very low	30.3	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	78%	0.777	S	S	*	*			cis	-177.6	-178.8	-2.6	-94.9	0	0	0	0	109.8
843	Y	29.1	Very low	29.9	Very low	228 Å²	228	128.5 Å²	128.5	89%	0.894	78%	0.775	S	S	*	*			trans	-43.1	139	165.1	-72.5	-103.8	0	0	0	116.6
844	S	24.2	Very low	29.4	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	78%	0.778	S	S	*	*			trans	-173.7	141.4	140.1	-84.5	0	0	0	0	109.6
845	S	25.7	Very low	29.1	Very low	101 Å²	101	137.3 Å²	137.3	71%	0.706	78%	0.782	S	S	*	*				74.4	134.2	52.2	-54.5	0	0	0	0	112.5
846	T	25.1	Very low	28.7	Very low	137 Å²	137	139.2 Å²	139.2	84%	0.84	78%	0.782	S	S	*	*			cis	-167.4	134.5	-1.7	12.6	0	0	0	0	110.4
847	A	26.3	Very low	28.7	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	78%	0.775	S	S	*	*			trans	-175.4	144.2	155.3	0	0	0	0	0	109.5
848	L	28.8	Very low	28.4	Very low	155 Å²	155	137.7 Å²	137.7	81%	0.812	78%	0.779	S	S	*	*			cis	-159	165.4	-11.9	-114.6	175.5	0	0	0	108.7
849	L	28.5	Very low	27.4	Very low	151 Å²	151	136 Å²	136	79%	0.791	78%	0.781	S	S	*	*			trans	62.3	96.3	159.9	-69.2	160.2	0	0	0	119.4
850	E	23.4	Very low	27.3	Very low	179 Å²	179	139.7 Å²	139.7	84%	0.836	79%	0.786	S	S	*	*				-121.4	151	129.3	-174.9	-175.8	-118.1	0	0	107.2
851	P	39.9	Very low	27.3	Very low	96 Å²	96	141.5 Å²	141.5	62%	0.623	79%	0.794	S	S	*	*			trans	-140	148.8	141.2	38.6	-26.4	0	0	0	115
852	L	28.5	Very low	27.3	Very low	159 Å²	159	141.2 Å²	141.2	83%	0.832	80%	0.798	S	S	*	*			trans	82.2	128.1	165.5	-47.1	-174.7	0	0	0	116.7
853	A	27.9	Very low	27.4	Very low	83 Å²	83	143.8 Å²	143.8	69%	0.686	80%	0.799	S	S	*	*			cis	-165.5	149.9	-3.8	0	0	0	0	0	115.7
854	F	25.6	Very low	27.5	Very low	182 Å²	182	140.8 Å²	140.8	80%	0.798	80%	0.796	S	S	*	*			trans	78.5	102.2	140.7	-93.9	-122	0	0	0	123.6
855	R	28.9	Very low	27.6	Very low	212 Å²	212	142.5 Å²	142.5	80%	0.8	80%	0.796	S	S	*	*				107.2	145.6	108.1	-157.9	175.1	-163.4	-178.7	9.2	120.5
856	E	26.9	Very low	27.8	Very low	175 Å²	175	142.6 Å²	142.6	82%	0.818	80%	0.797	S	S	*	*			trans	-91.4	156.4	-179.3	-38.7	135.2	99.5	0	0	115
857	G	28	Very low	28.9	Very low	65 Å²	65	141.1 Å²	141.1	67%	0.67	79%	0.79	S	S	*	*				94.5	153.8	118.1	0	0	0	0	0	120.7
858	R	28	Very low	29	Very low	256 Å²	256	145 Å²	145	97%	0.966	79%	0.792	S	S	*	*			trans	71.1	164	-174.4	-43	-176.9	-143.7	-138.8	2.7	113.2
859	G	24.8	Very low	28.9	Very low	74 Å²	74	142.9 Å²	142.9	76%	0.763	79%	0.79	S	S	*	*			cis	-176	177.4	0.6	0	0	0	0	0	112.3
860	L	26.7	Very low	28.8	Very low	175 Å²	175	141.6 Å²	141.6	92%	0.916	79%	0.794	S	S	*	*			trans	-67.4	142.5	-171.2	-67.7	162.8	0	0	0	116.3
861	S	25.8	Very low	29.4	Very low	121 Å²	121	138 Å²	138	85%	0.846	79%	0.794	S	S	*	*			trans	65.2	120.8	138.3	-167.6	0	0	0	0	122.2
862	A	26.5	Very low	29.1	Very low	101 Å²	101	138.9 Å²	138.9	84%	0.835	80%	0.8	S	S	*	*			trans	-161.5	161.5	144.1	0	0	0	0	0	112
863	M	26.2	Very low	29.1	Very low	166 Å²	166	138.9 Å²	138.9	82%	0.818	80%	0.801	S	S	*	*			trans	-99.1	160.6	-170.3	-59.7	158.5	122.6	0	0	114
864	M	31.6	Very low	29.5	Very low	166 Å²	166	140.7 Å²	140.7	82%	0.818	81%	0.806	S	S	*	*			trans	64.6	151.1	156.6	-74.4	155.1	172.4	0	0	116.6
865	D	25.8	Very low	29.8	Very low	145 Å²	145	140 Å²	140	78%	0.775	81%	0.809	S	S	*	*			cis	-145.9	177.4	9	-124.9	-32.3	0	0	0	112.3
866	S	30.2	Very low	30.1	Very low	104 Å²	104	135.5 Å²	135.5	73%	0.727	81%	0.808	S	S	*	*			trans	-94.8	171.1	166.4	-65.1	0	0	0	0	110.6
867	P	47.8	Very low	30.3	Very low	105 Å²	105	136.6 Å²	136.6	68%	0.682	81%	0.813	S	S	*	*			cis	-148	-174.4	18.3	43.1	-21.6	0	0	0	118.4
868	Q	29.2	Very low	30.6	Very low	176 Å²	176	143.4 Å²	143.4	82%	0.822	82%	0.818	S	S	*	*			trans	75	126.5	141.1	-88.2	171.3	-14.1	0	0	124.7
869	S	26.5	Very low	30.7	Very low	109 Å²	109	137 Å²	137	76%	0.762	81%	0.81	S	S	*	*			trans	74.3	108.4	137.5	67.8	0	0	0	0	121.8
870	S	26.8	Very low	31.1	Very low	125 Å²	125	138.1 Å²	138.1	87%	0.874	81%	0.812	S	S	*	*				-179.8	162.9	113.1	40	0	0	0	0	109.7
871	A	35.5	Very low	31.2	Very low	102 Å²	102	138.8 Å²	138.8	84%	0.843	81%	0.808	S	S	*	*			trans	-108.9	146	-171.5	0	0	0	0	0	113
872	P	33.4	Very low	31.5	Very low	116 Å²	116	139 Å²	139	75%	0.753	80%	0.799	S	S	*	*			trans	-123.1	131.1	163.4	36.3	-24	0	0	0	114
873	N	28.9	Very low	31.8	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	80%	0.8	S	S	*	*				35.2	159.2	121.1	-85.1	4.1	0	0	0	123.2
874	P	36.7	Very low	32	Very low	120 Å²	120	146 Å²	146	78%	0.779	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-89.2	168.9	-148.5	35.4	-38.6	0	0	0	116.8
875	L	31.8	Very low	32	Very low	168 Å²	168	149 Å²	149	88%	0.88	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-93.9	157.9	174.7	-76.4	168.7	0	0	0	112.5
876	P	35.3	Very low	31.9	Very low	118 Å²	118	145.8 Å²	145.8	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-85.3	171.6	-167	34.8	-38.2	0	0	0	115.6
877	E	31.5	Very low	31.8	Very low	198 Å²	198	146 Å²	146	93%	0.925	82%	0.815	S	S	*	*			trans	-78	-178	-175.8	-64	-171	123.7	0	0	115.4
878	R	33.7	Very low	30.7	Very low	208 Å²	208	145.8 Å²	145.8	79%	0.785	82%	0.822	S	S	*	*			trans	-115.4	140.5	-158.8	-168	-177.3	-165.8	173.5	3.7	111.6
879	P	30.5	Very low	30.7	Very low	121 Å²	121	144.6 Å²	144.6	79%	0.786	82%	0.821	S	S	*	*			trans	-62.8	135.5	178.7	-25	35.2	0	0	0	114.4	F881	P879-F881 PolarHBondContact O-N 2.69Å; P879-F881 VanDerWaalsContact O-N 3.13Å
880	A	32.3	Very low	30.8	Very low	98 Å²	98	147.4 Å²	147.4	81%	0.81	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	87.7	-173.6	0	0	0	0	0	113.4
881	F	30.3	Very low	30.8	Very low	188 Å²	188	146.6 Å²	146.6	83%	0.825	83%	0.825	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134	-26.6	169.2	161.3	-120.4	0	0	0	113	P879 E883	P879-F881 PolarHBondContact O-N 2.69Å; P879-F881 VanDerWaalsContact O-N 3.13Å; F881-E883 VanDerWaalsContact C-N 3.33Å; F881-E883 PolarHBondContact O-N 3.28Å
882	L	30.8	Very low	30.4	Very low	126 Å²	126	146.3 Å²	146.3	66%	0.66	82%	0.823	S	S	*	*	S	Bend	trans	-87.2	10.1	-171.2	-143.4	81.1	0	0	0	115.2	R884	L882-R884 PolarHBondContact O-N 3.26Å
883	E	32.3	Very low	30.1	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.6	23.2	-163.3	-149.4	164	-127.6	0	0	114.7	F881	F881-E883 VanDerWaalsContact C-N 3.33Å; F881-E883 PolarHBondContact O-N 3.28Å
884	R	30.5	Very low	30	Very low	231 Å²	231	149.4 Å²	149.4	87%	0.872	83%	0.829	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	12	174.6	-151	179.4	-74.2	-167.6	-2.5	114.7	L882	L882-R884 PolarHBondContact O-N 3.26Å
885	Y	31.4	Very low	29.7	Very low	230 Å²	230	149 Å²	149	90%	0.902	83%	0.826	S	S	*	*	S	Bend	trans	-132	80.6	170.1	-78.8	-76	0	0	0	110.6
886	G	25.5	Very low	29.3	Very low	76 Å²	76	149.5 Å²	149.5	78%	0.784	83%	0.826	S	S	*	*			trans	-91.4	133.1	179.8	0	0	0	0	0	113.8
887	A	26.3	Very low	28.8	Very low	109 Å²	109	152.3 Å²	152.3	90%	0.901	83%	0.831	S	S	*	*	S	Bend	trans	59.5	72.6	154.7	0	0	0	0	0	119.5
888	A	25.7	Very low	28.7	Very low	100 Å²	100	149.7 Å²	149.7	83%	0.826	82%	0.819	S	S	*	*			trans	-147.1	44.6	157.2	0	0	0	0	0	113.7
889	N	29.9	Very low	28.4	Very low	152 Å²	152	149.1 Å²	149.1	81%	0.813	83%	0.825	S	S	*	*			trans	-98.1	110.3	-177	-99	-6	0	0	0	114.4
890	M	27.5	Very low	28.3	Very low	168 Å²	168	149.4 Å²	149.4	83%	0.828	82%	0.816	S	S	*	*				46.1	94.7	125.8	-57.5	178.4	73.6	0	0	117.3
891	A	26.8	Very low	28.1	Very low	107 Å²	107	153.8 Å²	153.8	88%	0.884	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-63.9	137.5	164.6	0	0	0	0	0	111.3
892	A	27.1	Very low	27.9	Very low	96 Å²	96	152.3 Å²	152.3	79%	0.793	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73.6	144.4	-172.3	0	0	0	0	0	113.8	K894	A892-K894 PolarHBondContact O-N 3.27Å
893	V	27.6	Very low	27.8	Very low	146 Å²	146	152.9 Å²	152.9	89%	0.885	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-68.2	123.8	168.9	177.5	0	0	0	0	109.9
894	K	26.4	Very low	27.5	Very low	194 Å²	194	148.2 Å²	148.2	84%	0.843	83%	0.825	S	S	*	*			trans	-138.1	156.5	161.7	-93.2	-164.4	174.7	178.2	0	110.6	A892	A892-K894 PolarHBondContact O-N 3.27Å
895	P	29.8	Very low	27.2	Very low	113 Å²	113	141 Å²	141	73%	0.734	82%	0.823	S	S	*	*				-91.4	155.8	-126.8	31.9	-38	0	0	0	115.5	M897	P895-M897 PolarHBondContact O-N 3.26Å
896	M	24	Very low	26.9	Very low	178 Å²	178	135.2 Å²	135.2	88%	0.877	82%	0.822	S	S	*	*			trans	-66.6	110.7	165	-179.4	171.4	67.8	0	0	109.8	Q898	M896-Q898 PolarHBondContact O-N 2.71Å
897	M	25.4	Very low	27	Very low	176 Å²	176	141.3 Å²	141.3	87%	0.867	83%	0.828	S	S	*	*			trans	-76.2	110.9	173	-171.7	-178.1	178.8	0	0	109.8	P895 Q899	P895-M897 PolarHBondContact O-N 3.26Å; M897-Q899 PolarHBondContact O-N 3.08Å
898	Q	28.9	Very low	27.9	Very low	144 Å²	144	141.1 Å²	141.1	67%	0.673	82%	0.817	S	S	*	*			trans	-62.8	129.4	177.6	-164.3	179.2	62.9	0	0	110.7	M896 Q900	M896-Q898 PolarHBondContact O-N 2.71Å; Q898-Q900 VanDerWaalsContact C-N 3.25Å; Q898-Q900 PolarHBondContact O-N 3.12Å
899	Q	28	Very low	27.8	Very low	196 Å²	196	143.4 Å²	143.4	92%	0.916	82%	0.816	S	S	*	*			trans	-77.3	78.6	176.1	-168.8	174.9	14.4	0	0	110.1	M897 Q901	M897-Q899 PolarHBondContact O-N 3.08Å; Q899-Q901 PolarHBondContact O-N 3.01Å
900	Q	27.4	Very low	27.6	Very low	127 Å²	127	141.1 Å²	141.1	59%	0.593	81%	0.811	S	S	*	*			trans	-68.3	113.7	-172	-163.4	177.9	46	0	0	111.9	Q898 Q902	Q898-Q900 VanDerWaalsContact C-N 3.25Å; Q898-Q900 PolarHBondContact O-N 3.12Å; Q900-Q902 HydrophobicContact CG-CG 3.93Å; Q900-Q902 PolarHBondContact O-N 2.92Å; Q900-Q902 VanDerWaalsContact O-N 3.15Å
901	Q	29.2	Very low	27.5	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	81%	0.807	S	S	*	*			trans	-70.4	100.6	159	-74.1	-175.3	-10.1	0	0	108.4	Q899	Q899-Q901 PolarHBondContact O-N 3.01Å
902	Q	26.6	Very low	27.5	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	80%	0.8	S	S	*	*			trans	-90.1	115.4	165.9	-70.4	-164	7.1	0	0	110.1	Q900	Q900-Q902 HydrophobicContact CG-CG 3.93Å; Q900-Q902 PolarHBondContact O-N 2.92Å; Q900-Q902 VanDerWaalsContact O-N 3.15Å
903	T	28.7	Very low	27.4	Very low	139 Å²	139	143.2 Å²	143.2	85%	0.853	79%	0.793	S	S	*	*			trans	-98	120.6	168.6	51.9	0	0	0	0	110.4
904	G	25.9	Very low	27.5	Very low	84 Å²	84	142.2 Å²	142.2	87%	0.866	78%	0.782	S	S	*	*			trans	179.1	126.3	170.2	0	0	0	0	0	112.6
905	G	24.2	Very low	27.5	Very low	81 Å²	81	138.7 Å²	138.7	84%	0.835	77%	0.773	S	S	*	*			cis	172.2	145.3	-10.8	0	0	0	0	0	112.4
906	A	24.8	Very low	27.6	Very low	107 Å²	107	140.5 Å²	140.5	88%	0.884	78%	0.777	S	S	*	*			trans	-149.5	125	169.7	0	0	0	0	0	111.2
907	K	27	Very low	27.6	Very low	205 Å²	205	135.9 Å²	135.9	89%	0.891	78%	0.775	S	S	*	*			trans	-103.8	175.6	161.5	-71.5	-176.2	178.5	179.8	0	107.1
908	P	44.6	Very low	27.6	Very low	105 Å²	105	130.9 Å²	130.9	68%	0.682	77%	0.768	S	S	*	*			cis	-136.7	165	7.5	40.8	-23.8	0	0	0	116.8
909	N	24.8	Very low	27.4	Very low	148 Å²	148	131 Å²	131	79%	0.791	78%	0.779	S	S	*	*				162.6	113.9	126.4	-81.6	-18.3	0	0	0	107.9
910	S	26.2	Very low	27.4	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	78%	0.778	S	S	*	*				81	106.3	61.5	-171.7	0	0	0	0	113
911	S	25	Very low	27.6	Very low	104 Å²	104	125.1 Å²	125.1	73%	0.727	79%	0.786	S	S	*	*				178.7	103.8	120.5	-169.8	0	0	0	0	113.8
912	Y	25.4	Very low	27.7	Very low	192 Å²	192	122.5 Å²	122.5	75%	0.753	79%	0.785	S	S	*	*			trans	53.1	117.5	139	-70.9	-80.9	0	0	0	125.2
913	N	25.6	Very low	27.8	Very low	118 Å²	118	119.8 Å²	119.8	63%	0.631	78%	0.783	S	S	*	*				89.1	117.2	121.8	-86.6	9.9	0	0	0	124.3
914	N	29.3	Very low	28.3	Very low	125 Å²	125	120.3 Å²	120.3	67%	0.668	78%	0.778	S	S	*	*				64.6	146.6	119.3	-64.5	6.8	0	0	0	120.9
915	N	27.8	Very low	28.5	Very low	121 Å²	121	124.2 Å²	124.2	65%	0.647	77%	0.773	S	S	*	*			cis	-152.9	158.5	8	-134.9	2	0	0	0	114.2
916	N	30.1	Very low	29	Very low	151 Å²	151	129.4 Å²	129.4	81%	0.807	78%	0.776	S	S	*	*			trans	49.9	131.5	157.3	-74.5	-3	0	0	0	121.9
917	G	25.2	Very low	29.4	Very low	81 Å²	81	131.4 Å²	131.4	84%	0.835	77%	0.767	S	S	*	*			trans	150.7	88.2	139.1	0	0	0	0	0	119.1
918	G	24.2	Very low	29.7	Very low	71 Å²	71	127.7 Å²	127.7	73%	0.732	75%	0.753	S	S	*	*			trans	74.8	96.5	141.4	0	0	0	0	0	120.8
919	T	25.9	Very low	29.8	Very low	146 Å²	146	126.5 Å²	126.5	90%	0.896	75%	0.747	S	S	*	*			trans	22.5	107.9	132.5	53.8	0	0	0	0	120.6
920	A	27.7	Very low	30.9	Very low	109 Å²	109	124.6 Å²	124.6	90%	0.901	74%	0.735	S	S	*	*				-179.4	151	121.1	0	0	0	0	0	110.9
921	A	31.2	Very low	32	Very low	91 Å²	91	122.9 Å²	122.9	75%	0.752	72%	0.721	S	S	*	*			trans	-130.1	137.7	172.2	0	0	0	0	0	110.5
922	P	32.5	Very low	33.1	Very low	134 Å²	134	124.1 Å²	124.1	87%	0.87	72%	0.715	S	S	*	*			trans	-73.4	141.5	170.8	31.4	-33.3	0	0	0	110.4
923	S	28.7	Very low	34	Very low	99 Å²	99	118.9 Å²	118.9	69%	0.692	70%	0.7	S	S	*	*			trans	-112	169.7	-170.4	57.8	0	0	0	0	113.6	Q925	S923-Q925 PolarHBondContact O-N 3.36Å
924	M	39	Very low	35.2	Very low	150 Å²	150	113.4 Å²	113.4	74%	0.739	67%	0.671	S	S	*	*			trans	-61.1	129.1	176.9	-62.6	172.1	68.5	0	0	111.6	E927	M924-E927 WeakPolarHBondContact CE-OE2 3.28Å
925	Q	29.8	Very low	36.1	Very low	167 Å²	167	112.7 Å²	112.7	78%	0.78	67%	0.667	S	S	*	*			trans	-131.3	2.7	177.3	-72.6	-164.5	-16.7	0	0	115.7	S923	S923-Q925 PolarHBondContact O-N 3.36Å
926	Q	33.6	Very low	36.9	Very low	190 Å²	190	114 Å²	114	89%	0.888	67%	0.667	S	S	*	*	S	Bend	trans	-94.4	-10.6	-171.1	-151	161.2	18.4	0	0	116.1
927	E	33.1	Very low	37.5	Very low	149 Å²	149	111.7 Å²	111.7	70%	0.696	65%	0.647	S	S	*	*	S	Bend	trans	-95.9	-18.3	-179.5	-69.7	-176.9	115.7	0	0	114.9	M924 S929	M924-E927 WeakPolarHBondContact CE-OE2 3.28Å; E927-S929 VanDerWaalsContact C-N 3.3Å; E927-S929 PolarHBondContact O-N 3.46Å
928	Q	34.3	Very low	38.6	Very low	126 Å²	126	111.6 Å²	111.6	59%	0.589	63%	0.632	S	S	*	*	H	α-helix	trans	-73.8	-16.7	-170.1	-64.6	-170.8	-1.1	0	0	114.8
929	S	46.8	Very low	39.6	Very low	80 Å²	80	118.1 Å²	118.1	56%	0.559	64%	0.64	S	S	*	*	H	α-helix	trans	-67.1	-43.7	-169.8	-170.8	0	0	0	0	113.7	E927 L933	E927-S929 VanDerWaalsContact C-N 3.3Å; E927-S929 PolarHBondContact O-N 3.46Å; S929-L933 PolarHBondContact O-N 3.06Å
930	I	48.4	Very low	40.5	Very low	108 Å²	108	117.1 Å²	117.1	55%	0.554	63%	0.628	S	S	*	*	H	α-helix	trans	-68.8	-44.8	-173.8	-61.9	175.2	0	0	0	111.3	Q932 L933 V934	I930-Q932 VanDerWaalsContact C-N 3.31Å; I930-Q932 PolarHBondContact O-N 2.9Å; I930-L933 WeakPolarHBondContact O-CB 3.03Å; I930-L933 PolarHBondContact O-N 3.45Å; I930-V934 HydrophobicContact CG2-CG2 4.28Å; I930-V934 WeakPolarHBondContact O-CG2 3.34Å; I930-V934 PolarHBondContact O-N 3.39Å
931	T	47.4	Very low	41.6	Very low	68 Å²	68	114.7 Å²	114.7	42%	0.417	60%	0.597	S	S	.	*	H	α-helix	trans	-63.2	-36.5	-177.6	-47.3	0	0	0	0	112.1	N935	T931-N935 PolarHBondContact O-N 3.36Å; T931-N935 PolarHBondContact O-ND2 3.41Å
932	Q	48.2	Very low	43	Very low	130 Å²	130	114 Å²	114	61%	0.607	58%	0.584	S	S	*	*	H	α-helix	trans	-67	-40.1	172.8	-66.8	-175.3	14.2	0	0	111.7	I930 N935 K936	I930-Q932 VanDerWaalsContact C-N 3.31Å; I930-Q932 PolarHBondContact O-N 2.9Å; Q932-N935 PolarHBondContact O-N 3.35Å; Q932-K936 VanDerWaalsContact O-CB 3.28Å; Q932-K936 WeakPolarHBondContact O-CB 3.44Å; Q932-K936 PolarHBondContact O-N 3.35Å
933	L	45.1	Very low	44.1	Very low	82 Å²	82	111.5 Å²	111.5	43%	0.429	56%	0.563	S	S	.	*	H	α-helix	trans	-65.2	-42.9	-179.7	-125.9	135.9	0	0	0	112.8	S929 I930 N935 K936 Y937 F941	S929-L933 PolarHBondContact O-N 3.06Å; I930-L933 WeakPolarHBondContact O-CB 3.03Å; I930-L933 PolarHBondContact O-N 3.45Å; L933-N935 VanDerWaalsContact C-N 3.32Å; L933-N935 PolarHBondContact O-N 3.17Å; L933-K936 PolarHBondContact O-N 3.23Å; L933-Y937 HydrophobicContact CD2-CD2 4.06Å; L933-Y937 HydrophobicContact CD2-CE2 4.34Å; L933-Y937 WeakPolarHBondContact O-CD2 3.46Å; L933-Y937 PolarHBondContact O-N 3.25Å; L933-Y937 VanDerWaalsContact O-N 3.12Å; L933-F941 HydrophobicContact CD2-CE2 4.28Å; L933-F941 HydrophobicContact CD2-CZ 4.19Å
934	V	50.9	Low	45.5	Very low	4 Å²	4	114 Å²	114	2%	0.024	56%	0.564	C	S	.	*	H	α-helix	trans	-70.3	-28.3	179.2	-179.5	0	0	0	0	112.7	I930 F941 R946 L950	I930-V934 HydrophobicContact CG2-CG2 4.28Å; I930-V934 WeakPolarHBondContact O-CG2 3.34Å; I930-V934 PolarHBondContact O-N 3.39Å; V934-F941 HydrophobicContact CB-CD2 4.17Å; V934-F941 HydrophobicContact CB-CE2 4.38Å; V934-F941 HydrophobicContact CG1-CB 4.31Å; V934-F941 HydrophobicContact CG1-CD2 4.17Å; V934-F941 HydrophobicContact CG1-CG 4.28Å; V934-F941 HydrophobicContact CG2-CD1 4.26Å; V934-F941 HydrophobicContact CG2-CD2 3.94Å; V934-F941 HydrophobicContact CG2-CE1 4.24Å; V934-F941 HydrophobicContact CG2-CE2 3.91Å; V934-F941 HydrophobicContact CG2-CG 4.11Å; V934-F941 HydrophobicContact CG2-CZ 4.06Å; V934-R946 HydrophobicContact CG1-CG 3.85Å; V934-R946 PolarHBondContact O-NH2 3.5Å; V934-L950 HydrophobicContact CB-CD1 4.19Å; V934-L950 HydrophobicContact CG1-CD1 3.84Å; V934-L950 HydrophobicContact CG2-CD1 4.43Å
935	N	48.7	Very low	46.6	Very low	109 Å²	109	110 Å²	110	58%	0.583	54%	0.544	S	S	*	.	H	α-helix	trans	-80	-34.6	173.6	-73.4	-15.3	0	0	0	112.4	T931 Q932 L933	T931-N935 PolarHBondContact O-N 3.36Å; T931-N935 PolarHBondContact O-ND2 3.41Å; Q932-N935 PolarHBondContact O-N 3.35Å; L933-N935 VanDerWaalsContact C-N 3.32Å; L933-N935 PolarHBondContact O-N 3.17Å
936	K	44.9	Very low	48.1	Very low	149 Å²	149	104.6 Å²	104.6	65%	0.648	52%	0.517	S	S	*	.	H	α-helix	trans	-70.9	-29	177.5	-170.2	171.4	-179.8	175.5	0	113.1	Q932 L933 P938	Q932-K936 VanDerWaalsContact O-CB 3.28Å; Q932-K936 WeakPolarHBondContact O-CB 3.44Å; Q932-K936 PolarHBondContact O-N 3.35Å; L933-K936 PolarHBondContact O-N 3.23Å; K936-P938 WeakPolarHBondContact O-CD 3.43Å
937	Y	42.8	Very low	49.8	Very low	102 Å²	102	96.1 Å²	96.1	40%	0.4	48%	0.477	S	S	.	.			trans	-126.4	65	-176.7	-58	-68.5	0	0	0	113.6	L933 K939 I940	L933-Y937 HydrophobicContact CD2-CD2 4.06Å; L933-Y937 HydrophobicContact CD2-CE2 4.34Å; L933-Y937 WeakPolarHBondContact O-CD2 3.46Å; L933-Y937 PolarHBondContact O-N 3.25Å; L933-Y937 VanDerWaalsContact O-N 3.12Å; Y937-K939 PolarHBondContact O-N 2.85Å; Y937-K939 VanDerWaalsContact O-N 3.08Å; Y937-I940 HydrophobicContact CD1-CD1 4.07Å; Y937-I940 HydrophobicContact CG-CD1 4.09Å; Y937-I940 PolarHBondContact O-N 3.03Å; Y937-I940 VanDerWaalsContact O-N 3.08Å
938	P	46.5	Very low	51.2	Low	79 Å²	79	95.2 Å²	95.2	51%	0.513	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-13.9	-173.5	28.4	-36.7	0	0	0	114.9	K936	K936-P938 WeakPolarHBondContact O-CD 3.43Å
939	K	46.7	Very low	52.3	Low	209 Å²	209	96.3 Å²	96.3	91%	0.909	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-7.9	175.9	-64.2	-173.5	178.7	-176.7	0	114.3	Y937	Y937-K939 PolarHBondContact O-N 2.85Å; Y937-K939 VanDerWaalsContact O-N 3.08Å
940	I	44.4	Very low	53.3	Low	125 Å²	125	93.5 Å²	93.5	64%	0.641	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-28.7	-174.2	-60	-173.4	0	0	0	112	Y937	Y937-I940 HydrophobicContact CD1-CD1 4.07Å; Y937-I940 HydrophobicContact CG-CD1 4.09Å; Y937-I940 PolarHBondContact O-N 3.03Å; Y937-I940 VanDerWaalsContact O-N 3.08Å
941	F	50	Low	54.6	Low	57 Å²	57	88.4 Å²	88.4	25%	0.25	42%	0.423	C	S	.	.	S	Bend	trans	-97.8	124	-178.4	-68.9	-78.9	0	0	0	112	L933 V934 I945	L933-F941 HydrophobicContact CD2-CE2 4.28Å; L933-F941 HydrophobicContact CD2-CZ 4.19Å; V934-F941 HydrophobicContact CB-CD2 4.17Å; V934-F941 HydrophobicContact CB-CE2 4.38Å; V934-F941 HydrophobicContact CG1-CB 4.31Å; V934-F941 HydrophobicContact CG1-CD2 4.17Å; V934-F941 HydrophobicContact CG1-CG 4.28Å; V934-F941 HydrophobicContact CG2-CD1 4.26Å; V934-F941 HydrophobicContact CG2-CD2 3.94Å; V934-F941 HydrophobicContact CG2-CE1 4.24Å; V934-F941 HydrophobicContact CG2-CE2 3.91Å; V934-F941 HydrophobicContact CG2-CG 4.11Å; V934-F941 HydrophobicContact CG2-CZ 4.06Å; F941-I945 HydrophobicContact CD1-CD1 4.38Å; F941-I945 HydrophobicContact CD1-CG2 3.91Å
942	T	60.8	Low	56.1	Low	78 Å²	78	87.7 Å²	87.7	48%	0.479	42%	0.416	S	S	.	.			trans	-66.5	158.7	175	63.1	0	0	0	0	111.9	E944 I945 R946	T942-E944 PolarHBondContact O-N 3.31Å; T942-I945 PolarHBondContact O-N 3.47Å; T942-I945 VanDerWaalsContact O-N 3.17Å; T942-I945 WeakPolarHBondContact OG1-CD1 3.19Å; T942-I945 WeakPolarHBondContact OG1-CG1 3.49Å; T942-R946 PolarHBondContact O-N 3.09Å
943	L	56.5	Low	57.2	Low	81 Å²	81	83.7 Å²	83.7	42%	0.424	41%	0.409	S	S	.	.	H	α-helix	trans	-56.2	-37.6	-178	-154.4	74	0	0	0	112.6	R946 I947 W972	L943-R946 WeakPolarHBondContact O-CB 3.3Å; L943-R946 PolarHBondContact O-N 3.26Å; L943-I947 PolarHBondContact O-N 2.98Å; L943-I947 VanDerWaalsContact O-N 3.09Å; L943-W972 HydrophobicContact CD1-CE3 4.13Å; L943-W972 HydrophobicContact CD1-CH2 3.8Å; L943-W972 HydrophobicContact CD1-CZ3 3.58Å; L943-W972 HydrophobicContact CD2-CH2 4Å; L943-W972 HydrophobicContact CD2-CZ3 4.31Å; L943-W972 HydrophobicContact CG-CH2 4.27Å; L943-W972 HydrophobicContact CG-CZ3 4.1Å
944	E	58.4	Low	58.7	Low	151 Å²	151	82 Å²	82	71%	0.706	41%	0.406	S	S	*	.	H	α-helix	trans	-67.8	-38.8	-179.3	-59.6	178.2	154	0	0	112.4	T942 R946 I947 K948	T942-E944 PolarHBondContact O-N 3.31Å; E944-R946 VanDerWaalsContact C-N 3.3Å; E944-R946 PolarHBondContact O-N 2.99Å; E944-I947 PolarHBondContact O-N 3.17Å; E944-K948 WeakPolarHBondContact O-CB 3.43Å; E944-K948 PolarHBondContact O-N 3.46Å
945	I	61.5	Low	60.1	Low	65 Å²	65	81.9 Å²	81.9	33%	0.333	41%	0.406	S	S	.	.	H	α-helix	trans	-64.5	-39.4	176.6	-62.7	168	0	0	0	109.9	F941 T942 Y949	F941-I945 HydrophobicContact CD1-CD1 4.38Å; F941-I945 HydrophobicContact CD1-CG2 3.91Å; T942-I945 PolarHBondContact O-N 3.47Å; T942-I945 VanDerWaalsContact O-N 3.17Å; T942-I945 WeakPolarHBondContact OG1-CD1 3.19Å; T942-I945 WeakPolarHBondContact OG1-CG1 3.49Å; I945-Y949 HydrophobicContact CG2-CD2 3.89Å; I945-Y949 HydrophobicContact CG2-CE2 4.48Å; I945-Y949 WeakPolarHBondContact O-CB 3.47Å; I945-Y949 PolarHBondContact O-N 3.23Å
946	R	61.5	Low	61.4	Low	55 Å²	55	83.7 Å²	83.7	21%	0.208	41%	0.41	C	S	.	.	H	α-helix	trans	-62.5	-45.6	175.1	-71.8	-179.7	162	-156.6	-10.6	112	V934 T942 L943 E944 L950	V934-R946 HydrophobicContact CG1-CG 3.85Å; V934-R946 PolarHBondContact O-NH2 3.5Å; T942-R946 PolarHBondContact O-N 3.09Å; L943-R946 WeakPolarHBondContact O-CB 3.3Å; L943-R946 PolarHBondContact O-N 3.26Å; E944-R946 VanDerWaalsContact C-N 3.3Å; E944-R946 PolarHBondContact O-N 2.99Å; R946-L950 VanDerWaalsContact O-CB 3.3Å; R946-L950 WeakPolarHBondContact O-CB 3.47Å; R946-L950 PolarHBondContact O-N 2.73Å
947	I	68.8	Low	62.9	Low	11 Å²	11	80.3 Å²	80.3	6%	0.056	42%	0.418	C	S	.	.	I	π-helix	trans	-62.1	-53.9	176.2	-72.9	163.3	0	0	0	111	L943 E944 V951 Q952 T960 C963 K964 L967	L943-I947 PolarHBondContact O-N 2.98Å; L943-I947 VanDerWaalsContact O-N 3.09Å; E944-I947 PolarHBondContact O-N 3.17Å; I947-V951 PolarHBondContact O-N 2.79Å; I947-Q952 HydrophobicContact CG2-CG 4.44Å; I947-Q952 PolarHBondContact O-N 2.9Å; I947-Q952 VanDerWaalsContact O-N 3.09Å; I947-T960 HydrophobicContact CG2-CG2 3.94Å; I947-C963 HydrophobicContact CG1-CB 4.42Å; I947-C963 HydrophobicContact CG2-CB 3.67Å; I947-K964 HydrophobicContact CD1-CB 4.08Å; I947-K964 HydrophobicContact CD1-CG 4.47Å; I947-L967 HydrophobicContact CG1-CD1 3.86Å
948	K	62.2	Low	64.8	Low	130 Å²	130	75.9 Å²	75.9	57%	0.565	40%	0.402	S	S	*	.	I	π-helix	trans	-68.4	-39.1	-169.8	-172.9	172.3	-176.8	173.4	0	113.7	E944	E944-K948 WeakPolarHBondContact O-CB 3.43Å; E944-K948 PolarHBondContact O-N 3.46Å
949	Y	57	Low	66.7	Low	150 Å²	150	75.1 Å²	75.1	59%	0.588	40%	0.396	S	S	*	.	I	π-helix	trans	-99.1	-29.6	-175.1	-72	-88.2	0	0	0	114.4	I945	I945-Y949 HydrophobicContact CG2-CD2 3.89Å; I945-Y949 HydrophobicContact CG2-CE2 4.48Å; I945-Y949 WeakPolarHBondContact O-CB 3.47Å; I945-Y949 PolarHBondContact O-N 3.23Å
950	L	68.6	Low	68.3	Low	21 Å²	21	68.2 Å²	68.2	11%	0.11	37%	0.371	C	S	.	.	I	π-helix	trans	-102.2	-24.3	-174.6	-54.3	178.6	0	0	0	114.2	V934 R946 V974	V934-L950 HydrophobicContact CB-CD1 4.19Å; V934-L950 HydrophobicContact CG1-CD1 3.84Å; V934-L950 HydrophobicContact CG2-CD1 4.43Å; R946-L950 VanDerWaalsContact O-CB 3.3Å; R946-L950 WeakPolarHBondContact O-CB 3.47Å; R946-L950 PolarHBondContact O-N 2.73Å; L950-V974 HydrophobicContact CB-CG1 3.84Å; L950-V974 HydrophobicContact CB-CG2 4.33Å; L950-V974 HydrophobicContact CD1-CG2 4.17Å
951	V	75.1	Confident	70.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.367	C	S	.	.	I	π-helix	trans	-107.3	-55.9	-179.5	-167	0	0	0	0	111.1	I947 G953 A954 V955 C963 L967 V978 L981	I947-V951 PolarHBondContact O-N 2.79Å; V951-G953 PolarHBondContact O-N 3.43Å; V951-A954 PolarHBondContact O-N 2.97Å; V951-V955 PolarHBondContact O-N 2.91Å; V951-C963 HydrophobicContact CB-CB 4.23Å; V951-C963 HydrophobicContact CG1-CB 4.02Å; V951-C963 VanDerWaalsContact CG1-SG 3.58Å; V951-L967 HydrophobicContact CG2-CD1 4.01Å; V951-L967 HydrophobicContact CG2-CD2 4.23Å; V951-L967 HydrophobicContact CG2-CG 4.21Å; V951-V978 HydrophobicContact CB-CG2 4.49Å; V951-V978 HydrophobicContact CG1-CG2 4.1Å; V951-L981 HydrophobicContact CG1-CD1 3.49Å; V951-L981 VanDerWaalsContact CG1-CD1 3.49Å
952	Q	79.3	Confident	71.8	Confident	54 Å²	54	67.3 Å²	67.3	25%	0.252	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.8	178	-62.3	-172.6	-66.9	0	0	113.6	I947 V955 V958 C963	I947-Q952 HydrophobicContact CG2-CG 4.44Å; I947-Q952 PolarHBondContact O-N 2.9Å; I947-Q952 VanDerWaalsContact O-N 3.09Å; Q952-V955 CarbonylContact C-O 3.29Å; Q952-V955 VanDerWaalsContact O-O 3.08Å; Q952-V958 HydrophobicContact CG-CG2 4.33Å; Q952-V958 PolarHBondContact NE2-O 2.71Å; Q952-C963 VanDerWaalsContact CG-SG 3.51Å
953	G	72.2	Confident	72.9	Confident	45 Å²	45	63.6 Å²	63.6	46%	0.464	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-25.5	170.6	0	0	0	0	0	114	V951 H956	V951-G953 PolarHBondContact O-N 3.43Å; G953-H956 PolarHBondContact O-CE1 3.08Å
954	A	76.1	Confident	74.2	Confident	46 Å²	46	64.3 Å²	64.3	38%	0.38	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-13.3	-174.9	0	0	0	0	0	114	V951 V978 K982	V951-A954 PolarHBondContact O-N 2.97Å; A954-V978 HydrophobicContact CB-CG1 3.9Å; A954-V978 HydrophobicContact CB-CG2 3.85Å; A954-K982 VanDerWaalsContact O-CE 3.26Å; A954-K982 WeakPolarHBondContact O-CE 3.49Å
955	V	80.1	Confident	75.5	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.018	33%	0.329	C	S	.	.	S	Bend	trans	-137.2	117.6	170.1	-166.3	0	0	0	0	107.4	V951 Q952 V958 V978 L981 K982 Q985	V951-V955 PolarHBondContact O-N 2.91Å; Q952-V955 CarbonylContact C-O 3.29Å; Q952-V955 VanDerWaalsContact O-O 3.08Å; V955-V958 HydrophobicContact CB-CG1 4.38Å; V955-V958 HydrophobicContact CB-CG2 4.21Å; V955-V958 HydrophobicContact CG1-CG1 3.83Å; V955-V958 WeakPolarHBondContact O-CG2 3.44Å; V955-V978 HydrophobicContact CG2-CB 4.35Å; V955-V978 HydrophobicContact CG2-CG1 3.86Å; V955-V978 HydrophobicContact CG2-CG2 4.49Å; V955-L981 HydrophobicContact CB-CB 4.5Å; V955-L981 HydrophobicContact CG1-CB 4.26Å; V955-L981 HydrophobicContact CG2-CB 4.1Å; V955-K982 HydrophobicContact CG1-CG 4.37Å; V955-K982 HydrophobicContact CG2-CG 3.88Å; V955-Q985 HydrophobicContact CG1-CG 4.43Å; V955-Q985 VanDerWaalsContact CG1-OE1 3.27Å
956	H	75.4	Confident	76.7	Confident	146 Å²	146	56.6 Å²	56.6	68%	0.676	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	142.3	-177.2	-64.2	-30.3	0	0	0	111.7	G953 Q985	G953-H956 PolarHBondContact O-CE1 3.08Å; H956-Q985 PolarHBondContact O-NE2 3.34Å; H956-Q985 PolarHBondContact O-OE1 3.09Å
957	G	77.3	Confident	77.8	Confident	79 Å²	79	54.1 Å²	54.1	81%	0.814	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	19.5	176.7	0	0	0	0	0	115.6
958	V	83.3	Confident	78.4	Confident	9 Å²	9	58.6 Å²	58.6	6%	0.055	33%	0.325	C	S	.	.			trans	-98.3	143.9	168.4	-65.4	0	0	0	0	111.3	Q952 V955 E962 C963 L981 Q985	Q952-V958 HydrophobicContact CG-CG2 4.33Å; Q952-V958 PolarHBondContact NE2-O 2.71Å; V955-V958 HydrophobicContact CB-CG1 4.38Å; V955-V958 HydrophobicContact CB-CG2 4.21Å; V955-V958 HydrophobicContact CG1-CG1 3.83Å; V955-V958 WeakPolarHBondContact O-CG2 3.44Å; V958-E962 VanDerWaalsContact CA-OE2 3.25Å; V958-E962 WeakPolarHBondContact CA-OE2 3.49Å; V958-C963 WeakPolarHBondContact CG2-SG 3.44Å; V958-L981 HydrophobicContact CG1-CB 4.37Å; V958-L981 HydrophobicContact CG1-CD2 4.16Å; V958-L981 HydrophobicContact CG2-CD1 4.39Å; V958-Q985 HydrophobicContact CG1-CG 4.42Å
959	T	85.6	Confident	79.5	Confident	62 Å²	62	56 Å²	56	38%	0.38	32%	0.323	S	S	.	.			trans	-77.7	165.3	-179.9	91.1	0	0	0	0	112.4	E961 E962 C963	T959-E961 WeakPolarHBondContact CB-OE2 3.25Å; T959-E961 PolarHBondContact O-N 3Å; T959-E961 PolarHBondContact OG1-N 2.63Å; T959-E961 PolarHBondContact OG1-OE2 3.19Å; T959-E962 HydrophobicContact CG2-CG 4.34Å; T959-E962 PolarHBondContact N-OE2 3.18Å; T959-E962 PolarHBondContact O-N 3.37Å; T959-E962 PolarHBondContact OG1-N 3.12Å; T959-C963 WeakPolarHBondContact O-CB 3.26Å; T959-C963 PolarHBondContact O-N 2.86Å; T959-C963 PolarHBondContact O-SG 3.5Å
960	T	81.4	Confident	80.9	Confident	64 Å²	64	51.1 Å²	51.1	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-32.7	173.6	25.4	0	0	0	0	112.3	I947 K964	I947-T960 HydrophobicContact CG2-CG2 3.94Å; T960-K964 WeakPolarHBondContact O-CB 3.32Å; T960-K964 PolarHBondContact O-N 2.98Å
961	E	81.8	Confident	81.8	Confident	118 Å²	118	57.1 Å²	57.1	55%	0.551	34%	0.338	S	S	*	.	H	α-helix	trans	-77.1	-43.2	-178.9	-56.2	62.1	-121	0	0	110.4	T959 C963 K964 A965	T959-E961 WeakPolarHBondContact CB-OE2 3.25Å; T959-E961 PolarHBondContact O-N 3Å; T959-E961 PolarHBondContact OG1-N 2.63Å; T959-E961 PolarHBondContact OG1-OE2 3.19Å; E961-C963 VanDerWaalsContact C-N 3.32Å; E961-C963 PolarHBondContact O-N 2.78Å; E961-K964 PolarHBondContact O-N 3.42Å; E961-A965 WeakPolarHBondContact O-CB 3.18Å; E961-A965 PolarHBondContact O-N 2.77Å
962	E	84.3	Confident	82	Confident	45 Å²	45	62 Å²	62	21%	0.21	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-43.8	172.6	-67.1	-178.3	134	0	0	111.1	V958 T959 A965 A966 L981 R988	V958-E962 VanDerWaalsContact CA-OE2 3.25Å; V958-E962 WeakPolarHBondContact CA-OE2 3.49Å; T959-E962 HydrophobicContact CG2-CG 4.34Å; T959-E962 PolarHBondContact N-OE2 3.18Å; T959-E962 PolarHBondContact O-N 3.37Å; T959-E962 PolarHBondContact OG1-N 3.12Å; E962-A965 PolarHBondContact O-N 2.71Å; E962-A966 VanDerWaalsContact O-CB 3.27Å; E962-A966 WeakPolarHBondContact O-CB 3.42Å; E962-A966 PolarHBondContact O-N 3.44Å; E962-L981 HydrophobicContact CB-CD2 4.2Å; E962-R988 IonicContact OE1-CZ 3.94Å; E962-R988 IonicContact OE1-NH1 2.75Å; E962-R988 PolarHBondContact OE1-NH1 3.37Å; E962-R988 IonicContact OE1-NH2 2.83Å; E962-R988 PolarHBondContact OE1-NH2 3.38Å
963	C	85.4	Confident	82	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-42.8	175.2	-67.1	0	0	0	0	112.4	I947 V951 Q952 V958 T959 E961 L967	I947-C963 HydrophobicContact CG1-CB 4.42Å; I947-C963 HydrophobicContact CG2-CB 3.67Å; V951-C963 HydrophobicContact CB-CB 4.23Å; V951-C963 HydrophobicContact CG1-CB 4.02Å; V951-C963 VanDerWaalsContact CG1-SG 3.58Å; Q952-C963 VanDerWaalsContact CG-SG 3.51Å; V958-C963 WeakPolarHBondContact CG2-SG 3.44Å; T959-C963 WeakPolarHBondContact O-CB 3.26Å; T959-C963 PolarHBondContact O-N 2.86Å; T959-C963 PolarHBondContact O-SG 3.5Å; E961-C963 VanDerWaalsContact C-N 3.32Å; E961-C963 PolarHBondContact O-N 2.78Å; C963-L967 WeakPolarHBondContact O-CB 3.24Å; C963-L967 VanDerWaalsContact O-CG 3.29Å; C963-L967 WeakPolarHBondContact O-CG 3.46Å; C963-L967 PolarHBondContact O-N 3.21Å
964	K	82.8	Confident	82.5	Confident	96 Å²	96	60.6 Å²	60.6	42%	0.417	34%	0.344	S	S	.	.	H	α-helix	trans	-63.7	-44.7	177.1	-172.2	178.6	179.7	-178.9	0	111.4	I947 T960 E961 L967 Q968	I947-K964 HydrophobicContact CD1-CB 4.08Å; I947-K964 HydrophobicContact CD1-CG 4.47Å; T960-K964 WeakPolarHBondContact O-CB 3.32Å; T960-K964 PolarHBondContact O-N 2.98Å; E961-K964 PolarHBondContact O-N 3.42Å; K964-L967 PolarHBondContact O-N 2.99Å; K964-Q968 WeakPolarHBondContact O-CB 3.26Å; K964-Q968 VanDerWaalsContact O-CG 3.26Å; K964-Q968 WeakPolarHBondContact O-CG 3.46Å; K964-Q968 PolarHBondContact O-N 3.16Å
965	A	85.3	Confident	82.9	Confident	53 Å²	53	62.4 Å²	62.4	44%	0.438	35%	0.352	S	S	.	.	H	α-helix	trans	-67	-40.7	177.5	0	0	0	0	0	112.7	E961 E962 Q968 S969	E961-A965 WeakPolarHBondContact O-CB 3.18Å; E961-A965 PolarHBondContact O-N 2.77Å; E962-A965 PolarHBondContact O-N 2.71Å; A965-Q968 PolarHBondContact O-N 2.97Å; A965-S969 WeakPolarHBondContact O-CB 3.25Å; A965-S969 PolarHBondContact O-N 3.12Å; A965-S969 PolarHBondContact O-OG 2.97Å
966	A	87	Confident	83.2	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.008	38%	0.375	C	S	.	.	H	α-helix	trans	-64	-41.4	174.9	0	0	0	0	0	111.5	E962 S969 H970 A977 F980 L981	E962-A966 VanDerWaalsContact O-CB 3.27Å; E962-A966 WeakPolarHBondContact O-CB 3.42Å; E962-A966 PolarHBondContact O-N 3.44Å; A966-S969 WeakPolarHBondContact CA-OG 3.24Å; A966-S969 PolarHBondContact O-OG 3.32Å; A966-S969 VanDerWaalsContact O-OG 3.08Å; A966-H970 PolarHBondContact O-N 3.48Å; A966-H970 PolarHBondContact O-ND1 2.88Å; A966-A977 HydrophobicContact CB-CB 3.92Å; A966-F980 HydrophobicContact CB-CD1 4.06Å; A966-L981 HydrophobicContact CB-CD1 3.83Å; A966-L981 HydrophobicContact CB-CD2 4.03Å; A966-L981 HydrophobicContact CB-CG 3.75Å
967	L	84.9	Confident	83.7	Confident	3 Å²	3	60.4 Å²	60.4	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-45.1	174.3	-74.9	167.8	0	0	0	112	I947 V951 C963 K964 S969 H970 N971 W972 V974 A977	I947-L967 HydrophobicContact CG1-CD1 3.86Å; V951-L967 HydrophobicContact CG2-CD1 4.01Å; V951-L967 HydrophobicContact CG2-CD2 4.23Å; V951-L967 HydrophobicContact CG2-CG 4.21Å; C963-L967 WeakPolarHBondContact O-CB 3.24Å; C963-L967 VanDerWaalsContact O-CG 3.29Å; C963-L967 WeakPolarHBondContact O-CG 3.46Å; C963-L967 PolarHBondContact O-N 3.21Å; K964-L967 PolarHBondContact O-N 2.99Å; L967-S969 PolarHBondContact O-N 2.94Å; L967-H970 CarbonylContact O-C 3.48Å; L967-H970 PolarHBondContact O-N 3.02Å; L967-N971 PolarHBondContact O-N 3.1Å; L967-W972 HydrophobicContact CB-CD2 4.35Å; L967-W972 HydrophobicContact CB-CE3 3.58Å; L967-W972 HydrophobicContact CB-CZ3 3.78Å; L967-W972 HydrophobicContact CD1-CE3 4.12Å; L967-W972 HydrophobicContact CD1-CZ3 4.11Å; L967-W972 HydrophobicContact CG-CE3 4.33Å; L967-W972 WeakPolarHBondContact O-CA 3.35Å; L967-W972 PolarHBondContact O-N 2.96Å; L967-V974 HydrophobicContact CD2-CG2 3.97Å; L967-A977 HydrophobicContact CD2-CB 3.75Å; L967-A977 HydrophobicContact CG-CB 3.99Å
968	Q	82.5	Confident	84.3	Confident	106 Å²	106	57.2 Å²	57.2	50%	0.495	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-41.7	179.2	-77.1	174.1	-40.9	0	0	112.5	K964 A965 H970 W972	K964-Q968 WeakPolarHBondContact O-CB 3.26Å; K964-Q968 VanDerWaalsContact O-CG 3.26Å; K964-Q968 WeakPolarHBondContact O-CG 3.46Å; K964-Q968 PolarHBondContact O-N 3.16Å; A965-Q968 PolarHBondContact O-N 2.97Å; Q968-H970 VanDerWaalsContact C-N 3.28Å; Q968-H970 PolarHBondContact O-N 3.36Å; Q968-W972 HydrophobicContact CG-CH2 3.67Å; Q968-W972 HydrophobicContact CG-CZ2 3.48Å; Q968-W972 VanDerWaalsContact CG-CZ2 3.48Å
969	S	84.5	Confident	84.7	Confident	74 Å²	74	58.9 Å²	58.9	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-70	-20.7	177.9	48.2	0	0	0	0	114.1	A965 A966 L967	A965-S969 WeakPolarHBondContact O-CB 3.25Å; A965-S969 PolarHBondContact O-N 3.12Å; A965-S969 PolarHBondContact O-OG 2.97Å; A966-S969 WeakPolarHBondContact CA-OG 3.24Å; A966-S969 PolarHBondContact O-OG 3.32Å; A966-S969 VanDerWaalsContact O-OG 3.08Å; L967-S969 PolarHBondContact O-N 2.94Å
970	H	86.9	Confident	85	Confident	48 Å²	48	58.9 Å²	58.9	22%	0.222	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	36.5	-178.3	-59.5	79.2	0	0	0	112.5	A966 L967 Q968 W972 S973 Q976 F980	A966-H970 PolarHBondContact O-N 3.48Å; A966-H970 PolarHBondContact O-ND1 2.88Å; L967-H970 CarbonylContact O-C 3.48Å; L967-H970 PolarHBondContact O-N 3.02Å; Q968-H970 VanDerWaalsContact C-N 3.28Å; Q968-H970 PolarHBondContact O-N 3.36Å; H970-W972 PolarHBondContact O-N 3.24Å; H970-W972 VanDerWaalsContact O-N 3.11Å; H970-S973 WeakPolarHBondContact O-CB 3.39Å; H970-S973 PolarHBondContact O-N 3.15Å; H970-Q976 HydrophobicContact CB-CB 3.85Å; H970-F980 AromaticContact CE1-CD2 3.36Å; H970-F980 WeakPolarHBondContact CE1-CD2 3.45Å; H970-F980 AromaticContact CE1-CE2 3.96Å; H970-F980 AromaticContact CE1-CG 3.47Å; H970-F980 VanDerWaalsContact CE1-CG 3.47Å; H970-F980 WeakPolarHBondContact CE1-CG 3.33Å; H970-F980 AromaticContact NE2-CD2 3.69Å
971	N	85.8	Confident	85.6	Confident	148 Å²	148	56.1 Å²	56.1	79%	0.791	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	36.4	174.8	-64.8	-30	0	0	0	114.6	L967 S973	L967-N971 PolarHBondContact O-N 3.1Å; N971-S973 PolarHBondContact O-N 2.89Å
972	W	79.6	Confident	86.1	Confident	103 Å²	103	52.1 Å²	52.1	39%	0.39	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	16.8	-174.8	-57	93.7	0	0	0	115.5	L943 L967 Q968 H970 V974	L943-W972 HydrophobicContact CD1-CE3 4.13Å; L943-W972 HydrophobicContact CD1-CH2 3.8Å; L943-W972 HydrophobicContact CD1-CZ3 3.58Å; L943-W972 HydrophobicContact CD2-CH2 4Å; L943-W972 HydrophobicContact CD2-CZ3 4.31Å; L943-W972 HydrophobicContact CG-CH2 4.27Å; L943-W972 HydrophobicContact CG-CZ3 4.1Å; L967-W972 HydrophobicContact CB-CD2 4.35Å; L967-W972 HydrophobicContact CB-CE3 3.58Å; L967-W972 HydrophobicContact CB-CZ3 3.78Å; L967-W972 HydrophobicContact CD1-CE3 4.12Å; L967-W972 HydrophobicContact CD1-CZ3 4.11Å; L967-W972 HydrophobicContact CG-CE3 4.33Å; L967-W972 WeakPolarHBondContact O-CA 3.35Å; L967-W972 PolarHBondContact O-N 2.96Å; Q968-W972 HydrophobicContact CG-CH2 3.67Å; Q968-W972 HydrophobicContact CG-CZ2 3.48Å; Q968-W972 VanDerWaalsContact CG-CZ2 3.48Å; H970-W972 PolarHBondContact O-N 3.24Å; H970-W972 VanDerWaalsContact O-N 3.11Å; W972-V974 PolarHBondContact O-N 2.89Å; W972-V974 VanDerWaalsContact O-N 3.15Å
973	S	80.4	Confident	86.5	Confident	36 Å²	36	50.3 Å²	50.3	25%	0.252	27%	0.266	S	S	.	.			trans	-73.9	99.3	175.1	-175.5	0	0	0	0	111.1	H970 N971 Q976 A977	H970-S973 WeakPolarHBondContact O-CB 3.39Å; H970-S973 PolarHBondContact O-N 3.15Å; N971-S973 PolarHBondContact O-N 2.89Å; S973-Q976 PolarHBondContact O-N 3.37Å; S973-Q976 VanDerWaalsContact O-N 3.17Å; S973-Q976 PolarHBondContact OG-OE1 2.97Å; S973-A977 PolarHBondContact O-N 3.42Å
974	V	81.7	Confident	86.8	Confident	32 Å²	32	51.9 Å²	51.9	19%	0.194	27%	0.274	C	S	.	.	H	α-helix	trans	-50.1	-47.7	178.6	168.9	0	0	0	0	113	L950 L967 W972 Q976 A977 V978	L950-V974 HydrophobicContact CB-CG1 3.84Å; L950-V974 HydrophobicContact CB-CG2 4.33Å; L950-V974 HydrophobicContact CD1-CG2 4.17Å; L967-V974 HydrophobicContact CD2-CG2 3.97Å; W972-V974 PolarHBondContact O-N 2.89Å; W972-V974 VanDerWaalsContact O-N 3.15Å; V974-Q976 VanDerWaalsContact C-N 3.34Å; V974-Q976 PolarHBondContact O-N 2.92Å; V974-A977 PolarHBondContact O-N 3.4Å; V974-V978 HydrophobicContact CG1-CG2 4.4Å; V974-V978 WeakPolarHBondContact O-CB 3.26Å; V974-V978 WeakPolarHBondContact O-CG2 3.38Å; V974-V978 PolarHBondContact O-N 3.17Å
975	P	85.1	Confident	87.1	Confident	85 Å²	85	49.5 Å²	49.5	55%	0.552	26%	0.264	S	S	*	.	H	α-helix	trans	-64	-37.5	-179.3	-22.1	34.7	0	0	0	113.1	N979	P975-N979 WeakPolarHBondContact O-CB 3.29Å; P975-N979 VanDerWaalsContact O-CG 3.23Å; P975-N979 PolarHBondContact O-N 3.43Å; P975-N979 PolarHBondContact O-OD1 2.95Å
976	Q	85.2	Confident	87.1	Confident	106 Å²	106	47 Å²	47	50%	0.495	24%	0.243	S	C	.	.	H	α-helix	trans	-72	-40.2	178.8	-71.3	172.1	-39.8	0	0	111.4	H970 S973 V974 N979 F980	H970-Q976 HydrophobicContact CB-CB 3.85Å; S973-Q976 PolarHBondContact O-N 3.37Å; S973-Q976 VanDerWaalsContact O-N 3.17Å; S973-Q976 PolarHBondContact OG-OE1 2.97Å; V974-Q976 VanDerWaalsContact C-N 3.34Å; V974-Q976 PolarHBondContact O-N 2.92Å; Q976-N979 PolarHBondContact O-N 2.86Å; Q976-F980 WeakPolarHBondContact O-CB 3.4Å; Q976-F980 PolarHBondContact O-N 3.24Å
977	A	87.3	Confident	87.2	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-43	174.3	0	0	0	0	0	112.5	A966 L967 S973 V974 F980 L981	A966-A977 HydrophobicContact CB-CB 3.92Å; L967-A977 HydrophobicContact CD2-CB 3.75Å; L967-A977 HydrophobicContact CG-CB 3.99Å; S973-A977 PolarHBondContact O-N 3.42Å; V974-A977 PolarHBondContact O-N 3.4Å; A977-F980 PolarHBondContact O-N 3.47Å; A977-L981 WeakPolarHBondContact O-CB 3.35Å; A977-L981 VanDerWaalsContact O-CG 3.28Å; A977-L981 WeakPolarHBondContact O-CG 3.46Å; A977-L981 PolarHBondContact O-N 2.96Å
978	V	89.9	Confident	87.3	Confident	13 Å²	13	58 Å²	58	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-61.4	-45.6	174.3	164.6	0	0	0	0	111.3	V951 A954 V955 V974 L981 K982	V951-V978 HydrophobicContact CB-CG2 4.49Å; V951-V978 HydrophobicContact CG1-CG2 4.1Å; A954-V978 HydrophobicContact CB-CG1 3.9Å; A954-V978 HydrophobicContact CB-CG2 3.85Å; V955-V978 HydrophobicContact CG2-CB 4.35Å; V955-V978 HydrophobicContact CG2-CG1 3.86Å; V955-V978 HydrophobicContact CG2-CG2 4.49Å; V974-V978 HydrophobicContact CG1-CG2 4.4Å; V974-V978 WeakPolarHBondContact O-CB 3.26Å; V974-V978 WeakPolarHBondContact O-CG2 3.38Å; V974-V978 PolarHBondContact O-N 3.17Å; V978-L981 PolarHBondContact O-N 2.88Å; V978-K982 HydrophobicContact CG1-CD 4.37Å; V978-K982 WeakPolarHBondContact O-CG 3.46Å; V978-K982 PolarHBondContact O-N 3Å
979	N	92.3	Very high	87.3	Confident	43 Å²	43	57 Å²	57	23%	0.23	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-46.4	178.1	-77.6	6.9	0	0	0	112	P975 Q976 L981 K982 V983 W1006	P975-N979 WeakPolarHBondContact O-CB 3.29Å; P975-N979 VanDerWaalsContact O-CG 3.23Å; P975-N979 PolarHBondContact O-N 3.43Å; P975-N979 PolarHBondContact O-OD1 2.95Å; Q976-N979 PolarHBondContact O-N 2.86Å; N979-L981 VanDerWaalsContact C-N 3.34Å; N979-L981 PolarHBondContact O-N 3.49Å; N979-K982 PolarHBondContact O-N 3.03Å; N979-V983 WeakPolarHBondContact O-CG2 3.27Å; N979-V983 PolarHBondContact O-N 3.01Å; N979-W1006 HydrophobicContact CB-CD2 4.23Å; N979-W1006 HydrophobicContact CB-CE3 3.72Å; N979-W1006 HydrophobicContact CB-CH2 3.69Å; N979-W1006 HydrophobicContact CB-CZ2 4.19Å; N979-W1006 HydrophobicContact CB-CZ3 3.44Å; N979-W1006 VanDerWaalsContact CB-CZ3 3.44Å; N979-W1006 VanDerWaalsContact CG-CD2 3.49Å; N979-W1006 VanDerWaalsContact CG-CE3 3.47Å; N979-W1006 VanDerWaalsContact ND2-CE2 3.26Å; N979-W1006 WeakPolarHBondContact ND2-CZ2 3.28Å; N979-W1006 WeakPolarHBondContact O-CZ3 3.38Å
980	F	91.9	Very high	87.3	Confident	62 Å²	62	56.5 Å²	56.5	27%	0.272	29%	0.291	S	S	.	.	H	α-helix	trans	-56.6	-44.9	175.4	176.6	-90.8	0	0	0	112.3	A966 H970 Q976 A977 K982 V983 E984	A966-F980 HydrophobicContact CB-CD1 4.06Å; H970-F980 AromaticContact CE1-CD2 3.36Å; H970-F980 WeakPolarHBondContact CE1-CD2 3.45Å; H970-F980 AromaticContact CE1-CE2 3.96Å; H970-F980 AromaticContact CE1-CG 3.47Å; H970-F980 VanDerWaalsContact CE1-CG 3.47Å; H970-F980 WeakPolarHBondContact CE1-CG 3.33Å; H970-F980 AromaticContact NE2-CD2 3.69Å; Q976-F980 WeakPolarHBondContact O-CB 3.4Å; Q976-F980 PolarHBondContact O-N 3.24Å; A977-F980 PolarHBondContact O-N 3.47Å; F980-K982 PolarHBondContact O-N 3.4Å; F980-V983 PolarHBondContact O-N 3.28Å; F980-E984 HydrophobicContact CD1-CG 4.36Å; F980-E984 HydrophobicContact CE1-CG 3.98Å; F980-E984 HydrophobicContact CZ-CG 4.26Å; F980-E984 PolarHBondContact O-N 3.04Å
981	L	92.3	Very high	87.1	Confident	6 Å²	6	56.8 Å²	56.8	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-67.4	-33.8	178.3	-71.8	168.9	0	0	0	112.7	V951 V955 V958 E962 A966 A977 V978 N979 E984 Q985	V951-L981 HydrophobicContact CG1-CD1 3.49Å; V951-L981 VanDerWaalsContact CG1-CD1 3.49Å; V955-L981 HydrophobicContact CB-CB 4.5Å; V955-L981 HydrophobicContact CG1-CB 4.26Å; V955-L981 HydrophobicContact CG2-CB 4.1Å; V958-L981 HydrophobicContact CG1-CB 4.37Å; V958-L981 HydrophobicContact CG1-CD2 4.16Å; V958-L981 HydrophobicContact CG2-CD1 4.39Å; E962-L981 HydrophobicContact CB-CD2 4.2Å; A966-L981 HydrophobicContact CB-CD1 3.83Å; A966-L981 HydrophobicContact CB-CD2 4.03Å; A966-L981 HydrophobicContact CB-CG 3.75Å; A977-L981 WeakPolarHBondContact O-CB 3.35Å; A977-L981 VanDerWaalsContact O-CG 3.28Å; A977-L981 WeakPolarHBondContact O-CG 3.46Å; A977-L981 PolarHBondContact O-N 2.96Å; V978-L981 PolarHBondContact O-N 2.88Å; N979-L981 VanDerWaalsContact C-N 3.34Å; N979-L981 PolarHBondContact O-N 3.49Å; L981-E984 PolarHBondContact O-N 2.88Å; L981-Q985 PolarHBondContact O-N 3.35Å
982	K	93	Very high	87	Confident	35 Å²	35	54.1 Å²	54.1	15%	0.152	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-43.3	171.4	-74.1	178.5	174.1	-176.6	0	112	A954 V955 V978 N979 F980 E984 Q985 L986 L1001 W1006 L1008	A954-K982 VanDerWaalsContact O-CE 3.26Å; A954-K982 WeakPolarHBondContact O-CE 3.49Å; V955-K982 HydrophobicContact CG1-CG 4.37Å; V955-K982 HydrophobicContact CG2-CG 3.88Å; V978-K982 HydrophobicContact CG1-CD 4.37Å; V978-K982 WeakPolarHBondContact O-CG 3.46Å; V978-K982 PolarHBondContact O-N 3Å; N979-K982 PolarHBondContact O-N 3.03Å; F980-K982 PolarHBondContact O-N 3.4Å; K982-E984 VanDerWaalsContact C-N 3.3Å; K982-E984 PolarHBondContact O-N 3.02Å; K982-Q985 PolarHBondContact O-N 3.12Å; K982-L986 PolarHBondContact O-N 3.11Å; K982-L986 VanDerWaalsContact O-N 3.11Å; K982-L1001 HydrophobicContact CB-CD1 3.96Å; K982-L1001 HydrophobicContact CB-CD2 4.33Å; K982-W1006 WeakPolarHBondContact CD-O 3.47Å; K982-W1006 PolarHBondContact NZ-O 2.74Å; K982-L1008 HydrophobicContact CB-CD1 4.2Å; K982-L1008 HydrophobicContact CG-CD1 4.44Å
983	V	92.6	Very high	87.5	Confident	6 Å²	6	51.8 Å²	51.8	4%	0.036	27%	0.273	C	S	.	.	H	α-helix	trans	-59.8	-43	173.3	179	0	0	0	0	110.4	N979 F980 L986 F987 R994 C997 E998 L1001 W1006	N979-V983 WeakPolarHBondContact O-CG2 3.27Å; N979-V983 PolarHBondContact O-N 3.01Å; F980-V983 PolarHBondContact O-N 3.28Å; V983-L986 PolarHBondContact O-N 3.48Å; V983-F987 VanDerWaalsContact O-CB 3.24Å; V983-F987 WeakPolarHBondContact O-CB 3.48Å; V983-F987 PolarHBondContact O-N 3.18Å; V983-R994 HydrophobicContact CG1-CG 3.65Å; V983-R994 WeakPolarHBondContact CG1-O 3.34Å; V983-C997 HydrophobicContact CG1-CB 4.16Å; V983-E998 HydrophobicContact CG1-CB 4.39Å; V983-E998 HydrophobicContact CG2-CB 3.86Å; V983-E998 HydrophobicContact CG2-CG 4.09Å; V983-L1001 HydrophobicContact CB-CD1 4.42Å; V983-L1001 HydrophobicContact CG2-CD1 3.91Å; V983-W1006 HydrophobicContact CG2-CH2 4.25Å; V983-W1006 HydrophobicContact CG2-CZ3 3.84Å
984	E	91.5	Very high	87.9	Confident	34 Å²	34	54.4 Å²	54.4	16%	0.159	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-39.2	179.1	-75.3	-71.5	54.7	0	0	113.8	F980 L981 K982 L986 F987 R988 R994	F980-E984 HydrophobicContact CD1-CG 4.36Å; F980-E984 HydrophobicContact CE1-CG 3.98Å; F980-E984 HydrophobicContact CZ-CG 4.26Å; F980-E984 PolarHBondContact O-N 3.04Å; L981-E984 PolarHBondContact O-N 2.88Å; K982-E984 VanDerWaalsContact C-N 3.3Å; K982-E984 PolarHBondContact O-N 3.02Å; E984-L986 VanDerWaalsContact C-N 3.31Å; E984-L986 PolarHBondContact O-N 3.49Å; E984-F987 PolarHBondContact O-N 2.95Å; E984-F987 WeakPolarHBondContact OE1-CD1 3.48Å; E984-R988 VanDerWaalsContact O-CB 3.32Å; E984-R988 WeakPolarHBondContact O-CB 3.34Å; E984-R988 WeakPolarHBondContact O-CD 3.15Å; E984-R988 WeakPolarHBondContact O-CG 3.45Å; E984-R988 PolarHBondContact O-N 3.35Å; E984-R994 IonicContact OE1-CZ 3.16Å; E984-R994 VanDerWaalsContact OE1-CZ 3.24Å; E984-R994 IonicContact OE1-NH1 4Å; E984-R994 PolarHBondContact OE1-NH1 3.4Å; E984-R994 IonicContact OE1-NH2 3.98Å; E984-R994 PolarHBondContact OE1-NH2 2.7Å; E984-R994 IonicContact OE2-CZ 2.66Å; E984-R994 VanDerWaalsContact OE2-CZ 3.3Å; E984-R994 IonicContact OE2-NH1 3.2Å; E984-R994 PolarHBondContact OE2-NH1 3.4Å; E984-R994 IonicContact OE2-NH2 2.83Å; E984-R994 PolarHBondContact OE2-NH2 2.73Å
985	Q	89.2	Confident	88.3	Confident	46 Å²	46	56.2 Å²	56.2	22%	0.215	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-35.1	175.2	-74.5	-165.8	-26.2	0	0	112.3	V955 H956 V958 L981 K982 L1008	V955-Q985 HydrophobicContact CG1-CG 4.43Å; V955-Q985 VanDerWaalsContact CG1-OE1 3.27Å; H956-Q985 PolarHBondContact O-NE2 3.34Å; H956-Q985 PolarHBondContact O-OE1 3.09Å; V958-Q985 HydrophobicContact CG1-CG 4.42Å; L981-Q985 PolarHBondContact O-N 3.35Å; K982-Q985 PolarHBondContact O-N 3.12Å; Q985-L1008 HydrophobicContact CB-CD2 4.36Å
986	L	86.3	Confident	88.4	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-69.5	-46.2	172.7	-137.7	89.4	0	0	0	111.5	K982 V983 E984 R988 L989 C997 L1000 L1001 L1008 A1011 M1015	K982-L986 PolarHBondContact O-N 3.11Å; K982-L986 VanDerWaalsContact O-N 3.11Å; V983-L986 PolarHBondContact O-N 3.48Å; E984-L986 VanDerWaalsContact C-N 3.31Å; E984-L986 PolarHBondContact O-N 3.49Å; L986-R988 VanDerWaalsContact C-N 3.33Å; L986-R988 PolarHBondContact O-N 3.47Å; L986-L989 WeakPolarHBondContact O-CB 3.5Å; L986-L989 PolarHBondContact O-N 2.85Å; L986-L989 VanDerWaalsContact O-N 3.13Å; L986-C997 HydrophobicContact CB-CB 4.05Å; L986-C997 HydrophobicContact CD2-CB 3.79Å; L986-L1000 HydrophobicContact CD2-CD2 4.11Å; L986-L1001 HydrophobicContact CB-CD1 4.48Å; L986-L1008 HydrophobicContact CD1-CD1 3.7Å; L986-A1011 HydrophobicContact CD1-CB 4.04Å; L986-M1015 HydrophobicContact CD2-CE 4.2Å; L986-M1015 HydrophobicContact CD2-SD 3.82Å; L986-M1015 HydrophobicContact CG-CE 3.77Å; L986-M1015 HydrophobicContact CG-SD 4.09Å
987	F	89.4	Confident	88.7	Confident	81 Å²	81	50.5 Å²	50.5	36%	0.355	26%	0.261	S	S	.	.	H	α-helix	trans	-64.4	-34.5	-178.7	178.7	-116	0	0	0	112.7	V983 E984 L989 G990 R992 R994	V983-F987 VanDerWaalsContact O-CB 3.24Å; V983-F987 WeakPolarHBondContact O-CB 3.48Å; V983-F987 PolarHBondContact O-N 3.18Å; E984-F987 PolarHBondContact O-N 2.95Å; E984-F987 WeakPolarHBondContact OE1-CD1 3.48Å; F987-L989 PolarHBondContact O-N 3.34Å; F987-L989 VanDerWaalsContact O-N 3.11Å; F987-G990 PolarHBondContact O-N 2.92Å; F987-R992 WeakPolarHBondContact CD2-O 3.32Å; F987-R994 HydrophobicContact CD2-CB 4.09Å; F987-R994 HydrophobicContact CE2-CB 4.33Å; F987-R994 HydrophobicContact CG-CB 4.37Å; F987-R994 HydrophobicContact CG-CG 4.49Å
988	R	86.8	Confident	88.8	Confident	152 Å²	152	54.2 Å²	54.2	57%	0.574	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-15.1	173.9	-78.3	169.6	-173.2	-167.5	1.8	114.3	E962 E984 L986 G990	E962-R988 IonicContact OE1-CZ 3.94Å; E962-R988 IonicContact OE1-NH1 2.75Å; E962-R988 PolarHBondContact OE1-NH1 3.37Å; E962-R988 IonicContact OE1-NH2 2.83Å; E962-R988 PolarHBondContact OE1-NH2 3.38Å; E984-R988 VanDerWaalsContact O-CB 3.32Å; E984-R988 WeakPolarHBondContact O-CB 3.34Å; E984-R988 WeakPolarHBondContact O-CD 3.15Å; E984-R988 WeakPolarHBondContact O-CG 3.45Å; E984-R988 PolarHBondContact O-N 3.35Å; L986-R988 VanDerWaalsContact C-N 3.33Å; L986-R988 PolarHBondContact O-N 3.47Å; R988-G990 VanDerWaalsContact C-N 3.28Å
989	L	82.5	Confident	88.8	Confident	85 Å²	85	58.1 Å²	58.1	45%	0.445	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-13.3	171.4	-61.3	170.4	0	0	0	112.8	L986 F987 L991 M1015	L986-L989 WeakPolarHBondContact O-CB 3.5Å; L986-L989 PolarHBondContact O-N 2.85Å; L986-L989 VanDerWaalsContact O-N 3.13Å; F987-L989 PolarHBondContact O-N 3.34Å; F987-L989 VanDerWaalsContact O-N 3.11Å; L989-L991 HydrophobicContact CB-CG 4.47Å; L989-L991 PolarHBondContact O-N 3.19Å; L989-M1015 HydrophobicContact CB-CE 3.8Å; L989-M1015 HydrophobicContact CD1-CE 3.49Å; L989-M1015 VanDerWaalsContact CD1-CE 3.49Å; L989-M1015 HydrophobicContact CG-CE 4.24Å
990	G	83.4	Confident	88.7	Confident	65 Å²	65	57.4 Å²	57.4	67%	0.67	29%	0.292	S	S	*	.	S	Bend	trans	71.4	4.7	172.9	0	0	0	0	0	116.1	F987 R988	F987-G990 PolarHBondContact O-N 2.92Å; R988-G990 VanDerWaalsContact C-N 3.28Å
991	L	82.1	Confident	88.6	Confident	53 Å²	53	54.5 Å²	54.5	28%	0.277	28%	0.279	S	S	.	.	S	Bend	trans	-84.7	-17.5	-174.9	-57.3	-176.7	0	0	0	114.2	L989 M1015 L1016 Y1019	L989-L991 HydrophobicContact CB-CG 4.47Å; L989-L991 PolarHBondContact O-N 3.19Å; L991-M1015 HydrophobicContact CB-CE 4.19Å; L991-M1015 HydrophobicContact CB-CG 4.17Å; L991-M1015 HydrophobicContact CB-SD 4.15Å; L991-M1015 HydrophobicContact CD1-CE 4.26Å; L991-M1015 HydrophobicContact CD1-CG 4.32Å; L991-M1015 HydrophobicContact CG-CE 4.49Å; L991-L1016 HydrophobicContact CD1-CD2 3.85Å; L991-Y1019 HydrophobicContact CB-CE2 4.32Å; L991-Y1019 HydrophobicContact CD1-CD2 4.34Å; L991-Y1019 PolarHBondContact O-OH 2.83Å
992	R	84.3	Confident	88.5	Confident	92 Å²	92	59 Å²	59	35%	0.347	30%	0.3	S	S	.	.	S	Bend	trans	-147.8	156.8	-172.8	-71.5	-66.9	164.4	-178.7	-6.2	110.9	F987 E996 M1015 Y1019	F987-R992 WeakPolarHBondContact CD2-O 3.32Å; R992-E996 HydrophobicContact CB-CB 4Å; R992-E996 WeakPolarHBondContact CD-OE1 3.49Å; R992-E996 HydrophobicContact CG-CB 4.4Å; R992-E996 IonicContact CZ-OE1 3.67Å; R992-E996 IonicContact NE-OE1 3.8Å; R992-E996 IonicContact NH1-OE1 2.74Å; R992-E996 PolarHBondContact NH1-OE1 3.11Å; R992-M1015 HydrophobicContact CB-SD 3.85Å; R992-M1015 HydrophobicContact CG-CG 3.89Å; R992-M1015 HydrophobicContact CG-SD 3.53Å; R992-M1015 VanDerWaalsContact CG-SD 3.53Å; R992-Y1019 PolarHBondContact NH2-OH 2.74Å
993	S	90.6	Very high	88.4	Confident	55 Å²	55	65.2 Å²	65.2	39%	0.385	32%	0.323	S	S	.	.			trans	-68.2	158.2	169.4	67.7	0	0	0	0	111.5	A995 E996 C997	S993-A995 PolarHBondContact O-N 2.89Å; S993-E996 VanDerWaalsContact CB-OE2 3.25Å; S993-E996 WeakPolarHBondContact CB-OE2 3.33Å; S993-E996 PolarHBondContact N-OE2 3.32Å; S993-E996 PolarHBondContact O-N 3.38Å; S993-E996 VanDerWaalsContact O-N 3.16Å; S993-E996 WeakPolarHBondContact OG-CG 3.45Å; S993-E996 PolarHBondContact OG-N 3.48Å; S993-E996 PolarHBondContact OG-OE2 3.39Å; S993-C997 PolarHBondContact O-N 3.45Å; S993-C997 PolarHBondContact O-SG 3.29Å
994	R	88.4	Confident	88.3	Confident	90 Å²	90	67.3 Å²	67.3	34%	0.34	33%	0.332	S	S	.	.	H	α-helix	trans	-55.2	-36.1	179.5	-160.5	-174.1	-166.5	97.7	-4.7	112.8	V983 E984 F987 C997 E998	V983-R994 HydrophobicContact CG1-CG 3.65Å; V983-R994 WeakPolarHBondContact CG1-O 3.34Å; E984-R994 IonicContact OE1-CZ 3.16Å; E984-R994 VanDerWaalsContact OE1-CZ 3.24Å; E984-R994 IonicContact OE1-NH1 4Å; E984-R994 PolarHBondContact OE1-NH1 3.4Å; E984-R994 IonicContact OE1-NH2 3.98Å; E984-R994 PolarHBondContact OE1-NH2 2.7Å; E984-R994 IonicContact OE2-CZ 2.66Å; E984-R994 VanDerWaalsContact OE2-CZ 3.3Å; E984-R994 IonicContact OE2-NH1 3.2Å; E984-R994 PolarHBondContact OE2-NH1 3.4Å; E984-R994 IonicContact OE2-NH2 2.83Å; E984-R994 PolarHBondContact OE2-NH2 2.73Å; F987-R994 HydrophobicContact CD2-CB 4.09Å; F987-R994 HydrophobicContact CE2-CB 4.33Å; F987-R994 HydrophobicContact CG-CB 4.37Å; F987-R994 HydrophobicContact CG-CG 4.49Å; R994-C997 WeakPolarHBondContact O-CB 3.48Å; R994-E998 PolarHBondContact O-N 3.02Å; R994-E998 VanDerWaalsContact O-N 3.07Å
995	A	89.5	Confident	88.2	Confident	70 Å²	70	76.7 Å²	76.7	58%	0.579	37%	0.366	S	S	*	.	H	α-helix	trans	-72.6	-41.6	178.1	0	0	0	0	0	112.9	S993 C997 E998 E999	S993-A995 PolarHBondContact O-N 2.89Å; A995-C997 VanDerWaalsContact C-N 3.32Å; A995-E998 PolarHBondContact O-N 3.05Å; A995-E999 PolarHBondContact O-N 3.02Å
996	E	87.9	Confident	88.2	Confident	72 Å²	72	77 Å²	77	34%	0.336	37%	0.365	S	S	.	.	H	α-helix	trans	-63.8	-38.2	172.3	-72.1	166	102.1	0	0	111.6	R992 S993 E998 E999 L1000	R992-E996 HydrophobicContact CB-CB 4Å; R992-E996 WeakPolarHBondContact CD-OE1 3.49Å; R992-E996 HydrophobicContact CG-CB 4.4Å; R992-E996 IonicContact CZ-OE1 3.67Å; R992-E996 IonicContact NE-OE1 3.8Å; R992-E996 IonicContact NH1-OE1 2.74Å; R992-E996 PolarHBondContact NH1-OE1 3.11Å; S993-E996 VanDerWaalsContact CB-OE2 3.25Å; S993-E996 WeakPolarHBondContact CB-OE2 3.33Å; S993-E996 PolarHBondContact N-OE2 3.32Å; S993-E996 PolarHBondContact O-N 3.38Å; S993-E996 VanDerWaalsContact O-N 3.16Å; S993-E996 WeakPolarHBondContact OG-CG 3.45Å; S993-E996 PolarHBondContact OG-N 3.48Å; S993-E996 PolarHBondContact OG-OE2 3.39Å; E996-E998 VanDerWaalsContact C-N 3.33Å; E996-E999 PolarHBondContact O-N 3.33Å; E996-L1000 WeakPolarHBondContact O-CB 3.39Å; E996-L1000 PolarHBondContact O-N 3.17Å
997	C	90.5	Very high	88.2	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-61.1	-43.3	175	-67.1	0	0	0	0	111.6	V983 L986 S993 R994 A995 L1001	V983-C997 HydrophobicContact CG1-CB 4.16Å; L986-C997 HydrophobicContact CB-CB 4.05Å; L986-C997 HydrophobicContact CD2-CB 3.79Å; S993-C997 PolarHBondContact O-N 3.45Å; S993-C997 PolarHBondContact O-SG 3.29Å; R994-C997 WeakPolarHBondContact O-CB 3.48Å; A995-C997 VanDerWaalsContact C-N 3.32Å; C997-L1001 WeakPolarHBondContact O-CB 3.21Å; C997-L1001 WeakPolarHBondContact O-CG 3.35Å; C997-L1001 PolarHBondContact O-N 3.4Å
998	E	90.9	Very high	88.1	Confident	78 Å²	78	77.5 Å²	77.5	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-66.4	-46.3	175.9	-174.9	172.3	-179.8	0	0	112	V983 R994 A995 E996 L1000 L1001 Q1002 W1006	V983-E998 HydrophobicContact CG1-CB 4.39Å; V983-E998 HydrophobicContact CG2-CB 3.86Å; V983-E998 HydrophobicContact CG2-CG 4.09Å; R994-E998 PolarHBondContact O-N 3.02Å; R994-E998 VanDerWaalsContact O-N 3.07Å; A995-E998 PolarHBondContact O-N 3.05Å; E996-E998 VanDerWaalsContact C-N 3.33Å; E998-L1000 VanDerWaalsContact C-N 3.3Å; E998-L1000 PolarHBondContact O-N 3.13Å; E998-L1001 PolarHBondContact O-N 3.11Å; E998-Q1002 HydrophobicContact CG-CG 4.34Å; E998-Q1002 WeakPolarHBondContact O-CG 3.06Å; E998-Q1002 PolarHBondContact O-N 3.13Å; E998-Q1002 PolarHBondContact OE1-NE2 3.4Å; E998-W1006 HydrophobicContact CG-CH2 3.88Å
999	E	90	Very high	88	Confident	95 Å²	95	76.9 Å²	76.9	44%	0.444	38%	0.375	S	S	.	.	H	α-helix	trans	-60.9	-40.4	177.6	-161.6	-165.1	-179.4	0	0	111.6	A995 E996 Q1002 R1003	A995-E999 PolarHBondContact O-N 3.02Å; E996-E999 PolarHBondContact O-N 3.33Å; E999-Q1002 PolarHBondContact O-N 3.11Å; E999-R1003 WeakPolarHBondContact O-CB 3.41Å; E999-R1003 VanDerWaalsContact O-CG 3.27Å; E999-R1003 WeakPolarHBondContact O-CG 3.33Å; E999-R1003 PolarHBondContact O-N 3.03Å; E999-R1003 IonicContact OE1-CZ 3.65Å; E999-R1003 VanDerWaalsContact OE1-CZ 3.27Å; E999-R1003 IonicContact OE1-NE 2.82Å; E999-R1003 PolarHBondContact OE1-NE 2.94Å; E999-R1003 VanDerWaalsContact OE1-NE 3.16Å; E999-R1003 IonicContact OE1-NH2 3.54Å; E999-R1003 PolarHBondContact OE1-NH2 3.49Å; E999-R1003 IonicContact OE2-CZ 3.52Å; E999-R1003 IonicContact OE2-NE 3.46Å; E999-R1003 IonicContact OE2-NH2 2.7Å; E999-R1003 PolarHBondContact OE2-NH2 3.4Å
1000	L	89.3	Confident	88.2	Confident	28 Å²	28	77.8 Å²	77.8	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-63	-45.6	176.4	-162.5	72.8	0	0	0	111.4	L986 E996 E998 R1003 H1004 A1011 V1014 M1015	L986-L1000 HydrophobicContact CD2-CD2 4.11Å; E996-L1000 WeakPolarHBondContact O-CB 3.39Å; E996-L1000 PolarHBondContact O-N 3.17Å; E998-L1000 VanDerWaalsContact C-N 3.3Å; E998-L1000 PolarHBondContact O-N 3.13Å; L1000-R1003 PolarHBondContact O-N 3.11Å; L1000-H1004 PolarHBondContact O-CD2 3.39Å; L1000-H1004 VanDerWaalsContact O-CD2 3.29Å; L1000-H1004 PolarHBondContact O-N 3.41Å; L1000-A1011 HydrophobicContact CD2-CB 4.3Å; L1000-A1011 WeakPolarHBondContact CD2-O 3.48Å; L1000-A1011 HydrophobicContact CG-CB 4.33Å; L1000-V1014 HydrophobicContact CD1-CG1 4.11Å; L1000-M1015 HydrophobicContact CD2-CB 3.82Å; L1000-M1015 HydrophobicContact CD2-CG 4.46Å
1001	L	90.5	Very high	88.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-44	174.3	-80.5	162.4	0	0	0	111.8	K982 V983 L986 C997 E998 R1003 H1004 R1005 W1006 L1008 A1011	K982-L1001 HydrophobicContact CB-CD1 3.96Å; K982-L1001 HydrophobicContact CB-CD2 4.33Å; V983-L1001 HydrophobicContact CB-CD1 4.42Å; V983-L1001 HydrophobicContact CG2-CD1 3.91Å; L986-L1001 HydrophobicContact CB-CD1 4.48Å; C997-L1001 WeakPolarHBondContact O-CB 3.21Å; C997-L1001 WeakPolarHBondContact O-CG 3.35Å; C997-L1001 PolarHBondContact O-N 3.4Å; E998-L1001 PolarHBondContact O-N 3.11Å; L1001-R1003 PolarHBondContact O-N 2.8Å; L1001-H1004 CarbonylContact O-C 3.55Å; L1001-H1004 VanDerWaalsContact O-C 3.29Å; L1001-H1004 PolarHBondContact O-N 3.31Å; L1001-R1005 PolarHBondContact O-N 3.26Å; L1001-R1005 VanDerWaalsContact O-N 3.11Å; L1001-W1006 HydrophobicContact CB-CD2 4.35Å; L1001-W1006 HydrophobicContact CB-CE3 3.85Å; L1001-W1006 HydrophobicContact CB-CZ3 4.08Å; L1001-W1006 HydrophobicContact CD1-CE3 4.36Å; L1001-W1006 HydrophobicContact CD1-CZ3 4.28Å; L1001-W1006 WeakPolarHBondContact O-CA 3.36Å; L1001-W1006 PolarHBondContact O-N 2.85Å; L1001-L1008 HydrophobicContact CD2-CD1 4.1Å; L1001-A1011 HydrophobicContact CD2-CB 3.75Å; L1001-A1011 HydrophobicContact CG-CB 4.1Å
1002	Q	90.6	Very high	88.5	Confident	102 Å²	102	73.5 Å²	73.5	48%	0.477	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-45.5	177.2	-71.4	-179.7	18.1	0	0	111.5	E998 E999 H1004 R1005 W1006	E998-Q1002 HydrophobicContact CG-CG 4.34Å; E998-Q1002 WeakPolarHBondContact O-CG 3.06Å; E998-Q1002 PolarHBondContact O-N 3.13Å; E998-Q1002 PolarHBondContact OE1-NE2 3.4Å; E999-Q1002 PolarHBondContact O-N 3.11Å; Q1002-H1004 VanDerWaalsContact C-N 3.29Å; Q1002-H1004 PolarHBondContact O-N 2.75Å; Q1002-R1005 PolarHBondContact O-N 3.29Å; Q1002-R1005 VanDerWaalsContact O-N 3.12Å; Q1002-W1006 HydrophobicContact CG-CH2 4.34Å; Q1002-W1006 HydrophobicContact CG-CZ2 3.58Å
1003	R	89.9	Confident	88.6	Confident	165 Å²	165	72.2 Å²	72.2	62%	0.623	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-38	175.3	-71.2	170.4	-177.8	-169	4.4	112.2	E999 L1000 L1001 R1005	E999-R1003 WeakPolarHBondContact O-CB 3.41Å; E999-R1003 VanDerWaalsContact O-CG 3.27Å; E999-R1003 WeakPolarHBondContact O-CG 3.33Å; E999-R1003 PolarHBondContact O-N 3.03Å; E999-R1003 IonicContact OE1-CZ 3.65Å; E999-R1003 VanDerWaalsContact OE1-CZ 3.27Å; E999-R1003 IonicContact OE1-NE 2.82Å; E999-R1003 PolarHBondContact OE1-NE 2.94Å; E999-R1003 VanDerWaalsContact OE1-NE 3.16Å; E999-R1003 IonicContact OE1-NH2 3.54Å; E999-R1003 PolarHBondContact OE1-NH2 3.49Å; E999-R1003 IonicContact OE2-CZ 3.52Å; E999-R1003 IonicContact OE2-NE 3.46Å; E999-R1003 IonicContact OE2-NH2 2.7Å; E999-R1003 PolarHBondContact OE2-NH2 3.4Å; L1000-R1003 PolarHBondContact O-N 3.11Å; L1001-R1003 PolarHBondContact O-N 2.8Å; R1003-R1005 VanDerWaalsContact C-N 3.34Å; R1003-R1005 PolarHBondContact O-N 2.71Å
1004	H	89.8	Confident	88.3	Confident	49 Å²	49	72.7 Å²	72.7	23%	0.227	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	23.7	176.2	-70.8	-82.7	0	0	0	114.1	L1000 L1001 Q1002 W1006 D1007 Q1010 A1011	L1000-H1004 PolarHBondContact O-CD2 3.39Å; L1000-H1004 VanDerWaalsContact O-CD2 3.29Å; L1000-H1004 PolarHBondContact O-N 3.41Å; L1001-H1004 CarbonylContact O-C 3.55Å; L1001-H1004 VanDerWaalsContact O-C 3.29Å; L1001-H1004 PolarHBondContact O-N 3.31Å; Q1002-H1004 VanDerWaalsContact C-N 3.29Å; Q1002-H1004 PolarHBondContact O-N 2.75Å; H1004-W1006 PolarHBondContact O-N 3.08Å; H1004-W1006 VanDerWaalsContact O-N 3.16Å; H1004-D1007 VanDerWaalsContact O-CB 3.26Å; H1004-D1007 WeakPolarHBondContact O-CB 3.46Å; H1004-D1007 PolarHBondContact O-N 2.98Å; H1004-Q1010 HydrophobicContact CB-CB 4.32Å; H1004-A1011 HydrophobicContact CB-CB 4.42Å
1005	R	90.3	Very high	88.1	Confident	231 Å²	231	68.7 Å²	68.7	87%	0.872	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	33.1	176.1	-58.4	-179.1	175.8	171.5	-1.3	114.6	L1001 Q1002 R1003 D1007	L1001-R1005 PolarHBondContact O-N 3.26Å; L1001-R1005 VanDerWaalsContact O-N 3.11Å; Q1002-R1005 PolarHBondContact O-N 3.29Å; Q1002-R1005 VanDerWaalsContact O-N 3.12Å; R1003-R1005 VanDerWaalsContact C-N 3.34Å; R1003-R1005 PolarHBondContact O-N 2.71Å; R1005-D1007 VanDerWaalsContact C-N 3.25Å; R1005-D1007 PolarHBondContact O-N 3.03Å
1006	W	88.2	Confident	87.7	Confident	54 Å²	54	69.8 Å²	69.8	21%	0.205	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	23.1	-175.7	-57.7	89.5	0	0	0	114.9	N979 K982 V983 E998 L1001 Q1002 H1004 L1008	N979-W1006 HydrophobicContact CB-CD2 4.23Å; N979-W1006 HydrophobicContact CB-CE3 3.72Å; N979-W1006 HydrophobicContact CB-CH2 3.69Å; N979-W1006 HydrophobicContact CB-CZ2 4.19Å; N979-W1006 HydrophobicContact CB-CZ3 3.44Å; N979-W1006 VanDerWaalsContact CB-CZ3 3.44Å; N979-W1006 VanDerWaalsContact CG-CD2 3.49Å; N979-W1006 VanDerWaalsContact CG-CE3 3.47Å; N979-W1006 VanDerWaalsContact ND2-CE2 3.26Å; N979-W1006 WeakPolarHBondContact ND2-CZ2 3.28Å; N979-W1006 WeakPolarHBondContact O-CZ3 3.38Å; K982-W1006 WeakPolarHBondContact CD-O 3.47Å; K982-W1006 PolarHBondContact NZ-O 2.74Å; V983-W1006 HydrophobicContact CG2-CH2 4.25Å; V983-W1006 HydrophobicContact CG2-CZ3 3.84Å; E998-W1006 HydrophobicContact CG-CH2 3.88Å; L1001-W1006 HydrophobicContact CB-CD2 4.35Å; L1001-W1006 HydrophobicContact CB-CE3 3.85Å; L1001-W1006 HydrophobicContact CB-CZ3 4.08Å; L1001-W1006 HydrophobicContact CD1-CE3 4.36Å; L1001-W1006 HydrophobicContact CD1-CZ3 4.28Å; L1001-W1006 WeakPolarHBondContact O-CA 3.36Å; L1001-W1006 PolarHBondContact O-N 2.85Å; Q1002-W1006 HydrophobicContact CG-CH2 4.34Å; Q1002-W1006 HydrophobicContact CG-CZ2 3.58Å; H1004-W1006 PolarHBondContact O-N 3.08Å; H1004-W1006 VanDerWaalsContact O-N 3.16Å; W1006-L1008 PolarHBondContact O-N 3.36Å
1007	D	86.8	Confident	87.3	Confident	55 Å²	55	72.1 Å²	72.1	29%	0.294	34%	0.34	S	S	.	.			trans	-75.5	116.4	164.1	-171.1	-40.5	0	0	0	110	H1004 R1005 E1009 Q1010 A1011	H1004-D1007 VanDerWaalsContact O-CB 3.26Å; H1004-D1007 WeakPolarHBondContact O-CB 3.46Å; H1004-D1007 PolarHBondContact O-N 2.98Å; R1005-D1007 VanDerWaalsContact C-N 3.25Å; R1005-D1007 PolarHBondContact O-N 3.03Å; D1007-E1009 PolarHBondContact OD1-N 3.24Å; D1007-Q1010 HydrophobicContact CB-CB 4.12Å; D1007-Q1010 HydrophobicContact CB-CG 4.29Å; D1007-Q1010 PolarHBondContact OD1-N 3Å; D1007-Q1010 PolarHBondContact OD2-NE2 3.07Å; D1007-A1011 VanDerWaalsContact O-CB 3.24Å; D1007-A1011 WeakPolarHBondContact O-CB 3.32Å; D1007-A1011 PolarHBondContact O-N 3.37Å
1008	L	87.2	Confident	86.1	Confident	37 Å²	37	75.4 Å²	75.4	19%	0.194	37%	0.367	C	S	.	.	H	α-helix	trans	-79.1	-30.3	-177.1	-174.1	68.6	0	0	0	112.3	K982 Q985 L986 L1001 W1006 S1012	K982-L1008 HydrophobicContact CB-CD1 4.2Å; K982-L1008 HydrophobicContact CG-CD1 4.44Å; Q985-L1008 HydrophobicContact CB-CD2 4.36Å; L986-L1008 HydrophobicContact CD1-CD1 3.7Å; L1001-L1008 HydrophobicContact CD2-CD1 4.1Å; W1006-L1008 PolarHBondContact O-N 3.36Å; L1008-S1012 WeakPolarHBondContact O-CB 3.36Å; L1008-S1012 VanDerWaalsContact O-CB 3.25Å; L1008-S1012 PolarHBondContact O-OG 2.82Å; L1008-S1012 PolarHBondContact O-N 2.75Å
1009	E	85.6	Confident	84.6	Confident	138 Å²	138	77.4 Å²	77.4	65%	0.645	37%	0.372	S	S	*	.	H	α-helix	trans	-74.6	-44.7	-179.4	-171.5	172.7	177.3	0	0	110	D1007 S1012 T1013	D1007-E1009 PolarHBondContact OD1-N 3.24Å; E1009-S1012 PolarHBondContact O-OG 2.92Å; E1009-S1012 VanDerWaalsContact O-OG 3.12Å; E1009-T1013 WeakPolarHBondContact O-CB 3.24Å; E1009-T1013 PolarHBondContact O-N 2.66Å; E1009-T1013 PolarHBondContact O-OG1 2.92Å
1010	Q	86	Confident	82.8	Confident	104 Å²	104	74.4 Å²	74.4	49%	0.486	37%	0.366	S	S	.	.	H	α-helix	trans	-63.6	-47	173.3	-68.9	-176.4	58.9	0	0	111.9	H1004 D1007 S1012 T1013 V1014	H1004-Q1010 HydrophobicContact CB-CB 4.32Å; D1007-Q1010 HydrophobicContact CB-CB 4.12Å; D1007-Q1010 HydrophobicContact CB-CG 4.29Å; D1007-Q1010 PolarHBondContact OD1-N 3Å; D1007-Q1010 PolarHBondContact OD2-NE2 3.07Å; Q1010-S1012 PolarHBondContact O-N 2.94Å; Q1010-T1013 PolarHBondContact O-N 3.2Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.25Å; Q1010-V1014 PolarHBondContact O-N 3.18Å
1011	A	87.8	Confident	80.5	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-42.5	179.6	0	0	0	0	0	112.3	L986 L1000 L1001 H1004 D1007 M1015	L986-A1011 HydrophobicContact CD1-CB 4.04Å; L1000-A1011 HydrophobicContact CD2-CB 4.3Å; L1000-A1011 WeakPolarHBondContact CD2-O 3.48Å; L1000-A1011 HydrophobicContact CG-CB 4.33Å; L1001-A1011 HydrophobicContact CD2-CB 3.75Å; L1001-A1011 HydrophobicContact CG-CB 4.1Å; H1004-A1011 HydrophobicContact CB-CB 4.42Å; D1007-A1011 VanDerWaalsContact O-CB 3.24Å; D1007-A1011 WeakPolarHBondContact O-CB 3.32Å; D1007-A1011 PolarHBondContact O-N 3.37Å; A1011-M1015 WeakPolarHBondContact O-CB 3.37Å; A1011-M1015 PolarHBondContact O-N 3.32Å
1012	S	85.2	Confident	78.1	Confident	29 Å²	29	87.7 Å²	87.7	20%	0.203	44%	0.438	C	S	.	.	H	α-helix	trans	-68.2	-38.3	177.4	56.5	0	0	0	0	112.3	L1008 E1009 Q1010 M1015 L1016	L1008-S1012 WeakPolarHBondContact O-CB 3.36Å; L1008-S1012 VanDerWaalsContact O-CB 3.25Å; L1008-S1012 PolarHBondContact O-OG 2.82Å; L1008-S1012 PolarHBondContact O-N 2.75Å; E1009-S1012 PolarHBondContact O-OG 2.92Å; E1009-S1012 VanDerWaalsContact O-OG 3.12Å; Q1010-S1012 PolarHBondContact O-N 2.94Å; S1012-M1015 PolarHBondContact O-N 2.93Å; S1012-L1016 PolarHBondContact O-N 3.43Å; S1012-L1016 WeakPolarHBondContact O-CG 3.27Å; S1012-L1016 VanDerWaalsContact O-CG 3.24Å; S1012-L1016 WeakPolarHBondContact O-CB 3.49Å; S1012-L1016 WeakPolarHBondContact O-CD1 3.5Å
1013	T	86.2	Confident	75.7	Confident	65 Å²	65	88 Å²	88	40%	0.399	45%	0.451	S	S	.	.	H	α-helix	trans	-59.6	-51.7	174.6	-57.1	0	0	0	0	111.3	E1009 Q1010 M1015 L1016 D1017	E1009-T1013 WeakPolarHBondContact O-CB 3.24Å; E1009-T1013 PolarHBondContact O-N 2.66Å; E1009-T1013 PolarHBondContact O-OG1 2.92Å; Q1010-T1013 PolarHBondContact O-N 3.2Å; T1013-M1015 VanDerWaalsContact C-N 3.29Å; T1013-M1015 PolarHBondContact O-N 3.3Å; T1013-L1016 PolarHBondContact O-N 3.16Å; T1013-L1016 VanDerWaalsContact O-N 3.1Å; T1013-D1017 PolarHBondContact O-N 3.41Å
1014	V	84.3	Confident	72.9	Confident	65 Å²	65	88 Å²	88	39%	0.394	46%	0.463	S	S	.	.	H	α-helix	trans	-62.2	-36.3	178.4	172.7	0	0	0	0	112	L1000 Q1010 A1018	L1000-V1014 HydrophobicContact CD1-CG1 4.11Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.25Å; Q1010-V1014 PolarHBondContact O-N 3.18Å; V1014-A1018 PolarHBondContact O-N 3.16Å
1015	M	83.1	Confident	70.2	Confident	5 Å²	5	97 Å²	97	3%	0.025	50%	0.495	C	S	.	.	H	α-helix	trans	-69.6	-31.6	176	-165.1	173.1	70.1	0	0	113	L986 L989 L991 R992 L1000 A1011 S1012 T1013 Y1019	L986-M1015 HydrophobicContact CD2-CE 4.2Å; L986-M1015 HydrophobicContact CD2-SD 3.82Å; L986-M1015 HydrophobicContact CG-CE 3.77Å; L986-M1015 HydrophobicContact CG-SD 4.09Å; L989-M1015 HydrophobicContact CB-CE 3.8Å; L989-M1015 HydrophobicContact CD1-CE 3.49Å; L989-M1015 VanDerWaalsContact CD1-CE 3.49Å; L989-M1015 HydrophobicContact CG-CE 4.24Å; L991-M1015 HydrophobicContact CB-CE 4.19Å; L991-M1015 HydrophobicContact CB-CG 4.17Å; L991-M1015 HydrophobicContact CB-SD 4.15Å; L991-M1015 HydrophobicContact CD1-CE 4.26Å; L991-M1015 HydrophobicContact CD1-CG 4.32Å; L991-M1015 HydrophobicContact CG-CE 4.49Å; R992-M1015 HydrophobicContact CB-SD 3.85Å; R992-M1015 HydrophobicContact CG-CG 3.89Å; R992-M1015 HydrophobicContact CG-SD 3.53Å; R992-M1015 VanDerWaalsContact CG-SD 3.53Å; L1000-M1015 HydrophobicContact CD2-CB 3.82Å; L1000-M1015 HydrophobicContact CD2-CG 4.46Å; A1011-M1015 WeakPolarHBondContact O-CB 3.37Å; A1011-M1015 PolarHBondContact O-N 3.32Å; S1012-M1015 PolarHBondContact O-N 2.93Å; T1013-M1015 VanDerWaalsContact C-N 3.29Å; T1013-M1015 PolarHBondContact O-N 3.3Å; M1015-Y1019 WeakPolarHBondContact O-CD2 3.11Å
1016	L	82.1	Confident	67.5	Low	93 Å²	93	95.3 Å²	95.3	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-81.9	-41.4	179.3	-72.6	165.7	0	0	0	112.5	L991 S1012 T1013 A1018 Y1019	L991-L1016 HydrophobicContact CD1-CD2 3.85Å; S1012-L1016 PolarHBondContact O-N 3.43Å; S1012-L1016 WeakPolarHBondContact O-CG 3.27Å; S1012-L1016 VanDerWaalsContact O-CG 3.24Å; S1012-L1016 WeakPolarHBondContact O-CB 3.49Å; S1012-L1016 WeakPolarHBondContact O-CD1 3.5Å; T1013-L1016 PolarHBondContact O-N 3.16Å; T1013-L1016 VanDerWaalsContact O-N 3.1Å; L1016-A1018 PolarHBondContact O-N 3.2Å; L1016-Y1019 CarbonylContact O-C 3.49Å; L1016-Y1019 PolarHBondContact O-N 3.39Å
1017	D	78.1	Confident	64.9	Low	122 Å²	122	101.2 Å²	101.2	65%	0.652	53%	0.529	S	S	*	.	H	α-helix	trans	-60.4	-34.9	177.4	-79.7	-20.8	0	0	0	111.9	T1013 Y1019 G1020	T1013-D1017 PolarHBondContact O-N 3.41Å; D1017-Y1019 PolarHBondContact O-N 2.63Å; D1017-Y1019 VanDerWaalsContact O-N 3.11Å; D1017-G1020 PolarHBondContact O-N 3.39Å; D1017-G1020 VanDerWaalsContact O-N 3.13Å
1018	A	66.2	Low	62.5	Low	68 Å²	68	108.8 Å²	108.8	56%	0.562	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-14.3	173.7	0	0	0	0	0	114.4	V1014 L1016	V1014-A1018 PolarHBondContact O-N 3.16Å; L1016-A1018 PolarHBondContact O-N 3.2Å
1019	Y	60.1	Low	61.2	Low	121 Å²	121	112.4 Å²	112.4	48%	0.475	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-117.7	23.5	177.6	-71.5	-97.7	0	0	0	112.5	L991 R992 M1015 L1016 D1017	L991-Y1019 HydrophobicContact CB-CE2 4.32Å; L991-Y1019 HydrophobicContact CD1-CD2 4.34Å; L991-Y1019 PolarHBondContact O-OH 2.83Å; R992-Y1019 PolarHBondContact NH2-OH 2.74Å; M1015-Y1019 WeakPolarHBondContact O-CD2 3.11Å; L1016-Y1019 CarbonylContact O-C 3.49Å; L1016-Y1019 PolarHBondContact O-N 3.39Å; D1017-Y1019 PolarHBondContact O-N 2.63Å; D1017-Y1019 VanDerWaalsContact O-N 3.11Å
1020	G	51.4	Low	60	Low	32 Å²	32	111.1 Å²	111.1	33%	0.33	59%	0.594	S	S	.	*			trans	-60.1	172.3	176.4	0	0	0	0	0	115.3	D1017 H1022	D1017-G1020 PolarHBondContact O-N 3.39Å; D1017-G1020 VanDerWaalsContact O-N 3.13Å; G1020-H1022 PolarHBondContact O-N 3.33Å
1021	P	42.2	Very low	58.5	Low	128 Å²	128	111.4 Å²	111.4	83%	0.831	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.8	8.3	-152.1	-26.2	36.3	0	0	0	119.8
1022	H	39.3	Very low	56.8	Low	178 Å²	178	118 Å²	118	82%	0.824	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-14.7	-171.2	-76.3	65.7	0	0	0	114.9	G1020	G1020-H1022 PolarHBondContact O-N 3.33Å
1023	C	39.1	Very low	55	Low	110 Å²	110	123.6 Å²	123.6	74%	0.743	66%	0.662	S	S	*	*	S	Bend	trans	-83.5	-23.2	-178	-71	0	0	0	0	115.1	R1025	C1023-R1025 PolarHBondContact O-N 3.13Å
1024	N	32.1	Very low	53	Low	163 Å²	163	127.5 Å²	127.5	87%	0.872	68%	0.68	S	S	*	*			trans	-84.4	38.5	-177.9	-81.7	-8.1	0	0	0	114.3
1025	R	33.4	Very low	50.7	Low	238 Å²	238	131.9 Å²	131.9	90%	0.898	70%	0.7	S	S	*	*	S	Bend	trans	-118.4	50.7	168.9	-88.6	-167.9	173	-175.2	-0.3	112	C1023	C1023-R1025 PolarHBondContact O-N 3.13Å
1026	K	33.3	Very low	48.2	Very low	196 Å²	196	141.7 Å²	141.7	85%	0.852	75%	0.752	S	S	*	*	S	Bend	trans	-168.3	85.9	163	-109.9	166.3	-175.6	-179	0	110.6
1027	L	33.8	Very low	45.4	Very low	179 Å²	179	145.8 Å²	145.8	94%	0.937	77%	0.774	S	S	*	*			trans	171.6	94.5	152.4	-96	159.1	0	0	0	107.1
1028	T	35.7	Very low	42.4	Very low	214 Å²	214	147.9 Å²	147.9	100%	1.313	79%	0.785	S	S	*	*			trans	-94.9	0	161.9	49.5	0	0	0	0	108.2

Retrieved 1,028 of 1,028 residues in 301.8 ms (Link to these results)

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