A0A5K4F0R9_SCHMA Loading...

Rab-GAP TBC domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0R9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,157 aa.

						>A0A5K4F0R9_SCHMA|A0A5K4F0R9
MEKPPLSSSSLGFPIGVIKIPVSLSGLTEMDVNGLPRLPVSVTCYARFRRLLHIKHHNLCQYLDVVREKGEVLSVVCEYYSTSFSNFSGPVTDVNWLSQRFSECLSALSFMSDNGLVHWCLTPDMIMLDSDGHVKIGGYGIYYATDWGNIADFTLPSLMYSAPEVFLFLYNQANNLCQSERSIKSDKCWGNIKADVWSLGVIFFEIIFGREFTNPLLKLRSENMKEGEIISLFLRGLCQANEYPTLPEFLQLHLNGISADLDILVQLIQYCLRFDAIKRPTPKCLMKEINELLKTDCYISSDISGDKYSTPWCRKICNRPKRHEFHPQLFSLEDSKNNILKAYNFINSIENLSELYYYWMLTGGKTHAILKGHTDSKSIIDNYHHNGSKQESIKEKEALIGANSQSPILKIPHYLAIVQSNTTRAISSKEQWPLGEMPQPRTFRFQITPLPNECFIERISHTSLHNLYPLLICQDLKISSIRNSSVCSALYSVNNNGTNYVNTSSNSSIPNECSPVIPNSPLFEVTEKRSDFLDSLCKNDLTCITGIDWSMPFTNSQYESISQQPLSVRETDVDYQIYRTRLFTRIINGLPATKQYLRLEARKDIPPFLRWKVWAALLDVYPNRDFESAYLKALHKINKFGLDVTPTNELNNNEQYNNNNNNNNNNNDFSCDLLNEKVINQISVDLPRCHAYDPLLASSIGQSVLRRVLLATLLMKPGALDYTQGMDSVAAVFVRICYPDEALAAACLNAFLSTKLPGFFSSGGLTVGLKSYFNTLLRLLAFHVPRLAVRLVDINVPLIGLTTGWIYTLFAHAMPLDRIELLWDTIIPGPASLSMFFYIAFFIQLDRQINLELLGLEKICTILSNFPDINLDKCRTDALKLALATPRSLTAWSIPNRQYLNQKCMENKELKVEHVNFKRNESSASDFYERLTSQNAWPDHLECDFTESLEYSDIDVASNVCEKLNISSNAFKLVPLLSVKDAVVHIKRPDCLVLDVRNIKEYNKFHLPNSIHCEVFRSVMLDSSLIGIKENNDISSTTTDYNNTFAPENWEVIDYPSGNRNRPQIIPEFLAFLINQKLWHQTTQARRLLSIKSSQGVTKEPVNTVTPSSPGLLIVCGNDERLCWDLAFWLIKCDIDRVCILFSSNDSISNFINSCSQ
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	36.5	Very low	243 Å²	243	118 Å²	118	100%	1.197	66%	0.655	S	S	*	*				0	103	0	-76.1	-170	167	0	0	107.1	K3	M1-K3 PolarHBondContact O-N 3.37Å
2	E	28.1	Very low	39	Very low	194 Å²	194	113.6 Å²	113.6	91%	0.907	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-58.9	122.4	168	-71	-178.5	148.1	0	0	107.3
3	K	30.6	Very low	42.4	Very low	198 Å²	198	105.8 Å²	105.8	86%	0.861	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-56.1	129.5	170.7	-82.5	-179.4	176.3	177.5	0	106.5	M1	M1-K3 PolarHBondContact O-N 3.37Å
4	P	29.6	Very low	45.8	Very low	111 Å²	111	99.3 Å²	99.3	72%	0.721	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-54.9	144.9	179.1	23.1	-31.6	0	0	0	108.8	L6	P4-L6 PolarHBondContact O-N 2.93Å
5	P	32.6	Very low	49	Very low	115 Å²	115	92.7 Å²	92.7	75%	0.747	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-52.2	131	177.3	22	-31.7	0	0	0	108.6	S7	P5-S7 PolarHBondContact O-N 3.24Å
6	L	37.1	Very low	51.7	Low	125 Å²	125	86.9 Å²	86.9	65%	0.654	50%	0.502	S	S	*	.			trans	-50.6	101.1	173.2	-82.3	142.8	0	0	0	107.7	P4 L11	P4-L6 PolarHBondContact O-N 2.93Å; L6-L11 HydrophobicContact CB-CD1 4.31Å; L6-L11 HydrophobicContact CD2-CD1 4.16Å; L6-L11 HydrophobicContact CD2-CD2 4.31Å; L6-L11 HydrophobicContact CD2-CG 4.32Å
7	S	37	Very low	54.2	Low	61 Å²	61	81.9 Å²	81.9	43%	0.427	47%	0.473	S	S	.	.			trans	-68.1	141	173.4	63.6	0	0	0	0	107.6	P5 S9 S10	P5-S7 PolarHBondContact O-N 3.24Å; S7-S9 PolarHBondContact O-N 3.14Å; S7-S9 VanDerWaalsContact O-N 3.1Å; S7-S9 PolarHBondContact OG-OG 3.2Å; S7-S10 WeakPolarHBondContact O-CB 3.44Å; S7-S10 PolarHBondContact O-N 3.16Å; S7-S10 PolarHBondContact O-OG 3.31Å
8	S	40.2	Very low	56.1	Low	53 Å²	53	77.4 Å²	77.4	37%	0.371	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-49.2	-37.1	175.6	51.3	0	0	0	0	112	S10 L11	S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 3.22Å; S8-L11 PolarHBondContact O-N 3.12Å
9	S	38.3	Very low	57.6	Low	95 Å²	95	74.6 Å²	74.6	66%	0.664	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-63.9	-21.9	177.1	59.3	0	0	0	0	115.2	S7 L11	S7-S9 PolarHBondContact O-N 3.14Å; S7-S9 VanDerWaalsContact O-N 3.1Å; S7-S9 PolarHBondContact OG-OG 3.2Å; S9-L11 VanDerWaalsContact C-N 3.31Å
10	S	41.8	Very low	58.8	Low	68 Å²	68	71 Å²	71	48%	0.476	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-79.5	-15.6	179.8	68.8	0	0	0	0	113.3	S7 S8	S7-S10 WeakPolarHBondContact O-CB 3.44Å; S7-S10 PolarHBondContact O-N 3.16Å; S7-S10 PolarHBondContact O-OG 3.31Å; S8-S10 VanDerWaalsContact C-N 3.26Å; S8-S10 PolarHBondContact O-N 3.22Å
11	L	54.2	Low	59.7	Low	35 Å²	35	69.4 Å²	69.4	18%	0.183	40%	0.4	C	S	.	.	S	Bend	trans	-104.4	92.8	-176.5	-68.3	145.6	0	0	0	108.1	L6 S8 S9 F13 Y343	L6-L11 HydrophobicContact CB-CD1 4.31Å; L6-L11 HydrophobicContact CD2-CD1 4.16Å; L6-L11 HydrophobicContact CD2-CD2 4.31Å; L6-L11 HydrophobicContact CD2-CG 4.32Å; S8-L11 PolarHBondContact O-N 3.12Å; S9-L11 VanDerWaalsContact C-N 3.31Å; L11-F13 PolarHBondContact O-N 2.74Å; L11-Y343 HydrophobicContact CD2-CD2 3.61Å; L11-Y343 HydrophobicContact CD2-CE2 3.25Å; L11-Y343 HydrophobicContact CD2-CG 4.4Å; L11-Y343 HydrophobicContact CG-CE2 4.46Å
12	G	66.1	Low	61.7	Low	65 Å²	65	58 Å²	58	67%	0.67	34%	0.344	S	S	*	.			trans	-57.5	124.9	-174.8	0	0	0	0	0	112.7
13	F	83.6	Confident	63.5	Low	13 Å²	13	51.3 Å²	51.3	6%	0.057	32%	0.319	C	S	.	.			trans	-76.2	126.2	169.1	-165.3	-127.6	0	0	0	109.2	L11 I15 L355 W359 L450 N452 F455	L11-F13 PolarHBondContact O-N 2.74Å; F13-I15 HydrophobicContact CD1-CB 3.93Å; F13-I15 HydrophobicContact CD1-CG1 4.5Å; F13-I15 HydrophobicContact CE1-CB 3.71Å; F13-I15 HydrophobicContact CE1-CD1 3.89Å; F13-I15 HydrophobicContact CE1-CG1 4.1Å; F13-I15 HydrophobicContact CE2-CD1 4.46Å; F13-I15 HydrophobicContact CZ-CB 4.41Å; F13-I15 HydrophobicContact CZ-CD1 3.73Å; F13-I15 HydrophobicContact CZ-CG1 4.31Å; F13-I15 PolarHBondContact O-N 3.01Å; F13-L355 HydrophobicContact CE2-CD1 4.49Å; F13-L355 HydrophobicContact CE2-CD2 3.92Å; F13-L355 HydrophobicContact CE2-CG 4.03Å; F13-L355 HydrophobicContact CZ-CD2 4.47Å; F13-L355 HydrophobicContact CZ-CG 4.31Å; F13-W359 AromaticContact CE1-CD1 3.86Å; F13-W359 HydrophobicContact CE1-CG 4.19Å; F13-W359 HydrophobicContact CZ-CB 4.06Å; F13-W359 AromaticContact CZ-CD1 3.89Å; F13-W359 HydrophobicContact CZ-CG 4.12Å; F13-L450 HydrophobicContact CD1-CB 3.92Å; F13-L450 HydrophobicContact CE1-CB 3.95Å; F13-L450 HydrophobicContact CE1-CD1 4.28Å; F13-N452 HydrophobicContact CB-CB 3.89Å; F13-N452 HydrophobicContact CD1-CB 4.22Å; F13-N452 HydrophobicContact CD2-CB 3.92Å; F13-N452 HydrophobicContact CG-CB 3.76Å; F13-F455 AromaticContact CE2-CD1 3.86Å; F13-F455 HydrophobicContact CE2-CD1 3.86Å; F13-F455 AromaticContact CE2-CE1 3.91Å; F13-F455 HydrophobicContact CE2-CE1 3.91Å; F13-F455 HydrophobicContact CZ-CD1 4.26Å; F13-F455 HydrophobicContact CZ-CE1 4.43Å
14	P	89.4	Confident	64.7	Low	14 Å²	14	44.7 Å²	44.7	9%	0.091	29%	0.293	C	S	.	.	S	Bend	trans	-79.7	23.2	-169.8	33.2	-37	0	0	0	113.8	E78 Y79 Y80 L352 L355	P14-E78 WeakPolarHBondContact O-CA 3.08Å; P14-Y79 CarbonylContact C-O 3.55Å; P14-Y79 VanDerWaalsContact CA-O 3.26Å; P14-Y79 WeakPolarHBondContact CA-O 3.23Å; P14-Y79 PolarHBondContact O-N 3.46Å; P14-Y80 HydrophobicContact CB-CE1 4.37Å; P14-L352 HydrophobicContact CB-CD2 4.14Å; P14-L352 HydrophobicContact CG-CD2 3.78Å; P14-L355 HydrophobicContact CG-CD2 3.84Å
15	I	94	Very high	65.7	Low	0 Å²	0	41.1 Å²	41.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.2	-173.7	-53.3	172.7	0	0	0	110.1	F13 L63 V76 C77 L355 Y356 L450	F13-I15 HydrophobicContact CD1-CB 3.93Å; F13-I15 HydrophobicContact CD1-CG1 4.5Å; F13-I15 HydrophobicContact CE1-CB 3.71Å; F13-I15 HydrophobicContact CE1-CD1 3.89Å; F13-I15 HydrophobicContact CE1-CG1 4.1Å; F13-I15 HydrophobicContact CE2-CD1 4.46Å; F13-I15 HydrophobicContact CZ-CB 4.41Å; F13-I15 HydrophobicContact CZ-CD1 3.73Å; F13-I15 HydrophobicContact CZ-CG1 4.31Å; F13-I15 PolarHBondContact O-N 3.01Å; I15-L63 HydrophobicContact CB-CD1 4.48Å; I15-L63 HydrophobicContact CD1-CD1 4.1Å; I15-L63 HydrophobicContact CG1-CD1 3.92Å; I15-L63 HydrophobicContact CG2-CD1 3.84Å; I15-V76 HydrophobicContact CG2-CG1 3.52Å; I15-C77 WeakPolarHBondContact CA-O 3.41Å; I15-L355 HydrophobicContact CD1-CB 4.16Å; I15-L355 HydrophobicContact CD1-CD2 4.07Å; I15-L355 HydrophobicContact CD1-CG 4.08Å; I15-Y356 HydrophobicContact CG2-CD2 4.46Å; I15-L450 HydrophobicContact CB-CD1 4.14Å; I15-L450 HydrophobicContact CG2-CD1 3.44Å; I15-L450 VanDerWaalsContact CG2-CD1 3.44Å; I15-L450 HydrophobicContact CG2-CG 4.07Å; I15-L450 PolarHBondContact O-N 3.45Å
16	G	92.7	Very high	66.3	Low	0 Å²	0	38.6 Å²	38.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	177.8	175.8	0	0	0	0	0	112.4	V76 C77 T448	G16-V76 WeakPolarHBondContact O-CA 3.23Å; G16-C77 PolarHBondContact N-O 3.21Å; G16-C77 PolarHBondContact O-N 3.03Å; G16-T448 CarbonylContact C-O 3.19Å; G16-T448 WeakPolarHBondContact CA-O 3.44Å
17	V	93.4	Very high	66.7	Low	2 Å²	2	36.6 Å²	36.6	1%	0.012	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.3	-179.3	65.1	0	0	0	0	111.3	V75 V76 I369 T448 L450	V17-V75 CarbonylContact C-O 3.44Å; V17-V75 WeakPolarHBondContact CA-O 3.44Å; V17-V76 HydrophobicContact CG2-CG2 4.35Å; V17-I369 HydrophobicContact CG1-CD1 3.98Å; V17-I369 HydrophobicContact CG1-CG2 4.45Å; V17-T448 PolarHBondContact N-O 3.37Å; V17-T448 PolarHBondContact O-N 3.14Å; V17-L450 HydrophobicContact CB-CD2 3.97Å; V17-L450 HydrophobicContact CG1-CD2 3.86Å
18	I	88.3	Confident	67.1	Low	1 Å²	1	38.5 Å²	38.5	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123	170.3	-51.7	171.6	0	0	0	107.3	I20 V75 I141 F445 I447	I18-I20 HydrophobicContact CG2-CD1 4.38Å; I18-I20 HydrophobicContact CG2-CG1 3.94Å; I18-V75 HydrophobicContact CB-CB 4.43Å; I18-V75 PolarHBondContact N-O 2.92Å; I18-V75 PolarHBondContact O-N 3.15Å; I18-I141 HydrophobicContact CD1-CD1 4.37Å; I18-F445 HydrophobicContact CG2-CD1 4.41Å; I18-I447 HydrophobicContact CD1-CD1 4.46Å; I18-I447 HydrophobicContact CD1-CG1 3.8Å; I18-I447 HydrophobicContact CG1-CB 4.35Å; I18-I447 HydrophobicContact CG1-CG1 3.67Å
19	K	85.6	Confident	67.6	Low	25 Å²	25	44 Å²	44	11%	0.109	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.3	175.9	-70.5	-140.5	-170.1	-172.6	0	111.1	E68 V72 L73 T366 H367 L370 F443	K19-E68 IonicContact NZ-OE1 2.76Å; K19-E68 PolarHBondContact NZ-OE1 3.48Å; K19-E68 IonicContact NZ-OE2 2.69Å; K19-E68 PolarHBondContact NZ-OE2 3.11Å; K19-V72 HydrophobicContact CB-CG1 4.36Å; K19-V72 HydrophobicContact CD-CG1 4.3Å; K19-L73 CarbonylContact C-O 3.52Å; K19-L73 WeakPolarHBondContact CA-O 3.45Å; K19-T366 VanDerWaalsContact CE-O 3.25Å; K19-T366 WeakPolarHBondContact CE-O 3.25Å; K19-T366 PolarHBondContact NZ-O 3.32Å; K19-H367 PolarHBondContact NZ-O 3.01Å; K19-H367 VanDerWaalsContact NZ-O 3.11Å; K19-L370 HydrophobicContact CB-CD1 3.83Å; K19-L370 HydrophobicContact CD-CD1 3.43Å; K19-L370 VanDerWaalsContact CD-CD1 3.43Å; K19-L370 HydrophobicContact CG-CD1 3.57Å; K19-F443 WeakPolarHBondContact O-CE2 3.25Å; K19-F443 WeakPolarHBondContact O-CZ 3.38Å
20	I	81.3	Confident	67.8	Low	1 Å²	1	44.6 Å²	44.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.5	-175.2	-55.8	173.5	0	0	0	109.1	I18 V22 F48 V72 L73 V75 I141	I18-I20 HydrophobicContact CG2-CD1 4.38Å; I18-I20 HydrophobicContact CG2-CG1 3.94Å; I20-V22 HydrophobicContact CG2-CG2 4.2Å; I20-V22 PolarHBondContact O-N 3.3Å; I20-F48 HydrophobicContact CD1-CE1 4.28Å; I20-F48 HydrophobicContact CD1-CE2 3.54Å; I20-F48 HydrophobicContact CD1-CZ 3.28Å; I20-V72 WeakPolarHBondContact O-CA 3.42Å; I20-L73 PolarHBondContact N-O 2.99Å; I20-L73 PolarHBondContact O-N 3.03Å; I20-V75 HydrophobicContact CD1-CG2 3.9Å; I20-I141 HydrophobicContact CD1-CG2 4.28Å
21	P	77	Confident	68.2	Low	39 Å²	39	43.6 Å²	43.6	25%	0.253	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.9	171.2	29.9	-31.4	0	0	0	110.1	A151 F443	P21-A151 WeakPolarHBondContact O-CB 3.48Å; P21-F443 HydrophobicContact CG-CB 4.08Å; P21-F443 HydrophobicContact CG-CD1 4.42Å; P21-F443 HydrophobicContact CG-CD2 3.94Å; P21-F443 HydrophobicContact CG-CG 3.84Å
22	V	75.2	Confident	68	Low	3 Å²	3	48.5 Å²	48.5	2%	0.018	30%	0.297	C	S	.	.			trans	-110.3	74.7	-179.1	-168.8	0	0	0	0	108.9	I20 V40 C44 E71 L73 I150	I20-V22 HydrophobicContact CG2-CG2 4.2Å; I20-V22 PolarHBondContact O-N 3.3Å; V22-V40 HydrophobicContact CG1-CB 4.42Å; V22-V40 HydrophobicContact CG1-CG1 4.45Å; V22-C44 HydrophobicContact CG1-CB 4.38Å; V22-C44 HydrophobicContact CG2-CB 4.42Å; V22-E71 WeakPolarHBondContact CA-O 3.32Å; V22-E71 WeakPolarHBondContact CB-O 3.3Å; V22-E71 PolarHBondContact N-O 2.92Å; V22-E71 WeakPolarHBondContact O-CB 3.28Å; V22-L73 HydrophobicContact CG2-CD1 4.09Å; V22-L73 HydrophobicContact CG2-CG 4.03Å; V22-I150 WeakPolarHBondContact CG1-O 3.28Å
23	S	65.8	Low	67.1	Low	54 Å²	54	51.8 Å²	51.8	38%	0.378	30%	0.3	S	S	.	.			trans	-113.6	133.5	171.6	47.2	0	0	0	0	110.7	D152	S23-D152 PolarHBondContact OG-OD2 3.12Å
24	L	56.3	Low	65.1	Low	58 Å²	58	53 Å²	53	30%	0.304	32%	0.316	S	S	.	.			trans	-99.2	113.9	158.5	-104.5	126.3	0	0	0	107.2	G26 L27 V40 I150	L24-G26 PolarHBondContact O-N 3.41Å; L24-L27 HydrophobicContact CB-CB 4.49Å; L24-L27 HydrophobicContact CB-CD1 4.05Å; L24-L27 HydrophobicContact CB-CG 4.15Å; L24-L27 HydrophobicContact CD1-CD1 3.71Å; L24-L27 HydrophobicContact CD1-CG 4.47Å; L24-L27 HydrophobicContact CD2-CD1 4.21Å; L24-L27 HydrophobicContact CD2-CG 4.1Å; L24-L27 HydrophobicContact CG-CD1 4.21Å; L24-L27 HydrophobicContact CG-CG 4.48Å; L24-V40 HydrophobicContact CD1-CG1 4.31Å; L24-V40 HydrophobicContact CD1-CG2 4.23Å; L24-I150 HydrophobicContact CD1-CB 4.02Å; L24-I150 HydrophobicContact CD1-CG2 3.85Å
25	S	49.3	Very low	63	Low	37 Å²	37	57.4 Å²	57.4	26%	0.259	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	4	175.9	56.5	0	0	0	0	115	P407	S25-P407 WeakPolarHBondContact CB-O 3.43Å; S25-P407 PolarHBondContact OG-O 3.33Å
26	G	45.3	Very low	61	Low	61 Å²	61	62.6 Å²	62.6	63%	0.629	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.6	3.6	-170.2	0	0	0	0	0	118.2	L24	L24-G26 PolarHBondContact O-N 3.41Å
27	L	46.1	Very low	59.6	Low	83 Å²	83	68.1 Å²	68.1	44%	0.435	39%	0.393	S	S	.	.			trans	-88.3	121	174.6	-73.7	172.3	0	0	0	110.3	L24 V40	L24-L27 HydrophobicContact CB-CB 4.49Å; L24-L27 HydrophobicContact CB-CD1 4.05Å; L24-L27 HydrophobicContact CB-CG 4.15Å; L24-L27 HydrophobicContact CD1-CD1 3.71Å; L24-L27 HydrophobicContact CD1-CG 4.47Å; L24-L27 HydrophobicContact CD2-CD1 4.21Å; L24-L27 HydrophobicContact CD2-CG 4.1Å; L24-L27 HydrophobicContact CG-CD1 4.21Å; L24-L27 HydrophobicContact CG-CG 4.48Å; L27-V40 HydrophobicContact CD1-CG2 3.85Å
28	T	45	Very low	58.5	Low	101 Å²	101	72.2 Å²	72.2	62%	0.62	41%	0.414	S	S	*	.			trans	-59	137.3	165.3	50.7	0	0	0	0	109.3	M30	T28-M30 PolarHBondContact O-N 3.36Å; T28-M30 PolarHBondContact OG1-O 3.25Å
29	E	50.6	Low	58	Low	170 Å²	170	74.8 Å²	74.8	79%	0.794	43%	0.431	S	S	*	.	S	Bend	trans	-59.8	-13.3	-178.3	-69.4	-177.4	160.4	0	0	113.5	P36 R37	E29-P36 CarbonylContact O-C 3.55Å; E29-P36 VanDerWaalsContact O-CA 3.31Å; E29-P36 WeakPolarHBondContact O-CA 3.48Å; E29-R37 PolarHBondContact O-N 3.28Å
30	M	42.4	Very low	57.6	Low	107 Å²	107	75 Å²	75	53%	0.527	43%	0.434	S	S	.	.	B	Isolated β-bridge	trans	-107.7	140.1	-178.5	-53.7	-170.6	82.2	0	0	111.7	T28 G34 L35	T28-M30 PolarHBondContact O-N 3.36Å; T28-M30 PolarHBondContact OG1-O 3.25Å; M30-G34 VanDerWaalsContact CE-C 3.46Å; M30-G34 VanDerWaalsContact CE-CA 3.49Å; M30-G34 WeakPolarHBondContact CE-O 3.32Å; M30-L35 CarbonylContact C-O 3.53Å; M30-L35 WeakPolarHBondContact CA-O 3.28Å
31	D	51.4	Low	57.7	Low	47 Å²	47	75 Å²	75	25%	0.251	43%	0.434	S	S	.	.			trans	-74.3	-179.9	167.8	76.6	-0.2	0	0	0	111.3	N33 G34 L35 R37	D31-N33 PolarHBondContact O-N 2.93Å; D31-N33 VanDerWaalsContact O-N 3.09Å; D31-N33 VanDerWaalsContact OD1-C 3.25Å; D31-N33 VanDerWaalsContact OD1-CA 3.28Å; D31-N33 WeakPolarHBondContact OD1-CA 3.47Å; D31-N33 WeakPolarHBondContact OD1-CB 3.31Å; D31-N33 PolarHBondContact OD1-N 3.01Å; D31-G34 PolarHBondContact O-N 3.43Å; D31-G34 VanDerWaalsContact O-N 3.15Å; D31-G34 PolarHBondContact OD1-N 2.99Å; D31-L35 PolarHBondContact N-O 3.35Å; D31-L35 PolarHBondContact OD1-N 3.13Å; D31-R37 HydrophobicContact CB-CG 3.68Å
32	V	48.9	Very low	58.1	Low	137 Å²	137	73.5 Å²	73.5	83%	0.83	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-20	179.8	-170.3	0	0	0	0	112.1
33	N	46.5	Very low	58.4	Low	135 Å²	135	75.2 Å²	75.2	72%	0.722	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	4.7	-176.8	-61.1	-25.7	0	0	0	113.1	D31 L35	D31-N33 PolarHBondContact O-N 2.93Å; D31-N33 VanDerWaalsContact O-N 3.09Å; D31-N33 VanDerWaalsContact OD1-C 3.25Å; D31-N33 VanDerWaalsContact OD1-CA 3.28Å; D31-N33 WeakPolarHBondContact OD1-CA 3.47Å; D31-N33 WeakPolarHBondContact OD1-CB 3.31Å; D31-N33 PolarHBondContact OD1-N 3.01Å; N33-L35 VanDerWaalsContact C-N 3.32Å
34	G	42.1	Very low	59.4	Low	39 Å²	39	72.6 Å²	72.6	40%	0.402	42%	0.417	S	S	.	.	S	Bend	trans	74.7	17.7	-178.1	0	0	0	0	0	114.5	M30 D31	M30-G34 VanDerWaalsContact CE-C 3.46Å; M30-G34 VanDerWaalsContact CE-CA 3.49Å; M30-G34 WeakPolarHBondContact CE-O 3.32Å; D31-G34 PolarHBondContact O-N 3.43Å; D31-G34 VanDerWaalsContact O-N 3.15Å; D31-G34 PolarHBondContact OD1-N 2.99Å
35	L	45.2	Very low	61.1	Low	106 Å²	106	71.3 Å²	71.3	56%	0.555	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-91.1	144.3	169.3	-68.6	167.9	0	0	0	109.9	M30 D31 N33 R37	M30-L35 CarbonylContact C-O 3.53Å; M30-L35 WeakPolarHBondContact CA-O 3.28Å; D31-L35 PolarHBondContact N-O 3.35Å; D31-L35 PolarHBondContact OD1-N 3.13Å; N33-L35 VanDerWaalsContact C-N 3.32Å; L35-R37 PolarHBondContact O-N 3.34Å; L35-R37 VanDerWaalsContact O-N 3.16Å
36	P	51.7	Low	63	Low	109 Å²	109	69.5 Å²	69.5	71%	0.708	40%	0.396	S	S	*	.	B	Isolated β-bridge	trans	-58.5	123.3	174.5	22.6	-30.7	0	0	0	109.5	E29 L38	E29-P36 CarbonylContact O-C 3.55Å; E29-P36 VanDerWaalsContact O-CA 3.31Å; E29-P36 WeakPolarHBondContact O-CA 3.48Å; P36-L38 PolarHBondContact O-N 3.01Å
37	R	64.3	Low	65.1	Low	116 Å²	116	67.4 Å²	67.4	44%	0.438	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-64	135.8	174.1	-86.8	-178.4	165	162.6	-3.4	108.9	E29 D31 L35	E29-R37 PolarHBondContact O-N 3.28Å; D31-R37 HydrophobicContact CB-CG 3.68Å; L35-R37 PolarHBondContact O-N 3.34Å; L35-R37 VanDerWaalsContact O-N 3.16Å
38	L	71.2	Confident	67.2	Low	87 Å²	87	63.5 Å²	63.5	46%	0.455	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-52.6	127.4	171.4	-118.1	132.5	0	0	0	109.4	P36 V40 V42 A697	P36-L38 PolarHBondContact O-N 3.01Å; L38-V40 PolarHBondContact O-N 2.9Å; L38-V42 HydrophobicContact CD2-CB 3.71Å; L38-V42 HydrophobicContact CD2-CG1 3.43Å; L38-V42 VanDerWaalsContact CD2-CG1 3.43Å; L38-V42 HydrophobicContact CD2-CG2 4.03Å; L38-A697 WeakPolarHBondContact CD1-O 3.26Å; L38-A697 HydrophobicContact CD2-CB 3.81Å
39	P	76.8	Confident	69.5	Low	55 Å²	55	60.4 Å²	60.4	36%	0.357	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-57.8	139	-178.5	-21.7	29.7	0	0	0	110.8	S41 V42 E71	P39-S41 PolarHBondContact O-N 2.86Å; P39-V42 HydrophobicContact CB-CG2 4.16Å; P39-V42 HydrophobicContact CG-CG2 4.33Å; P39-V42 WeakPolarHBondContact O-CB 3.4Å; P39-V42 WeakPolarHBondContact O-CG2 3.25Å; P39-V42 PolarHBondContact O-N 3.03Å; P39-E71 VanDerWaalsContact CB-OE1 3.26Å; P39-E71 WeakPolarHBondContact CB-OE1 3.23Å
40	V	76.6	Confident	71.3	Confident	30 Å²	30	58.1 Å²	58.1	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-68.7	-28	-168.5	-167.1	0	0	0	0	111.9	V22 L24 L27 L38 V42 T43 C44 E71 I150	V22-V40 HydrophobicContact CG1-CB 4.42Å; V22-V40 HydrophobicContact CG1-CG1 4.45Å; L24-V40 HydrophobicContact CD1-CG1 4.31Å; L24-V40 HydrophobicContact CD1-CG2 4.23Å; L27-V40 HydrophobicContact CD1-CG2 3.85Å; L38-V40 PolarHBondContact O-N 2.9Å; V40-V42 PolarHBondContact O-N 2.64Å; V40-T43 PolarHBondContact O-N 3.26Å; V40-C44 PolarHBondContact O-N 3.02Å; V40-E71 PolarHBondContact N-OE2 2.94Å; V40-I150 HydrophobicContact CG1-CB 3.29Å; V40-I150 HydrophobicContact CG1-CD1 3.65Å; V40-I150 HydrophobicContact CG1-CG1 4.05Å; V40-I150 HydrophobicContact CG1-CG2 3.27Å
41	S	83.9	Confident	73.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-24.5	168.8	59.6	0	0	0	0	114	P39 C44 Y45 R67 E71	P39-S41 PolarHBondContact O-N 2.86Å; S41-C44 PolarHBondContact O-N 3.01Å; S41-Y45 WeakPolarHBondContact O-CB 3.27Å; S41-Y45 PolarHBondContact O-N 3.11Å; S41-R67 PolarHBondContact OG-NE 2.92Å; S41-R67 PolarHBondContact OG-NH2 3.34Å; S41-E71 WeakPolarHBondContact CB-OE2 3.48Å; S41-E71 PolarHBondContact N-OE2 2.98Å; S41-E71 PolarHBondContact OG-OE1 3.49Å; S41-E71 PolarHBondContact OG-OE2 3.05Å
42	V	85.5	Confident	75.6	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.048	28%	0.283	C	S	.	.	H	α-helix	trans	-68.9	-45.8	177.1	-180	0	0	0	0	111	L38 P39 V40 C44 Y45 A46 P694 A697	L38-V42 HydrophobicContact CD2-CB 3.71Å; L38-V42 HydrophobicContact CD2-CG1 3.43Å; L38-V42 VanDerWaalsContact CD2-CG1 3.43Å; L38-V42 HydrophobicContact CD2-CG2 4.03Å; P39-V42 HydrophobicContact CB-CG2 4.16Å; P39-V42 HydrophobicContact CG-CG2 4.33Å; P39-V42 WeakPolarHBondContact O-CB 3.4Å; P39-V42 WeakPolarHBondContact O-CG2 3.25Å; P39-V42 PolarHBondContact O-N 3.03Å; V40-V42 PolarHBondContact O-N 2.64Å; V42-C44 VanDerWaalsContact C-N 3.32Å; V42-C44 PolarHBondContact O-N 3.47Å; V42-Y45 PolarHBondContact O-N 2.97Å; V42-A46 PolarHBondContact O-N 3.48Å; V42-A46 VanDerWaalsContact O-N 3.09Å; V42-P694 HydrophobicContact CG1-CB 4.12Å; V42-P694 WeakPolarHBondContact CG1-O 3.32Å; V42-A697 HydrophobicContact CG1-CB 4.33Å
43	T	82.3	Confident	77.4	Confident	39 Å²	39	51.8 Å²	51.8	24%	0.239	27%	0.269	C	S	.	.	H	α-helix	trans	-61.6	-43.6	174.1	-56.8	0	0	0	0	110.8	V40 A46 R47	V40-T43 PolarHBondContact O-N 3.26Å; T43-A46 PolarHBondContact O-N 3.23Å; T43-R47 PolarHBondContact O-N 3.44Å; T43-R47 VanDerWaalsContact O-N 3.16Å
44	C	86.3	Confident	79.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.8	-43	179.3	-166.5	0	0	0	0	112.2	V22 V40 S41 V42 A46 R47 F48 L73 A144 T145 I150	V22-C44 HydrophobicContact CG1-CB 4.38Å; V22-C44 HydrophobicContact CG2-CB 4.42Å; V40-C44 PolarHBondContact O-N 3.02Å; S41-C44 PolarHBondContact O-N 3.01Å; V42-C44 VanDerWaalsContact C-N 3.32Å; V42-C44 PolarHBondContact O-N 3.47Å; C44-A46 PolarHBondContact O-N 2.91Å; C44-R47 PolarHBondContact O-N 3.09Å; C44-F48 WeakPolarHBondContact O-CD2 3.29Å; C44-F48 PolarHBondContact O-N 2.76Å; C44-L73 HydrophobicContact CB-CD1 3.67Å; C44-L73 WeakPolarHBondContact SG-CD1 3.23Å; C44-A144 WeakPolarHBondContact CA-O 3.32Å; C44-A144 PolarHBondContact SG-O 2.65Å; C44-T145 VanDerWaalsContact SG-CG2 3.54Å; C44-I150 HydrophobicContact CB-CD1 3.79Å
45	Y	90.9	Very high	81.7	Confident	30 Å²	30	50.4 Å²	50.4	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-55.6	-49	174.4	169.5	-92.6	0	0	0	111.9	S41 V42 R47 F48 R49 V65 R67 P694 L695	S41-Y45 WeakPolarHBondContact O-CB 3.27Å; S41-Y45 PolarHBondContact O-N 3.11Å; V42-Y45 PolarHBondContact O-N 2.97Å; Y45-R47 PolarHBondContact O-N 3.47Å; Y45-F48 PolarHBondContact O-N 2.83Å; Y45-R49 VanDerWaalsContact CE1-CD 3.42Å; Y45-R49 HydrophobicContact CE1-CG 4.12Å; Y45-R49 HydrophobicContact CE2-CG 4.38Å; Y45-R49 PolarHBondContact O-N 2.92Å; Y45-R49 WeakPolarHBondContact OH-CD 3.48Å; Y45-R49 PolarHBondContact OH-NH1 2.87Å; Y45-V65 HydrophobicContact CD2-CG1 3.94Å; Y45-V65 HydrophobicContact CE2-CG1 4.48Å; Y45-V65 VanDerWaalsContact CE2-O 3.29Å; Y45-V65 WeakPolarHBondContact CE2-O 3.2Å; Y45-R67 HydrophobicContact CD2-CB 4.24Å; Y45-P694 HydrophobicContact CD1-CB 3.61Å; Y45-P694 HydrophobicContact CE1-CB 3.74Å; Y45-P694 HydrophobicContact CG-CB 4.23Å; Y45-L695 HydrophobicContact CE1-CB 4.14Å
46	A	89.5	Confident	84.1	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.9	-40.7	-179.1	0	0	0	0	0	112.5	V42 T43 C44 R49 R50 L695 S698 I700	V42-A46 PolarHBondContact O-N 3.48Å; V42-A46 VanDerWaalsContact O-N 3.09Å; T43-A46 PolarHBondContact O-N 3.23Å; C44-A46 PolarHBondContact O-N 2.91Å; A46-R49 PolarHBondContact O-N 2.99Å; A46-R50 PolarHBondContact O-N 3.47Å; A46-L695 HydrophobicContact CB-CD1 4.11Å; A46-S698 WeakPolarHBondContact CB-OG 3.29Å; A46-I700 HydrophobicContact CB-CB 4.27Å; A46-I700 HydrophobicContact CB-CD1 4.44Å
47	R	89.4	Confident	86.2	Confident	17 Å²	17	47.5 Å²	47.5	6%	0.064	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-41.1	175.5	-71.9	-176.5	167.7	163.2	-8	112.4	T43 C44 Y45 R50 L51 Y143 A144 D146 D186 I700	T43-R47 PolarHBondContact O-N 3.44Å; T43-R47 VanDerWaalsContact O-N 3.16Å; C44-R47 PolarHBondContact O-N 3.09Å; Y45-R47 PolarHBondContact O-N 3.47Å; R47-R50 VanDerWaalsContact O-CB 3.27Å; R47-R50 WeakPolarHBondContact O-CB 3.5Å; R47-R50 PolarHBondContact O-N 3.49Å; R47-L51 PolarHBondContact O-N 3.3Å; R47-Y143 HydrophobicContact CB-CD1 4.46Å; R47-Y143 HydrophobicContact CB-CE1 3.87Å; R47-Y143 VanDerWaalsContact CD-O 3.3Å; R47-Y143 WeakPolarHBondContact CD-O 3.31Å; R47-Y143 HydrophobicContact CG-CE1 4.23Å; R47-A144 HydrophobicContact CB-CB 4.05Å; R47-A144 WeakPolarHBondContact CD-O 3.29Å; R47-D146 IonicContact CZ-OD1 2.96Å; R47-D146 IonicContact NH1-OD1 3.27Å; R47-D146 PolarHBondContact NH1-OD1 3.02Å; R47-D146 IonicContact NH2-OD1 2.84Å; R47-D146 PolarHBondContact NH2-OD1 3.34Å; R47-D186 IonicContact CZ-OD1 3.42Å; R47-D186 IonicContact NH2-OD1 3.49Å; R47-D186 PolarHBondContact NH2-OD1 3.46Å; R47-I700 HydrophobicContact CB-CD1 4.25Å; R47-I700 HydrophobicContact CG-CD1 3.21Å
48	F	91.6	Very high	87.8	Confident	1 Å²	1	42.2 Å²	42.2	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-63.7	-41.6	174	-90.7	-63.9	0	0	0	112.1	I20 C44 Y45 R50 L51 L52 V65 L73 V75 I141 A144 T145	I20-F48 HydrophobicContact CD1-CE1 4.28Å; I20-F48 HydrophobicContact CD1-CE2 3.54Å; I20-F48 HydrophobicContact CD1-CZ 3.28Å; C44-F48 WeakPolarHBondContact O-CD2 3.29Å; C44-F48 PolarHBondContact O-N 2.76Å; Y45-F48 PolarHBondContact O-N 2.83Å; F48-R50 PolarHBondContact O-N 2.86Å; F48-L51 HydrophobicContact CD1-CD1 3.91Å; F48-L51 HydrophobicContact CE1-CD1 4.21Å; F48-L51 WeakPolarHBondContact O-CB 3.4Å; F48-L51 PolarHBondContact O-N 3.1Å; F48-L52 WeakPolarHBondContact O-CD1 3.37Å; F48-V65 HydrophobicContact CB-CB 4.34Å; F48-V65 HydrophobicContact CB-CG1 4.04Å; F48-V65 HydrophobicContact CB-CG2 3.56Å; F48-V65 HydrophobicContact CG-CG2 4.29Å; F48-L73 HydrophobicContact CD2-CD1 3.95Å; F48-L73 HydrophobicContact CE2-CD1 4.34Å; F48-V75 HydrophobicContact CD1-CG1 4.12Å; F48-V75 HydrophobicContact CD1-CG2 4Å; F48-V75 HydrophobicContact CD2-CG2 4.11Å; F48-V75 HydrophobicContact CE1-CG1 4.25Å; F48-V75 HydrophobicContact CE1-CG2 3.98Å; F48-V75 HydrophobicContact CE2-CG2 4.07Å; F48-V75 HydrophobicContact CG-CG2 4.1Å; F48-V75 HydrophobicContact CZ-CG2 4.03Å; F48-I141 HydrophobicContact CE1-CG1 4.25Å; F48-I141 HydrophobicContact CZ-CB 4.41Å; F48-I141 HydrophobicContact CZ-CG1 4.12Å; F48-I141 HydrophobicContact CZ-CG2 4.33Å; F48-A144 HydrophobicContact CD1-CB 3.84Å; F48-A144 HydrophobicContact CD2-CB 3.49Å; F48-A144 VanDerWaalsContact CD2-CB 3.49Å; F48-A144 HydrophobicContact CE1-CB 3.75Å; F48-A144 HydrophobicContact CE2-CB 3.4Å; F48-A144 VanDerWaalsContact CE2-CB 3.4Å; F48-A144 HydrophobicContact CG-CB 3.68Å; F48-A144 HydrophobicContact CZ-CB 3.52Å; F48-T145 HydrophobicContact CE2-CG2 4.3Å
49	R	92.4	Very high	89	Confident	36 Å²	36	38.2 Å²	38.2	14%	0.136	18%	0.179	C	C	.	.	H	α-helix	trans	-55.9	-33	174	-79.1	-164.1	66.8	176	-1.7	112.7	Y45 A46 L51 L52 R735 Y738	Y45-R49 VanDerWaalsContact CE1-CD 3.42Å; Y45-R49 HydrophobicContact CE1-CG 4.12Å; Y45-R49 HydrophobicContact CE2-CG 4.38Å; Y45-R49 PolarHBondContact O-N 2.92Å; Y45-R49 WeakPolarHBondContact OH-CD 3.48Å; Y45-R49 PolarHBondContact OH-NH1 2.87Å; A46-R49 PolarHBondContact O-N 2.99Å; R49-L51 VanDerWaalsContact C-N 3.3Å; R49-L51 PolarHBondContact O-N 2.82Å; R49-L52 WeakPolarHBondContact O-CB 3.09Å; R49-L52 PolarHBondContact O-N 3.19Å; R49-R735 PolarHBondContact NH2-O 3.14Å; R49-Y738 HydrophobicContact CB-CD1 3.85Å; R49-Y738 HydrophobicContact CB-CE1 3.51Å
50	R	89.1	Confident	89.8	Confident	121 Å²	121	35.6 Å²	35.6	46%	0.457	16%	0.163	S	C	.	.	H	α-helix	trans	-64	-36	175.4	-163.7	178.6	170.2	128.7	-2.3	112.2	A46 R47 F48 L52 H53 Y143 Y738	A46-R50 PolarHBondContact O-N 3.47Å; R47-R50 VanDerWaalsContact O-CB 3.27Å; R47-R50 WeakPolarHBondContact O-CB 3.5Å; R47-R50 PolarHBondContact O-N 3.49Å; F48-R50 PolarHBondContact O-N 2.86Å; R50-L52 PolarHBondContact O-N 3.41Å; R50-H53 PolarHBondContact O-N 2.88Å; R50-Y143 WeakPolarHBondContact CD-OH 3.43Å; R50-Y738 VanDerWaalsContact CB-OH 3.31Å; R50-Y738 WeakPolarHBondContact CB-OH 3.34Å
51	L	91.9	Very high	90.7	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-69.7	-16.9	-179.2	-59.8	176.3	0	0	0	113	R47 F48 R49 H53 I54 Y62 L116 Y143 A144	R47-L51 PolarHBondContact O-N 3.3Å; F48-L51 HydrophobicContact CD1-CD1 3.91Å; F48-L51 HydrophobicContact CE1-CD1 4.21Å; F48-L51 WeakPolarHBondContact O-CB 3.4Å; F48-L51 PolarHBondContact O-N 3.1Å; R49-L51 VanDerWaalsContact C-N 3.3Å; R49-L51 PolarHBondContact O-N 2.82Å; L51-H53 PolarHBondContact O-N 3.29Å; L51-I54 HydrophobicContact CD2-CD1 3.63Å; L51-I54 WeakPolarHBondContact O-CB 3.35Å; L51-I54 PolarHBondContact O-N 3.15Å; L51-I54 VanDerWaalsContact O-N 3.07Å; L51-Y62 HydrophobicContact CB-CD2 3.76Å; L51-Y62 HydrophobicContact CB-CE2 4.2Å; L51-Y62 HydrophobicContact CD1-CD2 4.43Å; L51-Y62 HydrophobicContact CD1-CE2 4.05Å; L51-L116 HydrophobicContact CD2-CD1 4.01Å; L51-L116 HydrophobicContact CD2-CD2 4.25Å; L51-Y143 HydrophobicContact CD1-CD1 4.4Å; L51-Y143 HydrophobicContact CD2-CD1 3.98Å; L51-Y143 HydrophobicContact CD2-CE1 4.22Å; L51-Y143 HydrophobicContact CG-CD1 4.34Å; L51-Y143 HydrophobicContact CG-CE1 4.49Å; L51-A144 HydrophobicContact CD1-CB 4.41Å
52	L	91.4	Very high	91.3	Very high	38 Å²	38	35.9 Å²	35.9	20%	0.199	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.7	176.3	-81.1	60.2	0	0	0	112.8	F48 R49 R50 I54 V65	F48-L52 WeakPolarHBondContact O-CD1 3.37Å; R49-L52 WeakPolarHBondContact O-CB 3.09Å; R49-L52 PolarHBondContact O-N 3.19Å; R50-L52 PolarHBondContact O-N 3.41Å; L52-I54 VanDerWaalsContact C-N 3.29Å; L52-V65 HydrophobicContact CD1-CG2 3.97Å
53	H	86.3	Confident	91.7	Very high	117 Å²	117	36 Å²	36	54%	0.542	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-21.2	176.1	-150	26.1	0	0	0	113.4	R50 L51 K55 P739	R50-H53 PolarHBondContact O-N 2.88Å; L51-H53 PolarHBondContact O-N 3.29Å; H53-K55 PolarHBondContact O-N 2.85Å; H53-P739 HydrophobicContact CB-CG 3.51Å
54	I	88.9	Confident	92.2	Very high	19 Å²	19	36.3 Å²	36.3	10%	0.097	16%	0.162	C	C	.	.			trans	-72.5	117.6	-174.5	-67.9	173.1	0	0	0	108.6	L51 L52 L59 F110 L116 Y139	L51-I54 HydrophobicContact CD2-CD1 3.63Å; L51-I54 WeakPolarHBondContact O-CB 3.35Å; L51-I54 PolarHBondContact O-N 3.15Å; L51-I54 VanDerWaalsContact O-N 3.07Å; L52-I54 VanDerWaalsContact C-N 3.29Å; I54-L59 HydrophobicContact CG2-CD1 4.16Å; I54-F110 HydrophobicContact CG2-CD1 4.49Å; I54-F110 HydrophobicContact CG2-CE1 3.55Å; I54-F110 HydrophobicContact CG2-CZ 4.23Å; I54-L116 HydrophobicContact CD1-CD1 3.39Å; I54-Y139 HydrophobicContact CD1-CE2 4.49Å; I54-Y139 HydrophobicContact CG2-CE2 4.04Å
55	K	91.4	Very high	92.6	Very high	126 Å²	126	36.5 Å²	36.5	55%	0.548	16%	0.163	S	C	.	.			trans	-128.9	124.2	174.6	-63.7	-171.7	-179.9	-168.3	0	109.4	H53 Q61	H53-K55 PolarHBondContact O-N 2.85Å; K55-Q61 HydrophobicContact CG-CG 4.47Å
56	H	95.8	Very high	92.6	Very high	33 Å²	33	37.1 Å²	37.1	15%	0.153	17%	0.17	C	C	.	.			trans	-149.2	144.4	176.6	179.2	-97	0	0	0	108.7	N58 L59 S106 A107 F110	H56-N58 PolarHBondContact ND1-N 3.24Å; H56-N58 VanDerWaalsContact ND1-N 3.12Å; H56-N58 PolarHBondContact O-N 3.45Å; H56-N58 VanDerWaalsContact O-N 3.11Å; H56-L59 HydrophobicContact CB-CB 4.13Å; H56-L59 HydrophobicContact CB-CD1 3.97Å; H56-L59 HydrophobicContact CB-CG 4.03Å; H56-L59 PolarHBondContact O-N 3.29Å; H56-S106 PolarHBondContact CE1-OG 3.02Å; H56-S106 PolarHBondContact NE2-OG 2.77Å; H56-S106 VanDerWaalsContact NE2-OG 3.08Å; H56-A107 PolarHBondContact CE1-N 3.41Å; H56-F110 HydrophobicContact CB-CD1 4.05Å; H56-F110 HydrophobicContact CB-CD2 4.45Å; H56-F110 HydrophobicContact CB-CE1 4.27Å; H56-F110 HydrophobicContact CB-CG 4.17Å; H56-F110 AromaticContact CD2-CD2 3.7Å; H56-F110 AromaticContact CD2-CG 3.62Å; H56-F110 AromaticContact CG-CG 3.97Å
57	H	94.3	Very high	92.6	Very high	120 Å²	120	41.6 Å²	41.6	56%	0.556	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.6	-174.8	49.7	-153.5	0	0	0	114.1	S106 K135	H57-S106 PolarHBondContact NE2-OG 3.07Å; H57-K135 WeakPolarHBondContact O-CD 3.33Å; H57-K135 WeakPolarHBondContact O-CE 3.35Å; H57-K135 PolarHBondContact O-NZ 3.2Å
58	N	97.4	Very high	92.3	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.032	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	14.2	-176.2	-55.6	125	0	0	0	113.9	H56 E103 A107 V134 I136	H56-N58 PolarHBondContact ND1-N 3.24Å; H56-N58 VanDerWaalsContact ND1-N 3.12Å; H56-N58 PolarHBondContact O-N 3.45Å; H56-N58 VanDerWaalsContact O-N 3.11Å; N58-E103 WeakPolarHBondContact CB-O 3.41Å; N58-E103 WeakPolarHBondContact OD1-CA 3.45Å; N58-E103 PolarHBondContact OD1-O 3.06Å; N58-A107 HydrophobicContact CB-CB 4Å; N58-V134 WeakPolarHBondContact CA-O 3.25Å; N58-V134 WeakPolarHBondContact CB-O 3.45Å; N58-V134 PolarHBondContact ND2-O 3.01Å; N58-I136 PolarHBondContact O-N 2.83Å
59	L	96.7	Very high	91.6	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-114.7	142.7	171.8	-68.1	-179	0	0	0	109.1	I54 H56 Q61 A107 F110 M111 I136 Y139	I54-L59 HydrophobicContact CG2-CD1 4.16Å; H56-L59 HydrophobicContact CB-CB 4.13Å; H56-L59 HydrophobicContact CB-CD1 3.97Å; H56-L59 HydrophobicContact CB-CG 4.03Å; H56-L59 PolarHBondContact O-N 3.29Å; L59-Q61 PolarHBondContact O-N 2.93Å; L59-A107 HydrophobicContact CD2-CB 3.67Å; L59-A107 HydrophobicContact CG-CB 4.14Å; L59-F110 HydrophobicContact CD1-CD1 3.8Å; L59-F110 HydrophobicContact CD1-CE1 4.27Å; L59-M111 HydrophobicContact CD1-CG 4.13Å; L59-M111 HydrophobicContact CD2-CG 4.4Å; L59-M111 HydrophobicContact CD2-SD 4.11Å; L59-I136 HydrophobicContact CD2-CB 4.04Å; L59-Y139 HydrophobicContact CB-CD1 4.31Å; L59-Y139 HydrophobicContact CB-CE1 3.68Å; L59-Y139 HydrophobicContact CD1-CD2 4.46Å; L59-Y139 HydrophobicContact CD1-CE1 4.25Å; L59-Y139 HydrophobicContact CD1-CE2 4.19Å; L59-Y139 HydrophobicContact CD2-CD1 3.84Å; L59-Y139 HydrophobicContact CD2-CE1 4.09Å; L59-Y139 HydrophobicContact CD2-CG 4.25Å; L59-Y139 HydrophobicContact CG-CD1 4.45Å; L59-Y139 HydrophobicContact CG-CE1 4.22Å
60	C	95.1	Very high	90.7	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.007	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-70.4	117.4	171.9	-66.5	0	0	0	0	109.7	Y62 E78 M127 I136 Y139	C60-Y62 PolarHBondContact O-N 3.22Å; C60-E78 WeakPolarHBondContact CA-OE2 3.42Å; C60-E78 HydrophobicContact CB-CB 4.04Å; C60-E78 WeakPolarHBondContact CB-O 3.11Å; C60-M127 WeakPolarHBondContact SG-CE 3.33Å; C60-I136 PolarHBondContact N-O 3.42Å; C60-Y139 WeakPolarHBondContact O-CE1 3.47Å; C60-Y139 PolarHBondContact O-OH 3.48Å
61	Q	95.2	Very high	90.2	Very high	33 Å²	33	49.6 Å²	49.6	15%	0.154	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-63.4	129.3	-179.3	-169.3	-171.5	-27	0	0	111.4	K55 L59 L63 C77 E78	K55-Q61 HydrophobicContact CG-CG 4.47Å; L59-Q61 PolarHBondContact O-N 2.93Å; Q61-L63 HydrophobicContact CB-CD2 4.21Å; Q61-L63 HydrophobicContact CG-CD2 4.06Å; Q61-C77 CarbonylContact O-C 3.53Å; Q61-C77 VanDerWaalsContact O-CA 3.29Å; Q61-C77 WeakPolarHBondContact O-CA 3.39Å; Q61-E78 HydrophobicContact CB-CB 4.44Å; Q61-E78 PolarHBondContact N-OE2 3.17Å; Q61-E78 PolarHBondContact O-N 2.87Å
62	Y	95.2	Very high	89.8	Confident	2 Å²	2	51 Å²	51	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.1	164.4	-71	-62.6	0	0	0	110.2	L51 C60 V75 C77 Y139	L51-Y62 HydrophobicContact CB-CD2 3.76Å; L51-Y62 HydrophobicContact CB-CE2 4.2Å; L51-Y62 HydrophobicContact CD1-CD2 4.43Å; L51-Y62 HydrophobicContact CD1-CE2 4.05Å; C60-Y62 PolarHBondContact O-N 3.22Å; Y62-V75 HydrophobicContact CD1-CG1 3.42Å; Y62-V75 VanDerWaalsContact CD1-CG1 3.42Å; Y62-V75 HydrophobicContact CE1-CG1 3.48Å; Y62-V75 VanDerWaalsContact CE1-CG1 3.48Å; Y62-V75 HydrophobicContact CG-CG1 4.5Å; Y62-C77 HydrophobicContact CD1-CB 3.82Å; Y62-C77 HydrophobicContact CE1-CB 4.15Å; Y62-Y139 HydrophobicContact CD2-CE1 4.48Å; Y62-Y139 HydrophobicContact CD2-CE2 4.09Å; Y62-Y139 AromaticContact CD2-CZ 3.85Å; Y62-Y139 HydrophobicContact CE2-CD1 4.42Å; Y62-Y139 HydrophobicContact CE2-CD2 4.12Å; Y62-Y139 HydrophobicContact CE2-CE1 4.03Å; Y62-Y139 AromaticContact CE2-CE2 3.7Å; Y62-Y139 HydrophobicContact CE2-CE2 3.7Å; Y62-Y139 HydrophobicContact CE2-CG 4.46Å; Y62-Y139 AromaticContact CE2-CZ 3.66Å; Y62-Y139 WeakPolarHBondContact CE2-O 3.44Å; Y62-Y139 PolarHBondContact OH-O 3.36Å
63	L	94.3	Very high	89.7	Confident	11 Å²	11	49.2 Å²	49.2	6%	0.058	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-43.5	-172.3	-53	-177.5	0	0	0	112.4	I15 Q61 V76 L352	I15-L63 HydrophobicContact CB-CD1 4.48Å; I15-L63 HydrophobicContact CD1-CD1 4.1Å; I15-L63 HydrophobicContact CG1-CD1 3.92Å; I15-L63 HydrophobicContact CG2-CD1 3.84Å; Q61-L63 HydrophobicContact CB-CD2 4.21Å; Q61-L63 HydrophobicContact CG-CD2 4.06Å; L63-V76 HydrophobicContact CB-CG1 4.24Å; L63-V76 HydrophobicContact CD1-CG1 4.32Å; L63-V76 PolarHBondContact N-O 3.01Å; L63-L352 HydrophobicContact CD1-CB 3.86Å; L63-L352 HydrophobicContact CD2-CB 3.63Å; L63-L352 HydrophobicContact CG-CB 4.42Å
64	D	93.8	Very high	89.9	Confident	46 Å²	46	43.6 Å²	43.6	25%	0.246	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	159.1	-177.9	-170.3	23.4	0	0	0	111	V76 Y356	D64-V76 HydrophobicContact CB-CB 4.28Å; D64-V76 PolarHBondContact N-O 3.1Å; D64-V76 PolarHBondContact O-N 2.84Å; D64-Y356 HydrophobicContact CB-CD1 4.06Å; D64-Y356 HydrophobicContact CB-CE1 3.49Å; D64-Y356 VanDerWaalsContact CB-CE1 3.49Å; D64-Y356 WeakPolarHBondContact OD2-CE1 3.3Å; D64-Y356 PolarHBondContact OD2-OH 3.33Å
65	V	93.4	Very high	90.1	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	122.4	175	179.4	0	0	0	0	108.7	Y45 F48 L52 S74 V75	Y45-V65 HydrophobicContact CD2-CG1 3.94Å; Y45-V65 HydrophobicContact CE2-CG1 4.48Å; Y45-V65 VanDerWaalsContact CE2-O 3.29Å; Y45-V65 WeakPolarHBondContact CE2-O 3.2Å; F48-V65 HydrophobicContact CB-CB 4.34Å; F48-V65 HydrophobicContact CB-CG1 4.04Å; F48-V65 HydrophobicContact CB-CG2 3.56Å; F48-V65 HydrophobicContact CG-CG2 4.29Å; L52-V65 HydrophobicContact CD1-CG2 3.97Å; V65-S74 WeakPolarHBondContact CA-O 2.91Å; V65-V75 HydrophobicContact CG1-CG2 4.31Å; V65-V75 HydrophobicContact CG2-CG1 4.15Å; V65-V75 HydrophobicContact CG2-CG2 4.36Å
66	V	91.3	Very high	90.3	Very high	44 Å²	44	36.8 Å²	36.8	27%	0.267	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.9	-178.8	-177.2	0	0	0	0	109.6	E68 L73 S74	V66-E68 HydrophobicContact CG1-CG 4.48Å; V66-E68 PolarHBondContact O-N 2.89Å; V66-L73 WeakPolarHBondContact O-CA 3.39Å; V66-S74 PolarHBondContact N-O 2.97Å; V66-S74 PolarHBondContact O-N 3.5Å
67	R	88.7	Confident	90.3	Very high	94 Å²	94	35.2 Å²	35.2	36%	0.355	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	109.5	170.6	-175.7	173.9	175.8	-95.2	-2	109.6	S41 Y45 E71 L73	S41-R67 PolarHBondContact OG-NE 2.92Å; S41-R67 PolarHBondContact OG-NH2 3.34Å; Y45-R67 HydrophobicContact CD2-CB 4.24Å; R67-E71 IonicContact CZ-OE1 3.99Å; R67-E71 IonicContact NH2-OE1 2.61Å; R67-E71 PolarHBondContact NH2-OE1 3.31Å; R67-L73 HydrophobicContact CB-CD2 3.86Å; R67-L73 HydrophobicContact CG-CD2 3.97Å
68	E	84.5	Confident	90.3	Very high	21 Å²	21	30 Å²	30	10%	0.098	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	168.3	177.3	-61.1	-170.5	-176.8	0	0	111.2	K19 V66 V72 S74 T366 H367	K19-E68 IonicContact NZ-OE1 2.76Å; K19-E68 PolarHBondContact NZ-OE1 3.48Å; K19-E68 IonicContact NZ-OE2 2.69Å; K19-E68 PolarHBondContact NZ-OE2 3.11Å; V66-E68 HydrophobicContact CG1-CG 4.48Å; V66-E68 PolarHBondContact O-N 2.89Å; E68-V72 HydrophobicContact CB-CB 4.36Å; E68-V72 PolarHBondContact N-O 2.81Å; E68-S74 WeakPolarHBondContact OE1-CB 3.31Å; E68-S74 PolarHBondContact OE1-OG 3.46Å; E68-T366 PolarHBondContact OE1-OG1 2.71Å; E68-T366 VanDerWaalsContact OE1-OG1 3.13Å; E68-H367 WeakPolarHBondContact OE1-CA 3.38Å; E68-H367 PolarHBondContact OE1-N 3.39Å; E68-H367 IonicContact OE2-CE1 3.63Å; E68-H367 IonicContact OE2-CG 3.19Å; E68-H367 IonicContact OE2-ND1 2.64Å; E68-H367 PolarHBondContact OE2-ND1 3.39Å
69	K	75.9	Confident	90.2	Very high	204 Å²	204	31.8 Å²	31.8	89%	0.887	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	146.1	172.3	-66.8	-175.8	178.2	-177.3	0	110.1
70	G	73.5	Confident	89.9	Confident	70 Å²	70	32.9 Å²	32.9	72%	0.722	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.6	33.5	178.5	0	0	0	0	0	114.5	V72	G70-V72 PolarHBondContact O-N 3.09Å
71	E	80	Confident	89.4	Confident	48 Å²	48	36 Å²	36	22%	0.224	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	34.2	179.1	-60.2	-71.9	109.3	0	0	114.3	V22 P39 V40 S41 R67	V22-E71 WeakPolarHBondContact CA-O 3.32Å; V22-E71 WeakPolarHBondContact CB-O 3.3Å; V22-E71 PolarHBondContact N-O 2.92Å; V22-E71 WeakPolarHBondContact O-CB 3.28Å; P39-E71 VanDerWaalsContact CB-OE1 3.26Å; P39-E71 WeakPolarHBondContact CB-OE1 3.23Å; V40-E71 PolarHBondContact N-OE2 2.94Å; S41-E71 WeakPolarHBondContact CB-OE2 3.48Å; S41-E71 PolarHBondContact N-OE2 2.98Å; S41-E71 PolarHBondContact OG-OE1 3.49Å; S41-E71 PolarHBondContact OG-OE2 3.05Å; R67-E71 IonicContact CZ-OE1 3.99Å; R67-E71 IonicContact NH2-OE1 2.61Å; R67-E71 PolarHBondContact NH2-OE1 3.31Å
72	V	83	Confident	89.2	Confident	33 Å²	33	35.4 Å²	35.4	20%	0.2	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.8	175.1	179.7	0	0	0	0	109.5	K19 I20 E68 G70	K19-V72 HydrophobicContact CB-CG1 4.36Å; K19-V72 HydrophobicContact CD-CG1 4.3Å; I20-V72 WeakPolarHBondContact O-CA 3.42Å; E68-V72 HydrophobicContact CB-CB 4.36Å; E68-V72 PolarHBondContact N-O 2.81Å; G70-V72 PolarHBondContact O-N 3.09Å
73	L	88.3	Confident	89	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.1	169.6	-62.3	-177.1	0	0	0	110.3	K19 I20 V22 C44 F48 V66 R67	K19-L73 CarbonylContact C-O 3.52Å; K19-L73 WeakPolarHBondContact CA-O 3.45Å; I20-L73 PolarHBondContact N-O 2.99Å; I20-L73 PolarHBondContact O-N 3.03Å; V22-L73 HydrophobicContact CG2-CD1 4.09Å; V22-L73 HydrophobicContact CG2-CG 4.03Å; C44-L73 HydrophobicContact CB-CD1 3.67Å; C44-L73 WeakPolarHBondContact SG-CD1 3.23Å; F48-L73 HydrophobicContact CD2-CD1 3.95Å; F48-L73 HydrophobicContact CE2-CD1 4.34Å; V66-L73 WeakPolarHBondContact O-CA 3.39Å; R67-L73 HydrophobicContact CB-CD2 3.86Å; R67-L73 HydrophobicContact CG-CD2 3.97Å
74	S	91.9	Very high	89	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	108.1	168.5	-76.6	0	0	0	0	108.7	V65 V66 E68	V65-S74 WeakPolarHBondContact CA-O 2.91Å; V66-S74 PolarHBondContact N-O 2.97Å; V66-S74 PolarHBondContact O-N 3.5Å; E68-S74 WeakPolarHBondContact OE1-CB 3.31Å; E68-S74 PolarHBondContact OE1-OG 3.46Å
75	V	93.1	Very high	88.6	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	114.1	-179.8	-176.6	0	0	0	0	108.7	V17 I18 I20 F48 Y62 V65	V17-V75 CarbonylContact C-O 3.44Å; V17-V75 WeakPolarHBondContact CA-O 3.44Å; I18-V75 HydrophobicContact CB-CB 4.43Å; I18-V75 PolarHBondContact N-O 2.92Å; I18-V75 PolarHBondContact O-N 3.15Å; I20-V75 HydrophobicContact CD1-CG2 3.9Å; F48-V75 HydrophobicContact CD1-CG1 4.12Å; F48-V75 HydrophobicContact CD1-CG2 4Å; F48-V75 HydrophobicContact CD2-CG2 4.11Å; F48-V75 HydrophobicContact CE1-CG1 4.25Å; F48-V75 HydrophobicContact CE1-CG2 3.98Å; F48-V75 HydrophobicContact CE2-CG2 4.07Å; F48-V75 HydrophobicContact CG-CG2 4.1Å; F48-V75 HydrophobicContact CZ-CG2 4.03Å; Y62-V75 HydrophobicContact CD1-CG1 3.42Å; Y62-V75 VanDerWaalsContact CD1-CG1 3.42Å; Y62-V75 HydrophobicContact CE1-CG1 3.48Å; Y62-V75 VanDerWaalsContact CE1-CG1 3.48Å; Y62-V75 HydrophobicContact CG-CG1 4.5Å; V65-V75 HydrophobicContact CG1-CG2 4.31Å; V65-V75 HydrophobicContact CG2-CG1 4.15Å; V65-V75 HydrophobicContact CG2-CG2 4.36Å
76	V	95.5	Very high	88.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	131.8	-179.8	-175.7	0	0	0	0	109.5	I15 G16 V17 L63 D64 Y356 T366 L450	I15-V76 HydrophobicContact CG2-CG1 3.52Å; G16-V76 WeakPolarHBondContact O-CA 3.23Å; V17-V76 HydrophobicContact CG2-CG2 4.35Å; L63-V76 HydrophobicContact CB-CG1 4.24Å; L63-V76 HydrophobicContact CD1-CG1 4.32Å; L63-V76 PolarHBondContact N-O 3.01Å; D64-V76 HydrophobicContact CB-CB 4.28Å; D64-V76 PolarHBondContact N-O 3.1Å; D64-V76 PolarHBondContact O-N 2.84Å; V76-Y356 HydrophobicContact CB-CE2 4.34Å; V76-Y356 HydrophobicContact CG1-CD2 3.74Å; V76-Y356 HydrophobicContact CG1-CE2 3.72Å; V76-Y356 HydrophobicContact CG1-CG 4.19Å; V76-Y356 HydrophobicContact CG2-CE2 3.92Å; V76-T366 HydrophobicContact CG2-CG2 4.02Å; V76-L450 HydrophobicContact CG1-CD1 4.36Å
77	C	95.5	Very high	88	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.007	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	164.6	-176	57	0	0	0	0	112.8	I15 G16 Q61 Y62	I15-C77 WeakPolarHBondContact CA-O 3.41Å; G16-C77 PolarHBondContact N-O 3.21Å; G16-C77 PolarHBondContact O-N 3.03Å; Q61-C77 CarbonylContact O-C 3.53Å; Q61-C77 VanDerWaalsContact O-CA 3.29Å; Q61-C77 WeakPolarHBondContact O-CA 3.39Å; Y62-C77 HydrophobicContact CD1-CB 3.82Å; Y62-C77 HydrophobicContact CE1-CB 4.15Å
78	E	94.9	Very high	87.3	Confident	9 Å²	9	38.7 Å²	38.7	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	137.3	164.7	-178.1	178.2	-168.6	0	0	110.7	P14 C60 Q61 Y80 K135 L352	P14-E78 WeakPolarHBondContact O-CA 3.08Å; C60-E78 WeakPolarHBondContact CA-OE2 3.42Å; C60-E78 HydrophobicContact CB-CB 4.04Å; C60-E78 WeakPolarHBondContact CB-O 3.11Å; Q61-E78 HydrophobicContact CB-CB 4.44Å; Q61-E78 PolarHBondContact N-OE2 3.17Å; Q61-E78 PolarHBondContact O-N 2.87Å; E78-Y80 HydrophobicContact CG-CD2 4.39Å; E78-Y80 HydrophobicContact CG-CE2 3.49Å; E78-Y80 VanDerWaalsContact CG-CE2 3.49Å; E78-Y80 WeakPolarHBondContact OE1-CE2 3.19Å; E78-Y80 VanDerWaalsContact OE1-CZ 3.28Å; E78-Y80 PolarHBondContact OE1-OH 3.37Å; E78-K135 WeakPolarHBondContact OE1-CE 3.33Å; E78-K135 IonicContact OE1-NZ 3.66Å; E78-K135 PolarHBondContact OE1-NZ 3.11Å; E78-K135 IonicContact OE2-NZ 2.77Å; E78-K135 PolarHBondContact OE2-NZ 3.29Å; E78-L352 HydrophobicContact CB-CD1 3.78Å; E78-L352 HydrophobicContact CG-CD1 3.62Å
79	Y	93.4	Very high	86.9	Confident	44 Å²	44	39.1 Å²	39.1	17%	0.173	24%	0.236	C	C	.	.			trans	-143.8	145.6	-176	171.1	-99.6	0	0	0	112	P14 M127 I447 P449	P14-Y79 CarbonylContact C-O 3.55Å; P14-Y79 VanDerWaalsContact CA-O 3.26Å; P14-Y79 WeakPolarHBondContact CA-O 3.23Å; P14-Y79 PolarHBondContact O-N 3.46Å; Y79-M127 HydrophobicContact CD2-SD 3.74Å; Y79-M127 HydrophobicContact CE2-SD 4.1Å; Y79-I447 HydrophobicContact CD2-CB 3.91Å; Y79-I447 HydrophobicContact CD2-CG2 3.42Å; Y79-I447 VanDerWaalsContact CD2-CG2 3.42Å; Y79-I447 HydrophobicContact CE2-CB 4.3Å; Y79-I447 HydrophobicContact CE2-CG2 4.2Å; Y79-I447 HydrophobicContact CG-CG2 4.04Å; Y79-P449 HydrophobicContact CD1-CB 3.87Å; Y79-P449 HydrophobicContact CE1-CB 3.57Å; Y79-P449 HydrophobicContact CE1-CG 4.04Å
80	Y	90.5	Very high	87.3	Confident	25 Å²	25	33.1 Å²	33.1	10%	0.098	22%	0.218	C	C	.	.			trans	-138	143.9	171.3	-57.4	-85	0	0	0	111.5	P14 E78 T82 M127 L128 D129 K135	P14-Y80 HydrophobicContact CB-CE1 4.37Å; E78-Y80 HydrophobicContact CG-CD2 4.39Å; E78-Y80 HydrophobicContact CG-CE2 3.49Å; E78-Y80 VanDerWaalsContact CG-CE2 3.49Å; E78-Y80 WeakPolarHBondContact OE1-CE2 3.19Å; E78-Y80 VanDerWaalsContact OE1-CZ 3.28Å; E78-Y80 PolarHBondContact OE1-OH 3.37Å; Y80-T82 VanDerWaalsContact C-N 3.29Å; Y80-T82 PolarHBondContact O-N 3.1Å; Y80-M127 PolarHBondContact N-SD 2.92Å; Y80-M127 VanDerWaalsContact N-SD 3.4Å; Y80-L128 VanDerWaalsContact CB-O 3.26Å; Y80-L128 WeakPolarHBondContact CB-O 3.42Å; Y80-D129 HydrophobicContact CD1-CB 4.15Å; Y80-D129 HydrophobicContact CD2-CB 4.28Å; Y80-D129 HydrophobicContact CE1-CB 3.7Å; Y80-D129 HydrophobicContact CE2-CB 3.85Å; Y80-D129 HydrophobicContact CG-CB 4.42Å; Y80-K135 HydrophobicContact CD2-CB 4.18Å; Y80-K135 HydrophobicContact CD2-CG 4.18Å; Y80-K135 HydrophobicContact CE2-CB 4.16Å; Y80-K135 HydrophobicContact CE2-CD 4.38Å; Y80-K135 HydrophobicContact CE2-CG 3.74Å
81	S	85.8	Confident	88	Confident	67 Å²	67	30.4 Å²	30.4	47%	0.469	19%	0.187	S	C	.	.	S	Bend	trans	-70.3	-24	-175	61.2	0	0	0	0	114.3
82	T	90.1	Very high	88.3	Confident	21 Å²	21	32.5 Å²	32.5	13%	0.129	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.9	-175.5	-54.2	0	0	0	0	109.2	Y80 M127 L128 W312	Y80-T82 VanDerWaalsContact C-N 3.29Å; Y80-T82 PolarHBondContact O-N 3.1Å; T82-M127 CarbonylContact O-C 3.43Å; T82-M127 VanDerWaalsContact O-CA 3.31Å; T82-M127 WeakPolarHBondContact O-CA 3.48Å; T82-L128 HydrophobicContact CG2-CB 4.35Å; T82-L128 HydrophobicContact CG2-CD1 4.18Å; T82-L128 PolarHBondContact O-N 2.87Å; T82-W312 HydrophobicContact CG2-CH2 3.67Å; T82-W312 HydrophobicContact CG2-CZ3 3.7Å
83	S	92.5	Very high	88.7	Confident	8 Å²	8	33.6 Å²	33.6	6%	0.056	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	171.1	179.1	69.1	0	0	0	0	111.6	S85 N86 I126	S83-S85 PolarHBondContact O-N 3.25Å; S83-S85 PolarHBondContact OG-N 3.41Å; S83-S85 PolarHBondContact OG-OG 3.22Å; S83-N86 PolarHBondContact N-OD1 3.15Å; S83-N86 WeakPolarHBondContact O-CB 3.44Å; S83-N86 PolarHBondContact O-N 2.71Å; S83-N86 PolarHBondContact O-OD1 3.39Å; S83-N86 VanDerWaalsContact O-OD1 3.1Å; S83-N86 PolarHBondContact OG-OD1 3.04Å; S83-I126 CarbonylContact C-O 3.56Å; S83-I126 VanDerWaalsContact CA-O 3.25Å; S83-I126 WeakPolarHBondContact CA-O 3.19Å; S83-I126 WeakPolarHBondContact CB-O 3.2Å
84	F	92.6	Very high	88.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-64.5	-21.4	176	-77.7	21.9	0	0	0	112.6	N86 F87 W96 R100 P123 I126 L128 V134 I202 F203 I206	F84-N86 PolarHBondContact O-N 2.77Å; F84-F87 HydrophobicContact CB-CD2 4.22Å; F84-F87 HydrophobicContact CB-CE2 4.32Å; F84-F87 HydrophobicContact CD1-CD2 4.31Å; F84-F87 AromaticContact CD1-CE2 3.58Å; F84-F87 HydrophobicContact CD1-CE2 3.58Å; F84-F87 HydrophobicContact CE1-CE2 4.02Å; F84-F87 HydrophobicContact CG-CD2 4.33Å; F84-F87 HydrophobicContact CG-CE2 4.04Å; F84-F87 WeakPolarHBondContact O-CD2 3.4Å; F84-F87 PolarHBondContact O-N 3.42Å; F84-W96 HydrophobicContact CE1-CH2 4.14Å; F84-W96 HydrophobicContact CZ-CH2 4.19Å; F84-R100 HydrophobicContact CZ-CB 4Å; F84-R100 HydrophobicContact CZ-CG 4.33Å; F84-P123 WeakPolarHBondContact CA-O 3.43Å; F84-P123 HydrophobicContact CB-CB 3.99Å; F84-P123 VanDerWaalsContact CB-O 3.31Å; F84-P123 WeakPolarHBondContact CB-O 3.26Å; F84-P123 PolarHBondContact N-O 2.92Å; F84-P123 VanDerWaalsContact N-O 3.09Å; F84-I126 HydrophobicContact CB-CB 4.27Å; F84-I126 HydrophobicContact CD1-CB 4.23Å; F84-I126 HydrophobicContact CD1-CG2 3.77Å; F84-I126 HydrophobicContact CD2-CB 4.04Å; F84-I126 HydrophobicContact CD2-CD1 4.11Å; F84-I126 HydrophobicContact CD2-CG2 3.76Å; F84-I126 HydrophobicContact CE1-CG2 3.79Å; F84-I126 HydrophobicContact CE2-CD1 4.47Å; F84-I126 HydrophobicContact CE2-CG2 3.81Å; F84-I126 HydrophobicContact CG-CB 3.92Å; F84-I126 HydrophobicContact CG-CG2 3.81Å; F84-I126 HydrophobicContact CZ-CG2 3.84Å; F84-I126 PolarHBondContact N-O 3.41Å; F84-L128 HydrophobicContact CE1-CD2 3.92Å; F84-L128 HydrophobicContact CE1-CG 4.27Å; F84-V134 HydrophobicContact CE1-CG2 4.48Å; F84-V134 HydrophobicContact CZ-CG2 4.28Å; F84-I202 HydrophobicContact CD2-CG2 3.89Å; F84-F203 AromaticContact CE2-CE2 3.73Å; F84-F203 HydrophobicContact CE2-CE2 3.73Å; F84-F203 AromaticContact CE2-CZ 3.75Å; F84-F203 HydrophobicContact CE2-CZ 3.75Å; F84-F203 HydrophobicContact CZ-CZ 4.24Å; F84-I206 HydrophobicContact CB-CD1 4.01Å; F84-I206 HydrophobicContact CD2-CD1 3.12Å; F84-I206 HydrophobicContact CE2-CD1 3.61Å; F84-I206 HydrophobicContact CG-CD1 3.77Å
85	S	86.8	Confident	88.5	Confident	46 Å²	46	38.6 Å²	38.6	32%	0.322	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-63.1	-21.4	172.6	75.8	0	0	0	0	113.9	S83 F87 P123	S83-S85 PolarHBondContact O-N 3.25Å; S83-S85 PolarHBondContact OG-N 3.41Å; S83-S85 PolarHBondContact OG-OG 3.22Å; S85-F87 VanDerWaalsContact C-N 3.35Å; S85-P123 PolarHBondContact N-O 3.49Å
86	N	86.8	Confident	88.5	Confident	77 Å²	77	40.1 Å²	40.1	41%	0.412	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-80.7	-10	-178.5	-59	103.9	0	0	0	114	S83 F84 W312	S83-N86 PolarHBondContact N-OD1 3.15Å; S83-N86 WeakPolarHBondContact O-CB 3.44Å; S83-N86 PolarHBondContact O-N 2.71Å; S83-N86 PolarHBondContact O-OD1 3.39Å; S83-N86 VanDerWaalsContact O-OD1 3.1Å; S83-N86 PolarHBondContact OG-OD1 3.04Å; F84-N86 PolarHBondContact O-N 2.77Å; N86-W312 HydrophobicContact CB-CH2 3.6Å; N86-W312 HydrophobicContact CB-CZ2 4.14Å
87	F	83.9	Confident	88.4	Confident	24 Å²	24	40.1 Å²	40.1	11%	0.105	24%	0.242	C	C	.	.			trans	-79.3	119	176.7	-61.1	-63.6	0	0	0	111.1	F84 S85 W96 L128 R210 W312	F84-F87 HydrophobicContact CB-CD2 4.22Å; F84-F87 HydrophobicContact CB-CE2 4.32Å; F84-F87 HydrophobicContact CD1-CD2 4.31Å; F84-F87 AromaticContact CD1-CE2 3.58Å; F84-F87 HydrophobicContact CD1-CE2 3.58Å; F84-F87 HydrophobicContact CE1-CE2 4.02Å; F84-F87 HydrophobicContact CG-CD2 4.33Å; F84-F87 HydrophobicContact CG-CE2 4.04Å; F84-F87 WeakPolarHBondContact O-CD2 3.4Å; F84-F87 PolarHBondContact O-N 3.42Å; S85-F87 VanDerWaalsContact C-N 3.35Å; F87-W96 HydrophobicContact CE1-CH2 4.34Å; F87-W96 AromaticContact CE2-CH2 3.78Å; F87-W96 HydrophobicContact CE2-CH2 3.78Å; F87-W96 HydrophobicContact CE2-CZ2 4.44Å; F87-W96 AromaticContact CZ-CH2 3.53Å; F87-W96 HydrophobicContact CZ-CH2 3.53Å; F87-W96 AromaticContact CZ-CZ2 3.81Å; F87-W96 HydrophobicContact CZ-CZ2 3.81Å; F87-L128 HydrophobicContact CZ-CD1 4.06Å; F87-R210 PolarHBondContact O-NE 3.18Å; F87-W312 HydrophobicContact CD1-CE3 4.06Å; F87-W312 HydrophobicContact CD1-CZ3 4.07Å; F87-W312 AromaticContact CE1-CE3 3.52Å; F87-W312 HydrophobicContact CE1-CE3 3.52Å; F87-W312 AromaticContact CE1-CZ3 3.54Å; F87-W312 HydrophobicContact CE1-CZ3 3.54Å; F87-W312 HydrophobicContact CZ-CE3 4.37Å; F87-W312 HydrophobicContact CZ-CZ3 4.06Å
88	S	75	Confident	88.3	Confident	113 Å²	113	40.3 Å²	40.3	79%	0.79	24%	0.243	S	C	*	.			trans	-96	-23.3	-178.5	60.9	0	0	0	0	114.2
89	G	76.7	Confident	88.2	Confident	31 Å²	31	44.3 Å²	44.3	32%	0.32	26%	0.261	S	S	.	.	S	Bend	trans	-123.1	168.3	-174.4	0	0	0	0	0	113.2	V91	G89-V91 PolarHBondContact O-N 3.17Å
90	P	84.3	Confident	88.3	Confident	77 Å²	77	42.8 Å²	42.8	50%	0.5	26%	0.255	S	S	.	.			trans	-60.8	132.3	174.5	25.8	-33.3	0	0	0	110.5	I206 I207	P90-I206 CarbonylContact C-O 3.58Å; P90-I206 WeakPolarHBondContact CA-O 3.01Å; P90-I207 WeakPolarHBondContact CB-O 3.47Å
91	V	87.9	Confident	88.5	Confident	13 Å²	13	41.6 Å²	41.6	8%	0.079	25%	0.251	C	S	.	.			trans	-98.3	122.6	170.7	-179.3	0	0	0	0	107.5	G89 W96 L97 I206	G89-V91 PolarHBondContact O-N 3.17Å; V91-W96 HydrophobicContact CG1-CE3 3.86Å; V91-W96 HydrophobicContact CG1-CZ3 4.12Å; V91-L97 HydrophobicContact CB-CD2 4.23Å; V91-L97 HydrophobicContact CG1-CD2 4.05Å; V91-L97 HydrophobicContact CG1-CG 4.07Å; V91-L97 WeakPolarHBondContact O-CD1 3.35Å; V91-I206 HydrophobicContact CB-CG2 3.79Å; V91-I206 HydrophobicContact CG2-CG2 3.69Å; V91-I206 PolarHBondContact N-O 3.35Å
92	T	86.7	Confident	89	Confident	93 Å²	93	39.3 Å²	39.3	57%	0.571	24%	0.235	S	C	*	.			trans	-112.2	-0.1	-177.1	59.4	0	0	0	0	113.4	V94	T92-V94 PolarHBondContact O-N 3.33Å; T92-V94 VanDerWaalsContact O-N 3.12Å
93	D	89.6	Confident	89.3	Confident	56 Å²	56	39.5 Å²	39.5	30%	0.299	23%	0.234	S	C	.	.			trans	-74.4	99.8	178.4	-175.5	-23.5	0	0	0	109.9	N95 W96 L97	D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 2.89Å; D93-N95 PolarHBondContact OD1-N 3.39Å; D93-W96 HydrophobicContact CB-CB 3.94Å; D93-W96 PolarHBondContact O-N 3.38Å; D93-W96 PolarHBondContact OD1-N 3.49Å; D93-L97 WeakPolarHBondContact O-CB 3.49Å; D93-L97 VanDerWaalsContact O-CG 3.24Å; D93-L97 WeakPolarHBondContact O-CG 3.43Å; D93-L97 PolarHBondContact O-N 3.47Å
94	V	89.4	Confident	89.6	Confident	21 Å²	21	39.1 Å²	39.1	13%	0.127	23%	0.231	C	C	.	.	H	α-helix	trans	-59.8	-42.7	-176.4	-176.9	0	0	0	0	111.7	T92 L97 S98 D260 L261	T92-V94 PolarHBondContact O-N 3.33Å; T92-V94 VanDerWaalsContact O-N 3.12Å; V94-L97 PolarHBondContact O-N 2.93Å; V94-S98 WeakPolarHBondContact O-CB 3.27Å; V94-S98 PolarHBondContact O-N 3.46Å; V94-S98 PolarHBondContact O-OG 3.4Å; V94-D260 HydrophobicContact CG1-CB 4.31Å; V94-D260 HydrophobicContact CG2-CB 4.28Å; V94-L261 HydrophobicContact CG2-CB 3.63Å; V94-L261 HydrophobicContact CG2-CD1 4.11Å; V94-L261 HydrophobicContact CG2-CG 4.37Å
95	N	88.4	Confident	89.9	Confident	84 Å²	84	39.1 Å²	39.1	45%	0.449	23%	0.231	S	C	.	.	H	α-helix	trans	-64.3	-45.9	-179.4	-76.4	-34.7	0	0	0	110.9	D93 Q99	D93-N95 VanDerWaalsContact C-N 3.34Å; D93-N95 PolarHBondContact O-N 2.89Å; D93-N95 PolarHBondContact OD1-N 3.39Å; N95-Q99 WeakPolarHBondContact O-CB 3.38Å; N95-Q99 VanDerWaalsContact O-CG 3.26Å; N95-Q99 WeakPolarHBondContact O-CG 3.32Å; N95-Q99 PolarHBondContact O-N 2.93Å
96	W	91.8	Very high	90.4	Very high	33 Å²	33	37.9 Å²	37.9	13%	0.125	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-48.2	177.2	-173.7	91.3	0	0	0	111.4	F84 F87 V91 D93 S98 Q99 R100 L128	F84-W96 HydrophobicContact CE1-CH2 4.14Å; F84-W96 HydrophobicContact CZ-CH2 4.19Å; F87-W96 HydrophobicContact CE1-CH2 4.34Å; F87-W96 AromaticContact CE2-CH2 3.78Å; F87-W96 HydrophobicContact CE2-CH2 3.78Å; F87-W96 HydrophobicContact CE2-CZ2 4.44Å; F87-W96 AromaticContact CZ-CH2 3.53Å; F87-W96 HydrophobicContact CZ-CH2 3.53Å; F87-W96 AromaticContact CZ-CZ2 3.81Å; F87-W96 HydrophobicContact CZ-CZ2 3.81Å; V91-W96 HydrophobicContact CG1-CE3 3.86Å; V91-W96 HydrophobicContact CG1-CZ3 4.12Å; D93-W96 HydrophobicContact CB-CB 3.94Å; D93-W96 PolarHBondContact O-N 3.38Å; D93-W96 PolarHBondContact OD1-N 3.49Å; W96-S98 PolarHBondContact O-N 2.98Å; W96-Q99 PolarHBondContact O-N 2.9Å; W96-R100 HydrophobicContact CD2-CG 3.86Å; W96-R100 HydrophobicContact CE3-CG 4Å; W96-R100 HydrophobicContact CH2-CG 3.81Å; W96-R100 HydrophobicContact CZ2-CG 3.65Å; W96-R100 HydrophobicContact CZ3-CG 3.98Å; W96-R100 VanDerWaalsContact O-CG 3.31Å; W96-R100 WeakPolarHBondContact O-CG 3.11Å; W96-R100 PolarHBondContact O-N 3.03Å; W96-L128 HydrophobicContact CZ2-CD1 4.26Å
97	L	93.4	Very high	90.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.5	-47.7	178.7	-73	166.1	0	0	0	111.7	V91 D93 V94 Q99 R100 F101 F203 I206 I207 L261 L264	V91-L97 HydrophobicContact CB-CD2 4.23Å; V91-L97 HydrophobicContact CG1-CD2 4.05Å; V91-L97 HydrophobicContact CG1-CG 4.07Å; V91-L97 WeakPolarHBondContact O-CD1 3.35Å; D93-L97 WeakPolarHBondContact O-CB 3.49Å; D93-L97 VanDerWaalsContact O-CG 3.24Å; D93-L97 WeakPolarHBondContact O-CG 3.43Å; D93-L97 PolarHBondContact O-N 3.47Å; V94-L97 PolarHBondContact O-N 2.93Å; L97-Q99 PolarHBondContact O-N 3.43Å; L97-R100 PolarHBondContact O-N 2.93Å; L97-F101 VanDerWaalsContact O-CB 3.32Å; L97-F101 WeakPolarHBondContact O-CB 3.29Å; L97-F101 PolarHBondContact O-N 3.4Å; L97-F203 HydrophobicContact CD2-CD1 4.38Å; L97-F203 HydrophobicContact CD2-CE1 4.44Å; L97-I206 HydrophobicContact CD2-CG2 3.91Å; L97-I207 HydrophobicContact CD1-CD1 4.3Å; L97-I207 HydrophobicContact CD1-CG1 3.77Å; L97-I207 HydrophobicContact CD2-CG1 4.05Å; L97-L261 HydrophobicContact CD1-CD1 3.67Å; L97-L264 HydrophobicContact CB-CD2 3.61Å; L97-L264 HydrophobicContact CD1-CD2 4.27Å
98	S	93.2	Very high	91.5	Very high	4 Å²	4	33.1 Å²	33.1	3%	0.028	20%	0.198	C	C	.	.	H	α-helix	trans	-62.5	-42.2	-178.8	-69	0	0	0	0	111.9	V94 W96 F101 S102 I289	V94-S98 WeakPolarHBondContact O-CB 3.27Å; V94-S98 PolarHBondContact O-N 3.46Å; V94-S98 PolarHBondContact O-OG 3.4Å; W96-S98 PolarHBondContact O-N 2.98Å; S98-F101 PolarHBondContact O-N 3.3Å; S98-S102 WeakPolarHBondContact O-CB 3.32Å; S98-S102 PolarHBondContact O-N 2.96Å; S98-I289 VanDerWaalsContact O-CD1 3.26Å; S98-I289 WeakPolarHBondContact O-CD1 3.32Å
99	Q	92.3	Very high	92.5	Very high	94 Å²	94	28.3 Å²	28.3	44%	0.439	17%	0.165	S	C	.	.	H	α-helix	trans	-62.4	-49.2	175.3	-73.4	176.2	4.9	0	0	112	N95 W96 L97 F101 S102 E103	N95-Q99 WeakPolarHBondContact O-CB 3.38Å; N95-Q99 VanDerWaalsContact O-CG 3.26Å; N95-Q99 WeakPolarHBondContact O-CG 3.32Å; N95-Q99 PolarHBondContact O-N 2.93Å; W96-Q99 PolarHBondContact O-N 2.9Å; L97-Q99 PolarHBondContact O-N 3.43Å; Q99-F101 VanDerWaalsContact C-N 3.32Å; Q99-F101 PolarHBondContact O-N 3.25Å; Q99-S102 PolarHBondContact O-N 3.26Å; Q99-E103 WeakPolarHBondContact O-CG 3.43Å; Q99-E103 PolarHBondContact O-N 2.91Å
100	R	95.5	Very high	93.4	Very high	12 Å²	12	29.5 Å²	29.5	5%	0.045	16%	0.161	C	C	.	.	H	α-helix	trans	-66.3	-35.2	-179.8	-59	-63.2	78.1	76.9	-6.3	112.1	F84 W96 L97 E103 C104 G132 V134 F203	F84-R100 HydrophobicContact CZ-CB 4Å; F84-R100 HydrophobicContact CZ-CG 4.33Å; W96-R100 HydrophobicContact CD2-CG 3.86Å; W96-R100 HydrophobicContact CE3-CG 4Å; W96-R100 HydrophobicContact CH2-CG 3.81Å; W96-R100 HydrophobicContact CZ2-CG 3.65Å; W96-R100 HydrophobicContact CZ3-CG 3.98Å; W96-R100 VanDerWaalsContact O-CG 3.31Å; W96-R100 WeakPolarHBondContact O-CG 3.11Å; W96-R100 PolarHBondContact O-N 3.03Å; L97-R100 PolarHBondContact O-N 2.93Å; R100-E103 IonicContact CZ-OE1 3.42Å; R100-E103 IonicContact CZ-OE2 3.87Å; R100-E103 IonicContact NE-OE1 3.07Å; R100-E103 IonicContact NE-OE2 3.97Å; R100-E103 PolarHBondContact NE-OE2 2.9Å; R100-E103 IonicContact NH2-OE1 2.72Å; R100-E103 PolarHBondContact NH2-OE1 3.4Å; R100-E103 IonicContact NH2-OE2 3.64Å; R100-E103 PolarHBondContact NH2-OE2 2.78Å; R100-E103 PolarHBondContact O-N 3.17Å; R100-C104 PolarHBondContact O-N 3.06Å; R100-C104 PolarHBondContact O-SG 2.95Å; R100-G132 PolarHBondContact NE-O 3.29Å; R100-V134 HydrophobicContact CB-CG2 4.03Å; R100-V134 HydrophobicContact CG-CG2 4.42Å; R100-F203 HydrophobicContact CB-CE1 4.43Å; R100-F203 HydrophobicContact CB-CZ 4.09Å
101	F	96.4	Very high	93.8	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-46.2	174.8	-167.6	-114.5	0	0	0	110.5	L97 S98 Q99 E103 C104 L105 L199 F203 L264 L267 I268 I289	L97-F101 VanDerWaalsContact O-CB 3.32Å; L97-F101 WeakPolarHBondContact O-CB 3.29Å; L97-F101 PolarHBondContact O-N 3.4Å; S98-F101 PolarHBondContact O-N 3.3Å; Q99-F101 VanDerWaalsContact C-N 3.32Å; Q99-F101 PolarHBondContact O-N 3.25Å; F101-E103 VanDerWaalsContact C-N 3.35Å; F101-E103 PolarHBondContact O-N 3.04Å; F101-C104 PolarHBondContact O-N 3.21Å; F101-L105 HydrophobicContact CD1-CD1 3.57Å; F101-L105 HydrophobicContact CD1-CG 4.23Å; F101-L105 HydrophobicContact CE1-CD1 3.51Å; F101-L105 HydrophobicContact CE1-CD2 4.5Å; F101-L105 HydrophobicContact CE1-CG 4.18Å; F101-L105 HydrophobicContact CG-CD1 4.36Å; F101-L105 HydrophobicContact CZ-CD1 4.22Å; F101-L105 HydrophobicContact CZ-CD2 4.42Å; F101-L105 HydrophobicContact CZ-CG 4.46Å; F101-L105 VanDerWaalsContact O-CG 3.27Å; F101-L105 WeakPolarHBondContact O-CG 3.5Å; F101-L105 PolarHBondContact O-N 3Å; F101-L199 HydrophobicContact CD2-CD2 4.08Å; F101-L199 HydrophobicContact CD2-CG 4.24Å; F101-L199 HydrophobicContact CE2-CD2 3.73Å; F101-L199 HydrophobicContact CE2-CG 3.88Å; F101-L199 HydrophobicContact CZ-CD2 4.45Å; F101-F203 VanDerWaalsContact CA-CZ 3.43Å; F101-F203 HydrophobicContact CB-CD1 4.1Å; F101-F203 HydrophobicContact CB-CE1 3.57Å; F101-F203 HydrophobicContact CB-CZ 3.8Å; F101-F203 HydrophobicContact CD2-CB 4.36Å; F101-F203 AromaticContact CD2-CD1 3.74Å; F101-F203 HydrophobicContact CD2-CD1 3.74Å; F101-F203 AromaticContact CD2-CD2 3.66Å; F101-F203 HydrophobicContact CD2-CD2 3.66Å; F101-F203 AromaticContact CD2-CE1 3.89Å; F101-F203 HydrophobicContact CD2-CE1 3.89Å; F101-F203 AromaticContact CD2-CE2 3.81Å; F101-F203 HydrophobicContact CD2-CE2 3.81Å; F101-F203 AromaticContact CD2-CG 3.62Å; F101-F203 HydrophobicContact CD2-CG 3.62Å; F101-F203 AromaticContact CD2-CZ 3.92Å; F101-F203 HydrophobicContact CD2-CZ 3.92Å; F101-F203 HydrophobicContact CE2-CB 4.48Å; F101-F203 HydrophobicContact CE2-CD2 4.2Å; F101-F203 HydrophobicContact CE2-CG 4.17Å; F101-F203 HydrophobicContact CG-CD1 4.31Å; F101-F203 HydrophobicContact CG-CE1 4.2Å; F101-F203 HydrophobicContact CG-CZ 4.38Å; F101-L264 HydrophobicContact CD1-CD1 4.47Å; F101-L267 HydrophobicContact CD1-CD2 4.43Å; F101-L267 HydrophobicContact CE1-CD2 3.94Å; F101-L267 HydrophobicContact CE1-CG 4.28Å; F101-I268 HydrophobicContact CE2-CG1 4.27Å; F101-I268 HydrophobicContact CZ-CG1 4.27Å; F101-I289 HydrophobicContact CB-CD1 3.99Å; F101-I289 HydrophobicContact CD1-CD1 3.56Å; F101-I289 HydrophobicContact CG-CD1 4.25Å
102	S	95.8	Very high	94	Very high	19 Å²	19	27.7 Å²	27.7	13%	0.133	15%	0.151	C	C	.	.	H	α-helix	trans	-58.4	-43.6	175.5	-172.7	0	0	0	0	112.4	S98 Q99 L105 S106	S98-S102 WeakPolarHBondContact O-CB 3.32Å; S98-S102 PolarHBondContact O-N 2.96Å; Q99-S102 PolarHBondContact O-N 3.26Å; S102-L105 PolarHBondContact O-N 2.97Å; S102-S106 PolarHBondContact O-N 2.88Å
103	E	96.9	Very high	94.2	Very high	24 Å²	24	27.9 Å²	27.9	11%	0.112	15%	0.149	C	C	.	.	H	α-helix	trans	-62.8	-43.4	175.5	-73.5	172.1	179.3	0	0	112.7	N58 Q99 R100 F101 L105 S106 A107 H133 V134	N58-E103 WeakPolarHBondContact CB-O 3.41Å; N58-E103 WeakPolarHBondContact OD1-CA 3.45Å; N58-E103 PolarHBondContact OD1-O 3.06Å; Q99-E103 WeakPolarHBondContact O-CG 3.43Å; Q99-E103 PolarHBondContact O-N 2.91Å; R100-E103 IonicContact CZ-OE1 3.42Å; R100-E103 IonicContact CZ-OE2 3.87Å; R100-E103 IonicContact NE-OE1 3.07Å; R100-E103 IonicContact NE-OE2 3.97Å; R100-E103 PolarHBondContact NE-OE2 2.9Å; R100-E103 IonicContact NH2-OE1 2.72Å; R100-E103 PolarHBondContact NH2-OE1 3.4Å; R100-E103 IonicContact NH2-OE2 3.64Å; R100-E103 PolarHBondContact NH2-OE2 2.78Å; R100-E103 PolarHBondContact O-N 3.17Å; F101-E103 VanDerWaalsContact C-N 3.35Å; F101-E103 PolarHBondContact O-N 3.04Å; E103-L105 VanDerWaalsContact C-N 3.34Å; E103-L105 PolarHBondContact O-N 3.17Å; E103-S106 WeakPolarHBondContact O-CB 3.46Å; E103-S106 PolarHBondContact O-N 2.9Å; E103-A107 PolarHBondContact O-N 3.49Å; E103-A107 VanDerWaalsContact O-N 3.12Å; E103-H133 IonicContact OE1-CE1 3.8Å; E103-H133 IonicContact OE1-CG 3.23Å; E103-H133 IonicContact OE1-ND1 3.58Å; E103-H133 PolarHBondContact OE1-ND1 3.32Å; E103-V134 HydrophobicContact CB-CB 3.9Å; E103-V134 HydrophobicContact CB-CG2 4.09Å; E103-V134 WeakPolarHBondContact OE2-CB 3.46Å; E103-V134 WeakPolarHBondContact OE2-CG2 3.46Å; E103-V134 PolarHBondContact OE2-N 2.77Å
104	C	98.1	Very high	94.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-43.6	174.2	-67.1	0	0	0	0	111.5	R100 F101 S106 A107 L108 I136 L199	R100-C104 PolarHBondContact O-N 3.06Å; R100-C104 PolarHBondContact O-SG 2.95Å; F101-C104 PolarHBondContact O-N 3.21Å; C104-S106 VanDerWaalsContact C-N 3.33Å; C104-S106 PolarHBondContact O-N 3.19Å; C104-A107 WeakPolarHBondContact O-CB 3.47Å; C104-A107 PolarHBondContact O-N 3.19Å; C104-L108 WeakPolarHBondContact O-CG 3.49Å; C104-L108 PolarHBondContact O-N 2.85Å; C104-I136 HydrophobicContact CB-CD1 4.43Å; C104-L199 HydrophobicContact CB-CD1 3.55Å; C104-L199 HydrophobicContact CB-CD2 3.81Å; C104-L199 HydrophobicContact CB-CG 4.34Å
105	L	97.9	Very high	93.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.4	-35.7	177.6	-69.3	172.9	0	0	0	112.4	F101 S102 E103 A107 L108 S109 L199 P282 L285 M286 I289	F101-L105 HydrophobicContact CD1-CD1 3.57Å; F101-L105 HydrophobicContact CD1-CG 4.23Å; F101-L105 HydrophobicContact CE1-CD1 3.51Å; F101-L105 HydrophobicContact CE1-CD2 4.5Å; F101-L105 HydrophobicContact CE1-CG 4.18Å; F101-L105 HydrophobicContact CG-CD1 4.36Å; F101-L105 HydrophobicContact CZ-CD1 4.22Å; F101-L105 HydrophobicContact CZ-CD2 4.42Å; F101-L105 HydrophobicContact CZ-CG 4.46Å; F101-L105 VanDerWaalsContact O-CG 3.27Å; F101-L105 WeakPolarHBondContact O-CG 3.5Å; F101-L105 PolarHBondContact O-N 3Å; S102-L105 PolarHBondContact O-N 2.97Å; E103-L105 VanDerWaalsContact C-N 3.34Å; E103-L105 PolarHBondContact O-N 3.17Å; L105-A107 VanDerWaalsContact C-N 3.34Å; L105-L108 PolarHBondContact O-N 3.16Å; L105-S109 VanDerWaalsContact O-CB 3.29Å; L105-S109 WeakPolarHBondContact O-CB 3.28Å; L105-S109 PolarHBondContact O-N 2.85Å; L105-L199 HydrophobicContact CD2-CD2 3.82Å; L105-L199 HydrophobicContact CG-CD2 4.19Å; L105-P282 HydrophobicContact CD2-CB 4.4Å; L105-L285 HydrophobicContact CD1-CB 3.57Å; L105-L285 HydrophobicContact CD2-CB 3.9Å; L105-L285 HydrophobicContact CD2-CD1 3.62Å; L105-L285 HydrophobicContact CD2-CG 4.43Å; L105-L285 HydrophobicContact CG-CB 4.38Å; L105-M286 HydrophobicContact CB-CG 3.57Å; L105-M286 HydrophobicContact CB-SD 4.35Å; L105-M286 HydrophobicContact CD1-CG 4.27Å; L105-I289 HydrophobicContact CD1-CG2 4.42Å
106	S	97.3	Very high	93.9	Very high	21 Å²	21	26.6 Å²	26.6	15%	0.147	15%	0.151	C	C	.	.	H	α-helix	trans	-58.1	-47.3	172.2	-171.7	0	0	0	0	110.7	H56 H57 S102 E103 C104 S109 F110	H56-S106 PolarHBondContact CE1-OG 3.02Å; H56-S106 PolarHBondContact NE2-OG 2.77Å; H56-S106 VanDerWaalsContact NE2-OG 3.08Å; H57-S106 PolarHBondContact NE2-OG 3.07Å; S102-S106 PolarHBondContact O-N 2.88Å; E103-S106 WeakPolarHBondContact O-CB 3.46Å; E103-S106 PolarHBondContact O-N 2.9Å; C104-S106 VanDerWaalsContact C-N 3.33Å; C104-S106 PolarHBondContact O-N 3.19Å; S106-S109 PolarHBondContact O-N 3.49Å; S106-F110 WeakPolarHBondContact O-CB 3.28Å; S106-F110 PolarHBondContact O-N 3.3Å
107	A	97.6	Very high	93.8	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.6	-48.3	176	0	0	0	0	0	112.4	H56 N58 L59 E103 C104 L105 S109 F110 M111 I136	H56-A107 PolarHBondContact CE1-N 3.41Å; N58-A107 HydrophobicContact CB-CB 4Å; L59-A107 HydrophobicContact CD2-CB 3.67Å; L59-A107 HydrophobicContact CG-CB 4.14Å; E103-A107 PolarHBondContact O-N 3.49Å; E103-A107 VanDerWaalsContact O-N 3.12Å; C104-A107 WeakPolarHBondContact O-CB 3.47Å; C104-A107 PolarHBondContact O-N 3.19Å; L105-A107 VanDerWaalsContact C-N 3.34Å; A107-S109 PolarHBondContact O-N 3.33Å; A107-F110 PolarHBondContact O-N 3.44Å; A107-M111 WeakPolarHBondContact O-CG 3.26Å; A107-M111 PolarHBondContact O-N 2.91Å; A107-I136 HydrophobicContact CB-CD1 3.78Å; A107-I136 HydrophobicContact CB-CG1 4.39Å
108	L	97.3	Very high	93.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-65.6	-37.6	179	-65.4	-175.5	0	0	0	112.6	C104 L105 M111 S112 I192 D195 V196 L199 P282	C104-L108 WeakPolarHBondContact O-CG 3.49Å; C104-L108 PolarHBondContact O-N 2.85Å; L105-L108 PolarHBondContact O-N 3.16Å; L108-M111 HydrophobicContact CD2-SD 4.28Å; L108-M111 PolarHBondContact O-N 2.84Å; L108-S112 WeakPolarHBondContact O-CB 3.35Å; L108-S112 PolarHBondContact O-N 3.41Å; L108-I192 HydrophobicContact CB-CD1 4.35Å; L108-I192 HydrophobicContact CB-CG1 4.33Å; L108-I192 HydrophobicContact CD2-CD1 4.29Å; L108-I192 WeakPolarHBondContact O-CD1 3.3Å; L108-D195 HydrophobicContact CD1-CB 4.15Å; L108-D195 HydrophobicContact CD2-CB 3.73Å; L108-V196 HydrophobicContact CD1-CG2 4.45Å; L108-L199 HydrophobicContact CD1-CB 4.34Å; L108-L199 HydrophobicContact CD1-CD2 3.92Å; L108-P282 HydrophobicContact CB-CB 4.05Å; L108-P282 HydrophobicContact CB-CG 3.78Å
109	S	96.1	Very high	93.2	Very high	13 Å²	13	25.7 Å²	25.7	9%	0.091	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-46.2	174.2	-178.8	0	0	0	0	110.8	L105 S106 A107 M111 S112 D113 K283	L105-S109 VanDerWaalsContact O-CB 3.29Å; L105-S109 WeakPolarHBondContact O-CB 3.28Å; L105-S109 PolarHBondContact O-N 2.85Å; S106-S109 PolarHBondContact O-N 3.49Å; A107-S109 PolarHBondContact O-N 3.33Å; S109-M111 VanDerWaalsContact C-N 3.35Å; S109-M111 PolarHBondContact O-N 2.04Å; S109-S112 WeakPolarHBondContact O-CB 3.49Å; S109-S112 PolarHBondContact O-N 3.31Å; S109-D113 PolarHBondContact O-N 3.1Å; S109-K283 VanDerWaalsContact OG-CE 3.25Å; S109-K283 WeakPolarHBondContact OG-CE 3.31Å; S109-K283 WeakPolarHBondContact OG-CG 3.46Å
110	F	95.3	Very high	92.8	Very high	56 Å²	56	22 Å²	22	25%	0.246	13%	0.132	C	C	.	.	H	α-helix	trans	-62.1	-42.4	177.2	-179.8	-86.3	0	0	0	111.7	I54 H56 L59 S106 A107 D113 N114	I54-F110 HydrophobicContact CG2-CD1 4.49Å; I54-F110 HydrophobicContact CG2-CE1 3.55Å; I54-F110 HydrophobicContact CG2-CZ 4.23Å; H56-F110 HydrophobicContact CB-CD1 4.05Å; H56-F110 HydrophobicContact CB-CD2 4.45Å; H56-F110 HydrophobicContact CB-CE1 4.27Å; H56-F110 HydrophobicContact CB-CG 4.17Å; H56-F110 AromaticContact CD2-CD2 3.7Å; H56-F110 AromaticContact CD2-CG 3.62Å; H56-F110 AromaticContact CG-CG 3.97Å; L59-F110 HydrophobicContact CD1-CD1 3.8Å; L59-F110 HydrophobicContact CD1-CE1 4.27Å; S106-F110 WeakPolarHBondContact O-CB 3.28Å; S106-F110 PolarHBondContact O-N 3.3Å; A107-F110 PolarHBondContact O-N 3.44Å; F110-D113 PolarHBondContact O-N 2.98Å; F110-N114 VanDerWaalsContact CE1-ND2 3.26Å; F110-N114 WeakPolarHBondContact CE1-ND2 3.33Å; F110-N114 VanDerWaalsContact CZ-ND2 3.31Å; F110-N114 WeakPolarHBondContact CZ-ND2 3.49Å; F110-N114 PolarHBondContact O-N 2.86Å; F110-N114 PolarHBondContact O-ND2 3.14Å
111	M	93.5	Very high	92.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60.4	-45.8	174.2	-73.1	177.1	57.9	0	0	111.7	L59 A107 L108 S109 D113 N114 G115 L116 H118 Y139 I192	L59-M111 HydrophobicContact CD1-CG 4.13Å; L59-M111 HydrophobicContact CD2-CG 4.4Å; L59-M111 HydrophobicContact CD2-SD 4.11Å; A107-M111 WeakPolarHBondContact O-CG 3.26Å; A107-M111 PolarHBondContact O-N 2.91Å; L108-M111 HydrophobicContact CD2-SD 4.28Å; L108-M111 PolarHBondContact O-N 2.84Å; S109-M111 VanDerWaalsContact C-N 3.35Å; S109-M111 PolarHBondContact O-N 2.04Å; M111-D113 VanDerWaalsContact C-N 3.29Å; M111-D113 PolarHBondContact O-N 3.37Å; M111-N114 CarbonylContact O-C 3.43Å; M111-N114 WeakPolarHBondContact O-CA 3.24Å; M111-N114 PolarHBondContact O-N 3.31Å; M111-G115 PolarHBondContact O-N 3.09Å; M111-G115 VanDerWaalsContact O-N 3.12Å; M111-L116 CarbonylContact C-O 3.35Å; M111-L116 HydrophobicContact CB-CB 4.15Å; M111-L116 HydrophobicContact CE-CB 4.35Å; M111-L116 PolarHBondContact O-N 3.4Å; M111-H118 HydrophobicContact CE-CB 4Å; M111-Y139 HydrophobicContact SD-CG 4.42Å; M111-I192 HydrophobicContact CB-CD1 4.07Å
112	S	92.3	Very high	92.2	Very high	51 Å²	51	22 Å²	22	36%	0.357	13%	0.134	S	C	.	.	H	α-helix	trans	-56.8	-42.9	176.3	-173.2	0	0	0	0	112.2	L108 S109 N114 G115	L108-S112 WeakPolarHBondContact O-CB 3.35Å; L108-S112 PolarHBondContact O-N 3.41Å; S109-S112 WeakPolarHBondContact O-CB 3.49Å; S109-S112 PolarHBondContact O-N 3.31Å; S112-N114 PolarHBondContact O-N 3.3Å; S112-G115 PolarHBondContact O-N 2.81Å; S112-G115 VanDerWaalsContact O-N 3.09Å
113	D	90.6	Very high	92	Very high	98 Å²	98	21.2 Å²	21.2	52%	0.524	13%	0.129	S	C	.	.	H	α-helix	trans	-67.5	-24.1	179.7	-72.7	-16.1	0	0	0	112.6	S109 F110 M111 K283	S109-D113 PolarHBondContact O-N 3.1Å; F110-D113 PolarHBondContact O-N 2.98Å; M111-D113 VanDerWaalsContact C-N 3.29Å; M111-D113 PolarHBondContact O-N 3.37Å; D113-K283 VanDerWaalsContact OD1-CE 3.22Å; D113-K283 WeakPolarHBondContact OD1-CE 3.41Å; D113-K283 IonicContact OD1-NZ 3.9Å; D113-K283 PolarHBondContact OD1-NZ 2.97Å; D113-K283 WeakPolarHBondContact OD2-CE 3.38Å; D113-K283 IonicContact OD2-NZ 2.66Å; D113-K283 PolarHBondContact OD2-NZ 3.46Å
114	N	87.5	Confident	91.6	Very high	81 Å²	81	22.1 Å²	22.1	43%	0.433	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	7	174.2	-72.9	-89.3	0	0	0	113.3	F110 M111 S112 L116	F110-N114 VanDerWaalsContact CE1-ND2 3.26Å; F110-N114 WeakPolarHBondContact CE1-ND2 3.33Å; F110-N114 VanDerWaalsContact CZ-ND2 3.31Å; F110-N114 WeakPolarHBondContact CZ-ND2 3.49Å; F110-N114 PolarHBondContact O-N 2.86Å; F110-N114 PolarHBondContact O-ND2 3.14Å; M111-N114 CarbonylContact O-C 3.43Å; M111-N114 WeakPolarHBondContact O-CA 3.24Å; M111-N114 PolarHBondContact O-N 3.31Å; S112-N114 PolarHBondContact O-N 3.3Å; N114-L116 VanDerWaalsContact C-N 3.25Å; N114-L116 HydrophobicContact CB-CD1 4.24Å; N114-L116 HydrophobicContact CB-CG 4.3Å; N114-L116 PolarHBondContact O-N 3.37Å
115	G	84.9	Confident	91.3	Very high	44 Å²	44	22.5 Å²	22.5	45%	0.454	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.7	25	-178.4	0	0	0	0	0	114.1	M111 S112	M111-G115 PolarHBondContact O-N 3.09Å; M111-G115 VanDerWaalsContact O-N 3.12Å; S112-G115 PolarHBondContact O-N 2.81Å; S112-G115 VanDerWaalsContact O-N 3.09Å
116	L	89.1	Confident	91.2	Very high	9 Å²	9	22.5 Å²	22.5	5%	0.047	14%	0.136	C	C	.	.			trans	-105.5	154.4	-179.8	-64.4	175.3	0	0	0	111.5	L51 I54 M111 N114 Y143	L51-L116 HydrophobicContact CD2-CD1 4.01Å; L51-L116 HydrophobicContact CD2-CD2 4.25Å; I54-L116 HydrophobicContact CD1-CD1 3.39Å; M111-L116 CarbonylContact C-O 3.35Å; M111-L116 HydrophobicContact CB-CB 4.15Å; M111-L116 HydrophobicContact CE-CB 4.35Å; M111-L116 PolarHBondContact O-N 3.4Å; N114-L116 VanDerWaalsContact C-N 3.25Å; N114-L116 HydrophobicContact CB-CD1 4.24Å; N114-L116 HydrophobicContact CB-CG 4.3Å; N114-L116 PolarHBondContact O-N 3.37Å; L116-Y143 HydrophobicContact CD2-CD1 4.16Å; L116-Y143 HydrophobicContact CD2-CD2 4.44Å; L116-Y143 HydrophobicContact CD2-CG 3.87Å
117	V	87.9	Confident	91.1	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.03	13%	0.13	C	C	.	.			trans	-140.5	157.7	175.7	-66.4	0	0	0	0	108.9	W119 W147 I192 D195	V117-W119 HydrophobicContact CB-CG 4.49Å; V117-W119 HydrophobicContact CG2-CD2 4.1Å; V117-W119 HydrophobicContact CG2-CG 4.08Å; V117-W119 HydrophobicContact CG2-CZ2 4.09Å; V117-W119 VanDerWaalsContact CG2-NE1 3.31Å; V117-W147 HydrophobicContact CG2-CH2 4.36Å; V117-W147 HydrophobicContact CG2-CZ3 3.64Å; V117-I192 HydrophobicContact CG1-CD1 4.38Å; V117-D195 WeakPolarHBondContact CA-OD2 3.19Å
118	H	89.5	Confident	90.9	Very high	7 Å²	7	21.9 Å²	21.9	3%	0.032	13%	0.131	C	C	.	.			trans	-95.1	-45.9	177.2	-166.8	-47.5	0	0	0	111.9	M111 C120 L121 G137 Y142 D195	M111-H118 HydrophobicContact CE-CB 4Å; H118-C120 PolarHBondContact CE1-O 3.44Å; H118-C120 PolarHBondContact ND1-N 2.76Å; H118-C120 PolarHBondContact ND1-O 3.48Å; H118-C120 PolarHBondContact O-N 3.2Å; H118-L121 HydrophobicContact CB-CB 4.28Å; H118-L121 PolarHBondContact ND1-N 3.43Å; H118-G137 PolarHBondContact NE2-O 3.32Å; H118-Y142 WeakPolarHBondContact O-CD2 3.32Å; H118-D195 PolarHBondContact N-OD1 2.93Å; H118-D195 PolarHBondContact N-OD2 3.22Å
119	W	85.2	Confident	90.5	Very high	5 Å²	5	22.8 Å²	22.8	2%	0.019	14%	0.136	C	C	.	.	S	Bend	trans	58.8	-25	-176.8	-72.8	0.9	0	0	0	118.1	V117 Y142 W147 S161 F168 G190 D195	V117-W119 HydrophobicContact CB-CG 4.49Å; V117-W119 HydrophobicContact CG2-CD2 4.1Å; V117-W119 HydrophobicContact CG2-CG 4.08Å; V117-W119 HydrophobicContact CG2-CZ2 4.09Å; V117-W119 VanDerWaalsContact CG2-NE1 3.31Å; W119-Y142 HydrophobicContact CB-CD2 3.9Å; W119-Y142 HydrophobicContact CB-CE2 3.76Å; W119-Y142 AromaticContact CE3-CD1 3.65Å; W119-Y142 HydrophobicContact CE3-CD1 3.65Å; W119-Y142 HydrophobicContact CE3-CD2 4.27Å; W119-Y142 AromaticContact CE3-CE1 3.97Å; W119-Y142 HydrophobicContact CE3-CE1 3.97Å; W119-Y142 AromaticContact CE3-CG 3.82Å; W119-Y142 HydrophobicContact CE3-CG 3.82Å; W119-Y142 HydrophobicContact CZ3-CD1 4.02Å; W119-Y142 HydrophobicContact CZ3-CG 4.41Å; W119-W147 AromaticContact CH2-CE3 3.88Å; W119-W147 HydrophobicContact CH2-CE3 3.88Å; W119-W147 HydrophobicContact CZ2-CE3 4.26Å; W119-W147 HydrophobicContact CZ3-CE3 4.24Å; W119-S161 PolarHBondContact O-OG 3.43Å; W119-S161 VanDerWaalsContact O-OG 3.07Å; W119-F168 HydrophobicContact CH2-CD1 4.09Å; W119-F168 AromaticContact CH2-CE1 3.67Å; W119-F168 HydrophobicContact CH2-CE1 3.67Å; W119-F168 HydrophobicContact CH2-CZ 4.22Å; W119-F168 HydrophobicContact CZ3-CD1 4.22Å; W119-F168 AromaticContact CZ3-CE1 3.9Å; W119-F168 HydrophobicContact CZ3-CE1 3.9Å; W119-G190 VanDerWaalsContact CZ2-CA 3.48Å; W119-D195 WeakPolarHBondContact CA-OD1 2.98Å; W119-D195 PolarHBondContact N-OD1 3.19Å
120	C	83.6	Confident	89.8	Confident	16 Å²	16	23.7 Å²	23.7	11%	0.108	14%	0.142	C	C	.	.	S	Bend	trans	-121.4	44.1	175.2	-161	0	0	0	0	111	H118 T122 Y142	H118-C120 PolarHBondContact CE1-O 3.44Å; H118-C120 PolarHBondContact ND1-N 2.76Å; H118-C120 PolarHBondContact ND1-O 3.48Å; H118-C120 PolarHBondContact O-N 3.2Å; C120-T122 PolarHBondContact O-N 3.07Å; C120-Y142 HydrophobicContact CB-CE2 4.1Å
121	L	90.8	Very high	89.2	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.152	C	C	.	.			trans	-72.1	120.9	178.5	-178.1	65.7	0	0	0	109.3	H118 M125 I126 I136 Y160 L199 I202	H118-L121 HydrophobicContact CB-CB 4.28Å; H118-L121 PolarHBondContact ND1-N 3.43Å; L121-M125 HydrophobicContact CD1-CB 4.41Å; L121-I126 HydrophobicContact CD1-CD1 4.32Å; L121-I126 HydrophobicContact CD1-CG1 3.95Å; L121-I136 HydrophobicContact CD1-CG2 3.81Å; L121-Y160 WeakPolarHBondContact O-CB 3.35Å; L121-L199 HydrophobicContact CD2-CB 4.33Å; L121-I202 HydrophobicContact CD2-CD1 4.43Å; L121-I202 HydrophobicContact CG-CD1 4.04Å
122	T	89.4	Confident	89	Confident	13 Å²	13	25.4 Å²	25.4	8%	0.08	16%	0.156	C	C	.	.			trans	-130.5	161.1	-178.4	59.4	0	0	0	0	110.7	C120 D124 M125 Y160	C120-T122 PolarHBondContact O-N 3.07Å; T122-D124 WeakPolarHBondContact CB-OD1 2.85Å; T122-D124 PolarHBondContact O-N 3.29Å; T122-D124 VanDerWaalsContact O-N 3.16Å; T122-D124 PolarHBondContact OG1-OD1 2.89Å; T122-M125 PolarHBondContact O-N 3.3Å; T122-M125 WeakPolarHBondContact OG1-CG 3.31Å; T122-Y160 HydrophobicContact CG2-CD2 3.82Å
123	P	91.1	Very high	89	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.019	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-57.1	-29.8	-179.8	-25.1	31.9	0	0	0	114.7	F84 S85 M125 I126 Y160 I202	F84-P123 WeakPolarHBondContact CA-O 3.43Å; F84-P123 HydrophobicContact CB-CB 3.99Å; F84-P123 VanDerWaalsContact CB-O 3.31Å; F84-P123 WeakPolarHBondContact CB-O 3.26Å; F84-P123 PolarHBondContact N-O 2.92Å; F84-P123 VanDerWaalsContact N-O 3.09Å; S85-P123 PolarHBondContact N-O 3.49Å; P123-M125 VanDerWaalsContact C-N 3.3Å; P123-I126 PolarHBondContact O-N 2.58Å; P123-Y160 VanDerWaalsContact CD-CZ 3.44Å; P123-Y160 HydrophobicContact CG-CE1 3.92Å; P123-Y160 HydrophobicContact CG-CE2 3.97Å; P123-Y160 WeakPolarHBondContact CG-OH 3.32Å; P123-I202 HydrophobicContact CG-CG1 4.04Å; P123-I202 HydrophobicContact CG-CG2 4.33Å
124	D	89.3	Confident	89.3	Confident	43 Å²	43	22.2 Å²	22.2	23%	0.23	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-73.2	-20.6	176.5	52.6	-49	0	0	0	113.5	T122	T122-D124 WeakPolarHBondContact CB-OD1 2.85Å; T122-D124 PolarHBondContact O-N 3.29Å; T122-D124 VanDerWaalsContact O-N 3.16Å; T122-D124 PolarHBondContact OG1-OD1 2.89Å
125	M	92	Very high	89.8	Confident	8 Å²	8	19.5 Å²	19.5	4%	0.039	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-84.5	-13.6	174.9	-63.8	-63.3	170.1	0	0	113.1	L121 T122 P123 M127 I136 G137 F445 I447	L121-M125 HydrophobicContact CD1-CB 4.41Å; T122-M125 PolarHBondContact O-N 3.3Å; T122-M125 WeakPolarHBondContact OG1-CG 3.31Å; P123-M125 VanDerWaalsContact C-N 3.3Å; M125-M127 PolarHBondContact O-N 3.31Å; M125-I136 CarbonylContact O-C 3.59Å; M125-I136 WeakPolarHBondContact O-CA 3.42Å; M125-G137 PolarHBondContact O-N 3.23Å; M125-F445 HydrophobicContact CE-CB 3.75Å; M125-F445 WeakPolarHBondContact CE-O 3.28Å; M125-I447 HydrophobicContact SD-CD1 4.39Å
126	I	95.8	Very high	90.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	93	174.2	-52.7	-176.4	0	0	0	108.3	S83 F84 L121 P123 V134 I136 L199 I202	S83-I126 CarbonylContact C-O 3.56Å; S83-I126 VanDerWaalsContact CA-O 3.25Å; S83-I126 WeakPolarHBondContact CA-O 3.19Å; S83-I126 WeakPolarHBondContact CB-O 3.2Å; F84-I126 HydrophobicContact CB-CB 4.27Å; F84-I126 HydrophobicContact CD1-CB 4.23Å; F84-I126 HydrophobicContact CD1-CG2 3.77Å; F84-I126 HydrophobicContact CD2-CB 4.04Å; F84-I126 HydrophobicContact CD2-CD1 4.11Å; F84-I126 HydrophobicContact CD2-CG2 3.76Å; F84-I126 HydrophobicContact CE1-CG2 3.79Å; F84-I126 HydrophobicContact CE2-CD1 4.47Å; F84-I126 HydrophobicContact CE2-CG2 3.81Å; F84-I126 HydrophobicContact CG-CB 3.92Å; F84-I126 HydrophobicContact CG-CG2 3.81Å; F84-I126 HydrophobicContact CZ-CG2 3.84Å; F84-I126 PolarHBondContact N-O 3.41Å; L121-I126 HydrophobicContact CD1-CD1 4.32Å; L121-I126 HydrophobicContact CD1-CG1 3.95Å; P123-I126 PolarHBondContact O-N 2.58Å; I126-V134 HydrophobicContact CG2-CG1 3.76Å; I126-V134 HydrophobicContact CG2-CG2 4.35Å; I126-I136 HydrophobicContact CG1-CG1 4.48Å; I126-L199 HydrophobicContact CD1-CD1 4.08Å; I126-I202 HydrophobicContact CD1-CD1 3.89Å; I126-I202 HydrophobicContact CD1-CG2 4.17Å
127	M	95.2	Very high	90.5	Very high	3 Å²	3	17 Å²	17	2%	0.015	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	162.6	-179.1	-67.8	174.7	-79.2	0	0	112.2	C60 Y79 Y80 T82 M125 V134 K135 I447	C60-M127 WeakPolarHBondContact SG-CE 3.33Å; Y79-M127 HydrophobicContact CD2-SD 3.74Å; Y79-M127 HydrophobicContact CE2-SD 4.1Å; Y80-M127 PolarHBondContact N-SD 2.92Å; Y80-M127 VanDerWaalsContact N-SD 3.4Å; T82-M127 CarbonylContact O-C 3.43Å; T82-M127 VanDerWaalsContact O-CA 3.31Å; T82-M127 WeakPolarHBondContact O-CA 3.48Å; M125-M127 PolarHBondContact O-N 3.31Å; M127-V134 CarbonylContact O-C 3.06Å; M127-V134 WeakPolarHBondContact O-CA 3.43Å; M127-K135 HydrophobicContact CB-CB 4.49Å; M127-K135 WeakPolarHBondContact CB-O 3.33Å; M127-K135 PolarHBondContact N-O 3.33Å; M127-K135 PolarHBondContact O-N 3.39Å; M127-I447 HydrophobicContact CE-CD1 3.6Å; M127-I447 HydrophobicContact SD-CD1 4.47Å
128	L	92.9	Very high	90.6	Very high	5 Å²	5	17 Å²	17	3%	0.026	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.2	174.4	-64.6	178.6	0	0	0	109.8	Y80 T82 F84 F87 W96 H133 V134 I316	Y80-L128 VanDerWaalsContact CB-O 3.26Å; Y80-L128 WeakPolarHBondContact CB-O 3.42Å; T82-L128 HydrophobicContact CG2-CB 4.35Å; T82-L128 HydrophobicContact CG2-CD1 4.18Å; T82-L128 PolarHBondContact O-N 2.87Å; F84-L128 HydrophobicContact CE1-CD2 3.92Å; F84-L128 HydrophobicContact CE1-CG 4.27Å; F87-L128 HydrophobicContact CZ-CD1 4.06Å; W96-L128 HydrophobicContact CZ2-CD1 4.26Å; L128-H133 WeakPolarHBondContact CA-O 3.13Å; L128-V134 HydrophobicContact CD2-CG2 4.26Å; L128-I316 HydrophobicContact CD1-CD1 4.01Å
129	D	88.6	Confident	90.7	Very high	18 Å²	18	16.7 Å²	16.7	10%	0.096	9%	0.092	C	C	.	.			trans	-72.6	-174.7	176.7	72.3	12.8	0	0	0	113.1	Y80 D131 G132 H133 K135	Y80-D129 HydrophobicContact CD1-CB 4.15Å; Y80-D129 HydrophobicContact CD2-CB 4.28Å; Y80-D129 HydrophobicContact CE1-CB 3.7Å; Y80-D129 HydrophobicContact CE2-CB 3.85Å; Y80-D129 HydrophobicContact CG-CB 4.42Å; D129-D131 PolarHBondContact O-N 2.91Å; D129-D131 WeakPolarHBondContact OD1-CA 3.43Å; D129-D131 PolarHBondContact OD1-N 2.87Å; D129-G132 PolarHBondContact O-N 2.89Å; D129-G132 PolarHBondContact OD1-N 2.93Å; D129-H133 PolarHBondContact N-O 2.83Å; D129-H133 PolarHBondContact OD1-N 3.37Å; D129-K135 HydrophobicContact CB-CG 4.14Å
130	S	81.6	Confident	90.8	Very high	32 Å²	32	16.5 Å²	16.5	22%	0.224	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.4	179.6	44.5	0	0	0	0	113.9	R322	S130-R322 PolarHBondContact OG-NE 3.12Å
131	D	82.6	Confident	90.8	Very high	84 Å²	84	16 Å²	16	45%	0.449	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-4.3	-177.4	-59	-64.9	0	0	0	111.5	D129	D129-D131 PolarHBondContact O-N 2.91Å; D129-D131 WeakPolarHBondContact OD1-CA 3.43Å; D129-D131 PolarHBondContact OD1-N 2.87Å
132	G	88.2	Confident	90.4	Very high	8 Å²	8	16.4 Å²	16.4	8%	0.082	9%	0.089	C	C	.	.	S	Bend	trans	88.5	14	177.3	0	0	0	0	0	114.3	R100 D129	R100-G132 PolarHBondContact NE-O 3.29Å; D129-G132 PolarHBondContact O-N 2.89Å; D129-G132 PolarHBondContact OD1-N 2.93Å
133	H	93.9	Very high	90.2	Very high	83 Å²	83	16.9 Å²	16.9	38%	0.384	9%	0.09	S	C	.	.			trans	-83.7	147.8	175	-64.4	-68.9	0	0	0	111.5	E103 L128 D129	E103-H133 IonicContact OE1-CE1 3.8Å; E103-H133 IonicContact OE1-CG 3.23Å; E103-H133 IonicContact OE1-ND1 3.58Å; E103-H133 PolarHBondContact OE1-ND1 3.32Å; L128-H133 WeakPolarHBondContact CA-O 3.13Å; D129-H133 PolarHBondContact N-O 2.83Å; D129-H133 PolarHBondContact OD1-N 3.37Å
134	V	97.2	Very high	89.8	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	138.4	178.2	170.2	0	0	0	0	111.3	N58 F84 R100 E103 I126 M127 L128 I136	N58-V134 WeakPolarHBondContact CA-O 3.25Å; N58-V134 WeakPolarHBondContact CB-O 3.45Å; N58-V134 PolarHBondContact ND2-O 3.01Å; F84-V134 HydrophobicContact CE1-CG2 4.48Å; F84-V134 HydrophobicContact CZ-CG2 4.28Å; R100-V134 HydrophobicContact CB-CG2 4.03Å; R100-V134 HydrophobicContact CG-CG2 4.42Å; E103-V134 HydrophobicContact CB-CB 3.9Å; E103-V134 HydrophobicContact CB-CG2 4.09Å; E103-V134 WeakPolarHBondContact OE2-CB 3.46Å; E103-V134 WeakPolarHBondContact OE2-CG2 3.46Å; E103-V134 PolarHBondContact OE2-N 2.77Å; I126-V134 HydrophobicContact CG2-CG1 3.76Å; I126-V134 HydrophobicContact CG2-CG2 4.35Å; M127-V134 CarbonylContact O-C 3.06Å; M127-V134 WeakPolarHBondContact O-CA 3.43Å; L128-V134 HydrophobicContact CD2-CG2 4.26Å; V134-I136 HydrophobicContact CG1-CG1 3.87Å
135	K	96.5	Very high	89.3	Confident	24 Å²	24	14.7 Å²	14.7	10%	0.104	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	107.7	170	-71.1	-76.8	-172.6	156.2	0	109.9	H57 E78 Y80 M127 D129	H57-K135 WeakPolarHBondContact O-CD 3.33Å; H57-K135 WeakPolarHBondContact O-CE 3.35Å; H57-K135 PolarHBondContact O-NZ 3.2Å; E78-K135 WeakPolarHBondContact OE1-CE 3.33Å; E78-K135 IonicContact OE1-NZ 3.66Å; E78-K135 PolarHBondContact OE1-NZ 3.11Å; E78-K135 IonicContact OE2-NZ 2.77Å; E78-K135 PolarHBondContact OE2-NZ 3.29Å; Y80-K135 HydrophobicContact CD2-CB 4.18Å; Y80-K135 HydrophobicContact CD2-CG 4.18Å; Y80-K135 HydrophobicContact CE2-CB 4.16Å; Y80-K135 HydrophobicContact CE2-CD 4.38Å; Y80-K135 HydrophobicContact CE2-CG 3.74Å; M127-K135 HydrophobicContact CB-CB 4.49Å; M127-K135 WeakPolarHBondContact CB-O 3.33Å; M127-K135 PolarHBondContact N-O 3.33Å; M127-K135 PolarHBondContact O-N 3.39Å; D129-K135 HydrophobicContact CB-CG 4.14Å
136	I	96.8	Very high	88.5	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	120.7	179.1	-57.1	-177.2	0	0	0	110	N58 L59 C60 C104 A107 L121 M125 I126 V134	N58-I136 PolarHBondContact O-N 2.83Å; L59-I136 HydrophobicContact CD2-CB 4.04Å; C60-I136 PolarHBondContact N-O 3.42Å; C104-I136 HydrophobicContact CB-CD1 4.43Å; A107-I136 HydrophobicContact CB-CD1 3.78Å; A107-I136 HydrophobicContact CB-CG1 4.39Å; L121-I136 HydrophobicContact CD1-CG2 3.81Å; M125-I136 CarbonylContact O-C 3.59Å; M125-I136 WeakPolarHBondContact O-CA 3.42Å; I126-I136 HydrophobicContact CG1-CG1 4.48Å; V134-I136 HydrophobicContact CG1-CG1 3.87Å
137	G	93.4	Very high	87.5	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.			trans	-92.9	171.9	174.3	0	0	0	0	0	112.8	H118 M125 Y139	H118-G137 PolarHBondContact NE2-O 3.32Å; M125-G137 PolarHBondContact O-N 3.23Å; G137-Y139 PolarHBondContact O-N 2.87Å; G137-Y139 VanDerWaalsContact O-N 3.12Å
138	G	88.5	Confident	86.2	Confident	5 Å²	5	17.9 Å²	17.9	5%	0.052	10%	0.099	C	C	.	.	S	Bend	trans	71.5	4.6	169.1	0	0	0	0	0	117	I141	G138-I141 VanDerWaalsContact O-CD1 3.25Å; G138-I141 WeakPolarHBondContact O-CD1 3.48Å; G138-I141 VanDerWaalsContact O-CG1 3.3Å; G138-I141 WeakPolarHBondContact O-CG1 3.26Å
139	Y	91.2	Very high	85	Confident	1 Å²	1	20.6 Å²	20.6	0%	0.004	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	153.6	178.6	68	-89.5	0	0	0	112.5	I54 L59 C60 Y62 M111 G137 I141	I54-Y139 HydrophobicContact CD1-CE2 4.49Å; I54-Y139 HydrophobicContact CG2-CE2 4.04Å; L59-Y139 HydrophobicContact CB-CD1 4.31Å; L59-Y139 HydrophobicContact CB-CE1 3.68Å; L59-Y139 HydrophobicContact CD1-CD2 4.46Å; L59-Y139 HydrophobicContact CD1-CE1 4.25Å; L59-Y139 HydrophobicContact CD1-CE2 4.19Å; L59-Y139 HydrophobicContact CD2-CD1 3.84Å; L59-Y139 HydrophobicContact CD2-CE1 4.09Å; L59-Y139 HydrophobicContact CD2-CG 4.25Å; L59-Y139 HydrophobicContact CG-CD1 4.45Å; L59-Y139 HydrophobicContact CG-CE1 4.22Å; C60-Y139 WeakPolarHBondContact O-CE1 3.47Å; C60-Y139 PolarHBondContact O-OH 3.48Å; Y62-Y139 HydrophobicContact CD2-CE1 4.48Å; Y62-Y139 HydrophobicContact CD2-CE2 4.09Å; Y62-Y139 AromaticContact CD2-CZ 3.85Å; Y62-Y139 HydrophobicContact CE2-CD1 4.42Å; Y62-Y139 HydrophobicContact CE2-CD2 4.12Å; Y62-Y139 HydrophobicContact CE2-CE1 4.03Å; Y62-Y139 AromaticContact CE2-CE2 3.7Å; Y62-Y139 HydrophobicContact CE2-CE2 3.7Å; Y62-Y139 HydrophobicContact CE2-CG 4.46Å; Y62-Y139 AromaticContact CE2-CZ 3.66Å; Y62-Y139 WeakPolarHBondContact CE2-O 3.44Å; Y62-Y139 PolarHBondContact OH-O 3.36Å; M111-Y139 HydrophobicContact SD-CG 4.42Å; G137-Y139 PolarHBondContact O-N 2.87Å; G137-Y139 VanDerWaalsContact O-N 3.12Å; Y139-I141 PolarHBondContact O-N 3.18Å
140	G	87.9	Confident	83.9	Confident	1 Å²	1	20.5 Å²	20.5	1%	0.01	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	0.1	174.8	0	0	0	0	0	115.2	Y142 Y143 A144	G140-Y142 PolarHBondContact O-N 3.28Å; G140-Y143 WeakPolarHBondContact O-CB 3.43Å; G140-Y143 PolarHBondContact O-N 2.85Å; G140-A144 PolarHBondContact O-N 3.13Å
141	I	85	Confident	83.1	Confident	5 Å²	5	19.5 Å²	19.5	3%	0.026	11%	0.107	C	C	.	.	H	α-helix	trans	-60.1	-48.5	177.6	-66.4	173.4	0	0	0	111.1	I18 I20 F48 G138 Y139 Y143 A144 T145 F153 F445	I18-I141 HydrophobicContact CD1-CD1 4.37Å; I20-I141 HydrophobicContact CD1-CG2 4.28Å; F48-I141 HydrophobicContact CE1-CG1 4.25Å; F48-I141 HydrophobicContact CZ-CB 4.41Å; F48-I141 HydrophobicContact CZ-CG1 4.12Å; F48-I141 HydrophobicContact CZ-CG2 4.33Å; G138-I141 VanDerWaalsContact O-CD1 3.25Å; G138-I141 WeakPolarHBondContact O-CD1 3.48Å; G138-I141 VanDerWaalsContact O-CG1 3.3Å; G138-I141 WeakPolarHBondContact O-CG1 3.26Å; Y139-I141 PolarHBondContact O-N 3.18Å; I141-Y143 VanDerWaalsContact C-N 3.3Å; I141-Y143 PolarHBondContact O-N 2.98Å; I141-A144 PolarHBondContact O-N 3.3Å; I141-T145 HydrophobicContact CG2-CG2 4.18Å; I141-T145 WeakPolarHBondContact O-CB 3.03Å; I141-T145 VanDerWaalsContact O-CG2 3.25Å; I141-T145 WeakPolarHBondContact O-CG2 3.44Å; I141-T145 PolarHBondContact O-N 3.29Å; I141-T145 PolarHBondContact O-OG1 2.69Å; I141-F153 HydrophobicContact CG2-CE1 3.98Å; I141-F445 HydrophobicContact CB-CE1 4.48Å; I141-F445 HydrophobicContact CB-CZ 4.42Å; I141-F445 HydrophobicContact CD1-CD1 3.74Å; I141-F445 HydrophobicContact CD1-CE1 3.81Å; I141-F445 HydrophobicContact CD1-CG 4.28Å; I141-F445 HydrophobicContact CD1-CZ 4.33Å; I141-F445 HydrophobicContact CG2-CD1 4.49Å; I141-F445 HydrophobicContact CG2-CE1 3.51Å; I141-F445 HydrophobicContact CG2-CZ 3.47Å; I141-F445 VanDerWaalsContact CG2-CZ 3.47Å
142	Y	81.7	Confident	82	Confident	8 Å²	8	18 Å²	18	3%	0.031	10%	0.099	C	C	.	.	H	α-helix	trans	-58.4	-41.7	176.4	-78.5	-86	0	0	0	111.8	H118 W119 C120 G140 A144 T145 D146 W147	H118-Y142 WeakPolarHBondContact O-CD2 3.32Å; W119-Y142 HydrophobicContact CB-CD2 3.9Å; W119-Y142 HydrophobicContact CB-CE2 3.76Å; W119-Y142 AromaticContact CE3-CD1 3.65Å; W119-Y142 HydrophobicContact CE3-CD1 3.65Å; W119-Y142 HydrophobicContact CE3-CD2 4.27Å; W119-Y142 AromaticContact CE3-CE1 3.97Å; W119-Y142 HydrophobicContact CE3-CE1 3.97Å; W119-Y142 AromaticContact CE3-CG 3.82Å; W119-Y142 HydrophobicContact CE3-CG 3.82Å; W119-Y142 HydrophobicContact CZ3-CD1 4.02Å; W119-Y142 HydrophobicContact CZ3-CG 4.41Å; C120-Y142 HydrophobicContact CB-CE2 4.1Å; G140-Y142 PolarHBondContact O-N 3.28Å; Y142-A144 PolarHBondContact O-N 3.12Å; Y142-T145 CarbonylContact O-C 3.25Å; Y142-T145 PolarHBondContact O-N 3.44Å; Y142-T145 PolarHBondContact O-OG1 3.48Å; Y142-D146 PolarHBondContact O-N 3.15Å; Y142-W147 WeakPolarHBondContact O-CA 3.28Å; Y142-W147 PolarHBondContact O-N 3.07Å
143	Y	84.1	Confident	80.6	Confident	24 Å²	24	19.3 Å²	19.3	9%	0.094	10%	0.102	C	C	.	.	H	α-helix	trans	-57.3	-50.9	173	161.5	-100.7	0	0	0	111	R47 R50 L51 L116 G140 I141 T145 D146 W147	R47-Y143 HydrophobicContact CB-CD1 4.46Å; R47-Y143 HydrophobicContact CB-CE1 3.87Å; R47-Y143 VanDerWaalsContact CD-O 3.3Å; R47-Y143 WeakPolarHBondContact CD-O 3.31Å; R47-Y143 HydrophobicContact CG-CE1 4.23Å; R50-Y143 WeakPolarHBondContact CD-OH 3.43Å; L51-Y143 HydrophobicContact CD1-CD1 4.4Å; L51-Y143 HydrophobicContact CD2-CD1 3.98Å; L51-Y143 HydrophobicContact CD2-CE1 4.22Å; L51-Y143 HydrophobicContact CG-CD1 4.34Å; L51-Y143 HydrophobicContact CG-CE1 4.49Å; L116-Y143 HydrophobicContact CD2-CD1 4.16Å; L116-Y143 HydrophobicContact CD2-CD2 4.44Å; L116-Y143 HydrophobicContact CD2-CG 3.87Å; G140-Y143 WeakPolarHBondContact O-CB 3.43Å; G140-Y143 PolarHBondContact O-N 2.85Å; I141-Y143 VanDerWaalsContact C-N 3.3Å; I141-Y143 PolarHBondContact O-N 2.98Å; Y143-T145 PolarHBondContact O-N 3.36Å; Y143-T145 VanDerWaalsContact O-N 3.15Å; Y143-D146 PolarHBondContact O-N 3.49Å; Y143-W147 HydrophobicContact CD2-CZ2 4.15Å
144	A	84.3	Confident	78.7	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.4	-26.8	-176.7	0	0	0	0	0	113	C44 R47 F48 L51 G140 I141 Y142	C44-A144 WeakPolarHBondContact CA-O 3.32Å; C44-A144 PolarHBondContact SG-O 2.65Å; R47-A144 HydrophobicContact CB-CB 4.05Å; R47-A144 WeakPolarHBondContact CD-O 3.29Å; F48-A144 HydrophobicContact CD1-CB 3.84Å; F48-A144 HydrophobicContact CD2-CB 3.49Å; F48-A144 VanDerWaalsContact CD2-CB 3.49Å; F48-A144 HydrophobicContact CE1-CB 3.75Å; F48-A144 HydrophobicContact CE2-CB 3.4Å; F48-A144 VanDerWaalsContact CE2-CB 3.4Å; F48-A144 HydrophobicContact CG-CB 3.68Å; F48-A144 HydrophobicContact CZ-CB 3.52Å; L51-A144 HydrophobicContact CD1-CB 4.41Å; G140-A144 PolarHBondContact O-N 3.13Å; I141-A144 PolarHBondContact O-N 3.3Å; Y142-A144 PolarHBondContact O-N 3.12Å
145	T	78.9	Confident	76.9	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	30.4	-174.2	67.2	0	0	0	0	112.7	C44 F48 I141 Y142 Y143 W147 G148 N149 I150 F153	C44-T145 VanDerWaalsContact SG-CG2 3.54Å; F48-T145 HydrophobicContact CE2-CG2 4.3Å; I141-T145 HydrophobicContact CG2-CG2 4.18Å; I141-T145 WeakPolarHBondContact O-CB 3.03Å; I141-T145 VanDerWaalsContact O-CG2 3.25Å; I141-T145 WeakPolarHBondContact O-CG2 3.44Å; I141-T145 PolarHBondContact O-N 3.29Å; I141-T145 PolarHBondContact O-OG1 2.69Å; Y142-T145 CarbonylContact O-C 3.25Å; Y142-T145 PolarHBondContact O-N 3.44Å; Y142-T145 PolarHBondContact O-OG1 3.48Å; Y143-T145 PolarHBondContact O-N 3.36Å; Y143-T145 VanDerWaalsContact O-N 3.15Å; T145-W147 VanDerWaalsContact C-N 3.31Å; T145-W147 PolarHBondContact O-N 3.01Å; T145-G148 PolarHBondContact O-N 3.43Å; T145-G148 VanDerWaalsContact O-N 3.09Å; T145-N149 PolarHBondContact O-N 2.62Å; T145-I150 WeakPolarHBondContact O-CG1 3.15Å; T145-I150 PolarHBondContact O-N 2.99Å; T145-F153 HydrophobicContact CG2-CE1 3.98Å; T145-F153 HydrophobicContact CG2-CE2 4.21Å; T145-F153 HydrophobicContact CG2-CZ 3.27Å; T145-F153 VanDerWaalsContact OG1-CE2 3.26Å; T145-F153 WeakPolarHBondContact OG1-CE2 3.49Å; T145-F153 WeakPolarHBondContact OG1-CZ 3.29Å
146	D	75.2	Confident	75.5	Confident	44 Å²	44	18.1 Å²	18.1	24%	0.235	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	53.1	48.8	177.1	-156.5	54.3	0	0	0	113	R47 Y142 Y143 G148 N149 I150	R47-D146 IonicContact CZ-OD1 2.96Å; R47-D146 IonicContact NH1-OD1 3.27Å; R47-D146 PolarHBondContact NH1-OD1 3.02Å; R47-D146 IonicContact NH2-OD1 2.84Å; R47-D146 PolarHBondContact NH2-OD1 3.34Å; Y142-D146 PolarHBondContact O-N 3.15Å; Y143-D146 PolarHBondContact O-N 3.49Å; D146-G148 PolarHBondContact O-N 3.47Å; D146-G148 VanDerWaalsContact O-N 3.16Å; D146-N149 HydrophobicContact CB-CB 4.13Å; D146-N149 VanDerWaalsContact O-CB 3.22Å; D146-N149 WeakPolarHBondContact O-CB 3.23Å; D146-N149 PolarHBondContact O-N 3.34Å; D146-N149 PolarHBondContact O-ND2 2.95Å; D146-N149 PolarHBondContact OD2-ND2 3.01Å; D146-I150 HydrophobicContact CB-CD1 4.27Å; D146-I150 HydrophobicContact CB-CG1 3.89Å; D146-I150 HydrophobicContact CB-CG2 4.1Å
147	W	73.8	Confident	74.5	Confident	11 Å²	11	19.2 Å²	19.2	4%	0.042	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	56.8	31.5	179.5	-50.9	104.2	0	0	0	113.4	V117 W119 Y142 Y143 T145 C188	V117-W147 HydrophobicContact CG2-CH2 4.36Å; V117-W147 HydrophobicContact CG2-CZ3 3.64Å; W119-W147 AromaticContact CH2-CE3 3.88Å; W119-W147 HydrophobicContact CH2-CE3 3.88Å; W119-W147 HydrophobicContact CZ2-CE3 4.26Å; W119-W147 HydrophobicContact CZ3-CE3 4.24Å; Y142-W147 WeakPolarHBondContact O-CA 3.28Å; Y142-W147 PolarHBondContact O-N 3.07Å; Y143-W147 HydrophobicContact CD2-CZ2 4.15Å; T145-W147 VanDerWaalsContact C-N 3.31Å; T145-W147 PolarHBondContact O-N 3.01Å; W147-C188 HydrophobicContact CH2-CB 3.39Å; W147-C188 WeakPolarHBondContact CH2-SG 3.3Å; W147-C188 VanDerWaalsContact CZ2-CA 3.46Å; W147-C188 HydrophobicContact CZ2-CB 3.6Å; W147-C188 HydrophobicContact CZ3-CB 4.17Å; W147-C188 VanDerWaalsContact CZ3-SG 3.56Å
148	G	68.8	Low	73.7	Confident	22 Å²	22	20.5 Å²	20.5	23%	0.227	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	97.7	-9.2	-178.6	0	0	0	0	0	114.7	T145 D146 I150 F153	T145-G148 PolarHBondContact O-N 3.43Å; T145-G148 VanDerWaalsContact O-N 3.09Å; D146-G148 PolarHBondContact O-N 3.47Å; D146-G148 VanDerWaalsContact O-N 3.16Å; G148-I150 VanDerWaalsContact C-N 3.25Å; G148-I150 PolarHBondContact O-N 3.28Å; G148-F153 VanDerWaalsContact CA-CD2 3.46Å; G148-F153 VanDerWaalsContact CA-CE2 3.45Å
149	N	66.8	Low	73.2	Confident	62 Å²	62	21.5 Å²	21.5	33%	0.332	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.9	-172.5	-67	-28.4	0	0	0	113.9	T145 D146 Q172	T145-N149 PolarHBondContact O-N 2.62Å; D146-N149 HydrophobicContact CB-CB 4.13Å; D146-N149 VanDerWaalsContact O-CB 3.22Å; D146-N149 WeakPolarHBondContact O-CB 3.23Å; D146-N149 PolarHBondContact O-N 3.34Å; D146-N149 PolarHBondContact O-ND2 2.95Å; D146-N149 PolarHBondContact OD2-ND2 3.01Å; N149-Q172 PolarHBondContact OD1-NE2 3.22Å
150	I	64.9	Low	73	Confident	17 Å²	17	22.5 Å²	22.5	9%	0.087	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.1	6.2	-167.6	60.8	159.6	0	0	0	116.6	V22 L24 V40 C44 T145 D146 G148	V22-I150 WeakPolarHBondContact CG1-O 3.28Å; L24-I150 HydrophobicContact CD1-CB 4.02Å; L24-I150 HydrophobicContact CD1-CG2 3.85Å; V40-I150 HydrophobicContact CG1-CB 3.29Å; V40-I150 HydrophobicContact CG1-CD1 3.65Å; V40-I150 HydrophobicContact CG1-CG1 4.05Å; V40-I150 HydrophobicContact CG1-CG2 3.27Å; C44-I150 HydrophobicContact CB-CD1 3.79Å; T145-I150 WeakPolarHBondContact O-CG1 3.15Å; T145-I150 PolarHBondContact O-N 2.99Å; D146-I150 HydrophobicContact CB-CD1 4.27Å; D146-I150 HydrophobicContact CB-CG1 3.89Å; D146-I150 HydrophobicContact CB-CG2 4.1Å; G148-I150 VanDerWaalsContact C-N 3.25Å; G148-I150 PolarHBondContact O-N 3.28Å
151	A	65.2	Low	73	Confident	10 Å²	10	22.5 Å²	22.5	8%	0.083	12%	0.122	C	C	.	.	S	Bend	trans	-139.3	152.7	173.8	0	0	0	0	0	110.8	P21 F153	P21-A151 WeakPolarHBondContact O-CB 3.48Å; A151-F153 VanDerWaalsContact C-N 3.3Å; A151-F153 HydrophobicContact CB-CD2 4Å; A151-F153 HydrophobicContact CB-CE1 3.97Å; A151-F153 HydrophobicContact CB-CE2 3.21Å; A151-F153 HydrophobicContact CB-CZ 3.14Å; A151-F153 WeakPolarHBondContact O-CD2 3.28Å; A151-F153 WeakPolarHBondContact O-CE2 3.24Å; A151-F153 PolarHBondContact O-N 2.9Å
152	D	59.9	Low	73.2	Confident	54 Å²	54	22.2 Å²	22.2	29%	0.289	12%	0.121	S	C	.	.			trans	-76.1	83.7	173.9	-66.8	-41.8	0	0	0	108.5	S23	S23-D152 PolarHBondContact OG-OD2 3.12Å
153	F	59.9	Low	73.5	Confident	34 Å²	34	21.9 Å²	21.9	15%	0.149	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-76.3	149.1	-173.8	-76.7	-67.3	0	0	0	114.2	I141 T145 G148 A151 L155 F445	I141-F153 HydrophobicContact CG2-CE1 3.98Å; T145-F153 HydrophobicContact CG2-CE1 3.98Å; T145-F153 HydrophobicContact CG2-CE2 4.21Å; T145-F153 HydrophobicContact CG2-CZ 3.27Å; T145-F153 VanDerWaalsContact OG1-CE2 3.26Å; T145-F153 WeakPolarHBondContact OG1-CE2 3.49Å; T145-F153 WeakPolarHBondContact OG1-CZ 3.29Å; G148-F153 VanDerWaalsContact CA-CD2 3.46Å; G148-F153 VanDerWaalsContact CA-CE2 3.45Å; A151-F153 VanDerWaalsContact C-N 3.3Å; A151-F153 HydrophobicContact CB-CD2 4Å; A151-F153 HydrophobicContact CB-CE1 3.97Å; A151-F153 HydrophobicContact CB-CE2 3.21Å; A151-F153 HydrophobicContact CB-CZ 3.14Å; A151-F153 WeakPolarHBondContact O-CD2 3.28Å; A151-F153 WeakPolarHBondContact O-CE2 3.24Å; A151-F153 PolarHBondContact O-N 2.9Å; F153-L155 PolarHBondContact O-N 3.49Å; F153-F445 HydrophobicContact CD1-CE1 4.09Å; F153-F445 AromaticContact CD1-CE2 3.92Å; F153-F445 HydrophobicContact CD1-CE2 3.92Å; F153-F445 AromaticContact CD1-CZ 3.24Å; F153-F445 HydrophobicContact CD1-CZ 3.24Å; F153-F445 AromaticContact CE1-CE1 3.95Å; F153-F445 HydrophobicContact CE1-CE1 3.95Å; F153-F445 HydrophobicContact CE1-CE2 4.45Å; F153-F445 AromaticContact CE1-CZ 3.4Å; F153-F445 HydrophobicContact CE1-CZ 3.4Å
154	T	52.9	Low	73.6	Confident	22 Å²	22	22.9 Å²	22.9	14%	0.135	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-62.4	136.4	147.9	36.4	0	0	0	0	110.2	F443 R444	T154-F443 WeakPolarHBondContact CA-O 3.42Å; T154-F443 WeakPolarHBondContact CB-O 3.34Å; T154-F443 WeakPolarHBondContact CG2-O 3.36Å; T154-F443 PolarHBondContact N-O 2.6Å; T154-F443 PolarHBondContact OG1-O 2.75Å; T154-R444 VanDerWaalsContact CG2-CA 3.49Å; T154-R444 HydrophobicContact CG2-CB 4.02Å
155	L	58.7	Low	73.5	Confident	56 Å²	56	23.2 Å²	23.2	29%	0.293	13%	0.128	S	C	.	.	P	Polyproline II helix	trans	-48.8	147.4	166.8	-69.3	141.9	0	0	0	111.1	F153 P412 Y414	F153-L155 PolarHBondContact O-N 3.49Å; L155-P412 HydrophobicContact CD1-CG 4.05Å; L155-P412 HydrophobicContact CD2-CG 4.05Å; L155-Y414 HydrophobicContact CD1-CE1 4.46Å; L155-Y414 WeakPolarHBondContact CD1-OH 3.47Å; L155-Y414 WeakPolarHBondContact CD2-OH 3.45Å; L155-Y414 WeakPolarHBondContact CG-OH 3.33Å
156	P	68.2	Low	73.6	Confident	4 Å²	4	23.7 Å²	23.7	3%	0.026	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-50	147	167.5	-16.9	25.7	0	0	0	109.8	L158 S161 V165 F166 L169	P156-L158 PolarHBondContact O-N 2.97Å; P156-S161 WeakPolarHBondContact CB-OG 3.34Å; P156-V165 HydrophobicContact CB-CG1 4.03Å; P156-V165 HydrophobicContact CG-CG1 3.66Å; P156-F166 HydrophobicContact CB-CE1 4.42Å; P156-L169 VanDerWaalsContact CD-CD1 3.43Å; P156-L169 HydrophobicContact CG-CD1 3.28Å
157	S	75.8	Confident	73.7	Confident	24 Å²	24	24.7 Å²	24.7	17%	0.168	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-55.9	116.9	178.2	174.5	0	0	0	0	110	M159 Y160 S161	S157-M159 PolarHBondContact O-N 3.45Å; S157-M159 PolarHBondContact OG-N 3.46Å; S157-Y160 PolarHBondContact O-N 2.97Å; S157-Y160 WeakPolarHBondContact OG-CD2 3.46Å; S157-Y160 PolarHBondContact OG-N 3.47Å; S157-S161 PolarHBondContact N-OG 3.03Å; S157-S161 VanDerWaalsContact O-CB 3.24Å; S157-S161 WeakPolarHBondContact O-CB 3.37Å; S157-S161 PolarHBondContact O-N 2.78Å; S157-S161 PolarHBondContact O-OG 3.26Å
158	L	75.6	Confident	73.7	Confident	26 Å²	26	26.4 Å²	26.4	14%	0.136	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.1	174.8	-65	176.3	0	0	0	112.5	P156 F166 E226 I229 I230 F233	P156-L158 PolarHBondContact O-N 2.97Å; L158-F166 HydrophobicContact CD2-CE1 3.84Å; L158-F166 HydrophobicContact CD2-CZ 4.29Å; L158-E226 HydrophobicContact CD1-CB 3.71Å; L158-E226 HydrophobicContact CD1-CG 3.7Å; L158-I229 WeakPolarHBondContact O-CG2 3.2Å; L158-I230 HydrophobicContact CD2-CD1 3.82Å; L158-I230 HydrophobicContact CD2-CG1 3.94Å; L158-F233 WeakPolarHBondContact O-CE2 3.44Å
159	M	78.7	Confident	73.9	Confident	27 Å²	27	26.7 Å²	26.7	13%	0.133	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-32.8	-178	-61.1	-63.5	155.5	0	0	113.3	S157 L216 I229	S157-M159 PolarHBondContact O-N 3.45Å; S157-M159 PolarHBondContact OG-N 3.46Å; M159-L216 HydrophobicContact SD-CB 3.75Å; M159-L216 HydrophobicContact SD-CD1 4.34Å; M159-I229 HydrophobicContact CE-CD1 3.22Å; M159-I229 HydrophobicContact SD-CD1 4.26Å
160	Y	87.8	Confident	74.1	Confident	22 Å²	22	25.7 Å²	25.7	9%	0.086	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-28	-168	-59.3	-64.3	0	0	0	112.6	L121 T122 P123 S157 W197 S198 V201 I202 E205	L121-Y160 WeakPolarHBondContact O-CB 3.35Å; T122-Y160 HydrophobicContact CG2-CD2 3.82Å; P123-Y160 VanDerWaalsContact CD-CZ 3.44Å; P123-Y160 HydrophobicContact CG-CE1 3.92Å; P123-Y160 HydrophobicContact CG-CE2 3.97Å; P123-Y160 WeakPolarHBondContact CG-OH 3.32Å; S157-Y160 PolarHBondContact O-N 2.97Å; S157-Y160 WeakPolarHBondContact OG-CD2 3.46Å; S157-Y160 PolarHBondContact OG-N 3.47Å; Y160-W197 VanDerWaalsContact O-CD1 3.26Å; Y160-S198 VanDerWaalsContact O-CA 3.25Å; Y160-S198 WeakPolarHBondContact O-CA 3.33Å; Y160-S198 WeakPolarHBondContact O-CB 3.33Å; Y160-S198 PolarHBondContact O-OG 2.88Å; Y160-V201 HydrophobicContact CD1-CB 4.23Å; Y160-V201 HydrophobicContact CD1-CG1 3.69Å; Y160-V201 HydrophobicContact CE1-CG1 4.07Å; Y160-I202 HydrophobicContact CD1-CG1 3.86Å; Y160-I202 HydrophobicContact CE1-CG1 4.14Å; Y160-E205 VanDerWaalsContact CE1-OE2 3.23Å; Y160-E205 WeakPolarHBondContact CE1-OE2 3.06Å; Y160-E205 PolarHBondContact OH-OE1 3.48Å; Y160-E205 PolarHBondContact OH-OE2 3.45Å
161	S	87.1	Confident	74.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-72.1	146.4	-175.4	-63.6	0	0	0	0	112.3	W119 P156 S157	W119-S161 PolarHBondContact O-OG 3.43Å; W119-S161 VanDerWaalsContact O-OG 3.07Å; P156-S161 WeakPolarHBondContact CB-OG 3.34Å; S157-S161 PolarHBondContact N-OG 3.03Å; S157-S161 VanDerWaalsContact O-CB 3.24Å; S157-S161 WeakPolarHBondContact O-CB 3.37Å; S157-S161 PolarHBondContact O-N 2.78Å; S157-S161 PolarHBondContact O-OG 3.26Å
162	A	89.5	Confident	74.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.			trans	-69	150.8	-179.4	0	0	0	0	0	112.2	E164 V165 A194 W197	A162-E164 VanDerWaalsContact C-N 3.25Å; A162-E164 VanDerWaalsContact CB-CD 3.47Å; A162-E164 HydrophobicContact CB-CG 4.47Å; A162-E164 WeakPolarHBondContact CB-OE1 3.39Å; A162-E164 WeakPolarHBondContact CB-OE2 3.21Å; A162-E164 PolarHBondContact O-N 3.12Å; A162-V165 HydrophobicContact CB-CG2 4.21Å; A162-V165 WeakPolarHBondContact O-CB 3.42Å; A162-V165 PolarHBondContact O-N 3.19Å; A162-A194 HydrophobicContact CB-CB 4.05Å; A162-W197 VanDerWaalsContact CA-CD1 3.43Å; A162-W197 HydrophobicContact CB-CB 3.76Å; A162-W197 HydrophobicContact CB-CD2 4.22Å; A162-W197 HydrophobicContact CB-CG 3.64Å
163	P	86.9	Confident	74.4	Confident	1 Å²	1	29 Å²	29	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-53.3	-40.8	-178.5	-22.6	29.3	0	0	0	113.4	V165 F166 W197 F233 L237 F274	P163-V165 PolarHBondContact O-N 3.2Å; P163-F166 PolarHBondContact O-N 3.21Å; P163-W197 HydrophobicContact CG-CH2 4.02Å; P163-W197 HydrophobicContact CG-CZ2 4.08Å; P163-W197 HydrophobicContact CG-CZ3 4.45Å; P163-F233 HydrophobicContact CB-CB 4.22Å; P163-F233 HydrophobicContact CG-CB 4.19Å; P163-L237 HydrophobicContact CB-CD2 4.45Å; P163-F274 HydrophobicContact CG-CD1 3.92Å; P163-F274 HydrophobicContact CG-CE1 4.29Å
164	E	86	Confident	74.4	Confident	45 Å²	45	30.3 Å²	30.3	21%	0.21	16%	0.157	C	C	.	.	H	α-helix	trans	-67.6	-21.5	-177.9	67	-87.3	-161.4	0	0	113.9	A162 F166 L167 F168 A276 R279	A162-E164 VanDerWaalsContact C-N 3.25Å; A162-E164 VanDerWaalsContact CB-CD 3.47Å; A162-E164 HydrophobicContact CB-CG 4.47Å; A162-E164 WeakPolarHBondContact CB-OE1 3.39Å; A162-E164 WeakPolarHBondContact CB-OE2 3.21Å; A162-E164 PolarHBondContact O-N 3.12Å; E164-F166 VanDerWaalsContact C-N 3.32Å; E164-L167 PolarHBondContact O-N 3.44Å; E164-F168 WeakPolarHBondContact O-CB 3.03Å; E164-F168 PolarHBondContact O-N 3.18Å; E164-A276 HydrophobicContact CG-CB 4.43Å; E164-R279 IonicContact OE1-CZ 3.47Å; E164-R279 IonicContact OE1-NH1 2.66Å; E164-R279 PolarHBondContact OE1-NH1 3.45Å; E164-R279 IonicContact OE1-NH2 3.41Å; E164-R279 PolarHBondContact OE1-NH2 3.06Å; E164-R279 IonicContact OE2-NH1 3.82Å; E164-R279 IonicContact OE2-NH2 3.23Å; E164-R279 PolarHBondContact OE2-NH2 3.46Å
165	V	83.4	Confident	74.5	Confident	7 Å²	7	34.1 Å²	34.1	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-40.3	175.3	179.8	0	0	0	0	109.9	P156 A162 P163 F168 L169 A194	P156-V165 HydrophobicContact CB-CG1 4.03Å; P156-V165 HydrophobicContact CG-CG1 3.66Å; A162-V165 HydrophobicContact CB-CG2 4.21Å; A162-V165 WeakPolarHBondContact O-CB 3.42Å; A162-V165 PolarHBondContact O-N 3.19Å; P163-V165 PolarHBondContact O-N 3.2Å; V165-F168 PolarHBondContact O-N 3.47Å; V165-L169 HydrophobicContact CG1-CD1 4.35Å; V165-L169 WeakPolarHBondContact O-CG 3.42Å; V165-L169 PolarHBondContact O-N 3.01Å; V165-A194 HydrophobicContact CG2-CB 3.8Å
166	F	79.5	Confident	74	Confident	10 Å²	10	37 Å²	37	4%	0.044	19%	0.192	C	C	.	.	H	α-helix	trans	-68.3	-38.9	178	-54.7	-68.7	0	0	0	112	P156 L158 P163 E164 F168 L169 Y170 I230 F233	P156-F166 HydrophobicContact CB-CE1 4.42Å; L158-F166 HydrophobicContact CD2-CE1 3.84Å; L158-F166 HydrophobicContact CD2-CZ 4.29Å; P163-F166 PolarHBondContact O-N 3.21Å; E164-F166 VanDerWaalsContact C-N 3.32Å; F166-F168 VanDerWaalsContact C-N 3.35Å; F166-L169 PolarHBondContact O-N 3.16Å; F166-Y170 VanDerWaalsContact O-CB 3.3Å; F166-Y170 WeakPolarHBondContact O-CB 3.45Å; F166-Y170 PolarHBondContact O-N 3.31Å; F166-I230 HydrophobicContact CB-CG2 4.38Å; F166-I230 HydrophobicContact CD1-CD1 4.23Å; F166-I230 HydrophobicContact CD1-CG1 4.3Å; F166-I230 HydrophobicContact CG-CG1 4.4Å; F166-F233 HydrophobicContact CE2-CD2 4.28Å
167	L	78.3	Confident	72.7	Confident	64 Å²	64	42.3 Å²	42.3	34%	0.335	23%	0.228	S	C	.	.	H	α-helix	trans	-62.9	-41.8	174.5	-68.7	176	0	0	0	111.7	E164 Y170 N171 L234 L237	E164-L167 PolarHBondContact O-N 3.44Å; L167-Y170 PolarHBondContact O-N 3.33Å; L167-N171 PolarHBondContact O-N 2.85Å; L167-L234 HydrophobicContact CD1-CD2 4.26Å; L167-L234 HydrophobicContact CD2-CD2 3.64Å; L167-L234 HydrophobicContact CG-CD2 3.9Å; L167-L237 HydrophobicContact CD1-CD2 3.71Å
168	F	74.2	Confident	70.6	Confident	47 Å²	47	48.3 Å²	48.3	21%	0.206	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-51.1	176.7	176.2	-97.7	0	0	0	111.7	W119 E164 V165 F166 Y170 N171 Q172 W189	W119-F168 HydrophobicContact CH2-CD1 4.09Å; W119-F168 AromaticContact CH2-CE1 3.67Å; W119-F168 HydrophobicContact CH2-CE1 3.67Å; W119-F168 HydrophobicContact CH2-CZ 4.22Å; W119-F168 HydrophobicContact CZ3-CD1 4.22Å; W119-F168 AromaticContact CZ3-CE1 3.9Å; W119-F168 HydrophobicContact CZ3-CE1 3.9Å; E164-F168 WeakPolarHBondContact O-CB 3.03Å; E164-F168 PolarHBondContact O-N 3.18Å; V165-F168 PolarHBondContact O-N 3.47Å; F166-F168 VanDerWaalsContact C-N 3.35Å; F168-Y170 VanDerWaalsContact C-N 3.29Å; F168-Y170 PolarHBondContact O-N 3.19Å; F168-N171 PolarHBondContact O-N 2.69Å; F168-Q172 WeakPolarHBondContact O-CB 3.33Å; F168-Q172 PolarHBondContact O-N 3.31Å; F168-W189 HydrophobicContact CD2-CB 4.49Å; F168-W189 HydrophobicContact CE2-CB 3.52Å; F168-W189 HydrophobicContact CE2-CD2 4.41Å; F168-W189 HydrophobicContact CE2-CE3 4.28Å; F168-W189 HydrophobicContact CE2-CG 4.14Å; F168-W189 HydrophobicContact CZ-CB 3.82Å; F168-W189 HydrophobicContact CZ-CG 4.34Å
169	L	72.3	Confident	68.6	Low	28 Å²	28	52.9 Å²	52.9	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-37.3	179.1	-69.4	176.8	0	0	0	112.3	P156 V165 F166 Q172 A173	P156-L169 VanDerWaalsContact CD-CD1 3.43Å; P156-L169 HydrophobicContact CG-CD1 3.28Å; V165-L169 HydrophobicContact CG1-CD1 4.35Å; V165-L169 WeakPolarHBondContact O-CG 3.42Å; V165-L169 PolarHBondContact O-N 3.01Å; F166-L169 PolarHBondContact O-N 3.16Å; L169-Q172 PolarHBondContact O-N 3.26Å; L169-A173 WeakPolarHBondContact O-CB 3.5Å; L169-A173 PolarHBondContact O-N 3.02Å
170	Y	70.9	Confident	66.4	Low	42 Å²	42	59.4 Å²	59.4	17%	0.165	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-46.3	174.1	179.1	-104	0	0	0	111.9	F166 L167 F168 A173 N174 L415 V418	F166-Y170 VanDerWaalsContact O-CB 3.3Å; F166-Y170 WeakPolarHBondContact O-CB 3.45Å; F166-Y170 PolarHBondContact O-N 3.31Å; L167-Y170 PolarHBondContact O-N 3.33Å; F168-Y170 VanDerWaalsContact C-N 3.29Å; F168-Y170 PolarHBondContact O-N 3.19Å; Y170-A173 PolarHBondContact O-N 2.89Å; Y170-N174 WeakPolarHBondContact CD1-ND2 3.48Å; Y170-N174 WeakPolarHBondContact CE1-ND2 3.24Å; Y170-N174 WeakPolarHBondContact CE2-ND2 3.22Å; Y170-N174 PolarHBondContact O-N 3.43Å; Y170-N174 PolarHBondContact O-ND2 2.78Å; Y170-N174 PolarHBondContact OH-ND2 3.15Å; Y170-L415 HydrophobicContact CD2-CB 4.31Å; Y170-L415 WeakPolarHBondContact CD2-O 3.33Å; Y170-L415 WeakPolarHBondContact CE2-O 3.48Å; Y170-V418 HydrophobicContact CE2-CB 4.24Å
171	N	68.7	Low	63.8	Low	90 Å²	90	69.2 Å²	69.2	48%	0.481	36%	0.355	S	S	.	.	H	α-helix	trans	-65.1	-41.6	177.3	-77.2	-20.9	0	0	0	112.3	L167 F168 A173 N174 N175	L167-N171 PolarHBondContact O-N 2.85Å; F168-N171 PolarHBondContact O-N 2.69Å; N171-A173 VanDerWaalsContact C-N 3.34Å; N171-A173 PolarHBondContact O-N 3.07Å; N171-N174 PolarHBondContact O-N 2.6Å; N171-N175 WeakPolarHBondContact O-CB 3.48Å; N171-N175 VanDerWaalsContact O-CG 3.26Å; N171-N175 PolarHBondContact O-N 2.94Å; N171-N175 PolarHBondContact O-ND2 3.28Å
172	Q	64.5	Low	61.4	Low	36 Å²	36	74 Å²	74	17%	0.168	39%	0.389	C	S	.	.	H	α-helix	trans	-60.3	-45.1	176.4	-170.5	176.2	26	0	0	111.1	N149 F168 L169 N174 N175 L176	N149-Q172 PolarHBondContact OD1-NE2 3.22Å; F168-Q172 WeakPolarHBondContact O-CB 3.33Å; F168-Q172 PolarHBondContact O-N 3.31Å; L169-Q172 PolarHBondContact O-N 3.26Å; Q172-N174 PolarHBondContact O-N 2.66Å; Q172-N175 PolarHBondContact O-N 2.6Å; Q172-L176 WeakPolarHBondContact O-CD1 3.25Å; Q172-L176 WeakPolarHBondContact O-CG 3.2Å; Q172-L176 PolarHBondContact O-N 3.48Å
173	A	63.4	Low	58.9	Low	24 Å²	24	80.8 Å²	80.8	20%	0.198	42%	0.423	C	S	.	.	H	α-helix	trans	-61.2	-40.8	176.4	0	0	0	0	0	112.8	L169 Y170 N171 I411	L169-A173 WeakPolarHBondContact O-CB 3.5Å; L169-A173 PolarHBondContact O-N 3.02Å; Y170-A173 PolarHBondContact O-N 2.89Å; N171-A173 VanDerWaalsContact C-N 3.34Å; N171-A173 PolarHBondContact O-N 3.07Å; A173-I411 HydrophobicContact CB-CD1 4.07Å; A173-I411 HydrophobicContact CB-CG1 4.21Å
174	N	60.4	Low	56.7	Low	61 Å²	61	90.1 Å²	90.1	33%	0.326	46%	0.463	S	S	.	.	H	α-helix	trans	-75.4	-33.6	179.4	-71.9	-34.8	0	0	0	113.4	Y170 N171 Q172	Y170-N174 WeakPolarHBondContact CD1-ND2 3.48Å; Y170-N174 WeakPolarHBondContact CE1-ND2 3.24Å; Y170-N174 WeakPolarHBondContact CE2-ND2 3.22Å; Y170-N174 PolarHBondContact O-N 3.43Å; Y170-N174 PolarHBondContact O-ND2 2.78Å; Y170-N174 PolarHBondContact OH-ND2 3.15Å; N171-N174 PolarHBondContact O-N 2.6Å; Q172-N174 PolarHBondContact O-N 2.66Å
175	N	54.2	Low	54.7	Low	102 Å²	102	90.1 Å²	90.1	55%	0.545	47%	0.468	S	S	.	.	H	α-helix	trans	-75.2	-24.6	179.7	-72.8	-18.8	0	0	0	112.9	N171 Q172 C177 Q178	N171-N175 WeakPolarHBondContact O-CB 3.48Å; N171-N175 VanDerWaalsContact O-CG 3.26Å; N171-N175 PolarHBondContact O-N 2.94Å; N171-N175 PolarHBondContact O-ND2 3.28Å; Q172-N175 PolarHBondContact O-N 2.6Å; N175-C177 PolarHBondContact O-N 3.3Å; N175-C177 VanDerWaalsContact O-N 3.08Å; N175-Q178 PolarHBondContact O-N 3.06Å
176	L	48.8	Very low	53.1	Low	116 Å²	116	94.3 Å²	94.3	61%	0.607	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-19	174.5	-83	157.1	0	0	0	113.4	Q172 Q178	Q172-L176 WeakPolarHBondContact O-CD1 3.25Å; Q172-L176 WeakPolarHBondContact O-CG 3.2Å; Q172-L176 PolarHBondContact O-N 3.48Å; L176-Q178 VanDerWaalsContact C-N 3.33Å
177	C	40	Very low	51.8	Low	117 Å²	117	101.8 Å²	101.8	79%	0.791	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-8.9	172.6	-69.5	0	0	0	0	114.5	N175	N175-C177 PolarHBondContact O-N 3.3Å; N175-C177 VanDerWaalsContact O-N 3.08Å
178	Q	32.4	Very low	50.8	Low	149 Å²	149	100.4 Å²	100.4	70%	0.696	52%	0.518	S	S	*	.	S	Bend	trans	-106.7	109.5	176.8	-63.3	-174.2	18.7	0	0	109.3	N175 L176 E180	N175-Q178 PolarHBondContact O-N 3.06Å; L176-Q178 VanDerWaalsContact C-N 3.33Å; Q178-E180 PolarHBondContact O-N 2.85Å
179	S	34.2	Very low	50	Low	122 Å²	122	106.9 Å²	106.9	85%	0.853	54%	0.541	S	S	*	.			trans	-72.6	24.1	-170.5	55.4	0	0	0	0	115.8
180	E	31.8	Very low	49.6	Very low	164 Å²	164	106.6 Å²	106.6	77%	0.766	55%	0.546	S	S	*	.			trans	-127	128.2	-173.7	-72.2	-173.1	172.2	0	0	113.6	Q178	Q178-E180 PolarHBondContact O-N 2.85Å
181	R	33.3	Very low	50	Low	229 Å²	229	108.6 Å²	108.6	86%	0.864	56%	0.559	S	S	*	*			trans	73.6	66.4	168.5	-59.9	178.3	178.5	174.4	-0.6	116.9	I183	R181-I183 PolarHBondContact O-N 2.85Å
182	S	37.3	Very low	51.2	Low	101 Å²	101	104.7 Å²	104.7	71%	0.706	54%	0.538	S	S	*	.			trans	-72.7	81.5	150.4	68.6	0	0	0	0	109.2	K184	S182-K184 PolarHBondContact O-N 2.93Å
183	I	36	Very low	52.6	Low	141 Å²	141	104.3 Å²	104.3	72%	0.723	54%	0.536	S	S	*	.			trans	-63.1	98.7	153.7	-62.3	172.5	0	0	0	103.9	R181 S185	R181-I183 PolarHBondContact O-N 2.85Å; I183-S185 PolarHBondContact O-N 2.78Å
184	K	41.9	Very low	54	Low	197 Å²	197	103.3 Å²	103.3	86%	0.857	53%	0.528	S	S	*	.			trans	-64.1	76.5	174.9	-74.1	-178.9	177.1	177.6	0	108.3	S182	S182-K184 PolarHBondContact O-N 2.93Å
185	S	43.5	Very low	55.6	Low	45 Å²	45	100.4 Å²	100.4	32%	0.315	51%	0.513	S	S	.	.			trans	-86.3	123.8	170.6	79.4	0	0	0	0	107.9	I183 K187	I183-S185 PolarHBondContact O-N 2.78Å; S185-K187 PolarHBondContact O-N 3.22Å
186	D	50.4	Low	57.6	Low	95 Å²	95	95.6 Å²	95.6	51%	0.508	49%	0.487	S	S	.	.			trans	-62.3	-1	164.2	-89.2	-21.8	0	0	0	112.6	R47 C188	R47-D186 IonicContact CZ-OD1 3.42Å; R47-D186 IonicContact NH2-OD1 3.49Å; R47-D186 PolarHBondContact NH2-OD1 3.46Å; D186-C188 PolarHBondContact O-N 3.19Å
187	K	52	Low	59.8	Low	168 Å²	168	90 Å²	90	73%	0.73	46%	0.458	S	S	*	.			trans	-68.6	121.8	-177.6	-144	173.4	-173.5	178.8	0	110.3	S185 W189	S185-K187 PolarHBondContact O-N 3.22Å; K187-W189 PolarHBondContact O-N 2.84Å
188	C	56.9	Low	62.4	Low	34 Å²	34	84.5 Å²	84.5	23%	0.23	42%	0.42	C	S	.	.			trans	-59.3	118.4	172.4	-179	0	0	0	0	110	W147 D186 G190	W147-C188 HydrophobicContact CH2-CB 3.39Å; W147-C188 WeakPolarHBondContact CH2-SG 3.3Å; W147-C188 VanDerWaalsContact CZ2-CA 3.46Å; W147-C188 HydrophobicContact CZ2-CB 3.6Å; W147-C188 HydrophobicContact CZ3-CB 4.17Å; W147-C188 VanDerWaalsContact CZ3-SG 3.56Å; D186-C188 PolarHBondContact O-N 3.19Å; C188-G190 VanDerWaalsContact C-N 3.34Å; C188-G190 PolarHBondContact SG-O 2.71Å
189	W	58.2	Low	65.5	Low	183 Å²	183	77.4 Å²	77.4	69%	0.693	39%	0.387	S	S	*	.			trans	-78.2	-22.3	179.5	-69.2	63.6	0	0	0	112.4	F168 K187	F168-W189 HydrophobicContact CD2-CB 4.49Å; F168-W189 HydrophobicContact CE2-CB 3.52Å; F168-W189 HydrophobicContact CE2-CD2 4.41Å; F168-W189 HydrophobicContact CE2-CE3 4.28Å; F168-W189 HydrophobicContact CE2-CG 4.14Å; F168-W189 HydrophobicContact CZ-CB 3.82Å; F168-W189 HydrophobicContact CZ-CG 4.34Å; K187-W189 PolarHBondContact O-N 2.84Å
190	G	63.1	Low	68.4	Low	23 Å²	23	71.6 Å²	71.6	24%	0.237	35%	0.347	C	S	.	.	S	Bend	trans	-95.3	163.4	177.5	0	0	0	0	0	113.2	W119 C188	W119-G190 VanDerWaalsContact CZ2-CA 3.48Å; C188-G190 VanDerWaalsContact C-N 3.34Å; C188-G190 PolarHBondContact SG-O 2.71Å
191	N	80	Confident	71.2	Confident	84 Å²	84	64.8 Å²	64.8	45%	0.449	32%	0.316	S	S	.	.			trans	-108.7	138.5	-175.9	-171.5	-26.7	0	0	0	109.2	K193 A194	N191-K193 PolarHBondContact O-N 2.72Å; N191-K193 WeakPolarHBondContact OD1-CG 3.34Å; N191-K193 PolarHBondContact OD1-N 2.72Å; N191-K193 VanDerWaalsContact OD1-N 3.1Å; N191-A194 PolarHBondContact O-N 2.66Å
192	I	92	Very high	74.1	Confident	8 Å²	8	54 Å²	54	4%	0.041	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-21.9	174.2	-166	73.5	0	0	0	112.8	L108 M111 V117 A194 D195 V196 P282	L108-I192 HydrophobicContact CB-CD1 4.35Å; L108-I192 HydrophobicContact CB-CG1 4.33Å; L108-I192 HydrophobicContact CD2-CD1 4.29Å; L108-I192 WeakPolarHBondContact O-CD1 3.3Å; M111-I192 HydrophobicContact CB-CD1 4.07Å; V117-I192 HydrophobicContact CG1-CD1 4.38Å; I192-A194 PolarHBondContact O-N 3.46Å; I192-D195 HydrophobicContact CD1-CB 4.41Å; I192-D195 WeakPolarHBondContact CD1-OD2 3.35Å; I192-D195 WeakPolarHBondContact O-CA 3.45Å; I192-D195 WeakPolarHBondContact O-CB 3.2Å; I192-D195 PolarHBondContact O-N 3.26Å; I192-V196 PolarHBondContact O-N 3.08Å; I192-V196 VanDerWaalsContact O-N 3.15Å; I192-P282 HydrophobicContact CG1-CG 3.91Å; I192-P282 HydrophobicContact CG2-CG 4.19Å
193	K	94.8	Very high	76.7	Confident	27 Å²	27	49.1 Å²	49.1	12%	0.117	24%	0.242	C	C	.	.	H	α-helix	trans	-58.1	-25.9	173.6	-68.3	-174.2	-176.9	-166	0	113.9	N191 D195 V196 W197 A276 I277 R279	N191-K193 PolarHBondContact O-N 2.72Å; N191-K193 WeakPolarHBondContact OD1-CG 3.34Å; N191-K193 PolarHBondContact OD1-N 2.72Å; N191-K193 VanDerWaalsContact OD1-N 3.1Å; K193-D195 VanDerWaalsContact C-N 3.28Å; K193-D195 PolarHBondContact O-N 3.33Å; K193-V196 WeakPolarHBondContact O-CB 3.43Å; K193-V196 PolarHBondContact O-N 3.42Å; K193-W197 PolarHBondContact O-N 3.49Å; K193-W197 VanDerWaalsContact O-N 3.09Å; K193-A276 WeakPolarHBondContact CD-O 3.38Å; K193-A276 PolarHBondContact NZ-O 3.2Å; K193-A276 VanDerWaalsContact NZ-O 3.07Å; K193-I277 PolarHBondContact NZ-O 3.4Å; K193-R279 HydrophobicContact CD-CB 4.29Å; K193-R279 VanDerWaalsContact CD-O 3.31Å; K193-R279 WeakPolarHBondContact CD-O 3.47Å; K193-R279 WeakPolarHBondContact CE-O 3.33Å; K193-R279 PolarHBondContact NZ-O 3.08Å; K193-R279 WeakPolarHBondContact O-CD 3.46Å; K193-R279 PolarHBondContact O-NH1 3.04Å
194	A	92.5	Very high	79.3	Confident	4 Å²	4	42.9 Å²	42.9	3%	0.033	21%	0.209	C	C	.	.	H	α-helix	trans	-65	-34.6	172.2	0	0	0	0	0	111.9	A162 V165 N191 I192 W197 S198	A162-A194 HydrophobicContact CB-CB 4.05Å; V165-A194 HydrophobicContact CG2-CB 3.8Å; N191-A194 PolarHBondContact O-N 2.66Å; I192-A194 PolarHBondContact O-N 3.46Å; A194-W197 PolarHBondContact O-N 3Å; A194-S198 PolarHBondContact O-N 3.28Å; A194-S198 VanDerWaalsContact O-N 3.16Å; A194-S198 PolarHBondContact O-OG 3.14Å
195	D	94.7	Very high	81.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-74.9	-31.9	175.1	-58.4	-37.5	0	0	0	111.3	L108 V117 H118 W119 I192 K193 W197 S198 L199	L108-D195 HydrophobicContact CD1-CB 4.15Å; L108-D195 HydrophobicContact CD2-CB 3.73Å; V117-D195 WeakPolarHBondContact CA-OD2 3.19Å; H118-D195 PolarHBondContact N-OD1 2.93Å; H118-D195 PolarHBondContact N-OD2 3.22Å; W119-D195 WeakPolarHBondContact CA-OD1 2.98Å; W119-D195 PolarHBondContact N-OD1 3.19Å; I192-D195 HydrophobicContact CD1-CB 4.41Å; I192-D195 WeakPolarHBondContact CD1-OD2 3.35Å; I192-D195 WeakPolarHBondContact O-CA 3.45Å; I192-D195 WeakPolarHBondContact O-CB 3.2Å; I192-D195 PolarHBondContact O-N 3.26Å; K193-D195 VanDerWaalsContact C-N 3.28Å; K193-D195 PolarHBondContact O-N 3.33Å; D195-W197 VanDerWaalsContact C-N 3.33Å; D195-W197 PolarHBondContact O-N 2.94Å; D195-S198 PolarHBondContact O-N 3.24Å; D195-L199 WeakPolarHBondContact O-CB 3.11Å; D195-L199 PolarHBondContact O-N 2.88Å
196	V	96.8	Very high	83.7	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-42	171	174.9	0	0	0	0	111.3	L108 I192 K193 L199 G200 C271 R279 P282 L285	L108-V196 HydrophobicContact CD1-CG2 4.45Å; I192-V196 PolarHBondContact O-N 3.08Å; I192-V196 VanDerWaalsContact O-N 3.15Å; K193-V196 WeakPolarHBondContact O-CB 3.43Å; K193-V196 PolarHBondContact O-N 3.42Å; V196-L199 PolarHBondContact O-N 3.09Å; V196-G200 PolarHBondContact O-N 3.29Å; V196-C271 HydrophobicContact CG1-CB 3.77Å; V196-R279 HydrophobicContact CG1-CG 4.25Å; V196-P282 HydrophobicContact CG2-CG 3.75Å; V196-L285 HydrophobicContact CG1-CD1 3.67Å
197	W	95.2	Very high	85.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.7	-49	172.7	169.9	-76.5	0	0	0	111.4	Y160 A162 P163 K193 A194 D195 L199 G200 V201 F233 L246 L272 R273 F274	Y160-W197 VanDerWaalsContact O-CD1 3.26Å; A162-W197 VanDerWaalsContact CA-CD1 3.43Å; A162-W197 HydrophobicContact CB-CB 3.76Å; A162-W197 HydrophobicContact CB-CD2 4.22Å; A162-W197 HydrophobicContact CB-CG 3.64Å; P163-W197 HydrophobicContact CG-CH2 4.02Å; P163-W197 HydrophobicContact CG-CZ2 4.08Å; P163-W197 HydrophobicContact CG-CZ3 4.45Å; K193-W197 PolarHBondContact O-N 3.49Å; K193-W197 VanDerWaalsContact O-N 3.09Å; A194-W197 PolarHBondContact O-N 3Å; D195-W197 VanDerWaalsContact C-N 3.33Å; D195-W197 PolarHBondContact O-N 2.94Å; W197-L199 VanDerWaalsContact C-N 3.27Å; W197-L199 PolarHBondContact O-N 3.28Å; W197-G200 WeakPolarHBondContact O-CA 3.47Å; W197-G200 PolarHBondContact O-N 2.82Å; W197-V201 PolarHBondContact O-N 3.36Å; W197-F233 HydrophobicContact CZ2-CD1 4.12Å; W197-F233 AromaticContact CZ2-CE1 3.86Å; W197-F233 HydrophobicContact CZ2-CE1 3.86Å; W197-L246 HydrophobicContact CH2-CB 3.97Å; W197-L246 HydrophobicContact CH2-CD2 4.39Å; W197-L246 HydrophobicContact CZ2-CB 4.49Å; W197-L246 HydrophobicContact CZ2-CD2 4.08Å; W197-L272 HydrophobicContact CD2-CD2 4.35Å; W197-L272 VanDerWaalsContact CZ3-O 3.25Å; W197-L272 WeakPolarHBondContact CZ3-O 3.43Å; W197-R273 WeakPolarHBondContact CZ3-O 3.07Å; W197-F274 AromaticContact CH2-CD1 3.88Å; W197-F274 HydrophobicContact CH2-CD1 3.88Å; W197-F274 AromaticContact CH2-CE1 3.8Å; W197-F274 HydrophobicContact CH2-CE1 3.8Å; W197-F274 HydrophobicContact CH2-CG 4.42Å; W197-F274 HydrophobicContact CH2-CZ 4.29Å; W197-F274 HydrophobicContact CZ3-CD1 4.26Å; W197-F274 HydrophobicContact CZ3-CG 4.46Å
198	S	94.5	Very high	87.2	Confident	1 Å²	1	21 Å²	21	1%	0.007	11%	0.105	C	C	.	.	H	α-helix	trans	-57.4	-44.2	-179.7	-51.8	0	0	0	0	110.9	Y160 A194 D195 V201 I202	Y160-S198 VanDerWaalsContact O-CA 3.25Å; Y160-S198 WeakPolarHBondContact O-CA 3.33Å; Y160-S198 WeakPolarHBondContact O-CB 3.33Å; Y160-S198 PolarHBondContact O-OG 2.88Å; A194-S198 PolarHBondContact O-N 3.28Å; A194-S198 VanDerWaalsContact O-N 3.16Å; A194-S198 PolarHBondContact O-OG 3.14Å; D195-S198 PolarHBondContact O-N 3.24Å; S198-V201 PolarHBondContact O-N 3.48Å; S198-I202 WeakPolarHBondContact O-CD1 3.48Å; S198-I202 WeakPolarHBondContact O-CG1 3.17Å; S198-I202 PolarHBondContact O-N 2.9Å; S198-I202 VanDerWaalsContact O-N 3.08Å
199	L	96.2	Very high	88.3	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.4	-42.9	174.1	-173.2	66.4	0	0	0	112.2	F101 C104 L105 L108 L121 I126 D195 V196 W197 V201 I202 F203	F101-L199 HydrophobicContact CD2-CD2 4.08Å; F101-L199 HydrophobicContact CD2-CG 4.24Å; F101-L199 HydrophobicContact CE2-CD2 3.73Å; F101-L199 HydrophobicContact CE2-CG 3.88Å; F101-L199 HydrophobicContact CZ-CD2 4.45Å; C104-L199 HydrophobicContact CB-CD1 3.55Å; C104-L199 HydrophobicContact CB-CD2 3.81Å; C104-L199 HydrophobicContact CB-CG 4.34Å; L105-L199 HydrophobicContact CD2-CD2 3.82Å; L105-L199 HydrophobicContact CG-CD2 4.19Å; L108-L199 HydrophobicContact CD1-CB 4.34Å; L108-L199 HydrophobicContact CD1-CD2 3.92Å; L121-L199 HydrophobicContact CD2-CB 4.33Å; I126-L199 HydrophobicContact CD1-CD1 4.08Å; D195-L199 WeakPolarHBondContact O-CB 3.11Å; D195-L199 PolarHBondContact O-N 2.88Å; V196-L199 PolarHBondContact O-N 3.09Å; W197-L199 VanDerWaalsContact C-N 3.27Å; W197-L199 PolarHBondContact O-N 3.28Å; L199-V201 PolarHBondContact O-N 3.42Å; L199-I202 PolarHBondContact O-N 3.32Å; L199-F203 HydrophobicContact CD1-CD2 3.63Å; L199-F203 HydrophobicContact CD1-CE2 3.52Å; L199-F203 HydrophobicContact CG-CD2 4.03Å; L199-F203 HydrophobicContact CG-CE2 4.26Å; L199-F203 PolarHBondContact O-N 3.16Å
200	G	95	Very high	88.9	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-58.2	-45.5	175.9	0	0	0	0	0	112.3	V196 W197 I202 F203 F204 I268	V196-G200 PolarHBondContact O-N 3.29Å; W197-G200 WeakPolarHBondContact O-CA 3.47Å; W197-G200 PolarHBondContact O-N 2.82Å; G200-I202 VanDerWaalsContact C-N 3.35Å; G200-I202 PolarHBondContact O-N 2.62Å; G200-F203 PolarHBondContact O-N 2.77Å; G200-F204 WeakPolarHBondContact O-CB 3.39Å; G200-F204 PolarHBondContact O-N 3.17Å; G200-I268 WeakPolarHBondContact O-CG2 3.34Å
201	V	91.5	Very high	88.8	Confident	21 Å²	21	22.5 Å²	22.5	13%	0.127	11%	0.108	C	C	.	.	H	α-helix	trans	-63	-44	177.7	178.6	0	0	0	0	110.3	Y160 W197 S198 L199 F204 E205 L272	Y160-V201 HydrophobicContact CD1-CB 4.23Å; Y160-V201 HydrophobicContact CD1-CG1 3.69Å; Y160-V201 HydrophobicContact CE1-CG1 4.07Å; W197-V201 PolarHBondContact O-N 3.36Å; S198-V201 PolarHBondContact O-N 3.48Å; L199-V201 PolarHBondContact O-N 3.42Å; V201-F204 PolarHBondContact O-N 3.14Å; V201-E205 WeakPolarHBondContact O-CB 3.05Å; V201-E205 PolarHBondContact O-N 3.21Å; V201-L272 HydrophobicContact CB-CD2 4.36Å; V201-L272 HydrophobicContact CG2-CD2 3.49Å; V201-L272 VanDerWaalsContact CG2-CD2 3.49Å
202	I	92.9	Very high	87.6	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-62.7	-48.2	-179.8	-66.3	166.1	0	0	0	111.4	F84 L121 P123 I126 Y160 S198 L199 G200 E205 I206	F84-I202 HydrophobicContact CD2-CG2 3.89Å; L121-I202 HydrophobicContact CD2-CD1 4.43Å; L121-I202 HydrophobicContact CG-CD1 4.04Å; P123-I202 HydrophobicContact CG-CG1 4.04Å; P123-I202 HydrophobicContact CG-CG2 4.33Å; I126-I202 HydrophobicContact CD1-CD1 3.89Å; I126-I202 HydrophobicContact CD1-CG2 4.17Å; Y160-I202 HydrophobicContact CD1-CG1 3.86Å; Y160-I202 HydrophobicContact CE1-CG1 4.14Å; S198-I202 WeakPolarHBondContact O-CD1 3.48Å; S198-I202 WeakPolarHBondContact O-CG1 3.17Å; S198-I202 PolarHBondContact O-N 2.9Å; S198-I202 VanDerWaalsContact O-N 3.08Å; L199-I202 PolarHBondContact O-N 3.32Å; G200-I202 VanDerWaalsContact C-N 3.35Å; G200-I202 PolarHBondContact O-N 2.62Å; I202-E205 WeakPolarHBondContact O-CB 2.91Å; I202-E205 PolarHBondContact O-N 3.37Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 VanDerWaalsContact O-CG1 3.29Å; I202-I206 WeakPolarHBondContact O-CG1 3.35Å; I202-I206 PolarHBondContact O-N 3Å
203	F	93.6	Very high	85.8	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-69.6	-36.9	-179.8	-91.6	-99.2	0	0	0	112.4	F84 L97 R100 F101 L199 G200 E205 I206 I207 I268	F84-F203 AromaticContact CE2-CE2 3.73Å; F84-F203 HydrophobicContact CE2-CE2 3.73Å; F84-F203 AromaticContact CE2-CZ 3.75Å; F84-F203 HydrophobicContact CE2-CZ 3.75Å; F84-F203 HydrophobicContact CZ-CZ 4.24Å; L97-F203 HydrophobicContact CD2-CD1 4.38Å; L97-F203 HydrophobicContact CD2-CE1 4.44Å; R100-F203 HydrophobicContact CB-CE1 4.43Å; R100-F203 HydrophobicContact CB-CZ 4.09Å; F101-F203 VanDerWaalsContact CA-CZ 3.43Å; F101-F203 HydrophobicContact CB-CD1 4.1Å; F101-F203 HydrophobicContact CB-CE1 3.57Å; F101-F203 HydrophobicContact CB-CZ 3.8Å; F101-F203 HydrophobicContact CD2-CB 4.36Å; F101-F203 AromaticContact CD2-CD1 3.74Å; F101-F203 HydrophobicContact CD2-CD1 3.74Å; F101-F203 AromaticContact CD2-CD2 3.66Å; F101-F203 HydrophobicContact CD2-CD2 3.66Å; F101-F203 AromaticContact CD2-CE1 3.89Å; F101-F203 HydrophobicContact CD2-CE1 3.89Å; F101-F203 AromaticContact CD2-CE2 3.81Å; F101-F203 HydrophobicContact CD2-CE2 3.81Å; F101-F203 AromaticContact CD2-CG 3.62Å; F101-F203 HydrophobicContact CD2-CG 3.62Å; F101-F203 AromaticContact CD2-CZ 3.92Å; F101-F203 HydrophobicContact CD2-CZ 3.92Å; F101-F203 HydrophobicContact CE2-CB 4.48Å; F101-F203 HydrophobicContact CE2-CD2 4.2Å; F101-F203 HydrophobicContact CE2-CG 4.17Å; F101-F203 HydrophobicContact CG-CD1 4.31Å; F101-F203 HydrophobicContact CG-CE1 4.2Å; F101-F203 HydrophobicContact CG-CZ 4.38Å; L199-F203 HydrophobicContact CD1-CD2 3.63Å; L199-F203 HydrophobicContact CD1-CE2 3.52Å; L199-F203 HydrophobicContact CG-CD2 4.03Å; L199-F203 HydrophobicContact CG-CE2 4.26Å; L199-F203 PolarHBondContact O-N 3.16Å; G200-F203 PolarHBondContact O-N 2.77Å; F203-E205 VanDerWaalsContact C-N 3.33Å; F203-E205 PolarHBondContact O-N 3.45Å; F203-I206 PolarHBondContact O-N 3.29Å; F203-I207 VanDerWaalsContact O-CG1 3.27Å; F203-I207 WeakPolarHBondContact O-CG1 3.26Å; F203-I207 PolarHBondContact O-N 3.13Å; F203-I268 HydrophobicContact CB-CD1 3.85Å; F203-I268 HydrophobicContact CB-CG1 4.24Å
204	F	90.2	Very high	83.9	Confident	10 Å²	10	23 Å²	23	4%	0.044	11%	0.108	C	C	.	.	H	α-helix	trans	-58.8	-48.3	171.6	-164.3	-97.6	0	0	0	110.2	G200 V201 I206 I207 F208 T213 P247 L252 L254 I268 L272	G200-F204 WeakPolarHBondContact O-CB 3.39Å; G200-F204 PolarHBondContact O-N 3.17Å; V201-F204 PolarHBondContact O-N 3.14Å; F204-I206 VanDerWaalsContact C-N 3.32Å; F204-I206 PolarHBondContact O-N 3.3Å; F204-I207 PolarHBondContact O-N 3.15Å; F204-F208 HydrophobicContact CD1-CD2 4.21Å; F204-F208 HydrophobicContact CD2-CD2 4.03Å; F204-F208 AromaticContact CD2-CE2 3.69Å; F204-F208 HydrophobicContact CD2-CE2 3.69Å; F204-F208 HydrophobicContact CE1-CD2 4.11Å; F204-F208 HydrophobicContact CE1-CE2 4.4Å; F204-F208 AromaticContact CE2-CD2 3.94Å; F204-F208 HydrophobicContact CE2-CD2 3.94Å; F204-F208 AromaticContact CE2-CE2 3.43Å; F204-F208 HydrophobicContact CE2-CE2 3.43Å; F204-F208 VanDerWaalsContact CE2-CE2 3.43Å; F204-F208 HydrophobicContact CE2-CZ 4.3Å; F204-F208 HydrophobicContact CG-CD2 4.16Å; F204-F208 HydrophobicContact CG-CE2 4.29Å; F204-F208 AromaticContact CZ-CD2 3.98Å; F204-F208 HydrophobicContact CZ-CD2 3.98Å; F204-F208 AromaticContact CZ-CE2 3.82Å; F204-F208 HydrophobicContact CZ-CE2 3.82Å; F204-F208 WeakPolarHBondContact O-CD2 3.17Å; F204-F208 PolarHBondContact O-N 3.45Å; F204-T213 HydrophobicContact CD1-CG2 3.41Å; F204-T213 VanDerWaalsContact CD1-CG2 3.41Å; F204-T213 HydrophobicContact CE1-CG2 3.69Å; F204-T213 HydrophobicContact CG-CG2 4.37Å; F204-T213 VanDerWaalsContact O-CG2 3.28Å; F204-T213 WeakPolarHBondContact O-CG2 3.26Å; F204-P247 HydrophobicContact CE1-CG 4.48Å; F204-P247 HydrophobicContact CE2-CB 4.4Å; F204-P247 HydrophobicContact CE2-CG 3.82Å; F204-P247 HydrophobicContact CZ-CB 4.1Å; F204-P247 HydrophobicContact CZ-CG 3.81Å; F204-L252 HydrophobicContact CE1-CD1 3.76Å; F204-L252 HydrophobicContact CZ-CD1 3.96Å; F204-L254 HydrophobicContact CE2-CD1 4.2Å; F204-L254 HydrophobicContact CE2-CD2 4.17Å; F204-L254 HydrophobicContact CZ-CD1 4.4Å; F204-L254 HydrophobicContact CZ-CD2 3.67Å; F204-I268 HydrophobicContact CB-CG2 4.06Å; F204-I268 HydrophobicContact CD2-CG2 4.29Å; F204-L272 HydrophobicContact CB-CD1 4.25Å; F204-L272 HydrophobicContact CD2-CD1 4.21Å; F204-L272 HydrophobicContact CG-CD1 4.2Å
205	E	88.4	Confident	82	Confident	4 Å²	4	24.5 Å²	24.5	2%	0.019	12%	0.118	C	C	.	.	H	α-helix	trans	-56.8	-40.7	175.5	-176.8	-175.8	126.5	0	0	113.3	Y160 V201 I202 F203 G209 R210 T213	Y160-E205 VanDerWaalsContact CE1-OE2 3.23Å; Y160-E205 WeakPolarHBondContact CE1-OE2 3.06Å; Y160-E205 PolarHBondContact OH-OE1 3.48Å; Y160-E205 PolarHBondContact OH-OE2 3.45Å; V201-E205 WeakPolarHBondContact O-CB 3.05Å; V201-E205 PolarHBondContact O-N 3.21Å; I202-E205 WeakPolarHBondContact O-CB 2.91Å; I202-E205 PolarHBondContact O-N 3.37Å; F203-E205 VanDerWaalsContact C-N 3.33Å; F203-E205 PolarHBondContact O-N 3.45Å; E205-G209 CarbonylContact O-C 3.31Å; E205-G209 VanDerWaalsContact O-C 3.25Å; E205-G209 WeakPolarHBondContact O-CA 3.3Å; E205-G209 PolarHBondContact O-N 2.96Å; E205-R210 HydrophobicContact CG-CB 4.37Å; E205-R210 HydrophobicContact CG-CG 3.8Å; E205-R210 WeakPolarHBondContact OE1-CG 3.32Å; E205-R210 IonicContact OE1-CZ 2.81Å; E205-R210 IonicContact OE1-NE 2.84Å; E205-R210 PolarHBondContact OE1-NE 2.89Å; E205-R210 IonicContact OE1-NH1 3.17Å; E205-R210 PolarHBondContact OE1-NH1 2.9Å; E205-R210 IonicContact OE1-NH2 3.18Å; E205-R210 PolarHBondContact OE1-NH2 3.4Å; E205-T213 WeakPolarHBondContact CA-OG1 3.24Å
206	I	89.5	Confident	80	Confident	7 Å²	7	25 Å²	25	4%	0.036	12%	0.12	C	C	.	.	H	α-helix	trans	-70.5	-38.5	179.5	-71.3	166.2	0	0	0	111.8	F84 P90 V91 L97 I202 F203 F204	F84-I206 HydrophobicContact CB-CD1 4.01Å; F84-I206 HydrophobicContact CD2-CD1 3.12Å; F84-I206 HydrophobicContact CE2-CD1 3.61Å; F84-I206 HydrophobicContact CG-CD1 3.77Å; P90-I206 CarbonylContact C-O 3.58Å; P90-I206 WeakPolarHBondContact CA-O 3.01Å; V91-I206 HydrophobicContact CB-CG2 3.79Å; V91-I206 HydrophobicContact CG2-CG2 3.69Å; V91-I206 PolarHBondContact N-O 3.35Å; L97-I206 HydrophobicContact CD2-CG2 3.91Å; I202-I206 HydrophobicContact CG2-CD1 3.8Å; I202-I206 VanDerWaalsContact O-CG1 3.29Å; I202-I206 WeakPolarHBondContact O-CG1 3.35Å; I202-I206 PolarHBondContact O-N 3Å; F203-I206 PolarHBondContact O-N 3.29Å; F204-I206 VanDerWaalsContact C-N 3.32Å; F204-I206 PolarHBondContact O-N 3.3Å
207	I	89.1	Confident	78	Confident	6 Å²	6	28.7 Å²	28.7	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-69.2	-45.9	-177.2	-72.5	170.1	0	0	0	111.4	P90 L97 F203 F204 L261 V265 I268	P90-I207 WeakPolarHBondContact CB-O 3.47Å; L97-I207 HydrophobicContact CD1-CD1 4.3Å; L97-I207 HydrophobicContact CD1-CG1 3.77Å; L97-I207 HydrophobicContact CD2-CG1 4.05Å; F203-I207 VanDerWaalsContact O-CG1 3.27Å; F203-I207 WeakPolarHBondContact O-CG1 3.26Å; F203-I207 PolarHBondContact O-N 3.13Å; F204-I207 PolarHBondContact O-N 3.15Å; I207-L261 HydrophobicContact CD1-CD1 4.23Å; I207-L261 HydrophobicContact CG1-CD1 4.46Å; I207-L261 HydrophobicContact CG2-CD1 4.36Å; I207-L261 HydrophobicContact CG2-CD2 4.19Å; I207-L261 HydrophobicContact CG2-CG 4.45Å; I207-V265 HydrophobicContact CD1-CG2 4.06Å; I207-V265 HydrophobicContact CG2-CG2 4.09Å; I207-I268 HydrophobicContact CD1-CD1 3.25Å
208	F	85.6	Confident	75.9	Confident	29 Å²	29	35.9 Å²	35.9	13%	0.127	17%	0.171	C	C	.	.	H	α-helix	trans	-100	-10	-174.3	-60.1	-83	0	0	0	113.8	F204 F212 T213 L254 I257 V265	F204-F208 HydrophobicContact CD1-CD2 4.21Å; F204-F208 HydrophobicContact CD2-CD2 4.03Å; F204-F208 AromaticContact CD2-CE2 3.69Å; F204-F208 HydrophobicContact CD2-CE2 3.69Å; F204-F208 HydrophobicContact CE1-CD2 4.11Å; F204-F208 HydrophobicContact CE1-CE2 4.4Å; F204-F208 AromaticContact CE2-CD2 3.94Å; F204-F208 HydrophobicContact CE2-CD2 3.94Å; F204-F208 AromaticContact CE2-CE2 3.43Å; F204-F208 HydrophobicContact CE2-CE2 3.43Å; F204-F208 VanDerWaalsContact CE2-CE2 3.43Å; F204-F208 HydrophobicContact CE2-CZ 4.3Å; F204-F208 HydrophobicContact CG-CD2 4.16Å; F204-F208 HydrophobicContact CG-CE2 4.29Å; F204-F208 AromaticContact CZ-CD2 3.98Å; F204-F208 HydrophobicContact CZ-CD2 3.98Å; F204-F208 AromaticContact CZ-CE2 3.82Å; F204-F208 HydrophobicContact CZ-CE2 3.82Å; F204-F208 WeakPolarHBondContact O-CD2 3.17Å; F204-F208 PolarHBondContact O-N 3.45Å; F208-F212 HydrophobicContact CB-CB 4.3Å; F208-F212 HydrophobicContact CB-CD1 3.49Å; F208-F212 VanDerWaalsContact CB-CD1 3.49Å; F208-F212 HydrophobicContact CB-CE1 4.15Å; F208-F212 HydrophobicContact CB-CG 4.2Å; F208-F212 HydrophobicContact CD1-CD1 4.15Å; F208-F212 AromaticContact CD1-CE1 3.96Å; F208-F212 HydrophobicContact CD1-CE1 3.96Å; F208-F212 AromaticContact CG-CD1 3.99Å; F208-F212 HydrophobicContact CG-CD1 3.99Å; F208-F212 HydrophobicContact CG-CE1 4.17Å; F208-F212 WeakPolarHBondContact O-CB 3.35Å; F208-T213 HydrophobicContact CB-CG2 3.52Å; F208-T213 HydrophobicContact CD2-CG2 4.12Å; F208-T213 HydrophobicContact CG-CG2 4.24Å; F208-L254 HydrophobicContact CD1-CD2 4.46Å; F208-L254 HydrophobicContact CE1-CB 4.21Å; F208-L254 HydrophobicContact CE1-CD2 3.85Å; F208-L254 HydrophobicContact CE2-CD2 4.1Å; F208-L254 HydrophobicContact CZ-CB 4.18Å; F208-L254 HydrophobicContact CZ-CD1 4.26Å; F208-L254 HydrophobicContact CZ-CD2 3.66Å; F208-L254 HydrophobicContact CZ-CG 4.24Å; F208-I257 HydrophobicContact CE1-CD1 3.27Å; F208-I257 HydrophobicContact CE1-CG1 3.93Å; F208-I257 HydrophobicContact CZ-CD1 3.34Å; F208-I257 HydrophobicContact CZ-CG1 4.42Å; F208-V265 HydrophobicContact CE2-CG1 4.3Å; F208-V265 HydrophobicContact CE2-CG2 4.2Å; F208-V265 HydrophobicContact CZ-CG1 4.07Å; F208-V265 HydrophobicContact CZ-CG2 4.05Å
209	G	80.2	Confident	73.8	Confident	6 Å²	6	38.1 Å²	38.1	6%	0.062	18%	0.183	C	C	.	.			trans	88.1	148.6	-177.6	0	0	0	0	0	113.2	E205 E211 F212 T213	E205-G209 CarbonylContact O-C 3.31Å; E205-G209 VanDerWaalsContact O-C 3.25Å; E205-G209 WeakPolarHBondContact O-CA 3.3Å; E205-G209 PolarHBondContact O-N 2.96Å; G209-E211 PolarHBondContact O-N 3.38Å; G209-F212 PolarHBondContact O-N 3.21Å; G209-T213 PolarHBondContact O-N 3.43Å; G209-T213 VanDerWaalsContact O-N 3.15Å; G209-T213 PolarHBondContact O-OG1 2.86Å
210	R	70.6	Confident	71.3	Confident	74 Å²	74	45.2 Å²	45.2	28%	0.279	21%	0.209	S	C	.	.	H	α-helix	trans	-57.8	-31.9	-175.6	-60.6	-172	173.4	-110.9	-29.9	114.1	F87 E205 N214	F87-R210 PolarHBondContact O-NE 3.18Å; E205-R210 HydrophobicContact CG-CB 4.37Å; E205-R210 HydrophobicContact CG-CG 3.8Å; E205-R210 WeakPolarHBondContact OE1-CG 3.32Å; E205-R210 IonicContact OE1-CZ 2.81Å; E205-R210 IonicContact OE1-NE 2.84Å; E205-R210 PolarHBondContact OE1-NE 2.89Å; E205-R210 IonicContact OE1-NH1 3.17Å; E205-R210 PolarHBondContact OE1-NH1 2.9Å; E205-R210 IonicContact OE1-NH2 3.18Å; E205-R210 PolarHBondContact OE1-NH2 3.4Å; R210-N214 VanDerWaalsContact O-CB 3.28Å; R210-N214 WeakPolarHBondContact O-CB 3.38Å
211	E	62	Low	69.2	Low	191 Å²	191	49.7 Å²	49.7	89%	0.893	24%	0.241	S	C	*	.	H	α-helix	trans	-73	-28.5	-179.8	-62.5	-174.3	171.3	0	0	112.5	G209	G209-E211 PolarHBondContact O-N 3.38Å
212	F	54.9	Low	67.2	Low	97 Å²	97	55.3 Å²	55.3	43%	0.425	27%	0.265	S	S	.	.	H	α-helix	trans	-92.3	-43.3	-175.4	-174.8	-91	0	0	0	112.8	F208 G209 N214 H253 L254	F208-F212 HydrophobicContact CB-CB 4.3Å; F208-F212 HydrophobicContact CB-CD1 3.49Å; F208-F212 VanDerWaalsContact CB-CD1 3.49Å; F208-F212 HydrophobicContact CB-CE1 4.15Å; F208-F212 HydrophobicContact CB-CG 4.2Å; F208-F212 HydrophobicContact CD1-CD1 4.15Å; F208-F212 AromaticContact CD1-CE1 3.96Å; F208-F212 HydrophobicContact CD1-CE1 3.96Å; F208-F212 AromaticContact CG-CD1 3.99Å; F208-F212 HydrophobicContact CG-CD1 3.99Å; F208-F212 HydrophobicContact CG-CE1 4.17Å; F208-F212 WeakPolarHBondContact O-CB 3.35Å; G209-F212 PolarHBondContact O-N 3.21Å; F212-N214 VanDerWaalsContact C-N 3.33Å; F212-N214 PolarHBondContact O-N 3.19Å; F212-H253 WeakPolarHBondContact CZ-O 3.45Å; F212-L254 HydrophobicContact CE1-CD2 4.16Å
213	T	53	Low	65.3	Low	19 Å²	19	62.6 Å²	62.6	12%	0.117	30%	0.304	C	S	.	.	H	α-helix	trans	-82.7	-9.1	-173.7	57.4	0	0	0	0	115.3	F204 E205 F208 G209 P215	F204-T213 HydrophobicContact CD1-CG2 3.41Å; F204-T213 VanDerWaalsContact CD1-CG2 3.41Å; F204-T213 HydrophobicContact CE1-CG2 3.69Å; F204-T213 HydrophobicContact CG-CG2 4.37Å; F204-T213 VanDerWaalsContact O-CG2 3.28Å; F204-T213 WeakPolarHBondContact O-CG2 3.26Å; E205-T213 WeakPolarHBondContact CA-OG1 3.24Å; F208-T213 HydrophobicContact CB-CG2 3.52Å; F208-T213 HydrophobicContact CD2-CG2 4.12Å; F208-T213 HydrophobicContact CG-CG2 4.24Å; G209-T213 PolarHBondContact O-N 3.43Å; G209-T213 VanDerWaalsContact O-N 3.15Å; G209-T213 PolarHBondContact O-OG1 2.86Å; T213-P215 WeakPolarHBondContact O-CD 3.44Å
214	N	54.9	Low	63.3	Low	13 Å²	13	66 Å²	66	7%	0.07	32%	0.321	C	S	.	.			trans	-111.9	63	-171	-146.2	-31.7	0	0	0	112.3	R210 F212 L216 L217 K218	R210-N214 VanDerWaalsContact O-CB 3.28Å; R210-N214 WeakPolarHBondContact O-CB 3.38Å; F212-N214 VanDerWaalsContact C-N 3.33Å; F212-N214 PolarHBondContact O-N 3.19Å; N214-L216 PolarHBondContact O-N 3.21Å; N214-L216 VanDerWaalsContact O-N 3.1Å; N214-L216 WeakPolarHBondContact OD1-CA 3.36Å; N214-L216 VanDerWaalsContact OD1-CB 3.25Å; N214-L216 WeakPolarHBondContact OD1-CB 3.36Å; N214-L216 PolarHBondContact OD1-N 3.44Å; N214-L217 HydrophobicContact CB-CB 3.85Å; N214-L217 HydrophobicContact CB-CD1 3.89Å; N214-L217 HydrophobicContact CB-CG 4.11Å; N214-L217 VanDerWaalsContact CG-CB 3.49Å; N214-L217 VanDerWaalsContact CG-CD1 3.45Å; N214-L217 WeakPolarHBondContact ND2-CD1 3.47Å; N214-L217 VanDerWaalsContact ND2-CG 3.28Å; N214-L217 WeakPolarHBondContact ND2-CG 3.46Å; N214-L217 PolarHBondContact O-N 2.9Å; N214-L217 WeakPolarHBondContact OD1-CB 3.17Å; N214-L217 PolarHBondContact OD1-N 2.78Å; N214-K218 PolarHBondContact O-N 3.31Å
215	P	52.4	Low	61.9	Low	35 Å²	35	73.1 Å²	73.1	23%	0.227	35%	0.352	C	S	.	.	H	α-helix	trans	-47.3	-31.7	160.1	-25.8	33.8	0	0	0	111.8	T213 K218 L219 L250 L252	T213-P215 WeakPolarHBondContact O-CD 3.44Å; P215-K218 PolarHBondContact O-N 3.46Å; P215-L219 WeakPolarHBondContact O-CB 3.25Å; P215-L219 WeakPolarHBondContact O-CD1 3.45Å; P215-L219 WeakPolarHBondContact O-CG 3.35Å; P215-L219 PolarHBondContact O-N 2.89Å; P215-L250 HydrophobicContact CG-CD1 4.23Å; P215-L252 HydrophobicContact CG-CD2 3.96Å
216	L	54.3	Low	60.7	Low	11 Å²	11	77.5 Å²	77.5	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-38	176.1	-62.8	172.2	0	0	0	113.6	M159 N214 R220 I229 L232 F233	M159-L216 HydrophobicContact SD-CB 3.75Å; M159-L216 HydrophobicContact SD-CD1 4.34Å; N214-L216 PolarHBondContact O-N 3.21Å; N214-L216 VanDerWaalsContact O-N 3.1Å; N214-L216 WeakPolarHBondContact OD1-CA 3.36Å; N214-L216 VanDerWaalsContact OD1-CB 3.25Å; N214-L216 WeakPolarHBondContact OD1-CB 3.36Å; N214-L216 PolarHBondContact OD1-N 3.44Å; L216-R220 WeakPolarHBondContact O-CB 3.34Å; L216-R220 PolarHBondContact O-N 3.26Å; L216-I229 HydrophobicContact CD1-CG2 4.3Å; L216-I229 HydrophobicContact CD2-CG1 4.34Å; L216-I229 HydrophobicContact CD2-CG2 3.96Å; L216-L232 HydrophobicContact CD2-CD2 3.38Å; L216-F233 HydrophobicContact CD1-CE1 4.13Å; L216-F233 HydrophobicContact CD1-CE2 4.08Å; L216-F233 HydrophobicContact CD1-CZ 3.46Å; L216-F233 VanDerWaalsContact CD1-CZ 3.46Å
217	L	54.7	Low	59.5	Low	77 Å²	77	78.2 Å²	78.2	40%	0.403	38%	0.382	S	S	.	.	H	α-helix	trans	-73.7	-38.6	172.9	-85.8	172.2	0	0	0	111.1	N214 L219 R220 S221	N214-L217 HydrophobicContact CB-CB 3.85Å; N214-L217 HydrophobicContact CB-CD1 3.89Å; N214-L217 HydrophobicContact CB-CG 4.11Å; N214-L217 VanDerWaalsContact CG-CB 3.49Å; N214-L217 VanDerWaalsContact CG-CD1 3.45Å; N214-L217 WeakPolarHBondContact ND2-CD1 3.47Å; N214-L217 VanDerWaalsContact ND2-CG 3.28Å; N214-L217 WeakPolarHBondContact ND2-CG 3.46Å; N214-L217 PolarHBondContact O-N 2.9Å; N214-L217 WeakPolarHBondContact OD1-CB 3.17Å; N214-L217 PolarHBondContact OD1-N 2.78Å; L217-L219 VanDerWaalsContact C-N 3.32Å; L217-R220 WeakPolarHBondContact O-CB 3.27Å; L217-R220 PolarHBondContact O-N 3.02Å; L217-R220 VanDerWaalsContact O-N 3.15Å; L217-S221 PolarHBondContact O-N 3.19Å
218	K	51	Low	58.6	Low	152 Å²	152	81.4 Å²	81.4	66%	0.661	40%	0.397	S	S	*	.	H	α-helix	trans	-61.8	-43.4	174.7	-152.9	173.7	-175.8	177.8	0	110.4	N214 P215 R220 S221 E222	N214-K218 PolarHBondContact O-N 3.31Å; P215-K218 PolarHBondContact O-N 3.46Å; K218-R220 PolarHBondContact O-N 3.48Å; K218-S221 WeakPolarHBondContact O-CB 3.43Å; K218-S221 PolarHBondContact O-N 3.15Å; K218-S221 PolarHBondContact O-OG 3.04Å; K218-E222 PolarHBondContact O-N 2.72Å
219	L	49.2	Very low	58	Low	48 Å²	48	80.3 Å²	80.3	25%	0.251	39%	0.392	S	S	.	.	H	α-helix	trans	-64.6	-34	172	-73.5	168	0	0	0	112.6	P215 L217 S221 E222 M224	P215-L219 WeakPolarHBondContact O-CB 3.25Å; P215-L219 WeakPolarHBondContact O-CD1 3.45Å; P215-L219 WeakPolarHBondContact O-CG 3.35Å; P215-L219 PolarHBondContact O-N 2.89Å; L217-L219 VanDerWaalsContact C-N 3.32Å; L219-S221 VanDerWaalsContact C-N 3.33Å; L219-S221 PolarHBondContact O-N 3.1Å; L219-E222 CarbonylContact O-C 3.38Å; L219-E222 VanDerWaalsContact O-C 3.31Å; L219-E222 WeakPolarHBondContact O-CA 3.41Å; L219-E222 PolarHBondContact O-N 2.83Å; L219-E222 VanDerWaalsContact O-N 3.11Å; L219-M224 HydrophobicContact CB-CG 4.06Å; L219-M224 HydrophobicContact CB-SD 3.75Å; L219-M224 HydrophobicContact CD1-SD 4.19Å; L219-M224 HydrophobicContact CD2-CE 4.17Å; L219-M224 HydrophobicContact CD2-SD 3.98Å; L219-M224 HydrophobicContact CG-SD 4.18Å; L219-M224 WeakPolarHBondContact O-CB 3.39Å; L219-M224 VanDerWaalsContact O-CG 3.32Å; L219-M224 WeakPolarHBondContact O-CG 3.47Å; L219-M224 PolarHBondContact O-N 3.18Å
220	R	44.7	Very low	57.8	Low	149 Å²	149	80.3 Å²	80.3	56%	0.562	39%	0.39	S	S	*	.	H	α-helix	trans	-66.5	-33.4	172.8	-163.7	179.3	-168	-119.8	3.8	112.8	L216 L217 K218 E222 N223	L216-R220 WeakPolarHBondContact O-CB 3.34Å; L216-R220 PolarHBondContact O-N 3.26Å; L217-R220 WeakPolarHBondContact O-CB 3.27Å; L217-R220 PolarHBondContact O-N 3.02Å; L217-R220 VanDerWaalsContact O-N 3.15Å; K218-R220 PolarHBondContact O-N 3.48Å; R220-E222 PolarHBondContact O-N 3.19Å; R220-N223 PolarHBondContact O-N 2.64Å
221	S	50.7	Low	58.2	Low	94 Å²	94	80.3 Å²	80.3	66%	0.657	40%	0.402	S	S	*	.	H	α-helix	trans	-65.2	-26.3	173	78.8	0	0	0	0	111.9	L217 K218 L219 N223	L217-S221 PolarHBondContact O-N 3.19Å; K218-S221 WeakPolarHBondContact O-CB 3.43Å; K218-S221 PolarHBondContact O-N 3.15Å; K218-S221 PolarHBondContact O-OG 3.04Å; L219-S221 VanDerWaalsContact C-N 3.33Å; L219-S221 PolarHBondContact O-N 3.1Å; S221-N223 VanDerWaalsContact C-N 3.28Å; S221-N223 PolarHBondContact O-N 3.19Å
222	E	50.2	Low	59.1	Low	138 Å²	138	73.1 Å²	73.1	65%	0.645	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	47.4	170.7	-63.5	-177.9	176.2	0	0	111.7	K218 L219 R220 M224	K218-E222 PolarHBondContact O-N 2.72Å; L219-E222 CarbonylContact O-C 3.38Å; L219-E222 VanDerWaalsContact O-C 3.31Å; L219-E222 WeakPolarHBondContact O-CA 3.41Å; L219-E222 PolarHBondContact O-N 2.83Å; L219-E222 VanDerWaalsContact O-N 3.11Å; R220-E222 PolarHBondContact O-N 3.19Å; E222-M224 PolarHBondContact O-N 3.35Å
223	N	52.1	Low	60.5	Low	154 Å²	154	68.6 Å²	68.6	82%	0.824	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	18.7	169.4	-72.9	-27	0	0	0	117.2	R220 S221 K225	R220-N223 PolarHBondContact O-N 2.64Å; S221-N223 VanDerWaalsContact C-N 3.28Å; S221-N223 PolarHBondContact O-N 3.19Å; N223-K225 PolarHBondContact O-N 2.67Å
224	M	51.8	Low	61.9	Low	71 Å²	71	69.3 Å²	69.3	35%	0.35	35%	0.352	S	S	.	.			trans	-62	129.1	177.5	-78.3	-145.6	143.2	0	0	110.6	L219 E222 E228	L219-M224 HydrophobicContact CB-CG 4.06Å; L219-M224 HydrophobicContact CB-SD 3.75Å; L219-M224 HydrophobicContact CD1-SD 4.19Å; L219-M224 HydrophobicContact CD2-CE 4.17Å; L219-M224 HydrophobicContact CD2-SD 3.98Å; L219-M224 HydrophobicContact CG-SD 4.18Å; L219-M224 WeakPolarHBondContact O-CB 3.39Å; L219-M224 VanDerWaalsContact O-CG 3.32Å; L219-M224 WeakPolarHBondContact O-CG 3.47Å; L219-M224 PolarHBondContact O-N 3.18Å; E222-M224 PolarHBondContact O-N 3.35Å; M224-E228 WeakPolarHBondContact CA-OE2 3.21Å; M224-E228 HydrophobicContact CB-CB 4.29Å; M224-E228 WeakPolarHBondContact CB-OE2 3.33Å; M224-E228 HydrophobicContact CE-CB 4.27Å; M224-E228 VanDerWaalsContact CE-OE2 3.25Å; M224-E228 WeakPolarHBondContact CE-OE2 3.46Å; M224-E228 HydrophobicContact CG-CB 4.48Å; M224-E228 WeakPolarHBondContact CG-OE2 3.46Å; M224-E228 HydrophobicContact SD-CB 3.82Å
225	K	61.3	Low	63.4	Low	160 Å²	160	76 Å²	76	70%	0.696	38%	0.376	S	S	*	.			trans	-71.6	151.9	175.3	-66.4	179.7	-178.2	176.1	0	109.9	N223 G227 E228	N223-K225 PolarHBondContact O-N 2.67Å; K225-G227 PolarHBondContact O-N 2.94Å; K225-E228 PolarHBondContact N-OE1 3.49Å; K225-E228 WeakPolarHBondContact O-CB 3.42Å; K225-E228 PolarHBondContact O-N 3.22Å
226	E	62	Low	65	Low	96 Å²	96	74.3 Å²	74.3	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-50	-32.3	-179.6	-67.5	174.8	160.8	0	0	114.1	L158 E228 Y414	L158-E226 HydrophobicContact CD1-CB 3.71Å; L158-E226 HydrophobicContact CD1-CG 3.7Å; E226-E228 VanDerWaalsContact C-N 3.28Å; E226-E228 PolarHBondContact O-N 3.46Å; E226-Y414 HydrophobicContact CB-CD1 3.91Å; E226-Y414 HydrophobicContact CB-CE1 4.12Å; E226-Y414 HydrophobicContact CB-CG 4.4Å; E226-Y414 VanDerWaalsContact OE2-CE1 3.25Å; E226-Y414 WeakPolarHBondContact OE2-CE1 3.29Å
227	G	65	Low	66.5	Low	22 Å²	22	76.2 Å²	76.2	23%	0.227	38%	0.376	C	S	.	.	H	α-helix	trans	-67.3	-22.2	176.3	0	0	0	0	0	115.2	K225 S231	K225-G227 PolarHBondContact O-N 2.94Å; G227-S231 WeakPolarHBondContact O-CB 3.49Å; G227-S231 PolarHBondContact O-N 2.75Å
228	E	70.7	Confident	68	Low	74 Å²	74	77.8 Å²	77.8	35%	0.346	39%	0.392	S	S	.	.	H	α-helix	trans	-74.7	-33.4	-178.8	-66.6	166.9	-152	0	0	111.4	M224 K225 E226 S231 L232	M224-E228 WeakPolarHBondContact CA-OE2 3.21Å; M224-E228 HydrophobicContact CB-CB 4.29Å; M224-E228 WeakPolarHBondContact CB-OE2 3.33Å; M224-E228 HydrophobicContact CE-CB 4.27Å; M224-E228 VanDerWaalsContact CE-OE2 3.25Å; M224-E228 WeakPolarHBondContact CE-OE2 3.46Å; M224-E228 HydrophobicContact CG-CB 4.48Å; M224-E228 WeakPolarHBondContact CG-OE2 3.46Å; M224-E228 HydrophobicContact SD-CB 3.82Å; K225-E228 PolarHBondContact N-OE1 3.49Å; K225-E228 WeakPolarHBondContact O-CB 3.42Å; K225-E228 PolarHBondContact O-N 3.22Å; E226-E228 VanDerWaalsContact C-N 3.28Å; E226-E228 PolarHBondContact O-N 3.46Å; E228-S231 WeakPolarHBondContact O-CB 3.36Å; E228-S231 PolarHBondContact O-N 3.17Å; E228-L232 WeakPolarHBondContact O-CB 3.26Å; E228-L232 PolarHBondContact O-N 2.99Å
229	I	72.6	Confident	69.9	Low	6 Å²	6	73 Å²	73	3%	0.031	37%	0.372	C	S	.	.	H	α-helix	trans	-65.9	-45.6	174.4	-60.9	-178.5	0	0	0	110.6	L158 M159 L216 S231 L232 F233	L158-I229 WeakPolarHBondContact O-CG2 3.2Å; M159-I229 HydrophobicContact CE-CD1 3.22Å; M159-I229 HydrophobicContact SD-CD1 4.26Å; L216-I229 HydrophobicContact CD1-CG2 4.3Å; L216-I229 HydrophobicContact CD2-CG1 4.34Å; L216-I229 HydrophobicContact CD2-CG2 3.96Å; I229-S231 VanDerWaalsContact C-N 3.32Å; I229-S231 PolarHBondContact O-N 2.78Å; I229-L232 WeakPolarHBondContact O-CB 3.48Å; I229-L232 PolarHBondContact O-N 2.64Å; I229-F233 HydrophobicContact CG2-CD2 4.02Å; I229-F233 HydrophobicContact CG2-CE2 3.74Å; I229-F233 WeakPolarHBondContact O-CD2 3.19Å; I229-F233 PolarHBondContact O-N 3.25Å
230	I	75.1	Confident	71.7	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-44.2	176.1	-63.5	170.8	0	0	0	109.6	L158 F166 L232 F233 L234 Y414 L415	L158-I230 HydrophobicContact CD2-CD1 3.82Å; L158-I230 HydrophobicContact CD2-CG1 3.94Å; F166-I230 HydrophobicContact CB-CG2 4.38Å; F166-I230 HydrophobicContact CD1-CD1 4.23Å; F166-I230 HydrophobicContact CD1-CG1 4.3Å; F166-I230 HydrophobicContact CG-CG1 4.4Å; I230-L232 VanDerWaalsContact C-N 3.28Å; I230-L232 PolarHBondContact O-N 3Å; I230-F233 PolarHBondContact O-N 3.01Å; I230-L234 HydrophobicContact CG2-CD1 3.88Å; I230-L234 HydrophobicContact CG2-CG 4.19Å; I230-L234 WeakPolarHBondContact O-CB 3.3Å; I230-L234 VanDerWaalsContact O-CG 3.27Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 3.09Å; I230-Y414 HydrophobicContact CD1-CD2 3.34Å; I230-Y414 HydrophobicContact CD1-CE2 3.29Å; I230-Y414 HydrophobicContact CD1-CG 4.46Å; I230-L415 HydrophobicContact CD1-CD2 4.32Å
231	S	79.2	Confident	73.7	Confident	75 Å²	75	71.2 Å²	71.2	52%	0.524	38%	0.376	S	S	.	.	H	α-helix	trans	-58.2	-40.1	175.4	-174.3	0	0	0	0	112.1	G227 E228 I229 L234 R235	G227-S231 WeakPolarHBondContact O-CB 3.49Å; G227-S231 PolarHBondContact O-N 2.75Å; E228-S231 WeakPolarHBondContact O-CB 3.36Å; E228-S231 PolarHBondContact O-N 3.17Å; I229-S231 VanDerWaalsContact C-N 3.32Å; I229-S231 PolarHBondContact O-N 2.78Å; S231-L234 PolarHBondContact O-N 2.93Å; S231-R235 WeakPolarHBondContact O-CB 3.46Å; S231-R235 PolarHBondContact O-N 3.44Å
232	L	82.3	Confident	75.7	Confident	39 Å²	39	73 Å²	73	20%	0.204	37%	0.373	C	S	.	.	H	α-helix	trans	-62.7	-47.7	176	-171.4	74.1	0	0	0	111.7	L216 E228 I229 I230 L234 R235 G236 F249 L250	L216-L232 HydrophobicContact CD2-CD2 3.38Å; E228-L232 WeakPolarHBondContact O-CB 3.26Å; E228-L232 PolarHBondContact O-N 2.99Å; I229-L232 WeakPolarHBondContact O-CB 3.48Å; I229-L232 PolarHBondContact O-N 2.64Å; I230-L232 VanDerWaalsContact C-N 3.28Å; I230-L232 PolarHBondContact O-N 3Å; L232-L234 VanDerWaalsContact C-N 3.35Å; L232-L234 PolarHBondContact O-N 3.17Å; L232-R235 PolarHBondContact O-N 2.79Å; L232-G236 PolarHBondContact O-N 3.35Å; L232-F249 HydrophobicContact CD1-CE1 3.81Å; L232-F249 HydrophobicContact CD1-CZ 4.1Å; L232-F249 HydrophobicContact CG-CE1 3.97Å; L232-L250 HydrophobicContact CD2-CD2 4.11Å
233	F	83.7	Confident	77.7	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.009	36%	0.358	C	S	.	.	H	α-helix	trans	-64.2	-39.3	177.1	-75.1	-47.3	0	0	0	112.7	L158 P163 F166 W197 L216 I229 I230 G236 L237 L246 F274	L158-F233 WeakPolarHBondContact O-CE2 3.44Å; P163-F233 HydrophobicContact CB-CB 4.22Å; P163-F233 HydrophobicContact CG-CB 4.19Å; F166-F233 HydrophobicContact CE2-CD2 4.28Å; W197-F233 HydrophobicContact CZ2-CD1 4.12Å; W197-F233 AromaticContact CZ2-CE1 3.86Å; W197-F233 HydrophobicContact CZ2-CE1 3.86Å; L216-F233 HydrophobicContact CD1-CE1 4.13Å; L216-F233 HydrophobicContact CD1-CE2 4.08Å; L216-F233 HydrophobicContact CD1-CZ 3.46Å; L216-F233 VanDerWaalsContact CD1-CZ 3.46Å; I229-F233 HydrophobicContact CG2-CD2 4.02Å; I229-F233 HydrophobicContact CG2-CE2 3.74Å; I229-F233 WeakPolarHBondContact O-CD2 3.19Å; I229-F233 PolarHBondContact O-N 3.25Å; I230-F233 PolarHBondContact O-N 3.01Å; F233-G236 PolarHBondContact O-N 3.03Å; F233-L237 WeakPolarHBondContact O-CB 3.46Å; F233-L237 PolarHBondContact O-N 3.18Å; F233-L246 HydrophobicContact CD1-CD1 4.31Å; F233-L246 HydrophobicContact CE1-CD1 3.96Å; F233-L246 HydrophobicContact CE1-CD2 4.27Å; F233-F274 HydrophobicContact CD1-CE1 4.33Å
234	L	82.8	Confident	79.5	Confident	35 Å²	35	64.8 Å²	64.8	18%	0.183	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-38.3	175.6	-68.8	178	0	0	0	111.6	L167 I230 S231 L232 L237 C238 V418	L167-L234 HydrophobicContact CD1-CD2 4.26Å; L167-L234 HydrophobicContact CD2-CD2 3.64Å; L167-L234 HydrophobicContact CG-CD2 3.9Å; I230-L234 HydrophobicContact CG2-CD1 3.88Å; I230-L234 HydrophobicContact CG2-CG 4.19Å; I230-L234 WeakPolarHBondContact O-CB 3.3Å; I230-L234 VanDerWaalsContact O-CG 3.27Å; I230-L234 WeakPolarHBondContact O-CG 3.39Å; I230-L234 PolarHBondContact O-N 3.09Å; S231-L234 PolarHBondContact O-N 2.93Å; L232-L234 VanDerWaalsContact C-N 3.35Å; L232-L234 PolarHBondContact O-N 3.17Å; L234-L237 WeakPolarHBondContact O-CB 3.46Å; L234-L237 PolarHBondContact O-N 3.46Å; L234-C238 PolarHBondContact O-N 2.89Å; L234-C238 PolarHBondContact O-SG 2.88Å; L234-V418 HydrophobicContact CD1-CG1 4.45Å
235	R	85.7	Confident	81.4	Confident	152 Å²	152	61.7 Å²	61.7	57%	0.574	32%	0.316	S	S	*	.	H	α-helix	trans	-63.5	-45	173.4	-177.4	178.6	176.9	170.4	2.7	111.5	S231 L232 L237 C238 Q239 F249	S231-R235 WeakPolarHBondContact O-CB 3.46Å; S231-R235 PolarHBondContact O-N 3.44Å; L232-R235 PolarHBondContact O-N 2.79Å; R235-L237 VanDerWaalsContact C-N 3.29Å; R235-L237 PolarHBondContact O-N 2.93Å; R235-C238 WeakPolarHBondContact O-CB 3.46Å; R235-C238 PolarHBondContact O-N 3.22Å; R235-Q239 WeakPolarHBondContact O-CG 3.47Å; R235-Q239 PolarHBondContact O-N 3.3Å; R235-F249 HydrophobicContact CB-CZ 4.3Å; R235-F249 HydrophobicContact CG-CE2 4.25Å; R235-F249 HydrophobicContact CG-CZ 4.1Å
236	G	85.4	Confident	82.7	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.7	-41.9	173.6	0	0	0	0	0	111.9	L232 F233 C238 Q239 A240	L232-G236 PolarHBondContact O-N 3.35Å; F233-G236 PolarHBondContact O-N 3.03Å; G236-C238 PolarHBondContact O-N 2.89Å; G236-Q239 CarbonylContact O-C 3.43Å; G236-Q239 PolarHBondContact O-N 3.31Å; G236-Q239 VanDerWaalsContact O-N 3.15Å; G236-A240 PolarHBondContact O-N 3.36Å
237	L	86.1	Confident	83.9	Confident	51 Å²	51	50.7 Å²	50.7	27%	0.267	27%	0.268	S	S	.	.	H	α-helix	trans	-61.8	-41.9	174.1	-173.4	65.9	0	0	0	112.5	P163 L167 F233 L234 R235 Q239 A240 F274	P163-L237 HydrophobicContact CB-CD2 4.45Å; L167-L237 HydrophobicContact CD1-CD2 3.71Å; F233-L237 WeakPolarHBondContact O-CB 3.46Å; F233-L237 PolarHBondContact O-N 3.18Å; L234-L237 WeakPolarHBondContact O-CB 3.46Å; L234-L237 PolarHBondContact O-N 3.46Å; R235-L237 VanDerWaalsContact C-N 3.29Å; R235-L237 PolarHBondContact O-N 2.93Å; L237-Q239 VanDerWaalsContact C-N 3.28Å; L237-Q239 PolarHBondContact O-N 3.22Å; L237-A240 VanDerWaalsContact O-CB 3.29Å; L237-A240 WeakPolarHBondContact O-CB 3.42Å; L237-A240 PolarHBondContact O-N 2.7Å; L237-F274 HydrophobicContact CB-CD1 4.29Å; L237-F274 HydrophobicContact CD1-CB 4Å; L237-F274 WeakPolarHBondContact CD1-O 3.41Å
238	C	87.1	Confident	85	Confident	110 Å²	110	53.7 Å²	53.7	74%	0.743	28%	0.276	S	S	*	.	H	α-helix	trans	-65.4	-29.9	174.7	-68.4	0	0	0	0	113.1	L234 R235 G236	L234-C238 PolarHBondContact O-N 2.89Å; L234-C238 PolarHBondContact O-SG 2.88Å; R235-C238 WeakPolarHBondContact O-CB 3.46Å; R235-C238 PolarHBondContact O-N 3.22Å; G236-C238 PolarHBondContact O-N 2.89Å
239	Q	89.2	Confident	85.8	Confident	53 Å²	53	51.4 Å²	51.4	25%	0.248	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	13.9	-179.6	-60.7	-170.8	-78.6	0	0	113.1	R235 G236 L237 N241 E242 Y243	R235-Q239 WeakPolarHBondContact O-CG 3.47Å; R235-Q239 PolarHBondContact O-N 3.3Å; G236-Q239 CarbonylContact O-C 3.43Å; G236-Q239 PolarHBondContact O-N 3.31Å; G236-Q239 VanDerWaalsContact O-N 3.15Å; L237-Q239 VanDerWaalsContact C-N 3.28Å; L237-Q239 PolarHBondContact O-N 3.22Å; Q239-N241 PolarHBondContact O-N 3.14Å; Q239-E242 PolarHBondContact O-N 2.86Å; Q239-Y243 HydrophobicContact CB-CD2 4.37Å; Q239-Y243 PolarHBondContact O-N 2.87Å
240	A	87.2	Confident	86.4	Confident	13 Å²	13	53.2 Å²	53.2	11%	0.107	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-13.1	-175.7	0	0	0	0	0	114.8	G236 L237 P244 F274	G236-A240 PolarHBondContact O-N 3.36Å; L237-A240 VanDerWaalsContact O-CB 3.29Å; L237-A240 WeakPolarHBondContact O-CB 3.42Å; L237-A240 PolarHBondContact O-N 2.7Å; A240-P244 VanDerWaalsContact O-CA 3.23Å; A240-P244 WeakPolarHBondContact O-CA 3.49Å; A240-F274 HydrophobicContact CB-CB 3.73Å
241	N	88.5	Confident	86.8	Confident	146 Å²	146	59.2 Å²	59.2	78%	0.781	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-31.5	172.6	-70.5	-25.7	0	0	0	112.7	Q239	Q239-N241 PolarHBondContact O-N 3.14Å
242	E	91.5	Very high	86.8	Confident	130 Å²	130	57.5 Å²	57.5	61%	0.607	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-41.7	177.6	-65.8	172.5	-176	0	0	110.7	Q239	Q239-E242 PolarHBondContact O-N 2.86Å
243	Y	91.5	Very high	86.4	Confident	80 Å²	80	62.5 Å²	62.5	31%	0.314	31%	0.309	S	S	.	.			trans	-127.8	85.7	-178.6	-54.1	-79.3	0	0	0	109.2	Q239 T245 E248 F249	Q239-Y243 HydrophobicContact CB-CD2 4.37Å; Q239-Y243 PolarHBondContact O-N 2.87Å; Y243-T245 VanDerWaalsContact C-N 3.26Å; Y243-T245 PolarHBondContact O-N 3.23Å; Y243-E248 HydrophobicContact CD1-CB 4.33Å; Y243-E248 WeakPolarHBondContact CD1-O 3.31Å; Y243-F249 HydrophobicContact CD2-CD2 4.37Å; Y243-F249 HydrophobicContact CG-CB 4.43Å
244	P	91.3	Very high	86.1	Confident	41 Å²	41	64.1 Å²	64.1	27%	0.266	32%	0.318	S	S	.	.			trans	-66	-26.5	-171.1	20.9	-29.1	0	0	0	114.2	A240 E248 R273 F274	A240-P244 VanDerWaalsContact O-CA 3.23Å; A240-P244 WeakPolarHBondContact O-CA 3.49Å; P244-E248 WeakPolarHBondContact CD-OE2 3.07Å; P244-E248 WeakPolarHBondContact CG-OE2 3.4Å; P244-R273 WeakPolarHBondContact O-CA 3.13Å; P244-F274 PolarHBondContact O-N 2.93Å; P244-F274 VanDerWaalsContact O-N 3.08Å
245	T	91	Very high	85.6	Confident	6 Å²	6	69.1 Å²	69.1	4%	0.037	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-115.5	155.3	-179	68.7	0	0	0	0	113	Y243 E248 F249 Q269 L272 R273	Y243-T245 VanDerWaalsContact C-N 3.26Å; Y243-T245 PolarHBondContact O-N 3.23Å; T245-E248 WeakPolarHBondContact CB-OE2 3.33Å; T245-E248 PolarHBondContact N-OE2 2.69Å; T245-E248 PolarHBondContact O-N 2.96Å; T245-E248 VanDerWaalsContact OG1-CG 3.27Å; T245-E248 WeakPolarHBondContact OG1-CG 3.45Å; T245-E248 PolarHBondContact OG1-OE2 2.84Å; T245-F249 PolarHBondContact O-N 2.61Å; T245-F249 VanDerWaalsContact O-N 3.08Å; T245-Q269 WeakPolarHBondContact CG2-O 3.11Å; T245-L272 WeakPolarHBondContact CA-O 3.49Å; T245-R273 HydrophobicContact CG2-CG 3.9Å
246	L	88.8	Confident	85.1	Confident	18 Å²	18	66 Å²	66	9%	0.094	36%	0.36	C	S	.	.	H	α-helix	trans	-55.3	-45.3	176.6	-179.5	66.6	0	0	0	113.4	W197 F233 E248 F249 L250 L272 F274	W197-L246 HydrophobicContact CH2-CB 3.97Å; W197-L246 HydrophobicContact CH2-CD2 4.39Å; W197-L246 HydrophobicContact CZ2-CB 4.49Å; W197-L246 HydrophobicContact CZ2-CD2 4.08Å; F233-L246 HydrophobicContact CD1-CD1 4.31Å; F233-L246 HydrophobicContact CE1-CD1 3.96Å; F233-L246 HydrophobicContact CE1-CD2 4.27Å; L246-E248 PolarHBondContact O-N 3.33Å; L246-F249 PolarHBondContact O-N 3.08Å; L246-L250 HydrophobicContact CD1-CD1 3.83Å; L246-L250 HydrophobicContact CD1-CG 4.09Å; L246-L250 HydrophobicContact CG-CD1 3.99Å; L246-L250 WeakPolarHBondContact O-CG 3.38Å; L246-L250 PolarHBondContact O-N 3.49Å; L246-L272 HydrophobicContact CB-CB 4.21Å; L246-L272 PolarHBondContact N-O 3.11Å; L246-F274 HydrophobicContact CB-CE2 4.39Å; L246-F274 HydrophobicContact CB-CZ 4.3Å; L246-F274 HydrophobicContact CD1-CE1 4.42Å; L246-F274 HydrophobicContact CD1-CZ 3.73Å
247	P	87.1	Confident	84.9	Confident	6 Å²	6	68 Å²	68	4%	0.039	37%	0.37	C	S	.	.	H	α-helix	trans	-64.8	-36.2	179.6	-25.5	38.5	0	0	0	114.1	F204 L250 Q251 L252 Q269 L272	F204-P247 HydrophobicContact CE1-CG 4.48Å; F204-P247 HydrophobicContact CE2-CB 4.4Å; F204-P247 HydrophobicContact CE2-CG 3.82Å; F204-P247 HydrophobicContact CZ-CB 4.1Å; F204-P247 HydrophobicContact CZ-CG 3.81Å; P247-L250 PolarHBondContact O-N 3.3Å; P247-Q251 PolarHBondContact O-N 3.36Å; P247-L252 HydrophobicContact CB-CD1 4.27Å; P247-L252 PolarHBondContact O-N 3.27Å; P247-Q269 HydrophobicContact CG-CG 4.33Å; P247-L272 HydrophobicContact CG-CD1 3.97Å
248	E	88.2	Confident	84.7	Confident	86 Å²	86	68.5 Å²	68.5	40%	0.402	38%	0.378	S	S	.	.	H	α-helix	trans	-66.3	-44.1	175.3	-70	162.9	151.4	0	0	111.2	Y243 P244 T245 L246 L250 Q251	Y243-E248 HydrophobicContact CD1-CB 4.33Å; Y243-E248 WeakPolarHBondContact CD1-O 3.31Å; P244-E248 WeakPolarHBondContact CD-OE2 3.07Å; P244-E248 WeakPolarHBondContact CG-OE2 3.4Å; T245-E248 WeakPolarHBondContact CB-OE2 3.33Å; T245-E248 PolarHBondContact N-OE2 2.69Å; T245-E248 PolarHBondContact O-N 2.96Å; T245-E248 VanDerWaalsContact OG1-CG 3.27Å; T245-E248 WeakPolarHBondContact OG1-CG 3.45Å; T245-E248 PolarHBondContact OG1-OE2 2.84Å; L246-E248 PolarHBondContact O-N 3.33Å; E248-L250 VanDerWaalsContact C-N 3.29Å; E248-L250 PolarHBondContact O-N 3.22Å; E248-Q251 PolarHBondContact O-N 2.8Å
249	F	87.6	Confident	84.4	Confident	26 Å²	26	66.9 Å²	66.9	11%	0.114	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-38.4	178.2	172.4	-105.1	0	0	0	112	L232 R235 Y243 T245 L246 Q251 F274	L232-F249 HydrophobicContact CD1-CE1 3.81Å; L232-F249 HydrophobicContact CD1-CZ 4.1Å; L232-F249 HydrophobicContact CG-CE1 3.97Å; R235-F249 HydrophobicContact CB-CZ 4.3Å; R235-F249 HydrophobicContact CG-CE2 4.25Å; R235-F249 HydrophobicContact CG-CZ 4.1Å; Y243-F249 HydrophobicContact CD2-CD2 4.37Å; Y243-F249 HydrophobicContact CG-CB 4.43Å; T245-F249 PolarHBondContact O-N 2.61Å; T245-F249 VanDerWaalsContact O-N 3.08Å; L246-F249 PolarHBondContact O-N 3.08Å; F249-Q251 VanDerWaalsContact C-N 3.31Å; F249-F274 HydrophobicContact CB-CE2 3.75Å; F249-F274 HydrophobicContact CB-CZ 4.22Å; F249-F274 HydrophobicContact CD1-CE2 4.38Å; F249-F274 HydrophobicContact CD1-CZ 4Å; F249-F274 HydrophobicContact CG-CE2 4.11Å; F249-F274 HydrophobicContact CG-CZ 4.18Å
250	L	84.2	Confident	84	Confident	43 Å²	43	68.9 Å²	68.9	23%	0.225	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-2.8	176	-63.9	179.4	0	0	0	113.6	P215 L232 L246 P247 E248 L252	P215-L250 HydrophobicContact CG-CD1 4.23Å; L232-L250 HydrophobicContact CD2-CD2 4.11Å; L246-L250 HydrophobicContact CD1-CD1 3.83Å; L246-L250 HydrophobicContact CD1-CG 4.09Å; L246-L250 HydrophobicContact CG-CD1 3.99Å; L246-L250 WeakPolarHBondContact O-CG 3.38Å; L246-L250 PolarHBondContact O-N 3.49Å; P247-L250 PolarHBondContact O-N 3.3Å; E248-L250 VanDerWaalsContact C-N 3.29Å; E248-L250 PolarHBondContact O-N 3.22Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 HydrophobicContact CB-CD1 4.39Å; L250-L252 HydrophobicContact CB-CD2 4.19Å; L250-L252 HydrophobicContact CB-CG 3.89Å; L250-L252 PolarHBondContact O-N 3.43Å
251	Q	83.5	Confident	84	Confident	132 Å²	132	68.5 Å²	68.5	62%	0.617	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	42.2	-179.2	-57.1	178.8	0.4	0	0	113.4	P247 E248 F249 H253	P247-Q251 PolarHBondContact O-N 3.36Å; E248-Q251 PolarHBondContact O-N 2.8Å; F249-Q251 VanDerWaalsContact C-N 3.31Å; Q251-H253 PolarHBondContact O-ND1 2.93Å
252	L	80.4	Confident	84	Confident	39 Å²	39	64.5 Å²	64.5	20%	0.204	36%	0.36	C	S	.	.			trans	-72.8	129.3	-179	-60.9	179.5	0	0	0	111.2	F204 P215 P247 L250 L254	F204-L252 HydrophobicContact CE1-CD1 3.76Å; F204-L252 HydrophobicContact CZ-CD1 3.96Å; P215-L252 HydrophobicContact CG-CD2 3.96Å; P247-L252 HydrophobicContact CB-CD1 4.27Å; P247-L252 PolarHBondContact O-N 3.27Å; L250-L252 VanDerWaalsContact C-N 3.29Å; L250-L252 HydrophobicContact CB-CD1 4.39Å; L250-L252 HydrophobicContact CB-CD2 4.19Å; L250-L252 HydrophobicContact CB-CG 3.89Å; L250-L252 PolarHBondContact O-N 3.43Å; L252-L254 HydrophobicContact CB-CD2 4.14Å; L252-L254 PolarHBondContact O-N 2.86Å
253	H	74.4	Confident	83.8	Confident	143 Å²	143	61.9 Å²	61.9	66%	0.662	35%	0.349	S	S	*	.			trans	-91.2	99	179.1	-69.1	70.7	0	0	0	110.8	F212 Q251 N255	F212-H253 WeakPolarHBondContact CZ-O 3.45Å; Q251-H253 PolarHBondContact O-ND1 2.93Å; H253-N255 VanDerWaalsContact C-N 3.31Å; H253-N255 PolarHBondContact O-N 2.69Å; H253-N255 VanDerWaalsContact O-N 3.07Å
254	L	75.9	Confident	83.8	Confident	37 Å²	37	58.1 Å²	58.1	19%	0.194	34%	0.335	C	S	.	.			trans	-86.5	58.5	-173.1	-51.8	178.8	0	0	0	113	F204 F208 F212 L252 I257 V265	F204-L254 HydrophobicContact CE2-CD1 4.2Å; F204-L254 HydrophobicContact CE2-CD2 4.17Å; F204-L254 HydrophobicContact CZ-CD1 4.4Å; F204-L254 HydrophobicContact CZ-CD2 3.67Å; F208-L254 HydrophobicContact CD1-CD2 4.46Å; F208-L254 HydrophobicContact CE1-CB 4.21Å; F208-L254 HydrophobicContact CE1-CD2 3.85Å; F208-L254 HydrophobicContact CE2-CD2 4.1Å; F208-L254 HydrophobicContact CZ-CB 4.18Å; F208-L254 HydrophobicContact CZ-CD1 4.26Å; F208-L254 HydrophobicContact CZ-CD2 3.66Å; F208-L254 HydrophobicContact CZ-CG 4.24Å; F212-L254 HydrophobicContact CE1-CD2 4.16Å; L252-L254 HydrophobicContact CB-CD2 4.14Å; L252-L254 PolarHBondContact O-N 2.86Å; L254-I257 HydrophobicContact CB-CD1 4.31Å; L254-V265 HydrophobicContact CD1-CG1 4.18Å
255	N	73.3	Confident	83.8	Confident	139 Å²	139	56.2 Å²	56.2	74%	0.743	32%	0.322	S	S	*	.			trans	-85.6	150.2	-176.8	-64.5	-14.3	0	0	0	112.5	H253	H253-N255 VanDerWaalsContact C-N 3.31Å; H253-N255 PolarHBondContact O-N 2.69Å; H253-N255 VanDerWaalsContact O-N 3.07Å
256	G	75.1	Confident	83.8	Confident	87 Å²	87	60 Å²	60	90%	0.897	34%	0.339	S	S	*	.	S	Bend	trans	91.2	19.6	167.7	0	0	0	0	0	116.3
257	I	80.3	Confident	84	Confident	42 Å²	42	59.5 Å²	59.5	22%	0.215	34%	0.337	C	S	.	.			trans	-96.8	144.9	-179.1	-54	173.7	0	0	0	110.8	F208 L254 L261 V265	F208-I257 HydrophobicContact CE1-CD1 3.27Å; F208-I257 HydrophobicContact CE1-CG1 3.93Å; F208-I257 HydrophobicContact CZ-CD1 3.34Å; F208-I257 HydrophobicContact CZ-CG1 4.42Å; L254-I257 HydrophobicContact CB-CD1 4.31Å; I257-L261 HydrophobicContact CG2-CB 3.37Å; I257-L261 HydrophobicContact CG2-CD2 3.73Å; I257-L261 HydrophobicContact CG2-CG 3.43Å; I257-L261 VanDerWaalsContact CG2-CG 3.43Å; I257-V265 HydrophobicContact CD1-CG2 4.15Å
258	S	82.1	Confident	84.3	Confident	62 Å²	62	59.2 Å²	59.2	43%	0.434	34%	0.335	S	S	.	.			trans	-68.4	150.6	171.2	53.1	0	0	0	0	111.6	D260 L261 D262	S258-D260 VanDerWaalsContact C-N 3.26Å; S258-D260 PolarHBondContact O-N 3.41Å; S258-L261 PolarHBondContact O-N 2.84Å; S258-L261 VanDerWaalsContact OG-CB 3.31Å; S258-L261 WeakPolarHBondContact OG-CB 3.48Å; S258-D262 PolarHBondContact O-N 3.11Å
259	A	81	Confident	84.5	Confident	76 Å²	76	57.1 Å²	57.1	63%	0.628	33%	0.325	S	S	*	.	H	α-helix	trans	-52.6	-41.8	-179.5	0	0	0	0	0	113.2	L261 D262 I263	A259-L261 VanDerWaalsContact C-N 3.34Å; A259-L261 PolarHBondContact O-N 3.44Å; A259-D262 WeakPolarHBondContact O-CB 3.25Å; A259-D262 PolarHBondContact O-N 2.75Å; A259-I263 PolarHBondContact O-N 3.2Å
260	D	80.2	Confident	84.8	Confident	94 Å²	94	60.9 Å²	60.9	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-35.9	179	-51.2	-32.7	0	0	0	112.6	V94 S258 D262	V94-D260 HydrophobicContact CG1-CB 4.31Å; V94-D260 HydrophobicContact CG2-CB 4.28Å; S258-D260 VanDerWaalsContact C-N 3.26Å; S258-D260 PolarHBondContact O-N 3.41Å; D260-D262 VanDerWaalsContact C-N 3.34Å
261	L	87.5	Confident	85.3	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-75.2	-29.4	177	-175.5	56.1	0	0	0	110.6	V94 L97 I207 I257 S258 A259 I263 L264 V265	V94-L261 HydrophobicContact CG2-CB 3.63Å; V94-L261 HydrophobicContact CG2-CD1 4.11Å; V94-L261 HydrophobicContact CG2-CG 4.37Å; L97-L261 HydrophobicContact CD1-CD1 3.67Å; I207-L261 HydrophobicContact CD1-CD1 4.23Å; I207-L261 HydrophobicContact CG1-CD1 4.46Å; I207-L261 HydrophobicContact CG2-CD1 4.36Å; I207-L261 HydrophobicContact CG2-CD2 4.19Å; I207-L261 HydrophobicContact CG2-CG 4.45Å; I257-L261 HydrophobicContact CG2-CB 3.37Å; I257-L261 HydrophobicContact CG2-CD2 3.73Å; I257-L261 HydrophobicContact CG2-CG 3.43Å; I257-L261 VanDerWaalsContact CG2-CG 3.43Å; S258-L261 PolarHBondContact O-N 2.84Å; S258-L261 VanDerWaalsContact OG-CB 3.31Å; S258-L261 WeakPolarHBondContact OG-CB 3.48Å; A259-L261 VanDerWaalsContact C-N 3.34Å; A259-L261 PolarHBondContact O-N 3.44Å; L261-I263 VanDerWaalsContact C-N 3.33Å; L261-I263 PolarHBondContact O-N 2.88Å; L261-L264 HydrophobicContact CD1-CD2 4.17Å; L261-L264 PolarHBondContact O-N 3.45Å; L261-V265 HydrophobicContact CG-CG2 4.39Å; L261-V265 WeakPolarHBondContact O-CB 3.49Å; L261-V265 VanDerWaalsContact O-CG2 3.24Å; L261-V265 WeakPolarHBondContact O-CG2 3.49Å; L261-V265 PolarHBondContact O-N 3.46Å
262	D	88.5	Confident	85.8	Confident	62 Å²	62	52.6 Å²	52.6	33%	0.332	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-40.7	175	-170.3	57.9	0	0	0	111.5	S258 A259 D260 L264 V265 Q266	S258-D262 PolarHBondContact O-N 3.11Å; A259-D262 WeakPolarHBondContact O-CB 3.25Å; A259-D262 PolarHBondContact O-N 2.75Å; D260-D262 VanDerWaalsContact C-N 3.34Å; D262-L264 PolarHBondContact O-N 2.88Å; D262-V265 PolarHBondContact O-N 3.06Å; D262-Q266 VanDerWaalsContact O-CG 3.3Å; D262-Q266 WeakPolarHBondContact O-CG 3.27Å; D262-Q266 PolarHBondContact O-N 2.89Å; D262-Q266 PolarHBondContact OD2-NE2 3.29Å
263	I	88.5	Confident	86.5	Confident	76 Å²	76	54.1 Å²	54.1	39%	0.39	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-44.8	175.9	-58.9	166.8	0	0	0	111.1	A259 L261 V265 Q266 L267 L292	A259-I263 PolarHBondContact O-N 3.2Å; L261-I263 VanDerWaalsContact C-N 3.33Å; L261-I263 PolarHBondContact O-N 2.88Å; I263-V265 VanDerWaalsContact C-N 3.34Å; I263-V265 PolarHBondContact O-N 3.17Å; I263-Q266 PolarHBondContact O-N 3.09Å; I263-L267 PolarHBondContact O-N 3.33Å; I263-L267 VanDerWaalsContact O-N 3.12Å; I263-L292 HydrophobicContact CG2-CD1 3.78Å; I263-L292 HydrophobicContact CG2-CD2 3.45Å; I263-L292 VanDerWaalsContact CG2-CD2 3.45Å; I263-L292 HydrophobicContact CG2-CG 4.26Å
264	L	91	Very high	87.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-39.1	175.7	-179.3	62.7	0	0	0	111.8	L97 F101 L261 D262 L267 I268 I289	L97-L264 HydrophobicContact CB-CD2 3.61Å; L97-L264 HydrophobicContact CD1-CD2 4.27Å; F101-L264 HydrophobicContact CD1-CD1 4.47Å; L261-L264 HydrophobicContact CD1-CD2 4.17Å; L261-L264 PolarHBondContact O-N 3.45Å; D262-L264 PolarHBondContact O-N 2.88Å; L264-L267 HydrophobicContact CD1-CD2 4.5Å; L264-L267 WeakPolarHBondContact O-CB 3.27Å; L264-L267 PolarHBondContact O-N 3.13Å; L264-I268 HydrophobicContact CD1-CD1 4.41Å; L264-I268 HydrophobicContact CG-CD1 4Å; L264-I268 WeakPolarHBondContact O-CG1 3.25Å; L264-I268 PolarHBondContact O-N 3.24Å; L264-I289 HydrophobicContact CD1-CD1 4.21Å
265	V	91.8	Very high	87.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-64.1	-41.3	176.5	167.1	0	0	0	0	111.2	I207 F208 L254 I257 L261 D262 I263 L267 I268 Q269	I207-V265 HydrophobicContact CD1-CG2 4.06Å; I207-V265 HydrophobicContact CG2-CG2 4.09Å; F208-V265 HydrophobicContact CE2-CG1 4.3Å; F208-V265 HydrophobicContact CE2-CG2 4.2Å; F208-V265 HydrophobicContact CZ-CG1 4.07Å; F208-V265 HydrophobicContact CZ-CG2 4.05Å; L254-V265 HydrophobicContact CD1-CG1 4.18Å; I257-V265 HydrophobicContact CD1-CG2 4.15Å; L261-V265 HydrophobicContact CG-CG2 4.39Å; L261-V265 WeakPolarHBondContact O-CB 3.49Å; L261-V265 VanDerWaalsContact O-CG2 3.24Å; L261-V265 WeakPolarHBondContact O-CG2 3.49Å; L261-V265 PolarHBondContact O-N 3.46Å; D262-V265 PolarHBondContact O-N 3.06Å; I263-V265 VanDerWaalsContact C-N 3.34Å; I263-V265 PolarHBondContact O-N 3.17Å; V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 2.76Å; V265-I268 PolarHBondContact O-N 2.84Å; V265-Q269 HydrophobicContact CG1-CG 4.49Å; V265-Q269 WeakPolarHBondContact O-CG 3.42Å; V265-Q269 PolarHBondContact O-N 2.93Å
266	Q	90.8	Very high	88.7	Confident	86 Å²	86	42.4 Å²	42.4	40%	0.402	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-42.7	173.8	-70	174.5	30.3	0	0	111.2	D262 I263 I268 Q269 Y270	D262-Q266 VanDerWaalsContact O-CG 3.3Å; D262-Q266 WeakPolarHBondContact O-CG 3.27Å; D262-Q266 PolarHBondContact O-N 2.89Å; D262-Q266 PolarHBondContact OD2-NE2 3.29Å; I263-Q266 PolarHBondContact O-N 3.09Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 3.39Å; Q266-Q269 WeakPolarHBondContact O-CB 3.28Å; Q266-Q269 PolarHBondContact O-N 3.09Å; Q266-Y270 VanDerWaalsContact O-CD2 3.24Å; Q266-Y270 WeakPolarHBondContact O-CD2 3.5Å; Q266-Y270 PolarHBondContact O-N 2.89Å
267	L	92.2	Very high	89.3	Confident	8 Å²	8	45.2 Å²	45.2	4%	0.042	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-42.8	174.6	-171.5	64.6	0	0	0	112.3	F101 I263 L264 V265 Y270 L285 E288 I289	F101-L267 HydrophobicContact CD1-CD2 4.43Å; F101-L267 HydrophobicContact CE1-CD2 3.94Å; F101-L267 HydrophobicContact CE1-CG 4.28Å; I263-L267 PolarHBondContact O-N 3.33Å; I263-L267 VanDerWaalsContact O-N 3.12Å; L264-L267 HydrophobicContact CD1-CD2 4.5Å; L264-L267 WeakPolarHBondContact O-CB 3.27Å; L264-L267 PolarHBondContact O-N 3.13Å; V265-L267 VanDerWaalsContact C-N 3.31Å; V265-L267 PolarHBondContact O-N 2.76Å; L267-Y270 PolarHBondContact O-N 3.33Å; L267-L285 HydrophobicContact CD1-CD2 3.45Å; L267-L285 VanDerWaalsContact CD1-CD2 3.45Å; L267-L285 HydrophobicContact CG-CD2 3.93Å; L267-E288 HydrophobicContact CD1-CB 3.98Å; L267-E288 WeakPolarHBondContact CD1-OE2 3.46Å; L267-I289 HydrophobicContact CD2-CB 4.11Å
268	I	93.6	Very high	89.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-38	176.6	-69.4	161.8	0	0	0	111.2	F101 G200 F203 F204 I207 L264 V265 Q266 Y270 C271 L272	F101-I268 HydrophobicContact CE2-CG1 4.27Å; F101-I268 HydrophobicContact CZ-CG1 4.27Å; G200-I268 WeakPolarHBondContact O-CG2 3.34Å; F203-I268 HydrophobicContact CB-CD1 3.85Å; F203-I268 HydrophobicContact CB-CG1 4.24Å; F204-I268 HydrophobicContact CB-CG2 4.06Å; F204-I268 HydrophobicContact CD2-CG2 4.29Å; I207-I268 HydrophobicContact CD1-CD1 3.25Å; L264-I268 HydrophobicContact CD1-CD1 4.41Å; L264-I268 HydrophobicContact CG-CD1 4Å; L264-I268 WeakPolarHBondContact O-CG1 3.25Å; L264-I268 PolarHBondContact O-N 3.24Å; V265-I268 PolarHBondContact O-N 2.84Å; Q266-I268 VanDerWaalsContact C-N 3.34Å; Q266-I268 PolarHBondContact O-N 3.39Å; I268-Y270 VanDerWaalsContact C-N 3.28Å; I268-Y270 PolarHBondContact O-N 3.25Å; I268-C271 WeakPolarHBondContact O-CA 3.25Å; I268-C271 WeakPolarHBondContact O-CB 3.44Å; I268-C271 PolarHBondContact O-N 3.39Å; I268-L272 PolarHBondContact O-N 3.38Å
269	Q	92.5	Very high	90.4	Very high	42 Å²	42	45.2 Å²	45.2	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-34.5	175.7	-72.9	178	14.9	0	0	112.5	T245 P247 V265 Q266 C271 L272	T245-Q269 WeakPolarHBondContact CG2-O 3.11Å; P247-Q269 HydrophobicContact CG-CG 4.33Å; V265-Q269 HydrophobicContact CG1-CG 4.49Å; V265-Q269 WeakPolarHBondContact O-CG 3.42Å; V265-Q269 PolarHBondContact O-N 2.93Å; Q266-Q269 WeakPolarHBondContact O-CB 3.28Å; Q266-Q269 PolarHBondContact O-N 3.09Å; Q269-C271 PolarHBondContact O-N 2.98Å; Q269-L272 PolarHBondContact O-N 3.26Å
270	Y	93.9	Very high	91.1	Very high	105 Å²	105	42.6 Å²	42.6	41%	0.412	21%	0.209	S	C	.	.	H	α-helix	trans	-61.9	-31.5	172.8	-69.3	-57	0	0	0	112.9	Q266 L267 I268 L272 P280	Q266-Y270 VanDerWaalsContact O-CD2 3.24Å; Q266-Y270 WeakPolarHBondContact O-CD2 3.5Å; Q266-Y270 PolarHBondContact O-N 2.89Å; L267-Y270 PolarHBondContact O-N 3.33Å; I268-Y270 VanDerWaalsContact C-N 3.28Å; I268-Y270 PolarHBondContact O-N 3.25Å; Y270-L272 PolarHBondContact O-N 3.35Å; Y270-P280 WeakPolarHBondContact O-CD 3.26Å
271	C	95.7	Very high	91.8	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-28.9	173.6	-55.7	0	0	0	0	112.1	V196 I268 Q269 R273 R279 L285	V196-C271 HydrophobicContact CG1-CB 3.77Å; I268-C271 WeakPolarHBondContact O-CA 3.25Å; I268-C271 WeakPolarHBondContact O-CB 3.44Å; I268-C271 PolarHBondContact O-N 3.39Å; Q269-C271 PolarHBondContact O-N 2.98Å; C271-R273 VanDerWaalsContact C-N 3.31Å; C271-R273 PolarHBondContact O-N 2.81Å; C271-R279 WeakPolarHBondContact O-CD 3.25Å; C271-R279 WeakPolarHBondContact O-CG 3.41Å; C271-R279 PolarHBondContact O-NE 3.38Å; C271-L285 WeakPolarHBondContact SG-CD1 3.31Å
272	L	93.8	Very high	92.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	22.3	-176.6	-63.7	179	0	0	0	113.9	W197 V201 F204 T245 L246 P247 I268 Q269 Y270	W197-L272 HydrophobicContact CD2-CD2 4.35Å; W197-L272 VanDerWaalsContact CZ3-O 3.25Å; W197-L272 WeakPolarHBondContact CZ3-O 3.43Å; V201-L272 HydrophobicContact CB-CD2 4.36Å; V201-L272 HydrophobicContact CG2-CD2 3.49Å; V201-L272 VanDerWaalsContact CG2-CD2 3.49Å; F204-L272 HydrophobicContact CB-CD1 4.25Å; F204-L272 HydrophobicContact CD2-CD1 4.21Å; F204-L272 HydrophobicContact CG-CD1 4.2Å; T245-L272 WeakPolarHBondContact CA-O 3.49Å; L246-L272 HydrophobicContact CB-CB 4.21Å; L246-L272 PolarHBondContact N-O 3.11Å; P247-L272 HydrophobicContact CG-CD1 3.97Å; I268-L272 PolarHBondContact O-N 3.38Å; Q269-L272 PolarHBondContact O-N 3.26Å; Y270-L272 PolarHBondContact O-N 3.35Å
273	R	94.2	Very high	92.4	Very high	71 Å²	71	42.4 Å²	42.4	27%	0.268	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-71.1	129.9	172	-75.7	-176.5	168.8	-155	-5.1	111.2	W197 P244 T245 C271 R279	W197-R273 WeakPolarHBondContact CZ3-O 3.07Å; P244-R273 WeakPolarHBondContact O-CA 3.13Å; T245-R273 HydrophobicContact CG2-CG 3.9Å; C271-R273 VanDerWaalsContact C-N 3.31Å; C271-R273 PolarHBondContact O-N 2.81Å; R273-R279 HydrophobicContact CB-CB 4.48Å; R273-R279 PolarHBondContact O-NE 3.22Å; R273-R279 VanDerWaalsContact O-NE 3.07Å; R273-R279 PolarHBondContact O-NH2 3.31Å
274	F	91.3	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	S	Bend	trans	-63	-43.1	178.1	-79	-76.3	0	0	0	111.8	P163 W197 F233 L237 A240 P244 L246 F249 A276	P163-F274 HydrophobicContact CG-CD1 3.92Å; P163-F274 HydrophobicContact CG-CE1 4.29Å; W197-F274 AromaticContact CH2-CD1 3.88Å; W197-F274 HydrophobicContact CH2-CD1 3.88Å; W197-F274 AromaticContact CH2-CE1 3.8Å; W197-F274 HydrophobicContact CH2-CE1 3.8Å; W197-F274 HydrophobicContact CH2-CG 4.42Å; W197-F274 HydrophobicContact CH2-CZ 4.29Å; W197-F274 HydrophobicContact CZ3-CD1 4.26Å; W197-F274 HydrophobicContact CZ3-CG 4.46Å; F233-F274 HydrophobicContact CD1-CE1 4.33Å; L237-F274 HydrophobicContact CB-CD1 4.29Å; L237-F274 HydrophobicContact CD1-CB 4Å; L237-F274 WeakPolarHBondContact CD1-O 3.41Å; A240-F274 HydrophobicContact CB-CB 3.73Å; P244-F274 PolarHBondContact O-N 2.93Å; P244-F274 VanDerWaalsContact O-N 3.08Å; L246-F274 HydrophobicContact CB-CE2 4.39Å; L246-F274 HydrophobicContact CB-CZ 4.3Å; L246-F274 HydrophobicContact CD1-CE1 4.42Å; L246-F274 HydrophobicContact CD1-CZ 3.73Å; F249-F274 HydrophobicContact CB-CE2 3.75Å; F249-F274 HydrophobicContact CB-CZ 4.22Å; F249-F274 HydrophobicContact CD1-CE2 4.38Å; F249-F274 HydrophobicContact CD1-CZ 4Å; F249-F274 HydrophobicContact CG-CE2 4.11Å; F249-F274 HydrophobicContact CG-CZ 4.18Å; F274-A276 PolarHBondContact O-N 3.45Å
275	D	89.3	Confident	92.9	Very high	47 Å²	47	41.1 Å²	41.1	25%	0.251	20%	0.203	S	C	.	.			trans	-73	106.9	175.8	-177.8	-7.2	0	0	0	111.1	I277 K278 R279	D275-I277 PolarHBondContact O-N 3.31Å; D275-I277 VanDerWaalsContact OD1-CB 3.3Å; D275-I277 WeakPolarHBondContact OD1-CB 3.19Å; D275-I277 PolarHBondContact OD1-N 2.94Å; D275-K278 HydrophobicContact CB-CB 4.22Å; D275-K278 HydrophobicContact CB-CD 4.09Å; D275-K278 HydrophobicContact CB-CG 4.25Å; D275-K278 PolarHBondContact O-N 3.28Å; D275-K278 WeakPolarHBondContact OD2-CD 3.32Å; D275-K278 VanDerWaalsContact OD2-CE 3.23Å; D275-K278 WeakPolarHBondContact OD2-CE 3.37Å; D275-K278 WeakPolarHBondContact OD2-CG 3.39Å; D275-K278 IonicContact OD2-NZ 3.84Å; D275-R279 PolarHBondContact O-N 3.35Å; D275-R279 VanDerWaalsContact O-N 3.09Å
276	A	89	Confident	92.9	Very high	26 Å²	26	43 Å²	43	22%	0.215	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-24.5	178.7	0	0	0	0	0	113.4	E164 K193 F274	E164-A276 HydrophobicContact CG-CB 4.43Å; K193-A276 WeakPolarHBondContact CD-O 3.38Å; K193-A276 PolarHBondContact NZ-O 3.2Å; K193-A276 VanDerWaalsContact NZ-O 3.07Å; F274-A276 PolarHBondContact O-N 3.45Å
277	I	88.3	Confident	92.9	Very high	145 Å²	145	46 Å²	46	74%	0.744	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-42.7	175.5	-59.6	174.6	0	0	0	109.6	K193 D275	K193-I277 PolarHBondContact NZ-O 3.4Å; D275-I277 PolarHBondContact O-N 3.31Å; D275-I277 VanDerWaalsContact OD1-CB 3.3Å; D275-I277 WeakPolarHBondContact OD1-CB 3.19Å; D275-I277 PolarHBondContact OD1-N 2.94Å
278	K	91.8	Very high	92.8	Very high	103 Å²	103	49.1 Å²	49.1	45%	0.448	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-15.5	-179.7	-66.1	176.8	-171.7	169.4	0	114.1	D275	D275-K278 HydrophobicContact CB-CB 4.22Å; D275-K278 HydrophobicContact CB-CD 4.09Å; D275-K278 HydrophobicContact CB-CG 4.25Å; D275-K278 PolarHBondContact O-N 3.28Å; D275-K278 WeakPolarHBondContact OD2-CD 3.32Å; D275-K278 VanDerWaalsContact OD2-CE 3.23Å; D275-K278 WeakPolarHBondContact OD2-CE 3.37Å; D275-K278 WeakPolarHBondContact OD2-CG 3.39Å; D275-K278 IonicContact OD2-NZ 3.84Å
279	R	94.6	Very high	92.5	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.008	24%	0.238	C	C	.	.	S	Bend	trans	-68.2	137.1	176.7	-164.6	-178.6	-56.8	143	7	110.4	E164 K193 V196 C271 R273 D275	E164-R279 IonicContact OE1-CZ 3.47Å; E164-R279 IonicContact OE1-NH1 2.66Å; E164-R279 PolarHBondContact OE1-NH1 3.45Å; E164-R279 IonicContact OE1-NH2 3.41Å; E164-R279 PolarHBondContact OE1-NH2 3.06Å; E164-R279 IonicContact OE2-NH1 3.82Å; E164-R279 IonicContact OE2-NH2 3.23Å; E164-R279 PolarHBondContact OE2-NH2 3.46Å; K193-R279 HydrophobicContact CD-CB 4.29Å; K193-R279 VanDerWaalsContact CD-O 3.31Å; K193-R279 WeakPolarHBondContact CD-O 3.47Å; K193-R279 WeakPolarHBondContact CE-O 3.33Å; K193-R279 PolarHBondContact NZ-O 3.08Å; K193-R279 WeakPolarHBondContact O-CD 3.46Å; K193-R279 PolarHBondContact O-NH1 3.04Å; V196-R279 HydrophobicContact CG1-CG 4.25Å; C271-R279 WeakPolarHBondContact O-CD 3.25Å; C271-R279 WeakPolarHBondContact O-CG 3.41Å; C271-R279 PolarHBondContact O-NE 3.38Å; R273-R279 HydrophobicContact CB-CB 4.48Å; R273-R279 PolarHBondContact O-NE 3.22Å; R273-R279 VanDerWaalsContact O-NE 3.07Å; R273-R279 PolarHBondContact O-NH2 3.31Å; D275-R279 PolarHBondContact O-N 3.35Å; D275-R279 VanDerWaalsContact O-N 3.09Å
280	P	94.7	Very high	92.2	Very high	21 Å²	21	50.3 Å²	50.3	14%	0.136	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-69.7	159.7	-178.2	28.3	-34.8	0	0	0	112.1	Y270 C284 L285	Y270-P280 WeakPolarHBondContact O-CD 3.26Å; P280-C284 HydrophobicContact CB-CB 4.27Å; P280-L285 HydrophobicContact CB-CD2 4.05Å; P280-L285 HydrophobicContact CB-CG 3.96Å; P280-L285 HydrophobicContact CG-CD1 4.01Å; P280-L285 HydrophobicContact CG-CD2 3.58Å; P280-L285 HydrophobicContact CG-CG 3.79Å
281	T	94.5	Very high	91.6	Very high	59 Å²	59	51.7 Å²	51.7	36%	0.362	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-86	157.5	170.6	61	0	0	0	0	110.3	K283 C284 L285	T281-K283 PolarHBondContact O-N 3.43Å; T281-C284 WeakPolarHBondContact O-CB 3.35Å; T281-C284 PolarHBondContact O-N 2.76Å; T281-C284 PolarHBondContact OG1-N 3.36Å; T281-L285 PolarHBondContact O-N 3.2Å; T281-L285 VanDerWaalsContact O-N 3.16Å
282	P	95.3	Very high	90.6	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-53.3	-41.3	176	-26.1	33.4	0	0	0	112.9	L105 L108 I192 V196 C284 L285 M286	L105-P282 HydrophobicContact CD2-CB 4.4Å; L108-P282 HydrophobicContact CB-CB 4.05Å; L108-P282 HydrophobicContact CB-CG 3.78Å; I192-P282 HydrophobicContact CG1-CG 3.91Å; I192-P282 HydrophobicContact CG2-CG 4.19Å; V196-P282 HydrophobicContact CG2-CG 3.75Å; P282-C284 VanDerWaalsContact C-N 3.3Å; P282-C284 PolarHBondContact O-N 3.3Å; P282-L285 PolarHBondContact O-N 3.12Å; P282-M286 VanDerWaalsContact O-CG 3.32Å; P282-M286 WeakPolarHBondContact O-CG 3.48Å; P282-M286 PolarHBondContact O-N 2.95Å
283	K	93.9	Very high	89.7	Confident	97 Å²	97	55.4 Å²	55.4	42%	0.422	28%	0.275	S	S	.	.	H	α-helix	trans	-62.5	-32.3	177.1	-70.1	-174.8	176.3	179.8	0	114	S109 D113 T281 K287	S109-K283 VanDerWaalsContact OG-CE 3.25Å; S109-K283 WeakPolarHBondContact OG-CE 3.31Å; S109-K283 WeakPolarHBondContact OG-CG 3.46Å; D113-K283 VanDerWaalsContact OD1-CE 3.22Å; D113-K283 WeakPolarHBondContact OD1-CE 3.41Å; D113-K283 IonicContact OD1-NZ 3.9Å; D113-K283 PolarHBondContact OD1-NZ 2.97Å; D113-K283 WeakPolarHBondContact OD2-CE 3.38Å; D113-K283 IonicContact OD2-NZ 2.66Å; D113-K283 PolarHBondContact OD2-NZ 3.46Å; T281-K283 PolarHBondContact O-N 3.43Å; K283-K287 WeakPolarHBondContact O-CG 3.36Å; K283-K287 PolarHBondContact O-N 3.33Å
284	C	94.3	Very high	88.6	Confident	50 Å²	50	59.1 Å²	59.1	34%	0.338	29%	0.293	S	S	.	.	H	α-helix	trans	-69.2	-52.1	175.6	-164.3	0	0	0	0	109.9	P280 T281 P282 M286 K287 E288	P280-C284 HydrophobicContact CB-CB 4.27Å; T281-C284 WeakPolarHBondContact O-CB 3.35Å; T281-C284 PolarHBondContact O-N 2.76Å; T281-C284 PolarHBondContact OG1-N 3.36Å; P282-C284 VanDerWaalsContact C-N 3.3Å; P282-C284 PolarHBondContact O-N 3.3Å; C284-M286 VanDerWaalsContact C-N 3.28Å; C284-M286 PolarHBondContact O-N 2.97Å; C284-K287 WeakPolarHBondContact O-CB 3.45Å; C284-K287 PolarHBondContact O-N 3.4Å; C284-E288 PolarHBondContact O-N 2.68Å; C284-E288 PolarHBondContact SG-OE1 3.26Å
285	L	95	Very high	87.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.5	-38.1	179	-66.7	170	0	0	0	112.3	L105 V196 L267 C271 P280 T281 P282 K287 E288 I289	L105-L285 HydrophobicContact CD1-CB 3.57Å; L105-L285 HydrophobicContact CD2-CB 3.9Å; L105-L285 HydrophobicContact CD2-CD1 3.62Å; L105-L285 HydrophobicContact CD2-CG 4.43Å; L105-L285 HydrophobicContact CG-CB 4.38Å; V196-L285 HydrophobicContact CG1-CD1 3.67Å; L267-L285 HydrophobicContact CD1-CD2 3.45Å; L267-L285 VanDerWaalsContact CD1-CD2 3.45Å; L267-L285 HydrophobicContact CG-CD2 3.93Å; C271-L285 WeakPolarHBondContact SG-CD1 3.31Å; P280-L285 HydrophobicContact CB-CD2 4.05Å; P280-L285 HydrophobicContact CB-CG 3.96Å; P280-L285 HydrophobicContact CG-CD1 4.01Å; P280-L285 HydrophobicContact CG-CD2 3.58Å; P280-L285 HydrophobicContact CG-CG 3.79Å; T281-L285 PolarHBondContact O-N 3.2Å; T281-L285 VanDerWaalsContact O-N 3.16Å; P282-L285 PolarHBondContact O-N 3.12Å; L285-K287 VanDerWaalsContact C-N 3.3Å; L285-K287 PolarHBondContact O-N 2.97Å; L285-E288 PolarHBondContact O-N 3.39Å; L285-I289 WeakPolarHBondContact O-CG2 3.33Å; L285-I289 PolarHBondContact O-N 2.75Å
286	M	92.6	Very high	85.3	Confident	40 Å²	40	63.1 Å²	63.1	20%	0.197	32%	0.318	C	S	.	.	H	α-helix	trans	-61.3	-35.8	175.4	-76.1	-175.8	77.8	0	0	112.8	L105 P282 C284 I289 N290	L105-M286 HydrophobicContact CB-CG 3.57Å; L105-M286 HydrophobicContact CB-SD 4.35Å; L105-M286 HydrophobicContact CD1-CG 4.27Å; P282-M286 VanDerWaalsContact O-CG 3.32Å; P282-M286 WeakPolarHBondContact O-CG 3.48Å; P282-M286 PolarHBondContact O-N 2.95Å; C284-M286 VanDerWaalsContact C-N 3.28Å; C284-M286 PolarHBondContact O-N 2.97Å; M286-I289 WeakPolarHBondContact O-CG2 3.47Å; M286-N290 VanDerWaalsContact O-CB 3.25Å; M286-N290 WeakPolarHBondContact O-CB 3.46Å; M286-N290 PolarHBondContact O-N 3.02Å; M286-N290 VanDerWaalsContact O-N 3.13Å; M286-N290 PolarHBondContact O-ND2 2.86Å
287	K	90.3	Very high	83.1	Confident	149 Å²	149	66.3 Å²	66.3	65%	0.648	34%	0.338	S	S	*	.	H	α-helix	trans	-68	-48.1	177	-71.6	177.7	-179.5	-175.7	0	110.6	K283 C284 L285 I289 N290 E291	K283-K287 WeakPolarHBondContact O-CG 3.36Å; K283-K287 PolarHBondContact O-N 3.33Å; C284-K287 WeakPolarHBondContact O-CB 3.45Å; C284-K287 PolarHBondContact O-N 3.4Å; L285-K287 VanDerWaalsContact C-N 3.3Å; L285-K287 PolarHBondContact O-N 2.97Å; K287-I289 PolarHBondContact O-N 2.72Å; K287-N290 PolarHBondContact O-N 3.45Å; K287-E291 WeakPolarHBondContact O-CG 3.15Å; K287-E291 PolarHBondContact O-N 3.24Å; K287-E291 VanDerWaalsContact O-N 3.08Å
288	E	89.8	Confident	80.6	Confident	72 Å²	72	69.4 Å²	69.4	34%	0.336	34%	0.342	S	S	.	.	H	α-helix	trans	-60.5	-46.9	179.9	-68.7	172.5	-148.8	0	0	111.4	L267 C284 L285 N290 E291 L292	L267-E288 HydrophobicContact CD1-CB 3.98Å; L267-E288 WeakPolarHBondContact CD1-OE2 3.46Å; C284-E288 PolarHBondContact O-N 2.68Å; C284-E288 PolarHBondContact SG-OE1 3.26Å; L285-E288 PolarHBondContact O-N 3.39Å; E288-N290 PolarHBondContact O-N 2.86Å; E288-E291 WeakPolarHBondContact O-CB 3.42Å; E288-E291 PolarHBondContact O-N 2.94Å; E288-L292 WeakPolarHBondContact O-CG 3.37Å; E288-L292 PolarHBondContact O-N 3.03Å
289	I	88.6	Confident	78.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.8	-32.8	179	-164.6	156.8	0	0	0	113.6	S98 F101 L105 L264 L267 L285 M286 K287 E291 L292 L293	S98-I289 VanDerWaalsContact O-CD1 3.26Å; S98-I289 WeakPolarHBondContact O-CD1 3.32Å; F101-I289 HydrophobicContact CB-CD1 3.99Å; F101-I289 HydrophobicContact CD1-CD1 3.56Å; F101-I289 HydrophobicContact CG-CD1 4.25Å; L105-I289 HydrophobicContact CD1-CG2 4.42Å; L264-I289 HydrophobicContact CD1-CD1 4.21Å; L267-I289 HydrophobicContact CD2-CB 4.11Å; L285-I289 WeakPolarHBondContact O-CG2 3.33Å; L285-I289 PolarHBondContact O-N 2.75Å; M286-I289 WeakPolarHBondContact O-CG2 3.47Å; K287-I289 PolarHBondContact O-N 2.72Å; I289-E291 VanDerWaalsContact C-N 3.27Å; I289-E291 PolarHBondContact O-N 3.29Å; I289-L292 WeakPolarHBondContact O-CB 3.3Å; I289-L292 PolarHBondContact O-N 2.68Å; I289-L293 HydrophobicContact CG1-CD1 4.37Å; I289-L293 HydrophobicContact CG1-CG 4.46Å; I289-L293 WeakPolarHBondContact O-CG 3.22Å; I289-L293 PolarHBondContact O-N 3.47Å
290	N	84.6	Confident	75.1	Confident	67 Å²	67	74.4 Å²	74.4	36%	0.358	38%	0.379	S	S	.	.	H	α-helix	trans	-69.4	-29.3	176	-77	-30.6	0	0	0	111.8	M286 K287 E288 K294	M286-N290 VanDerWaalsContact O-CB 3.25Å; M286-N290 WeakPolarHBondContact O-CB 3.46Å; M286-N290 PolarHBondContact O-N 3.02Å; M286-N290 VanDerWaalsContact O-N 3.13Å; M286-N290 PolarHBondContact O-ND2 2.86Å; K287-N290 PolarHBondContact O-N 3.45Å; E288-N290 PolarHBondContact O-N 2.86Å; N290-K294 WeakPolarHBondContact O-CB 3.44Å; N290-K294 VanDerWaalsContact O-CG 3.25Å; N290-K294 WeakPolarHBondContact O-CG 3.04Å; N290-K294 PolarHBondContact O-N 3.04Å; N290-K294 VanDerWaalsContact O-N 3.16Å
291	E	81.6	Confident	72.3	Confident	135 Å²	135	78.3 Å²	78.3	63%	0.631	41%	0.407	S	S	*	.	H	α-helix	trans	-66.5	-43.2	170.4	-72	178.6	179	0	0	110.7	K287 E288 I289 K294 T295	K287-E291 WeakPolarHBondContact O-CG 3.15Å; K287-E291 PolarHBondContact O-N 3.24Å; K287-E291 VanDerWaalsContact O-N 3.08Å; E288-E291 WeakPolarHBondContact O-CB 3.42Å; E288-E291 PolarHBondContact O-N 2.94Å; I289-E291 VanDerWaalsContact C-N 3.27Å; I289-E291 PolarHBondContact O-N 3.29Å; E291-K294 PolarHBondContact O-N 2.93Å; E291-T295 PolarHBondContact O-N 3.4Å; E291-T295 PolarHBondContact O-OG1 3.04Å; E291-T295 VanDerWaalsContact O-OG1 3.1Å
292	L	75.2	Confident	69.3	Low	42 Å²	42	82.3 Å²	82.3	22%	0.22	43%	0.426	C	S	.	.	H	α-helix	trans	-60.9	-46	174.9	-62	176	0	0	0	112.9	I263 E288 I289 K294 T295 D296	I263-L292 HydrophobicContact CG2-CD1 3.78Å; I263-L292 HydrophobicContact CG2-CD2 3.45Å; I263-L292 VanDerWaalsContact CG2-CD2 3.45Å; I263-L292 HydrophobicContact CG2-CG 4.26Å; E288-L292 WeakPolarHBondContact O-CG 3.37Å; E288-L292 PolarHBondContact O-N 3.03Å; I289-L292 WeakPolarHBondContact O-CB 3.3Å; I289-L292 PolarHBondContact O-N 2.68Å; L292-K294 VanDerWaalsContact C-N 3.29Å; L292-K294 PolarHBondContact O-N 3.21Å; L292-T295 WeakPolarHBondContact CA-OG1 3.32Å; L292-T295 PolarHBondContact O-N 3.23Å; L292-T295 PolarHBondContact O-OG1 3.24Å; L292-D296 PolarHBondContact O-N 2.66Å
293	L	74.8	Confident	66.5	Low	37 Å²	37	89.3 Å²	89.3	19%	0.194	46%	0.462	C	S	.	.	H	α-helix	trans	-67	-28.7	179.4	-72.6	171.6	0	0	0	113	I289 C297	I289-L293 HydrophobicContact CG1-CD1 4.37Å; I289-L293 HydrophobicContact CG1-CG 4.46Å; I289-L293 WeakPolarHBondContact O-CG 3.22Å; I289-L293 PolarHBondContact O-N 3.47Å; L293-C297 PolarHBondContact O-N 2.8Å
294	K	71.9	Confident	63.5	Low	149 Å²	149	91.1 Å²	91.1	65%	0.648	49%	0.487	S	S	*	.	H	α-helix	trans	-70.4	-36.4	175.9	-80.2	173.9	-176.7	178.5	0	112.2	N290 E291 L292 D296	N290-K294 WeakPolarHBondContact O-CB 3.44Å; N290-K294 VanDerWaalsContact O-CG 3.25Å; N290-K294 WeakPolarHBondContact O-CG 3.04Å; N290-K294 PolarHBondContact O-N 3.04Å; N290-K294 VanDerWaalsContact O-N 3.16Å; E291-K294 PolarHBondContact O-N 2.93Å; L292-K294 VanDerWaalsContact C-N 3.29Å; L292-K294 PolarHBondContact O-N 3.21Å; K294-D296 VanDerWaalsContact C-N 3.34Å
295	T	59.6	Low	60.6	Low	86 Å²	86	91.1 Å²	91.1	53%	0.528	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-38.1	177	20.7	0	0	0	0	112.2	E291 L292 Y298	E291-T295 PolarHBondContact O-N 3.4Å; E291-T295 PolarHBondContact O-OG1 3.04Å; E291-T295 VanDerWaalsContact O-OG1 3.1Å; L292-T295 WeakPolarHBondContact CA-OG1 3.32Å; L292-T295 PolarHBondContact O-N 3.23Å; L292-T295 PolarHBondContact O-OG1 3.24Å; T295-Y298 PolarHBondContact O-N 2.76Å
296	D	51.4	Low	57.7	Low	44 Å²	44	98.1 Å²	98.1	24%	0.235	53%	0.533	C	S	.	.	H	α-helix	trans	-73.9	-31.1	-178.7	-70.8	-26	0	0	0	113.8	L292 K294 Y298 I299 S300	L292-D296 PolarHBondContact O-N 2.66Å; K294-D296 VanDerWaalsContact C-N 3.34Å; D296-Y298 PolarHBondContact O-N 3.36Å; D296-I299 PolarHBondContact O-N 3.44Å; D296-S300 PolarHBondContact O-N 3.33Å
297	C	43.5	Very low	54.9	Low	94 Å²	94	105 Å²	105	64%	0.635	56%	0.562	S	S	*	*	H	α-helix	trans	-61.3	-25.2	177	-78.9	0	0	0	0	113.4	L293 I299	L293-C297 PolarHBondContact O-N 2.8Å; C297-I299 VanDerWaalsContact C-N 3.32Å
298	Y	35.3	Very low	52.2	Low	210 Å²	210	108.2 Å²	108.2	82%	0.824	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-15.4	175.1	-84.3	-81.1	0	0	0	113.8	T295 D296	T295-Y298 PolarHBondContact O-N 2.76Å; D296-Y298 PolarHBondContact O-N 3.36Å
299	I	38.4	Very low	49.5	Very low	120 Å²	120	106.1 Å²	106.1	62%	0.615	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-24	-175.3	-58.1	175.3	0	0	0	111.4	D296 C297 S301	D296-I299 PolarHBondContact O-N 3.44Å; C297-I299 VanDerWaalsContact C-N 3.32Å; I299-S301 PolarHBondContact O-N 3.46Å
300	S	32.9	Very low	47	Very low	90 Å²	90	109 Å²	109	63%	0.629	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	3.3	-169.8	70.2	0	0	0	0	117.7	D296 D302	D296-S300 PolarHBondContact O-N 3.33Å; S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 3.02Å
301	S	34.1	Very low	44.9	Very low	103 Å²	103	110.7 Å²	110.7	72%	0.72	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-13.1	178.3	60	0	0	0	0	115.1	I299	I299-S301 PolarHBondContact O-N 3.46Å
302	D	33	Very low	42.7	Very low	142 Å²	142	108.8 Å²	108.8	76%	0.759	58%	0.584	S	S	*	*	S	Bend	trans	-138.2	74.7	179.8	-76.5	-39.6	0	0	0	111.8	S300	S300-D302 VanDerWaalsContact C-N 3.29Å; S300-D302 PolarHBondContact O-N 3.02Å
303	I	35	Very low	40.8	Very low	148 Å²	148	107.8 Å²	107.8	76%	0.759	58%	0.58	S	S	*	*			trans	-156.4	100.8	148.8	-81.9	123.6	0	0	0	107.7	G305	I303-G305 PolarHBondContact O-N 3.25Å
304	S	32.5	Very low	39	Very low	136 Å²	136	112 Å²	112	95%	0.951	59%	0.593	S	S	*	*			trans	-75.7	97.4	158.1	43.6	0	0	0	0	107.8
305	G	33.2	Very low	37.6	Very low	49 Å²	49	112.3 Å²	112.3	51%	0.505	60%	0.595	S	S	.	*			trans	-153.3	68.8	-170.8	0	0	0	0	0	113.8	I303 K307	I303-G305 PolarHBondContact O-N 3.25Å; G305-K307 PolarHBondContact O-N 3.05Å
306	D	32.6	Very low	36.6	Very low	148 Å²	148	109.7 Å²	109.7	79%	0.791	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	35.2	-172.6	-137.8	-0.7	0	0	0	115.2
307	K	34.2	Very low	35.9	Very low	185 Å²	185	112.6 Å²	112.6	80%	0.804	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-5.2	-169	-86.2	-172.1	178.4	178.6	0	117.5	G305	G305-K307 PolarHBondContact O-N 3.05Å
308	Y	33.2	Very low	35.2	Very low	215 Å²	215	114.2 Å²	114.2	84%	0.843	60%	0.602	S	S	*	*			trans	-120.2	7.3	-176.5	-62.7	-71.6	0	0	0	115.8	T310	Y308-T310 PolarHBondContact O-N 3.39Å
309	S	33.5	Very low	35.1	Very low	28 Å²	28	110 Å²	110	20%	0.196	59%	0.585	C	S	.	*			trans	-70.9	117.3	171.4	65.4	0	0	0	0	110.1	R314	S309-R314 PolarHBondContact O-NH2 3.15Å; S309-R314 PolarHBondContact OG-NE 2.92Å; S309-R314 VanDerWaalsContact OG-NE 3.12Å
310	T	37.8	Very low	34.8	Very low	60 Å²	60	108.7 Å²	108.7	37%	0.368	58%	0.584	S	S	.	*			trans	-54.1	148.2	171.2	60.4	0	0	0	0	109.2	Y308 W312 C313 R314	Y308-T310 PolarHBondContact O-N 3.39Å; T310-W312 PolarHBondContact O-N 3.08Å; T310-C313 PolarHBondContact O-N 3.49Å; T310-C313 PolarHBondContact OG1-SG 3.42Å; T310-C313 VanDerWaalsContact OG1-SG 3.39Å; T310-R314 PolarHBondContact O-N 3.48Å
311	P	39	Very low	35	Very low	103 Å²	103	111.8 Å²	111.8	67%	0.669	59%	0.586	S	S	*	*	H	α-helix	trans	-53.5	-22.3	-179.2	-26.9	34.1	0	0	0	114.1	K315	P311-K315 PolarHBondContact O-N 3.22Å
312	W	35.8	Very low	35.3	Very low	95 Å²	95	111.3 Å²	111.3	36%	0.36	57%	0.568	S	S	.	*	H	α-helix	trans	-78.7	-42.7	178.9	-124.1	71.3	0	0	0	113.4	T82 N86 F87 T310 R314 K315 I316	T82-W312 HydrophobicContact CG2-CH2 3.67Å; T82-W312 HydrophobicContact CG2-CZ3 3.7Å; N86-W312 HydrophobicContact CB-CH2 3.6Å; N86-W312 HydrophobicContact CB-CZ2 4.14Å; F87-W312 HydrophobicContact CD1-CE3 4.06Å; F87-W312 HydrophobicContact CD1-CZ3 4.07Å; F87-W312 AromaticContact CE1-CE3 3.52Å; F87-W312 HydrophobicContact CE1-CE3 3.52Å; F87-W312 AromaticContact CE1-CZ3 3.54Å; F87-W312 HydrophobicContact CE1-CZ3 3.54Å; F87-W312 HydrophobicContact CZ-CE3 4.37Å; F87-W312 HydrophobicContact CZ-CZ3 4.06Å; T310-W312 PolarHBondContact O-N 3.08Å; W312-R314 PolarHBondContact O-N 3Å; W312-K315 WeakPolarHBondContact O-CB 3.18Å; W312-K315 PolarHBondContact O-N 3.35Å; W312-I316 HydrophobicContact CE3-CD1 4.06Å; W312-I316 HydrophobicContact CZ3-CD1 4.23Å; W312-I316 PolarHBondContact O-N 3.01Å
313	C	35.4	Very low	35.4	Very low	22 Å²	22	112 Å²	112	15%	0.149	57%	0.567	C	S	.	*	H	α-helix	trans	-56.7	-42.1	172.6	-66.8	0	0	0	0	110.8	T310 K315 I316 C317	T310-C313 PolarHBondContact O-N 3.49Å; T310-C313 PolarHBondContact OG1-SG 3.42Å; T310-C313 VanDerWaalsContact OG1-SG 3.39Å; C313-K315 VanDerWaalsContact C-N 3.32Å; C313-K315 PolarHBondContact O-N 2.88Å; C313-I316 PolarHBondContact O-N 3.02Å; C313-C317 PolarHBondContact O-N 2.79Å; C313-C317 PolarHBondContact O-SG 3.16Å
314	R	37.1	Very low	35.3	Very low	125 Å²	125	111.6 Å²	111.6	47%	0.472	56%	0.562	S	S	.	*	H	α-helix	trans	-62.2	-34.2	174.7	-110.7	-179.8	-74.4	158.8	-1.8	113.5	S309 T310 W312 N318	S309-R314 PolarHBondContact O-NH2 3.15Å; S309-R314 PolarHBondContact OG-NE 2.92Å; S309-R314 VanDerWaalsContact OG-NE 3.12Å; T310-R314 PolarHBondContact O-N 3.48Å; W312-R314 PolarHBondContact O-N 3Å; R314-N318 VanDerWaalsContact O-CB 3.23Å; R314-N318 WeakPolarHBondContact O-CB 3.11Å; R314-N318 PolarHBondContact O-N 3.39Å; R314-N318 VanDerWaalsContact O-N 3.17Å; R314-N318 PolarHBondContact O-ND2 3.39Å; R314-N318 VanDerWaalsContact O-ND2 3.15Å
315	K	42.1	Very low	35.5	Very low	155 Å²	155	112.4 Å²	112.4	67%	0.674	55%	0.548	S	S	*	.	H	α-helix	trans	-68.9	-32.5	177	-98.8	-176.5	176.8	-180	0	113	P311 W312 C313	P311-K315 PolarHBondContact O-N 3.22Å; W312-K315 WeakPolarHBondContact O-CB 3.18Å; W312-K315 PolarHBondContact O-N 3.35Å; C313-K315 VanDerWaalsContact C-N 3.32Å; C313-K315 PolarHBondContact O-N 2.88Å
316	I	38.4	Very low	35.7	Very low	32 Å²	32	114 Å²	114	16%	0.164	54%	0.543	C	S	.	.	H	α-helix	trans	-77.3	-47.9	177.8	-63.3	172.4	0	0	0	109.7	L128 W312 C313 N318 R319	L128-I316 HydrophobicContact CD1-CD1 4.01Å; W312-I316 HydrophobicContact CE3-CD1 4.06Å; W312-I316 HydrophobicContact CZ3-CD1 4.23Å; W312-I316 PolarHBondContact O-N 3.01Å; C313-I316 PolarHBondContact O-N 3.02Å; I316-N318 PolarHBondContact O-N 3.36Å; I316-R319 PolarHBondContact O-N 3.44Å
317	C	35.9	Very low	36.2	Very low	105 Å²	105	112.3 Å²	112.3	71%	0.709	54%	0.54	S	S	*	.	H	α-helix	trans	-64.5	-23.3	179.9	-61.7	0	0	0	0	114.2	C313	C313-C317 PolarHBondContact O-N 2.79Å; C313-C317 PolarHBondContact O-SG 3.16Å
318	N	29.8	Very low	36.4	Very low	128 Å²	128	109.7 Å²	109.7	68%	0.684	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	10.4	-179.6	-74.6	-20	0	0	0	114.4	R314 I316	R314-N318 VanDerWaalsContact O-CB 3.23Å; R314-N318 WeakPolarHBondContact O-CB 3.11Å; R314-N318 PolarHBondContact O-N 3.39Å; R314-N318 VanDerWaalsContact O-N 3.17Å; R314-N318 PolarHBondContact O-ND2 3.39Å; R314-N318 VanDerWaalsContact O-ND2 3.15Å; I316-N318 PolarHBondContact O-N 3.36Å
319	R	33.3	Very low	36.8	Very low	122 Å²	122	102 Å²	102	46%	0.46	50%	0.503	S	S	.	.	S	Bend	trans	-74.6	134.6	168.9	-72.7	-173.6	173.6	-173.8	-2.7	109.1	I316 K321	I316-R319 PolarHBondContact O-N 3.44Å; R319-K321 PolarHBondContact O-N 3.08Å
320	P	32	Very low	37.1	Very low	91 Å²	91	108.5 Å²	108.5	59%	0.591	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-57.7	126.9	177.1	22.7	-30.8	0	0	0	109.1
321	K	37.8	Very low	37.4	Very low	155 Å²	155	108.8 Å²	108.8	67%	0.674	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-57.2	141.2	179	-68.4	-178	177.4	-178.8	0	109.1	R319 H323 E324	R319-K321 PolarHBondContact O-N 3.08Å; K321-H323 PolarHBondContact O-N 3.3Å; K321-E324 PolarHBondContact O-N 3.39Å
322	R	39.6	Very low	37.5	Very low	94 Å²	94	110.9 Å²	110.9	36%	0.355	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-13.9	-177.2	-93.9	-177.7	172.7	171.6	1.5	115.8	S130	S130-R322 PolarHBondContact OG-NE 3.12Å
323	H	34.3	Very low	37.9	Very low	155 Å²	155	115.4 Å²	115.4	72%	0.718	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	9	-171.1	-61.8	-58.1	0	0	0	116.1	K321 F325	K321-H323 PolarHBondContact O-N 3.3Å; H323-F325 VanDerWaalsContact C-N 3.29Å; H323-F325 PolarHBondContact O-N 3.1Å
324	E	34.8	Very low	38.7	Very low	141 Å²	141	119.5 Å²	119.5	66%	0.659	58%	0.583	S	S	*	*			trans	-74.5	87.3	169.5	-76.4	-174.7	-178.8	0	0	110.2	K321 H326	K321-E324 PolarHBondContact O-N 3.39Å; E324-H326 PolarHBondContact O-N 2.89Å
325	F	36.1	Very low	39.5	Very low	152 Å²	152	118 Å²	118	67%	0.667	59%	0.592	S	S	*	*			trans	-61.5	103.7	170.9	-133.9	-88.8	0	0	0	108.1	H323 P327	H323-F325 VanDerWaalsContact C-N 3.29Å; H323-F325 PolarHBondContact O-N 3.1Å; F325-P327 WeakPolarHBondContact O-CD 3.43Å
326	H	37.3	Very low	40.4	Very low	84 Å²	84	118.5 Å²	118.5	39%	0.389	59%	0.594	S	S	.	*			trans	-69.8	114.8	-176.6	-141.5	-87.2	0	0	0	109	E324 Q328	E324-H326 PolarHBondContact O-N 2.89Å; H326-Q328 PolarHBondContact CE1-OE1 3.24Å; H326-Q328 PolarHBondContact O-N 2.94Å
327	P	43.7	Very low	41.8	Very low	112 Å²	112	119 Å²	119	73%	0.727	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-0.9	-172.4	25.7	-33.3	0	0	0	114.3	F325 L329	F325-P327 WeakPolarHBondContact O-CD 3.43Å; P327-L329 VanDerWaalsContact C-N 3.25Å; P327-L329 PolarHBondContact O-N 3Å
328	Q	38.1	Very low	43.8	Very low	129 Å²	129	117 Å²	117	60%	0.603	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	7.7	-178.3	-69.6	179.3	-15.7	0	0	114.5	H326 F330 S331	H326-Q328 PolarHBondContact CE1-OE1 3.24Å; H326-Q328 PolarHBondContact O-N 2.94Å; Q328-F330 PolarHBondContact O-N 3.46Å; Q328-S331 PolarHBondContact O-N 3.45Å
329	L	40.6	Very low	46	Very low	54 Å²	54	114.7 Å²	114.7	28%	0.283	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.8	-11.3	-175.2	-146.5	94.6	0	0	0	114.7	P327 N344 L464	P327-L329 VanDerWaalsContact C-N 3.25Å; P327-L329 PolarHBondContact O-N 3Å; L329-N344 WeakPolarHBondContact CD1-ND2 3.37Å; L329-L464 HydrophobicContact CD2-CD1 4.31Å; L329-L464 HydrophobicContact CD2-CD2 4.3Å
330	F	40.7	Very low	48.1	Very low	165 Å²	165	111.7 Å²	111.7	72%	0.724	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	1.2	-175.3	-62.4	-69.5	0	0	0	115.6	Q328 L332	Q328-F330 PolarHBondContact O-N 3.46Å; F330-L332 PolarHBondContact O-N 2.91Å
331	S	43.6	Very low	50.5	Low	66 Å²	66	108.8 Å²	108.8	46%	0.462	54%	0.537	S	S	.	.			trans	-90.4	85.4	169.3	63.2	0	0	0	0	110.4	Q328 E333 N337	Q328-S331 PolarHBondContact O-N 3.45Å; S331-E333 PolarHBondContact O-N 3.46Å; S331-N337 PolarHBondContact O-ND2 3.07Å; S331-N337 PolarHBondContact OG-ND2 3.42Å
332	L	41	Very low	52.6	Low	146 Å²	146	101.4 Å²	101.4	76%	0.764	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	107.1	171.3	-96.9	79.5	0	0	0	108.5	F330	F330-L332 PolarHBondContact O-N 2.91Å
333	E	45.1	Very low	54.5	Low	190 Å²	190	100.4 Å²	100.4	89%	0.888	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	172.1	-7.4	139.5	-95	175.1	-170.5	0	0	115.3	S331	S331-E333 PolarHBondContact O-N 3.46Å
334	D	50.5	Low	56.6	Low	108 Å²	108	94.2 Å²	94.2	58%	0.578	47%	0.474	S	S	*	.			trans	-83.6	137.4	178.8	-78	-30.2	0	0	0	114	K336 N337	D334-K336 PolarHBondContact O-N 2.94Å; D334-K336 VanDerWaalsContact O-N 3.14Å; D334-N337 WeakPolarHBondContact O-CA 3.48Å; D334-N337 VanDerWaalsContact O-CB 3.31Å; D334-N337 WeakPolarHBondContact O-CB 3.42Å; D334-N337 PolarHBondContact O-N 3.43Å
335	S	55.3	Low	59	Low	94 Å²	94	87.5 Å²	87.5	66%	0.657	44%	0.443	S	S	*	.	H	α-helix	trans	-55.9	-30.6	173.6	61	0	0	0	0	113.1	N337 N338	S335-N337 VanDerWaalsContact C-N 3.28Å; S335-N337 PolarHBondContact O-N 3.39Å; S335-N338 PolarHBondContact O-N 3.11Å
336	K	60	Low	61.3	Low	166 Å²	166	81.1 Å²	81.1	72%	0.722	42%	0.415	S	S	*	.	H	α-helix	trans	-61.9	-33.5	171.8	-72	-179.5	178.8	173.3	0	112.4	D334 L340	D334-K336 PolarHBondContact O-N 2.94Å; D334-K336 VanDerWaalsContact O-N 3.14Å; K336-L340 PolarHBondContact O-N 2.92Å
337	N	68.1	Low	63.4	Low	43 Å²	43	79.1 Å²	79.1	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-73	-28.3	179.6	-68	-13.5	0	0	0	112.1	S331 D334 S335 L340 K341	S331-N337 PolarHBondContact O-ND2 3.07Å; S331-N337 PolarHBondContact OG-ND2 3.42Å; D334-N337 WeakPolarHBondContact O-CA 3.48Å; D334-N337 VanDerWaalsContact O-CB 3.31Å; D334-N337 WeakPolarHBondContact O-CB 3.42Å; D334-N337 PolarHBondContact O-N 3.43Å; S335-N337 VanDerWaalsContact C-N 3.28Å; S335-N337 PolarHBondContact O-N 3.39Å; N337-L340 PolarHBondContact O-N 3.42Å; N337-K341 VanDerWaalsContact O-CB 3.27Å; N337-K341 WeakPolarHBondContact O-CB 3.1Å; N337-K341 PolarHBondContact O-N 2.97Å
338	N	79	Confident	65.1	Low	61 Å²	61	75.6 Å²	75.6	33%	0.326	39%	0.385	S	S	.	.	H	α-helix	trans	-69.9	-41.1	177	-76	-25	0	0	0	112.9	S335 K341 A342 S460	S335-N338 PolarHBondContact O-N 3.11Å; N338-K341 WeakPolarHBondContact O-CB 3.33Å; N338-K341 PolarHBondContact O-N 3.48Å; N338-A342 PolarHBondContact O-N 3.43Å; N338-S460 WeakPolarHBondContact O-CB 3.48Å
339	I	75.7	Confident	67.4	Low	81 Å²	81	69.9 Å²	69.9	42%	0.415	36%	0.359	S	S	.	.	H	α-helix	trans	-66.5	-42.7	174.9	-61.9	174.5	0	0	0	109.9	K341 A342 Y343	I339-K341 VanDerWaalsContact C-N 3.32Å; I339-K341 PolarHBondContact O-N 3.21Å; I339-A342 PolarHBondContact O-N 2.95Å; I339-Y343 WeakPolarHBondContact O-CB 3.46Å; I339-Y343 PolarHBondContact O-N 3.14Å
340	L	77.2	Confident	69.4	Low	58 Å²	58	75.8 Å²	75.8	30%	0.304	39%	0.385	S	S	.	.	H	α-helix	trans	-62.8	-38.8	176.4	-173.5	63.4	0	0	0	112	K336 N337 Y343 N344	K336-L340 PolarHBondContact O-N 2.92Å; N337-L340 PolarHBondContact O-N 3.42Å; L340-Y343 HydrophobicContact CD1-CD1 4.43Å; L340-Y343 WeakPolarHBondContact O-CB 3.47Å; L340-Y343 PolarHBondContact O-N 2.81Å; L340-N344 WeakPolarHBondContact O-CB 3.25Å; L340-N344 VanDerWaalsContact O-CG 3.23Å; L340-N344 PolarHBondContact O-N 3.04Å; L340-N344 PolarHBondContact O-ND2 3.24Å
341	K	81.4	Confident	71.8	Confident	30 Å²	30	70.2 Å²	70.2	13%	0.13	36%	0.363	C	S	.	.	H	α-helix	trans	-58.5	-48.6	172.5	176.7	-171.7	67	179.3	0	111.3	N337 N338 I339 Y343 N344 F345 S460 T462 L464 L467	N337-K341 VanDerWaalsContact O-CB 3.27Å; N337-K341 WeakPolarHBondContact O-CB 3.1Å; N337-K341 PolarHBondContact O-N 2.97Å; N338-K341 WeakPolarHBondContact O-CB 3.33Å; N338-K341 PolarHBondContact O-N 3.48Å; I339-K341 VanDerWaalsContact C-N 3.32Å; I339-K341 PolarHBondContact O-N 3.21Å; K341-Y343 VanDerWaalsContact C-N 3.31Å; K341-Y343 PolarHBondContact O-N 3.07Å; K341-N344 PolarHBondContact O-N 3.26Å; K341-F345 WeakPolarHBondContact O-CB 3.4Å; K341-F345 PolarHBondContact O-N 3.5Å; K341-S460 WeakPolarHBondContact CE-O 3.44Å; K341-S460 PolarHBondContact NZ-O 3.23Å; K341-T462 WeakPolarHBondContact CE-O 3.26Å; K341-T462 PolarHBondContact NZ-O 3.27Å; K341-L464 HydrophobicContact CD-CD1 4.07Å; K341-L464 HydrophobicContact CG-CD1 4.13Å; K341-L467 HydrophobicContact CD-CD1 4.14Å; K341-L467 HydrophobicContact CG-CD1 4.07Å
342	A	83.8	Confident	74.1	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.7	-41.3	177.5	0	0	0	0	0	112	N338 I339 F345 I346 I456 I459	N338-A342 PolarHBondContact O-N 3.43Å; I339-A342 PolarHBondContact O-N 2.95Å; A342-F345 PolarHBondContact O-N 3.49Å; A342-I346 VanDerWaalsContact O-CG1 3.29Å; A342-I346 WeakPolarHBondContact O-CG1 3.26Å; A342-I346 PolarHBondContact O-N 3.35Å; A342-I456 HydrophobicContact CB-CG2 4.32Å; A342-I459 HydrophobicContact CB-CB 3.94Å; A342-I459 HydrophobicContact CB-CG2 3.72Å
343	Y	79.1	Confident	76.6	Confident	73 Å²	73	62.1 Å²	62.1	29%	0.286	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-47.3	176.1	-176.6	-109.7	0	0	0	112.7	L11 I339 L340 K341 F345 I346 N347	L11-Y343 HydrophobicContact CD2-CD2 3.61Å; L11-Y343 HydrophobicContact CD2-CE2 3.25Å; L11-Y343 HydrophobicContact CD2-CG 4.4Å; L11-Y343 HydrophobicContact CG-CE2 4.46Å; I339-Y343 WeakPolarHBondContact O-CB 3.46Å; I339-Y343 PolarHBondContact O-N 3.14Å; L340-Y343 HydrophobicContact CD1-CD1 4.43Å; L340-Y343 WeakPolarHBondContact O-CB 3.47Å; L340-Y343 PolarHBondContact O-N 2.81Å; K341-Y343 VanDerWaalsContact C-N 3.31Å; K341-Y343 PolarHBondContact O-N 3.07Å; Y343-F345 VanDerWaalsContact C-N 3.28Å; Y343-F345 PolarHBondContact O-N 3.33Å; Y343-I346 PolarHBondContact O-N 3.21Å; Y343-N347 WeakPolarHBondContact CD1-ND2 3.39Å; Y343-N347 WeakPolarHBondContact CE1-ND2 3.39Å; Y343-N347 WeakPolarHBondContact CE2-ND2 3.42Å; Y343-N347 WeakPolarHBondContact O-CB 3.35Å; Y343-N347 PolarHBondContact O-N 3.32Å; Y343-N347 PolarHBondContact OH-ND2 2.92Å
344	N	78.2	Confident	78.9	Confident	26 Å²	26	53.5 Å²	53.5	14%	0.139	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-38.9	176.5	-71.4	-14.4	0	0	0	111.5	L329 L340 K341 S348	L329-N344 WeakPolarHBondContact CD1-ND2 3.37Å; L340-N344 WeakPolarHBondContact O-CB 3.25Å; L340-N344 VanDerWaalsContact O-CG 3.23Å; L340-N344 PolarHBondContact O-N 3.04Å; L340-N344 PolarHBondContact O-ND2 3.24Å; K341-N344 PolarHBondContact O-N 3.26Å; N344-S348 VanDerWaalsContact O-CB 3.3Å; N344-S348 WeakPolarHBondContact O-CB 3.34Å; N344-S348 PolarHBondContact O-N 3.45Å
345	F	84.4	Confident	80.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.8	-51	174.8	177.3	-103.9	0	0	0	111.7	K341 A342 Y343 N347 S348 I349 Y358 I459 L467 Y468 I577	K341-F345 WeakPolarHBondContact O-CB 3.4Å; K341-F345 PolarHBondContact O-N 3.5Å; A342-F345 PolarHBondContact O-N 3.49Å; Y343-F345 VanDerWaalsContact C-N 3.28Å; Y343-F345 PolarHBondContact O-N 3.33Å; F345-N347 VanDerWaalsContact C-N 3.31Å; F345-N347 PolarHBondContact O-N 2.78Å; F345-S348 WeakPolarHBondContact O-CB 3.33Å; F345-S348 PolarHBondContact O-N 2.98Å; F345-S348 PolarHBondContact O-OG 3.17Å; F345-I349 HydrophobicContact CD1-CD1 4.1Å; F345-I349 HydrophobicContact CE1-CD1 3.59Å; F345-I349 HydrophobicContact CE2-CD1 4.36Å; F345-I349 HydrophobicContact CZ-CD1 3.74Å; F345-I349 PolarHBondContact O-N 3.11Å; F345-Y358 HydrophobicContact CE1-CD2 4.13Å; F345-Y358 HydrophobicContact CE1-CE2 4.3Å; F345-Y358 HydrophobicContact CZ-CD2 4.17Å; F345-Y358 AromaticContact CZ-CE2 3.89Å; F345-Y358 HydrophobicContact CZ-CE2 3.89Å; F345-I459 HydrophobicContact CB-CG2 4.07Å; F345-I459 HydrophobicContact CD1-CD1 4.2Å; F345-I459 HydrophobicContact CD1-CG1 4.33Å; F345-I459 HydrophobicContact CD1-CG2 3.61Å; F345-I459 HydrophobicContact CE1-CD1 3.92Å; F345-I459 HydrophobicContact CE1-CG1 4.47Å; F345-I459 HydrophobicContact CE1-CG2 4.37Å; F345-I459 HydrophobicContact CG-CG2 4.07Å; F345-L467 HydrophobicContact CB-CD1 4.32Å; F345-L467 HydrophobicContact CD1-CD2 4.23Å; F345-L467 HydrophobicContact CD2-CB 3.84Å; F345-L467 HydrophobicContact CD2-CD1 4.37Å; F345-L467 HydrophobicContact CD2-CD2 3.79Å; F345-L467 HydrophobicContact CD2-CG 4.19Å; F345-L467 HydrophobicContact CE1-CD2 4.19Å; F345-L467 HydrophobicContact CE2-CB 4.08Å; F345-L467 HydrophobicContact CE2-CD2 3.76Å; F345-L467 HydrophobicContact CE2-CG 4.46Å; F345-L467 HydrophobicContact CG-CD1 4.36Å; F345-L467 HydrophobicContact CG-CD2 4.02Å; F345-L467 HydrophobicContact CZ-CD2 3.96Å; F345-Y468 WeakPolarHBondContact CA-OH 3.06Å; F345-I577 HydrophobicContact CE1-CD1 4.35Å; F345-I577 HydrophobicContact CE2-CG2 4.04Å; F345-I577 HydrophobicContact CZ-CD1 4.28Å; F345-I577 HydrophobicContact CZ-CG1 4.38Å; F345-I577 HydrophobicContact CZ-CG2 3.66Å
346	I	84.6	Confident	82.8	Confident	18 Å²	18	44.4 Å²	44.4	9%	0.092	22%	0.22	C	C	.	.	H	α-helix	trans	-57	-45.8	178.3	-70.2	169	0	0	0	110.8	A342 Y343 S348 I349 L355 F455 I456	A342-I346 VanDerWaalsContact O-CG1 3.29Å; A342-I346 WeakPolarHBondContact O-CG1 3.26Å; A342-I346 PolarHBondContact O-N 3.35Å; Y343-I346 PolarHBondContact O-N 3.21Å; I346-S348 VanDerWaalsContact C-N 3.26Å; I346-S348 PolarHBondContact O-N 3.26Å; I346-I349 PolarHBondContact O-N 2.86Å; I346-L355 HydrophobicContact CB-CD1 4.43Å; I346-L355 HydrophobicContact CG1-CD1 4.22Å; I346-L355 HydrophobicContact CG2-CD1 4.07Å; I346-L355 HydrophobicContact CG2-CD2 4.11Å; I346-F455 HydrophobicContact CD1-CD1 4.21Å; I346-F455 HydrophobicContact CD1-CE1 3.8Å; I346-F455 HydrophobicContact CG1-CE1 3.82Å; I346-F455 HydrophobicContact CG1-CZ 4.32Å; I346-I456 HydrophobicContact CD1-CG1 3.97Å
347	N	80.9	Confident	84.4	Confident	41 Å²	41	37.6 Å²	37.6	22%	0.219	19%	0.19	C	C	.	.	H	α-helix	trans	-70.9	-20.1	178.8	-72.4	-20.7	0	0	0	114	Y343 F345 I349	Y343-N347 WeakPolarHBondContact CD1-ND2 3.39Å; Y343-N347 WeakPolarHBondContact CE1-ND2 3.39Å; Y343-N347 WeakPolarHBondContact CE2-ND2 3.42Å; Y343-N347 WeakPolarHBondContact O-CB 3.35Å; Y343-N347 PolarHBondContact O-N 3.32Å; Y343-N347 PolarHBondContact OH-ND2 2.92Å; F345-N347 VanDerWaalsContact C-N 3.31Å; F345-N347 PolarHBondContact O-N 2.78Å; N347-I349 VanDerWaalsContact C-N 3.25Å
348	S	80.2	Confident	85.6	Confident	39 Å²	39	35.6 Å²	35.6	27%	0.273	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-10.2	175.4	75.6	0	0	0	0	113.5	N344 F345 I346	N344-S348 VanDerWaalsContact O-CB 3.3Å; N344-S348 WeakPolarHBondContact O-CB 3.34Å; N344-S348 PolarHBondContact O-N 3.45Å; F345-S348 WeakPolarHBondContact O-CB 3.33Å; F345-S348 PolarHBondContact O-N 2.98Å; F345-S348 PolarHBondContact O-OG 3.17Å; I346-S348 VanDerWaalsContact C-N 3.26Å; I346-S348 PolarHBondContact O-N 3.26Å
349	I	85.3	Confident	86.3	Confident	9 Å²	9	33 Å²	33	5%	0.046	17%	0.165	C	C	.	.			trans	-94.5	105.6	179.4	-61.5	163.9	0	0	0	109.2	F345 I346 N347 N351 E354 L355 Y358	F345-I349 HydrophobicContact CD1-CD1 4.1Å; F345-I349 HydrophobicContact CE1-CD1 3.59Å; F345-I349 HydrophobicContact CE2-CD1 4.36Å; F345-I349 HydrophobicContact CZ-CD1 3.74Å; F345-I349 PolarHBondContact O-N 3.11Å; I346-I349 PolarHBondContact O-N 2.86Å; N347-I349 VanDerWaalsContact C-N 3.25Å; I349-N351 WeakPolarHBondContact CG2-O 3.48Å; I349-E354 HydrophobicContact CG2-CB 3.99Å; I349-E354 HydrophobicContact CG2-CG 4.23Å; I349-L355 HydrophobicContact CD1-CD1 3.87Å; I349-L355 HydrophobicContact CG2-CB 4.14Å; I349-Y358 HydrophobicContact CD1-CD2 3.72Å; I349-Y358 HydrophobicContact CD1-CE2 3.62Å
350	E	83.9	Confident	87.2	Confident	177 Å²	177	32.3 Å²	32.3	83%	0.827	16%	0.161	S	C	*	.			trans	-74.7	-33.2	176.1	-64.3	178.6	179.1	0	0	112.6	L352	E350-L352 PolarHBondContact O-N 3.45Å
351	N	89.7	Confident	87.9	Confident	48 Å²	48	31 Å²	31	26%	0.257	15%	0.154	S	C	.	.			trans	-83.8	101.5	-177.9	-175.5	-0.5	0	0	0	110.9	I349 S353 E354 L355	I349-N351 WeakPolarHBondContact CG2-O 3.48Å; N351-S353 PolarHBondContact O-N 3.43Å; N351-S353 VanDerWaalsContact O-N 3.15Å; N351-S353 WeakPolarHBondContact OD1-CB 3.32Å; N351-S353 PolarHBondContact OD1-N 3.02Å; N351-S353 VanDerWaalsContact OD1-N 3.11Å; N351-E354 HydrophobicContact CB-CB 4.04Å; N351-E354 WeakPolarHBondContact O-CA 3.35Å; N351-E354 VanDerWaalsContact O-CB 3.26Å; N351-E354 WeakPolarHBondContact O-CB 3.34Å; N351-E354 PolarHBondContact O-N 3.4Å; N351-L355 PolarHBondContact O-N 3.34Å
352	L	92.7	Very high	88.3	Confident	15 Å²	15	30.9 Å²	30.9	8%	0.079	16%	0.156	C	C	.	.	H	α-helix	trans	-59	-27.2	179	-66.3	-179.4	0	0	0	113.8	P14 L63 E78 E350 E354 L355 Y356	P14-L352 HydrophobicContact CB-CD2 4.14Å; P14-L352 HydrophobicContact CG-CD2 3.78Å; L63-L352 HydrophobicContact CD1-CB 3.86Å; L63-L352 HydrophobicContact CD2-CB 3.63Å; L63-L352 HydrophobicContact CG-CB 4.42Å; E78-L352 HydrophobicContact CB-CD1 3.78Å; E78-L352 HydrophobicContact CG-CD1 3.62Å; E350-L352 PolarHBondContact O-N 3.45Å; L352-E354 VanDerWaalsContact C-N 3.32Å; L352-L355 HydrophobicContact CD2-CD2 4.27Å; L352-L355 PolarHBondContact O-N 3.06Å; L352-Y356 WeakPolarHBondContact O-CB 3.48Å; L352-Y356 PolarHBondContact O-N 3.12Å
353	S	93	Very high	88.5	Confident	27 Å²	27	33.3 Å²	33.3	19%	0.189	18%	0.181	C	C	.	.	H	α-helix	trans	-67.6	-33	173.6	-57.5	0	0	0	0	112	N351 Y357 F608	N351-S353 PolarHBondContact O-N 3.43Å; N351-S353 VanDerWaalsContact O-N 3.15Å; N351-S353 WeakPolarHBondContact OD1-CB 3.32Å; N351-S353 PolarHBondContact OD1-N 3.02Å; N351-S353 VanDerWaalsContact OD1-N 3.11Å; S353-Y357 WeakPolarHBondContact O-CB 3.45Å; S353-Y357 PolarHBondContact O-N 3.34Å; S353-F608 VanDerWaalsContact C-CE2 3.49Å; S353-F608 VanDerWaalsContact O-CE2 3.29Å; S353-F608 WeakPolarHBondContact O-CE2 3.41Å
354	E	93.5	Very high	88.8	Confident	10 Å²	10	30.7 Å²	30.7	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-68.7	-42.7	173.8	-175.3	-177.5	157.3	0	0	110.1	I349 N351 L352 Y356 Y357 Y358 T580 R581 F608	I349-E354 HydrophobicContact CG2-CB 3.99Å; I349-E354 HydrophobicContact CG2-CG 4.23Å; N351-E354 HydrophobicContact CB-CB 4.04Å; N351-E354 WeakPolarHBondContact O-CA 3.35Å; N351-E354 VanDerWaalsContact O-CB 3.26Å; N351-E354 WeakPolarHBondContact O-CB 3.34Å; N351-E354 PolarHBondContact O-N 3.4Å; L352-E354 VanDerWaalsContact C-N 3.32Å; E354-Y356 PolarHBondContact O-N 3.34Å; E354-Y357 WeakPolarHBondContact O-CB 3.2Å; E354-Y357 PolarHBondContact O-N 3.41Å; E354-Y358 HydrophobicContact CG-CD2 4.36Å; E354-Y358 HydrophobicContact CG-CE1 4.41Å; E354-Y358 HydrophobicContact CG-CE2 3.58Å; E354-Y358 WeakPolarHBondContact O-CD2 3.27Å; E354-Y358 PolarHBondContact O-N 2.86Å; E354-Y358 WeakPolarHBondContact OE1-CE2 3.22Å; E354-Y358 PolarHBondContact OE1-OH 2.82Å; E354-T580 HydrophobicContact CG-CG2 4.14Å; E354-R581 WeakPolarHBondContact OE1-CD 3.43Å; E354-R581 IonicContact OE1-NH1 3.73Å; E354-R581 PolarHBondContact OE1-NH1 3.17Å; E354-R581 IonicContact OE2-NH1 3.8Å; E354-F608 HydrophobicContact CB-CD1 4.44Å; E354-F608 HydrophobicContact CB-CE1 3.53Å; E354-F608 HydrophobicContact CB-CE2 4.43Å; E354-F608 HydrophobicContact CB-CZ 3.54Å; E354-F608 HydrophobicContact CG-CD1 4.31Å; E354-F608 HydrophobicContact CG-CE1 3.79Å; E354-F608 HydrophobicContact CG-CZ 4.28Å
355	L	92.8	Very high	89.1	Confident	2 Å²	2	36.8 Å²	36.8	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-42.6	176.3	-171.1	66.3	0	0	0	111.9	F13 P14 I15 I346 I349 N351 L352 Y357 Y358 W359 F455	F13-L355 HydrophobicContact CE2-CD1 4.49Å; F13-L355 HydrophobicContact CE2-CD2 3.92Å; F13-L355 HydrophobicContact CE2-CG 4.03Å; F13-L355 HydrophobicContact CZ-CD2 4.47Å; F13-L355 HydrophobicContact CZ-CG 4.31Å; P14-L355 HydrophobicContact CG-CD2 3.84Å; I15-L355 HydrophobicContact CD1-CB 4.16Å; I15-L355 HydrophobicContact CD1-CD2 4.07Å; I15-L355 HydrophobicContact CD1-CG 4.08Å; I346-L355 HydrophobicContact CB-CD1 4.43Å; I346-L355 HydrophobicContact CG1-CD1 4.22Å; I346-L355 HydrophobicContact CG2-CD1 4.07Å; I346-L355 HydrophobicContact CG2-CD2 4.11Å; I349-L355 HydrophobicContact CD1-CD1 3.87Å; I349-L355 HydrophobicContact CG2-CB 4.14Å; N351-L355 PolarHBondContact O-N 3.34Å; L352-L355 HydrophobicContact CD2-CD2 4.27Å; L352-L355 PolarHBondContact O-N 3.06Å; L355-Y357 VanDerWaalsContact C-N 3.33Å; L355-Y357 PolarHBondContact O-N 3.11Å; L355-Y358 PolarHBondContact O-N 3.33Å; L355-W359 PolarHBondContact O-N 3.46Å; L355-F455 HydrophobicContact CD1-CE1 3.73Å; L355-F455 HydrophobicContact CD1-CZ 3.82Å
356	Y	94.9	Very high	89	Confident	9 Å²	9	37.4 Å²	37.4	4%	0.035	21%	0.205	C	C	.	.	H	α-helix	trans	-61.1	-40.9	173.2	175.3	-116.8	0	0	0	112.1	I15 D64 V76 L352 E354 W359 M360 L450	I15-Y356 HydrophobicContact CG2-CD2 4.46Å; D64-Y356 HydrophobicContact CB-CD1 4.06Å; D64-Y356 HydrophobicContact CB-CE1 3.49Å; D64-Y356 VanDerWaalsContact CB-CE1 3.49Å; D64-Y356 WeakPolarHBondContact OD2-CE1 3.3Å; D64-Y356 PolarHBondContact OD2-OH 3.33Å; V76-Y356 HydrophobicContact CB-CE2 4.34Å; V76-Y356 HydrophobicContact CG1-CD2 3.74Å; V76-Y356 HydrophobicContact CG1-CE2 3.72Å; V76-Y356 HydrophobicContact CG1-CG 4.19Å; V76-Y356 HydrophobicContact CG2-CE2 3.92Å; L352-Y356 WeakPolarHBondContact O-CB 3.48Å; L352-Y356 PolarHBondContact O-N 3.12Å; E354-Y356 PolarHBondContact O-N 3.34Å; Y356-W359 AromaticContact CD2-CE3 3.99Å; Y356-W359 HydrophobicContact CD2-CE3 3.99Å; Y356-W359 AromaticContact CE2-CE3 3.76Å; Y356-W359 HydrophobicContact CE2-CE3 3.76Å; Y356-W359 AromaticContact CE2-CZ3 3.88Å; Y356-W359 HydrophobicContact CE2-CZ3 3.88Å; Y356-W359 WeakPolarHBondContact O-CB 3.48Å; Y356-W359 PolarHBondContact O-N 2.82Å; Y356-M360 HydrophobicContact CD1-CE 3.7Å; Y356-M360 HydrophobicContact CD1-SD 4.29Å; Y356-M360 HydrophobicContact CD2-CG 4.43Å; Y356-M360 HydrophobicContact CE1-CE 3.39Å; Y356-M360 HydrophobicContact CE1-CG 4.14Å; Y356-M360 HydrophobicContact CE1-SD 3.49Å; Y356-M360 WeakPolarHBondContact CE1-SD 3.33Å; Y356-M360 HydrophobicContact CE2-CG 3.94Å; Y356-M360 HydrophobicContact CE2-SD 4.25Å; Y356-M360 WeakPolarHBondContact O-CG 3.16Å; Y356-M360 PolarHBondContact O-N 2.79Å; Y356-M360 PolarHBondContact OH-SD 3.37Å; Y356-L450 HydrophobicContact CD2-CD1 4Å; Y356-L450 HydrophobicContact CE2-CD1 4.08Å
357	Y	94.7	Very high	88.5	Confident	23 Å²	23	41.1 Å²	41.1	9%	0.09	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-46.8	176.1	174.1	-113.5	0	0	0	112.2	S353 E354 L355 W359 M360 L361 Q576 F608	S353-Y357 WeakPolarHBondContact O-CB 3.45Å; S353-Y357 PolarHBondContact O-N 3.34Å; E354-Y357 WeakPolarHBondContact O-CB 3.2Å; E354-Y357 PolarHBondContact O-N 3.41Å; L355-Y357 VanDerWaalsContact C-N 3.33Å; L355-Y357 PolarHBondContact O-N 3.11Å; Y357-W359 VanDerWaalsContact C-N 3.32Å; Y357-W359 PolarHBondContact O-N 3.14Å; Y357-M360 HydrophobicContact CD2-CE 4.18Å; Y357-M360 WeakPolarHBondContact O-CB 3.26Å; Y357-M360 PolarHBondContact O-N 2.74Å; Y357-L361 HydrophobicContact CD1-CD1 4.23Å; Y357-L361 HydrophobicContact CE1-CD1 3.71Å; Y357-L361 HydrophobicContact CE1-CG 4.49Å; Y357-L361 HydrophobicContact CE2-CD1 4.34Å; Y357-L361 HydrophobicContact CE2-CD2 4.33Å; Y357-L361 HydrophobicContact CE2-CG 4.29Å; Y357-L361 WeakPolarHBondContact O-CG 3.42Å; Y357-L361 PolarHBondContact O-N 2.99Å; Y357-L361 VanDerWaalsContact O-N 3.15Å; Y357-Q576 HydrophobicContact CE1-CB 4.24Å; Y357-Q576 PolarHBondContact OH-OE1 3.23Å; Y357-Q576 VanDerWaalsContact OH-OE1 3.13Å; Y357-F608 HydrophobicContact CD1-CB 3.54Å; Y357-F608 HydrophobicContact CD1-CD2 4.12Å; Y357-F608 AromaticContact CD1-CG 3.82Å; Y357-F608 HydrophobicContact CD1-CG 3.82Å; Y357-F608 HydrophobicContact CD2-CB 4.17Å; Y357-F608 HydrophobicContact CD2-CD2 4.35Å; Y357-F608 HydrophobicContact CE1-CB 3.58Å; Y357-F608 HydrophobicContact CE1-CG 4.36Å; Y357-F608 HydrophobicContact CE2-CB 4.24Å; Y357-F608 HydrophobicContact CG-CB 3.84Å; Y357-F608 AromaticContact CG-CD2 3.78Å; Y357-F608 HydrophobicContact CG-CD2 3.78Å; Y357-F608 AromaticContact CG-CG 3.96Å; Y357-F608 HydrophobicContact CG-CG 3.96Å
358	Y	93.6	Very high	87.7	Confident	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.1	-37.5	175.8	-58.4	-33.8	0	0	0	112.7	F345 I349 E354 L355 M360 L361 T362 I577 T580	F345-Y358 HydrophobicContact CE1-CD2 4.13Å; F345-Y358 HydrophobicContact CE1-CE2 4.3Å; F345-Y358 HydrophobicContact CZ-CD2 4.17Å; F345-Y358 AromaticContact CZ-CE2 3.89Å; F345-Y358 HydrophobicContact CZ-CE2 3.89Å; I349-Y358 HydrophobicContact CD1-CD2 3.72Å; I349-Y358 HydrophobicContact CD1-CE2 3.62Å; E354-Y358 HydrophobicContact CG-CD2 4.36Å; E354-Y358 HydrophobicContact CG-CE1 4.41Å; E354-Y358 HydrophobicContact CG-CE2 3.58Å; E354-Y358 WeakPolarHBondContact O-CD2 3.27Å; E354-Y358 PolarHBondContact O-N 2.86Å; E354-Y358 WeakPolarHBondContact OE1-CE2 3.22Å; E354-Y358 PolarHBondContact OE1-OH 2.82Å; L355-Y358 PolarHBondContact O-N 3.33Å; Y358-M360 VanDerWaalsContact C-N 3.34Å; Y358-M360 PolarHBondContact O-N 3.17Å; Y358-L361 HydrophobicContact CD1-CD1 4.33Å; Y358-L361 PolarHBondContact O-N 3.15Å; Y358-T362 PolarHBondContact O-N 2.81Å; Y358-I577 HydrophobicContact CD1-CD1 4.49Å; Y358-I577 HydrophobicContact CD1-CG1 3.54Å; Y358-I577 HydrophobicContact CD2-CG1 4.25Å; Y358-I577 HydrophobicContact CE1-CB 4.2Å; Y358-I577 HydrophobicContact CE1-CG1 3.55Å; Y358-I577 HydrophobicContact CE2-CG1 4.25Å; Y358-I577 HydrophobicContact CG-CD1 4.48Å; Y358-I577 HydrophobicContact CG-CG1 3.92Å; Y358-T580 HydrophobicContact CE1-CG2 4.42Å; Y358-T580 VanDerWaalsContact OH-CB 3.3Å; Y358-T580 WeakPolarHBondContact OH-CB 3.48Å; Y358-T580 VanDerWaalsContact OH-CG2 3.24Å; Y358-T580 WeakPolarHBondContact OH-CG2 3.5Å
359	W	93.7	Very high	86.9	Confident	6 Å²	6	41.6 Å²	41.6	2%	0.023	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-44.2	173.7	176.7	86.9	0	0	0	112.1	F13 L355 Y356 Y357 L361 T362 G364 I369 L450 P451	F13-W359 AromaticContact CE1-CD1 3.86Å; F13-W359 HydrophobicContact CE1-CG 4.19Å; F13-W359 HydrophobicContact CZ-CB 4.06Å; F13-W359 AromaticContact CZ-CD1 3.89Å; F13-W359 HydrophobicContact CZ-CG 4.12Å; L355-W359 PolarHBondContact O-N 3.46Å; Y356-W359 AromaticContact CD2-CE3 3.99Å; Y356-W359 HydrophobicContact CD2-CE3 3.99Å; Y356-W359 AromaticContact CE2-CE3 3.76Å; Y356-W359 HydrophobicContact CE2-CE3 3.76Å; Y356-W359 AromaticContact CE2-CZ3 3.88Å; Y356-W359 HydrophobicContact CE2-CZ3 3.88Å; Y356-W359 WeakPolarHBondContact O-CB 3.48Å; Y356-W359 PolarHBondContact O-N 2.82Å; Y357-W359 VanDerWaalsContact C-N 3.32Å; Y357-W359 PolarHBondContact O-N 3.14Å; W359-L361 VanDerWaalsContact C-N 3.34Å; W359-L361 PolarHBondContact O-N 3.49Å; W359-T362 PolarHBondContact O-N 3.08Å; W359-T362 PolarHBondContact O-OG1 2.62Å; W359-G364 VanDerWaalsContact CH2-CA 3.42Å; W359-G364 VanDerWaalsContact CZ2-CA 3.49Å; W359-G364 VanDerWaalsContact CZ3-C 3.42Å; W359-G364 PolarHBondContact O-N 2.78Å; W359-I369 HydrophobicContact CH2-CD1 4.48Å; W359-L450 HydrophobicContact CD2-CD1 4.06Å; W359-L450 HydrophobicContact CE3-CD1 4.02Å; W359-L450 HydrophobicContact CH2-CD1 4.14Å; W359-L450 HydrophobicContact CH2-CD2 4.11Å; W359-L450 HydrophobicContact CZ2-CB 4.07Å; W359-L450 HydrophobicContact CZ2-CD1 4.19Å; W359-L450 HydrophobicContact CZ2-CD2 4.26Å; W359-L450 HydrophobicContact CZ2-CG 4.42Å; W359-L450 HydrophobicContact CZ3-CD1 4.07Å; W359-P451 HydrophobicContact CZ2-CG 4.33Å; W359-P451 PolarHBondContact NE1-O 3.11Å
360	M	93.6	Very high	85.5	Confident	67 Å²	67	44.3 Å²	44.3	33%	0.33	24%	0.244	S	C	.	.	H	α-helix	trans	-60.5	-42.4	176.2	-72.1	-169.8	-71	0	0	112.3	Y356 Y357 Y358 T362 G363 G364	Y356-M360 HydrophobicContact CD1-CE 3.7Å; Y356-M360 HydrophobicContact CD1-SD 4.29Å; Y356-M360 HydrophobicContact CD2-CG 4.43Å; Y356-M360 HydrophobicContact CE1-CE 3.39Å; Y356-M360 HydrophobicContact CE1-CG 4.14Å; Y356-M360 HydrophobicContact CE1-SD 3.49Å; Y356-M360 WeakPolarHBondContact CE1-SD 3.33Å; Y356-M360 HydrophobicContact CE2-CG 3.94Å; Y356-M360 HydrophobicContact CE2-SD 4.25Å; Y356-M360 WeakPolarHBondContact O-CG 3.16Å; Y356-M360 PolarHBondContact O-N 2.79Å; Y356-M360 PolarHBondContact OH-SD 3.37Å; Y357-M360 HydrophobicContact CD2-CE 4.18Å; Y357-M360 WeakPolarHBondContact O-CB 3.26Å; Y357-M360 PolarHBondContact O-N 2.74Å; Y358-M360 VanDerWaalsContact C-N 3.34Å; Y358-M360 PolarHBondContact O-N 3.17Å; M360-T362 PolarHBondContact O-N 2.84Å; M360-G363 PolarHBondContact O-N 2.97Å; M360-G364 PolarHBondContact O-N 3.23Å
361	L	91.9	Very high	83.7	Confident	30 Å²	30	41.9 Å²	41.9	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-61.3	-30.1	178.6	-67.7	173.9	0	0	0	112.6	Y357 Y358 W359 G363 E570 V573 Q576	Y357-L361 HydrophobicContact CD1-CD1 4.23Å; Y357-L361 HydrophobicContact CE1-CD1 3.71Å; Y357-L361 HydrophobicContact CE1-CG 4.49Å; Y357-L361 HydrophobicContact CE2-CD1 4.34Å; Y357-L361 HydrophobicContact CE2-CD2 4.33Å; Y357-L361 HydrophobicContact CE2-CG 4.29Å; Y357-L361 WeakPolarHBondContact O-CG 3.42Å; Y357-L361 PolarHBondContact O-N 2.99Å; Y357-L361 VanDerWaalsContact O-N 3.15Å; Y358-L361 HydrophobicContact CD1-CD1 4.33Å; Y358-L361 PolarHBondContact O-N 3.15Å; W359-L361 VanDerWaalsContact C-N 3.34Å; W359-L361 PolarHBondContact O-N 3.49Å; L361-G363 PolarHBondContact O-N 2.73Å; L361-G363 VanDerWaalsContact O-N 3.13Å; L361-E570 WeakPolarHBondContact CD2-O 3.2Å; L361-V573 HydrophobicContact CB-CB 4.48Å; L361-V573 HydrophobicContact CB-CG2 3.87Å; L361-V573 WeakPolarHBondContact O-CG2 3.43Å; L361-Q576 HydrophobicContact CD1-CB 3.41Å; L361-Q576 VanDerWaalsContact CD1-CB 3.41Å; L361-Q576 HydrophobicContact CD1-CG 3.87Å; L361-Q576 HydrophobicContact CD2-CG 4.36Å
362	T	90.4	Very high	81	Confident	28 Å²	28	42.4 Å²	42.4	17%	0.172	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	12.4	175.4	62.2	0	0	0	0	114.6	Y358 W359 M360 F455 R458 V573	Y358-T362 PolarHBondContact O-N 2.81Å; W359-T362 PolarHBondContact O-N 3.08Å; W359-T362 PolarHBondContact O-OG1 2.62Å; M360-T362 PolarHBondContact O-N 2.84Å; T362-F455 HydrophobicContact CG2-CD2 3.68Å; T362-F455 HydrophobicContact CG2-CE2 4.45Å; T362-R458 HydrophobicContact CG2-CB 3.85Å; T362-R458 HydrophobicContact CG2-CG 3.86Å; T362-V573 HydrophobicContact CG2-CG1 3.88Å; T362-V573 HydrophobicContact CG2-CG2 3.84Å
363	G	86.3	Confident	78.2	Confident	52 Å²	52	48.1 Å²	48.1	54%	0.536	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	10.4	179.9	0	0	0	0	0	114	M360 L361 K365	M360-G363 PolarHBondContact O-N 2.97Å; L361-G363 PolarHBondContact O-N 2.73Å; L361-G363 VanDerWaalsContact O-N 3.13Å; G363-K365 PolarHBondContact O-N 3.18Å
364	G	85.5	Confident	75.3	Confident	18 Å²	18	51.2 Å²	51.2	19%	0.186	29%	0.291	C	S	.	.			trans	-59.6	122.8	174.6	0	0	0	0	0	111.7	W359 M360	W359-G364 VanDerWaalsContact CH2-CA 3.42Å; W359-G364 VanDerWaalsContact CZ2-CA 3.49Å; W359-G364 VanDerWaalsContact CZ3-C 3.42Å; W359-G364 PolarHBondContact O-N 2.78Å; M360-G364 PolarHBondContact O-N 3.23Å
365	K	85.1	Confident	72.1	Confident	153 Å²	153	56 Å²	56	67%	0.665	32%	0.317	S	S	*	.			trans	-128.4	116.9	178.3	-67.5	-179.8	-175.7	179	0	110.6	G363 H367 A368	G363-K365 PolarHBondContact O-N 3.18Å; K365-H367 PolarHBondContact O-N 3.28Å; K365-H367 VanDerWaalsContact O-N 3.17Å; K365-A368 PolarHBondContact O-N 3.14Å
366	T	81.5	Confident	69	Low	13 Å²	13	60.3 Å²	60.3	8%	0.08	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-56.9	-32.2	177.6	58.3	0	0	0	0	112.7	K19 E68 V76 A368	K19-T366 VanDerWaalsContact CE-O 3.25Å; K19-T366 WeakPolarHBondContact CE-O 3.25Å; K19-T366 PolarHBondContact NZ-O 3.32Å; E68-T366 PolarHBondContact OE1-OG1 2.71Å; E68-T366 VanDerWaalsContact OE1-OG1 3.13Å; V76-T366 HydrophobicContact CG2-CG2 4.02Å; T366-A368 VanDerWaalsContact C-N 3.31Å; T366-A368 PolarHBondContact O-N 3.27Å
367	H	75	Confident	65.9	Low	96 Å²	96	69.3 Å²	69.3	44%	0.444	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-62	-36.4	-178.1	-173.4	64.5	0	0	0	113.1	K19 E68 K365 I369	K19-H367 PolarHBondContact NZ-O 3.01Å; K19-H367 VanDerWaalsContact NZ-O 3.11Å; E68-H367 WeakPolarHBondContact OE1-CA 3.38Å; E68-H367 PolarHBondContact OE1-N 3.39Å; E68-H367 IonicContact OE2-CE1 3.63Å; E68-H367 IonicContact OE2-CG 3.19Å; E68-H367 IonicContact OE2-ND1 2.64Å; E68-H367 PolarHBondContact OE2-ND1 3.39Å; K365-H367 PolarHBondContact O-N 3.28Å; K365-H367 VanDerWaalsContact O-N 3.17Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.22Å
368	A	64.2	Low	62.7	Low	61 Å²	61	72 Å²	72	50%	0.504	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-73.3	-20.3	-171.5	0	0	0	0	0	114.4	K365 T366 L370 K371	K365-A368 PolarHBondContact O-N 3.14Å; T366-A368 VanDerWaalsContact C-N 3.31Å; T366-A368 PolarHBondContact O-N 3.27Å; A368-L370 VanDerWaalsContact C-N 3.29Å; A368-L370 PolarHBondContact O-N 2.95Å; A368-K371 PolarHBondContact O-N 3.15Å
369	I	62.7	Low	59.6	Low	30 Å²	30	78.9 Å²	78.9	15%	0.154	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-66.8	-26.2	-164.7	-61.8	173.9	0	0	0	113.2	V17 W359 H367 T448 L450	V17-I369 HydrophobicContact CG1-CD1 3.98Å; V17-I369 HydrophobicContact CG1-CG2 4.45Å; W359-I369 HydrophobicContact CH2-CD1 4.48Å; H367-I369 VanDerWaalsContact C-N 3.33Å; H367-I369 PolarHBondContact O-N 3.22Å; I369-T448 HydrophobicContact CG2-CG2 3.79Å; I369-L450 HydrophobicContact CD1-CD2 3.23Å
370	L	55.8	Low	56.5	Low	65 Å²	65	86 Å²	86	34%	0.34	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-99.3	-15.8	-178.1	-95.4	153.1	0	0	0	115.4	K19 A368 G372 H373 T374	K19-L370 HydrophobicContact CB-CD1 3.83Å; K19-L370 HydrophobicContact CD-CD1 3.43Å; K19-L370 VanDerWaalsContact CD-CD1 3.43Å; K19-L370 HydrophobicContact CG-CD1 3.57Å; A368-L370 VanDerWaalsContact C-N 3.29Å; A368-L370 PolarHBondContact O-N 2.95Å; L370-G372 PolarHBondContact O-N 3.31Å; L370-H373 HydrophobicContact CD2-CB 4.33Å; L370-H373 PolarHBondContact O-N 3.45Å; L370-T374 PolarHBondContact O-N 3.34Å
371	K	47.9	Very low	53.5	Low	127 Å²	127	89.4 Å²	89.4	55%	0.552	50%	0.501	S	S	*	.	H	α-helix	trans	-59.3	-31.9	177.8	-77.5	-171.3	176.5	-174.5	0	111.7	A368 H373 T374 D375	A368-K371 PolarHBondContact O-N 3.15Å; K371-H373 VanDerWaalsContact C-N 3.29Å; K371-H373 PolarHBondContact O-N 2.84Å; K371-T374 PolarHBondContact O-OG1 3.48Å; K371-D375 PolarHBondContact O-N 2.85Å
372	G	33	Very low	50.3	Low	59 Å²	59	93.4 Å²	93.4	61%	0.608	52%	0.522	S	S	*	.	H	α-helix	trans	-67.1	-21.8	175.3	0	0	0	0	0	115.4	L370	L370-G372 PolarHBondContact O-N 3.31Å
373	H	33.9	Very low	47.3	Very low	134 Å²	134	101 Å²	101	62%	0.62	55%	0.549	S	S	*	.	H	α-helix	trans	-98.6	-20	-179.1	-78.8	-48.7	0	0	0	113.9	L370 K371 S376	L370-H373 HydrophobicContact CD2-CB 4.33Å; L370-H373 PolarHBondContact O-N 3.45Å; K371-H373 VanDerWaalsContact C-N 3.29Å; K371-H373 PolarHBondContact O-N 2.84Å; H373-S376 PolarHBondContact O-OG 3.3Å
374	T	30.3	Very low	44.6	Very low	92 Å²	92	105.5 Å²	105.5	56%	0.564	56%	0.556	S	S	*	*	H	α-helix	trans	-85.4	-29	173.8	51.4	0	0	0	0	112.9	L370 K371 S376	L370-T374 PolarHBondContact O-N 3.34Å; K371-T374 PolarHBondContact O-OG1 3.48Å; T374-S376 VanDerWaalsContact C-N 3.33Å; T374-S376 PolarHBondContact O-N 3.05Å
375	D	27.7	Very low	41.9	Very low	110 Å²	110	113.5 Å²	113.5	59%	0.588	59%	0.588	S	S	*	*	S	Bend	trans	-84.1	-3.7	-175.3	-68.9	-10.5	0	0	0	114	K371 K377 S378	K371-D375 PolarHBondContact O-N 2.85Å; D375-K377 PolarHBondContact O-N 2.75Å; D375-S378 PolarHBondContact O-OG 2.89Å
376	S	27.5	Very low	39.1	Very low	93 Å²	93	113.2 Å²	113.2	65%	0.65	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	22.2	168	44.9	0	0	0	0	114	H373 T374	H373-S376 PolarHBondContact O-OG 3.3Å; T374-S376 VanDerWaalsContact C-N 3.33Å; T374-S376 PolarHBondContact O-N 3.05Å
377	K	29.1	Very low	36.6	Very low	198 Å²	198	116.1 Å²	116.1	86%	0.861	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	6.5	167.9	-112	-178.4	-179	179.8	0	114.2	D375	D375-K377 PolarHBondContact O-N 2.75Å
378	S	28.7	Very low	34.3	Very low	79 Å²	79	117 Å²	117	55%	0.552	64%	0.644	S	S	*	*	S	Bend	trans	-129	13.1	-177.3	60.7	0	0	0	0	117.3	D375	D375-S378 PolarHBondContact O-OG 2.89Å
379	I	27	Very low	32.7	Very low	146 Å²	146	123.9 Å²	123.9	75%	0.749	66%	0.662	S	S	*	*	S	Bend	trans	-115.7	16.5	178.9	-56.7	-178.8	0	0	0	114
380	I	28.5	Very low	30.9	Very low	156 Å²	156	131.8 Å²	131.8	80%	0.8	70%	0.698	S	S	*	*			trans	-141.5	42	159.8	-41.1	174.1	0	0	0	108.6
381	D	31	Very low	29.8	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	72%	0.722	S	S	*	*				-56.8	85	102.3	-69.1	-20.8	0	0	0	114
382	N	26.1	Very low	28.9	Very low	113 Å²	113	136.6 Å²	136.6	60%	0.604	73%	0.734	S	S	*	*			trans	176.7	100.6	144.4	-90.1	-30.5	0	0	0	107.9
383	Y	26.7	Very low	28.7	Very low	188 Å²	188	141.8 Å²	141.8	74%	0.737	75%	0.746	S	S	*	*				161.3	109.4	111.8	-87.7	-67.4	0	0	0	110.7
384	H	28.5	Very low	28.4	Very low	146 Å²	146	144.7 Å²	144.7	68%	0.676	76%	0.756	S	S	*	*			trans	61.5	91.3	148	-60.2	-51.3	0	0	0	118.7
385	H	29.4	Very low	28.3	Very low	186 Å²	186	149.4 Å²	149.4	86%	0.861	77%	0.772	S	S	*	*				-139.6	96.3	126.8	-98.1	-53.3	0	0	0	111.7
386	N	26	Very low	28.3	Very low	147 Å²	147	153.7 Å²	153.7	79%	0.786	79%	0.785	S	S	*	*			trans	22.2	127.4	140.8	-64.2	-15.7	0	0	0	119.4
387	G	29.2	Very low	28.4	Very low	74 Å²	74	158.9 Å²	158.9	76%	0.763	80%	0.799	S	S	*	*			trans	151.3	79.7	150.8	0	0	0	0	0	114	K389	G387-K389 PolarHBondContact O-N 3.34Å
388	S	26.7	Very low	28.4	Very low	115 Å²	115	154 Å²	154	80%	0.804	80%	0.797	S	S	*	*			trans	-17.3	122.4	159.3	53.5	0	0	0	0	116.4
389	K	31.4	Very low	28.3	Very low	206 Å²	206	157.9 Å²	157.9	90%	0.896	81%	0.81	S	S	*	*			trans	-167.7	100.4	134.2	-104.7	169.2	-175.1	-172	0	109.2	G387	G387-K389 PolarHBondContact O-N 3.34Å
390	Q	25.4	Very low	28.4	Very low	195 Å²	195	159.4 Å²	159.4	91%	0.911	82%	0.818	S	S	*	*			trans	-69.8	123	161.4	-77.5	171.9	-38.9	0	0	107.9
391	E	31.2	Very low	28.3	Very low	180 Å²	180	155.1 Å²	155.1	84%	0.841	81%	0.812	S	S	*	*			trans	-154.2	111.8	154.3	-111.9	164.3	-153.5	0	0	110.1
392	S	30.6	Very low	28.2	Very low	114 Å²	114	153 Å²	153	80%	0.797	81%	0.814	S	S	*	*			trans	37.3	97.3	155.8	58.1	0	0	0	0	119.7
393	I	27.8	Very low	28.3	Very low	167 Å²	167	155.3 Å²	155.3	86%	0.856	83%	0.826	S	S	*	*			trans	-78.5	108.9	157.1	-62.7	166	0	0	0	107.9
394	K	26.8	Very low	28.4	Very low	195 Å²	195	151.7 Å²	151.7	85%	0.848	83%	0.829	S	S	*	*			trans	-177.6	136.4	150	-99.7	164.2	-170.8	-170.4	0	107.5
395	E	28.7	Very low	28.3	Very low	192 Å²	192	152.5 Å²	152.5	90%	0.897	83%	0.832	S	S	*	*			trans	85.4	74.8	-179.5	-55.8	-177	166.9	0	0	116.8
396	K	28.1	Very low	28.2	Very low	199 Å²	199	147.7 Å²	147.7	87%	0.865	82%	0.82	S	S	*	*			trans	-153.5	26.7	151.3	-114	178.8	-166.5	-174.9	0	115	A398	K396-A398 VanDerWaalsContact C-N 3.28Å; K396-A398 PolarHBondContact O-N 3.46Å
397	E	28.6	Very low	28.7	Very low	202 Å²	202	144.9 Å²	144.9	94%	0.944	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	14.3	175.1	-79.5	-173.6	155.9	0	0	114.6
398	A	29.3	Very low	28.8	Very low	97 Å²	97	148.3 Å²	148.3	80%	0.802	81%	0.809	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.6	25.6	-178.7	0	0	0	0	0	114.8	K396	K396-A398 VanDerWaalsContact C-N 3.28Å; K396-A398 PolarHBondContact O-N 3.46Å
399	L	28	Very low	29.2	Very low	160 Å²	160	148.2 Å²	148.2	84%	0.838	80%	0.799	S	S	*	*			trans	-128.2	47.2	175.4	-133.9	92.2	0	0	0	112.7
400	I	27.5	Very low	29.6	Very low	177 Å²	177	144.7 Å²	144.7	91%	0.908	78%	0.784	S	S	*	*			trans	-113.8	75.1	164	-53.3	177.7	0	0	0	106.9
401	G	27.5	Very low	30.4	Very low	66 Å²	66	138.4 Å²	138.4	68%	0.68	76%	0.756	S	S	*	*	S	Bend	trans	-163.2	116.7	177.6	0	0	0	0	0	110
402	A	29.2	Very low	31	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	73%	0.728	S	S	*	*			trans	68.7	80.3	170.4	0	0	0	0	0	117.2
403	N	27.9	Very low	31.6	Very low	162 Å²	162	133.3 Å²	133.3	87%	0.866	72%	0.722	S	S	*	*			trans	-145.7	55.4	147.6	-94.2	-19.1	0	0	0	109.9	Q405	N403-Q405 PolarHBondContact O-N 3.46Å
404	S	28.5	Very low	32.6	Very low	113 Å²	113	126.4 Å²	126.4	79%	0.79	69%	0.685	S	S	*	*			trans	-84.3	65.8	162.9	63.8	0	0	0	0	108.9	S406	S404-S406 PolarHBondContact O-N 3.29Å
405	Q	26.3	Very low	33.5	Very low	162 Å²	162	117.7 Å²	117.7	76%	0.757	65%	0.648	S	S	*	*			trans	-74.9	106.2	159.9	-80.7	-169.6	-15.3	0	0	106.7	N403	N403-Q405 PolarHBondContact O-N 3.46Å
406	S	27.8	Very low	34.6	Very low	85 Å²	85	110.9 Å²	110.9	59%	0.594	63%	0.625	S	S	*	*			trans	-52	121.8	175.7	-52.5	0	0	0	0	109.1	S404 I408	S404-S406 PolarHBondContact O-N 3.29Å; S406-I408 PolarHBondContact O-N 2.94Å
407	P	35.9	Very low	35.4	Very low	89 Å²	89	106.8 Å²	106.8	58%	0.578	61%	0.611	S	S	*	*			trans	-70.3	100.5	179.3	25.2	-27.3	0	0	0	107.8	S25 L409	S25-P407 WeakPolarHBondContact CB-O 3.43Å; S25-P407 PolarHBondContact OG-O 3.33Å; P407-L409 PolarHBondContact O-N 2.93Å
408	I	32.7	Very low	36.1	Very low	146 Å²	146	99.6 Å²	99.6	75%	0.749	58%	0.581	S	S	*	*			trans	-46.8	131.2	164.3	-61.2	169.3	0	0	0	106.8	S406 K410	S406-I408 PolarHBondContact O-N 2.94Å; I408-K410 VanDerWaalsContact C-N 3.3Å; I408-K410 WeakPolarHBondContact O-CG 3.27Å; I408-K410 PolarHBondContact O-N 3.44Å
409	L	34.8	Very low	36.4	Very low	112 Å²	112	102 Å²	102	59%	0.586	58%	0.576	S	S	*	*			trans	-49.7	95.3	176.1	-142.4	150	0	0	0	107.9	P407 I411	P407-L409 PolarHBondContact O-N 2.93Å; L409-I411 PolarHBondContact O-N 2.62Å
410	K	39.2	Very low	36.9	Very low	133 Å²	133	99 Å²	99	58%	0.578	57%	0.568	S	S	*	*			trans	-73.5	102.3	-175.7	-76.8	-172.1	179.6	178.9	0	106.1	I408 P412	I408-K410 VanDerWaalsContact C-N 3.3Å; I408-K410 WeakPolarHBondContact O-CG 3.27Å; I408-K410 PolarHBondContact O-N 3.44Å; K410-P412 VanDerWaalsContact O-CD 3.32Å; K410-P412 WeakPolarHBondContact O-CD 3.49Å; K410-P412 VanDerWaalsContact O-N 3.1Å
411	I	41.7	Very low	37.2	Very low	63 Å²	63	97.8 Å²	97.8	32%	0.323	56%	0.563	S	S	.	*			trans	-50.7	120.2	164.4	-60.2	176.2	0	0	0	105.8	A173 L409 H413 L415 A416	A173-I411 HydrophobicContact CB-CD1 4.07Å; A173-I411 HydrophobicContact CB-CG1 4.21Å; L409-I411 PolarHBondContact O-N 2.62Å; I411-H413 PolarHBondContact O-N 3.16Å; I411-L415 HydrophobicContact CG2-CB 3.7Å; I411-A416 HydrophobicContact CG2-CB 4.48Å
412	P	44.6	Very low	37.4	Very low	39 Å²	39	100.2 Å²	100.2	25%	0.253	57%	0.565	S	S	.	*			trans	-51.4	130.4	177.8	-26.2	32.7	0	0	0	108.9	L155 K410 Y414 L415 A416	L155-P412 HydrophobicContact CD1-CG 4.05Å; L155-P412 HydrophobicContact CD2-CG 4.05Å; K410-P412 VanDerWaalsContact O-CD 3.32Å; K410-P412 WeakPolarHBondContact O-CD 3.49Å; K410-P412 VanDerWaalsContact O-N 3.1Å; P412-Y414 HydrophobicContact CB-CD1 3.75Å; P412-Y414 HydrophobicContact CB-CE1 3.33Å; P412-Y414 HydrophobicContact CB-CE2 4.18Å; P412-Y414 HydrophobicContact CB-CG 4.35Å; P412-Y414 HydrophobicContact CG-CE1 4.28Å; P412-Y414 PolarHBondContact O-N 3.38Å; P412-L415 PolarHBondContact O-N 3.22Å; P412-A416 PolarHBondContact O-N 2.75Å
413	H	42.4	Very low	37.9	Very low	148 Å²	148	103.3 Å²	103.3	69%	0.685	58%	0.575	S	S	*	*	H	α-helix	trans	-50	-29	-171.2	-173.4	-66.8	0	0	0	112.7	I411 A416 I417	I411-H413 PolarHBondContact O-N 3.16Å; H413-A416 PolarHBondContact O-N 3.1Å; H413-I417 VanDerWaalsContact ND1-CD1 3.27Å; H413-I417 WeakPolarHBondContact ND1-CD1 3.3Å; H413-I417 VanDerWaalsContact O-CG1 3.28Å; H413-I417 WeakPolarHBondContact O-CG1 3.27Å; H413-I417 PolarHBondContact O-N 3.24Å; H413-I417 VanDerWaalsContact O-N 3.14Å
414	Y	50.1	Low	38.1	Very low	21 Å²	21	106.6 Å²	106.6	8%	0.082	58%	0.575	C	S	.	*	H	α-helix	trans	-71.5	-29.4	176.7	64	-104.7	0	0	0	115.1	L155 E226 I230 P412	L155-Y414 HydrophobicContact CD1-CE1 4.46Å; L155-Y414 WeakPolarHBondContact CD1-OH 3.47Å; L155-Y414 WeakPolarHBondContact CD2-OH 3.45Å; L155-Y414 WeakPolarHBondContact CG-OH 3.33Å; E226-Y414 HydrophobicContact CB-CD1 3.91Å; E226-Y414 HydrophobicContact CB-CE1 4.12Å; E226-Y414 HydrophobicContact CB-CG 4.4Å; E226-Y414 VanDerWaalsContact OE2-CE1 3.25Å; E226-Y414 WeakPolarHBondContact OE2-CE1 3.29Å; I230-Y414 HydrophobicContact CD1-CD2 3.34Å; I230-Y414 HydrophobicContact CD1-CE2 3.29Å; I230-Y414 HydrophobicContact CD1-CG 4.46Å; P412-Y414 HydrophobicContact CB-CD1 3.75Å; P412-Y414 HydrophobicContact CB-CE1 3.33Å; P412-Y414 HydrophobicContact CB-CE2 4.18Å; P412-Y414 HydrophobicContact CB-CG 4.35Å; P412-Y414 HydrophobicContact CG-CE1 4.28Å; P412-Y414 PolarHBondContact O-N 3.38Å
415	L	45.4	Very low	38.2	Very low	12 Å²	12	105.2 Å²	105.2	6%	0.063	57%	0.571	C	S	.	*	H	α-helix	trans	-72.4	-35	170.9	-72.8	-178.8	0	0	0	110.2	Y170 I230 I411 P412 I417 V418	Y170-L415 HydrophobicContact CD2-CB 4.31Å; Y170-L415 WeakPolarHBondContact CD2-O 3.33Å; Y170-L415 WeakPolarHBondContact CE2-O 3.48Å; I230-L415 HydrophobicContact CD1-CD2 4.32Å; I411-L415 HydrophobicContact CG2-CB 3.7Å; P412-L415 PolarHBondContact O-N 3.22Å; L415-I417 VanDerWaalsContact C-N 3.3Å; L415-I417 PolarHBondContact O-N 2.95Å; L415-V418 PolarHBondContact O-N 2.71Å
416	A	50.6	Low	38.2	Very low	50 Å²	50	104.7 Å²	104.7	41%	0.413	57%	0.571	S	S	.	*	H	α-helix	trans	-66.5	-29	175.7	0	0	0	0	0	113.3	I411 P412 H413 V418	I411-A416 HydrophobicContact CG2-CB 4.48Å; P412-A416 PolarHBondContact O-N 2.75Å; H413-A416 PolarHBondContact O-N 3.1Å; A416-V418 PolarHBondContact O-N 2.96Å
417	I	45.7	Very low	38.3	Very low	112 Å²	112	106 Å²	106	57%	0.574	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-17	178.7	-73.2	163.5	0	0	0	112.7	H413 L415 Q419	H413-I417 VanDerWaalsContact ND1-CD1 3.27Å; H413-I417 WeakPolarHBondContact ND1-CD1 3.3Å; H413-I417 VanDerWaalsContact O-CG1 3.28Å; H413-I417 WeakPolarHBondContact O-CG1 3.27Å; H413-I417 PolarHBondContact O-N 3.24Å; H413-I417 VanDerWaalsContact O-N 3.14Å; L415-I417 VanDerWaalsContact C-N 3.3Å; L415-I417 PolarHBondContact O-N 2.95Å; I417-Q419 PolarHBondContact O-N 3.32Å
418	V	42.3	Very low	38	Very low	51 Å²	51	106 Å²	106	31%	0.309	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	5.8	-177.4	-170.2	0	0	0	0	113.2	Y170 L234 L415 A416 S420	Y170-V418 HydrophobicContact CE2-CB 4.24Å; L234-V418 HydrophobicContact CD1-CG1 4.45Å; L415-V418 PolarHBondContact O-N 2.71Å; A416-V418 PolarHBondContact O-N 2.96Å; V418-S420 PolarHBondContact O-N 3.06Å
419	Q	37.4	Very low	37.9	Very low	149 Å²	149	108 Å²	108	70%	0.696	59%	0.586	S	S	*	*			trans	-68.6	74.4	165.4	-71.6	-170.1	-8.6	0	0	111.9	I417	I417-Q419 PolarHBondContact O-N 3.32Å
420	S	37.3	Very low	37.5	Very low	96 Å²	96	109.1 Å²	109.1	67%	0.671	59%	0.588	S	S	*	*			trans	-77	119.7	163.6	58.2	0	0	0	0	109.1	V418	V418-S420 PolarHBondContact O-N 3.06Å
421	N	34.9	Very low	36.9	Very low	151 Å²	151	111.7 Å²	111.7	81%	0.807	60%	0.602	S	S	*	*			trans	93.3	85.5	172.3	-52.8	-26.5	0	0	0	116.3
422	T	31.9	Very low	36.2	Very low	118 Å²	118	116 Å²	116	72%	0.724	62%	0.615	S	S	*	*				-162.7	119.6	125.5	20.4	0	0	0	0	107.6	R424	T422-R424 PolarHBondContact O-N 3.33Å
423	T	37.7	Very low	35.8	Very low	157 Å²	157	119.1 Å²	119.1	96%	0.963	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	26.9	-178.6	27.6	0	0	0	0	114.8
424	R	32.3	Very low	35.6	Very low	231 Å²	231	121 Å²	121	87%	0.872	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-148.8	28.4	-178.4	-92.4	-170.3	-176.7	172.5	1.1	115.3	T422 I426	T422-R424 PolarHBondContact O-N 3.33Å; R424-I426 PolarHBondContact O-N 2.98Å; R424-I426 VanDerWaalsContact O-N 3.08Å
425	A	30.9	Very low	34.9	Very low	85 Å²	85	122.9 Å²	122.9	70%	0.702	68%	0.675	S	S	*	*			trans	-76.7	96.7	163.6	0	0	0	0	0	109.1	S427	A425-S427 PolarHBondContact O-N 3.25Å
426	I	27.2	Very low	34.5	Very low	150 Å²	150	131.2 Å²	131.2	77%	0.769	71%	0.713	S	S	*	*			trans	-44.9	122.7	171.9	-67.5	163	0	0	0	108.3	R424 S428	R424-I426 PolarHBondContact O-N 2.98Å; R424-I426 VanDerWaalsContact O-N 3.08Å; I426-S428 PolarHBondContact O-N 3.49Å
427	S	29.2	Very low	33.4	Very low	114 Å²	114	134.5 Å²	134.5	80%	0.797	72%	0.722	S	S	*	*			trans	-69.6	67.6	170.8	74.3	0	0	0	0	109.6	A425 K429	A425-S427 PolarHBondContact O-N 3.25Å; S427-K429 PolarHBondContact O-N 2.85Å
428	S	29.4	Very low	32.8	Very low	89 Å²	89	134.1 Å²	134.1	62%	0.622	73%	0.726	S	S	*	*			trans	-73.2	87.9	156.4	53.4	0	0	0	0	105.3	I426 E430	I426-S428 PolarHBondContact O-N 3.49Å; S428-E430 PolarHBondContact O-N 2.74Å
429	K	30.4	Very low	32.4	Very low	187 Å²	187	139.9 Å²	139.9	81%	0.813	75%	0.75	S	S	*	*			trans	-54	92.9	152.1	-81.1	180	174.3	177.7	0	104.8	S427 Q431	S427-K429 PolarHBondContact O-N 2.85Å; K429-Q431 PolarHBondContact O-N 3.36Å
430	E	26	Very low	32.4	Very low	136 Å²	136	137.7 Å²	137.7	64%	0.636	75%	0.749	S	S	*	*			trans	-60.3	101.3	164.5	-75.3	-174.1	152	0	0	105.7	S428 W432	S428-E430 PolarHBondContact O-N 2.74Å; E430-W432 VanDerWaalsContact CB-NE1 3.33Å; E430-W432 PolarHBondContact O-N 3.13Å; E430-W432 PolarHBondContact OE2-NE1 2.6Å
431	Q	26.8	Very low	32.7	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	76%	0.758	S	S	*	*			trans	-70.7	84.6	170.8	-77.3	179.8	-25.9	0	0	106.8	K429	K429-Q431 PolarHBondContact O-N 3.36Å
432	W	28.5	Very low	33.4	Very low	154 Å²	154	141 Å²	141	58%	0.583	75%	0.745	S	S	*	*			trans	-70.2	136.3	168.7	-71.5	90.3	0	0	0	108.8	E430 L434 M437	E430-W432 VanDerWaalsContact CB-NE1 3.33Å; E430-W432 PolarHBondContact O-N 3.13Å; E430-W432 PolarHBondContact OE2-NE1 2.6Å; W432-L434 PolarHBondContact O-N 3.23Å; W432-M437 HydrophobicContact CB-CE 3.96Å; W432-M437 HydrophobicContact CG-CE 4.21Å
433	P	34.4	Very low	34.6	Very low	105 Å²	105	137.7 Å²	137.7	68%	0.682	72%	0.72	S	S	*	*			trans	-58.9	135.2	-178.1	-3.2	8.9	0	0	0	110	G435	P433-G435 PolarHBondContact O-N 3.27Å
434	L	38.4	Very low	35.8	Very low	188 Å²	188	138.3 Å²	138.3	98%	0.984	71%	0.705	S	S	*	*	S	Bend	trans	-63.5	11.5	-178.5	-84.1	152.1	0	0	0	115	W432	W432-L434 PolarHBondContact O-N 3.23Å
435	G	36.7	Very low	37.7	Very low	60 Å²	60	128 Å²	128	62%	0.619	67%	0.666	S	S	*	*	S	Bend	trans	-94.1	108.1	176.7	0	0	0	0	0	110.8	P433	P433-G435 PolarHBondContact O-N 3.27Å
436	E	35.7	Very low	39.9	Very low	186 Å²	186	129.9 Å²	129.9	87%	0.869	66%	0.661	S	S	*	*			trans	52.8	76.7	164.3	-62.4	-177.9	176.6	0	0	115.4	P438	E436-P438 WeakPolarHBondContact O-CD 3.33Å
437	M	28.9	Very low	42.8	Very low	120 Å²	120	123.4 Å²	123.4	59%	0.591	63%	0.628	S	S	*	*			trans	-65.4	108.8	154.7	-85.2	-91.1	161.2	0	0	107.7	W432 Q439	W432-M437 HydrophobicContact CB-CE 3.96Å; W432-M437 HydrophobicContact CG-CE 4.21Å; M437-Q439 PolarHBondContact O-N 3.4Å; M437-Q439 VanDerWaalsContact O-N 3.11Å
438	P	33.5	Very low	45.6	Very low	104 Å²	104	119.5 Å²	119.5	68%	0.675	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-60.8	122.2	171.8	24.3	-31.5	0	0	0	107.6	E436	E436-P438 WeakPolarHBondContact O-CD 3.33Å
439	Q	33.8	Very low	48.5	Very low	172 Å²	172	118.1 Å²	118.1	80%	0.804	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-52.9	129	176.6	-72.8	-173	-14.5	0	0	108.6	M437 R441	M437-Q439 PolarHBondContact O-N 3.4Å; M437-Q439 VanDerWaalsContact O-N 3.11Å; Q439-R441 PolarHBondContact O-N 3.01Å; Q439-R441 VanDerWaalsContact O-N 3.15Å
440	P	37.1	Very low	51.4	Low	103 Å²	103	109.4 Å²	109.4	67%	0.669	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-57.8	124	175.2	22.2	-30	0	0	0	108.4	T442	P440-T442 VanDerWaalsContact C-N 3.26Å; P440-T442 PolarHBondContact O-N 3.48Å
441	R	43.6	Very low	54.3	Low	230 Å²	230	106 Å²	106	87%	0.868	54%	0.54	S	S	*	.			trans	-71.6	82.4	178.6	-66.4	-177.2	-176.1	-175.5	1.7	108.7	Q439 F443	Q439-R441 PolarHBondContact O-N 3.01Å; Q439-R441 VanDerWaalsContact O-N 3.15Å; R441-F443 PolarHBondContact O-N 3.09Å
442	T	49.2	Very low	57.1	Low	87 Å²	87	97.8 Å²	97.8	53%	0.534	50%	0.502	S	S	.	.			trans	-77.6	104.6	171.3	43.7	0	0	0	0	108.7	P440 R444	P440-T442 VanDerWaalsContact C-N 3.26Å; P440-T442 PolarHBondContact O-N 3.48Å; T442-R444 PolarHBondContact O-N 3.27Å
443	F	57.1	Low	59.8	Low	47 Å²	47	95.1 Å²	95.1	21%	0.206	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-79	105.7	179.7	170.1	-103.4	0	0	0	111.6	K19 P21 T154 R441 F445	K19-F443 WeakPolarHBondContact O-CE2 3.25Å; K19-F443 WeakPolarHBondContact O-CZ 3.38Å; P21-F443 HydrophobicContact CG-CB 4.08Å; P21-F443 HydrophobicContact CG-CD1 4.42Å; P21-F443 HydrophobicContact CG-CD2 3.94Å; P21-F443 HydrophobicContact CG-CG 3.84Å; T154-F443 WeakPolarHBondContact CA-O 3.42Å; T154-F443 WeakPolarHBondContact CB-O 3.34Å; T154-F443 WeakPolarHBondContact CG2-O 3.36Å; T154-F443 PolarHBondContact N-O 2.6Å; T154-F443 PolarHBondContact OG1-O 2.75Å; R441-F443 PolarHBondContact O-N 3.09Å; F443-F445 HydrophobicContact CD1-CD1 4.23Å; F443-F445 HydrophobicContact CD1-CE1 4.14Å; F443-F445 AromaticContact CE1-CD1 3.48Å; F443-F445 HydrophobicContact CE1-CD1 3.48Å; F443-F445 VanDerWaalsContact CE1-CD1 3.48Å; F443-F445 AromaticContact CE1-CE1 3.66Å; F443-F445 HydrophobicContact CE1-CE1 3.66Å; F443-F445 HydrophobicContact CE1-CG 4.31Å; F443-F445 HydrophobicContact CZ-CD1 4.34Å
444	R	63.3	Low	62.2	Low	171 Å²	171	94.1 Å²	94.1	65%	0.645	49%	0.49	S	S	*	.			trans	-81.2	127.1	178	-174.3	177.4	177.9	170.2	-0.7	111.6	T154 T442 Q446	T154-R444 VanDerWaalsContact CG2-CA 3.49Å; T154-R444 HydrophobicContact CG2-CB 4.02Å; T442-R444 PolarHBondContact O-N 3.27Å; R444-Q446 PolarHBondContact O-N 3.18Å; R444-Q446 VanDerWaalsContact O-N 3.15Å
445	F	71.1	Confident	64.7	Low	13 Å²	13	85.2 Å²	85.2	6%	0.057	44%	0.444	C	S	.	.			trans	-64.5	113.8	171.3	-61.6	-66.1	0	0	0	110.8	I18 M125 I141 F153 F443	I18-F445 HydrophobicContact CG2-CD1 4.41Å; M125-F445 HydrophobicContact CE-CB 3.75Å; M125-F445 WeakPolarHBondContact CE-O 3.28Å; I141-F445 HydrophobicContact CB-CE1 4.48Å; I141-F445 HydrophobicContact CB-CZ 4.42Å; I141-F445 HydrophobicContact CD1-CD1 3.74Å; I141-F445 HydrophobicContact CD1-CE1 3.81Å; I141-F445 HydrophobicContact CD1-CG 4.28Å; I141-F445 HydrophobicContact CD1-CZ 4.33Å; I141-F445 HydrophobicContact CG2-CD1 4.49Å; I141-F445 HydrophobicContact CG2-CE1 3.51Å; I141-F445 HydrophobicContact CG2-CZ 3.47Å; I141-F445 VanDerWaalsContact CG2-CZ 3.47Å; F153-F445 HydrophobicContact CD1-CE1 4.09Å; F153-F445 AromaticContact CD1-CE2 3.92Å; F153-F445 HydrophobicContact CD1-CE2 3.92Å; F153-F445 AromaticContact CD1-CZ 3.24Å; F153-F445 HydrophobicContact CD1-CZ 3.24Å; F153-F445 AromaticContact CE1-CE1 3.95Å; F153-F445 HydrophobicContact CE1-CE1 3.95Å; F153-F445 HydrophobicContact CE1-CE2 4.45Å; F153-F445 AromaticContact CE1-CZ 3.4Å; F153-F445 HydrophobicContact CE1-CZ 3.4Å; F443-F445 HydrophobicContact CD1-CD1 4.23Å; F443-F445 HydrophobicContact CD1-CE1 4.14Å; F443-F445 AromaticContact CE1-CD1 3.48Å; F443-F445 HydrophobicContact CE1-CD1 3.48Å; F443-F445 VanDerWaalsContact CE1-CD1 3.48Å; F443-F445 AromaticContact CE1-CE1 3.66Å; F443-F445 HydrophobicContact CE1-CE1 3.66Å; F443-F445 HydrophobicContact CE1-CG 4.31Å; F443-F445 HydrophobicContact CZ-CD1 4.34Å
446	Q	78.5	Confident	67.1	Low	125 Å²	125	83.4 Å²	83.4	58%	0.584	42%	0.42	S	S	*	.			trans	-138.8	129.3	173.3	-174.8	175.1	-2.4	0	0	108.6	R444	R444-Q446 PolarHBondContact O-N 3.18Å; R444-Q446 VanDerWaalsContact O-N 3.15Å
447	I	87.3	Confident	69.5	Low	14 Å²	14	80.1 Å²	80.1	7%	0.072	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-81.9	119.1	171.5	-54.1	168.3	0	0	0	107.2	I18 Y79 M125 M127	I18-I447 HydrophobicContact CD1-CD1 4.46Å; I18-I447 HydrophobicContact CD1-CG1 3.8Å; I18-I447 HydrophobicContact CG1-CB 4.35Å; I18-I447 HydrophobicContact CG1-CG1 3.67Å; Y79-I447 HydrophobicContact CD2-CB 3.91Å; Y79-I447 HydrophobicContact CD2-CG2 3.42Å; Y79-I447 VanDerWaalsContact CD2-CG2 3.42Å; Y79-I447 HydrophobicContact CE2-CB 4.3Å; Y79-I447 HydrophobicContact CE2-CG2 4.2Å; Y79-I447 HydrophobicContact CG-CG2 4.04Å; M125-I447 HydrophobicContact SD-CD1 4.39Å; M127-I447 HydrophobicContact CE-CD1 3.6Å; M127-I447 HydrophobicContact SD-CD1 4.47Å
448	T	88.6	Confident	72.3	Confident	32 Å²	32	79.1 Å²	79.1	20%	0.196	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.2	176.9	-52.6	0	0	0	0	108.9	G16 V17 I369	G16-T448 CarbonylContact C-O 3.19Å; G16-T448 WeakPolarHBondContact CA-O 3.44Å; V17-T448 PolarHBondContact N-O 3.37Å; V17-T448 PolarHBondContact O-N 3.14Å; I369-T448 HydrophobicContact CG2-CG2 3.79Å
449	P	89.7	Confident	74.9	Confident	60 Å²	60	74.1 Å²	74.1	39%	0.39	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	143.1	176.4	21.5	-30.3	0	0	0	111.5	Y79	Y79-P449 HydrophobicContact CD1-CB 3.87Å; Y79-P449 HydrophobicContact CE1-CB 3.57Å; Y79-P449 HydrophobicContact CE1-CG 4.04Å
450	L	90.4	Very high	77.3	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.026	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-74.3	137.7	171.2	-62	-175	0	0	0	110.3	F13 I15 V17 V76 Y356 W359 I369	F13-L450 HydrophobicContact CD1-CB 3.92Å; F13-L450 HydrophobicContact CE1-CB 3.95Å; F13-L450 HydrophobicContact CE1-CD1 4.28Å; I15-L450 HydrophobicContact CB-CD1 4.14Å; I15-L450 HydrophobicContact CG2-CD1 3.44Å; I15-L450 VanDerWaalsContact CG2-CD1 3.44Å; I15-L450 HydrophobicContact CG2-CG 4.07Å; I15-L450 PolarHBondContact O-N 3.45Å; V17-L450 HydrophobicContact CB-CD2 3.97Å; V17-L450 HydrophobicContact CG1-CD2 3.86Å; V76-L450 HydrophobicContact CG1-CD1 4.36Å; Y356-L450 HydrophobicContact CD2-CD1 4Å; Y356-L450 HydrophobicContact CE2-CD1 4.08Å; W359-L450 HydrophobicContact CD2-CD1 4.06Å; W359-L450 HydrophobicContact CE3-CD1 4.02Å; W359-L450 HydrophobicContact CH2-CD1 4.14Å; W359-L450 HydrophobicContact CH2-CD2 4.11Å; W359-L450 HydrophobicContact CZ2-CB 4.07Å; W359-L450 HydrophobicContact CZ2-CD1 4.19Å; W359-L450 HydrophobicContact CZ2-CD2 4.26Å; W359-L450 HydrophobicContact CZ2-CG 4.42Å; W359-L450 HydrophobicContact CZ3-CD1 4.07Å; I369-L450 HydrophobicContact CD1-CD2 3.23Å
451	P	88	Confident	79.6	Confident	63 Å²	63	67.8 Å²	67.8	41%	0.409	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-66.5	133.3	175.3	27.6	-33.9	0	0	0	110.3	W359 E453	W359-P451 HydrophobicContact CZ2-CG 4.33Å; W359-P451 PolarHBondContact NE1-O 3.11Å; P451-E453 WeakPolarHBondContact CB-OE2 3.29Å
452	N	85.8	Confident	81.5	Confident	14 Å²	14	57 Å²	57	8%	0.075	28%	0.283	C	S	.	.			trans	-119.8	3.2	-171.2	69.6	-8.4	0	0	0	114.1	F13 F455 I456	F13-N452 HydrophobicContact CB-CB 3.89Å; F13-N452 HydrophobicContact CD1-CB 4.22Å; F13-N452 HydrophobicContact CD2-CB 3.92Å; F13-N452 HydrophobicContact CG-CB 3.76Å; N452-F455 PolarHBondContact O-N 2.89Å; N452-I456 HydrophobicContact CB-CD1 4.32Å; N452-I456 WeakPolarHBondContact ND2-CD1 3.42Å; N452-I456 WeakPolarHBondContact O-CG1 3.34Å; N452-I456 PolarHBondContact O-N 2.97Å
453	E	85	Confident	83	Confident	98 Å²	98	54.3 Å²	54.3	46%	0.458	27%	0.269	S	S	.	.	H	α-helix	trans	-63.8	-53.4	-171.4	-60.6	80.8	-176.5	0	0	111.5	P451 F455 I456 E457	P451-E453 WeakPolarHBondContact CB-OE2 3.29Å; E453-F455 PolarHBondContact O-N 3.27Å; E453-I456 PolarHBondContact O-N 3.17Å; E453-E457 WeakPolarHBondContact O-CB 3.43Å; E453-E457 PolarHBondContact O-N 3.07Å
454	C	85.3	Confident	83.8	Confident	84 Å²	84	54.5 Å²	54.5	57%	0.568	27%	0.271	S	S	*	.	H	α-helix	trans	-61.4	-34.9	177.7	-59.7	0	0	0	0	112.1	R458	C454-R458 WeakPolarHBondContact O-CB 3.39Å; C454-R458 PolarHBondContact O-N 2.88Å
455	F	89.4	Confident	84.3	Confident	1 Å²	1	48 Å²	48	0%	0.004	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-50.5	178.3	176.4	-125.4	0	0	0	110.8	F13 I346 L355 T362 N452 E453 E457 R458 I459	F13-F455 AromaticContact CE2-CD1 3.86Å; F13-F455 HydrophobicContact CE2-CD1 3.86Å; F13-F455 AromaticContact CE2-CE1 3.91Å; F13-F455 HydrophobicContact CE2-CE1 3.91Å; F13-F455 HydrophobicContact CZ-CD1 4.26Å; F13-F455 HydrophobicContact CZ-CE1 4.43Å; I346-F455 HydrophobicContact CD1-CD1 4.21Å; I346-F455 HydrophobicContact CD1-CE1 3.8Å; I346-F455 HydrophobicContact CG1-CE1 3.82Å; I346-F455 HydrophobicContact CG1-CZ 4.32Å; L355-F455 HydrophobicContact CD1-CE1 3.73Å; L355-F455 HydrophobicContact CD1-CZ 3.82Å; T362-F455 HydrophobicContact CG2-CD2 3.68Å; T362-F455 HydrophobicContact CG2-CE2 4.45Å; N452-F455 PolarHBondContact O-N 2.89Å; E453-F455 PolarHBondContact O-N 3.27Å; F455-E457 VanDerWaalsContact C-N 3.34Å; F455-E457 PolarHBondContact O-N 3.32Å; F455-R458 PolarHBondContact O-N 3.14Å; F455-I459 HydrophobicContact CD2-CD1 4.46Å; F455-I459 HydrophobicContact CD2-CG1 4Å; F455-I459 HydrophobicContact CE2-CD1 3.78Å; F455-I459 HydrophobicContact CE2-CG1 3.57Å; F455-I459 HydrophobicContact CZ-CD1 4.36Å; F455-I459 HydrophobicContact CZ-CG1 3.95Å; F455-I459 WeakPolarHBondContact O-CG1 3.2Å; F455-I459 PolarHBondContact O-N 3.1Å
456	I	87.1	Confident	84.5	Confident	22 Å²	22	48 Å²	48	11%	0.113	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-46.1	176.8	-69.7	170.6	0	0	0	110.6	A342 I346 N452 E453 R458 I459 S460	A342-I456 HydrophobicContact CB-CG2 4.32Å; I346-I456 HydrophobicContact CD1-CG1 3.97Å; N452-I456 HydrophobicContact CB-CD1 4.32Å; N452-I456 WeakPolarHBondContact ND2-CD1 3.42Å; N452-I456 WeakPolarHBondContact O-CG1 3.34Å; N452-I456 PolarHBondContact O-N 2.97Å; E453-I456 PolarHBondContact O-N 3.17Å; I456-R458 PolarHBondContact O-N 3.05Å; I456-I459 PolarHBondContact O-N 3.29Å; I456-S460 VanDerWaalsContact O-CB 3.3Å; I456-S460 WeakPolarHBondContact O-CB 3.24Å; I456-S460 PolarHBondContact O-N 3.36Å
457	E	86.4	Confident	84.5	Confident	117 Å²	117	42 Å²	42	55%	0.547	22%	0.221	S	C	.	.	H	α-helix	trans	-57.3	-49.1	177.8	-175.2	178.2	-175.4	0	0	110.7	E453 F455 I459 S460 H461	E453-E457 WeakPolarHBondContact O-CB 3.43Å; E453-E457 PolarHBondContact O-N 3.07Å; F455-E457 VanDerWaalsContact C-N 3.34Å; F455-E457 PolarHBondContact O-N 3.32Å; E457-I459 PolarHBondContact O-N 2.93Å; E457-S460 WeakPolarHBondContact O-CB 3.42Å; E457-S460 PolarHBondContact O-N 3.24Å; E457-S460 PolarHBondContact O-OG 2.81Å; E457-H461 PolarHBondContact O-CD2 3.13Å; E457-H461 PolarHBondContact O-N 2.82Å
458	R	87.9	Confident	83.9	Confident	99 Å²	99	42.5 Å²	42.5	37%	0.374	22%	0.222	S	C	.	.	H	α-helix	trans	-59.2	-50.7	179.1	-177.5	59.6	-177.6	-148.7	2	112	T362 C454 F455 I456 S460 H461 T462 V573 D574	T362-R458 HydrophobicContact CG2-CB 3.85Å; T362-R458 HydrophobicContact CG2-CG 3.86Å; C454-R458 WeakPolarHBondContact O-CB 3.39Å; C454-R458 PolarHBondContact O-N 2.88Å; F455-R458 PolarHBondContact O-N 3.14Å; I456-R458 PolarHBondContact O-N 3.05Å; R458-S460 PolarHBondContact O-N 3.28Å; R458-H461 PolarHBondContact O-N 2.67Å; R458-T462 PolarHBondContact O-N 3.07Å; R458-T462 PolarHBondContact O-OG1 3.49Å; R458-T462 VanDerWaalsContact O-OG1 3.11Å; R458-V573 HydrophobicContact CG-CB 4.34Å; R458-V573 HydrophobicContact CG-CG1 3.96Å; R458-V573 HydrophobicContact CG-CG2 4.37Å; R458-D574 IonicContact CZ-OD2 2.84Å; R458-D574 IonicContact NE-OD1 3.45Å; R458-D574 IonicContact NE-OD2 3.49Å; R458-D574 IonicContact NH2-OD2 2.69Å; R458-D574 PolarHBondContact NH2-OD2 3.36Å
459	I	87.9	Confident	82.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-33.4	179.4	-60	-58.2	0	0	0	111.6	A342 F345 F455 I456 E457 H461 T462 L467 I577	A342-I459 HydrophobicContact CB-CB 3.94Å; A342-I459 HydrophobicContact CB-CG2 3.72Å; F345-I459 HydrophobicContact CB-CG2 4.07Å; F345-I459 HydrophobicContact CD1-CD1 4.2Å; F345-I459 HydrophobicContact CD1-CG1 4.33Å; F345-I459 HydrophobicContact CD1-CG2 3.61Å; F345-I459 HydrophobicContact CE1-CD1 3.92Å; F345-I459 HydrophobicContact CE1-CG1 4.47Å; F345-I459 HydrophobicContact CE1-CG2 4.37Å; F345-I459 HydrophobicContact CG-CG2 4.07Å; F455-I459 HydrophobicContact CD2-CD1 4.46Å; F455-I459 HydrophobicContact CD2-CG1 4Å; F455-I459 HydrophobicContact CE2-CD1 3.78Å; F455-I459 HydrophobicContact CE2-CG1 3.57Å; F455-I459 HydrophobicContact CZ-CD1 4.36Å; F455-I459 HydrophobicContact CZ-CG1 3.95Å; F455-I459 WeakPolarHBondContact O-CG1 3.2Å; F455-I459 PolarHBondContact O-N 3.1Å; I456-I459 PolarHBondContact O-N 3.29Å; E457-I459 PolarHBondContact O-N 2.93Å; I459-H461 PolarHBondContact O-N 3.02Å; I459-T462 PolarHBondContact O-N 3.27Å; I459-L467 HydrophobicContact CG2-CD1 4.28Å; I459-L467 HydrophobicContact CG2-CD2 4.23Å; I459-I577 HydrophobicContact CD1-CD1 3.4Å; I459-I577 VanDerWaalsContact CD1-CD1 3.4Å
460	S	85.5	Confident	81.6	Confident	10 Å²	10	38.9 Å²	38.9	7%	0.07	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-27.5	177.3	85.3	0	0	0	0	112.3	N338 K341 I456 E457 R458	N338-S460 WeakPolarHBondContact O-CB 3.48Å; K341-S460 WeakPolarHBondContact CE-O 3.44Å; K341-S460 PolarHBondContact NZ-O 3.23Å; I456-S460 VanDerWaalsContact O-CB 3.3Å; I456-S460 WeakPolarHBondContact O-CB 3.24Å; I456-S460 PolarHBondContact O-N 3.36Å; E457-S460 WeakPolarHBondContact O-CB 3.42Å; E457-S460 PolarHBondContact O-N 3.24Å; E457-S460 PolarHBondContact O-OG 2.81Å; R458-S460 PolarHBondContact O-N 3.28Å
461	H	84.7	Confident	80.1	Confident	132 Å²	132	43.9 Å²	43.9	61%	0.611	23%	0.225	S	C	*	.	H	α-helix	trans	-93.5	-18.6	175.3	-66.7	-60.6	0	0	0	113.6	E457 R458 I459 S463	E457-H461 PolarHBondContact O-CD2 3.13Å; E457-H461 PolarHBondContact O-N 2.82Å; R458-H461 PolarHBondContact O-N 2.67Å; I459-H461 PolarHBondContact O-N 3.02Å; H461-S463 PolarHBondContact O-N 3.19Å
462	T	83.8	Confident	78.3	Confident	2 Å²	2	43.2 Å²	43.2	1%	0.012	22%	0.217	C	C	.	.	S	Bend	trans	-61.3	131.8	174.1	-54.1	0	0	0	0	111	K341 R458 I459 N466 L467 D574	K341-T462 WeakPolarHBondContact CE-O 3.26Å; K341-T462 PolarHBondContact NZ-O 3.27Å; R458-T462 PolarHBondContact O-N 3.07Å; R458-T462 PolarHBondContact O-OG1 3.49Å; R458-T462 VanDerWaalsContact O-OG1 3.11Å; I459-T462 PolarHBondContact O-N 3.27Å; T462-N466 HydrophobicContact CG2-CB 3.83Å; T462-L467 HydrophobicContact CG2-CD2 3.52Å; T462-L467 HydrophobicContact CG2-CG 3.87Å; T462-D574 WeakPolarHBondContact CB-OD1 3.49Å; T462-D574 HydrophobicContact CG2-CB 4.37Å; T462-D574 WeakPolarHBondContact CG2-OD1 3.43Å; T462-D574 PolarHBondContact OG1-OD1 3.11Å
463	S	79.5	Confident	76.1	Confident	32 Å²	32	46 Å²	46	22%	0.224	24%	0.237	C	C	.	.			trans	-66.2	144.4	178.2	52.9	0	0	0	0	112.6	H461 H465 N466 L467	H461-S463 PolarHBondContact O-N 3.19Å; S463-H465 WeakPolarHBondContact CB-CE1 3.49Å; S463-H465 VanDerWaalsContact CB-ND1 3.33Å; S463-H465 WeakPolarHBondContact CB-ND1 3.36Å; S463-H465 PolarHBondContact O-N 3.32Å; S463-H465 VanDerWaalsContact O-N 3.15Å; S463-H465 PolarHBondContact OG-CE1 2.82Å; S463-H465 PolarHBondContact OG-ND1 2.62Å; S463-H465 PolarHBondContact OG-NE2 3.17Å; S463-N466 PolarHBondContact O-N 3.11Å; S463-N466 PolarHBondContact OG-ND2 3.06Å; S463-L467 PolarHBondContact O-N 2.73Å
464	L	75.4	Confident	73.7	Confident	51 Å²	51	48.3 Å²	48.3	27%	0.267	25%	0.248	S	C	.	.	H	α-helix	trans	-60.1	-30.7	-174.8	-159.5	72	0	0	0	113.5	L329 K341 N466 L467 Y468 I472	L329-L464 HydrophobicContact CD2-CD1 4.31Å; L329-L464 HydrophobicContact CD2-CD2 4.3Å; K341-L464 HydrophobicContact CD-CD1 4.07Å; K341-L464 HydrophobicContact CG-CD1 4.13Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.44Å; L464-L467 PolarHBondContact O-N 3.49Å; L464-Y468 HydrophobicContact CD1-CD2 3.69Å; L464-Y468 HydrophobicContact CD1-CE2 3.77Å; L464-Y468 HydrophobicContact CG-CD2 4Å; L464-Y468 PolarHBondContact O-N 3.35Å; L464-I472 HydrophobicContact CB-CD1 3.75Å; L464-I472 HydrophobicContact CD2-CD1 3.54Å; L464-I472 HydrophobicContact CG-CD1 3.6Å
465	H	72.1	Confident	71.2	Confident	35 Å²	35	50 Å²	50	16%	0.162	25%	0.251	C	S	.	.	H	α-helix	trans	-66.1	-32	176	70.1	-90.9	0	0	0	113	S463 Y468 P469 N555	S463-H465 WeakPolarHBondContact CB-CE1 3.49Å; S463-H465 VanDerWaalsContact CB-ND1 3.33Å; S463-H465 WeakPolarHBondContact CB-ND1 3.36Å; S463-H465 PolarHBondContact O-N 3.32Å; S463-H465 VanDerWaalsContact O-N 3.15Å; S463-H465 PolarHBondContact OG-CE1 2.82Å; S463-H465 PolarHBondContact OG-ND1 2.62Å; S463-H465 PolarHBondContact OG-NE2 3.17Å; H465-Y468 CarbonylContact O-C 3.55Å; H465-P469 WeakPolarHBondContact O-CA 3.46Å; H465-P469 VanDerWaalsContact O-N 3.11Å; H465-N555 PolarHBondContact CE1-ND2 3.44Å; H465-N555 PolarHBondContact NE2-ND2 3.26Å
466	N	76.5	Confident	68.3	Low	11 Å²	11	57.5 Å²	57.5	6%	0.059	29%	0.29	C	S	.	.	H	α-helix	trans	-74.2	-38.1	175.6	-73.7	-20.8	0	0	0	111.1	T462 S463 L464 Y468	T462-N466 HydrophobicContact CG2-CB 3.83Å; S463-N466 PolarHBondContact O-N 3.11Å; S463-N466 PolarHBondContact OG-ND2 3.06Å; L464-N466 VanDerWaalsContact C-N 3.33Å; L464-N466 PolarHBondContact O-N 3.44Å; N466-Y468 VanDerWaalsContact C-N 3.35Å
467	L	78.8	Confident	65.7	Low	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-68.8	-35.1	177.5	-57.4	-177.6	0	0	0	111.9	K341 F345 I459 T462 S463 L464 I577	K341-L467 HydrophobicContact CD-CD1 4.14Å; K341-L467 HydrophobicContact CG-CD1 4.07Å; F345-L467 HydrophobicContact CB-CD1 4.32Å; F345-L467 HydrophobicContact CD1-CD2 4.23Å; F345-L467 HydrophobicContact CD2-CB 3.84Å; F345-L467 HydrophobicContact CD2-CD1 4.37Å; F345-L467 HydrophobicContact CD2-CD2 3.79Å; F345-L467 HydrophobicContact CD2-CG 4.19Å; F345-L467 HydrophobicContact CE1-CD2 4.19Å; F345-L467 HydrophobicContact CE2-CB 4.08Å; F345-L467 HydrophobicContact CE2-CD2 3.76Å; F345-L467 HydrophobicContact CE2-CG 4.46Å; F345-L467 HydrophobicContact CG-CD1 4.36Å; F345-L467 HydrophobicContact CG-CD2 4.02Å; F345-L467 HydrophobicContact CZ-CD2 3.96Å; I459-L467 HydrophobicContact CG2-CD1 4.28Å; I459-L467 HydrophobicContact CG2-CD2 4.23Å; T462-L467 HydrophobicContact CG2-CD2 3.52Å; T462-L467 HydrophobicContact CG2-CG 3.87Å; S463-L467 PolarHBondContact O-N 2.73Å; L464-L467 PolarHBondContact O-N 3.49Å; L467-I577 HydrophobicContact CD2-CD1 4.44Å; L467-I577 HydrophobicContact CD2-CG2 4.14Å
468	Y	75	Confident	62.9	Low	25 Å²	25	66 Å²	66	10%	0.098	33%	0.329	C	S	.	.	S	Bend	trans	-136.1	66	-174.7	-55.5	-78	0	0	0	112.5	F345 L464 H465 N466 L470 L471	F345-Y468 WeakPolarHBondContact CA-OH 3.06Å; L464-Y468 HydrophobicContact CD1-CD2 3.69Å; L464-Y468 HydrophobicContact CD1-CE2 3.77Å; L464-Y468 HydrophobicContact CG-CD2 4Å; L464-Y468 PolarHBondContact O-N 3.35Å; H465-Y468 CarbonylContact O-C 3.55Å; N466-Y468 VanDerWaalsContact C-N 3.35Å; Y468-L470 PolarHBondContact O-N 2.81Å; Y468-L471 HydrophobicContact CD1-CD1 3.77Å; Y468-L471 HydrophobicContact CG-CD1 4.08Å; Y468-L471 PolarHBondContact O-N 2.83Å
469	P	66.5	Low	60.4	Low	4 Å²	4	66.8 Å²	66.8	3%	0.026	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-18.1	-167.3	22.1	-34.1	0	0	0	116.3	H465 Y578 R581	H465-P469 WeakPolarHBondContact O-CA 3.46Å; H465-P469 VanDerWaalsContact O-N 3.11Å; P469-Y578 HydrophobicContact CB-CD2 3.52Å; P469-Y578 HydrophobicContact CB-CE2 3.39Å; P469-Y578 HydrophobicContact CG-CD2 4.16Å; P469-Y578 HydrophobicContact CG-CE2 4.36Å; P469-R581 HydrophobicContact CG-CB 4.1Å
470	L	62	Low	57.9	Low	11 Å²	11	71.6 Å²	71.6	6%	0.058	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	4.3	179.5	-49.1	-179.7	0	0	0	114.4	Y468 W549 F553 L582 R585	Y468-L470 PolarHBondContact O-N 2.81Å; L470-W549 HydrophobicContact CD1-CE3 4.38Å; L470-W549 HydrophobicContact CD1-CH2 3.27Å; L470-W549 HydrophobicContact CD1-CZ2 4.38Å; L470-W549 HydrophobicContact CD1-CZ3 3.26Å; L470-W549 HydrophobicContact CD2-CE3 4.39Å; L470-W549 HydrophobicContact CD2-CZ3 3.92Å; L470-W549 HydrophobicContact CG-CZ3 4.25Å; L470-F553 HydrophobicContact CD2-CE2 4.28Å; L470-F553 HydrophobicContact CD2-CZ 4.48Å; L470-L582 HydrophobicContact CD2-CD1 4.38Å; L470-R585 HydrophobicContact CD1-CB 4.05Å; L470-R585 VanDerWaalsContact CD1-CD 3.5Å; L470-R585 HydrophobicContact CD1-CG 4.01Å
471	L	59.4	Low	55.3	Low	111 Å²	111	77.3 Å²	77.3	58%	0.581	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-13.3	175.4	-67.8	-179.9	0	0	0	112.6	Y468	Y468-L471 HydrophobicContact CD1-CD1 3.77Å; Y468-L471 HydrophobicContact CG-CD1 4.08Å; Y468-L471 PolarHBondContact O-N 2.83Å
472	I	49.6	Very low	52.9	Low	49 Å²	49	83 Å²	83	25%	0.251	43%	0.428	S	S	.	.			trans	-122	88.9	-173.5	-48.7	174.9	0	0	0	108.7	L464 Q474	L464-I472 HydrophobicContact CB-CD1 3.75Å; L464-I472 HydrophobicContact CD2-CD1 3.54Å; L464-I472 HydrophobicContact CG-CD1 3.6Å; I472-Q474 HydrophobicContact CG2-CG 3.82Å; I472-Q474 PolarHBondContact O-N 3.07Å
473	C	40.7	Very low	50.5	Low	73 Å²	73	88.4 Å²	88.4	49%	0.493	46%	0.457	S	S	.	.			trans	-69.6	105.9	159.5	-67.7	0	0	0	0	106.8	D475	C473-D475 PolarHBondContact O-N 3.48Å
474	Q	33.7	Very low	48.3	Very low	146 Å²	146	91.8 Å²	91.8	68%	0.682	48%	0.48	S	S	*	.	S	Bend	trans	-70.4	4	-178.3	-85.7	-170	-32.8	0	0	114.7	I472	I472-Q474 HydrophobicContact CG2-CG 3.82Å; I472-Q474 PolarHBondContact O-N 3.07Å
475	D	32.4	Very low	46.4	Very low	120 Å²	120	94 Å²	94	64%	0.642	50%	0.5	S	S	*	.			trans	-114.2	69.2	176.2	-69.3	-45.2	0	0	0	113	C473 K477	C473-D475 PolarHBondContact O-N 3.48Å; D475-K477 PolarHBondContact O-N 3.22Å
476	L	30.2	Very low	44.6	Very low	158 Å²	158	97.3 Å²	97.3	83%	0.827	52%	0.522	S	S	*	.			trans	-71.5	65.7	157.6	-81.9	165	0	0	0	110
477	K	31.3	Very low	42.3	Very low	193 Å²	193	99.1 Å²	99.1	84%	0.839	54%	0.536	S	S	*	.			trans	-111.3	48.1	156.8	-85.6	-171.5	179.4	174.9	0	110.1	D475 S479	D475-K477 PolarHBondContact O-N 3.22Å; K477-S479 PolarHBondContact O-N 3.42Å
478	I	29.1	Very low	40.2	Very low	125 Å²	125	103.2 Å²	103.2	64%	0.641	56%	0.564	S	S	*	*			trans	-93.5	79.7	167.9	-55.1	177	0	0	0	107.2	S480	I478-S480 PolarHBondContact O-N 3.24Å
479	S	34.1	Very low	38.2	Very low	114 Å²	114	105.7 Å²	105.7	80%	0.797	59%	0.589	S	S	*	*			trans	-63.3	86.7	163	53.2	0	0	0	0	108.9	K477	K477-S479 PolarHBondContact O-N 3.42Å
480	S	36.7	Very low	36.5	Very low	101 Å²	101	110.3 Å²	110.3	71%	0.706	61%	0.613	S	S	*	*			trans	155.8	66.3	150.5	63	0	0	0	0	113.9	I478	I478-S480 PolarHBondContact O-N 3.24Å
481	I	29.9	Very low	34.9	Very low	130 Å²	130	117.7 Å²	117.7	67%	0.667	64%	0.642	S	S	*	*			trans	-138.3	109.7	158.2	-57.5	-179.1	0	0	0	110	N483	I481-N483 VanDerWaalsContact C-N 3.29Å; I481-N483 PolarHBondContact O-N 3.32Å
482	R	35.3	Very low	33.8	Very low	253 Å²	253	117.1 Å²	117.1	96%	0.955	65%	0.647	S	S	*	*			trans	-78.4	53.9	-177.4	-71	-177.5	176.9	175.9	-1	113.4
483	N	32.8	Very low	33	Very low	115 Å²	115	119.9 Å²	119.9	62%	0.615	67%	0.666	S	S	*	*			trans	-110	106.1	171.3	-84	-13.2	0	0	0	110.9	I481	I481-N483 VanDerWaalsContact C-N 3.29Å; I481-N483 PolarHBondContact O-N 3.32Å
484	S	33.4	Very low	32.5	Very low	103 Å²	103	123.5 Å²	123.5	72%	0.72	68%	0.68	S	S	*	*	H	α-helix	trans	-80.3	-11.9	-166	52.8	0	0	0	0	115.6
485	S	34.8	Very low	32.2	Very low	98 Å²	98	122.4 Å²	122.4	69%	0.685	68%	0.679	S	S	*	*	H	α-helix	trans	-84.2	-23.5	-176.4	58.1	0	0	0	0	114.5
486	V	34.8	Very low	32.1	Very low	103 Å²	103	125 Å²	125	62%	0.624	69%	0.693	S	S	*	*	H	α-helix	trans	-90.7	-25.7	175.7	-176.4	0	0	0	0	111
487	C	29	Very low	32	Very low	50 Å²	50	119.6 Å²	119.6	34%	0.338	68%	0.676	S	S	.	*	H	α-helix	trans	-78	-27.5	-178.7	-68	0	0	0	0	114.1	A489 L490 Y491	C487-A489 VanDerWaalsContact C-N 3.28Å; C487-A489 PolarHBondContact O-N 3.4Å; C487-L490 PolarHBondContact O-N 3.05Å; C487-Y491 HydrophobicContact CB-CD2 4.26Å; C487-Y491 PolarHBondContact O-N 2.89Å
488	S	32.7	Very low	31.9	Very low	85 Å²	85	117.4 Å²	117.4	59%	0.594	68%	0.679	S	S	*	*	H	α-helix	trans	-66.6	-29.4	-177.9	54.1	0	0	0	0	113	L490	S488-L490 VanDerWaalsContact C-N 3.33Å
489	A	33.9	Very low	31.9	Very low	77 Å²	77	118.5 Å²	118.5	64%	0.636	69%	0.686	S	S	*	*	H	α-helix	trans	-74.3	-23.8	171.2	0	0	0	0	0	113	C487	C487-A489 VanDerWaalsContact C-N 3.28Å; C487-A489 PolarHBondContact O-N 3.4Å
490	L	30.1	Very low	31.6	Very low	101 Å²	101	123.7 Å²	123.7	53%	0.529	69%	0.69	S	S	.	*	H	α-helix	trans	-90.1	-25.1	-178.9	-70.5	167.2	0	0	0	113.2	C487 S488	C487-L490 PolarHBondContact O-N 3.05Å; S488-L490 VanDerWaalsContact C-N 3.33Å
491	Y	30.1	Very low	31.1	Very low	167 Å²	167	124.6 Å²	124.6	66%	0.655	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-11.7	-177.7	-99.3	-81.2	0	0	0	115.2	C487 V493	C487-Y491 HydrophobicContact CB-CD2 4.26Å; C487-Y491 PolarHBondContact O-N 2.89Å; Y491-V493 PolarHBondContact O-N 3.03Å
492	S	34.7	Very low	30.9	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-4.3	-176	58.8	0	0	0	0	114.8
493	V	33.6	Very low	30.5	Very low	106 Å²	106	120.4 Å²	120.4	64%	0.642	69%	0.694	S	S	*	*	S	Bend	trans	-113.7	-20.2	-173.1	-176.6	0	0	0	0	114.6	Y491	Y491-V493 PolarHBondContact O-N 3.03Å
494	N	31.2	Very low	30	Very low	150 Å²	150	120.5 Å²	120.5	80%	0.802	70%	0.703	S	S	*	*	S	Bend	trans	-105.6	6.5	-174.8	-95	-0	0	0	0	117.3
495	N	27	Very low	29.8	Very low	123 Å²	123	121.3 Å²	121.3	66%	0.658	71%	0.709	S	S	*	*			trans	-112.2	44.4	174	-77.9	-11.2	0	0	0	113.1	G497	N495-G497 PolarHBondContact O-N 3.3Å; N495-G497 VanDerWaalsContact O-N 3.1Å
496	N	30.1	Very low	29.3	Very low	173 Å²	173	124.6 Å²	124.6	93%	0.925	72%	0.719	S	S	*	*			trans	-77.4	77.9	153.3	-85.7	-15.5	0	0	0	108.4
497	G	28.3	Very low	29	Very low	45 Å²	45	125 Å²	125	46%	0.464	73%	0.727	S	S	.	*	S	Bend	trans	153.5	119.2	173.6	0	0	0	0	0	112.6	N495	N495-G497 PolarHBondContact O-N 3.3Å; N495-G497 VanDerWaalsContact O-N 3.1Å
498	T	28.4	Very low	28.9	Very low	148 Å²	148	128.2 Å²	128.2	91%	0.908	75%	0.749	S	S	*	*			trans	88.4	107.3	165.2	72	0	0	0	0	117.2
499	N	29.1	Very low	28.5	Very low	148 Å²	148	131 Å²	131	79%	0.791	76%	0.756	S	S	*	*			trans	-41.3	141.6	160.5	-64.5	-39.9	0	0	0	111.9
500	Y	27.5	Very low	28.2	Very low	223 Å²	223	133.3 Å²	133.3	88%	0.875	77%	0.765	S	S	*	*				176.7	113.2	127.7	-96.2	-73.1	0	0	0	111.5
501	V	26.2	Very low	27.9	Very low	120 Å²	120	135.4 Å²	135.4	73%	0.727	78%	0.776	S	S	*	*			trans	44.3	111.9	139.5	-173.2	0	0	0	0	120.8
502	N	25.7	Very low	27.6	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	79%	0.787	S	S	*	*			trans	10.2	121.2	137.3	-67.1	-18.1	0	0	0	118.8
503	T	26.6	Very low	27.1	Very low	144 Å²	144	138.1 Å²	138.1	88%	0.883	80%	0.798	S	S	*	*			trans	-150.2	122.3	132.4	46.4	0	0	0	0	111.3
504	S	23.7	Very low	26.7	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	81%	0.805	S	S	*	*			trans	-68.3	143.7	168	50.8	0	0	0	0	113.1
505	S	29.3	Very low	27	Very low	121 Å²	121	136.7 Å²	136.7	85%	0.846	80%	0.802	S	S	*	*			trans	-166.4	118.4	141.9	51.3	0	0	0	0	111.5
506	N	23.6	Very low	27	Very low	167 Å²	167	137.2 Å²	137.2	89%	0.893	81%	0.809	S	S	*	*			trans	-66.1	145.5	172.2	-69	-37	0	0	0	112.3
507	S	28.8	Very low	26.7	Very low	112 Å²	112	136 Å²	136	78%	0.783	80%	0.801	S	S	*	*			trans	-159.9	107.7	140.3	58.7	0	0	0	0	111.5
508	S	26.8	Very low	26.6	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	81%	0.813	S	S	*	*			trans	-8.8	128.6	159.1	47.7	0	0	0	0	120.5
509	I	23.8	Very low	26.6	Very low	145 Å²	145	139.2 Å²	139.2	74%	0.744	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-87.5	135.3	164.2	-64.1	159.9	0	0	0	108.9
510	P	26.8	Very low	26.4	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-90.2	121	163.5	28.8	-18.5	0	0	0	110.3
511	N	24.7	Very low	26.5	Very low	145 Å²	145	132.4 Å²	132.4	78%	0.775	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.6	166.5	170.8	-78.2	-29.4	0	0	0	111.5
512	E	23.8	Very low	26.5	Very low	187 Å²	187	135 Å²	135	87%	0.874	81%	0.811	S	S	*	*			trans	101.5	93.6	164.3	-58.7	-177.5	174.6	0	0	116.4
513	C	23.4	Very low	26.7	Very low	136 Å²	136	137.1 Å²	137.1	92%	0.919	81%	0.813	S	S	*	*				-168.3	110.1	121.6	-106.1	0	0	0	0	110.1
514	S	25.5	Very low	26.7	Very low	115 Å²	115	138.9 Å²	138.9	80%	0.804	81%	0.811	S	S	*	*			trans	-77.7	159.5	174.9	38.2	0	0	0	0	112.6
515	P	37.4	Very low	27	Very low	111 Å²	111	139 Å²	139	72%	0.721	81%	0.806	S	S	*	*			trans	-93.5	138.8	-151.2	35.3	-31.8	0	0	0	113
516	V	26.6	Very low	27.2	Very low	133 Å²	133	138.5 Å²	138.5	81%	0.806	80%	0.799	S	S	*	*			trans	-116.8	117.9	157.1	-179.5	0	0	0	0	105.6	P518	V516-P518 VanDerWaalsContact O-CD 3.24Å; V516-P518 WeakPolarHBondContact O-CD 3.31Å
517	I	24.2	Very low	28	Very low	148 Å²	148	139.4 Å²	139.4	76%	0.759	80%	0.797	S	S	*	*			trans	-96	104.5	177.4	-60.5	166.8	0	0	0	106.6
518	P	27.4	Very low	28.5	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	80%	0.797	S	S	*	*			trans	-95.5	125.6	161	28.2	-15.8	0	0	0	108.9	V516 S520	V516-P518 VanDerWaalsContact O-CD 3.24Å; V516-P518 WeakPolarHBondContact O-CD 3.31Å; P518-S520 PolarHBondContact O-N 3.02Å
519	N	27.6	Very low	28.8	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	79%	0.79	S	S	*	*			trans	-36.7	124	177.2	-66.9	-40	0	0	0	113.9	P521	N519-P521 VanDerWaalsContact O-CD 3.32Å; N519-P521 WeakPolarHBondContact O-CD 3.45Å
520	S	24.9	Very low	29.6	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	78%	0.778	S	S	*	*			trans	-61.2	118	168.9	47.9	0	0	0	0	112.5	P518	P518-S520 PolarHBondContact O-N 3.02Å
521	P	29.3	Very low	30.2	Very low	115 Å²	115	141.6 Å²	141.6	75%	0.747	77%	0.77	S	S	*	*			trans	-88.1	122.4	149.5	23.9	-7.7	0	0	0	107.9	N519 F523	N519-P521 VanDerWaalsContact O-CD 3.32Å; N519-P521 WeakPolarHBondContact O-CD 3.45Å; P521-F523 PolarHBondContact O-N 3.46Å; P521-F523 VanDerWaalsContact O-N 3.16Å
522	L	26.5	Very low	30.7	Very low	176 Å²	176	141 Å²	141	92%	0.921	76%	0.761	S	S	*	*			trans	-42.4	118.4	169.5	-82.9	132.4	0	0	0	110.6	E524	L522-E524 PolarHBondContact O-N 3.49Å
523	F	29.4	Very low	31.2	Very low	194 Å²	194	136.4 Å²	136.4	85%	0.851	74%	0.742	S	S	*	*			trans	-43	117.9	176.5	-92.6	-101.8	0	0	0	112	P521 V525	P521-F523 PolarHBondContact O-N 3.46Å; P521-F523 VanDerWaalsContact O-N 3.16Å; F523-V525 PolarHBondContact O-N 3.13Å
524	E	28.1	Very low	32	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	72%	0.722	S	S	*	*			trans	-58.3	112.7	157.9	-98.5	176.4	149.3	0	0	108.7	L522 T526	L522-E524 PolarHBondContact O-N 3.49Å; E524-T526 PolarHBondContact O-N 2.79Å
525	V	30.4	Very low	32.7	Very low	118 Å²	118	131.9 Å²	131.9	72%	0.715	70%	0.703	S	S	*	*			trans	-84.9	90.4	-178.5	179.9	0	0	0	0	108.2	F523	F523-V525 PolarHBondContact O-N 3.13Å
526	T	32.5	Very low	32.4	Very low	112 Å²	112	129 Å²	129	69%	0.687	68%	0.682	S	S	*	*			trans	-122.3	128	173.9	48.9	0	0	0	0	112.5	E524 K528	E524-T526 PolarHBondContact O-N 2.79Å; T526-K528 VanDerWaalsContact C-N 3.34Å; T526-K528 PolarHBondContact O-N 2.88Å
527	E	39.9	Very low	33.1	Very low	185 Å²	185	128 Å²	128	86%	0.864	68%	0.679	S	S	*	*	S	Bend	trans	56.7	-21.6	165	-78.3	-179	150	0	0	122.4	R529	E527-R529 PolarHBondContact O-N 2.93Å; E527-R529 VanDerWaalsContact O-N 3.11Å
528	K	39.5	Very low	34	Very low	180 Å²	180	129.1 Å²	129.1	78%	0.783	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	5.5	-178.8	-74.2	-171.1	176.9	-179.7	0	116.2	T526	T526-K528 VanDerWaalsContact C-N 3.34Å; T526-K528 PolarHBondContact O-N 2.88Å
529	R	34.1	Very low	34.3	Very low	176 Å²	176	127.8 Å²	127.8	66%	0.664	67%	0.666	S	S	*	*	H	α-helix	trans	-83.5	-23.5	-176.3	-150.5	176.5	-173.3	175.3	1.7	114	E527 L533	E527-R529 PolarHBondContact O-N 2.93Å; E527-R529 VanDerWaalsContact O-N 3.11Å; R529-L533 HydrophobicContact CG-CD1 4.24Å; R529-L533 WeakPolarHBondContact O-CG 3.44Å; R529-L533 PolarHBondContact O-N 2.77Å; R529-L533 VanDerWaalsContact O-N 3.15Å
530	S	39.5	Very low	34.9	Very low	69 Å²	69	127.2 Å²	127.2	48%	0.483	66%	0.662	S	S	.	*	H	α-helix	trans	-66.7	-46.5	177.1	57.3	0	0	0	0	111.3	F532 L533 D534	S530-F532 VanDerWaalsContact C-N 3.29Å; S530-F532 PolarHBondContact O-N 2.85Å; S530-L533 PolarHBondContact O-N 3.09Å; S530-D534 PolarHBondContact O-N 3.1Å
531	D	40.8	Very low	35.4	Very low	119 Å²	119	125.9 Å²	125.9	64%	0.636	65%	0.646	S	S	*	*	H	α-helix	trans	-67.5	-33.5	-176.6	-63.2	-6.7	0	0	0	111.8	S535	D531-S535 WeakPolarHBondContact O-CB 3.38Å; D531-S535 PolarHBondContact O-N 3.45Å
532	F	34.2	Very low	35.6	Very low	134 Å²	134	123.9 Å²	123.9	59%	0.588	63%	0.632	S	S	*	*	H	α-helix	trans	-69.9	-40.2	175.6	-173.7	-103.3	0	0	0	112.4	S530 S535 L536	S530-F532 VanDerWaalsContact C-N 3.29Å; S530-F532 PolarHBondContact O-N 2.85Å; F532-S535 PolarHBondContact O-N 2.93Å; F532-L536 HydrophobicContact CD1-CD1 3.79Å; F532-L536 HydrophobicContact CE1-CD1 3.47Å; F532-L536 VanDerWaalsContact CE1-CD1 3.47Å; F532-L536 HydrophobicContact CE1-CG 4.38Å; F532-L536 HydrophobicContact CZ-CD1 4.09Å; F532-L536 PolarHBondContact O-N 3.18Å; F532-L536 VanDerWaalsContact O-N 3.08Å
533	L	34.8	Very low	35.9	Very low	90 Å²	90	120.9 Å²	120.9	47%	0.471	62%	0.624	S	S	.	*	H	α-helix	trans	-70.3	-39.5	176.7	-74.5	166.9	0	0	0	111.8	R529 S530 S535 L536 C537	R529-L533 HydrophobicContact CG-CD1 4.24Å; R529-L533 WeakPolarHBondContact O-CG 3.44Å; R529-L533 PolarHBondContact O-N 2.77Å; R529-L533 VanDerWaalsContact O-N 3.15Å; S530-L533 PolarHBondContact O-N 3.09Å; L533-S535 VanDerWaalsContact C-N 3.33Å; L533-S535 PolarHBondContact O-N 3.03Å; L533-L536 HydrophobicContact CD2-CD1 4.39Å; L533-L536 WeakPolarHBondContact O-CB 3.34Å; L533-L536 PolarHBondContact O-N 2.9Å; L533-L536 VanDerWaalsContact O-N 3.16Å; L533-C537 PolarHBondContact O-N 3.25Å; L533-C537 PolarHBondContact O-SG 2.84Å; L533-C537 VanDerWaalsContact O-SG 3.42Å
534	D	40.6	Very low	36.1	Very low	97 Å²	97	116.6 Å²	116.6	52%	0.519	61%	0.609	S	S	.	*	H	α-helix	trans	-66.9	-34.7	175	-89.8	-2.2	0	0	0	112.3	S530 L536 C537 K538	S530-D534 PolarHBondContact O-N 3.1Å; D534-L536 VanDerWaalsContact C-N 3.32Å; D534-C537 PolarHBondContact O-N 3.44Å; D534-K538 PolarHBondContact O-N 3.12Å
535	S	38.9	Very low	36.6	Very low	58 Å²	58	111.3 Å²	111.3	41%	0.406	59%	0.59	S	S	.	*	H	α-helix	trans	-66.9	-32.6	171.7	-175.6	0	0	0	0	112.7	D531 F532 L533 N539	D531-S535 WeakPolarHBondContact O-CB 3.38Å; D531-S535 PolarHBondContact O-N 3.45Å; F532-S535 PolarHBondContact O-N 2.93Å; L533-S535 VanDerWaalsContact C-N 3.33Å; L533-S535 PolarHBondContact O-N 3.03Å; S535-N539 PolarHBondContact O-N 2.95Å; S535-N539 PolarHBondContact O-ND2 2.92Å
536	L	31	Very low	36.8	Very low	51 Å²	51	108.4 Å²	108.4	27%	0.267	58%	0.583	S	S	.	*	H	α-helix	trans	-71.4	-32.8	175.5	-84.7	163.3	0	0	0	112.1	F532 L533 D534	F532-L536 HydrophobicContact CD1-CD1 3.79Å; F532-L536 HydrophobicContact CE1-CD1 3.47Å; F532-L536 VanDerWaalsContact CE1-CD1 3.47Å; F532-L536 HydrophobicContact CE1-CG 4.38Å; F532-L536 HydrophobicContact CZ-CD1 4.09Å; F532-L536 PolarHBondContact O-N 3.18Å; F532-L536 VanDerWaalsContact O-N 3.08Å; L533-L536 HydrophobicContact CD2-CD1 4.39Å; L533-L536 WeakPolarHBondContact O-CB 3.34Å; L533-L536 PolarHBondContact O-N 2.9Å; L533-L536 VanDerWaalsContact O-N 3.16Å; D534-L536 VanDerWaalsContact C-N 3.32Å
537	C	41.6	Very low	37.2	Very low	111 Å²	111	105.3 Å²	105.3	75%	0.75	56%	0.562	S	S	*	*	H	α-helix	trans	-75.5	-28.9	177.2	-70.2	0	0	0	0	113.2	L533 D534	L533-C537 PolarHBondContact O-N 3.25Å; L533-C537 PolarHBondContact O-SG 2.84Å; L533-C537 VanDerWaalsContact O-SG 3.42Å; D534-C537 PolarHBondContact O-N 3.44Å
538	K	43.1	Very low	37.2	Very low	173 Å²	173	99.6 Å²	99.6	75%	0.752	54%	0.537	S	S	*	.	H	α-helix	trans	-85.6	-27	-178.5	-75.5	178.4	-178.2	169.7	0	114.2	D534	D534-K538 PolarHBondContact O-N 3.12Å
539	N	34.8	Very low	37.5	Very low	82 Å²	82	94.2 Å²	94.2	44%	0.439	51%	0.512	S	S	.	.	S	Bend	trans	-96.6	114.9	178.5	-67.4	-23.8	0	0	0	108.3	S535 L541 I544	S535-N539 PolarHBondContact O-N 2.95Å; S535-N539 PolarHBondContact O-ND2 2.92Å; N539-L541 PolarHBondContact O-N 3.43Å; N539-I544 HydrophobicContact CB-CD1 4.35Å
540	D	39	Very low	37.7	Very low	137 Å²	137	90.3 Å²	90.3	73%	0.733	51%	0.512	S	S	*	.			trans	-39.6	116.8	173.3	-72.9	-40.7	0	0	0	109.7	T542 C543	D540-T542 PolarHBondContact O-N 3.37Å; D540-C543 PolarHBondContact O-N 3.07Å
541	L	36.1	Very low	37.3	Very low	85 Å²	85	91.7 Å²	91.7	45%	0.445	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-11.8	-169.1	-88.8	117.9	0	0	0	114.9	N539 C543 T545	N539-L541 PolarHBondContact O-N 3.43Å; L541-C543 PolarHBondContact O-N 3.42Å; L541-T545 PolarHBondContact O-OG1 3.04Å
542	T	33.1	Very low	37.3	Very low	74 Å²	74	90.6 Å²	90.6	45%	0.454	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-36.5	-179.3	53.5	0	0	0	0	112.5	D540	D540-T542 PolarHBondContact O-N 3.37Å
543	C	32.9	Very low	37.9	Very low	112 Å²	112	87 Å²	87	76%	0.757	50%	0.496	S	S	*	.	H	α-helix	trans	-82.2	-26.6	-170.4	-65.1	0	0	0	0	114.8	D540 L541	D540-C543 PolarHBondContact O-N 3.07Å; L541-C543 PolarHBondContact O-N 3.42Å
544	I	33.1	Very low	38.5	Very low	104 Å²	104	86.6 Å²	86.6	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-99.9	-31.8	-169.1	-58.9	177.4	0	0	0	112.7	N539	N539-I544 HydrophobicContact CB-CD1 4.35Å
545	T	38.7	Very low	39.1	Very low	71 Å²	71	83.8 Å²	83.8	44%	0.436	48%	0.482	S	S	.	.	H	α-helix	trans	-89.9	-12.7	178.4	61.5	0	0	0	0	113.4	L541 I547	L541-T545 PolarHBondContact O-OG1 3.04Å; T545-I547 PolarHBondContact O-N 2.85Å
546	G	35	Very low	40.1	Very low	57 Å²	57	85.1 Å²	85.1	59%	0.588	49%	0.491	S	S	*	.			trans	61.1	6.3	-173	0	0	0	0	0	113.8
547	I	40.3	Very low	41.5	Very low	46 Å²	46	88.2 Å²	88.2	24%	0.236	51%	0.505	C	S	.	.			trans	-102.6	95.9	177.7	-60	168	0	0	0	106	T545 W549	T545-I547 PolarHBondContact O-N 2.85Å; I547-W549 HydrophobicContact CG2-CD2 3.83Å; I547-W549 HydrophobicContact CG2-CE3 4.27Å; I547-W549 HydrophobicContact CG2-CG 4.25Å; I547-W549 HydrophobicContact CG2-CH2 4.4Å; I547-W549 HydrophobicContact CG2-CZ2 3.92Å; I547-W549 PolarHBondContact O-N 3.5Å; I547-W549 VanDerWaalsContact O-N 3.09Å
548	D	40.6	Very low	42.7	Very low	65 Å²	65	84.4 Å²	84.4	35%	0.348	47%	0.474	S	S	.	.			trans	-71.7	97.8	166.6	-173.6	-1.4	0	0	0	108.7	S550 M551	D548-S550 PolarHBondContact O-N 2.95Å; D548-S550 VanDerWaalsContact O-N 3.17Å; D548-S550 WeakPolarHBondContact OD1-CB 3.33Å; D548-S550 PolarHBondContact OD1-N 3.36Å; D548-S550 PolarHBondContact OD1-OG 3.45Å; D548-S550 PolarHBondContact OD2-OG 3.02Å; D548-M551 HydrophobicContact CB-CG 4.15Å; D548-M551 PolarHBondContact O-N 3.34Å
549	W	45.2	Very low	43.9	Very low	68 Å²	68	80.5 Å²	80.5	26%	0.258	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-10.4	177.8	-62.3	95.9	0	0	0	113.5	L470 I547 Y596	L470-W549 HydrophobicContact CD1-CE3 4.38Å; L470-W549 HydrophobicContact CD1-CH2 3.27Å; L470-W549 HydrophobicContact CD1-CZ2 4.38Å; L470-W549 HydrophobicContact CD1-CZ3 3.26Å; L470-W549 HydrophobicContact CD2-CE3 4.39Å; L470-W549 HydrophobicContact CD2-CZ3 3.92Å; L470-W549 HydrophobicContact CG-CZ3 4.25Å; I547-W549 HydrophobicContact CG2-CD2 3.83Å; I547-W549 HydrophobicContact CG2-CE3 4.27Å; I547-W549 HydrophobicContact CG2-CG 4.25Å; I547-W549 HydrophobicContact CG2-CH2 4.4Å; I547-W549 HydrophobicContact CG2-CZ2 3.92Å; I547-W549 PolarHBondContact O-N 3.5Å; I547-W549 VanDerWaalsContact O-N 3.09Å; W549-Y596 HydrophobicContact CE3-CD1 4.36Å; W549-Y596 AromaticContact CE3-CE1 3.82Å; W549-Y596 HydrophobicContact CE3-CE1 3.82Å; W549-Y596 HydrophobicContact CZ3-CE1 4.19Å
550	S	37.7	Very low	45.6	Very low	94 Å²	94	79.4 Å²	79.4	66%	0.657	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-9.7	-177.5	76.4	0	0	0	0	114.2	D548 P552	D548-S550 PolarHBondContact O-N 2.95Å; D548-S550 VanDerWaalsContact O-N 3.17Å; D548-S550 WeakPolarHBondContact OD1-CB 3.33Å; D548-S550 PolarHBondContact OD1-N 3.36Å; D548-S550 PolarHBondContact OD1-OG 3.45Å; D548-S550 PolarHBondContact OD2-OG 3.02Å; S550-P552 VanDerWaalsContact O-CD 3.29Å; S550-P552 WeakPolarHBondContact O-CD 3.45Å
551	M	32.5	Very low	47.3	Very low	97 Å²	97	74.8 Å²	74.8	48%	0.478	43%	0.433	S	S	.	.	S	Bend	trans	-72	120.2	178.4	-74	-110.4	83.7	0	0	111	D548 F553	D548-M551 HydrophobicContact CB-CG 4.15Å; D548-M551 PolarHBondContact O-N 3.34Å; M551-F553 WeakPolarHBondContact O-CD2 3.34Å; M551-F553 PolarHBondContact O-N 3.39Å
552	P	40.2	Very low	49	Very low	96 Å²	96	72.6 Å²	72.6	62%	0.623	43%	0.425	S	S	*	.			trans	-71.1	101.8	172.3	28	-30.7	0	0	0	109.3	S550 T554	S550-P552 VanDerWaalsContact O-CD 3.29Å; S550-P552 WeakPolarHBondContact O-CD 3.45Å; P552-T554 VanDerWaalsContact C-N 3.29Å; P552-T554 HydrophobicContact CB-CG2 4.13Å; P552-T554 PolarHBondContact O-N 2.89Å
553	F	47.7	Very low	51	Low	59 Å²	59	75.6 Å²	75.6	26%	0.259	43%	0.434	S	S	.	.			trans	-64.7	84.3	171.6	-66.2	-86.4	0	0	0	109.9	L470 M551 N555	L470-F553 HydrophobicContact CD2-CE2 4.28Å; L470-F553 HydrophobicContact CD2-CZ 4.48Å; M551-F553 WeakPolarHBondContact O-CD2 3.34Å; M551-F553 PolarHBondContact O-N 3.39Å; F553-N555 PolarHBondContact O-N 3.28Å
554	T	47.2	Very low	53.2	Low	81 Å²	81	74.6 Å²	74.6	50%	0.497	42%	0.418	S	S	.	.			trans	-100.3	84.5	-176.5	49.9	0	0	0	0	109.9	P552 E559	P552-T554 VanDerWaalsContact C-N 3.29Å; P552-T554 HydrophobicContact CB-CG2 4.13Å; P552-T554 PolarHBondContact O-N 2.89Å; T554-E559 HydrophobicContact CG2-CG 4.04Å; T554-E559 WeakPolarHBondContact CG2-OE1 3.36Å
555	N	53.4	Low	55.3	Low	38 Å²	38	72.8 Å²	72.8	20%	0.203	41%	0.413	C	S	.	.			trans	-72.6	129.8	151.4	-175.6	17.2	0	0	0	107.1	H465 F553 Q557 Y558 E559	H465-N555 PolarHBondContact CE1-ND2 3.44Å; H465-N555 PolarHBondContact NE2-ND2 3.26Å; F553-N555 PolarHBondContact O-N 3.28Å; N555-Q557 PolarHBondContact O-N 3.4Å; N555-Q557 VanDerWaalsContact O-N 3.09Å; N555-Y558 WeakPolarHBondContact O-CB 3.5Å; N555-Y558 PolarHBondContact O-N 2.82Å; N555-E559 PolarHBondContact O-N 2.78Å
556	S	58	Low	57.3	Low	87 Å²	87	70.3 Å²	70.3	61%	0.608	40%	0.397	S	S	*	.	H	α-helix	trans	-56	-29.9	-178.3	57.3	0	0	0	0	112.8	S560	S556-S560 PolarHBondContact O-N 3.37Å; S556-S560 VanDerWaalsContact O-N 3.14Å
557	Q	61.2	Low	59.3	Low	116 Å²	116	71 Å²	71	54%	0.542	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-41.6	173	-67.9	179.1	-20.9	0	0	112.6	N555 S560 I561	N555-Q557 PolarHBondContact O-N 3.4Å; N555-Q557 VanDerWaalsContact O-N 3.09Å; Q557-S560 PolarHBondContact O-N 2.75Å; Q557-S560 PolarHBondContact O-OG 3.27Å; Q557-I561 WeakPolarHBondContact O-CG1 3.25Å; Q557-I561 PolarHBondContact O-N 2.97Å; Q557-I561 VanDerWaalsContact O-N 3.09Å
558	Y	67.4	Low	61.4	Low	30 Å²	30	71.7 Å²	71.7	12%	0.118	40%	0.399	C	S	.	.	H	α-helix	trans	-65.6	-45.1	179.6	-179.5	-95	0	0	0	111.4	N555 S560 I561 S562 Y575 Y578	N555-Y558 WeakPolarHBondContact O-CB 3.5Å; N555-Y558 PolarHBondContact O-N 2.82Å; Y558-S560 VanDerWaalsContact C-N 3.3Å; Y558-S560 PolarHBondContact O-N 3.25Å; Y558-I561 PolarHBondContact O-N 2.84Å; Y558-S562 WeakPolarHBondContact O-CB 3.49Å; Y558-S562 PolarHBondContact O-N 3.45Å; Y558-Y575 AromaticContact CD2-CD2 3.96Å; Y558-Y575 HydrophobicContact CD2-CD2 3.96Å; Y558-Y575 HydrophobicContact CD2-CE2 4.23Å; Y558-Y575 AromaticContact CE2-CD2 3.51Å; Y558-Y575 HydrophobicContact CE2-CD2 3.51Å; Y558-Y575 AromaticContact CE2-CE2 3.46Å; Y558-Y575 HydrophobicContact CE2-CE2 3.46Å; Y558-Y575 VanDerWaalsContact CE2-CE2 3.46Å; Y558-Y575 AromaticContact CZ-CE2 3.8Å; Y558-Y578 HydrophobicContact CD2-CD1 4.15Å; Y558-Y578 HydrophobicContact CD2-CE1 4.32Å; Y558-Y578 HydrophobicContact CD2-CG 4.44Å; Y558-Y578 HydrophobicContact CE1-CE1 4.49Å; Y558-Y578 AromaticContact CE2-CD1 3.37Å; Y558-Y578 HydrophobicContact CE2-CD1 3.37Å; Y558-Y578 AromaticContact CE2-CE1 3.47Å; Y558-Y578 HydrophobicContact CE2-CE1 3.47Å; Y558-Y578 VanDerWaalsContact CE2-CE1 3.47Å; Y558-Y578 HydrophobicContact CE2-CG 4.07Å; Y558-Y578 AromaticContact CZ-CD1 3.95Å; Y558-Y578 AromaticContact CZ-CE1 3.56Å; Y558-Y578 WeakPolarHBondContact OH-CE1 3.45Å
559	E	66.9	Low	63.5	Low	91 Å²	91	69.4 Å²	69.4	43%	0.425	39%	0.385	S	S	.	.	H	α-helix	trans	-57.6	-44.3	174.9	-71.6	-169.1	153.4	0	0	111.5	T554 N555 I561 S562 Q563	T554-E559 HydrophobicContact CG2-CG 4.04Å; T554-E559 WeakPolarHBondContact CG2-OE1 3.36Å; N555-E559 PolarHBondContact O-N 2.78Å; E559-I561 VanDerWaalsContact C-N 3.34Å; E559-I561 PolarHBondContact O-N 2.89Å; E559-S562 PolarHBondContact O-N 3.2Å; E559-S562 PolarHBondContact O-OG 3.33Å; E559-Q563 WeakPolarHBondContact O-CG 3.3Å; E559-Q563 PolarHBondContact O-N 2.86Å
560	S	71.3	Confident	65.6	Low	60 Å²	60	68.2 Å²	68.2	42%	0.42	38%	0.383	S	S	.	.	H	α-helix	trans	-61.9	-38.2	178.9	76.8	0	0	0	0	113.4	S556 Q557 Y558	S556-S560 PolarHBondContact O-N 3.37Å; S556-S560 VanDerWaalsContact O-N 3.14Å; Q557-S560 PolarHBondContact O-N 2.75Å; Q557-S560 PolarHBondContact O-OG 3.27Å; Y558-S560 VanDerWaalsContact C-N 3.3Å; Y558-S560 PolarHBondContact O-N 3.25Å
561	I	75.1	Confident	67.9	Low	39 Å²	39	68.3 Å²	68.3	20%	0.2	38%	0.379	C	S	.	.	H	α-helix	trans	-77.5	-37.6	178.5	-66.7	163.7	0	0	0	110.7	Q557 Y558 E559 Q563 Q564 R569 D572 Y575	Q557-I561 WeakPolarHBondContact O-CG1 3.25Å; Q557-I561 PolarHBondContact O-N 2.97Å; Q557-I561 VanDerWaalsContact O-N 3.09Å; Y558-I561 PolarHBondContact O-N 2.84Å; E559-I561 VanDerWaalsContact C-N 3.34Å; E559-I561 PolarHBondContact O-N 2.89Å; I561-Q563 PolarHBondContact O-N 2.7Å; I561-Q563 VanDerWaalsContact O-N 3.09Å; I561-Q564 VanDerWaalsContact O-CB 3.25Å; I561-Q564 WeakPolarHBondContact O-CB 3.14Å; I561-Q564 WeakPolarHBondContact O-CG 3.35Å; I561-Q564 PolarHBondContact O-N 2.85Å; I561-R569 HydrophobicContact CG2-CG 4.32Å; I561-R569 WeakPolarHBondContact O-CD 3.35Å; I561-R569 VanDerWaalsContact O-CG 3.32Å; I561-R569 WeakPolarHBondContact O-CG 3.45Å; I561-D572 HydrophobicContact CG2-CB 4.44Å; I561-Y575 HydrophobicContact CG2-CD2 3.83Å; I561-Y575 HydrophobicContact CG2-CE2 4.47Å; I561-Y575 HydrophobicContact CG2-CG 3.98Å
562	S	72.3	Confident	70.7	Confident	40 Å²	40	65.2 Å²	65.2	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-24.1	178.6	77	0	0	0	0	113.8	Y558 E559	Y558-S562 WeakPolarHBondContact O-CB 3.49Å; Y558-S562 PolarHBondContact O-N 3.45Å; E559-S562 PolarHBondContact O-N 3.2Å; E559-S562 PolarHBondContact O-OG 3.33Å
563	Q	73.5	Confident	73	Confident	137 Å²	137	61.1 Å²	61.1	64%	0.64	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-8.5	177.7	-66.5	177.2	4.1	0	0	113.3	E559 I561	E559-Q563 WeakPolarHBondContact O-CG 3.3Å; E559-Q563 PolarHBondContact O-N 2.86Å; I561-Q563 PolarHBondContact O-N 2.7Å; I561-Q563 VanDerWaalsContact O-N 3.09Å
564	Q	79.2	Confident	74.9	Confident	91 Å²	91	59.5 Å²	59.5	43%	0.425	33%	0.332	S	S	.	.	S	Bend	trans	-72.7	157.6	178.2	-62.6	-65.2	-38.8	0	0	111.8	I561 V568 R569	I561-Q564 VanDerWaalsContact O-CB 3.25Å; I561-Q564 WeakPolarHBondContact O-CB 3.14Å; I561-Q564 WeakPolarHBondContact O-CG 3.35Å; I561-Q564 PolarHBondContact O-N 2.85Å; Q564-V568 HydrophobicContact CB-CB 3.99Å; Q564-V568 HydrophobicContact CB-CG1 3.96Å; Q564-V568 HydrophobicContact CG-CG1 4.24Å; Q564-R569 HydrophobicContact CB-CG 4.24Å; Q564-R569 WeakPolarHBondContact O-CD 3.47Å; Q564-R569 PolarHBondContact O-NE 3.35Å
565	P	77.6	Confident	76.9	Confident	66 Å²	66	55.9 Å²	55.9	43%	0.429	31%	0.309	S	S	.	.			trans	-51.6	151.3	171.9	-25.8	35	0	0	0	112.4	S567 V568 R569	P565-S567 VanDerWaalsContact C-N 3.25Å; P565-S567 PolarHBondContact O-N 2.97Å; P565-V568 HydrophobicContact CB-CG2 4.41Å; P565-V568 HydrophobicContact CG-CG2 4.5Å; P565-V568 WeakPolarHBondContact O-CB 3.44Å; P565-V568 PolarHBondContact O-N 3.34Å; P565-R569 PolarHBondContact O-N 3.32Å; P565-R569 VanDerWaalsContact O-N 3.14Å
566	L	81.6	Confident	78.8	Confident	19 Å²	19	54 Å²	54	10%	0.099	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-38.6	-175.1	-176.2	62.1	0	0	0	112	V568 R569 E570 D604 L821 D872	L566-V568 VanDerWaalsContact C-N 3.27Å; L566-V568 PolarHBondContact O-N 3.36Å; L566-R569 PolarHBondContact O-N 3.36Å; L566-R569 VanDerWaalsContact O-N 3.1Å; L566-E570 HydrophobicContact CD1-CG 4.12Å; L566-E570 HydrophobicContact CG-CG 4.18Å; L566-E570 WeakPolarHBondContact O-CG 3.03Å; L566-E570 PolarHBondContact O-N 3.27Å; L566-D604 HydrophobicContact CD1-CB 4.17Å; L566-L821 HydrophobicContact CD2-CD2 3.89Å; L566-D872 WeakPolarHBondContact CB-OD1 3.2Å
567	S	77.1	Confident	80.3	Confident	72 Å²	72	49.9 Å²	49.9	50%	0.503	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-33.4	177	56.6	0	0	0	0	114.1	P565 T571	P565-S567 VanDerWaalsContact C-N 3.25Å; P565-S567 PolarHBondContact O-N 2.97Å; S567-T571 PolarHBondContact O-OG1 2.98Å
568	V	82.9	Confident	81.6	Confident	60 Å²	60	45.2 Å²	45.2	36%	0.364	25%	0.248	S	C	.	.	H	α-helix	trans	-74.5	-43.2	174.9	179.6	0	0	0	0	109.7	Q564 P565 L566 E570 T571 D572	Q564-V568 HydrophobicContact CB-CB 3.99Å; Q564-V568 HydrophobicContact CB-CG1 3.96Å; Q564-V568 HydrophobicContact CG-CG1 4.24Å; P565-V568 HydrophobicContact CB-CG2 4.41Å; P565-V568 HydrophobicContact CG-CG2 4.5Å; P565-V568 WeakPolarHBondContact O-CB 3.44Å; P565-V568 PolarHBondContact O-N 3.34Å; L566-V568 VanDerWaalsContact C-N 3.27Å; L566-V568 PolarHBondContact O-N 3.36Å; V568-E570 PolarHBondContact O-N 3.07Å; V568-T571 PolarHBondContact O-N 3.21Å; V568-T571 PolarHBondContact O-OG1 3.24Å; V568-T571 VanDerWaalsContact O-OG1 3.14Å; V568-D572 PolarHBondContact O-N 3.22Å
569	R	86.2	Confident	82.7	Confident	17 Å²	17	43.8 Å²	43.8	6%	0.064	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-39.5	179	-68.1	-172.3	-71.6	147.6	-1.1	112.7	I561 Q564 P565 L566 T571 D572 Y575 Q576 D604	I561-R569 HydrophobicContact CG2-CG 4.32Å; I561-R569 WeakPolarHBondContact O-CD 3.35Å; I561-R569 VanDerWaalsContact O-CG 3.32Å; I561-R569 WeakPolarHBondContact O-CG 3.45Å; Q564-R569 HydrophobicContact CB-CG 4.24Å; Q564-R569 WeakPolarHBondContact O-CD 3.47Å; Q564-R569 PolarHBondContact O-NE 3.35Å; P565-R569 PolarHBondContact O-N 3.32Å; P565-R569 VanDerWaalsContact O-N 3.14Å; L566-R569 PolarHBondContact O-N 3.36Å; L566-R569 VanDerWaalsContact O-N 3.1Å; R569-T571 PolarHBondContact O-N 3.28Å; R569-D572 PolarHBondContact O-N 2.99Å; R569-Y575 HydrophobicContact CB-CD1 4Å; R569-Y575 HydrophobicContact CB-CE1 3.69Å; R569-Y575 HydrophobicContact CG-CE1 4.19Å; R569-Y575 PolarHBondContact NH1-OH 3.1Å; R569-Y575 WeakPolarHBondContact O-CD1 3.48Å; R569-Q576 PolarHBondContact O-NE2 3.24Å; R569-D604 IonicContact NH1-OD1 3.42Å; R569-D604 PolarHBondContact NH1-OD1 3.36Å; R569-D604 IonicContact NH1-OD2 3.82Å
570	E	87.7	Confident	83.9	Confident	43 Å²	43	39.4 Å²	39.4	20%	0.201	22%	0.222	C	C	.	.	H	α-helix	trans	-68.9	-18.9	178.3	-74.7	-169.5	147	0	0	113.8	L361 L566 V568 P607 R610 L821	L361-E570 WeakPolarHBondContact CD2-O 3.2Å; L566-E570 HydrophobicContact CD1-CG 4.12Å; L566-E570 HydrophobicContact CG-CG 4.18Å; L566-E570 WeakPolarHBondContact O-CG 3.03Å; L566-E570 PolarHBondContact O-N 3.27Å; V568-E570 PolarHBondContact O-N 3.07Å; E570-P607 HydrophobicContact CB-CG 4.44Å; E570-P607 HydrophobicContact CG-CG 3.93Å; E570-P607 WeakPolarHBondContact OE1-CG 3.36Å; E570-R610 IonicContact OE1-NH2 3.01Å; E570-R610 PolarHBondContact OE1-NH2 3.46Å; E570-R610 VanDerWaalsContact OE1-NH2 3.14Å; E570-L821 VanDerWaalsContact OE1-CD2 3.25Å; E570-L821 WeakPolarHBondContact OE1-CD2 3.26Å
571	T	87.1	Confident	84.7	Confident	95 Å²	95	39 Å²	39	58%	0.583	21%	0.211	S	C	*	.	H	α-helix	trans	-105	-12.4	179.3	53.8	0	0	0	0	113.7	S567 V568 R569 V573	S567-T571 PolarHBondContact O-OG1 2.98Å; V568-T571 PolarHBondContact O-N 3.21Å; V568-T571 PolarHBondContact O-OG1 3.24Å; V568-T571 VanDerWaalsContact O-OG1 3.14Å; R569-T571 PolarHBondContact O-N 3.28Å; T571-V573 PolarHBondContact O-N 2.89Å
572	D	90.2	Very high	85.3	Confident	33 Å²	33	37.1 Å²	37.1	18%	0.176	20%	0.201	C	C	.	.			trans	-74.2	121.9	177.1	-174.9	-92.3	0	0	0	112	I561 V568 R569 D574 Y575 Q576	I561-D572 HydrophobicContact CG2-CB 4.44Å; V568-D572 PolarHBondContact O-N 3.22Å; R569-D572 PolarHBondContact O-N 2.99Å; D572-D574 PolarHBondContact OD1-N 3.24Å; D572-D574 VanDerWaalsContact OD1-N 3.17Å; D572-Y575 WeakPolarHBondContact OD1-CB 3.29Å; D572-Y575 PolarHBondContact OD1-N 3.44Å; D572-Q576 WeakPolarHBondContact O-CB 3.24Å; D572-Q576 VanDerWaalsContact O-CG 3.26Å; D572-Q576 WeakPolarHBondContact O-CG 3.23Å; D572-Q576 PolarHBondContact O-N 3.19Å
573	V	89.9	Confident	86.3	Confident	10 Å²	10	35.2 Å²	35.2	6%	0.061	19%	0.188	C	C	.	.	H	α-helix	trans	-62.1	-49.3	-174.9	-179.3	0	0	0	0	111.8	L361 T362 R458 T571 Q576 I577	L361-V573 HydrophobicContact CB-CB 4.48Å; L361-V573 HydrophobicContact CB-CG2 3.87Å; L361-V573 WeakPolarHBondContact O-CG2 3.43Å; T362-V573 HydrophobicContact CG2-CG1 3.88Å; T362-V573 HydrophobicContact CG2-CG2 3.84Å; R458-V573 HydrophobicContact CG-CB 4.34Å; R458-V573 HydrophobicContact CG-CG1 3.96Å; R458-V573 HydrophobicContact CG-CG2 4.37Å; T571-V573 PolarHBondContact O-N 2.89Å; V573-Q576 PolarHBondContact O-N 3.42Å; V573-I577 HydrophobicContact CG1-CD1 3.8Å; V573-I577 VanDerWaalsContact O-CG1 3.27Å; V573-I577 WeakPolarHBondContact O-CG1 3.24Å; V573-I577 PolarHBondContact O-N 3.26Å
574	D	87.8	Confident	87	Confident	25 Å²	25	30.2 Å²	30.2	13%	0.134	17%	0.167	C	C	.	.	H	α-helix	trans	-72.3	-39.1	-170.3	-61	-43.3	0	0	0	110.7	R458 T462 D572 Y578	R458-D574 IonicContact CZ-OD2 2.84Å; R458-D574 IonicContact NE-OD1 3.45Å; R458-D574 IonicContact NE-OD2 3.49Å; R458-D574 IonicContact NH2-OD2 2.69Å; R458-D574 PolarHBondContact NH2-OD2 3.36Å; T462-D574 WeakPolarHBondContact CB-OD1 3.49Å; T462-D574 HydrophobicContact CG2-CB 4.37Å; T462-D574 WeakPolarHBondContact CG2-OD1 3.43Å; T462-D574 PolarHBondContact OG1-OD1 3.11Å; D572-D574 PolarHBondContact OD1-N 3.24Å; D572-D574 VanDerWaalsContact OD1-N 3.17Å; D574-Y578 WeakPolarHBondContact O-CB 3.48Å; D574-Y578 PolarHBondContact O-N 3.38Å
575	Y	89	Confident	87.4	Confident	4 Å²	4	29.6 Å²	29.6	2%	0.016	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-48.1	174	-173.4	-100.6	0	0	0	112.1	Y558 I561 R569 D572 I577 Y578 R579 D604	Y558-Y575 AromaticContact CD2-CD2 3.96Å; Y558-Y575 HydrophobicContact CD2-CD2 3.96Å; Y558-Y575 HydrophobicContact CD2-CE2 4.23Å; Y558-Y575 AromaticContact CE2-CD2 3.51Å; Y558-Y575 HydrophobicContact CE2-CD2 3.51Å; Y558-Y575 AromaticContact CE2-CE2 3.46Å; Y558-Y575 HydrophobicContact CE2-CE2 3.46Å; Y558-Y575 VanDerWaalsContact CE2-CE2 3.46Å; Y558-Y575 AromaticContact CZ-CE2 3.8Å; I561-Y575 HydrophobicContact CG2-CD2 3.83Å; I561-Y575 HydrophobicContact CG2-CE2 4.47Å; I561-Y575 HydrophobicContact CG2-CG 3.98Å; R569-Y575 HydrophobicContact CB-CD1 4Å; R569-Y575 HydrophobicContact CB-CE1 3.69Å; R569-Y575 HydrophobicContact CG-CE1 4.19Å; R569-Y575 PolarHBondContact NH1-OH 3.1Å; R569-Y575 WeakPolarHBondContact O-CD1 3.48Å; D572-Y575 WeakPolarHBondContact OD1-CB 3.29Å; D572-Y575 PolarHBondContact OD1-N 3.44Å; Y575-I577 PolarHBondContact O-N 2.83Å; Y575-Y578 PolarHBondContact O-N 2.9Å; Y575-R579 HydrophobicContact CD1-CG 4.25Å; Y575-R579 HydrophobicContact CE1-CG 4.03Å; Y575-R579 HydrophobicContact CE2-CG 4.49Å; Y575-R579 VanDerWaalsContact O-CG 3.3Å; Y575-R579 WeakPolarHBondContact O-CG 3.37Å; Y575-R579 PolarHBondContact O-N 3.19Å; Y575-R579 PolarHBondContact OH-NH1 3.02Å; Y575-D604 WeakPolarHBondContact CE1-OD2 3.45Å; Y575-D604 PolarHBondContact OH-OD1 3.36Å; Y575-D604 PolarHBondContact OH-OD2 3.2Å; Y575-D604 VanDerWaalsContact OH-OD2 3.08Å
576	Q	92.9	Very high	87.9	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-67.8	-35.6	-179.4	-71.7	-55.3	-41.7	0	0	113	Y357 L361 R569 D572 V573 T580	Y357-Q576 HydrophobicContact CE1-CB 4.24Å; Y357-Q576 PolarHBondContact OH-OE1 3.23Å; Y357-Q576 VanDerWaalsContact OH-OE1 3.13Å; L361-Q576 HydrophobicContact CD1-CB 3.41Å; L361-Q576 VanDerWaalsContact CD1-CB 3.41Å; L361-Q576 HydrophobicContact CD1-CG 3.87Å; L361-Q576 HydrophobicContact CD2-CG 4.36Å; R569-Q576 PolarHBondContact O-NE2 3.24Å; D572-Q576 WeakPolarHBondContact O-CB 3.24Å; D572-Q576 VanDerWaalsContact O-CG 3.26Å; D572-Q576 WeakPolarHBondContact O-CG 3.23Å; D572-Q576 PolarHBondContact O-N 3.19Å; V573-Q576 PolarHBondContact O-N 3.42Å; Q576-T580 WeakPolarHBondContact O-CB 3.49Å; Q576-T580 PolarHBondContact O-N 2.97Å; Q576-T580 PolarHBondContact O-OG1 2.91Å
577	I	90.6	Very high	88.3	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.4	-53.3	171.2	-70.8	166.9	0	0	0	109.6	F345 Y358 I459 L467 V573 Y575 R579 T580 R581	F345-I577 HydrophobicContact CE1-CD1 4.35Å; F345-I577 HydrophobicContact CE2-CG2 4.04Å; F345-I577 HydrophobicContact CZ-CD1 4.28Å; F345-I577 HydrophobicContact CZ-CG1 4.38Å; F345-I577 HydrophobicContact CZ-CG2 3.66Å; Y358-I577 HydrophobicContact CD1-CD1 4.49Å; Y358-I577 HydrophobicContact CD1-CG1 3.54Å; Y358-I577 HydrophobicContact CD2-CG1 4.25Å; Y358-I577 HydrophobicContact CE1-CB 4.2Å; Y358-I577 HydrophobicContact CE1-CG1 3.55Å; Y358-I577 HydrophobicContact CE2-CG1 4.25Å; Y358-I577 HydrophobicContact CG-CD1 4.48Å; Y358-I577 HydrophobicContact CG-CG1 3.92Å; I459-I577 HydrophobicContact CD1-CD1 3.4Å; I459-I577 VanDerWaalsContact CD1-CD1 3.4Å; L467-I577 HydrophobicContact CD2-CD1 4.44Å; L467-I577 HydrophobicContact CD2-CG2 4.14Å; V573-I577 HydrophobicContact CG1-CD1 3.8Å; V573-I577 VanDerWaalsContact O-CG1 3.27Å; V573-I577 WeakPolarHBondContact O-CG1 3.24Å; V573-I577 PolarHBondContact O-N 3.26Å; Y575-I577 PolarHBondContact O-N 2.83Å; I577-R579 VanDerWaalsContact C-N 3.29Å; I577-R579 PolarHBondContact O-N 2.85Å; I577-T580 PolarHBondContact O-N 3.45Å; I577-R581 HydrophobicContact CG2-CG 4.34Å; I577-R581 VanDerWaalsContact O-CG 3.27Å; I577-R581 WeakPolarHBondContact O-CG 3.5Å; I577-R581 PolarHBondContact O-N 2.72Å
578	Y	87.8	Confident	88.8	Confident	17 Å²	17	28.3 Å²	28.3	7%	0.067	15%	0.145	C	C	.	.	H	α-helix	trans	-52.6	-49.6	179.3	170.4	-88.1	0	0	0	111.1	P469 Y558 D574 Y575 R581 L582	P469-Y578 HydrophobicContact CB-CD2 3.52Å; P469-Y578 HydrophobicContact CB-CE2 3.39Å; P469-Y578 HydrophobicContact CG-CD2 4.16Å; P469-Y578 HydrophobicContact CG-CE2 4.36Å; Y558-Y578 HydrophobicContact CD2-CD1 4.15Å; Y558-Y578 HydrophobicContact CD2-CE1 4.32Å; Y558-Y578 HydrophobicContact CD2-CG 4.44Å; Y558-Y578 HydrophobicContact CE1-CE1 4.49Å; Y558-Y578 AromaticContact CE2-CD1 3.37Å; Y558-Y578 HydrophobicContact CE2-CD1 3.37Å; Y558-Y578 AromaticContact CE2-CE1 3.47Å; Y558-Y578 HydrophobicContact CE2-CE1 3.47Å; Y558-Y578 VanDerWaalsContact CE2-CE1 3.47Å; Y558-Y578 HydrophobicContact CE2-CG 4.07Å; Y558-Y578 AromaticContact CZ-CD1 3.95Å; Y558-Y578 AromaticContact CZ-CE1 3.56Å; Y558-Y578 WeakPolarHBondContact OH-CE1 3.45Å; D574-Y578 WeakPolarHBondContact O-CB 3.48Å; D574-Y578 PolarHBondContact O-N 3.38Å; Y575-Y578 PolarHBondContact O-N 2.9Å; Y578-R581 PolarHBondContact O-N 3.18Å; Y578-L582 HydrophobicContact CE1-CD2 3.97Å; Y578-L582 WeakPolarHBondContact O-CB 3.35Å; Y578-L582 PolarHBondContact O-N 3.33Å
579	R	91.2	Very high	88.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-69	-43.5	-177.2	-65.3	-58.8	-73	-74	1.2	113.3	Y575 I577 R581 L582 F583 E600 D604 P606	Y575-R579 HydrophobicContact CD1-CG 4.25Å; Y575-R579 HydrophobicContact CE1-CG 4.03Å; Y575-R579 HydrophobicContact CE2-CG 4.49Å; Y575-R579 VanDerWaalsContact O-CG 3.3Å; Y575-R579 WeakPolarHBondContact O-CG 3.37Å; Y575-R579 PolarHBondContact O-N 3.19Å; Y575-R579 PolarHBondContact OH-NH1 3.02Å; I577-R579 VanDerWaalsContact C-N 3.29Å; I577-R579 PolarHBondContact O-N 2.85Å; R579-R581 VanDerWaalsContact C-N 3.3Å; R579-R581 PolarHBondContact O-N 3.46Å; R579-L582 PolarHBondContact O-N 3.28Å; R579-F583 WeakPolarHBondContact O-CD2 3.49Å; R579-F583 PolarHBondContact O-N 3.4Å; R579-E600 PolarHBondContact NH2-O 3.01Å; R579-D604 IonicContact CZ-OD1 2.6Å; R579-D604 IonicContact CZ-OD2 3.76Å; R579-D604 IonicContact NH1-OD1 3.06Å; R579-D604 PolarHBondContact NH1-OD1 2.67Å; R579-D604 IonicContact NH1-OD2 3.2Å; R579-D604 PolarHBondContact NH1-OD2 3.21Å; R579-D604 PolarHBondContact NH2-O 3.04Å; R579-D604 IonicContact NH2-OD1 3.17Å; R579-D604 PolarHBondContact NH2-OD1 3.36Å; R579-D604 IonicContact NH2-OD2 3.47Å; R579-D604 PolarHBondContact NH2-OD2 2.91Å; R579-P606 HydrophobicContact CB-CB 4.12Å; R579-P606 HydrophobicContact CB-CG 4.33Å
580	T	92.1	Very high	88.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-42.9	177.6	-60.9	0	0	0	0	111	E354 Y358 Q576 I577 T584 F608 L609	E354-T580 HydrophobicContact CG-CG2 4.14Å; Y358-T580 HydrophobicContact CE1-CG2 4.42Å; Y358-T580 VanDerWaalsContact OH-CB 3.3Å; Y358-T580 WeakPolarHBondContact OH-CB 3.48Å; Y358-T580 VanDerWaalsContact OH-CG2 3.24Å; Y358-T580 WeakPolarHBondContact OH-CG2 3.5Å; Q576-T580 WeakPolarHBondContact O-CB 3.49Å; Q576-T580 PolarHBondContact O-N 2.97Å; Q576-T580 PolarHBondContact O-OG1 2.91Å; I577-T580 PolarHBondContact O-N 3.45Å; T580-T584 WeakPolarHBondContact O-CB 3.43Å; T580-T584 PolarHBondContact O-N 3.29Å; T580-T584 PolarHBondContact O-OG1 3.46Å; T580-F608 HydrophobicContact CG2-CD1 3.75Å; T580-F608 HydrophobicContact CG2-CE1 4.38Å; T580-L609 HydrophobicContact CG2-CD1 3.95Å; T580-L609 HydrophobicContact CG2-CG 4.14Å; T580-L609 WeakPolarHBondContact O-CD1 3.42Å
581	R	88.1	Confident	88.8	Confident	50 Å²	50	30.5 Å²	30.5	19%	0.189	17%	0.17	C	C	.	.	H	α-helix	trans	-68.8	-39.7	177.7	-62.4	-55.2	-65.5	174.1	-5	112.5	E354 P469 I577 Y578 R579 R585	E354-R581 WeakPolarHBondContact OE1-CD 3.43Å; E354-R581 IonicContact OE1-NH1 3.73Å; E354-R581 PolarHBondContact OE1-NH1 3.17Å; E354-R581 IonicContact OE2-NH1 3.8Å; P469-R581 HydrophobicContact CG-CB 4.1Å; I577-R581 HydrophobicContact CG2-CG 4.34Å; I577-R581 VanDerWaalsContact O-CG 3.27Å; I577-R581 WeakPolarHBondContact O-CG 3.5Å; I577-R581 PolarHBondContact O-N 2.72Å; Y578-R581 PolarHBondContact O-N 3.18Å; R579-R581 VanDerWaalsContact C-N 3.3Å; R579-R581 PolarHBondContact O-N 3.46Å; R581-R585 PolarHBondContact O-N 3.18Å
582	L	87.5	Confident	88.8	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.3	-58.6	174.1	179.3	62.6	0	0	0	110.4	L470 Y578 R579 T584 R585 I586 Y596 E600	L470-L582 HydrophobicContact CD2-CD1 4.38Å; Y578-L582 HydrophobicContact CE1-CD2 3.97Å; Y578-L582 WeakPolarHBondContact O-CB 3.35Å; Y578-L582 PolarHBondContact O-N 3.33Å; R579-L582 PolarHBondContact O-N 3.28Å; L582-T584 VanDerWaalsContact C-N 3.33Å; L582-T584 PolarHBondContact O-N 2.99Å; L582-R585 WeakPolarHBondContact O-CB 3.44Å; L582-R585 PolarHBondContact O-N 3.2Å; L582-I586 HydrophobicContact CD1-CD1 4.16Å; L582-I586 HydrophobicContact CD1-CG1 4.39Å; L582-I586 HydrophobicContact CG-CD1 3.92Å; L582-I586 HydrophobicContact CG-CG1 4.48Å; L582-I586 WeakPolarHBondContact O-CG1 3.29Å; L582-I586 PolarHBondContact O-N 3.47Å; L582-Y596 HydrophobicContact CD1-CE1 4.15Å; L582-E600 HydrophobicContact CD2-CG 4.06Å
583	F	92.3	Very high	88.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.3	-37.5	-178.4	-87	-88.4	0	0	0	113.3	R579 R585 I586 I587 L597 E600 A601 D604 P606 L609 V613	R579-F583 WeakPolarHBondContact O-CD2 3.49Å; R579-F583 PolarHBondContact O-N 3.4Å; F583-R585 VanDerWaalsContact C-N 3.28Å; F583-R585 PolarHBondContact O-N 3.46Å; F583-I586 PolarHBondContact O-N 3.03Å; F583-I587 WeakPolarHBondContact O-CB 3.42Å; F583-I587 VanDerWaalsContact O-CG1 3.25Å; F583-I587 WeakPolarHBondContact O-CG1 3.3Å; F583-I587 PolarHBondContact O-N 3.4Å; F583-L597 HydrophobicContact CD1-CD1 3.76Å; F583-L597 HydrophobicContact CE1-CD1 3.83Å; F583-E600 HydrophobicContact CE1-CB 4.42Å; F583-E600 HydrophobicContact CE2-CB 4.26Å; F583-E600 HydrophobicContact CZ-CB 3.92Å; F583-A601 HydrophobicContact CE1-CB 4.31Å; F583-A601 HydrophobicContact CZ-CB 4.4Å; F583-D604 WeakPolarHBondContact CZ-O 3.39Å; F583-P606 HydrophobicContact CB-CG 4.19Å; F583-P606 HydrophobicContact CD2-CG 3.57Å; F583-P606 HydrophobicContact CE2-CG 4.08Å; F583-P606 HydrophobicContact CG-CG 3.96Å; F583-L609 HydrophobicContact CB-CD1 3.69Å; F583-V613 HydrophobicContact CD1-CG1 4.25Å; F583-V613 HydrophobicContact CD1-CG2 3.5Å; F583-V613 VanDerWaalsContact CD1-CG2 3.5Å; F583-V613 HydrophobicContact CE1-CG1 3.87Å; F583-V613 HydrophobicContact CE1-CG2 3.92Å; F583-V613 HydrophobicContact CG-CG2 4.23Å
584	T	89.4	Confident	88.6	Confident	33 Å²	33	31.5 Å²	31.5	20%	0.202	18%	0.179	C	C	.	.	H	α-helix	trans	-56.8	-44.3	174	-61.8	0	0	0	0	111.3	T580 L582 N588	T580-T584 WeakPolarHBondContact O-CB 3.43Å; T580-T584 PolarHBondContact O-N 3.29Å; T580-T584 PolarHBondContact O-OG1 3.46Å; L582-T584 VanDerWaalsContact C-N 3.33Å; L582-T584 PolarHBondContact O-N 2.99Å; T584-N588 WeakPolarHBondContact O-CB 3.34Å; T584-N588 PolarHBondContact O-N 2.94Å; T584-N588 VanDerWaalsContact O-N 3.07Å; T584-N588 PolarHBondContact O-ND2 3.08Å
585	R	86.6	Confident	88.5	Confident	78 Å²	78	37.5 Å²	37.5	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-67.2	-43.4	176.9	-108.5	143.4	157.5	179.3	2.5	112.5	L470 R581 L582 F583 N588 G589	L470-R585 HydrophobicContact CD1-CB 4.05Å; L470-R585 VanDerWaalsContact CD1-CD 3.5Å; L470-R585 HydrophobicContact CD1-CG 4.01Å; R581-R585 PolarHBondContact O-N 3.18Å; L582-R585 WeakPolarHBondContact O-CB 3.44Å; L582-R585 PolarHBondContact O-N 3.2Å; F583-R585 VanDerWaalsContact C-N 3.28Å; F583-R585 PolarHBondContact O-N 3.46Å; R585-N588 PolarHBondContact O-N 2.91Å; R585-G589 PolarHBondContact O-N 3.25Å; R585-G589 VanDerWaalsContact O-N 3.13Å
586	I	88	Confident	88.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-50.7	177.1	-62.7	177.5	0	0	0	110.1	L582 F583 N588 G589 L590 T593 Y596 L597 E600	L582-I586 HydrophobicContact CD1-CD1 4.16Å; L582-I586 HydrophobicContact CD1-CG1 4.39Å; L582-I586 HydrophobicContact CG-CD1 3.92Å; L582-I586 HydrophobicContact CG-CG1 4.48Å; L582-I586 WeakPolarHBondContact O-CG1 3.29Å; L582-I586 PolarHBondContact O-N 3.47Å; F583-I586 PolarHBondContact O-N 3.03Å; I586-N588 VanDerWaalsContact C-N 3.32Å; I586-N588 PolarHBondContact O-N 3.19Å; I586-G589 PolarHBondContact O-N 3.25Å; I586-L590 PolarHBondContact O-N 3.14Å; I586-T593 WeakPolarHBondContact O-CB 3.35Å; I586-T593 PolarHBondContact O-OG1 3.07Å; I586-Y596 HydrophobicContact CD1-CD1 3.41Å; I586-Y596 VanDerWaalsContact CD1-CD1 3.41Å; I586-Y596 HydrophobicContact CD1-CE1 3.38Å; I586-Y596 HydrophobicContact CG1-CD1 3.57Å; I586-Y596 HydrophobicContact CG1-CE1 3.67Å; I586-Y596 HydrophobicContact CG2-CD1 4.37Å; I586-L597 HydrophobicContact CG2-CB 3.58Å; I586-L597 HydrophobicContact CG2-CD1 3.79Å; I586-L597 HydrophobicContact CG2-CG 4.29Å; I586-E600 HydrophobicContact CD1-CB 4.04Å; I586-E600 HydrophobicContact CD1-CG 3.75Å
587	I	90	Very high	88.4	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.036	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-42.3	-178.9	-70.2	167	0	0	0	110.9	F583 G589 L590 L597 K612 V613 Y621	F583-I587 WeakPolarHBondContact O-CB 3.42Å; F583-I587 VanDerWaalsContact O-CG1 3.25Å; F583-I587 WeakPolarHBondContact O-CG1 3.3Å; F583-I587 PolarHBondContact O-N 3.4Å; I587-G589 PolarHBondContact O-N 3.38Å; I587-L590 HydrophobicContact CG2-CD1 4.4Å; I587-L590 WeakPolarHBondContact O-CB 3.46Å; I587-L590 WeakPolarHBondContact O-CG 3.36Å; I587-L590 PolarHBondContact O-N 3.42Å; I587-L597 HydrophobicContact CG1-CD1 4.33Å; I587-K612 HydrophobicContact CD1-CB 4.02Å; I587-V613 HydrophobicContact CD1-CG2 3.98Å; I587-Y621 HydrophobicContact CG2-CD1 3.89Å; I587-Y621 HydrophobicContact CG2-CE1 3.38Å
588	N	86.9	Confident	88.4	Confident	123 Å²	123	43.8 Å²	43.8	66%	0.658	23%	0.231	S	C	*	.	H	α-helix	trans	-66.5	-18	176.8	-69.8	-11.3	0	0	0	113.5	T584 R585 I586	T584-N588 WeakPolarHBondContact O-CB 3.34Å; T584-N588 PolarHBondContact O-N 2.94Å; T584-N588 VanDerWaalsContact O-N 3.07Å; T584-N588 PolarHBondContact O-ND2 3.08Å; R585-N588 PolarHBondContact O-N 2.91Å; I586-N588 VanDerWaalsContact C-N 3.32Å; I586-N588 PolarHBondContact O-N 3.19Å
589	G	85.7	Confident	88.4	Confident	29 Å²	29	46.5 Å²	46.5	30%	0.299	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	3.8	176.4	0	0	0	0	0	114.9	R585 I586 I587 A592 T593	R585-G589 PolarHBondContact O-N 3.25Å; R585-G589 VanDerWaalsContact O-N 3.13Å; I586-G589 PolarHBondContact O-N 3.25Å; I587-G589 PolarHBondContact O-N 3.38Å; G589-A592 PolarHBondContact O-N 2.99Å; G589-A592 VanDerWaalsContact O-N 3.14Å; G589-T593 PolarHBondContact O-N 2.77Å; G589-T593 PolarHBondContact O-OG1 3.02Å
590	L	85.9	Confident	88.4	Confident	26 Å²	26	47 Å²	47	14%	0.136	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	145.4	178.2	-72.1	168.8	0	0	0	111.1	I586 I587 T593 K594 L597 A616 Y621 P622	I586-L590 PolarHBondContact O-N 3.14Å; I587-L590 HydrophobicContact CG2-CD1 4.4Å; I587-L590 WeakPolarHBondContact O-CB 3.46Å; I587-L590 WeakPolarHBondContact O-CG 3.36Å; I587-L590 PolarHBondContact O-N 3.42Å; L590-T593 PolarHBondContact N-OG1 3.04Å; L590-K594 HydrophobicContact CD2-CB 4.03Å; L590-L597 HydrophobicContact CD1-CD2 4.48Å; L590-L597 HydrophobicContact CD2-CD2 4.39Å; L590-A616 HydrophobicContact CD1-CB 3.76Å; L590-Y621 HydrophobicContact CD1-CD1 4.32Å; L590-P622 HydrophobicContact CB-CG 4.21Å
591	P	86.9	Confident	88.4	Confident	110 Å²	110	47 Å²	47	71%	0.714	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	cis	-85.2	-9.1	5.9	33.8	-36	0	0	0	115	T593 K594	P591-T593 PolarHBondContact O-N 3.42Å; P591-K594 VanDerWaalsContact O-CB 3.25Å; P591-K594 WeakPolarHBondContact O-CB 3.19Å; P591-K594 PolarHBondContact O-N 3.36Å; P591-K594 VanDerWaalsContact O-N 3.09Å
592	A	85.5	Confident	88.5	Confident	73 Å²	73	46.1 Å²	46.1	60%	0.603	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.7	-173.4	0	0	0	0	0	113.3	G589	G589-A592 PolarHBondContact O-N 2.99Å; G589-A592 VanDerWaalsContact O-N 3.14Å
593	T	87.8	Confident	88.4	Confident	21 Å²	21	50.8 Å²	50.8	13%	0.129	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	7.2	-179.5	55.6	0	0	0	0	114.3	I586 G589 L590 P591 Q595 Y596 L597	I586-T593 WeakPolarHBondContact O-CB 3.35Å; I586-T593 PolarHBondContact O-OG1 3.07Å; G589-T593 PolarHBondContact O-N 2.77Å; G589-T593 PolarHBondContact O-OG1 3.02Å; L590-T593 PolarHBondContact N-OG1 3.04Å; P591-T593 PolarHBondContact O-N 3.42Å; T593-Q595 VanDerWaalsContact C-N 3.34Å; T593-Q595 PolarHBondContact O-N 2.92Å; T593-Y596 CarbonylContact O-C 3.57Å; T593-Y596 WeakPolarHBondContact O-CA 3.28Å; T593-Y596 WeakPolarHBondContact O-CB 3.27Å; T593-Y596 PolarHBondContact O-N 3.23Å; T593-L597 PolarHBondContact O-N 3.02Å
594	K	88.4	Confident	88.2	Confident	66 Å²	66	51.3 Å²	51.3	29%	0.287	27%	0.268	S	S	.	.	H	α-helix	trans	-56.8	-41.5	-172.2	-179.9	172.3	176.7	170.4	0	113.9	L590 P591 L597 R598 D619	L590-K594 HydrophobicContact CD2-CB 4.03Å; P591-K594 VanDerWaalsContact O-CB 3.25Å; P591-K594 WeakPolarHBondContact O-CB 3.19Å; P591-K594 PolarHBondContact O-N 3.36Å; P591-K594 VanDerWaalsContact O-N 3.09Å; K594-L597 PolarHBondContact O-N 3.27Å; K594-R598 VanDerWaalsContact CE-NH2 3.27Å; K594-R598 PolarHBondContact O-N 3.16Å; K594-D619 WeakPolarHBondContact CE-OD1 3.49Å; K594-D619 IonicContact NZ-OD1 3.43Å; K594-D619 PolarHBondContact NZ-OD1 2.51Å; K594-D619 IonicContact NZ-OD2 2.62Å; K594-D619 PolarHBondContact NZ-OD2 3.1Å
595	Q	86.7	Confident	88.5	Confident	150 Å²	150	49.9 Å²	49.9	70%	0.701	26%	0.259	S	S	*	.	H	α-helix	trans	-66	-41.7	176.6	-177.5	175.7	-9.2	0	0	111.3	T593 R598 L599	T593-Q595 VanDerWaalsContact C-N 3.34Å; T593-Q595 PolarHBondContact O-N 2.92Å; Q595-R598 WeakPolarHBondContact O-CB 3.34Å; Q595-R598 PolarHBondContact O-N 3.44Å; Q595-L599 HydrophobicContact CG-CD1 4.46Å; Q595-L599 WeakPolarHBondContact O-CG 3.44Å; Q595-L599 PolarHBondContact O-N 3.15Å
596	Y	87.9	Confident	88.8	Confident	41 Å²	41	46.2 Å²	46.2	16%	0.161	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-36.7	178.8	-169.4	-112	0	0	0	112.2	W549 L582 I586 T593 R598 L599 E600	W549-Y596 HydrophobicContact CE3-CD1 4.36Å; W549-Y596 AromaticContact CE3-CE1 3.82Å; W549-Y596 HydrophobicContact CE3-CE1 3.82Å; W549-Y596 HydrophobicContact CZ3-CE1 4.19Å; L582-Y596 HydrophobicContact CD1-CE1 4.15Å; I586-Y596 HydrophobicContact CD1-CD1 3.41Å; I586-Y596 VanDerWaalsContact CD1-CD1 3.41Å; I586-Y596 HydrophobicContact CD1-CE1 3.38Å; I586-Y596 HydrophobicContact CG1-CD1 3.57Å; I586-Y596 HydrophobicContact CG1-CE1 3.67Å; I586-Y596 HydrophobicContact CG2-CD1 4.37Å; T593-Y596 CarbonylContact O-C 3.57Å; T593-Y596 WeakPolarHBondContact O-CA 3.28Å; T593-Y596 WeakPolarHBondContact O-CB 3.27Å; T593-Y596 PolarHBondContact O-N 3.23Å; Y596-R598 VanDerWaalsContact C-N 3.31Å; Y596-R598 PolarHBondContact O-N 3.1Å; Y596-L599 PolarHBondContact O-N 2.99Å; Y596-E600 HydrophobicContact CD1-CG 4.38Å; Y596-E600 HydrophobicContact CE1-CG 3.99Å; Y596-E600 HydrophobicContact CE2-CG 4.28Å; Y596-E600 PolarHBondContact O-N 3.47Å
597	L	91.6	Very high	89.2	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-55.7	-46	170.5	-179.2	67.9	0	0	0	111.8	F583 I586 I587 L590 T593 K594 A601 V613 A616 L617	F583-L597 HydrophobicContact CD1-CD1 3.76Å; F583-L597 HydrophobicContact CE1-CD1 3.83Å; I586-L597 HydrophobicContact CG2-CB 3.58Å; I586-L597 HydrophobicContact CG2-CD1 3.79Å; I586-L597 HydrophobicContact CG2-CG 4.29Å; I587-L597 HydrophobicContact CG1-CD1 4.33Å; L590-L597 HydrophobicContact CD1-CD2 4.48Å; L590-L597 HydrophobicContact CD2-CD2 4.39Å; T593-L597 PolarHBondContact O-N 3.02Å; K594-L597 PolarHBondContact O-N 3.27Å; L597-A601 WeakPolarHBondContact O-CB 3.5Å; L597-A601 PolarHBondContact O-N 3.48Å; L597-V613 HydrophobicContact CD1-CG1 4.29Å; L597-A616 HydrophobicContact CD2-CB 3.54Å; L597-L617 HydrophobicContact CD2-CD2 4.1Å; L597-L617 HydrophobicContact CD2-CG 4.29Å; L597-L617 HydrophobicContact CG-CD2 4.06Å; L597-L617 HydrophobicContact CG-CG 4.49Å
598	R	90.7	Very high	89.4	Confident	94 Å²	94	49.2 Å²	49.2	36%	0.355	26%	0.261	S	S	.	.	H	α-helix	trans	-62.4	-48.5	177	-71.7	177.6	177.4	159	-3.6	110.8	K594 Q595 Y596 E600 A601 R602 L617	K594-R598 VanDerWaalsContact CE-NH2 3.27Å; K594-R598 PolarHBondContact O-N 3.16Å; Q595-R598 WeakPolarHBondContact O-CB 3.34Å; Q595-R598 PolarHBondContact O-N 3.44Å; Y596-R598 VanDerWaalsContact C-N 3.31Å; Y596-R598 PolarHBondContact O-N 3.1Å; R598-E600 VanDerWaalsContact C-N 3.35Å; R598-E600 PolarHBondContact O-N 3.32Å; R598-A601 PolarHBondContact O-N 3.01Å; R598-R602 WeakPolarHBondContact O-CG 3.45Å; R598-R602 PolarHBondContact O-N 3.05Å; R598-L617 HydrophobicContact CG-CD2 3.71Å
599	L	88	Confident	89.8	Confident	73 Å²	73	43.7 Å²	43.7	38%	0.382	23%	0.232	S	C	.	.	H	α-helix	trans	-58.6	-43.4	-180	-68	174.6	0	0	0	112.8	Q595 Y596	Q595-L599 HydrophobicContact CG-CD1 4.46Å; Q595-L599 WeakPolarHBondContact O-CG 3.44Å; Q595-L599 PolarHBondContact O-N 3.15Å; Y596-L599 PolarHBondContact O-N 2.99Å
600	E	89.8	Confident	90.3	Very high	10 Å²	10	43.2 Å²	43.2	5%	0.047	22%	0.221	C	C	.	.	H	α-helix	trans	-73.6	-34.8	177.8	-68.2	-55.2	138.2	0	0	112.9	R579 L582 F583 I586 Y596 R598 R602 K603 D604	R579-E600 PolarHBondContact NH2-O 3.01Å; L582-E600 HydrophobicContact CD2-CG 4.06Å; F583-E600 HydrophobicContact CE1-CB 4.42Å; F583-E600 HydrophobicContact CE2-CB 4.26Å; F583-E600 HydrophobicContact CZ-CB 3.92Å; I586-E600 HydrophobicContact CD1-CB 4.04Å; I586-E600 HydrophobicContact CD1-CG 3.75Å; Y596-E600 HydrophobicContact CD1-CG 4.38Å; Y596-E600 HydrophobicContact CE1-CG 3.99Å; Y596-E600 HydrophobicContact CE2-CG 4.28Å; Y596-E600 PolarHBondContact O-N 3.47Å; R598-E600 VanDerWaalsContact C-N 3.35Å; R598-E600 PolarHBondContact O-N 3.32Å; E600-R602 VanDerWaalsContact C-N 3.31Å; E600-R602 PolarHBondContact O-N 2.86Å; E600-K603 WeakPolarHBondContact O-CB 3.39Å; E600-K603 PolarHBondContact O-N 3.39Å; E600-K603 IonicContact OE1-NZ 3.86Å; E600-K603 PolarHBondContact OE1-NZ 2.92Å; E600-K603 WeakPolarHBondContact OE2-CD 3.38Å; E600-K603 IonicContact OE2-NZ 3.19Å; E600-K603 PolarHBondContact OE2-NZ 3.48Å; E600-D604 VanDerWaalsContact O-O 3.11Å
601	A	93.2	Very high	90.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-30.5	175.9	0	0	0	0	0	113.2	F583 L597 R598 K603 D604 I605 V613 L617 P828	F583-A601 HydrophobicContact CE1-CB 4.31Å; F583-A601 HydrophobicContact CZ-CB 4.4Å; L597-A601 WeakPolarHBondContact O-CB 3.5Å; L597-A601 PolarHBondContact O-N 3.48Å; R598-A601 PolarHBondContact O-N 3.01Å; A601-K603 PolarHBondContact O-N 3.32Å; A601-D604 PolarHBondContact O-N 2.67Å; A601-I605 HydrophobicContact CB-CD1 4.16Å; A601-I605 HydrophobicContact CB-CG1 4Å; A601-V613 HydrophobicContact CB-CG1 4.41Å; A601-L617 HydrophobicContact CB-CD1 3.88Å; A601-L617 HydrophobicContact CB-CD2 4.35Å; A601-P828 HydrophobicContact CB-CB 4.16Å; A601-P828 HydrophobicContact CB-CG 4.48Å
602	R	89.4	Confident	91.1	Very high	31 Å²	31	43.8 Å²	43.8	12%	0.117	21%	0.209	C	C	.	.	H	α-helix	trans	-63	-30.6	175.9	-71.7	170.9	-179.3	-176.6	-0.6	113.2	R598 E600 P828 R875 W937 D939 E942	R598-R602 WeakPolarHBondContact O-CG 3.45Å; R598-R602 PolarHBondContact O-N 3.05Å; E600-R602 VanDerWaalsContact C-N 3.31Å; E600-R602 PolarHBondContact O-N 2.86Å; R602-P828 HydrophobicContact CG-CB 4.44Å; R602-R875 PolarHBondContact O-NH2 3.28Å; R602-R875 VanDerWaalsContact O-NH2 3.12Å; R602-W937 HydrophobicContact CB-CD2 3.95Å; R602-W937 HydrophobicContact CB-CE3 3.66Å; R602-W937 HydrophobicContact CB-CH2 4.19Å; R602-W937 HydrophobicContact CB-CZ2 4.42Å; R602-W937 HydrophobicContact CB-CZ3 3.8Å; R602-W937 HydrophobicContact CG-CD2 3.52Å; R602-W937 VanDerWaalsContact CG-CE2 3.46Å; R602-W937 HydrophobicContact CG-CE3 3.72Å; R602-W937 HydrophobicContact CG-CG 4.1Å; R602-W937 HydrophobicContact CG-CH2 3.79Å; R602-W937 HydrophobicContact CG-CZ2 3.57Å; R602-W937 HydrophobicContact CG-CZ3 3.86Å; R602-W937 VanDerWaalsContact NE-CD1 3.33Å; R602-W937 VanDerWaalsContact NE-NE1 3.15Å; R602-D939 IonicContact CZ-OD1 3.38Å; R602-D939 IonicContact NH1-OD1 3.12Å; R602-D939 PolarHBondContact NH1-OD1 3.43Å; R602-D939 IonicContact NH1-OD2 2.75Å; R602-D939 IonicContact NH2-OD1 2.71Å; R602-D939 PolarHBondContact NH2-OD1 3.31Å; R602-E942 IonicContact CZ-OE1 3.44Å; R602-E942 IonicContact CZ-OE2 2.85Å; R602-E942 IonicContact NE-OE1 3.16Å; R602-E942 IonicContact NH2-OE1 2.88Å; R602-E942 PolarHBondContact NH2-OE1 2.56Å; R602-E942 IonicContact NH2-OE2 2.85Å; R602-E942 PolarHBondContact NH2-OE2 2.93Å
603	K	86.3	Confident	91.6	Very high	99 Å²	99	40.3 Å²	40.3	43%	0.43	18%	0.18	S	C	.	.	H	α-helix	trans	-68.2	-54	175.1	-60.2	176.2	-171.7	165.4	0	109.4	E600 A601 R875	E600-K603 WeakPolarHBondContact O-CB 3.39Å; E600-K603 PolarHBondContact O-N 3.39Å; E600-K603 IonicContact OE1-NZ 3.86Å; E600-K603 PolarHBondContact OE1-NZ 2.92Å; E600-K603 WeakPolarHBondContact OE2-CD 3.38Å; E600-K603 IonicContact OE2-NZ 3.19Å; E600-K603 PolarHBondContact OE2-NZ 3.48Å; A601-K603 PolarHBondContact O-N 3.32Å; K603-R875 PolarHBondContact O-NH2 3.37Å
604	D	88.3	Confident	92.1	Very high	11 Å²	11	39.4 Å²	39.4	6%	0.059	17%	0.174	C	C	.	.			trans	176	169.5	176.9	52	-57.8	0	0	0	109.6	L566 R569 Y575 R579 F583 E600 A601	L566-D604 HydrophobicContact CD1-CB 4.17Å; R569-D604 IonicContact NH1-OD1 3.42Å; R569-D604 PolarHBondContact NH1-OD1 3.36Å; R569-D604 IonicContact NH1-OD2 3.82Å; Y575-D604 WeakPolarHBondContact CE1-OD2 3.45Å; Y575-D604 PolarHBondContact OH-OD1 3.36Å; Y575-D604 PolarHBondContact OH-OD2 3.2Å; Y575-D604 VanDerWaalsContact OH-OD2 3.08Å; R579-D604 IonicContact CZ-OD1 2.6Å; R579-D604 IonicContact CZ-OD2 3.76Å; R579-D604 IonicContact NH1-OD1 3.06Å; R579-D604 PolarHBondContact NH1-OD1 2.67Å; R579-D604 IonicContact NH1-OD2 3.2Å; R579-D604 PolarHBondContact NH1-OD2 3.21Å; R579-D604 PolarHBondContact NH2-O 3.04Å; R579-D604 IonicContact NH2-OD1 3.17Å; R579-D604 PolarHBondContact NH2-OD1 3.36Å; R579-D604 IonicContact NH2-OD2 3.47Å; R579-D604 PolarHBondContact NH2-OD2 2.91Å; F583-D604 WeakPolarHBondContact CZ-O 3.39Å; E600-D604 VanDerWaalsContact O-O 3.11Å; A601-D604 PolarHBondContact O-N 2.67Å
605	I	94.4	Very high	92.4	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.015	16%	0.161	C	C	.	.			trans	-121.4	127.4	-178.8	-64.3	179	0	0	0	108.2	A601 P607 R610 V613 L617 D824	A601-I605 HydrophobicContact CB-CD1 4.16Å; A601-I605 HydrophobicContact CB-CG1 4Å; I605-P607 WeakPolarHBondContact O-CD 3.32Å; I605-R610 HydrophobicContact CG2-CB 4.28Å; I605-R610 HydrophobicContact CG2-CG 4.46Å; I605-V613 HydrophobicContact CD1-CG1 3.77Å; I605-V613 HydrophobicContact CG1-CG1 4.03Å; I605-V613 HydrophobicContact CG2-CB 3.88Å; I605-V613 HydrophobicContact CG2-CG1 3.94Å; I605-V613 HydrophobicContact CG2-CG2 4.1Å; I605-L617 HydrophobicContact CD1-CD1 4.17Å; I605-D824 HydrophobicContact CB-CB 4.38Å; I605-D824 HydrophobicContact CD1-CB 4.17Å; I605-D824 HydrophobicContact CG1-CB 4.44Å
606	P	94.4	Very high	92.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.128	C	C	.	.			trans	-66	125.7	178.2	24.7	-32.1	0	0	0	109.9	R579 F583 F608 L609 R610	R579-P606 HydrophobicContact CB-CB 4.12Å; R579-P606 HydrophobicContact CB-CG 4.33Å; F583-P606 HydrophobicContact CB-CG 4.19Å; F583-P606 HydrophobicContact CD2-CG 3.57Å; F583-P606 HydrophobicContact CE2-CG 4.08Å; F583-P606 HydrophobicContact CG-CG 3.96Å; P606-F608 PolarHBondContact O-N 2.95Å; P606-F608 VanDerWaalsContact O-N 3.1Å; P606-L609 HydrophobicContact CG-CB 4.27Å; P606-L609 HydrophobicContact CG-CD1 4.41Å; P606-L609 PolarHBondContact O-N 3.2Å; P606-R610 PolarHBondContact O-N 3.34Å
607	P	94.7	Very high	93.2	Very high	32 Å²	32	28 Å²	28	21%	0.208	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-52.8	-38.9	-174.1	-30.2	36	0	0	0	113.9	E570 I605 L609 R610	E570-P607 HydrophobicContact CB-CG 4.44Å; E570-P607 HydrophobicContact CG-CG 3.93Å; E570-P607 WeakPolarHBondContact OE1-CG 3.36Å; I605-P607 WeakPolarHBondContact O-CD 3.32Å; P607-L609 PolarHBondContact O-N 3.23Å; P607-R610 WeakPolarHBondContact O-CB 3.47Å; P607-R610 PolarHBondContact O-N 3.29Å
608	F	94.5	Very high	93.4	Very high	39 Å²	39	28.4 Å²	28.4	17%	0.171	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-60	-31	-179.8	-179.5	-106.5	0	0	0	114.1	S353 E354 Y357 T580 P606	S353-F608 VanDerWaalsContact C-CE2 3.49Å; S353-F608 VanDerWaalsContact O-CE2 3.29Å; S353-F608 WeakPolarHBondContact O-CE2 3.41Å; E354-F608 HydrophobicContact CB-CD1 4.44Å; E354-F608 HydrophobicContact CB-CE1 3.53Å; E354-F608 HydrophobicContact CB-CE2 4.43Å; E354-F608 HydrophobicContact CB-CZ 3.54Å; E354-F608 HydrophobicContact CG-CD1 4.31Å; E354-F608 HydrophobicContact CG-CE1 3.79Å; E354-F608 HydrophobicContact CG-CZ 4.28Å; Y357-F608 HydrophobicContact CD1-CB 3.54Å; Y357-F608 HydrophobicContact CD1-CD2 4.12Å; Y357-F608 AromaticContact CD1-CG 3.82Å; Y357-F608 HydrophobicContact CD1-CG 3.82Å; Y357-F608 HydrophobicContact CD2-CB 4.17Å; Y357-F608 HydrophobicContact CD2-CD2 4.35Å; Y357-F608 HydrophobicContact CE1-CB 3.58Å; Y357-F608 HydrophobicContact CE1-CG 4.36Å; Y357-F608 HydrophobicContact CE2-CB 4.24Å; Y357-F608 HydrophobicContact CG-CB 3.84Å; Y357-F608 AromaticContact CG-CD2 3.78Å; Y357-F608 HydrophobicContact CG-CD2 3.78Å; Y357-F608 AromaticContact CG-CG 3.96Å; Y357-F608 HydrophobicContact CG-CG 3.96Å; T580-F608 HydrophobicContact CG2-CD1 3.75Å; T580-F608 HydrophobicContact CG2-CE1 4.38Å; P606-F608 PolarHBondContact O-N 2.95Å; P606-F608 VanDerWaalsContact O-N 3.1Å
609	L	95.5	Very high	93.4	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.031	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-106.8	5	-179.8	-59.3	177.3	0	0	0	113.2	T580 F583 P606 P607 W611 K612 V613	T580-L609 HydrophobicContact CG2-CD1 3.95Å; T580-L609 HydrophobicContact CG2-CG 4.14Å; T580-L609 WeakPolarHBondContact O-CD1 3.42Å; F583-L609 HydrophobicContact CB-CD1 3.69Å; P606-L609 HydrophobicContact CG-CB 4.27Å; P606-L609 HydrophobicContact CG-CD1 4.41Å; P606-L609 PolarHBondContact O-N 3.2Å; P607-L609 PolarHBondContact O-N 3.23Å; L609-W611 VanDerWaalsContact C-N 3.34Å; L609-W611 PolarHBondContact O-N 2.99Å; L609-K612 HydrophobicContact CD2-CD 4.34Å; L609-K612 WeakPolarHBondContact O-CA 3.09Å; L609-K612 WeakPolarHBondContact O-CB 3.38Å; L609-K612 PolarHBondContact O-N 2.85Å; L609-V613 HydrophobicContact CB-CG2 4.11Å; L609-V613 WeakPolarHBondContact O-CG2 3.35Å; L609-V613 PolarHBondContact O-N 3.22Å
610	R	96.1	Very high	93.6	Very high	20 Å²	20	25.7 Å²	25.7	8%	0.075	12%	0.12	C	C	.	.	H	α-helix	trans	-47.1	-52.8	-172.6	-178.9	175.3	-72.4	129	5.2	113.1	E570 I605 P606 P607 K612 V613 W614 E820 D824	E570-R610 IonicContact OE1-NH2 3.01Å; E570-R610 PolarHBondContact OE1-NH2 3.46Å; E570-R610 VanDerWaalsContact OE1-NH2 3.14Å; I605-R610 HydrophobicContact CG2-CB 4.28Å; I605-R610 HydrophobicContact CG2-CG 4.46Å; P606-R610 PolarHBondContact O-N 3.34Å; P607-R610 WeakPolarHBondContact O-CB 3.47Å; P607-R610 PolarHBondContact O-N 3.29Å; R610-K612 VanDerWaalsContact C-N 3.33Å; R610-K612 PolarHBondContact O-N 2.96Å; R610-V613 PolarHBondContact O-N 3.37Å; R610-W614 HydrophobicContact CG-CD2 4.03Å; R610-W614 VanDerWaalsContact CG-CE2 3.5Å; R610-W614 HydrophobicContact CG-CG 4.39Å; R610-W614 HydrophobicContact CG-CH2 4.49Å; R610-W614 HydrophobicContact CG-CZ2 3.76Å; R610-W614 WeakPolarHBondContact O-CB 3.5Å; R610-W614 VanDerWaalsContact O-CG 3.31Å; R610-W614 PolarHBondContact O-N 3.24Å; R610-E820 IonicContact CZ-OE2 2.69Å; R610-E820 IonicContact NH1-OE2 3.48Å; R610-E820 PolarHBondContact NH1-OE2 2.95Å; R610-D824 IonicContact CZ-OD2 3.67Å; R610-D824 IonicContact NE-OD1 2.78Å; R610-D824 PolarHBondContact NE-OD1 2.84Å; R610-D824 IonicContact NE-OD2 3.75Å; R610-D824 PolarHBondContact NE-OD2 2.94Å; R610-D824 IonicContact NH2-OD2 2.84Å; R610-D824 PolarHBondContact NH2-OD2 2.87Å
611	W	94.5	Very high	93.1	Very high	88 Å²	88	28.5 Å²	28.5	33%	0.333	13%	0.13	S	C	.	.	H	α-helix	trans	-60.4	-39.1	-179.8	68	-92.3	0	0	0	113.1	L609 A615 I736 L743	L609-W611 VanDerWaalsContact C-N 3.34Å; L609-W611 PolarHBondContact O-N 2.99Å; W611-A615 WeakPolarHBondContact O-CB 3.47Å; W611-A615 PolarHBondContact O-N 3.45Å; W611-I736 HydrophobicContact CB-CB 4.21Å; W611-I736 HydrophobicContact CB-CD1 4.23Å; W611-I736 HydrophobicContact CB-CG1 4.05Å; W611-L743 HydrophobicContact CE3-CD2 3.6Å; W611-L743 HydrophobicContact CZ3-CD2 3.53Å
612	K	94.7	Very high	92.2	Very high	60 Å²	60	30.9 Å²	30.9	26%	0.261	15%	0.146	S	C	.	.	H	α-helix	trans	-69.3	-43.3	176.5	-68.8	-170.3	179.6	-178.1	0	111.5	I587 L609 R610 A615 A616	I587-K612 HydrophobicContact CD1-CB 4.02Å; L609-K612 HydrophobicContact CD2-CD 4.34Å; L609-K612 WeakPolarHBondContact O-CA 3.09Å; L609-K612 WeakPolarHBondContact O-CB 3.38Å; L609-K612 PolarHBondContact O-N 2.85Å; R610-K612 VanDerWaalsContact C-N 3.33Å; R610-K612 PolarHBondContact O-N 2.96Å; K612-A615 PolarHBondContact O-N 3.04Å; K612-A616 WeakPolarHBondContact O-CB 3.5Å; K612-A616 PolarHBondContact O-N 2.84Å
613	V	96.8	Very high	91.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.1	-45.5	179.7	176.2	0	0	0	0	109.9	F583 I587 L597 A601 I605 L609 R610 A616 L617	F583-V613 HydrophobicContact CD1-CG1 4.25Å; F583-V613 HydrophobicContact CD1-CG2 3.5Å; F583-V613 VanDerWaalsContact CD1-CG2 3.5Å; F583-V613 HydrophobicContact CE1-CG1 3.87Å; F583-V613 HydrophobicContact CE1-CG2 3.92Å; F583-V613 HydrophobicContact CG-CG2 4.23Å; I587-V613 HydrophobicContact CD1-CG2 3.98Å; L597-V613 HydrophobicContact CD1-CG1 4.29Å; A601-V613 HydrophobicContact CB-CG1 4.41Å; I605-V613 HydrophobicContact CD1-CG1 3.77Å; I605-V613 HydrophobicContact CG1-CG1 4.03Å; I605-V613 HydrophobicContact CG2-CB 3.88Å; I605-V613 HydrophobicContact CG2-CG1 3.94Å; I605-V613 HydrophobicContact CG2-CG2 4.1Å; L609-V613 HydrophobicContact CB-CG2 4.11Å; L609-V613 WeakPolarHBondContact O-CG2 3.35Å; L609-V613 PolarHBondContact O-N 3.22Å; R610-V613 PolarHBondContact O-N 3.37Å; V613-A616 PolarHBondContact O-N 3.23Å; V613-L617 HydrophobicContact CG1-CD1 3.83Å; V613-L617 HydrophobicContact CG1-CG 4.25Å; V613-L617 WeakPolarHBondContact O-CB 3.34Å; V613-L617 VanDerWaalsContact O-CG 3.28Å; V613-L617 WeakPolarHBondContact O-CG 3.45Å; V613-L617 PolarHBondContact O-N 3.38Å
614	W	97.6	Very high	91.6	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-47.5	176.1	-71.2	9.5	0	0	0	112.2	R610 A616 L617 L618 V732 F733 I736 E820 W823 D824 I827	R610-W614 HydrophobicContact CG-CD2 4.03Å; R610-W614 VanDerWaalsContact CG-CE2 3.5Å; R610-W614 HydrophobicContact CG-CG 4.39Å; R610-W614 HydrophobicContact CG-CH2 4.49Å; R610-W614 HydrophobicContact CG-CZ2 3.76Å; R610-W614 WeakPolarHBondContact O-CB 3.5Å; R610-W614 VanDerWaalsContact O-CG 3.31Å; R610-W614 PolarHBondContact O-N 3.24Å; W614-A616 VanDerWaalsContact C-N 3.27Å; W614-A616 PolarHBondContact O-N 3.41Å; W614-L617 PolarHBondContact O-N 3.28Å; W614-L618 WeakPolarHBondContact O-CB 3.45Å; W614-L618 VanDerWaalsContact O-CG 3.29Å; W614-L618 WeakPolarHBondContact O-CG 3.33Å; W614-L618 PolarHBondContact O-N 3.06Å; W614-V732 HydrophobicContact CH2-CG1 4.11Å; W614-V732 HydrophobicContact CZ3-CG1 3.79Å; W614-F733 HydrophobicContact CE3-CE1 4.04Å; W614-F733 HydrophobicContact CZ3-CE1 4.5Å; W614-I736 HydrophobicContact CD2-CD1 4.17Å; W614-I736 HydrophobicContact CE3-CD1 3.21Å; W614-I736 HydrophobicContact CH2-CD1 4.31Å; W614-I736 HydrophobicContact CZ3-CD1 3.3Å; W614-E820 HydrophobicContact CH2-CB 4.43Å; W614-E820 HydrophobicContact CH2-CG 4.35Å; W614-E820 WeakPolarHBondContact CZ2-O 3.11Å; W614-W823 HydrophobicContact CE3-CE3 4.41Å; W614-W823 HydrophobicContact CH2-CB 3.63Å; W614-W823 HydrophobicContact CH2-CD2 4.4Å; W614-W823 AromaticContact CH2-CE3 3.84Å; W614-W823 HydrophobicContact CH2-CE3 3.84Å; W614-W823 HydrophobicContact CH2-CG 4.39Å; W614-W823 HydrophobicContact CZ2-CB 3.59Å; W614-W823 HydrophobicContact CZ3-CB 4.42Å; W614-W823 AromaticContact CZ3-CE3 3.62Å; W614-W823 HydrophobicContact CZ3-CE3 3.62Å; W614-W823 HydrophobicContact CZ3-CZ3 4.29Å; W614-D824 WeakPolarHBondContact CZ2-OD1 3.39Å; W614-D824 PolarHBondContact NE1-OD1 3.49Å; W614-I827 HydrophobicContact CB-CD1 4.14Å; W614-I827 HydrophobicContact CD2-CD1 3.33Å; W614-I827 HydrophobicContact CE3-CD1 3.62Å; W614-I827 HydrophobicContact CG-CD1 3.57Å; W614-I827 HydrophobicContact CH2-CD1 4.44Å; W614-I827 HydrophobicContact CZ2-CD1 4.21Å; W614-I827 HydrophobicContact CZ3-CD1 4.17Å
615	A	96.4	Very high	91.5	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-39.8	176.2	0	0	0	0	0	112.2	W611 K612 D619 V620 Y621 L743	W611-A615 WeakPolarHBondContact O-CB 3.47Å; W611-A615 PolarHBondContact O-N 3.45Å; K612-A615 PolarHBondContact O-N 3.04Å; A615-D619 PolarHBondContact O-N 3.41Å; A615-V620 HydrophobicContact CB-CB 4.43Å; A615-V620 WeakPolarHBondContact O-CA 3.41Å; A615-V620 WeakPolarHBondContact O-CB 3.49Å; A615-V620 PolarHBondContact O-N 3.33Å; A615-Y621 PolarHBondContact O-N 3.37Å; A615-L743 HydrophobicContact CB-CD1 3.93Å
616	A	95.7	Very high	91.3	Very high	2 Å²	2	40.6 Å²	40.6	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-70	-39.8	176	0	0	0	0	0	112.9	L590 L597 K612 V613 W614 L618 D619 Y621	L590-A616 HydrophobicContact CD1-CB 3.76Å; L597-A616 HydrophobicContact CD2-CB 3.54Å; K612-A616 WeakPolarHBondContact O-CB 3.5Å; K612-A616 PolarHBondContact O-N 2.84Å; V613-A616 PolarHBondContact O-N 3.23Å; W614-A616 VanDerWaalsContact C-N 3.27Å; W614-A616 PolarHBondContact O-N 3.41Å; A616-L618 VanDerWaalsContact C-N 3.29Å; A616-L618 PolarHBondContact O-N 2.89Å; A616-D619 PolarHBondContact O-N 2.8Å; A616-Y621 HydrophobicContact CB-CD1 4.48Å
617	L	95.2	Very high	91.2	Very high	16 Å²	16	43.9 Å²	43.9	8%	0.084	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-29.8	176	-72.2	172.1	0	0	0	112.7	L597 R598 A601 I605 V613 W614 D619 I827 P828	L597-L617 HydrophobicContact CD2-CD2 4.1Å; L597-L617 HydrophobicContact CD2-CG 4.29Å; L597-L617 HydrophobicContact CG-CD2 4.06Å; L597-L617 HydrophobicContact CG-CG 4.49Å; R598-L617 HydrophobicContact CG-CD2 3.71Å; A601-L617 HydrophobicContact CB-CD1 3.88Å; A601-L617 HydrophobicContact CB-CD2 4.35Å; I605-L617 HydrophobicContact CD1-CD1 4.17Å; V613-L617 HydrophobicContact CG1-CD1 3.83Å; V613-L617 HydrophobicContact CG1-CG 4.25Å; V613-L617 WeakPolarHBondContact O-CB 3.34Å; V613-L617 VanDerWaalsContact O-CG 3.28Å; V613-L617 WeakPolarHBondContact O-CG 3.45Å; V613-L617 PolarHBondContact O-N 3.38Å; W614-L617 PolarHBondContact O-N 3.28Å; L617-D619 VanDerWaalsContact C-N 3.28Å; L617-I827 HydrophobicContact CB-CG2 3.78Å; L617-I827 HydrophobicContact CD1-CG2 3.97Å; L617-P828 HydrophobicContact CD1-CB 4.1Å
618	L	94.5	Very high	91.1	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.052	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	7.2	175.3	-68.3	172.6	0	0	0	113.5	W614 A616 V620 F733 C747 A750 F751 I827	W614-L618 WeakPolarHBondContact O-CB 3.45Å; W614-L618 VanDerWaalsContact O-CG 3.29Å; W614-L618 WeakPolarHBondContact O-CG 3.33Å; W614-L618 PolarHBondContact O-N 3.06Å; A616-L618 VanDerWaalsContact C-N 3.29Å; A616-L618 PolarHBondContact O-N 2.89Å; L618-V620 HydrophobicContact CB-CG2 4.19Å; L618-V620 PolarHBondContact O-N 3.37Å; L618-F733 HydrophobicContact CD1-CE1 4.04Å; L618-F733 HydrophobicContact CD1-CZ 4.03Å; L618-C747 HydrophobicContact CD1-CB 4.23Å; L618-A750 HydrophobicContact CB-CB 4.01Å; L618-A750 WeakPolarHBondContact O-CB 3.41Å; L618-F751 HydrophobicContact CD1-CB 4.2Å; L618-F751 HydrophobicContact CD1-CD2 4.44Å; L618-F751 HydrophobicContact CD2-CB 4.28Å; L618-F751 HydrophobicContact CD2-CD2 4.24Å; L618-I827 HydrophobicContact CD2-CG2 4.39Å; L618-I827 HydrophobicContact CG-CG2 4.27Å
619	D	92	Very high	90.9	Very high	98 Å²	98	45.3 Å²	45.3	52%	0.524	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.9	28.6	180	-68.1	-39.7	0	0	0	114.4	K594 A615 A616 L617	K594-D619 WeakPolarHBondContact CE-OD1 3.49Å; K594-D619 IonicContact NZ-OD1 3.43Å; K594-D619 PolarHBondContact NZ-OD1 2.51Å; K594-D619 IonicContact NZ-OD2 2.62Å; K594-D619 PolarHBondContact NZ-OD2 3.1Å; A615-D619 PolarHBondContact O-N 3.41Å; A616-D619 PolarHBondContact O-N 2.8Å; L617-D619 VanDerWaalsContact C-N 3.28Å
620	V	91.2	Very high	90.9	Very high	12 Å²	12	45.6 Å²	45.6	7%	0.073	23%	0.23	C	C	.	.			trans	-93.5	-24.2	174.6	177.8	0	0	0	0	111.6	A615 L618 N623 F626 L743 A746 A750	A615-V620 HydrophobicContact CB-CB 4.43Å; A615-V620 WeakPolarHBondContact O-CA 3.41Å; A615-V620 WeakPolarHBondContact O-CB 3.49Å; A615-V620 PolarHBondContact O-N 3.33Å; L618-V620 HydrophobicContact CB-CG2 4.19Å; L618-V620 PolarHBondContact O-N 3.37Å; V620-N623 VanDerWaalsContact O-O 3.04Å; V620-F626 HydrophobicContact CG1-CD1 3.63Å; V620-F626 HydrophobicContact CG1-CE1 3.43Å; V620-F626 VanDerWaalsContact CG1-CE1 3.43Å; V620-F626 HydrophobicContact CG1-CG 4.46Å; V620-F626 HydrophobicContact CG1-CZ 4.16Å; V620-F626 WeakPolarHBondContact O-CE1 3.41Å; V620-L743 HydrophobicContact CG1-CD1 3.69Å; V620-A746 HydrophobicContact CG1-CB 3.51Å; V620-A746 HydrophobicContact CG2-CB 4.31Å; V620-A750 HydrophobicContact CG2-CB 3.75Å
621	Y	78.9	Confident	90.8	Very high	68 Å²	68	49.9 Å²	49.9	27%	0.267	25%	0.254	S	S	.	.	S	Bend	trans	-118.2	145	179.9	-168.1	-89.8	0	0	0	109.9	I587 L590 A615 A616	I587-Y621 HydrophobicContact CG2-CD1 3.89Å; I587-Y621 HydrophobicContact CG2-CE1 3.38Å; L590-Y621 HydrophobicContact CD1-CD1 4.32Å; A615-Y621 PolarHBondContact O-N 3.37Å; A616-Y621 HydrophobicContact CB-CD1 4.48Å
622	P	74.9	Confident	90.7	Very high	51 Å²	51	52.7 Å²	52.7	33%	0.331	27%	0.269	S	S	.	.	S	Bend	cis	-88.2	-14.3	9.5	34	-35.2	0	0	0	116	L590 R624	L590-P622 HydrophobicContact CB-CG 4.21Å; P622-R624 PolarHBondContact O-N 2.82Å; P622-R624 VanDerWaalsContact O-N 3.17Å
623	N	78.1	Confident	90.5	Very high	110 Å²	110	50 Å²	50	59%	0.588	26%	0.257	S	S	*	.			trans	-74.2	110.5	-174.6	-64.3	-0.4	0	0	0	110.4	V620 D625	V620-N623 VanDerWaalsContact O-O 3.04Å; N623-D625 PolarHBondContact O-N 3.26Å
624	R	84.6	Confident	90.3	Very high	97 Å²	97	51.6 Å²	51.6	37%	0.366	27%	0.266	S	S	.	.			trans	-80.8	31.6	179	-59.4	-172.7	83.3	-153.8	-0.1	113.2	P622 F626 E627 D740	P622-R624 PolarHBondContact O-N 2.82Å; P622-R624 VanDerWaalsContact O-N 3.17Å; R624-F626 HydrophobicContact CB-CE1 4.14Å; R624-F626 HydrophobicContact CB-CZ 4.24Å; R624-F626 HydrophobicContact CG-CE1 4.24Å; R624-F626 HydrophobicContact CG-CZ 4.23Å; R624-F626 PolarHBondContact O-N 3.22Å; R624-E627 HydrophobicContact CB-CG 4.09Å; R624-E627 IonicContact CZ-OE1 2.66Å; R624-E627 IonicContact NE-OE1 2.6Å; R624-E627 PolarHBondContact NE-OE1 2.9Å; R624-E627 IonicContact NH1-OE1 3.43Å; R624-E627 PolarHBondContact NH1-OE1 3.39Å; R624-E627 IonicContact NH2-OE1 3.63Å; R624-E627 PolarHBondContact NH2-OE1 3.24Å; R624-E627 WeakPolarHBondContact O-CB 3.48Å; R624-E627 WeakPolarHBondContact O-CG 3.28Å; R624-E627 PolarHBondContact O-N 2.77Å; R624-D740 IonicContact CZ-OD2 3.06Å; R624-D740 IonicContact NH2-OD1 3.52Å; R624-D740 IonicContact NH2-OD2 3.43Å; R624-D740 PolarHBondContact NH2-OD2 3.13Å
625	D	86.5	Confident	89.9	Confident	119 Å²	119	57.6 Å²	57.6	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.3	-176.3	-61	-24.2	0	0	0	112.4	N623 E627 S628	N623-D625 PolarHBondContact O-N 3.26Å; D625-E627 VanDerWaalsContact C-N 3.25Å; D625-E627 PolarHBondContact O-N 3.17Å; D625-S628 PolarHBondContact O-OG 3.26Å
626	F	90.1	Very high	89.5	Confident	22 Å²	22	61.1 Å²	61.1	10%	0.096	31%	0.309	C	S	.	.	H	α-helix	trans	-64.2	-22.4	176.9	63.1	-98.3	0	0	0	114.1	V620 R624 S628 A629 Y630 M715 A742 L743 A746	V620-F626 HydrophobicContact CG1-CD1 3.63Å; V620-F626 HydrophobicContact CG1-CE1 3.43Å; V620-F626 VanDerWaalsContact CG1-CE1 3.43Å; V620-F626 HydrophobicContact CG1-CG 4.46Å; V620-F626 HydrophobicContact CG1-CZ 4.16Å; V620-F626 WeakPolarHBondContact O-CE1 3.41Å; R624-F626 HydrophobicContact CB-CE1 4.14Å; R624-F626 HydrophobicContact CB-CZ 4.24Å; R624-F626 HydrophobicContact CG-CE1 4.24Å; R624-F626 HydrophobicContact CG-CZ 4.23Å; R624-F626 PolarHBondContact O-N 3.22Å; F626-S628 VanDerWaalsContact C-N 3.28Å; F626-S628 PolarHBondContact O-N 2.87Å; F626-A629 PolarHBondContact O-N 2.96Å; F626-A629 VanDerWaalsContact O-N 3.14Å; F626-Y630 PolarHBondContact O-N 3.4Å; F626-M715 HydrophobicContact CB-CE 4.23Å; F626-A742 HydrophobicContact CD2-CB 4.03Å; F626-A742 WeakPolarHBondContact CD2-O 3.43Å; F626-A742 VanDerWaalsContact CE2-C 3.41Å; F626-A742 HydrophobicContact CE2-CB 3.83Å; F626-L743 HydrophobicContact CE1-CD1 4.18Å; F626-L743 HydrophobicContact CE2-CB 4.17Å; F626-L743 HydrophobicContact CZ-CB 4.11Å; F626-L743 HydrophobicContact CZ-CD1 3.72Å; F626-A746 HydrophobicContact CB-CB 3.64Å; F626-A746 HydrophobicContact CD1-CB 3.82Å; F626-A746 HydrophobicContact CD2-CB 3.6Å; F626-A746 HydrophobicContact CE1-CB 4.36Å; F626-A746 HydrophobicContact CE2-CB 4.21Å; F626-A746 HydrophobicContact CG-CB 3.39Å
627	E	93.2	Very high	89.1	Confident	70 Å²	70	61 Å²	61	33%	0.327	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-40.8	-178.9	-71.6	-173.9	138.2	0	0	111.5	R624 D625 A629 Y630 L631 A742	R624-E627 HydrophobicContact CB-CG 4.09Å; R624-E627 IonicContact CZ-OE1 2.66Å; R624-E627 IonicContact NE-OE1 2.6Å; R624-E627 PolarHBondContact NE-OE1 2.9Å; R624-E627 IonicContact NH1-OE1 3.43Å; R624-E627 PolarHBondContact NH1-OE1 3.39Å; R624-E627 IonicContact NH2-OE1 3.63Å; R624-E627 PolarHBondContact NH2-OE1 3.24Å; R624-E627 WeakPolarHBondContact O-CB 3.48Å; R624-E627 WeakPolarHBondContact O-CG 3.28Å; R624-E627 PolarHBondContact O-N 2.77Å; D625-E627 VanDerWaalsContact C-N 3.25Å; D625-E627 PolarHBondContact O-N 3.17Å; E627-A629 VanDerWaalsContact C-N 3.33Å; E627-A629 PolarHBondContact O-N 3.03Å; E627-Y630 PolarHBondContact O-N 3.16Å; E627-L631 WeakPolarHBondContact O-CB 3.43Å; E627-L631 WeakPolarHBondContact O-CG 3.26Å; E627-L631 PolarHBondContact O-N 3.19Å; E627-A742 HydrophobicContact CG-CB 4.37Å
628	S	91.8	Very high	88.7	Confident	69 Å²	69	64.6 Å²	64.6	48%	0.483	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-38.4	177.8	72.4	0	0	0	0	112.2	D625 F626 K632	D625-S628 PolarHBondContact O-OG 3.26Å; F626-S628 VanDerWaalsContact C-N 3.28Å; F626-S628 PolarHBondContact O-N 2.87Å; S628-K632 VanDerWaalsContact O-CG 3.28Å; S628-K632 WeakPolarHBondContact O-CG 3.29Å; S628-K632 PolarHBondContact O-N 3.45Å; S628-K632 VanDerWaalsContact O-N 3.14Å
629	A	91.4	Very high	88.1	Confident	32 Å²	32	71.5 Å²	71.5	26%	0.264	36%	0.357	S	S	.	.	H	α-helix	trans	-70.2	-41.6	177	0	0	0	0	0	111.1	F626 E627 K632 A633 M715	F626-A629 PolarHBondContact O-N 2.96Å; F626-A629 VanDerWaalsContact O-N 3.14Å; E627-A629 VanDerWaalsContact C-N 3.33Å; E627-A629 PolarHBondContact O-N 3.03Å; A629-K632 PolarHBondContact O-N 3.26Å; A629-A633 PolarHBondContact O-N 3.5Å; A629-M715 HydrophobicContact CB-CE 4.23Å; A629-M715 HydrophobicContact CB-CG 4.26Å
630	Y	94.9	Very high	87.4	Confident	11 Å²	11	72.8 Å²	72.8	4%	0.043	36%	0.358	C	S	.	.	H	α-helix	trans	-61.1	-47.7	174.7	-176.8	-101.4	0	0	0	111.7	F626 E627 K632 A633 L634 A711 E741 A742 A745	F626-Y630 PolarHBondContact O-N 3.4Å; E627-Y630 PolarHBondContact O-N 3.16Å; Y630-K632 VanDerWaalsContact C-N 3.33Å; Y630-K632 PolarHBondContact O-N 2.92Å; Y630-A633 CarbonylContact O-C 3.6Å; Y630-A633 WeakPolarHBondContact O-CB 3.45Å; Y630-A633 PolarHBondContact O-N 2.85Å; Y630-A633 VanDerWaalsContact O-N 3.1Å; Y630-L634 HydrophobicContact CE1-CD2 4.18Å; Y630-L634 WeakPolarHBondContact O-CB 2.96Å; Y630-L634 PolarHBondContact O-N 3.13Å; Y630-A711 HydrophobicContact CD2-CB 3.58Å; Y630-A711 HydrophobicContact CE2-CB 3.39Å; Y630-E741 HydrophobicContact CE1-CB 4.12Å; Y630-E741 HydrophobicContact CE2-CB 4.35Å; Y630-E741 WeakPolarHBondContact OH-CB 3.46Å; Y630-E741 PolarHBondContact OH-OE2 3.21Å; Y630-A742 HydrophobicContact CD1-CB 3.6Å; Y630-A742 HydrophobicContact CD2-CB 4.35Å; Y630-A742 HydrophobicContact CE1-CB 4.28Å; Y630-A742 HydrophobicContact CG-CB 3.64Å; Y630-A745 HydrophobicContact CD2-CB 3.83Å; Y630-A745 HydrophobicContact CE2-CB 4.02Å
631	L	93.7	Very high	86.7	Confident	111 Å²	111	74.3 Å²	74.3	58%	0.581	38%	0.376	S	S	*	.	H	α-helix	trans	-61.2	-40.3	178.1	-73.6	174	0	0	0	112.4	E627 A633 L634 H635	E627-L631 WeakPolarHBondContact O-CB 3.43Å; E627-L631 WeakPolarHBondContact O-CG 3.26Å; E627-L631 PolarHBondContact O-N 3.19Å; L631-A633 VanDerWaalsContact C-N 3.33Å; L631-L634 PolarHBondContact O-N 3.3Å; L631-H635 WeakPolarHBondContact O-CB 3.47Å; L631-H635 PolarHBondContact O-N 2.76Å
632	K	92	Very high	86.4	Confident	147 Å²	147	72.4 Å²	72.4	64%	0.639	37%	0.37	S	S	*	.	H	α-helix	trans	-62.2	-41.2	173.5	-74.1	171.5	-175.6	174.6	0	111.6	S628 A629 Y630 K636	S628-K632 VanDerWaalsContact O-CG 3.28Å; S628-K632 WeakPolarHBondContact O-CG 3.29Å; S628-K632 PolarHBondContact O-N 3.45Å; S628-K632 VanDerWaalsContact O-N 3.14Å; A629-K632 PolarHBondContact O-N 3.26Å; Y630-K632 VanDerWaalsContact C-N 3.33Å; Y630-K632 PolarHBondContact O-N 2.92Å; K632-K636 WeakPolarHBondContact O-CG 3.19Å; K632-K636 PolarHBondContact O-N 3.17Å
633	A	92.1	Very high	86.1	Confident	2 Å²	2	72.3 Å²	72.3	2%	0.017	37%	0.367	C	S	.	.	H	α-helix	trans	-66.4	-45	175.9	0	0	0	0	0	111.6	A629 Y630 L631 H635 K636 I637 A711 L714	A629-A633 PolarHBondContact O-N 3.5Å; Y630-A633 CarbonylContact O-C 3.6Å; Y630-A633 WeakPolarHBondContact O-CB 3.45Å; Y630-A633 PolarHBondContact O-N 2.85Å; Y630-A633 VanDerWaalsContact O-N 3.1Å; L631-A633 VanDerWaalsContact C-N 3.33Å; A633-H635 PolarHBondContact O-N 3.44Å; A633-K636 WeakPolarHBondContact O-CB 3.39Å; A633-K636 PolarHBondContact O-N 3.32Å; A633-K636 VanDerWaalsContact O-N 3.09Å; A633-I637 WeakPolarHBondContact O-CG1 3.01Å; A633-I637 PolarHBondContact O-N 3.03Å; A633-A711 HydrophobicContact CB-CB 3.98Å; A633-L714 HydrophobicContact CB-CB 3.84Å
634	L	91.8	Very high	85.2	Confident	34 Å²	34	71.7 Å²	71.7	18%	0.178	37%	0.367	C	S	.	.	H	α-helix	trans	-60.8	-42.5	177.7	-176.3	60.7	0	0	0	112.3	Y630 L631 K636 I637 N638 R707	Y630-L634 HydrophobicContact CE1-CD2 4.18Å; Y630-L634 WeakPolarHBondContact O-CB 2.96Å; Y630-L634 PolarHBondContact O-N 3.13Å; L631-L634 PolarHBondContact O-N 3.3Å; L634-K636 VanDerWaalsContact C-N 3.27Å; L634-K636 PolarHBondContact O-N 2.9Å; L634-I637 WeakPolarHBondContact O-CB 3.36Å; L634-I637 PolarHBondContact O-N 3.31Å; L634-N638 PolarHBondContact O-N 3.28Å; L634-R707 VanDerWaalsContact CD1-CD 3.48Å; L634-R707 HydrophobicContact CD1-CG 4.3Å
635	H	89.5	Confident	83.7	Confident	128 Å²	128	71.3 Å²	71.3	59%	0.593	38%	0.376	S	S	*	.	H	α-helix	trans	-59.6	-39.6	174.6	-177.6	-74.5	0	0	0	111.6	L631 A633 K639	L631-H635 WeakPolarHBondContact O-CB 3.47Å; L631-H635 PolarHBondContact O-N 2.76Å; A633-H635 PolarHBondContact O-N 3.44Å; H635-K639 VanDerWaalsContact O-CB 3.23Å; H635-K639 WeakPolarHBondContact O-CB 3.33Å; H635-K639 PolarHBondContact O-N 2.98Å
636	K	87.5	Confident	81.6	Confident	75 Å²	75	69.1 Å²	69.1	33%	0.326	37%	0.368	S	S	.	.	H	α-helix	trans	-64.6	-47.8	174.4	-67.8	172.5	177.9	-176.4	0	110.8	K632 A633 L634 N638 K639 F640 L673 L714	K632-K636 WeakPolarHBondContact O-CG 3.19Å; K632-K636 PolarHBondContact O-N 3.17Å; A633-K636 WeakPolarHBondContact O-CB 3.39Å; A633-K636 PolarHBondContact O-N 3.32Å; A633-K636 VanDerWaalsContact O-N 3.09Å; L634-K636 VanDerWaalsContact C-N 3.27Å; L634-K636 PolarHBondContact O-N 2.9Å; K636-N638 VanDerWaalsContact C-N 3.3Å; K636-N638 PolarHBondContact O-N 3.25Å; K636-K639 PolarHBondContact O-N 3.45Å; K636-F640 HydrophobicContact CB-CD2 4.41Å; K636-F640 HydrophobicContact CB-CE2 4.42Å; K636-F640 WeakPolarHBondContact O-CD2 3.37Å; K636-F640 PolarHBondContact O-N 3.31Å; K636-L673 HydrophobicContact CD-CD2 3.83Å; K636-L714 HydrophobicContact CB-CD1 4.4Å
637	I	88.5	Confident	79	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-52.6	-49.4	177	-67.1	166.7	0	0	0	110.7	A633 L634 F640 G641 L642 D643 L710 A711 L714	A633-I637 WeakPolarHBondContact O-CG1 3.01Å; A633-I637 PolarHBondContact O-N 3.03Å; L634-I637 WeakPolarHBondContact O-CB 3.36Å; L634-I637 PolarHBondContact O-N 3.31Å; I637-F640 PolarHBondContact O-N 3.43Å; I637-G641 PolarHBondContact O-N 3.15Å; I637-L642 HydrophobicContact CG2-CB 3.99Å; I637-L642 PolarHBondContact O-N 3.07Å; I637-D643 HydrophobicContact CG2-CB 4.23Å; I637-L710 HydrophobicContact CD1-CB 3.59Å; I637-L710 HydrophobicContact CD1-CD1 4.5Å; I637-L710 HydrophobicContact CG1-CB 4.02Å; I637-L710 HydrophobicContact CG1-CD1 4.43Å; I637-L710 HydrophobicContact CG2-CD1 4.27Å; I637-A711 HydrophobicContact CD1-CB 4.24Å; I637-L714 HydrophobicContact CD1-CD1 4.31Å; I637-L714 HydrophobicContact CG1-CD1 3.75Å
638	N	86.9	Confident	75.8	Confident	90 Å²	90	77.5 Å²	77.5	48%	0.481	42%	0.42	S	S	.	.	H	α-helix	trans	-67.8	-43.4	-179.5	-68	-12.9	0	0	0	112.5	L634 K636 F640 G641	L634-N638 PolarHBondContact O-N 3.28Å; K636-N638 VanDerWaalsContact C-N 3.3Å; K636-N638 PolarHBondContact O-N 3.25Å; N638-F640 PolarHBondContact O-N 3.22Å; N638-G641 PolarHBondContact O-N 3.39Å; N638-G641 VanDerWaalsContact O-N 3.11Å
639	K	81.9	Confident	72.8	Confident	155 Å²	155	82.2 Å²	82.2	67%	0.674	43%	0.434	S	S	*	.	H	α-helix	trans	-59.2	-35.3	179.2	-176.4	-178.9	178.4	-175.2	0	112.3	H635 K636	H635-K639 VanDerWaalsContact O-CB 3.23Å; H635-K639 WeakPolarHBondContact O-CB 3.33Å; H635-K639 PolarHBondContact O-N 2.98Å; K636-K639 PolarHBondContact O-N 3.45Å
640	F	76.9	Confident	69.8	Low	125 Å²	125	88.3 Å²	88.3	55%	0.548	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	8	-179.6	-65.9	-65.8	0	0	0	113.5	K636 I637 N638 L642	K636-F640 HydrophobicContact CB-CD2 4.41Å; K636-F640 HydrophobicContact CB-CE2 4.42Å; K636-F640 WeakPolarHBondContact O-CD2 3.37Å; K636-F640 PolarHBondContact O-N 3.31Å; I637-F640 PolarHBondContact O-N 3.43Å; N638-F640 PolarHBondContact O-N 3.22Å; F640-L642 HydrophobicContact CB-CD1 4.05Å; F640-L642 HydrophobicContact CB-CD2 4.48Å; F640-L642 HydrophobicContact CB-CG 3.79Å; F640-L642 PolarHBondContact O-N 3.32Å
641	G	75.3	Confident	66.6	Low	44 Å²	44	94.5 Å²	94.5	45%	0.454	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	20.3	179.3	0	0	0	0	0	114.2	I637 N638 D643 V644	I637-G641 PolarHBondContact O-N 3.15Å; N638-G641 PolarHBondContact O-N 3.39Å; N638-G641 VanDerWaalsContact O-N 3.11Å; G641-D643 VanDerWaalsContact C-N 3.25Å; G641-D643 PolarHBondContact O-N 2.88Å; G641-V644 PolarHBondContact O-N 3.03Å
642	L	73.4	Confident	63.5	Low	29 Å²	29	96.8 Å²	96.8	15%	0.152	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-13.9	-172.3	-64.2	177.4	0	0	0	113.4	I637 F640 V644 I679 R706 L710	I637-L642 HydrophobicContact CG2-CB 3.99Å; I637-L642 PolarHBondContact O-N 3.07Å; F640-L642 HydrophobicContact CB-CD1 4.05Å; F640-L642 HydrophobicContact CB-CD2 4.48Å; F640-L642 HydrophobicContact CB-CG 3.79Å; F640-L642 PolarHBondContact O-N 3.32Å; L642-V644 VanDerWaalsContact C-N 3.31Å; L642-I679 HydrophobicContact CD1-CD1 4.46Å; L642-I679 HydrophobicContact CD2-CD1 3.41Å; L642-I679 VanDerWaalsContact CD2-CD1 3.41Å; L642-I679 HydrophobicContact CD2-CG1 4.12Å; L642-I679 HydrophobicContact CD2-CG2 4.24Å; L642-R706 VanDerWaalsContact O-CZ 3.24Å; L642-R706 PolarHBondContact O-NE 3.44Å; L642-R706 PolarHBondContact O-NH2 3.46Å; L642-L710 HydrophobicContact CB-CD1 4.16Å
643	D	67.3	Low	60.4	Low	48 Å²	48	96.7 Å²	96.7	26%	0.257	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-21.1	177.9	-155.2	3.1	0	0	0	112.4	I637 G641 S703 R707	I637-D643 HydrophobicContact CG2-CB 4.23Å; G641-D643 VanDerWaalsContact C-N 3.25Å; G641-D643 PolarHBondContact O-N 2.88Å; D643-S703 PolarHBondContact OD1-OG 2.88Å; D643-R707 IonicContact OD1-NH1 2.76Å; D643-R707 PolarHBondContact OD1-NH1 3.09Å; D643-R707 IonicContact OD2-NH1 2.68Å; D643-R707 PolarHBondContact OD2-NH1 3.15Å
644	V	60	Low	57.5	Low	98 Å²	98	105 Å²	105	59%	0.594	55%	0.553	S	S	*	*	S	Bend	trans	-84.2	132.3	-178.6	-166	0	0	0	0	110.1	G641 L642	G641-V644 PolarHBondContact O-N 3.03Å; L642-V644 VanDerWaalsContact C-N 3.31Å
645	T	53	Low	54.3	Low	89 Å²	89	112.1 Å²	112.1	55%	0.546	59%	0.586	S	S	.	*			trans	-62.7	132.3	167.9	43.6	0	0	0	0	109.3	T647	T645-T647 PolarHBondContact O-N 2.92Å
646	P	42	Very low	51.5	Low	73 Å²	73	116.5 Å²	116.5	47%	0.474	60%	0.598	S	S	.	*			trans	-56.2	109.2	177.6	-19.3	29.1	0	0	0	110	N648	P646-N648 PolarHBondContact O-N 3.13Å
647	T	35.1	Very low	48.8	Very low	104 Å²	104	120.2 Å²	120.2	64%	0.638	62%	0.622	S	S	*	*			trans	-79.8	117.7	174.2	44.8	0	0	0	0	108.1	T645 E649	T645-T647 PolarHBondContact O-N 2.92Å; T647-E649 PolarHBondContact O-N 3.12Å
648	N	27.8	Very low	46	Very low	163 Å²	163	127.5 Å²	127.5	87%	0.872	66%	0.661	S	S	*	*			trans	-71	39.1	171.6	-83.3	-12.2	0	0	0	112.8	P646	P646-N648 PolarHBondContact O-N 3.13Å
649	E	28.6	Very low	43.3	Very low	168 Å²	168	130.1 Å²	130.1	79%	0.785	68%	0.675	S	S	*	*			trans	-94	107.2	171.4	-71	-171.8	177.4	0	0	108.1	T647 N651	T647-E649 PolarHBondContact O-N 3.12Å; E649-N651 PolarHBondContact O-N 3Å
650	L	27.7	Very low	40.8	Very low	161 Å²	161	129 Å²	129	84%	0.843	68%	0.676	S	S	*	*			trans	-48.4	128.9	179.3	-89.8	91.7	0	0	0	111.4	N652	L650-N652 PolarHBondContact O-N 2.6Å
651	N	27.6	Very low	38.5	Very low	140 Å²	140	129.4 Å²	129.4	75%	0.749	68%	0.684	S	S	*	*			trans	-47.3	108.6	164.3	-75.6	-29.5	0	0	0	111	E649 N653	E649-N651 PolarHBondContact O-N 3Å; N651-N653 PolarHBondContact O-N 3.2Å
652	N	28.7	Very low	36.3	Very low	159 Å²	159	133.6 Å²	133.6	85%	0.85	70%	0.696	S	S	*	*			trans	-74.6	104.8	155.6	-79.1	-28.7	0	0	0	107.3	L650 E654	L650-N652 PolarHBondContact O-N 2.6Å; N652-E654 PolarHBondContact O-N 3.23Å; N652-E654 VanDerWaalsContact O-N 3.08Å
653	N	27.5	Very low	34.3	Very low	146 Å²	146	140.3 Å²	140.3	78%	0.781	73%	0.732	S	S	*	*			trans	-54.4	104.4	177.7	-65.1	-42.9	0	0	0	111.4	N651	N651-N653 PolarHBondContact O-N 3.2Å
654	E	30.3	Very low	32.5	Very low	175 Å²	175	144.8 Å²	144.8	82%	0.818	76%	0.756	S	S	*	*			trans	-91	104.9	156.1	-74	-167.4	171.1	0	0	108.7	N652 Y656	N652-E654 PolarHBondContact O-N 3.23Å; N652-E654 VanDerWaalsContact O-N 3.08Å; E654-Y656 PolarHBondContact O-N 2.81Å
655	Q	25.8	Very low	31.1	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.864	77%	0.765	S	S	*	*			trans	-59.5	95.5	173.5	-71.6	174.3	-39.5	0	0	110.3
656	Y	30.4	Very low	29.9	Very low	220 Å²	220	151 Å²	151	86%	0.863	78%	0.782	S	S	*	*			trans	-86.2	112.6	163.7	-115.9	-91.3	0	0	0	109.5	E654 N658	E654-Y656 PolarHBondContact O-N 2.81Å; Y656-N658 PolarHBondContact O-N 3.43Å
657	N	30.8	Very low	29.3	Very low	152 Å²	152	154.7 Å²	154.7	81%	0.813	80%	0.798	S	S	*	*			trans	-52.8	123.7	-178.4	-88.1	-36.5	0	0	0	112.8	N659	N657-N659 PolarHBondContact O-N 3.25Å
658	N	29.3	Very low	29.1	Very low	153 Å²	153	156.7 Å²	156.7	82%	0.818	81%	0.805	S	S	*	*			trans	-52.6	123.6	161.4	-84.7	-32.7	0	0	0	110.7	Y656	Y656-N658 PolarHBondContact O-N 3.43Å
659	N	30	Very low	29.5	Very low	145 Å²	145	158.9 Å²	158.9	78%	0.775	81%	0.807	S	S	*	*			trans	-152.1	114.1	150.4	-96.5	-25.6	0	0	0	111.5	N657	N657-N659 PolarHBondContact O-N 3.25Å
660	N	29.3	Very low	29.8	Very low	131 Å²	131	155.1 Å²	155.1	70%	0.701	80%	0.8	S	S	*	*			trans	82.7	99.8	144.2	-63.3	-22	0	0	0	121.2
661	N	27.9	Very low	30.3	Very low	135 Å²	135	152.8 Å²	152.8	72%	0.722	80%	0.795	S	S	*	*				70.2	107.9	117.4	-71	-13.3	0	0	0	120.5
662	N	29.6	Very low	31.5	Very low	132 Å²	132	153.2 Å²	153.2	71%	0.706	80%	0.798	S	S	*	*			trans	51	96.3	130.3	-68.2	-9.8	0	0	0	118
663	N	30.8	Very low	33.2	Very low	170 Å²	170	149.2 Å²	149.2	91%	0.909	78%	0.776	S	S	*	*			trans	-142.3	84.8	135.9	-92.2	-27.7	0	0	0	108.7	N665	N663-N665 PolarHBondContact O-N 3.03Å
664	N	31.2	Very low	35.5	Very low	142 Å²	142	143.9 Å²	143.9	76%	0.759	75%	0.747	S	S	*	*			trans	-63.3	119.4	161	-77.7	-17.1	0	0	0	107.9
665	N	28.9	Very low	37.9	Very low	147 Å²	147	139.9 Å²	139.9	79%	0.786	73%	0.732	S	S	*	*			trans	162.6	47.2	147.4	-81.6	-11.5	0	0	0	112.8	N663	N663-N665 PolarHBondContact O-N 3.03Å
666	N	29.2	Very low	40.7	Very low	169 Å²	169	137.8 Å²	137.8	90%	0.904	72%	0.722	S	S	*	*	S	Bend	trans	-117.1	91	162.1	-82.7	-20.4	0	0	0	109.2	D668	N666-D668 PolarHBondContact O-N 3.38Å
667	N	28.9	Very low	43.4	Very low	152 Å²	152	135 Å²	135	81%	0.813	71%	0.714	S	S	*	*			trans	-4.8	110.1	161.5	-65.7	-26	0	0	0	115.1	F669	N667-F669 PolarHBondContact O-N 3.5Å
668	D	31.1	Very low	46.1	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	69%	0.685	S	S	*	*			trans	-63.2	63.4	179.3	-146.8	-0	0	0	0	112.8	N666 S670	N666-D668 PolarHBondContact O-N 3.38Å; D668-S670 PolarHBondContact O-N 3.05Å; D668-S670 VanDerWaalsContact O-N 3.13Å
669	F	36.2	Very low	49	Very low	209 Å²	209	122.9 Å²	122.9	92%	0.917	65%	0.65	S	S	*	*			trans	-80	28.5	169.1	-113.4	-80	0	0	0	111.9	N667 C671	N667-F669 PolarHBondContact O-N 3.5Å; F669-C671 PolarHBondContact O-N 3.19Å
670	S	34.3	Very low	51.8	Low	89 Å²	89	118.9 Å²	118.9	62%	0.622	63%	0.629	S	S	*	*			trans	-97.8	55.3	177.7	-177.9	0	0	0	0	110.6	D668 D672	D668-S670 PolarHBondContact O-N 3.05Å; D668-S670 VanDerWaalsContact O-N 3.13Å; S670-D672 PolarHBondContact O-N 3.02Å
671	C	38.4	Very low	54.8	Low	111 Å²	111	116.1 Å²	116.1	75%	0.75	61%	0.612	S	S	*	*			trans	-87.4	99.6	165.9	-82.8	0	0	0	0	109.1	F669 L673	F669-C671 PolarHBondContact O-N 3.19Å; C671-L673 WeakPolarHBondContact O-CA 3.43Å; C671-L673 PolarHBondContact O-N 2.91Å
672	D	53.1	Low	57.9	Low	149 Å²	149	109.7 Å²	109.7	80%	0.797	58%	0.577	S	S	*	*			trans	11.1	69.7	146.8	-60.5	-28.4	0	0	0	116.1	S670 L674	S670-D672 PolarHBondContact O-N 3.02Å; D672-L674 PolarHBondContact O-N 3.47Å; D672-L674 VanDerWaalsContact O-N 3.16Å
673	L	64.7	Low	60.8	Low	76 Å²	76	104.5 Å²	104.5	40%	0.398	55%	0.551	S	S	.	*	S	Bend	trans	-63.4	-29.4	-167.8	-163.2	73.2	0	0	0	113	K636 C671 L714	K636-L673 HydrophobicContact CD-CD2 3.83Å; C671-L673 WeakPolarHBondContact O-CA 3.43Å; C671-L673 PolarHBondContact O-N 2.91Å; L673-L714 HydrophobicContact CD2-CD2 3.36Å; L673-L714 HydrophobicContact CG-CD2 3.66Å
674	L	76	Confident	63.7	Low	34 Å²	34	100.3 Å²	100.3	18%	0.178	53%	0.532	C	S	.	.	S	Bend	trans	-139.8	129.8	170.6	-71.8	170.7	0	0	0	107.7	D672 E676 I679 L710 L713 L714	D672-L674 PolarHBondContact O-N 3.47Å; D672-L674 VanDerWaalsContact O-N 3.16Å; L674-E676 PolarHBondContact O-N 3.35Å; L674-I679 HydrophobicContact CB-CD1 4.19Å; L674-I679 HydrophobicContact CB-CG1 4.4Å; L674-L710 HydrophobicContact CD1-CD2 3.79Å; L674-L713 HydrophobicContact CD2-CB 3.86Å; L674-L713 HydrophobicContact CD2-CD1 4.06Å; L674-L714 HydrophobicContact CD1-CD1 4.09Å; L674-L714 HydrophobicContact CD1-CD2 3.84Å; L674-L714 HydrophobicContact CD1-CG 3.87Å; L674-L714 HydrophobicContact CD2-CD2 4.4Å; L674-L714 HydrophobicContact CG-CD2 3.87Å; L674-L714 HydrophobicContact CG-CG 4.41Å
675	N	80.8	Confident	66.7	Low	91 Å²	91	93.6 Å²	93.6	49%	0.487	50%	0.496	S	S	.	.			trans	-59.4	132	178.7	-172.7	-25.3	0	0	0	110.4	K677 V678 I679	N675-K677 PolarHBondContact O-N 3.14Å; N675-K677 VanDerWaalsContact O-N 3.11Å; N675-K677 WeakPolarHBondContact OD1-CB 3.39Å; N675-K677 PolarHBondContact OD1-N 3.37Å; N675-V678 HydrophobicContact CB-CG2 4.16Å; N675-V678 WeakPolarHBondContact O-CA 3.38Å; N675-V678 WeakPolarHBondContact O-CB 3.11Å; N675-V678 PolarHBondContact O-N 3.19Å; N675-I679 PolarHBondContact O-N 3.48Å
676	E	83.8	Confident	69.7	Low	140 Å²	140	87 Å²	87	65%	0.654	46%	0.461	S	S	*	.	H	α-helix	trans	-53.4	-34.2	177.5	-161.3	-167	153.6	0	0	112	L674 V678 I679 N680	L674-E676 PolarHBondContact O-N 3.35Å; E676-V678 VanDerWaalsContact C-N 3.3Å; E676-V678 PolarHBondContact O-N 2.7Å; E676-I679 PolarHBondContact O-N 2.89Å; E676-N680 WeakPolarHBondContact O-CB 3.43Å; E676-N680 PolarHBondContact O-N 3.34Å; E676-N680 PolarHBondContact O-ND2 3.18Å
677	K	86.4	Confident	72.6	Confident	161 Å²	161	82.2 Å²	82.2	70%	0.7	44%	0.439	S	S	*	.	H	α-helix	trans	-58.1	-40.3	173.7	-66.1	-177.4	178.9	-179.9	0	112.6	N675 Q681	N675-K677 PolarHBondContact O-N 3.14Å; N675-K677 VanDerWaalsContact O-N 3.11Å; N675-K677 WeakPolarHBondContact OD1-CB 3.39Å; N675-K677 PolarHBondContact OD1-N 3.37Å; K677-Q681 VanDerWaalsContact O-CB 3.23Å; K677-Q681 WeakPolarHBondContact O-CB 3.44Å; K677-Q681 PolarHBondContact O-N 2.91Å
678	V	88.5	Confident	75.6	Confident	33 Å²	33	81.1 Å²	81.1	20%	0.2	42%	0.423	C	S	.	.	H	α-helix	trans	-66.4	-44.4	177.7	168.5	0	0	0	0	110.4	N675 E676 N680 Q681 I682 L713 Y722	N675-V678 HydrophobicContact CB-CG2 4.16Å; N675-V678 WeakPolarHBondContact O-CA 3.38Å; N675-V678 WeakPolarHBondContact O-CB 3.11Å; N675-V678 PolarHBondContact O-N 3.19Å; E676-V678 VanDerWaalsContact C-N 3.3Å; E676-V678 PolarHBondContact O-N 2.7Å; V678-N680 VanDerWaalsContact C-N 3.35Å; V678-N680 PolarHBondContact O-N 3.24Å; V678-Q681 PolarHBondContact O-N 3.14Å; V678-I682 HydrophobicContact CG1-CD1 3.89Å; V678-I682 HydrophobicContact CG1-CG1 4.5Å; V678-I682 WeakPolarHBondContact O-CG1 3.26Å; V678-I682 PolarHBondContact O-N 3.29Å; V678-L713 HydrophobicContact CG1-CD1 4.28Å; V678-Y722 VanDerWaalsContact CG1-CB 3.46Å; V678-Y722 HydrophobicContact CG1-CD1 4.31Å; V678-Y722 HydrophobicContact CG1-CG 4.05Å
679	I	89.3	Confident	78.6	Confident	18 Å²	18	74.5 Å²	74.5	9%	0.092	39%	0.388	C	S	.	.	H	α-helix	trans	-63.2	-43.1	179.6	-64.7	155.8	0	0	0	111	L642 L674 N675 E676 S683 R706	L642-I679 HydrophobicContact CD1-CD1 4.46Å; L642-I679 HydrophobicContact CD2-CD1 3.41Å; L642-I679 VanDerWaalsContact CD2-CD1 3.41Å; L642-I679 HydrophobicContact CD2-CG1 4.12Å; L642-I679 HydrophobicContact CD2-CG2 4.24Å; L674-I679 HydrophobicContact CB-CD1 4.19Å; L674-I679 HydrophobicContact CB-CG1 4.4Å; N675-I679 PolarHBondContact O-N 3.48Å; E676-I679 PolarHBondContact O-N 2.89Å; I679-S683 PolarHBondContact O-N 3.4Å; I679-S683 VanDerWaalsContact O-N 3.12Å; I679-S683 PolarHBondContact O-OG 3.36Å; I679-R706 VanDerWaalsContact CG2-NH2 3.27Å
680	N	89.8	Confident	81.3	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.332	35%	0.348	S	S	.	.	H	α-helix	trans	-67.3	-41.3	176.9	-70.9	-21.6	0	0	0	111.4	E676 V678 S683 V684	E676-N680 WeakPolarHBondContact O-CB 3.43Å; E676-N680 PolarHBondContact O-N 3.34Å; E676-N680 PolarHBondContact O-ND2 3.18Å; V678-N680 VanDerWaalsContact C-N 3.35Å; V678-N680 PolarHBondContact O-N 3.24Å; N680-S683 WeakPolarHBondContact O-CB 3.48Å; N680-S683 PolarHBondContact O-N 2.88Å; N680-V684 WeakPolarHBondContact O-CG2 3.49Å; N680-V684 PolarHBondContact O-N 3.32Å; N680-V684 VanDerWaalsContact O-N 3.16Å
681	Q	91.9	Very high	84	Confident	72 Å²	72	63.5 Å²	63.5	34%	0.336	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-47.2	176.8	-174.9	60.8	43.3	0	0	111.9	K677 V678 S683 V684 D685 Y722	K677-Q681 VanDerWaalsContact O-CB 3.23Å; K677-Q681 WeakPolarHBondContact O-CB 3.44Å; K677-Q681 PolarHBondContact O-N 2.91Å; V678-Q681 PolarHBondContact O-N 3.14Å; Q681-S683 VanDerWaalsContact C-N 3.28Å; Q681-S683 PolarHBondContact O-N 3.18Å; Q681-V684 PolarHBondContact O-N 3.35Å; Q681-D685 WeakPolarHBondContact CG-OD2 3.42Å; Q681-D685 PolarHBondContact NE2-OD2 3.4Å; Q681-D685 PolarHBondContact O-N 3.28Å; Q681-Y722 HydrophobicContact CB-CE1 4.44Å; Q681-Y722 HydrophobicContact CG-CD1 4.36Å; Q681-Y722 HydrophobicContact CG-CE1 3.89Å
682	I	93.5	Very high	86.5	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-54.7	-46.9	173.9	-70.2	167.2	0	0	0	110	V678 V684 D685 L686 R706 L709 L710 L713 Y722	V678-I682 HydrophobicContact CG1-CD1 3.89Å; V678-I682 HydrophobicContact CG1-CG1 4.5Å; V678-I682 WeakPolarHBondContact O-CG1 3.26Å; V678-I682 PolarHBondContact O-N 3.29Å; I682-V684 PolarHBondContact O-N 3.46Å; I682-D685 PolarHBondContact O-N 3.17Å; I682-D685 VanDerWaalsContact O-N 3.13Å; I682-L686 HydrophobicContact CG2-CD1 3.72Å; I682-L686 HydrophobicContact CG2-CD2 4.43Å; I682-L686 HydrophobicContact CG2-CG 4.01Å; I682-L686 WeakPolarHBondContact O-CG 3.46Å; I682-L686 PolarHBondContact O-N 3.34Å; I682-L686 VanDerWaalsContact O-N 3.11Å; I682-R706 HydrophobicContact CG2-CG 4.29Å; I682-L709 HydrophobicContact CG2-CD1 4.18Å; I682-L710 HydrophobicContact CD1-CD2 3.79Å; I682-L713 HydrophobicContact CD1-CD1 4.46Å; I682-Y722 HydrophobicContact CD1-CD2 3.95Å; I682-Y722 HydrophobicContact CD1-CE2 4.22Å; I682-Y722 HydrophobicContact CD1-CG 4.11Å; I682-Y722 HydrophobicContact CG1-CD1 3.89Å; I682-Y722 HydrophobicContact CG1-CD2 3.76Å; I682-Y722 HydrophobicContact CG1-CE1 3.72Å; I682-Y722 HydrophobicContact CG1-CE2 3.6Å; I682-Y722 HydrophobicContact CG1-CG 3.9Å
683	S	90.4	Very high	88.3	Confident	23 Å²	23	57.6 Å²	57.6	16%	0.161	29%	0.29	C	S	.	.	H	α-helix	trans	-57.5	-33.1	179.5	-51.3	0	0	0	0	113.4	I679 N680 Q681 P687 R706	I679-S683 PolarHBondContact O-N 3.4Å; I679-S683 VanDerWaalsContact O-N 3.12Å; I679-S683 PolarHBondContact O-OG 3.36Å; N680-S683 WeakPolarHBondContact O-CB 3.48Å; N680-S683 PolarHBondContact O-N 2.88Å; Q681-S683 VanDerWaalsContact C-N 3.28Å; Q681-S683 PolarHBondContact O-N 3.18Å; S683-P687 WeakPolarHBondContact O-CD 3.35Å; S683-R706 PolarHBondContact OG-NH1 2.91Å
684	V	91.8	Very high	89.6	Confident	83 Å²	83	55.4 Å²	55.4	50%	0.503	28%	0.281	S	S	.	.	H	α-helix	trans	-81	-31.3	179.5	171.7	0	0	0	0	112.3	N680 Q681 I682 R688	N680-V684 WeakPolarHBondContact O-CG2 3.49Å; N680-V684 PolarHBondContact O-N 3.32Å; N680-V684 VanDerWaalsContact O-N 3.16Å; Q681-V684 PolarHBondContact O-N 3.35Å; I682-V684 PolarHBondContact O-N 3.46Å; V684-R688 PolarHBondContact O-NH1 3.46Å
685	D	93.4	Very high	90.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-76.9	-38.1	-179.1	-77.7	-42.4	0	0	0	113.4	Q681 I682 R688 C689 Y722	Q681-D685 WeakPolarHBondContact CG-OD2 3.42Å; Q681-D685 PolarHBondContact NE2-OD2 3.4Å; Q681-D685 PolarHBondContact O-N 3.28Å; I682-D685 PolarHBondContact O-N 3.17Å; I682-D685 VanDerWaalsContact O-N 3.13Å; D685-R688 WeakPolarHBondContact O-CG 3.29Å; D685-R688 PolarHBondContact O-N 3.07Å; D685-R688 IonicContact OD1-CZ 3.07Å; D685-R688 IonicContact OD1-NE 2.7Å; D685-R688 PolarHBondContact OD1-NE 3.45Å; D685-R688 IonicContact OD1-NH2 3.36Å; D685-R688 PolarHBondContact OD1-NH2 3.08Å; D685-C689 PolarHBondContact O-N 2.74Å; D685-C689 VanDerWaalsContact O-N 3.15Å; D685-Y722 PolarHBondContact OD2-OH 3.28Å; D685-Y722 VanDerWaalsContact OD2-OH 3.13Å
686	L	93.1	Very high	91	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-43.1	-172.4	-65.7	169.3	0	0	0	115.4	I682 R688 C689 Q702 L705 R706 L709	I682-L686 HydrophobicContact CG2-CD1 3.72Å; I682-L686 HydrophobicContact CG2-CD2 4.43Å; I682-L686 HydrophobicContact CG2-CG 4.01Å; I682-L686 WeakPolarHBondContact O-CG 3.46Å; I682-L686 PolarHBondContact O-N 3.34Å; I682-L686 VanDerWaalsContact O-N 3.11Å; L686-R688 PolarHBondContact O-N 2.92Å; L686-C689 PolarHBondContact O-N 2.78Å; L686-Q702 HydrophobicContact CB-CB 4.47Å; L686-Q702 HydrophobicContact CB-CG 4.5Å; L686-L705 HydrophobicContact CD2-CB 3.87Å; L686-L705 HydrophobicContact CD2-CD2 3.4Å; L686-L705 VanDerWaalsContact CD2-CD2 3.4Å; L686-L705 HydrophobicContact CD2-CG 3.4Å; L686-R706 HydrophobicContact CD1-CB 3.59Å; L686-R706 HydrophobicContact CD1-CG 4.04Å; L686-L709 HydrophobicContact CD2-CD1 4.08Å
687	P	89.5	Confident	91.3	Very high	68 Å²	68	43.1 Å²	43.1	44%	0.442	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-22.6	-177.4	-23.4	35.6	0	0	0	114.5	S683	S683-P687 WeakPolarHBondContact O-CD 3.35Å
688	R	90.9	Very high	91.4	Very high	130 Å²	130	35.6 Å²	35.6	49%	0.491	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-20.3	179.1	55.7	173.3	172.8	-115.6	13.8	113.3	V684 D685 L686 H690	V684-R688 PolarHBondContact O-NH1 3.46Å; D685-R688 WeakPolarHBondContact O-CG 3.29Å; D685-R688 PolarHBondContact O-N 3.07Å; D685-R688 IonicContact OD1-CZ 3.07Å; D685-R688 IonicContact OD1-NE 2.7Å; D685-R688 PolarHBondContact OD1-NE 3.45Å; D685-R688 IonicContact OD1-NH2 3.36Å; D685-R688 PolarHBondContact OD1-NH2 3.08Å; L686-R688 PolarHBondContact O-N 2.92Å; R688-H690 PolarHBondContact O-N 3.5Å; R688-H690 VanDerWaalsContact O-N 3.12Å
689	C	93.9	Very high	91.3	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.041	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	108.9	-177.4	-174	0	0	0	0	111.1	D685 L686 A691 L705 D727	D685-C689 PolarHBondContact O-N 2.74Å; D685-C689 VanDerWaalsContact O-N 3.15Å; L686-C689 PolarHBondContact O-N 2.78Å; C689-A691 PolarHBondContact O-N 2.88Å; C689-A691 VanDerWaalsContact O-N 3.14Å; C689-L705 HydrophobicContact CB-CD2 4.4Å; C689-D727 WeakPolarHBondContact CB-OD2 3.25Å; C689-D727 VanDerWaalsContact SG-C 3.6Å; C689-D727 PolarHBondContact SG-O 3.22Å; C689-D727 PolarHBondContact SG-OD2 3.31Å
690	H	94.2	Very high	91.2	Very high	16 Å²	16	37.5 Å²	37.5	7%	0.074	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	40	179.5	-62.8	-80.5	0	0	0	114.4	R688 Y692 D693 L696 A731 A811 L816	R688-H690 PolarHBondContact O-N 3.5Å; R688-H690 VanDerWaalsContact O-N 3.12Å; H690-Y692 HydrophobicContact CB-CE1 4.3Å; H690-Y692 AromaticContact ND1-CE1 3.81Å; H690-Y692 AromaticContact ND1-CZ 3.62Å; H690-Y692 PolarHBondContact ND1-OH 2.99Å; H690-Y692 PolarHBondContact O-N 3.35Å; H690-D693 WeakPolarHBondContact O-CB 3.31Å; H690-D693 PolarHBondContact O-N 2.92Å; H690-L696 HydrophobicContact CB-CD1 3.58Å; H690-A731 VanDerWaalsContact CD2-CB 3.5Å; H690-A731 WeakPolarHBondContact CD2-CB 3.42Å; H690-A811 PolarHBondContact CE1-O 3.38Å; H690-A811 PolarHBondContact NE2-O 2.63Å; H690-L816 HydrophobicContact CB-CD1 3.98Å
691	A	90.4	Very high	91.3	Very high	51 Å²	51	34.5 Å²	34.5	42%	0.421	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.5	-175.1	0	0	0	0	0	115.6	C689 A697	C689-A691 PolarHBondContact O-N 2.88Å; C689-A691 VanDerWaalsContact O-N 3.14Å; A691-A697 WeakPolarHBondContact O-CB 3.5Å
692	Y	90.3	Very high	91.4	Very high	130 Å²	130	33.3 Å²	33.3	51%	0.51	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-21.5	169.9	61	-99.1	0	0	0	112.9	H690 P815 L816	H690-Y692 HydrophobicContact CB-CE1 4.3Å; H690-Y692 AromaticContact ND1-CE1 3.81Å; H690-Y692 AromaticContact ND1-CZ 3.62Å; H690-Y692 PolarHBondContact ND1-OH 2.99Å; H690-Y692 PolarHBondContact O-N 3.35Å; Y692-P815 WeakPolarHBondContact OH-CA 3.26Å; Y692-L816 PolarHBondContact OH-N 3.2Å; Y692-L816 VanDerWaalsContact OH-N 3.09Å
693	D	92.6	Very high	91.3	Very high	6 Å²	6	35 Å²	35	3%	0.032	19%	0.193	C	C	.	.	S	Bend	trans	-78.8	123.2	177	179.4	-83.4	0	0	0	109.6	H690 L695 L696 A697 R735 L816	H690-D693 WeakPolarHBondContact O-CB 3.31Å; H690-D693 PolarHBondContact O-N 2.92Å; D693-L695 VanDerWaalsContact C-N 3.27Å; D693-L695 PolarHBondContact O-N 3.41Å; D693-L695 WeakPolarHBondContact OD1-CA 3.17Å; D693-L695 WeakPolarHBondContact OD1-CB 3.26Å; D693-L695 PolarHBondContact OD1-N 3.38Å; D693-L696 HydrophobicContact CB-CB 4.15Å; D693-L696 HydrophobicContact CB-CD1 4.02Å; D693-L696 HydrophobicContact CB-CG 4.26Å; D693-L696 PolarHBondContact O-N 3.36Å; D693-L696 PolarHBondContact OD1-N 3.32Å; D693-A697 WeakPolarHBondContact O-CB 3.43Å; D693-A697 PolarHBondContact O-N 2.57Å; D693-R735 IonicContact OD2-CZ 3.97Å; D693-R735 IonicContact OD2-NE 3.19Å; D693-R735 IonicContact OD2-NH1 2.66Å; D693-R735 PolarHBondContact OD2-NH1 3.37Å; D693-L816 HydrophobicContact CB-CD1 4.23Å
694	P	90.6	Very high	91.5	Very high	31 Å²	31	34 Å²	34	20%	0.201	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-31.6	-174.6	-25.5	34.5	0	0	0	114.3	V42 Y45 S698	V42-P694 HydrophobicContact CG1-CB 4.12Å; V42-P694 WeakPolarHBondContact CG1-O 3.32Å; Y45-P694 HydrophobicContact CD1-CB 3.61Å; Y45-P694 HydrophobicContact CE1-CB 3.74Å; Y45-P694 HydrophobicContact CG-CB 4.23Å; P694-S698 PolarHBondContact O-N 2.86Å
695	L	92.3	Very high	91.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-69.7	-53.3	176.2	175.5	63.4	0	0	0	109.3	Y45 A46 D693 A697 S698 G701 Y738	Y45-L695 HydrophobicContact CE1-CB 4.14Å; A46-L695 HydrophobicContact CB-CD1 4.11Å; D693-L695 VanDerWaalsContact C-N 3.27Å; D693-L695 PolarHBondContact O-N 3.41Å; D693-L695 WeakPolarHBondContact OD1-CA 3.17Å; D693-L695 WeakPolarHBondContact OD1-CB 3.26Å; D693-L695 PolarHBondContact OD1-N 3.38Å; L695-A697 VanDerWaalsContact C-N 3.31Å; L695-A697 PolarHBondContact O-N 3.06Å; L695-S698 WeakPolarHBondContact O-CB 3.08Å; L695-S698 PolarHBondContact O-N 3.14Å; L695-S698 VanDerWaalsContact O-N 3.14Å; L695-S698 PolarHBondContact O-OG 3.01Å; L695-G701 VanDerWaalsContact O-CA 3.3Å; L695-G701 WeakPolarHBondContact O-CA 3.38Å; L695-Y738 HydrophobicContact CD1-CD1 4.1Å; L695-Y738 HydrophobicContact CD1-CD2 4.34Å; L695-Y738 HydrophobicContact CD1-CE1 4Å; L695-Y738 HydrophobicContact CD1-CE2 4.3Å; L695-Y738 HydrophobicContact CD1-CG 4.26Å; L695-Y738 HydrophobicContact CD2-CD1 3.94Å; L695-Y738 HydrophobicContact CD2-CD2 4.15Å; L695-Y738 HydrophobicContact CD2-CG 3.64Å
696	L	94	Very high	91.8	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.164	C	C	.	.	H	α-helix	trans	-69	-27.7	-174.3	-60.9	170.8	0	0	0	113.3	H690 D693 S698 Q702 L705 A731 V734 L816	H690-L696 HydrophobicContact CB-CD1 3.58Å; D693-L696 HydrophobicContact CB-CB 4.15Å; D693-L696 HydrophobicContact CB-CD1 4.02Å; D693-L696 HydrophobicContact CB-CG 4.26Å; D693-L696 PolarHBondContact O-N 3.36Å; D693-L696 PolarHBondContact OD1-N 3.32Å; L696-S698 VanDerWaalsContact C-N 3.33Å; L696-Q702 WeakPolarHBondContact O-CG 3.19Å; L696-L705 HydrophobicContact CD2-CD2 4.41Å; L696-A731 HydrophobicContact CD1-CB 3.73Å; L696-A731 HydrophobicContact CD2-CB 4.24Å; L696-V734 HydrophobicContact CD2-CB 4.3Å; L696-V734 HydrophobicContact CD2-CG1 3.89Å; L696-L816 HydrophobicContact CD1-CD1 3.51Å
697	A	90.8	Very high	91.9	Very high	5 Å²	5	31.1 Å²	31.1	4%	0.041	17%	0.166	C	C	.	.	H	α-helix	trans	-74.4	-22.8	174.6	0	0	0	0	0	113.2	L38 V42 A691 D693 L695 Q702	L38-A697 WeakPolarHBondContact CD1-O 3.26Å; L38-A697 HydrophobicContact CD2-CB 3.81Å; V42-A697 HydrophobicContact CG1-CB 4.33Å; A691-A697 WeakPolarHBondContact O-CB 3.5Å; D693-A697 WeakPolarHBondContact O-CB 3.43Å; D693-A697 PolarHBondContact O-N 2.57Å; L695-A697 VanDerWaalsContact C-N 3.31Å; L695-A697 PolarHBondContact O-N 3.06Å; A697-Q702 PolarHBondContact O-NE2 2.9Å
698	S	88.2	Confident	92.3	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.014	15%	0.145	C	C	.	.	S	Bend	trans	-73.2	151.9	178.2	77.8	0	0	0	0	112.1	A46 P694 L695 L696 I700 G701 Q702	A46-S698 WeakPolarHBondContact CB-OG 3.29Å; P694-S698 PolarHBondContact O-N 2.86Å; L695-S698 WeakPolarHBondContact O-CB 3.08Å; L695-S698 PolarHBondContact O-N 3.14Å; L695-S698 VanDerWaalsContact O-N 3.14Å; L695-S698 PolarHBondContact O-OG 3.01Å; L696-S698 VanDerWaalsContact C-N 3.33Å; S698-I700 PolarHBondContact O-N 3.34Å; S698-G701 PolarHBondContact O-N 3Å; S698-G701 VanDerWaalsContact O-N 3.16Å; S698-G701 PolarHBondContact OG-N 2.92Å; S698-Q702 WeakPolarHBondContact O-CG 3.38Å; S698-Q702 PolarHBondContact O-N 3.12Å
699	S	86.4	Confident	92.6	Very high	77 Å²	77	21.7 Å²	21.7	54%	0.538	12%	0.122	S	C	.	.	H	α-helix	trans	-58.9	-33.3	174.3	56	0	0	0	0	112.8	S703	S699-S703 WeakPolarHBondContact O-CB 3.47Å; S699-S703 PolarHBondContact O-N 2.67Å
700	I	87.3	Confident	92.6	Very high	14 Å²	14	21.4 Å²	21.4	7%	0.072	12%	0.12	C	C	.	.	H	α-helix	trans	-65.9	-48.7	176.5	-66.9	171.2	0	0	0	110.2	A46 R47 S698 Q702 S703 V704 Y738	A46-I700 HydrophobicContact CB-CB 4.27Å; A46-I700 HydrophobicContact CB-CD1 4.44Å; R47-I700 HydrophobicContact CB-CD1 4.25Å; R47-I700 HydrophobicContact CG-CD1 3.21Å; S698-I700 PolarHBondContact O-N 3.34Å; I700-Q702 VanDerWaalsContact C-N 3.35Å; I700-Q702 PolarHBondContact O-N 3.09Å; I700-S703 PolarHBondContact O-N 3.4Å; I700-V704 HydrophobicContact CG2-CG2 4.34Å; I700-V704 WeakPolarHBondContact O-CG2 3.14Å; I700-V704 PolarHBondContact O-N 3.29Å; I700-Y738 WeakPolarHBondContact CG2-OH 3.44Å
701	G	91.9	Very high	92.6	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.3	-39.9	177.9	0	0	0	0	0	112.5	L695 S698 V704 L705	L695-G701 VanDerWaalsContact O-CA 3.3Å; L695-G701 WeakPolarHBondContact O-CA 3.38Å; S698-G701 PolarHBondContact O-N 3Å; S698-G701 VanDerWaalsContact O-N 3.16Å; S698-G701 PolarHBondContact OG-N 2.92Å; G701-V704 PolarHBondContact O-N 2.7Å; G701-L705 VanDerWaalsContact O-CB 3.28Å; G701-L705 WeakPolarHBondContact O-CB 3.46Å; G701-L705 PolarHBondContact O-N 3.44Å
702	Q	93.2	Very high	92.8	Very high	46 Å²	46	18.2 Å²	18.2	22%	0.215	10%	0.096	C	C	.	.	H	α-helix	trans	-62.5	-43.2	174.3	-68.2	175	14.5	0	0	112	L686 L696 A697 S698 I700 L705 R706	L686-Q702 HydrophobicContact CB-CB 4.47Å; L686-Q702 HydrophobicContact CB-CG 4.5Å; L696-Q702 WeakPolarHBondContact O-CG 3.19Å; A697-Q702 PolarHBondContact O-NE2 2.9Å; S698-Q702 WeakPolarHBondContact O-CG 3.38Å; S698-Q702 PolarHBondContact O-N 3.12Å; I700-Q702 VanDerWaalsContact C-N 3.35Å; I700-Q702 PolarHBondContact O-N 3.09Å; Q702-L705 PolarHBondContact O-N 2.71Å; Q702-R706 WeakPolarHBondContact O-CB 3.28Å; Q702-R706 PolarHBondContact O-N 2.97Å
703	S	92.2	Very high	93	Very high	35 Å²	35	12.3 Å²	12.3	25%	0.245	7%	0.073	C	C	.	.	H	α-helix	trans	-65.6	-39.9	176.5	177.3	0	0	0	0	111.9	D643 S699 I700 R706 R707	D643-S703 PolarHBondContact OD1-OG 2.88Å; S699-S703 WeakPolarHBondContact O-CB 3.47Å; S699-S703 PolarHBondContact O-N 2.67Å; I700-S703 PolarHBondContact O-N 3.4Å; S703-R706 WeakPolarHBondContact O-CB 3.32Å; S703-R706 PolarHBondContact O-N 3.1Å; S703-R707 PolarHBondContact O-N 3.5Å; S703-R707 PolarHBondContact OG-NH1 3.27Å
704	V	93.9	Very high	92.9	Very high	3 Å²	3	12.4 Å²	12.4	2%	0.018	7%	0.074	C	C	.	.	H	α-helix	trans	-62.7	-49	173.5	173.3	0	0	0	0	110.9	I700 G701 R706 R707 V708 V734 Y738 E741	I700-V704 HydrophobicContact CG2-CG2 4.34Å; I700-V704 WeakPolarHBondContact O-CG2 3.14Å; I700-V704 PolarHBondContact O-N 3.29Å; G701-V704 PolarHBondContact O-N 2.7Å; V704-R706 VanDerWaalsContact C-N 3.28Å; V704-R706 PolarHBondContact O-N 3.29Å; V704-R707 PolarHBondContact O-N 2.83Å; V704-R707 VanDerWaalsContact O-N 3.16Å; V704-V708 HydrophobicContact CG1-CG2 4.32Å; V704-V708 WeakPolarHBondContact O-CG2 3.35Å; V704-V708 PolarHBondContact O-N 3.11Å; V704-V734 HydrophobicContact CG1-CG1 3.88Å; V704-V734 HydrophobicContact CG1-CG2 4.34Å; V704-Y738 HydrophobicContact CG1-CD2 4.21Å; V704-Y738 HydrophobicContact CG1-CE2 4.45Å; V704-Y738 HydrophobicContact CG2-CD2 4.25Å; V704-Y738 HydrophobicContact CG2-CE2 3.68Å; V704-E741 HydrophobicContact CG1-CG 3.86Å; V704-E741 WeakPolarHBondContact CG2-OE1 3.39Å
705	L	96.6	Very high	92.8	Very high	1 Å²	1	12.8 Å²	12.8	1%	0.005	7%	0.073	C	C	.	.	H	α-helix	trans	-60.4	-40.2	179.2	-178	59.5	0	0	0	111.3	L686 C689 L696 G701 Q702 V708 L709 A730 V734	L686-L705 HydrophobicContact CD2-CB 3.87Å; L686-L705 HydrophobicContact CD2-CD2 3.4Å; L686-L705 VanDerWaalsContact CD2-CD2 3.4Å; L686-L705 HydrophobicContact CD2-CG 3.4Å; C689-L705 HydrophobicContact CB-CD2 4.4Å; L696-L705 HydrophobicContact CD2-CD2 4.41Å; G701-L705 VanDerWaalsContact O-CB 3.28Å; G701-L705 WeakPolarHBondContact O-CB 3.46Å; G701-L705 PolarHBondContact O-N 3.44Å; Q702-L705 PolarHBondContact O-N 2.71Å; L705-V708 PolarHBondContact O-N 2.89Å; L705-L709 HydrophobicContact CD1-CD1 4.44Å; L705-L709 HydrophobicContact CD1-CG 4.48Å; L705-L709 HydrophobicContact CG-CD1 4.28Å; L705-L709 WeakPolarHBondContact O-CB 3.49Å; L705-L709 VanDerWaalsContact O-CG 3.32Å; L705-L709 WeakPolarHBondContact O-CG 3.5Å; L705-L709 PolarHBondContact O-N 3.36Å; L705-A730 HydrophobicContact CD1-CB 3.55Å; L705-V734 HydrophobicContact CB-CG2 4.4Å; L705-V734 HydrophobicContact CD1-CB 4.49Å; L705-V734 HydrophobicContact CD1-CG2 3.79Å
706	R	96	Very high	92.4	Very high	6 Å²	6	18.4 Å²	18.4	2%	0.023	10%	0.098	C	C	.	.	H	α-helix	trans	-57.3	-53.3	171.6	-171.2	178.1	179.4	81.6	-6.9	111.8	L642 I679 I682 S683 L686 Q702 S703 V704 V708 L709 L710	L642-R706 VanDerWaalsContact O-CZ 3.24Å; L642-R706 PolarHBondContact O-NE 3.44Å; L642-R706 PolarHBondContact O-NH2 3.46Å; I679-R706 VanDerWaalsContact CG2-NH2 3.27Å; I682-R706 HydrophobicContact CG2-CG 4.29Å; S683-R706 PolarHBondContact OG-NH1 2.91Å; L686-R706 HydrophobicContact CD1-CB 3.59Å; L686-R706 HydrophobicContact CD1-CG 4.04Å; Q702-R706 WeakPolarHBondContact O-CB 3.28Å; Q702-R706 PolarHBondContact O-N 2.97Å; S703-R706 WeakPolarHBondContact O-CB 3.32Å; S703-R706 PolarHBondContact O-N 3.1Å; V704-R706 VanDerWaalsContact C-N 3.28Å; V704-R706 PolarHBondContact O-N 3.29Å; R706-V708 VanDerWaalsContact C-N 3.34Å; R706-V708 PolarHBondContact O-N 2.87Å; R706-L709 PolarHBondContact O-N 2.89Å; R706-L710 HydrophobicContact CG-CD1 3.88Å; R706-L710 HydrophobicContact CG-CG 4.42Å; R706-L710 WeakPolarHBondContact O-CB 3.23Å; R706-L710 VanDerWaalsContact O-CG 3.29Å; R706-L710 WeakPolarHBondContact O-CG 3.45Å; R706-L710 PolarHBondContact O-N 3.28Å
707	R	95.4	Very high	91.9	Very high	25 Å²	25	21.9 Å²	21.9	9%	0.094	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-42.3	-179.9	-76	-165.4	-65.3	-78.9	-9.9	112	L634 D643 S703 V704 L710 A711 E741	L634-R707 VanDerWaalsContact CD1-CD 3.48Å; L634-R707 HydrophobicContact CD1-CG 4.3Å; D643-R707 IonicContact OD1-NH1 2.76Å; D643-R707 PolarHBondContact OD1-NH1 3.09Å; D643-R707 IonicContact OD2-NH1 2.68Å; D643-R707 PolarHBondContact OD2-NH1 3.15Å; S703-R707 PolarHBondContact O-N 3.5Å; S703-R707 PolarHBondContact OG-NH1 3.27Å; V704-R707 PolarHBondContact O-N 2.83Å; V704-R707 VanDerWaalsContact O-N 3.16Å; R707-L710 PolarHBondContact O-N 3.33Å; R707-A711 WeakPolarHBondContact O-CB 3.49Å; R707-A711 PolarHBondContact O-N 2.95Å; R707-E741 IonicContact CZ-OE1 2.61Å; R707-E741 IonicContact CZ-OE2 3.36Å; R707-E741 IonicContact NE-OE1 3.47Å; R707-E741 PolarHBondContact NE-OE1 2.86Å; R707-E741 IonicContact NE-OE2 3Å; R707-E741 PolarHBondContact NE-OE2 2.9Å; R707-E741 IonicContact NH2-OE1 2.81Å; R707-E741 PolarHBondContact NH2-OE1 3.2Å; R707-E741 IonicContact NH2-OE2 2.97Å
708	V	97.1	Very high	91.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62	-45.7	177.6	167.6	0	0	0	0	111.5	V704 L705 R706 T712 V734 E741 A744 A745 L748	V704-V708 HydrophobicContact CG1-CG2 4.32Å; V704-V708 WeakPolarHBondContact O-CG2 3.35Å; V704-V708 PolarHBondContact O-N 3.11Å; L705-V708 PolarHBondContact O-N 2.89Å; R706-V708 VanDerWaalsContact C-N 3.34Å; R706-V708 PolarHBondContact O-N 2.87Å; V708-T712 VanDerWaalsContact O-CB 3.31Å; V708-T712 WeakPolarHBondContact O-CB 3.38Å; V708-T712 PolarHBondContact O-N 2.85Å; V708-T712 PolarHBondContact O-OG1 3.38Å; V708-V734 HydrophobicContact CB-CG2 4.15Å; V708-V734 HydrophobicContact CG1-CG2 4.2Å; V708-V734 HydrophobicContact CG2-CG2 4.01Å; V708-E741 HydrophobicContact CG2-CB 4.06Å; V708-A744 HydrophobicContact CG1-CB 4.25Å; V708-A744 HydrophobicContact CG2-CB 4.01Å; V708-A745 HydrophobicContact CG1-CB 4.21Å; V708-L748 HydrophobicContact CG1-CD2 4.25Å
709	L	96.6	Very high	91.3	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-52.9	176.6	-75.2	168.7	0	0	0	111.7	I682 L686 L705 R706 A711 T712 L713 Y722 M726 D727 A730 L748	I682-L709 HydrophobicContact CG2-CD1 4.18Å; L686-L709 HydrophobicContact CD2-CD1 4.08Å; L705-L709 HydrophobicContact CD1-CD1 4.44Å; L705-L709 HydrophobicContact CD1-CG 4.48Å; L705-L709 HydrophobicContact CG-CD1 4.28Å; L705-L709 WeakPolarHBondContact O-CB 3.49Å; L705-L709 VanDerWaalsContact O-CG 3.32Å; L705-L709 WeakPolarHBondContact O-CG 3.5Å; L705-L709 PolarHBondContact O-N 3.36Å; R706-L709 PolarHBondContact O-N 2.89Å; L709-A711 VanDerWaalsContact C-N 3.34Å; L709-A711 PolarHBondContact O-N 2.93Å; L709-T712 WeakPolarHBondContact O-CB 3.34Å; L709-T712 PolarHBondContact O-N 3.27Å; L709-L713 WeakPolarHBondContact O-CG 3.07Å; L709-L713 PolarHBondContact O-N 3.43Å; L709-L713 VanDerWaalsContact O-N 3.15Å; L709-Y722 HydrophobicContact CD1-CE2 4.09Å; L709-Y722 HydrophobicContact CD2-CD2 4.47Å; L709-Y722 HydrophobicContact CD2-CE2 4.13Å; L709-M726 HydrophobicContact CD2-CB 4.33Å; L709-M726 HydrophobicContact CD2-CE 4.1Å; L709-M726 HydrophobicContact CD2-CG 3.76Å; L709-M726 HydrophobicContact CD2-SD 4.16Å; L709-D727 HydrophobicContact CD1-CB 4.05Å; L709-A730 HydrophobicContact CD2-CB 3.6Å; L709-A730 HydrophobicContact CG-CB 4.04Å; L709-L748 HydrophobicContact CD2-CD2 4.32Å
710	L	94.9	Very high	91.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.7	-43.5	-179.9	-66.8	175.9	0	0	0	111.3	I637 L642 L674 I682 R706 R707 T712 L713 L714	I637-L710 HydrophobicContact CD1-CB 3.59Å; I637-L710 HydrophobicContact CD1-CD1 4.5Å; I637-L710 HydrophobicContact CG1-CB 4.02Å; I637-L710 HydrophobicContact CG1-CD1 4.43Å; I637-L710 HydrophobicContact CG2-CD1 4.27Å; L642-L710 HydrophobicContact CB-CD1 4.16Å; L674-L710 HydrophobicContact CD1-CD2 3.79Å; I682-L710 HydrophobicContact CD1-CD2 3.79Å; R706-L710 HydrophobicContact CG-CD1 3.88Å; R706-L710 HydrophobicContact CG-CG 4.42Å; R706-L710 WeakPolarHBondContact O-CB 3.23Å; R706-L710 VanDerWaalsContact O-CG 3.29Å; R706-L710 WeakPolarHBondContact O-CG 3.45Å; R706-L710 PolarHBondContact O-N 3.28Å; R707-L710 PolarHBondContact O-N 3.33Å; L710-T712 VanDerWaalsContact C-N 3.33Å; L710-T712 PolarHBondContact O-N 3.42Å; L710-L713 PolarHBondContact O-N 3.35Å; L710-L714 WeakPolarHBondContact O-CB 3.31Å; L710-L714 WeakPolarHBondContact O-CG 3.21Å; L710-L714 PolarHBondContact O-N 3.46Å
711	A	94.8	Very high	91.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.5	-41	178.7	0	0	0	0	0	111.5	Y630 A633 I637 R707 L709 L713 L714 M715	Y630-A711 HydrophobicContact CD2-CB 3.58Å; Y630-A711 HydrophobicContact CE2-CB 3.39Å; A633-A711 HydrophobicContact CB-CB 3.98Å; I637-A711 HydrophobicContact CD1-CB 4.24Å; R707-A711 WeakPolarHBondContact O-CB 3.49Å; R707-A711 PolarHBondContact O-N 2.95Å; L709-A711 VanDerWaalsContact C-N 3.34Å; L709-A711 PolarHBondContact O-N 2.93Å; A711-L713 VanDerWaalsContact C-N 3.34Å; A711-L713 PolarHBondContact O-N 2.98Å; A711-L714 CarbonylContact O-C 3.53Å; A711-L714 PolarHBondContact O-N 2.88Å; A711-L714 VanDerWaalsContact O-N 3.08Å; A711-M715 WeakPolarHBondContact O-CB 3.39Å; A711-M715 WeakPolarHBondContact O-CG 3.19Å; A711-M715 PolarHBondContact O-N 3.48Å
712	T	94.8	Very high	91.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.6	-44.5	176.5	-61.7	0	0	0	0	111.8	V708 L709 L710 L714 L720 M726 L748 N749	V708-T712 VanDerWaalsContact O-CB 3.31Å; V708-T712 WeakPolarHBondContact O-CB 3.38Å; V708-T712 PolarHBondContact O-N 2.85Å; V708-T712 PolarHBondContact O-OG1 3.38Å; L709-T712 WeakPolarHBondContact O-CB 3.34Å; L709-T712 PolarHBondContact O-N 3.27Å; L710-T712 VanDerWaalsContact C-N 3.33Å; L710-T712 PolarHBondContact O-N 3.42Å; T712-L714 VanDerWaalsContact C-N 3.28Å; T712-L714 PolarHBondContact O-N 2.83Å; T712-L720 HydrophobicContact CG2-CD1 3.91Å; T712-M726 HydrophobicContact CG2-CE 3.77Å; T712-L748 HydrophobicContact CG2-CD2 4.03Å; T712-L748 HydrophobicContact CG2-CG 4.11Å; T712-N749 HydrophobicContact CG2-CB 4.09Å
713	L	92.6	Very high	91.4	Very high	5 Å²	5	27 Å²	27	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-31.4	176.2	-60.8	169	0	0	0	112.3	L674 V678 I682 L709 L710 A711 L720 M726	L674-L713 HydrophobicContact CD2-CB 3.86Å; L674-L713 HydrophobicContact CD2-CD1 4.06Å; V678-L713 HydrophobicContact CG1-CD1 4.28Å; I682-L713 HydrophobicContact CD1-CD1 4.46Å; L709-L713 WeakPolarHBondContact O-CG 3.07Å; L709-L713 PolarHBondContact O-N 3.43Å; L709-L713 VanDerWaalsContact O-N 3.15Å; L710-L713 PolarHBondContact O-N 3.35Å; A711-L713 VanDerWaalsContact C-N 3.34Å; A711-L713 PolarHBondContact O-N 2.98Å; L713-L720 HydrophobicContact CD2-CB 3.97Å; L713-M726 HydrophobicContact CD2-CE 4.04Å; L713-M726 HydrophobicContact CD2-SD 4.22Å; L713-M726 HydrophobicContact CG-CE 4.38Å
714	L	91.3	Very high	91.3	Very high	9 Å²	9	29.6 Å²	29.6	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-89.8	-19.1	-176.7	-69.4	177.2	0	0	0	114.7	A633 K636 I637 L673 L674 L710 A711 T712 K716 P717	A633-L714 HydrophobicContact CB-CB 3.84Å; K636-L714 HydrophobicContact CB-CD1 4.4Å; I637-L714 HydrophobicContact CD1-CD1 4.31Å; I637-L714 HydrophobicContact CG1-CD1 3.75Å; L673-L714 HydrophobicContact CD2-CD2 3.36Å; L673-L714 HydrophobicContact CG-CD2 3.66Å; L674-L714 HydrophobicContact CD1-CD1 4.09Å; L674-L714 HydrophobicContact CD1-CD2 3.84Å; L674-L714 HydrophobicContact CD1-CG 3.87Å; L674-L714 HydrophobicContact CD2-CD2 4.4Å; L674-L714 HydrophobicContact CG-CD2 3.87Å; L674-L714 HydrophobicContact CG-CG 4.41Å; L710-L714 WeakPolarHBondContact O-CB 3.31Å; L710-L714 WeakPolarHBondContact O-CG 3.21Å; L710-L714 PolarHBondContact O-N 3.46Å; A711-L714 CarbonylContact O-C 3.53Å; A711-L714 PolarHBondContact O-N 2.88Å; A711-L714 VanDerWaalsContact O-N 3.08Å; T712-L714 VanDerWaalsContact C-N 3.28Å; T712-L714 PolarHBondContact O-N 2.83Å; L714-K716 VanDerWaalsContact C-N 3.29Å; L714-P717 WeakPolarHBondContact O-CD 3.36Å; L714-P717 WeakPolarHBondContact O-CG 3.47Å
715	M	89	Confident	91.2	Very high	38 Å²	38	29.4 Å²	29.4	19%	0.187	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-36.1	176.9	-81.5	171.1	71.7	0	0	111.1	F626 A629 A711 A745	F626-M715 HydrophobicContact CB-CE 4.23Å; A629-M715 HydrophobicContact CB-CE 4.23Å; A629-M715 HydrophobicContact CB-CG 4.26Å; A711-M715 WeakPolarHBondContact O-CB 3.39Å; A711-M715 WeakPolarHBondContact O-CG 3.19Å; A711-M715 PolarHBondContact O-N 3.48Å; M715-A745 HydrophobicContact SD-CB 4.15Å
716	K	84.5	Confident	91.2	Very high	118 Å²	118	29.4 Å²	29.4	51%	0.513	17%	0.171	S	C	.	.	S	Bend	trans	-135.2	80.2	171.9	-65.9	-175.3	-177.9	-177.7	0	109.9	L714 G718 A719	L714-K716 VanDerWaalsContact C-N 3.29Å; K716-G718 PolarHBondContact O-N 3.15Å; K716-A719 HydrophobicContact CB-CB 3.82Å; K716-A719 VanDerWaalsContact O-CB 3.26Å; K716-A719 WeakPolarHBondContact O-CB 3.43Å; K716-A719 PolarHBondContact O-N 3.27Å; K716-A719 VanDerWaalsContact O-N 3.09Å
717	P	82.4	Confident	91.2	Very high	76 Å²	76	29.3 Å²	29.3	49%	0.494	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	134.2	-175.9	-24.8	34.9	0	0	0	112.2	L714 A719	L714-P717 WeakPolarHBondContact O-CD 3.36Å; L714-P717 WeakPolarHBondContact O-CG 3.47Å; P717-A719 PolarHBondContact O-N 3.21Å
718	G	81.7	Confident	91.3	Very high	68 Å²	68	28.2 Å²	28.2	70%	0.701	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.2	-4.1	-179.4	0	0	0	0	0	115.4	K716	K716-G718 PolarHBondContact O-N 3.15Å
719	A	84.3	Confident	91.4	Very high	45 Å²	45	28.2 Å²	28.2	37%	0.372	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-31.4	173	0	0	0	0	0	112.3	K716 P717	K716-A719 HydrophobicContact CB-CB 3.82Å; K716-A719 VanDerWaalsContact O-CB 3.26Å; K716-A719 WeakPolarHBondContact O-CB 3.43Å; K716-A719 PolarHBondContact O-N 3.27Å; K716-A719 VanDerWaalsContact O-N 3.09Å; P717-A719 PolarHBondContact O-N 3.21Å
720	L	89.2	Confident	91.5	Very high	19 Å²	19	28.2 Å²	28.2	10%	0.099	17%	0.168	C	C	.	.			trans	-130.7	141.2	-177.1	-62	173.5	0	0	0	110.8	T712 L713 L752 F760	T712-L720 HydrophobicContact CG2-CD1 3.91Å; L713-L720 HydrophobicContact CD2-CB 3.97Å; L720-L752 HydrophobicContact CD1-CD1 4.2Å; L720-L752 HydrophobicContact CD2-CB 4.49Å; L720-F760 CarbonylContact C-O 3.56Å; L720-F760 WeakPolarHBondContact CA-O 3.32Å; L720-F760 HydrophobicContact CD2-CB 4.03Å
721	D	89.4	Confident	91.6	Very high	63 Å²	63	28.2 Å²	28.2	34%	0.337	17%	0.168	S	C	.	.			trans	-116	137.9	171.2	-77.4	-16.5	0	0	0	109.9	T723 F760 S762	D721-T723 PolarHBondContact O-N 2.93Å; D721-F760 PolarHBondContact N-O 2.93Å; D721-S762 WeakPolarHBondContact OD2-CA 3.47Å; D721-S762 WeakPolarHBondContact OD2-CB 3.43Å; D721-S762 PolarHBondContact OD2-N 3.06Å; D721-S762 PolarHBondContact OD2-OG 3.17Å
722	Y	92.5	Very high	91.8	Very high	23 Å²	23	28.2 Å²	28.2	9%	0.09	17%	0.168	C	C	.	.			trans	-66.9	124.4	175.2	-175.6	-100.8	0	0	0	110.5	V678 Q681 I682 D685 L709 M726	V678-Y722 VanDerWaalsContact CG1-CB 3.46Å; V678-Y722 HydrophobicContact CG1-CD1 4.31Å; V678-Y722 HydrophobicContact CG1-CG 4.05Å; Q681-Y722 HydrophobicContact CB-CE1 4.44Å; Q681-Y722 HydrophobicContact CG-CD1 4.36Å; Q681-Y722 HydrophobicContact CG-CE1 3.89Å; I682-Y722 HydrophobicContact CD1-CD2 3.95Å; I682-Y722 HydrophobicContact CD1-CE2 4.22Å; I682-Y722 HydrophobicContact CD1-CG 4.11Å; I682-Y722 HydrophobicContact CG1-CD1 3.89Å; I682-Y722 HydrophobicContact CG1-CD2 3.76Å; I682-Y722 HydrophobicContact CG1-CE1 3.72Å; I682-Y722 HydrophobicContact CG1-CE2 3.6Å; I682-Y722 HydrophobicContact CG1-CG 3.9Å; D685-Y722 PolarHBondContact OD2-OH 3.28Å; D685-Y722 VanDerWaalsContact OD2-OH 3.13Å; L709-Y722 HydrophobicContact CD1-CE2 4.09Å; L709-Y722 HydrophobicContact CD2-CD2 4.47Å; L709-Y722 HydrophobicContact CD2-CE2 4.13Å; Y722-M726 HydrophobicContact CD2-CB 4.06Å; Y722-M726 HydrophobicContact CD2-CG 4.43Å; Y722-M726 HydrophobicContact CD2-SD 3.85Å; Y722-M726 HydrophobicContact CE2-CB 3.95Å
723	T	90.5	Very high	92	Very high	32 Å²	32	28.3 Å²	28.3	20%	0.196	17%	0.168	C	C	.	.			trans	-123.8	134.5	170.1	-59.5	0	0	0	0	107	D721 G725 M726 L765 Y807	D721-T723 PolarHBondContact O-N 2.93Å; T723-G725 PolarHBondContact O-N 2.72Å; T723-M726 WeakPolarHBondContact O-CB 3.28Å; T723-M726 PolarHBondContact O-N 2.95Å; T723-L765 HydrophobicContact CG2-CD1 4.42Å; T723-L765 HydrophobicContact CG2-CD2 3.56Å; T723-Y807 HydrophobicContact CG2-CE2 4.28Å
724	Q	89.9	Confident	92.2	Very high	90 Å²	90	28.1 Å²	28.1	42%	0.421	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	133.3	172.1	-175	-177.9	0.6	0	0	109	Y807	Q724-Y807 VanDerWaalsContact O-CE2 3.28Å; Q724-Y807 WeakPolarHBondContact O-CE2 3.49Å; Q724-Y807 PolarHBondContact O-OH 2.9Å
725	G	92.4	Very high	92.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.1	-25.4	-168.6	0	0	0	0	0	113.6	T723 D727 S728 V729	T723-G725 PolarHBondContact O-N 2.72Å; G725-D727 VanDerWaalsContact C-OD1 3.27Å; G725-D727 WeakPolarHBondContact CA-OD1 3.44Å; G725-D727 PolarHBondContact N-OD1 3.42Å; G725-D727 PolarHBondContact O-N 2.96Å; G725-S728 PolarHBondContact O-N 3.35Å; G725-S728 VanDerWaalsContact O-N 3.14Å; G725-V729 PolarHBondContact O-N 3.43Å
726	M	95.9	Very high	92.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-33.7	170.1	-170.5	179.2	170.3	0	0	111.5	L709 T712 L713 Y722 T723 V729 A730 L748 L752 F760	L709-M726 HydrophobicContact CD2-CB 4.33Å; L709-M726 HydrophobicContact CD2-CE 4.1Å; L709-M726 HydrophobicContact CD2-CG 3.76Å; L709-M726 HydrophobicContact CD2-SD 4.16Å; T712-M726 HydrophobicContact CG2-CE 3.77Å; L713-M726 HydrophobicContact CD2-CE 4.04Å; L713-M726 HydrophobicContact CD2-SD 4.22Å; L713-M726 HydrophobicContact CG-CE 4.38Å; Y722-M726 HydrophobicContact CD2-CB 4.06Å; Y722-M726 HydrophobicContact CD2-CG 4.43Å; Y722-M726 HydrophobicContact CD2-SD 3.85Å; Y722-M726 HydrophobicContact CE2-CB 3.95Å; T723-M726 WeakPolarHBondContact O-CB 3.28Å; T723-M726 PolarHBondContact O-N 2.95Å; M726-V729 PolarHBondContact O-N 2.7Å; M726-A730 VanDerWaalsContact O-CB 3.28Å; M726-A730 WeakPolarHBondContact O-CB 3.22Å; M726-A730 PolarHBondContact O-N 3.27Å; M726-L748 HydrophobicContact CE-CD2 4.1Å; M726-L752 HydrophobicContact CE-CD1 3.72Å; M726-L752 HydrophobicContact CG-CD1 4.27Å; M726-L752 HydrophobicContact SD-CD1 4.38Å; M726-F760 HydrophobicContact CB-CD1 4.02Å; M726-F760 HydrophobicContact CB-CE1 3.56Å; M726-F760 HydrophobicContact CB-CZ 4.38Å; M726-F760 HydrophobicContact CG-CD1 4.2Å; M726-F760 HydrophobicContact CG-CE1 4.05Å; M726-F760 HydrophobicContact SD-CD1 4.33Å
727	D	97.2	Very high	93.1	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-41	172.8	61.1	-40.7	0	0	0	112.3	C689 L709 G725 A730 A731	C689-D727 WeakPolarHBondContact CB-OD2 3.25Å; C689-D727 VanDerWaalsContact SG-C 3.6Å; C689-D727 PolarHBondContact SG-O 3.22Å; C689-D727 PolarHBondContact SG-OD2 3.31Å; L709-D727 HydrophobicContact CD1-CB 4.05Å; G725-D727 VanDerWaalsContact C-OD1 3.27Å; G725-D727 WeakPolarHBondContact CA-OD1 3.44Å; G725-D727 PolarHBondContact N-OD1 3.42Å; G725-D727 PolarHBondContact O-N 2.96Å; D727-A730 PolarHBondContact O-N 2.96Å; D727-A731 VanDerWaalsContact O-CB 3.31Å; D727-A731 WeakPolarHBondContact O-CB 3.19Å; D727-A731 PolarHBondContact O-N 2.79Å
728	S	97.3	Very high	93.6	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.014	13%	0.131	C	C	.	.	H	α-helix	trans	-68.4	-38	176.2	-51.4	0	0	0	0	111.9	G725 A731 H812	G725-S728 PolarHBondContact O-N 3.35Å; G725-S728 VanDerWaalsContact O-N 3.14Å; S728-A731 WeakPolarHBondContact O-CB 3.43Å; S728-A731 PolarHBondContact O-N 3.15Å; S728-H812 PolarHBondContact OG-ND1 3.36Å
729	V	98.1	Very high	93.9	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-65.4	-44.3	173.1	-177.8	0	0	0	0	110.8	G725 M726 A731 V732 F733 L748 F751 L752 T808 W823	G725-V729 PolarHBondContact O-N 3.43Å; M726-V729 PolarHBondContact O-N 2.7Å; V729-A731 VanDerWaalsContact C-N 3.33Å; V729-A731 PolarHBondContact O-N 3.45Å; V729-V732 PolarHBondContact O-N 3.08Å; V729-F733 HydrophobicContact CG1-CE2 4.46Å; V729-L748 HydrophobicContact CB-CD1 4.2Å; V729-L748 HydrophobicContact CG1-CD1 3.61Å; V729-F751 HydrophobicContact CG1-CD1 3.8Å; V729-F751 HydrophobicContact CG1-CE1 3.82Å; V729-L752 HydrophobicContact CG1-CD2 4.12Å; V729-T808 HydrophobicContact CG2-CG2 4.41Å; V729-W823 HydrophobicContact CG1-CH2 3.85Å; V729-W823 HydrophobicContact CG1-CZ2 4.48Å
730	A	98.2	Very high	94.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.2	-36.5	178.2	0	0	0	0	0	112.5	L705 L709 M726 D727 V732 F733 V734 L748	L705-A730 HydrophobicContact CD1-CB 3.55Å; L709-A730 HydrophobicContact CD2-CB 3.6Å; L709-A730 HydrophobicContact CG-CB 4.04Å; M726-A730 VanDerWaalsContact O-CB 3.28Å; M726-A730 WeakPolarHBondContact O-CB 3.22Å; M726-A730 PolarHBondContact O-N 3.27Å; D727-A730 PolarHBondContact O-N 2.96Å; A730-V732 VanDerWaalsContact C-N 3.26Å; A730-V732 PolarHBondContact O-N 3.04Å; A730-F733 PolarHBondContact O-N 2.84Å; A730-F733 VanDerWaalsContact O-N 3.14Å; A730-V734 WeakPolarHBondContact O-CG2 3.45Å; A730-V734 PolarHBondContact O-N 2.88Å; A730-L748 HydrophobicContact CB-CD1 4.29Å; A730-L748 HydrophobicContact CB-CD2 3.56Å
731	A	98.3	Very high	94.5	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-56.7	-37.5	178.2	0	0	0	0	0	112.9	H690 L696 D727 S728 V729 V734 R735	H690-A731 VanDerWaalsContact CD2-CB 3.5Å; H690-A731 WeakPolarHBondContact CD2-CB 3.42Å; L696-A731 HydrophobicContact CD1-CB 3.73Å; L696-A731 HydrophobicContact CD2-CB 4.24Å; D727-A731 VanDerWaalsContact O-CB 3.31Å; D727-A731 WeakPolarHBondContact O-CB 3.19Å; D727-A731 PolarHBondContact O-N 2.79Å; S728-A731 WeakPolarHBondContact O-CB 3.43Å; S728-A731 PolarHBondContact O-N 3.15Å; V729-A731 VanDerWaalsContact C-N 3.33Å; V729-A731 PolarHBondContact O-N 3.45Å; A731-V734 PolarHBondContact O-N 3.34Å; A731-R735 VanDerWaalsContact O-CB 3.29Å; A731-R735 WeakPolarHBondContact O-CB 3.29Å; A731-R735 PolarHBondContact O-N 2.99Å
732	V	98.3	Very high	94.8	Very high	1 Å²	1	17.2 Å²	17.2	1%	0.006	9%	0.086	C	C	.	.	H	α-helix	trans	-60.5	-50.5	175.9	-172.4	0	0	0	0	110.4	W614 V729 A730 R735 I736 A811 L816 I819 W823	W614-V732 HydrophobicContact CH2-CG1 4.11Å; W614-V732 HydrophobicContact CZ3-CG1 3.79Å; V729-V732 PolarHBondContact O-N 3.08Å; A730-V732 VanDerWaalsContact C-N 3.26Å; A730-V732 PolarHBondContact O-N 3.04Å; V732-R735 PolarHBondContact O-N 3.44Å; V732-I736 WeakPolarHBondContact O-CG1 3.33Å; V732-I736 PolarHBondContact O-N 2.78Å; V732-A811 HydrophobicContact CG2-CB 4.1Å; V732-L816 HydrophobicContact CB-CD2 4.43Å; V732-L816 HydrophobicContact CG2-CD2 3.68Å; V732-I819 HydrophobicContact CG1-CG2 4.23Å; V732-I819 HydrophobicContact CG2-CG2 3.73Å; V732-W823 HydrophobicContact CB-CE3 4.35Å; V732-W823 HydrophobicContact CB-CH2 3.81Å; V732-W823 HydrophobicContact CB-CZ3 3.6Å; V732-W823 HydrophobicContact CG1-CE3 3.79Å; V732-W823 HydrophobicContact CG1-CH2 4.16Å; V732-W823 HydrophobicContact CG1-CZ3 3.53Å; V732-W823 HydrophobicContact CG2-CH2 3.62Å; V732-W823 HydrophobicContact CG2-CZ2 4.14Å; V732-W823 HydrophobicContact CG2-CZ3 3.89Å
733	F	98.2	Very high	94.9	Very high	1 Å²	1	16.3 Å²	16.3	0%	0.004	8%	0.083	C	C	.	.	H	α-helix	trans	-67.8	-39.1	179.5	-68.1	-64.1	0	0	0	112.6	W614 L618 V729 A730 I736 C737 A744 C747 L748 F751 W823	W614-F733 HydrophobicContact CE3-CE1 4.04Å; W614-F733 HydrophobicContact CZ3-CE1 4.5Å; L618-F733 HydrophobicContact CD1-CE1 4.04Å; L618-F733 HydrophobicContact CD1-CZ 4.03Å; V729-F733 HydrophobicContact CG1-CE2 4.46Å; A730-F733 PolarHBondContact O-N 2.84Å; A730-F733 VanDerWaalsContact O-N 3.14Å; F733-I736 HydrophobicContact CD1-CD1 4.25Å; F733-C737 WeakPolarHBondContact O-CB 3.04Å; F733-C737 PolarHBondContact O-N 3.22Å; F733-C737 PolarHBondContact O-SG 3.45Å; F733-A744 HydrophobicContact CB-CB 4.26Å; F733-C747 HydrophobicContact CD1-CB 3.45Å; F733-C747 VanDerWaalsContact CD1-CB 3.45Å; F733-C747 HydrophobicContact CE1-CB 3.58Å; F733-C747 HydrophobicContact CG-CB 4.01Å; F733-C747 HydrophobicContact CZ-CB 4.22Å; F733-L748 HydrophobicContact CD2-CB 4Å; F733-L748 HydrophobicContact CD2-CD1 4.15Å; F733-L748 HydrophobicContact CE2-CB 4.49Å; F733-L748 HydrophobicContact CE2-CD1 4.36Å; F733-F751 HydrophobicContact CE2-CB 3.78Å; F733-F751 HydrophobicContact CE2-CD1 4.17Å; F733-F751 HydrophobicContact CE2-CD2 4.38Å; F733-F751 AromaticContact CE2-CG 3.88Å; F733-F751 HydrophobicContact CE2-CG 3.88Å; F733-F751 HydrophobicContact CZ-CB 3.69Å; F733-F751 HydrophobicContact CZ-CD1 4.46Å; F733-F751 AromaticContact CZ-CD2 3.86Å; F733-F751 HydrophobicContact CZ-CD2 3.86Å; F733-F751 AromaticContact CZ-CG 3.78Å; F733-F751 HydrophobicContact CZ-CG 3.78Å; F733-W823 HydrophobicContact CD2-CZ3 4.42Å; F733-W823 HydrophobicContact CE1-CZ3 4.43Å; F733-W823 HydrophobicContact CE2-CH2 4.32Å; F733-W823 AromaticContact CE2-CZ3 3.79Å; F733-W823 HydrophobicContact CE2-CZ3 3.79Å; F733-W823 HydrophobicContact CZ-CE3 4.42Å; F733-W823 AromaticContact CZ-CZ3 3.8Å; F733-W823 HydrophobicContact CZ-CZ3 3.8Å
734	V	97.4	Very high	95.3	Very high	1 Å²	1	14.9 Å²	14.9	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-59	-49.6	173.4	169.9	0	0	0	0	109.8	L696 V704 L705 V708 A730 A731 I736 Y738	L696-V734 HydrophobicContact CD2-CB 4.3Å; L696-V734 HydrophobicContact CD2-CG1 3.89Å; V704-V734 HydrophobicContact CG1-CG1 3.88Å; V704-V734 HydrophobicContact CG1-CG2 4.34Å; L705-V734 HydrophobicContact CB-CG2 4.4Å; L705-V734 HydrophobicContact CD1-CB 4.49Å; L705-V734 HydrophobicContact CD1-CG2 3.79Å; V708-V734 HydrophobicContact CB-CG2 4.15Å; V708-V734 HydrophobicContact CG1-CG2 4.2Å; V708-V734 HydrophobicContact CG2-CG2 4.01Å; A730-V734 WeakPolarHBondContact O-CG2 3.45Å; A730-V734 PolarHBondContact O-N 2.88Å; A731-V734 PolarHBondContact O-N 3.34Å; V734-I736 PolarHBondContact O-N 3.33Å; V734-Y738 WeakPolarHBondContact O-CA 3.12Å; V734-Y738 WeakPolarHBondContact O-CB 3.43Å; V734-Y738 PolarHBondContact O-N 3.4Å
735	R	95.5	Very high	95.6	Very high	53 Å²	53	10.6 Å²	10.6	20%	0.2	5%	0.054	C	C	.	.	H	α-helix	trans	-57.9	-45.5	-178.1	173.4	175.7	156.6	137	-12	113.4	R49 D693 A731 V732 L816 E820	R49-R735 PolarHBondContact NH2-O 3.14Å; D693-R735 IonicContact OD2-CZ 3.97Å; D693-R735 IonicContact OD2-NE 3.19Å; D693-R735 IonicContact OD2-NH1 2.66Å; D693-R735 PolarHBondContact OD2-NH1 3.37Å; A731-R735 VanDerWaalsContact O-CB 3.29Å; A731-R735 WeakPolarHBondContact O-CB 3.29Å; A731-R735 PolarHBondContact O-N 2.99Å; V732-R735 PolarHBondContact O-N 3.44Å; R735-L816 VanDerWaalsContact CD-CD1 3.5Å; R735-E820 IonicContact CZ-OE1 2.69Å; R735-E820 IonicContact NE-OE1 3.63Å; R735-E820 PolarHBondContact NE-OE1 3.29Å; R735-E820 IonicContact NH2-OE1 3.86Å; R735-E820 PolarHBondContact NH2-OE1 3.19Å; R735-E820 VanDerWaalsContact NH2-OE1 3.12Å
736	I	94.7	Very high	95.8	Very high	27 Å²	27	10.9 Å²	10.9	14%	0.138	6%	0.056	C	C	.	.	H	α-helix	trans	-86.5	-30	-174.4	72.2	-178.1	0	0	0	113.7	W611 W614 V732 F733 V734 E820	W611-I736 HydrophobicContact CB-CB 4.21Å; W611-I736 HydrophobicContact CB-CD1 4.23Å; W611-I736 HydrophobicContact CB-CG1 4.05Å; W614-I736 HydrophobicContact CD2-CD1 4.17Å; W614-I736 HydrophobicContact CE3-CD1 3.21Å; W614-I736 HydrophobicContact CH2-CD1 4.31Å; W614-I736 HydrophobicContact CZ3-CD1 3.3Å; V732-I736 WeakPolarHBondContact O-CG1 3.33Å; V732-I736 PolarHBondContact O-N 2.78Å; F733-I736 HydrophobicContact CD1-CD1 4.25Å; V734-I736 PolarHBondContact O-N 3.33Å; I736-E820 HydrophobicContact CG2-CG 4.3Å
737	C	94.2	Very high	95.8	Very high	9 Å²	9	10.9 Å²	10.9	6%	0.061	6%	0.056	C	C	.	.	H	α-helix	trans	-94.2	-11.9	-178.9	-61.3	0	0	0	0	112.6	F733 D740 L743 A744	F733-C737 WeakPolarHBondContact O-CB 3.04Å; F733-C737 PolarHBondContact O-N 3.22Å; F733-C737 PolarHBondContact O-SG 3.45Å; C737-D740 PolarHBondContact O-N 3.17Å; C737-L743 HydrophobicContact CB-CD2 4.39Å; C737-A744 HydrophobicContact CB-CB 4.01Å
738	Y	92.1	Very high	95.8	Very high	20 Å²	20	10.7 Å²	10.7	8%	0.078	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	129.7	-178.1	-175.2	-98	0	0	0	111.5	R49 R50 L695 I700 V704 V734	R49-Y738 HydrophobicContact CB-CD1 3.85Å; R49-Y738 HydrophobicContact CB-CE1 3.51Å; R50-Y738 VanDerWaalsContact CB-OH 3.31Å; R50-Y738 WeakPolarHBondContact CB-OH 3.34Å; L695-Y738 HydrophobicContact CD1-CD1 4.1Å; L695-Y738 HydrophobicContact CD1-CD2 4.34Å; L695-Y738 HydrophobicContact CD1-CE1 4Å; L695-Y738 HydrophobicContact CD1-CE2 4.3Å; L695-Y738 HydrophobicContact CD1-CG 4.26Å; L695-Y738 HydrophobicContact CD2-CD1 3.94Å; L695-Y738 HydrophobicContact CD2-CD2 4.15Å; L695-Y738 HydrophobicContact CD2-CG 3.64Å; I700-Y738 WeakPolarHBondContact CG2-OH 3.44Å; V704-Y738 HydrophobicContact CG1-CD2 4.21Å; V704-Y738 HydrophobicContact CG1-CE2 4.45Å; V704-Y738 HydrophobicContact CG2-CD2 4.25Å; V704-Y738 HydrophobicContact CG2-CE2 3.68Å; V734-Y738 WeakPolarHBondContact O-CA 3.12Å; V734-Y738 WeakPolarHBondContact O-CB 3.43Å; V734-Y738 PolarHBondContact O-N 3.4Å
739	P	88.2	Confident	95.7	Very high	31 Å²	31	11.5 Å²	11.5	20%	0.201	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99.3	14.2	13.4	36.2	-33.4	0	0	0	117.1	H53 E741	H53-P739 HydrophobicContact CB-CG 3.51Å; P739-E741 PolarHBondContact O-N 3.11Å
740	D	92	Very high	95.5	Very high	26 Å²	26	12.2 Å²	12.2	14%	0.139	7%	0.066	C	C	.	.			trans	-78.7	84.9	176.9	-169.1	-14.4	0	0	0	111.5	R624 C737 A742 L743 A744	R624-D740 IonicContact CZ-OD2 3.06Å; R624-D740 IonicContact NH2-OD1 3.52Å; R624-D740 IonicContact NH2-OD2 3.43Å; R624-D740 PolarHBondContact NH2-OD2 3.13Å; C737-D740 PolarHBondContact O-N 3.17Å; D740-A742 VanDerWaalsContact C-N 3.29Å; D740-A742 PolarHBondContact O-N 3.41Å; D740-A742 PolarHBondContact OD1-N 2.88Å; D740-L743 HydrophobicContact CB-CB 3.96Å; D740-L743 PolarHBondContact O-N 3.29Å; D740-L743 WeakPolarHBondContact OD1-CB 3.29Å; D740-L743 PolarHBondContact OD1-N 2.57Å; D740-L743 WeakPolarHBondContact OD2-CB 3.13Å; D740-A744 PolarHBondContact O-N 2.81Å
741	E	94.2	Very high	95.3	Very high	33 Å²	33	12.2 Å²	12.2	15%	0.154	7%	0.066	C	C	.	.	H	α-helix	trans	-63.8	-34.4	-179.9	-47.9	-174.2	175.3	0	0	112.5	Y630 V704 R707 V708 P739 A744 A745	Y630-E741 HydrophobicContact CE1-CB 4.12Å; Y630-E741 HydrophobicContact CE2-CB 4.35Å; Y630-E741 WeakPolarHBondContact OH-CB 3.46Å; Y630-E741 PolarHBondContact OH-OE2 3.21Å; V704-E741 HydrophobicContact CG1-CG 3.86Å; V704-E741 WeakPolarHBondContact CG2-OE1 3.39Å; R707-E741 IonicContact CZ-OE1 2.61Å; R707-E741 IonicContact CZ-OE2 3.36Å; R707-E741 IonicContact NE-OE1 3.47Å; R707-E741 PolarHBondContact NE-OE1 2.86Å; R707-E741 IonicContact NE-OE2 3Å; R707-E741 PolarHBondContact NE-OE2 2.9Å; R707-E741 IonicContact NH2-OE1 2.81Å; R707-E741 PolarHBondContact NH2-OE1 3.2Å; R707-E741 IonicContact NH2-OE2 2.97Å; V708-E741 HydrophobicContact CG2-CB 4.06Å; P739-E741 PolarHBondContact O-N 3.11Å; E741-A744 PolarHBondContact O-N 2.85Å; E741-A745 WeakPolarHBondContact O-CB 3.46Å; E741-A745 PolarHBondContact O-N 3.47Å
742	A	95.3	Very high	95.1	Very high	9 Å²	9	12.3 Å²	12.3	7%	0.074	7%	0.066	C	C	.	.	H	α-helix	trans	-65.1	-44.4	179.4	0	0	0	0	0	110.5	F626 E627 Y630 D740 A745 A746	F626-A742 HydrophobicContact CD2-CB 4.03Å; F626-A742 WeakPolarHBondContact CD2-O 3.43Å; F626-A742 VanDerWaalsContact CE2-C 3.41Å; F626-A742 HydrophobicContact CE2-CB 3.83Å; E627-A742 HydrophobicContact CG-CB 4.37Å; Y630-A742 HydrophobicContact CD1-CB 3.6Å; Y630-A742 HydrophobicContact CD2-CB 4.35Å; Y630-A742 HydrophobicContact CE1-CB 4.28Å; Y630-A742 HydrophobicContact CG-CB 3.64Å; D740-A742 VanDerWaalsContact C-N 3.29Å; D740-A742 PolarHBondContact O-N 3.41Å; D740-A742 PolarHBondContact OD1-N 2.88Å; A742-A745 PolarHBondContact O-N 2.92Å; A742-A746 WeakPolarHBondContact O-CB 3.28Å; A742-A746 PolarHBondContact O-N 2.85Å
743	L	95.7	Very high	94.6	Very high	4 Å²	4	15.1 Å²	15.1	2%	0.021	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-41.5	175.5	-179	65.3	0	0	0	111.7	W611 A615 V620 F626 C737 D740 A745 A746 C747	W611-L743 HydrophobicContact CE3-CD2 3.6Å; W611-L743 HydrophobicContact CZ3-CD2 3.53Å; A615-L743 HydrophobicContact CB-CD1 3.93Å; V620-L743 HydrophobicContact CG1-CD1 3.69Å; F626-L743 HydrophobicContact CE1-CD1 4.18Å; F626-L743 HydrophobicContact CE2-CB 4.17Å; F626-L743 HydrophobicContact CZ-CB 4.11Å; F626-L743 HydrophobicContact CZ-CD1 3.72Å; C737-L743 HydrophobicContact CB-CD2 4.39Å; D740-L743 HydrophobicContact CB-CB 3.96Å; D740-L743 PolarHBondContact O-N 3.29Å; D740-L743 WeakPolarHBondContact OD1-CB 3.29Å; D740-L743 PolarHBondContact OD1-N 2.57Å; D740-L743 WeakPolarHBondContact OD2-CB 3.13Å; L743-A745 PolarHBondContact O-N 3.14Å; L743-A746 PolarHBondContact O-N 3.12Å; L743-C747 WeakPolarHBondContact O-CB 3.22Å; L743-C747 PolarHBondContact O-N 2.98Å; L743-C747 PolarHBondContact O-SG 2.94Å
744	A	97.2	Very high	94.1	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.008	11%	0.107	C	C	.	.	H	α-helix	trans	-59	-46.9	176.1	0	0	0	0	0	111.8	V708 F733 C737 D740 E741 C747 L748	V708-A744 HydrophobicContact CG1-CB 4.25Å; V708-A744 HydrophobicContact CG2-CB 4.01Å; F733-A744 HydrophobicContact CB-CB 4.26Å; C737-A744 HydrophobicContact CB-CB 4.01Å; D740-A744 PolarHBondContact O-N 2.81Å; E741-A744 PolarHBondContact O-N 2.85Å; A744-C747 PolarHBondContact O-N 2.94Å; A744-L748 WeakPolarHBondContact O-CB 3.47Å; A744-L748 PolarHBondContact O-N 3.31Å
745	A	97.1	Very high	93.8	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-40.8	177.6	0	0	0	0	0	112.4	Y630 V708 M715 E741 A742 L743 L748 N749	Y630-A745 HydrophobicContact CD2-CB 3.83Å; Y630-A745 HydrophobicContact CE2-CB 4.02Å; V708-A745 HydrophobicContact CG1-CB 4.21Å; M715-A745 HydrophobicContact SD-CB 4.15Å; E741-A745 WeakPolarHBondContact O-CB 3.46Å; E741-A745 PolarHBondContact O-N 3.47Å; A742-A745 PolarHBondContact O-N 2.92Å; L743-A745 PolarHBondContact O-N 3.14Å; A745-L748 PolarHBondContact O-N 3.15Å; A745-N749 WeakPolarHBondContact O-CB 3.47Å; A745-N749 PolarHBondContact O-N 2.8Å
746	A	96.1	Very high	93.5	Very high	6 Å²	6	17.6 Å²	17.6	5%	0.05	10%	0.104	C	C	.	.	H	α-helix	trans	-66.2	-43.7	177.4	0	0	0	0	0	112.4	V620 F626 A742 L743 N749 A750	V620-A746 HydrophobicContact CG1-CB 3.51Å; V620-A746 HydrophobicContact CG2-CB 4.31Å; F626-A746 HydrophobicContact CB-CB 3.64Å; F626-A746 HydrophobicContact CD1-CB 3.82Å; F626-A746 HydrophobicContact CD2-CB 3.6Å; F626-A746 HydrophobicContact CE1-CB 4.36Å; F626-A746 HydrophobicContact CE2-CB 4.21Å; F626-A746 HydrophobicContact CG-CB 3.39Å; A742-A746 WeakPolarHBondContact O-CB 3.28Å; A742-A746 PolarHBondContact O-N 2.85Å; L743-A746 PolarHBondContact O-N 3.12Å; A746-N749 PolarHBondContact O-N 3.44Å; A746-A750 WeakPolarHBondContact O-CB 3.42Å; A746-A750 PolarHBondContact O-N 3.11Å
747	C	97.1	Very high	92.9	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.007	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-44.1	174.9	-67	0	0	0	0	111.4	L618 F733 L743 A744 A750 F751	L618-C747 HydrophobicContact CD1-CB 4.23Å; F733-C747 HydrophobicContact CD1-CB 3.45Å; F733-C747 VanDerWaalsContact CD1-CB 3.45Å; F733-C747 HydrophobicContact CE1-CB 3.58Å; F733-C747 HydrophobicContact CG-CB 4.01Å; F733-C747 HydrophobicContact CZ-CB 4.22Å; L743-C747 WeakPolarHBondContact O-CB 3.22Å; L743-C747 PolarHBondContact O-N 2.98Å; L743-C747 PolarHBondContact O-SG 2.94Å; A744-C747 PolarHBondContact O-N 2.94Å; C747-A750 PolarHBondContact O-N 3.03Å; C747-F751 WeakPolarHBondContact O-CB 3.19Å; C747-F751 PolarHBondContact O-N 3.24Å
748	L	97.5	Very high	92.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-58.5	-51.7	175	179.1	61.9	0	0	0	111.1	V708 L709 T712 M726 V729 A730 F733 A744 A745 A750 F751 L752	V708-L748 HydrophobicContact CG1-CD2 4.25Å; L709-L748 HydrophobicContact CD2-CD2 4.32Å; T712-L748 HydrophobicContact CG2-CD2 4.03Å; T712-L748 HydrophobicContact CG2-CG 4.11Å; M726-L748 HydrophobicContact CE-CD2 4.1Å; V729-L748 HydrophobicContact CB-CD1 4.2Å; V729-L748 HydrophobicContact CG1-CD1 3.61Å; A730-L748 HydrophobicContact CB-CD1 4.29Å; A730-L748 HydrophobicContact CB-CD2 3.56Å; F733-L748 HydrophobicContact CD2-CB 4Å; F733-L748 HydrophobicContact CD2-CD1 4.15Å; F733-L748 HydrophobicContact CE2-CB 4.49Å; F733-L748 HydrophobicContact CE2-CD1 4.36Å; A744-L748 WeakPolarHBondContact O-CB 3.47Å; A744-L748 PolarHBondContact O-N 3.31Å; A745-L748 PolarHBondContact O-N 3.15Å; L748-A750 VanDerWaalsContact C-N 3.34Å; L748-A750 PolarHBondContact O-N 3.21Å; L748-F751 PolarHBondContact O-N 2.6Å; L748-L752 HydrophobicContact CD1-CD1 3.97Å; L748-L752 HydrophobicContact CD1-CD2 4.27Å; L748-L752 HydrophobicContact CD1-CG 3.92Å; L748-L752 HydrophobicContact CG-CD1 4.09Å; L748-L752 HydrophobicContact CG-CG 4.34Å; L748-L752 WeakPolarHBondContact O-CB 3.49Å; L748-L752 VanDerWaalsContact O-CG 3.28Å; L748-L752 WeakPolarHBondContact O-CG 3.23Å; L748-L752 PolarHBondContact O-N 3.17Å
749	N	94.3	Very high	91.9	Very high	18 Å²	18	16.9 Å²	16.9	10%	0.096	11%	0.106	C	C	.	.	H	α-helix	trans	-57.5	-45.4	179.3	-179.7	73	0	0	0	112.4	T712 A745 A746 S753	T712-N749 HydrophobicContact CG2-CB 4.09Å; A745-N749 WeakPolarHBondContact O-CB 3.47Å; A745-N749 PolarHBondContact O-N 2.8Å; A746-N749 PolarHBondContact O-N 3.44Å; N749-S753 WeakPolarHBondContact O-CB 3.16Å; N749-S753 PolarHBondContact O-N 3.13Å; N749-S753 PolarHBondContact O-OG 3.4Å
750	A	93.4	Very high	92	Very high	16 Å²	16	15.5 Å²	15.5	13%	0.132	10%	0.097	C	C	.	.	H	α-helix	trans	-65	-43.2	178	0	0	0	0	0	111.9	L618 V620 A746 C747 L748 S753 T754	L618-A750 HydrophobicContact CB-CB 4.01Å; L618-A750 WeakPolarHBondContact O-CB 3.41Å; V620-A750 HydrophobicContact CG2-CB 3.75Å; A746-A750 WeakPolarHBondContact O-CB 3.42Å; A746-A750 PolarHBondContact O-N 3.11Å; C747-A750 PolarHBondContact O-N 3.03Å; L748-A750 VanDerWaalsContact C-N 3.34Å; L748-A750 PolarHBondContact O-N 3.21Å; A750-S753 PolarHBondContact O-N 3Å; A750-T754 WeakPolarHBondContact O-CB 3.39Å; A750-T754 WeakPolarHBondContact O-CG2 3.26Å; A750-T754 PolarHBondContact O-N 2.97Å; A750-T754 PolarHBondContact O-OG1 3.41Å
751	F	95.6	Very high	91.7	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.4	-45.3	178.5	-174	-95	0	0	0	112.1	L618 V729 F733 C747 L748 S753 T754 K755 L756 L809 W823 I827	L618-F751 HydrophobicContact CD1-CB 4.2Å; L618-F751 HydrophobicContact CD1-CD2 4.44Å; L618-F751 HydrophobicContact CD2-CB 4.28Å; L618-F751 HydrophobicContact CD2-CD2 4.24Å; V729-F751 HydrophobicContact CG1-CD1 3.8Å; V729-F751 HydrophobicContact CG1-CE1 3.82Å; F733-F751 HydrophobicContact CE2-CB 3.78Å; F733-F751 HydrophobicContact CE2-CD1 4.17Å; F733-F751 HydrophobicContact CE2-CD2 4.38Å; F733-F751 AromaticContact CE2-CG 3.88Å; F733-F751 HydrophobicContact CE2-CG 3.88Å; F733-F751 HydrophobicContact CZ-CB 3.69Å; F733-F751 HydrophobicContact CZ-CD1 4.46Å; F733-F751 AromaticContact CZ-CD2 3.86Å; F733-F751 HydrophobicContact CZ-CD2 3.86Å; F733-F751 AromaticContact CZ-CG 3.78Å; F733-F751 HydrophobicContact CZ-CG 3.78Å; C747-F751 WeakPolarHBondContact O-CB 3.19Å; C747-F751 PolarHBondContact O-N 3.24Å; L748-F751 PolarHBondContact O-N 2.6Å; F751-S753 VanDerWaalsContact C-N 3.29Å; F751-S753 PolarHBondContact O-N 2.86Å; F751-T754 PolarHBondContact O-N 2.86Å; F751-K755 HydrophobicContact CD2-CB 4.27Å; F751-K755 HydrophobicContact CD2-CG 3.92Å; F751-K755 HydrophobicContact CE2-CB 4.19Å; F751-K755 HydrophobicContact CE2-CG 3.99Å; F751-K755 HydrophobicContact CZ-CB 4.37Å; F751-K755 WeakPolarHBondContact O-CB 3.29Å; F751-K755 PolarHBondContact O-N 2.83Å; F751-L756 HydrophobicContact CD1-CD1 4.13Å; F751-L756 HydrophobicContact CE1-CD1 3.68Å; F751-L756 HydrophobicContact CE1-CG 4.49Å; F751-L756 PolarHBondContact O-N 3.46Å; F751-L809 HydrophobicContact CE1-CD1 3.69Å; F751-L809 HydrophobicContact CE2-CD1 4.22Å; F751-L809 HydrophobicContact CZ-CB 4.44Å; F751-L809 HydrophobicContact CZ-CD1 3.31Å; F751-L809 HydrophobicContact CZ-CG 4.42Å; F751-W823 AromaticContact CE1-CH2 3.81Å; F751-W823 HydrophobicContact CE1-CH2 3.81Å; F751-W823 AromaticContact CE1-CZ2 3.86Å; F751-W823 HydrophobicContact CE1-CZ2 3.86Å; F751-W823 HydrophobicContact CE1-CZ3 4.28Å; F751-W823 HydrophobicContact CE2-CD2 4.12Å; F751-W823 HydrophobicContact CE2-CE3 4Å; F751-W823 HydrophobicContact CE2-CH2 4.43Å; F751-W823 HydrophobicContact CE2-CZ3 4.17Å; F751-W823 AromaticContact CZ-CD2 3.89Å; F751-W823 HydrophobicContact CZ-CD2 3.89Å; F751-W823 AromaticContact CZ-CE2 3.66Å; F751-W823 AromaticContact CZ-CE3 4Å; F751-W823 HydrophobicContact CZ-CE3 4Å; F751-W823 AromaticContact CZ-CH2 3.74Å; F751-W823 HydrophobicContact CZ-CH2 3.74Å; F751-W823 AromaticContact CZ-CZ2 3.59Å; F751-W823 HydrophobicContact CZ-CZ2 3.59Å; F751-W823 AromaticContact CZ-CZ3 3.93Å; F751-W823 HydrophobicContact CZ-CZ3 3.93Å; F751-I827 HydrophobicContact CD2-CD1 4.44Å; F751-I827 HydrophobicContact CD2-CG1 4.19Å; F751-I827 HydrophobicContact CE2-CD1 4.21Å; F751-I827 HydrophobicContact CE2-CG1 3.8Å
752	L	93.4	Very high	90.7	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-63.4	-36.7	175.9	-65.4	-174.6	0	0	0	112.1	L720 M726 V729 L748 L756 F760	L720-L752 HydrophobicContact CD1-CD1 4.2Å; L720-L752 HydrophobicContact CD2-CB 4.49Å; M726-L752 HydrophobicContact CE-CD1 3.72Å; M726-L752 HydrophobicContact CG-CD1 4.27Å; M726-L752 HydrophobicContact SD-CD1 4.38Å; V729-L752 HydrophobicContact CG1-CD2 4.12Å; L748-L752 HydrophobicContact CD1-CD1 3.97Å; L748-L752 HydrophobicContact CD1-CD2 4.27Å; L748-L752 HydrophobicContact CD1-CG 3.92Å; L748-L752 HydrophobicContact CG-CD1 4.09Å; L748-L752 HydrophobicContact CG-CG 4.34Å; L748-L752 WeakPolarHBondContact O-CB 3.49Å; L748-L752 VanDerWaalsContact O-CG 3.28Å; L748-L752 WeakPolarHBondContact O-CG 3.23Å; L748-L752 PolarHBondContact O-N 3.17Å; L752-L756 HydrophobicContact CD2-CB 4.4Å; L752-L756 HydrophobicContact CD2-CD1 4.03Å; L752-L756 CarbonylContact O-C 3.55Å; L752-L756 VanDerWaalsContact O-O 3.05Å; L752-F760 HydrophobicContact CD1-CD2 4.32Å; L752-F760 HydrophobicContact CD1-CG 4.38Å; L752-F760 HydrophobicContact CD2-CD2 3.57Å; L752-F760 HydrophobicContact CD2-CE2 3.42Å; L752-F760 VanDerWaalsContact CD2-CE2 3.42Å; L752-F760 HydrophobicContact CD2-CG 4.37Å; L752-F760 HydrophobicContact CD2-CZ 4.11Å; L752-F760 HydrophobicContact CG-CD2 4.36Å
753	S	88.4	Confident	89.6	Confident	59 Å²	59	19.6 Å²	19.6	41%	0.413	14%	0.14	S	C	.	.	H	α-helix	trans	-75	-28.5	179.8	-56.9	0	0	0	0	113.4	N749 A750 F751	N749-S753 WeakPolarHBondContact O-CB 3.16Å; N749-S753 PolarHBondContact O-N 3.13Å; N749-S753 PolarHBondContact O-OG 3.4Å; A750-S753 PolarHBondContact O-N 3Å; F751-S753 VanDerWaalsContact C-N 3.29Å; F751-S753 PolarHBondContact O-N 2.86Å
754	T	87.4	Confident	88.7	Confident	73 Å²	73	19.5 Å²	19.5	45%	0.448	14%	0.14	S	C	.	.	H	α-helix	trans	-107.8	-39.2	-170.9	57	0	0	0	0	114.1	A750 F751	A750-T754 WeakPolarHBondContact O-CB 3.39Å; A750-T754 WeakPolarHBondContact O-CG2 3.26Å; A750-T754 PolarHBondContact O-N 2.97Å; A750-T754 PolarHBondContact O-OG1 3.41Å; F751-T754 PolarHBondContact O-N 2.86Å
755	K	90.2	Very high	88.1	Confident	31 Å²	31	21.4 Å²	21.4	14%	0.135	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	-25.6	-176.9	-56.9	-55.6	179.1	179.7	0	113.3	F751 L809 I827 G829	F751-K755 HydrophobicContact CD2-CB 4.27Å; F751-K755 HydrophobicContact CD2-CG 3.92Å; F751-K755 HydrophobicContact CE2-CB 4.19Å; F751-K755 HydrophobicContact CE2-CG 3.99Å; F751-K755 HydrophobicContact CZ-CB 4.37Å; F751-K755 WeakPolarHBondContact O-CB 3.29Å; F751-K755 PolarHBondContact O-N 2.83Å; K755-L809 HydrophobicContact CB-CD1 4Å; K755-I827 WeakPolarHBondContact CE-O 3.04Å; K755-I827 PolarHBondContact NZ-O 2.74Å; K755-G829 PolarHBondContact NZ-O 2.88Å
756	L	89.6	Confident	87.4	Confident	3 Å²	3	26.6 Å²	26.6	2%	0.016	18%	0.182	C	C	.	.	S	Bend	trans	-124.5	45.1	179.9	-70.6	165.1	0	0	0	112.6	F751 L752 G758 F759 F760 Y807 L809	F751-L756 HydrophobicContact CD1-CD1 4.13Å; F751-L756 HydrophobicContact CE1-CD1 3.68Å; F751-L756 HydrophobicContact CE1-CG 4.49Å; F751-L756 PolarHBondContact O-N 3.46Å; L752-L756 HydrophobicContact CD2-CB 4.4Å; L752-L756 HydrophobicContact CD2-CD1 4.03Å; L752-L756 CarbonylContact O-C 3.55Å; L752-L756 VanDerWaalsContact O-O 3.05Å; L756-G758 PolarHBondContact O-N 2.83Å; L756-F759 HydrophobicContact CB-CD2 4.04Å; L756-F759 HydrophobicContact CD2-CD2 3.67Å; L756-F759 HydrophobicContact CD2-CE2 3.9Å; L756-F759 PolarHBondContact O-N 3.35Å; L756-F760 HydrophobicContact CB-CE2 4.26Å; L756-F760 HydrophobicContact CD1-CE2 4.11Å; L756-Y807 VanDerWaalsContact CD1-O 3.29Å; L756-Y807 WeakPolarHBondContact CD1-O 3.46Å; L756-L809 HydrophobicContact CD1-CD1 3.99Å; L756-L809 HydrophobicContact CD1-CG 4.09Å; L756-L809 HydrophobicContact CD2-CD1 4.17Å; L756-L809 HydrophobicContact CD2-CD2 4.33Å; L756-L809 HydrophobicContact CD2-CG 3.88Å; L756-L809 HydrophobicContact CG-CD1 3.88Å; L756-L809 HydrophobicContact CG-CG 4.08Å
757	P	81.2	Confident	86.6	Confident	21 Å²	21	29.6 Å²	29.6	14%	0.136	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	131.4	-172.8	29.9	-36.9	0	0	0	111.2	F759 I894	P757-F759 VanDerWaalsContact C-N 3.32Å; P757-F759 PolarHBondContact O-N 3.34Å; P757-I894 HydrophobicContact CB-CD1 4.12Å; P757-I894 HydrophobicContact CB-CG1 4.47Å; P757-I894 HydrophobicContact CB-CG2 3.84Å; P757-I894 HydrophobicContact CG-CD1 3.6Å; P757-I894 HydrophobicContact CG-CG1 4.03Å; P757-I894 HydrophobicContact CG-CG2 4.31Å
758	G	79.7	Confident	85.9	Confident	16 Å²	16	29.7 Å²	29.7	17%	0.165	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	-22.8	175.8	0	0	0	0	0	116	L756 F760 S761 G764	L756-G758 PolarHBondContact O-N 2.83Å; G758-F760 VanDerWaalsContact C-N 3.34Å; G758-F760 PolarHBondContact O-N 3.18Å; G758-S761 PolarHBondContact O-N 3.05Å; G758-S761 PolarHBondContact O-OG 2.57Å; G758-G764 CarbonylContact O-C 3.58Å; G758-G764 VanDerWaalsContact O-CA 3.27Å; G758-G764 WeakPolarHBondContact O-CA 3.33Å
759	F	87.2	Confident	85.3	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.018	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-38.5	-177.8	-72.8	-66.7	0	0	0	113.3	L756 P757 L765 L769 Y772 I806	L756-F759 HydrophobicContact CB-CD2 4.04Å; L756-F759 HydrophobicContact CD2-CD2 3.67Å; L756-F759 HydrophobicContact CD2-CE2 3.9Å; L756-F759 PolarHBondContact O-N 3.35Å; P757-F759 VanDerWaalsContact C-N 3.32Å; P757-F759 PolarHBondContact O-N 3.34Å; F759-L765 HydrophobicContact CD1-CD1 4.34Å; F759-L765 WeakPolarHBondContact O-CA 3.07Å; F759-L765 WeakPolarHBondContact O-CB 3.43Å; F759-L765 PolarHBondContact O-N 3.13Å; F759-L769 HydrophobicContact CD1-CD2 4.28Å; F759-L769 HydrophobicContact CD1-CG 4.22Å; F759-L769 HydrophobicContact CE1-CD2 3.78Å; F759-L769 HydrophobicContact CE1-CG 3.99Å; F759-Y772 HydrophobicContact CE2-CD2 4.39Å; F759-Y772 AromaticContact CZ-CD2 3.77Å; F759-Y772 HydrophobicContact CZ-CD2 3.77Å; F759-Y772 HydrophobicContact CZ-CE2 4.46Å; F759-Y772 HydrophobicContact CZ-CG 4.08Å; F759-I806 HydrophobicContact CZ-CG2 4.21Å
760	F	89.9	Confident	84.9	Confident	3 Å²	3	36 Å²	36	1%	0.013	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	27.9	-178.2	-61.7	-86.7	0	0	0	112.6	L720 D721 M726 L752 L756 G758 Y807	L720-F760 CarbonylContact C-O 3.56Å; L720-F760 WeakPolarHBondContact CA-O 3.32Å; L720-F760 HydrophobicContact CD2-CB 4.03Å; D721-F760 PolarHBondContact N-O 2.93Å; M726-F760 HydrophobicContact CB-CD1 4.02Å; M726-F760 HydrophobicContact CB-CE1 3.56Å; M726-F760 HydrophobicContact CB-CZ 4.38Å; M726-F760 HydrophobicContact CG-CD1 4.2Å; M726-F760 HydrophobicContact CG-CE1 4.05Å; M726-F760 HydrophobicContact SD-CD1 4.33Å; L752-F760 HydrophobicContact CD1-CD2 4.32Å; L752-F760 HydrophobicContact CD1-CG 4.38Å; L752-F760 HydrophobicContact CD2-CD2 3.57Å; L752-F760 HydrophobicContact CD2-CE2 3.42Å; L752-F760 VanDerWaalsContact CD2-CE2 3.42Å; L752-F760 HydrophobicContact CD2-CG 4.37Å; L752-F760 HydrophobicContact CD2-CZ 4.11Å; L752-F760 HydrophobicContact CG-CD2 4.36Å; L756-F760 HydrophobicContact CB-CE2 4.26Å; L756-F760 HydrophobicContact CD1-CE2 4.11Å; G758-F760 VanDerWaalsContact C-N 3.34Å; G758-F760 PolarHBondContact O-N 3.18Å; F760-Y807 HydrophobicContact CE1-CD2 4.04Å; F760-Y807 HydrophobicContact CE1-CE2 4.28Å; F760-Y807 HydrophobicContact CE2-CD2 4.35Å; F760-Y807 WeakPolarHBondContact CE2-O 3.17Å; F760-Y807 AromaticContact CZ-CD2 3.63Å; F760-Y807 HydrophobicContact CZ-CD2 3.63Å; F760-Y807 HydrophobicContact CZ-CE2 4.19Å; F760-Y807 WeakPolarHBondContact CZ-O 3.43Å
761	S	84.4	Confident	84.3	Confident	35 Å²	35	35.7 Å²	35.7	25%	0.245	22%	0.224	C	C	.	.	S	Bend	trans	-103.9	162.6	173.2	66.3	0	0	0	0	111	G758 G763 G764	G758-S761 PolarHBondContact O-N 3.05Å; G758-S761 PolarHBondContact O-OG 2.57Å; S761-G763 PolarHBondContact O-N 3.33Å; S761-G763 VanDerWaalsContact O-N 3.08Å; S761-G764 WeakPolarHBondContact O-CA 3.41Å; S761-G764 PolarHBondContact O-N 3.03Å
762	S	73.6	Confident	83.9	Confident	59 Å²	59	35.9 Å²	35.9	41%	0.413	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	113.1	-177.1	-48.4	0	0	0	0	113.3	D721 G764	D721-S762 WeakPolarHBondContact OD2-CA 3.47Å; D721-S762 WeakPolarHBondContact OD2-CB 3.43Å; D721-S762 PolarHBondContact OD2-N 3.06Å; D721-S762 PolarHBondContact OD2-OG 3.17Å; S762-G764 PolarHBondContact O-N 2.84Å
763	G	72	Confident	83.6	Confident	59 Å²	59	35.9 Å²	35.9	61%	0.608	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	1.2	-173.8	0	0	0	0	0	114.4	S761	S761-G763 PolarHBondContact O-N 3.33Å; S761-G763 VanDerWaalsContact O-N 3.08Å
764	G	77.6	Confident	83.5	Confident	3 Å²	3	35 Å²	35	3%	0.031	22%	0.215	C	C	.	.	H	α-helix	trans	-73.3	-26.9	-176.2	0	0	0	0	0	114	G758 S761 S762 G768	G758-G764 CarbonylContact O-C 3.58Å; G758-G764 VanDerWaalsContact O-CA 3.27Å; G758-G764 WeakPolarHBondContact O-CA 3.33Å; S761-G764 WeakPolarHBondContact O-CA 3.41Å; S761-G764 PolarHBondContact O-N 3.03Å; S762-G764 PolarHBondContact O-N 2.84Å; G764-G768 WeakPolarHBondContact O-CA 3.22Å; G764-G768 PolarHBondContact O-N 3.33Å
765	L	84.5	Confident	83.6	Confident	40 Å²	40	32 Å²	32	21%	0.209	20%	0.197	C	C	.	.	H	α-helix	trans	-59.2	-53.9	178.8	-175.6	69.4	0	0	0	111.9	T723 F759 L769 Y807	T723-L765 HydrophobicContact CG2-CD1 4.42Å; T723-L765 HydrophobicContact CG2-CD2 3.56Å; F759-L765 HydrophobicContact CD1-CD1 4.34Å; F759-L765 WeakPolarHBondContact O-CA 3.07Å; F759-L765 WeakPolarHBondContact O-CB 3.43Å; F759-L765 PolarHBondContact O-N 3.13Å; L765-L769 HydrophobicContact CD1-CD1 3.72Å; L765-L769 HydrophobicContact CD1-CG 4.08Å; L765-L769 HydrophobicContact CD2-CD1 4.49Å; L765-L769 HydrophobicContact CG-CD1 3.75Å; L765-L769 HydrophobicContact CG-CG 4.39Å; L765-L769 VanDerWaalsContact O-CB 3.23Å; L765-L769 WeakPolarHBondContact O-CB 3.38Å; L765-L769 VanDerWaalsContact O-CG 3.24Å; L765-L769 WeakPolarHBondContact O-CG 3.4Å; L765-L769 PolarHBondContact O-N 3.33Å; L765-Y807 HydrophobicContact CD1-CD1 4.22Å; L765-Y807 HydrophobicContact CD1-CD2 4.1Å; L765-Y807 HydrophobicContact CD1-CG 3.89Å
766	T	82.7	Confident	83.7	Confident	109 Å²	109	30.7 Å²	30.7	67%	0.669	19%	0.192	S	C	*	.	H	α-helix	trans	-65.4	-46.2	-175.5	-48.9	0	0	0	0	111.7	K770	T766-K770 WeakPolarHBondContact O-CB 3.37Å; T766-K770 PolarHBondContact O-N 3.42Å; T766-K770 VanDerWaalsContact O-N 3.07Å
767	V	79.2	Confident	83.8	Confident	69 Å²	69	31.7 Å²	31.7	42%	0.418	20%	0.197	S	C	.	.	H	α-helix	trans	-66.5	-46.4	179.4	179.4	0	0	0	0	110.5	K770 S771 P895	V767-K770 PolarHBondContact O-N 3.21Å; V767-S771 WeakPolarHBondContact O-CB 3.48Å; V767-S771 PolarHBondContact O-N 3.32Å; V767-P895 HydrophobicContact CB-CG 4.45Å; V767-P895 HydrophobicContact CG1-CG 4.05Å
768	G	81.8	Confident	84.3	Confident	3 Å²	3	32.1 Å²	32.1	3%	0.031	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-46.8	179.1	0	0	0	0	0	112.4	G764 S771 Y772	G764-G768 WeakPolarHBondContact O-CA 3.22Å; G764-G768 PolarHBondContact O-N 3.33Å; G768-S771 PolarHBondContact O-N 3.03Å; G768-Y772 VanDerWaalsContact O-CB 3.25Å; G768-Y772 WeakPolarHBondContact O-CB 3.45Å; G768-Y772 PolarHBondContact O-N 2.88Å
769	L	85.6	Confident	85	Confident	11 Å²	11	31.4 Å²	31.4	6%	0.058	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-44.6	176.8	-76	172.2	0	0	0	111.7	F759 L765 S771 Y772 F773 T803 I806 Y807	F759-L769 HydrophobicContact CD1-CD2 4.28Å; F759-L769 HydrophobicContact CD1-CG 4.22Å; F759-L769 HydrophobicContact CE1-CD2 3.78Å; F759-L769 HydrophobicContact CE1-CG 3.99Å; L765-L769 HydrophobicContact CD1-CD1 3.72Å; L765-L769 HydrophobicContact CD1-CG 4.08Å; L765-L769 HydrophobicContact CD2-CD1 4.49Å; L765-L769 HydrophobicContact CG-CD1 3.75Å; L765-L769 HydrophobicContact CG-CG 4.39Å; L765-L769 VanDerWaalsContact O-CB 3.23Å; L765-L769 WeakPolarHBondContact O-CB 3.38Å; L765-L769 VanDerWaalsContact O-CG 3.24Å; L765-L769 WeakPolarHBondContact O-CG 3.4Å; L765-L769 PolarHBondContact O-N 3.33Å; L769-S771 VanDerWaalsContact C-N 3.33Å; L769-S771 PolarHBondContact O-N 2.69Å; L769-Y772 PolarHBondContact O-N 3.46Å; L769-F773 HydrophobicContact CD2-CE2 4.23Å; L769-F773 WeakPolarHBondContact O-CB 3.42Å; L769-F773 WeakPolarHBondContact O-CD2 3.41Å; L769-F773 PolarHBondContact O-N 3.16Å; L769-T803 HydrophobicContact CD1-CG2 3.54Å; L769-T803 HydrophobicContact CD2-CG2 4.33Å; L769-I806 HydrophobicContact CD2-CG2 4.38Å; L769-Y807 HydrophobicContact CD2-CD1 4.49Å
770	K	84.4	Confident	85.3	Confident	139 Å²	139	31.3 Å²	31.3	60%	0.604	19%	0.188	S	C	*	.	H	α-helix	trans	-58.8	-46.9	177.8	-174.8	-178.7	179	-173.7	0	111.1	T766 V767 N774	T766-K770 WeakPolarHBondContact O-CB 3.37Å; T766-K770 PolarHBondContact O-N 3.42Å; T766-K770 VanDerWaalsContact O-N 3.07Å; V767-K770 PolarHBondContact O-N 3.21Å; K770-N774 WeakPolarHBondContact O-CB 3.01Å; K770-N774 PolarHBondContact O-N 3.38Å; K770-N774 PolarHBondContact O-ND2 3.43Å
771	S	81.4	Confident	85.4	Confident	10 Å²	10	31.2 Å²	31.2	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-44.9	177.7	-170.9	0	0	0	0	112.3	V767 G768 L769 N774 T775 S893	V767-S771 WeakPolarHBondContact O-CB 3.48Å; V767-S771 PolarHBondContact O-N 3.32Å; G768-S771 PolarHBondContact O-N 3.03Å; L769-S771 VanDerWaalsContact C-N 3.33Å; L769-S771 PolarHBondContact O-N 2.69Å; S771-N774 PolarHBondContact O-N 3.45Å; S771-T775 PolarHBondContact O-N 2.95Å; S771-T775 VanDerWaalsContact O-N 3.15Å; S771-T775 PolarHBondContact O-OG1 3.48Å; S771-S893 WeakPolarHBondContact CB-OG 3.26Å; S771-S893 PolarHBondContact OG-N 3.27Å; S771-S893 VanDerWaalsContact OG-N 3.1Å; S771-S893 PolarHBondContact OG-OG 2.9Å
772	Y	87	Confident	85.8	Confident	5 Å²	5	29.6 Å²	29.6	2%	0.02	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-49.1	178	-170.8	-79.5	0	0	0	111.7	F759 G768 L769 N774 T775 L776 I806 S834 M835 W892	F759-Y772 HydrophobicContact CE2-CD2 4.39Å; F759-Y772 AromaticContact CZ-CD2 3.77Å; F759-Y772 HydrophobicContact CZ-CD2 3.77Å; F759-Y772 HydrophobicContact CZ-CE2 4.46Å; F759-Y772 HydrophobicContact CZ-CG 4.08Å; G768-Y772 VanDerWaalsContact O-CB 3.25Å; G768-Y772 WeakPolarHBondContact O-CB 3.45Å; G768-Y772 PolarHBondContact O-N 2.88Å; L769-Y772 PolarHBondContact O-N 3.46Å; Y772-N774 PolarHBondContact O-N 3.46Å; Y772-T775 WeakPolarHBondContact O-CB 3.19Å; Y772-T775 PolarHBondContact O-N 3.21Å; Y772-L776 HydrophobicContact CD1-CB 4.41Å; Y772-L776 HydrophobicContact CD1-CD2 4.34Å; Y772-L776 HydrophobicContact CE1-CB 4.45Å; Y772-L776 HydrophobicContact CE1-CD2 4Å; Y772-L776 VanDerWaalsContact O-CB 3.31Å; Y772-L776 WeakPolarHBondContact O-CB 3.16Å; Y772-L776 PolarHBondContact O-N 3.35Å; Y772-I806 HydrophobicContact CD1-CD1 3.94Å; Y772-I806 HydrophobicContact CD1-CG1 4.41Å; Y772-I806 HydrophobicContact CD1-CG2 3.51Å; Y772-I806 HydrophobicContact CD2-CG2 4.2Å; Y772-I806 HydrophobicContact CE1-CB 4.21Å; Y772-I806 HydrophobicContact CE1-CD1 3.77Å; Y772-I806 HydrophobicContact CE1-CG1 3.86Å; Y772-I806 HydrophobicContact CE1-CG2 3.29Å; Y772-I806 HydrophobicContact CE2-CG2 4Å; Y772-I806 HydrophobicContact CG-CG2 3.95Å; Y772-S834 PolarHBondContact OH-OG 3.4Å; Y772-M835 HydrophobicContact CD1-CE 4.03Å; Y772-M835 HydrophobicContact CD2-CE 3.35Å; Y772-M835 HydrophobicContact CE1-CE 4.02Å; Y772-M835 HydrophobicContact CE1-CG 3.95Å; Y772-M835 HydrophobicContact CE2-CE 3.36Å; Y772-M835 HydrophobicContact CE2-CG 3.85Å; Y772-M835 HydrophobicContact CE2-SD 4.47Å; Y772-M835 HydrophobicContact CG-CE 3.72Å; Y772-M835 VanDerWaalsContact CZ-CG 3.41Å; Y772-M835 VanDerWaalsContact OH-CG 3.22Å; Y772-M835 WeakPolarHBondContact OH-CG 3.38Å; Y772-M835 PolarHBondContact OH-N 3.06Å; Y772-W892 HydrophobicContact CD2-CD2 4.26Å; Y772-W892 HydrophobicContact CD2-CZ2 4.36Å; Y772-W892 HydrophobicContact CE2-CH2 4.43Å; Y772-W892 HydrophobicContact CE2-CZ2 4.39Å
773	F	88.6	Confident	86.7	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.009	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-35.4	-179.8	-90.3	-78.9	0	0	0	113.2	L769 T775 L776 L777 L798 I799 T802 I806	L769-F773 HydrophobicContact CD2-CE2 4.23Å; L769-F773 WeakPolarHBondContact O-CB 3.42Å; L769-F773 WeakPolarHBondContact O-CD2 3.41Å; L769-F773 PolarHBondContact O-N 3.16Å; F773-T775 VanDerWaalsContact C-N 3.29Å; F773-T775 PolarHBondContact O-N 2.98Å; F773-L776 HydrophobicContact CD1-CD2 4.09Å; F773-L776 HydrophobicContact CE1-CD2 4.24Å; F773-L776 PolarHBondContact O-N 2.85Å; F773-L777 WeakPolarHBondContact O-CB 3.35Å; F773-L777 WeakPolarHBondContact O-CG 3.49Å; F773-L777 PolarHBondContact O-N 3.31Å; F773-L798 HydrophobicContact CE1-CB 4.1Å; F773-I799 HydrophobicContact CB-CD1 4.39Å; F773-I799 HydrophobicContact CB-CG1 4.12Å; F773-I799 HydrophobicContact CD1-CG1 4.07Å; F773-I799 HydrophobicContact CD2-CB 4.33Å; F773-I799 HydrophobicContact CD2-CG1 3.73Å; F773-I799 HydrophobicContact CD2-CG2 4.3Å; F773-I799 HydrophobicContact CE1-CG1 4.36Å; F773-I799 HydrophobicContact CE2-CB 4.17Å; F773-I799 HydrophobicContact CE2-CG1 4.03Å; F773-I799 HydrophobicContact CE2-CG2 4.12Å; F773-I799 HydrophobicContact CG-CD1 4.49Å; F773-I799 HydrophobicContact CG-CG1 3.72Å; F773-I799 HydrophobicContact CZ-CB 4.41Å; F773-I799 HydrophobicContact CZ-CG1 4.32Å; F773-T802 WeakPolarHBondContact CZ-OG1 3.44Å; F773-I806 HydrophobicContact CD1-CD1 4.3Å; F773-I806 HydrophobicContact CD2-CD1 4.13Å; F773-I806 HydrophobicContact CE1-CD1 3.66Å; F773-I806 HydrophobicContact CE2-CD1 3.47Å; F773-I806 VanDerWaalsContact CE2-CD1 3.47Å; F773-I806 HydrophobicContact CZ-CD1 3.22Å
774	N	86.3	Confident	87.6	Confident	39 Å²	39	26.4 Å²	26.4	21%	0.209	14%	0.141	C	C	.	.	H	α-helix	trans	-60.6	-42.5	173.2	-74.2	-15.5	0	0	0	111.1	K770 S771 Y772 R778	K770-N774 WeakPolarHBondContact O-CB 3.01Å; K770-N774 PolarHBondContact O-N 3.38Å; K770-N774 PolarHBondContact O-ND2 3.43Å; S771-N774 PolarHBondContact O-N 3.45Å; Y772-N774 PolarHBondContact O-N 3.46Å; N774-R778 WeakPolarHBondContact O-CG 3.41Å; N774-R778 PolarHBondContact O-N 3Å
775	T	88.8	Confident	88.2	Confident	10 Å²	10	26.4 Å²	26.4	6%	0.061	14%	0.14	C	C	.	.	H	α-helix	trans	-67.8	-44.6	176.3	-52.4	0	0	0	0	110.8	S771 Y772 F773 L777 R778 L779 M835 L889 W892	S771-T775 PolarHBondContact O-N 2.95Å; S771-T775 VanDerWaalsContact O-N 3.15Å; S771-T775 PolarHBondContact O-OG1 3.48Å; Y772-T775 WeakPolarHBondContact O-CB 3.19Å; Y772-T775 PolarHBondContact O-N 3.21Å; F773-T775 VanDerWaalsContact C-N 3.29Å; F773-T775 PolarHBondContact O-N 2.98Å; T775-L777 PolarHBondContact O-N 3.28Å; T775-R778 PolarHBondContact O-N 3.37Å; T775-L779 HydrophobicContact CG2-CD1 4.33Å; T775-L779 WeakPolarHBondContact O-CG 3.3Å; T775-L779 PolarHBondContact O-N 3.04Å; T775-M835 HydrophobicContact CG2-CE 4.01Å; T775-M835 HydrophobicContact CG2-SD 4.07Å; T775-L889 VanDerWaalsContact CG2-O 3.3Å; T775-L889 WeakPolarHBondContact CG2-O 2.92Å; T775-W892 HydrophobicContact CG2-CB 4.47Å; T775-W892 WeakPolarHBondContact OG1-CB 3.34Å
776	L	91.5	Very high	88.2	Confident	4 Å²	4	30.1 Å²	30.1	2%	0.021	15%	0.152	C	C	.	.	H	α-helix	trans	-62.2	-41.5	-179.6	-173.2	64.7	0	0	0	112.8	Y772 F773 L779 L780 I806 M835 Y838 I839	Y772-L776 HydrophobicContact CD1-CB 4.41Å; Y772-L776 HydrophobicContact CD1-CD2 4.34Å; Y772-L776 HydrophobicContact CE1-CB 4.45Å; Y772-L776 HydrophobicContact CE1-CD2 4Å; Y772-L776 VanDerWaalsContact O-CB 3.31Å; Y772-L776 WeakPolarHBondContact O-CB 3.16Å; Y772-L776 PolarHBondContact O-N 3.35Å; F773-L776 HydrophobicContact CD1-CD2 4.09Å; F773-L776 HydrophobicContact CE1-CD2 4.24Å; F773-L776 PolarHBondContact O-N 2.85Å; L776-L779 PolarHBondContact O-N 3.23Å; L776-L780 WeakPolarHBondContact O-CB 3.39Å; L776-L780 PolarHBondContact O-N 3.21Å; L776-I806 HydrophobicContact CD2-CD1 3.93Å; L776-M835 HydrophobicContact CD1-CB 3.79Å; L776-M835 HydrophobicContact CD1-CG 4.09Å; L776-Y838 HydrophobicContact CD1-CD1 3.8Å; L776-Y838 HydrophobicContact CD1-CE1 4.48Å; L776-Y838 HydrophobicContact CD1-CG 4.11Å; L776-Y838 HydrophobicContact CD2-CD1 3.54Å; L776-Y838 HydrophobicContact CD2-CD2 4.08Å; L776-Y838 HydrophobicContact CD2-CE1 3.5Å; L776-Y838 HydrophobicContact CD2-CE2 4.06Å; L776-Y838 HydrophobicContact CD2-CG 3.83Å; L776-Y838 HydrophobicContact CG-CD1 3.91Å; L776-Y838 HydrophobicContact CG-CE1 4.08Å; L776-Y838 HydrophobicContact CG-CG 4.45Å; L776-I839 HydrophobicContact CD1-CG1 4.32Å
777	L	91.8	Very high	88.5	Confident	25 Å²	25	25 Å²	25	13%	0.131	12%	0.12	C	C	.	.	H	α-helix	trans	-65.7	-39.3	177.2	-80.5	173.4	0	0	0	112.2	F773 T775 L780 A781 V792 L798 L973	F773-L777 WeakPolarHBondContact O-CB 3.35Å; F773-L777 WeakPolarHBondContact O-CG 3.49Å; F773-L777 PolarHBondContact O-N 3.31Å; T775-L777 PolarHBondContact O-N 3.28Å; L777-L780 PolarHBondContact O-N 3.31Å; L777-A781 WeakPolarHBondContact O-CB 3.35Å; L777-A781 PolarHBondContact O-N 3.2Å; L777-V792 HydrophobicContact CD2-CG2 4.46Å; L777-L798 HydrophobicContact CD2-CD1 3.83Å; L777-L973 HydrophobicContact CB-CD2 4.47Å
778	R	92.7	Very high	89.1	Confident	30 Å²	30	21.7 Å²	21.7	11%	0.113	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-41.5	173	-68.4	172.6	-178.9	158	-0.4	111.4	N774 T775 L780 A781 F782 F971 K972 V974 P975	N774-R778 WeakPolarHBondContact O-CG 3.41Å; N774-R778 PolarHBondContact O-N 3Å; T775-R778 PolarHBondContact O-N 3.37Å; R778-L780 VanDerWaalsContact C-N 3.34Å; R778-A781 PolarHBondContact O-N 2.89Å; R778-F782 WeakPolarHBondContact O-CB 3.37Å; R778-F782 PolarHBondContact O-N 2.87Å; R778-F971 PolarHBondContact NE-O 3.38Å; R778-F971 PolarHBondContact NH2-O 3.15Å; R778-K972 VanDerWaalsContact CG-O 3.29Å; R778-K972 WeakPolarHBondContact CG-O 3.46Å; R778-V974 WeakPolarHBondContact CD-O 3.47Å; R778-V974 PolarHBondContact NE-O 2.94Å; R778-P975 HydrophobicContact CB-CB 4.48Å; R778-P975 HydrophobicContact CB-CG 4.43Å
779	L	93.6	Very high	89.5	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-39.1	174.3	-72.3	174.7	0	0	0	112	T775 L776 A781 F782 H783 M835 F836 I839 T885 L889 T890	T775-L779 HydrophobicContact CG2-CD1 4.33Å; T775-L779 WeakPolarHBondContact O-CG 3.3Å; T775-L779 PolarHBondContact O-N 3.04Å; L776-L779 PolarHBondContact O-N 3.23Å; L779-A781 VanDerWaalsContact C-N 3.35Å; L779-F782 WeakPolarHBondContact O-CB 3.27Å; L779-F782 PolarHBondContact O-N 2.96Å; L779-H783 PolarHBondContact O-CD2 3.22Å; L779-H783 VanDerWaalsContact O-CD2 3.26Å; L779-H783 PolarHBondContact O-N 3.23Å; L779-H783 VanDerWaalsContact O-N 3.08Å; L779-M835 HydrophobicContact CD1-CB 4.03Å; L779-M835 HydrophobicContact CD1-CG 4.43Å; L779-M835 HydrophobicContact CD1-SD 3.56Å; L779-M835 VanDerWaalsContact CD1-SD 3.56Å; L779-F836 HydrophobicContact CD2-CE1 4.45Å; L779-I839 HydrophobicContact CB-CD1 3.65Å; L779-T885 HydrophobicContact CD2-CG2 3.6Å; L779-L889 HydrophobicContact CD2-CB 3.77Å; L779-L889 WeakPolarHBondContact CD2-O 3.37Å; L779-T890 HydrophobicContact CD1-CG2 4.47Å; L779-T890 HydrophobicContact CD2-CG2 4.49Å
780	L	93	Very high	89.6	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-63.6	-42.7	174.5	-171.2	64.2	0	0	0	110.6	L776 L777 R778 F782 H783 V784 A788 L791 I839 F842	L776-L780 WeakPolarHBondContact O-CB 3.39Å; L776-L780 PolarHBondContact O-N 3.21Å; L777-L780 PolarHBondContact O-N 3.31Å; R778-L780 VanDerWaalsContact C-N 3.34Å; L780-F782 VanDerWaalsContact C-N 3.33Å; L780-F782 PolarHBondContact O-N 3.36Å; L780-H783 PolarHBondContact O-N 3.11Å; L780-V784 HydrophobicContact CD1-CB 4.33Å; L780-V784 HydrophobicContact CD1-CG2 4.44Å; L780-V784 CarbonylContact O-C 3.53Å; L780-V784 WeakPolarHBondContact O-CA 3.49Å; L780-V784 PolarHBondContact O-N 2.84Å; L780-A788 HydrophobicContact CB-CB 4.26Å; L780-A788 HydrophobicContact CD2-CB 4.23Å; L780-A788 HydrophobicContact CG-CB 3.96Å; L780-L791 HydrophobicContact CD2-CD1 3.75Å; L780-I839 HydrophobicContact CD1-CG1 4.21Å; L780-I839 HydrophobicContact CD1-CG2 4.05Å; L780-F842 HydrophobicContact CD1-CB 4.49Å
781	A	93	Very high	89.9	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.008	9%	0.088	C	C	.	.	H	α-helix	trans	-65.7	-35.5	174.6	0	0	0	0	0	112.9	L777 R778 L779 P785 A788 L973 I1131	L777-A781 WeakPolarHBondContact O-CB 3.35Å; L777-A781 PolarHBondContact O-N 3.2Å; R778-A781 PolarHBondContact O-N 2.89Å; L779-A781 VanDerWaalsContact C-N 3.35Å; A781-P785 WeakPolarHBondContact O-CA 3.1Å; A781-P785 WeakPolarHBondContact O-CB 3.34Å; A781-A788 VanDerWaalsContact CA-CB 3.5Å; A781-A788 HydrophobicContact CB-CB 3.81Å; A781-L973 HydrophobicContact CB-CB 4.08Å; A781-L973 HydrophobicContact CB-CD2 4.23Å; A781-L973 VanDerWaalsContact CB-O 3.25Å; A781-L973 WeakPolarHBondContact CB-O 3.44Å; A781-I1131 HydrophobicContact CB-CG2 4.34Å
782	F	93.2	Very high	90.3	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65.2	-37.8	177.7	-178.4	-95	0	0	0	112.2	R778 L779 L780 L889 P975 R1137	R778-F782 WeakPolarHBondContact O-CB 3.37Å; R778-F782 PolarHBondContact O-N 2.87Å; L779-F782 WeakPolarHBondContact O-CB 3.27Å; L779-F782 PolarHBondContact O-N 2.96Å; L780-F782 VanDerWaalsContact C-N 3.33Å; L780-F782 PolarHBondContact O-N 3.36Å; F782-L889 HydrophobicContact CD1-CD1 4.28Å; F782-L889 HydrophobicContact CD2-CD1 3.53Å; F782-L889 HydrophobicContact CE1-CD1 4.34Å; F782-L889 HydrophobicContact CE2-CD1 3.61Å; F782-L889 HydrophobicContact CG-CD1 3.89Å; F782-L889 HydrophobicContact CZ-CD1 4.03Å; F782-P975 HydrophobicContact CB-CG 3.92Å; F782-P975 HydrophobicContact CD2-CB 4.42Å; F782-P975 HydrophobicContact CD2-CG 4.19Å; F782-R1137 HydrophobicContact CD1-CG 4.32Å; F782-R1137 HydrophobicContact CD2-CB 4.33Å; F782-R1137 HydrophobicContact CE1-CB 4.35Å; F782-R1137 HydrophobicContact CE1-CG 3.79Å; F782-R1137 VanDerWaalsContact CE2-CA 3.46Å; F782-R1137 HydrophobicContact CE2-CB 3.76Å; F782-R1137 HydrophobicContact CE2-CG 4.13Å; F782-R1137 HydrophobicContact CZ-CB 3.78Å; F782-R1137 HydrophobicContact CZ-CG 3.68Å; F782-R1137 WeakPolarHBondContact O-CA 3.43Å; F782-R1137 PolarHBondContact O-N 2.92Å
783	H	91.9	Very high	90.3	Very high	22 Å²	22	23 Å²	23	10%	0.102	11%	0.106	C	C	.	.	H	α-helix	trans	-99.6	-33.3	-177	-69.6	-68	0	0	0	114.5	L779 L780 F836 I839 L881 T885	L779-H783 PolarHBondContact O-CD2 3.22Å; L779-H783 VanDerWaalsContact O-CD2 3.26Å; L779-H783 PolarHBondContact O-N 3.23Å; L779-H783 VanDerWaalsContact O-N 3.08Å; L780-H783 PolarHBondContact O-N 3.11Å; H783-F836 AromaticContact NE2-CE1 3.95Å; H783-I839 HydrophobicContact CB-CG2 4.49Å; H783-L881 HydrophobicContact CB-CD2 3.87Å; H783-L881 PolarHBondContact CE1-O 3.49Å; H783-L881 WeakPolarHBondContact ND1-CD2 3.11Å; H783-T885 PolarHBondContact CE1-OG1 3.42Å; H783-T885 PolarHBondContact NE2-OG1 2.97Å
784	V	90.2	Very high	90.3	Very high	29 Å²	29	24.3 Å²	24.3	18%	0.176	11%	0.113	C	C	.	.			trans	-140.6	65.8	-173.4	-160.4	0	0	0	0	109.4	L780 R786 L787 A788 I839 I843	L780-V784 HydrophobicContact CD1-CB 4.33Å; L780-V784 HydrophobicContact CD1-CG2 4.44Å; L780-V784 CarbonylContact O-C 3.53Å; L780-V784 WeakPolarHBondContact O-CA 3.49Å; L780-V784 PolarHBondContact O-N 2.84Å; V784-R786 PolarHBondContact O-N 2.78Å; V784-L787 HydrophobicContact CB-CB 4.3Å; V784-L787 HydrophobicContact CG1-CB 3.59Å; V784-L787 HydrophobicContact CG1-CD2 4.23Å; V784-L787 PolarHBondContact O-N 3.12Å; V784-A788 PolarHBondContact O-N 3.44Å; V784-A788 VanDerWaalsContact O-N 3.08Å; V784-I839 HydrophobicContact CG2-CG2 4.35Å; V784-I843 HydrophobicContact CG2-CD1 3.77Å; V784-I843 HydrophobicContact CG2-CG1 3.64Å
785	P	90.6	Very high	90.4	Very high	3 Å²	3	28 Å²	28	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-56.6	-46.9	-169.8	21.4	-33.4	0	0	0	112.8	A781 L787 A788 V789 I1131 D1134 D1136	A781-P785 WeakPolarHBondContact O-CA 3.1Å; A781-P785 WeakPolarHBondContact O-CB 3.34Å; P785-L787 PolarHBondContact O-N 2.78Å; P785-A788 WeakPolarHBondContact O-CB 3.34Å; P785-A788 PolarHBondContact O-N 2.78Å; P785-A788 VanDerWaalsContact O-N 3.11Å; P785-V789 WeakPolarHBondContact O-CG2 3.4Å; P785-V789 PolarHBondContact O-N 2.65Å; P785-I1131 HydrophobicContact CB-CG2 3.84Å; P785-D1134 WeakPolarHBondContact CG-OD1 3.15Å; P785-D1136 HydrophobicContact CG-CB 3.78Å
786	R	85.7	Confident	90.5	Very high	119 Å²	119	28.1 Å²	28.1	45%	0.449	13%	0.133	S	C	.	.	H	α-helix	trans	-60	-41.9	-178.6	-170.6	171.3	-171.4	-130.8	-6.3	113.9	V784 R790 E852 D1134	V784-R786 PolarHBondContact O-N 2.78Å; R786-R790 VanDerWaalsContact O-CB 3.27Å; R786-R790 WeakPolarHBondContact O-CB 3.23Å; R786-R790 PolarHBondContact O-N 3.5Å; R786-E852 VanDerWaalsContact CD-OE1 3.26Å; R786-E852 WeakPolarHBondContact CD-OE1 3.27Å; R786-E852 WeakPolarHBondContact CG-OE1 3.4Å; R786-E852 IonicContact CZ-OE1 2.87Å; R786-E852 IonicContact CZ-OE2 3.63Å; R786-E852 IonicContact NE-OE1 3.7Å; R786-E852 IonicContact NE-OE2 3.73Å; R786-E852 IonicContact NH1-OE1 3.83Å; R786-E852 PolarHBondContact NH1-OE1 3.41Å; R786-E852 IonicContact NH1-OE2 2.72Å; R786-E852 PolarHBondContact NH1-OE2 3.31Å; R786-E852 IonicContact NH2-OE2 3.9Å; R786-E852 PolarHBondContact NH2-OE2 3.21Å; R786-D1134 HydrophobicContact CB-CB 4.29Å; R786-D1134 WeakPolarHBondContact CB-OD1 3.25Å; R786-D1134 PolarHBondContact N-OD1 3.49Å
787	L	88.6	Confident	90.4	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-64.8	-44.2	174.4	-178.6	58.7	0	0	0	110.9	V784 P785 R790 L791 F842 D846 L851	V784-L787 HydrophobicContact CB-CB 4.3Å; V784-L787 HydrophobicContact CG1-CB 3.59Å; V784-L787 HydrophobicContact CG1-CD2 4.23Å; V784-L787 PolarHBondContact O-N 3.12Å; P785-L787 PolarHBondContact O-N 2.78Å; L787-R790 PolarHBondContact O-N 2.95Å; L787-L791 HydrophobicContact CD1-CD1 4.17Å; L787-L791 HydrophobicContact CD1-CG 4.14Å; L787-L791 HydrophobicContact CG-CD1 4.05Å; L787-L791 HydrophobicContact CG-CG 4.45Å; L787-L791 VanDerWaalsContact O-CG 3.25Å; L787-L791 WeakPolarHBondContact O-CG 3.21Å; L787-L791 PolarHBondContact O-N 2.91Å; L787-F842 HydrophobicContact CD2-CB 3.98Å; L787-F842 HydrophobicContact CD2-CD1 4.27Å; L787-D846 HydrophobicContact CD2-CB 4.21Å; L787-L851 HydrophobicContact CD1-CB 4.09Å; L787-L851 HydrophobicContact CD1-CD1 4.1Å
788	A	91.2	Very high	90.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-47.1	178.4	0	0	0	0	0	112.4	L780 A781 V784 P785 R790 L791 V792 L973	L780-A788 HydrophobicContact CB-CB 4.26Å; L780-A788 HydrophobicContact CD2-CB 4.23Å; L780-A788 HydrophobicContact CG-CB 3.96Å; A781-A788 VanDerWaalsContact CA-CB 3.5Å; A781-A788 HydrophobicContact CB-CB 3.81Å; V784-A788 PolarHBondContact O-N 3.44Å; V784-A788 VanDerWaalsContact O-N 3.08Å; P785-A788 WeakPolarHBondContact O-CB 3.34Å; P785-A788 PolarHBondContact O-N 2.78Å; P785-A788 VanDerWaalsContact O-N 3.11Å; A788-R790 VanDerWaalsContact C-N 3.34Å; A788-R790 PolarHBondContact O-N 3.09Å; A788-L791 PolarHBondContact O-N 3.3Å; A788-V792 WeakPolarHBondContact O-CG2 3.45Å; A788-V792 PolarHBondContact O-N 3.13Å; A788-V792 VanDerWaalsContact O-N 3.11Å; A788-L973 HydrophobicContact CB-CD2 4.15Å
789	V	90.2	Very high	90	Very high	14 Å²	14	33.2 Å²	33.2	9%	0.085	17%	0.166	C	C	.	.	H	α-helix	trans	-59	-47.6	175.5	173.6	0	0	0	0	110.1	P785 L791 V792 D793 L973 I1131 K1132	P785-V789 WeakPolarHBondContact O-CG2 3.4Å; P785-V789 PolarHBondContact O-N 2.65Å; V789-L791 PolarHBondContact O-N 3.39Å; V789-V792 PolarHBondContact O-N 3.39Å; V789-D793 VanDerWaalsContact CG1-OD2 3.3Å; V789-D793 WeakPolarHBondContact CG1-OD2 3.39Å; V789-D793 WeakPolarHBondContact O-CB 3.31Å; V789-D793 PolarHBondContact O-N 3.1Å; V789-L973 HydrophobicContact CB-CD1 4.44Å; V789-L973 HydrophobicContact CG2-CD1 3.85Å; V789-I1131 HydrophobicContact CG2-CG2 3.71Å; V789-K1132 HydrophobicContact CG1-CG 4.05Å; V789-K1132 HydrophobicContact CG2-CG 4.22Å
790	R	88.2	Confident	89.7	Confident	94 Å²	94	36.4 Å²	36.4	36%	0.355	20%	0.2	S	C	.	.	H	α-helix	trans	-60.3	-45.5	-179.4	-177.3	58.7	172.6	153.8	8.7	112.3	R786 L787 A788 V792 D793 I794 E852 L854	R786-R790 VanDerWaalsContact O-CB 3.27Å; R786-R790 WeakPolarHBondContact O-CB 3.23Å; R786-R790 PolarHBondContact O-N 3.5Å; L787-R790 PolarHBondContact O-N 2.95Å; A788-R790 VanDerWaalsContact C-N 3.34Å; A788-R790 PolarHBondContact O-N 3.09Å; R790-V792 VanDerWaalsContact C-N 3.31Å; R790-V792 PolarHBondContact O-N 3.39Å; R790-D793 PolarHBondContact O-N 3.16Å; R790-I794 HydrophobicContact CG-CD1 3.93Å; R790-I794 VanDerWaalsContact CZ-CG1 3.44Å; R790-I794 VanDerWaalsContact NH1-CG1 3.32Å; R790-I794 VanDerWaalsContact O-CG1 3.27Å; R790-I794 WeakPolarHBondContact O-CG1 3.31Å; R790-I794 PolarHBondContact O-N 2.84Å; R790-I794 VanDerWaalsContact O-N 3.07Å; R790-E852 PolarHBondContact NE-O 3.45Å; R790-L854 PolarHBondContact NH2-O 3.42Å
791	L	90.2	Very high	89.5	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.8	-37.9	178.6	-68.1	172.2	0	0	0	111.9	L780 L787 A788 V789 N795 V796 L798 F842 I859	L780-L791 HydrophobicContact CD2-CD1 3.75Å; L787-L791 HydrophobicContact CD1-CD1 4.17Å; L787-L791 HydrophobicContact CD1-CG 4.14Å; L787-L791 HydrophobicContact CG-CD1 4.05Å; L787-L791 HydrophobicContact CG-CG 4.45Å; L787-L791 VanDerWaalsContact O-CG 3.25Å; L787-L791 WeakPolarHBondContact O-CG 3.21Å; L787-L791 PolarHBondContact O-N 2.91Å; A788-L791 PolarHBondContact O-N 3.3Å; V789-L791 PolarHBondContact O-N 3.39Å; L791-N795 PolarHBondContact O-N 3.48Å; L791-V796 HydrophobicContact CD2-CB 4.18Å; L791-V796 HydrophobicContact CD2-CG1 4.36Å; L791-V796 HydrophobicContact CD2-CG2 3.81Å; L791-V796 PolarHBondContact O-N 3.28Å; L791-L798 HydrophobicContact CB-CD1 4.35Å; L791-L798 HydrophobicContact CD1-CD1 4.13Å; L791-F842 HydrophobicContact CD1-CD1 4.12Å; L791-F842 HydrophobicContact CD1-CE1 3.97Å; L791-I859 HydrophobicContact CD2-CG2 4.5Å
792	V	89.4	Confident	89.4	Confident	11 Å²	11	38.2 Å²	38.2	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-73.7	-42.7	176.7	171.3	0	0	0	0	112.1	L777 A788 V789 R790 I794 N795 N969 L973	L777-V792 HydrophobicContact CD2-CG2 4.46Å; A788-V792 WeakPolarHBondContact O-CG2 3.45Å; A788-V792 PolarHBondContact O-N 3.13Å; A788-V792 VanDerWaalsContact O-N 3.11Å; V789-V792 PolarHBondContact O-N 3.39Å; R790-V792 VanDerWaalsContact C-N 3.31Å; R790-V792 PolarHBondContact O-N 3.39Å; V792-I794 PolarHBondContact O-N 3.45Å; V792-N795 WeakPolarHBondContact O-CA 3.39Å; V792-N795 PolarHBondContact O-N 3.26Å; V792-N795 PolarHBondContact O-OD1 3.18Å; V792-N969 HydrophobicContact CG1-CB 4.09Å; V792-N969 VanDerWaalsContact CG1-CG 3.43Å; V792-N969 WeakPolarHBondContact CG1-OD1 3.37Å; V792-L973 HydrophobicContact CB-CD1 4.35Å; V792-L973 HydrophobicContact CG2-CD1 4.28Å; V792-L973 HydrophobicContact CG2-CD2 3.67Å; V792-L973 HydrophobicContact CG2-CG 4.19Å
793	D	87.9	Confident	89.3	Confident	74 Å²	74	39.6 Å²	39.6	40%	0.396	22%	0.217	S	C	.	.	H	α-helix	trans	-68.1	-35.9	-177.1	-77.6	-10.1	0	0	0	112.4	V789 R790 N795	V789-D793 VanDerWaalsContact CG1-OD2 3.3Å; V789-D793 WeakPolarHBondContact CG1-OD2 3.39Å; V789-D793 WeakPolarHBondContact O-CB 3.31Å; V789-D793 PolarHBondContact O-N 3.1Å; R790-D793 PolarHBondContact O-N 3.16Å; D793-N795 PolarHBondContact O-N 3.34Å
794	I	88.7	Confident	89.3	Confident	30 Å²	30	39.4 Å²	39.4	15%	0.154	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.5	171.8	-50.5	168.1	0	0	0	111.7	R790 V792 V796 L856 I859	R790-I794 HydrophobicContact CG-CD1 3.93Å; R790-I794 VanDerWaalsContact CZ-CG1 3.44Å; R790-I794 VanDerWaalsContact NH1-CG1 3.32Å; R790-I794 VanDerWaalsContact O-CG1 3.27Å; R790-I794 WeakPolarHBondContact O-CG1 3.31Å; R790-I794 PolarHBondContact O-N 2.84Å; R790-I794 VanDerWaalsContact O-N 3.07Å; V792-I794 PolarHBondContact O-N 3.45Å; I794-V796 HydrophobicContact CB-CG2 4.28Å; I794-L856 HydrophobicContact CG2-CB 3.52Å; I794-L856 HydrophobicContact CG2-CD1 3.93Å; I794-L856 HydrophobicContact CG2-CD2 4.46Å; I794-L856 HydrophobicContact CG2-CG 4.13Å; I794-I859 HydrophobicContact CD1-CD1 3.87Å
795	N	88.4	Confident	89.4	Confident	116 Å²	116	38.6 Å²	38.6	62%	0.62	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	48.5	-173	-66.8	-58.7	0	0	0	113	L791 V792 D793 P797	L791-N795 PolarHBondContact O-N 3.48Å; V792-N795 WeakPolarHBondContact O-CA 3.39Å; V792-N795 PolarHBondContact O-N 3.26Å; V792-N795 PolarHBondContact O-OD1 3.18Å; D793-N795 PolarHBondContact O-N 3.34Å; N795-P797 WeakPolarHBondContact O-CD 3.36Å
796	V	89.9	Confident	89.4	Confident	13 Å²	13	38.6 Å²	38.6	8%	0.079	22%	0.215	C	C	.	.			trans	-61.8	124.8	173.8	-179.4	0	0	0	0	109	L791 I794 L798 L801 L856 I859 L863	L791-V796 HydrophobicContact CD2-CB 4.18Å; L791-V796 HydrophobicContact CD2-CG1 4.36Å; L791-V796 HydrophobicContact CD2-CG2 3.81Å; L791-V796 PolarHBondContact O-N 3.28Å; I794-V796 HydrophobicContact CB-CG2 4.28Å; V796-L798 HydrophobicContact CB-CG 4.42Å; V796-L798 HydrophobicContact CG1-CD2 3.85Å; V796-L798 HydrophobicContact CG1-CG 4.08Å; V796-L798 PolarHBondContact O-N 2.98Å; V796-L801 HydrophobicContact CG1-CD1 3.91Å; V796-L856 HydrophobicContact CB-CD1 4.41Å; V796-L856 HydrophobicContact CG2-CD1 3.94Å; V796-I859 HydrophobicContact CG1-CG2 4.1Å; V796-I859 HydrophobicContact CG2-CG2 4.13Å; V796-L863 HydrophobicContact CG1-CD1 4.14Å
797	P	89.7	Confident	89.7	Confident	70 Å²	70	33.9 Å²	33.9	46%	0.455	20%	0.197	S	C	.	.			trans	-78.9	63.6	-178	32.6	-35.4	0	0	0	111.3	N795 I799 G800 L801	N795-P797 WeakPolarHBondContact O-CD 3.36Å; P797-I799 VanDerWaalsContact C-N 3.25Å; P797-I799 PolarHBondContact O-N 3.35Å; P797-G800 PolarHBondContact O-N 3.38Å; P797-L801 HydrophobicContact CG-CD1 4.02Å; P797-L801 HydrophobicContact CG-CG 4.25Å; P797-L801 WeakPolarHBondContact O-CG 3.41Å; P797-L801 PolarHBondContact O-N 3.35Å
798	L	89.7	Confident	90	Very high	11 Å²	11	33.8 Å²	33.8	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-55	-39.2	-175.2	-69.5	172.3	0	0	0	112.8	F773 L777 L791 V796 G800 L801 T802 F842 L863	F773-L798 HydrophobicContact CE1-CB 4.1Å; L777-L798 HydrophobicContact CD2-CD1 3.83Å; L791-L798 HydrophobicContact CB-CD1 4.35Å; L791-L798 HydrophobicContact CD1-CD1 4.13Å; V796-L798 HydrophobicContact CB-CG 4.42Å; V796-L798 HydrophobicContact CG1-CD2 3.85Å; V796-L798 HydrophobicContact CG1-CG 4.08Å; V796-L798 PolarHBondContact O-N 2.98Å; L798-G800 PolarHBondContact O-N 3.01Å; L798-L801 PolarHBondContact O-N 2.83Å; L798-T802 PolarHBondContact O-N 2.87Å; L798-T802 PolarHBondContact O-OG1 2.69Å; L798-F842 HydrophobicContact CD2-CE1 4.13Å; L798-F842 HydrophobicContact CD2-CZ 3.79Å; L798-L863 HydrophobicContact CD2-CD1 3.91Å
799	I	87.4	Confident	90.3	Very high	85 Å²	85	34 Å²	34	44%	0.436	20%	0.197	S	C	.	.	H	α-helix	trans	-56.2	-52.9	175.3	-57.9	176.2	0	0	0	109.5	F773 P797 L801 T803	F773-I799 HydrophobicContact CB-CD1 4.39Å; F773-I799 HydrophobicContact CB-CG1 4.12Å; F773-I799 HydrophobicContact CD1-CG1 4.07Å; F773-I799 HydrophobicContact CD2-CB 4.33Å; F773-I799 HydrophobicContact CD2-CG1 3.73Å; F773-I799 HydrophobicContact CD2-CG2 4.3Å; F773-I799 HydrophobicContact CE1-CG1 4.36Å; F773-I799 HydrophobicContact CE2-CB 4.17Å; F773-I799 HydrophobicContact CE2-CG1 4.03Å; F773-I799 HydrophobicContact CE2-CG2 4.12Å; F773-I799 HydrophobicContact CG-CD1 4.49Å; F773-I799 HydrophobicContact CG-CG1 3.72Å; F773-I799 HydrophobicContact CZ-CB 4.41Å; F773-I799 HydrophobicContact CZ-CG1 4.32Å; P797-I799 VanDerWaalsContact C-N 3.25Å; P797-I799 PolarHBondContact O-N 3.35Å; I799-L801 VanDerWaalsContact C-N 3.35Å; I799-L801 PolarHBondContact O-N 2.74Å; I799-T803 WeakPolarHBondContact O-CB 3.35Å; I799-T803 PolarHBondContact O-N 2.82Å; I799-T803 VanDerWaalsContact O-N 3.1Å; I799-T803 PolarHBondContact O-OG1 3.48Å
800	G	87	Confident	90.5	Very high	69 Å²	69	33.4 Å²	33.4	71%	0.711	19%	0.194	S	C	*	.	H	α-helix	trans	-63.6	-37.6	179.8	0	0	0	0	0	113.7	P797 L798	P797-G800 PolarHBondContact O-N 3.38Å; L798-G800 PolarHBondContact O-N 3.01Å
801	L	89.1	Confident	90.9	Very high	40 Å²	40	28.9 Å²	28.9	21%	0.209	18%	0.177	C	C	.	.	H	α-helix	trans	-80.1	-36.5	-173.8	-66.1	169.1	0	0	0	113.6	V796 P797 L798 I799 C860 L863	V796-L801 HydrophobicContact CG1-CD1 3.91Å; P797-L801 HydrophobicContact CG-CD1 4.02Å; P797-L801 HydrophobicContact CG-CG 4.25Å; P797-L801 WeakPolarHBondContact O-CG 3.41Å; P797-L801 PolarHBondContact O-N 3.35Å; L798-L801 PolarHBondContact O-N 2.83Å; I799-L801 VanDerWaalsContact C-N 3.35Å; I799-L801 PolarHBondContact O-N 2.74Å; L801-C860 HydrophobicContact CD1-CB 4.33Å; L801-C860 HydrophobicContact CD2-CB 4.46Å; L801-L863 HydrophobicContact CB-CB 4.32Å; L801-L863 HydrophobicContact CD1-CB 4.2Å; L801-L863 HydrophobicContact CD1-CD1 4.12Å
802	T	91	Very high	91	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-119.5	10.2	-170.4	75.4	0	0	0	0	113.5	F773 L798 G804 W805 Y838	F773-T802 WeakPolarHBondContact CZ-OG1 3.44Å; L798-T802 PolarHBondContact O-N 2.87Å; L798-T802 PolarHBondContact O-OG1 2.69Å; T802-G804 VanDerWaalsContact C-N 3.29Å; T802-G804 PolarHBondContact O-N 2.8Å; T802-W805 HydrophobicContact CG2-CD2 3.98Å; T802-W805 HydrophobicContact CG2-CE3 3.76Å; T802-W805 HydrophobicContact CG2-CH2 3.99Å; T802-W805 HydrophobicContact CG2-CZ2 4.19Å; T802-W805 HydrophobicContact CG2-CZ3 3.76Å; T802-W805 VanDerWaalsContact O-CB 3.3Å; T802-W805 WeakPolarHBondContact O-CB 3.38Å; T802-W805 PolarHBondContact O-N 2.83Å; T802-Y838 HydrophobicContact CG2-CE2 4.24Å; T802-Y838 WeakPolarHBondContact OG1-CE2 3.4Å; T802-Y838 PolarHBondContact OG1-OH 3.07Å
803	T	91	Very high	91.1	Very high	29 Å²	29	34.3 Å²	34.3	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-54.1	-47.4	176	-83.2	0	0	0	0	111	L769 I799 W805 I806 Y807	L769-T803 HydrophobicContact CD1-CG2 3.54Å; L769-T803 HydrophobicContact CD2-CG2 4.33Å; I799-T803 WeakPolarHBondContact O-CB 3.35Å; I799-T803 PolarHBondContact O-N 2.82Å; I799-T803 VanDerWaalsContact O-N 3.1Å; I799-T803 PolarHBondContact O-OG1 3.48Å; T803-W805 PolarHBondContact O-N 2.81Å; T803-I806 PolarHBondContact O-N 3.45Å; T803-I806 VanDerWaalsContact O-N 3.07Å; T803-Y807 HydrophobicContact CG2-CD1 3.66Å; T803-Y807 HydrophobicContact CG2-CE1 3.5Å; T803-Y807 VanDerWaalsContact CG2-CE1 3.5Å; T803-Y807 WeakPolarHBondContact O-CD1 3.38Å; T803-Y807 WeakPolarHBondContact O-CE1 3.49Å; T803-Y807 PolarHBondContact O-N 3.46Å
804	G	90.2	Very high	91.2	Very high	18 Å²	18	31 Å²	31	19%	0.186	19%	0.189	C	C	.	.	H	α-helix	trans	-56.8	-22.7	177.2	0	0	0	0	0	114.7	T802 T808	T802-G804 VanDerWaalsContact C-N 3.29Å; T802-G804 PolarHBondContact O-N 2.8Å; G804-T808 PolarHBondContact O-OG1 2.92Å
805	W	93.2	Very high	91.5	Very high	13 Å²	13	32.3 Å²	32.3	5%	0.049	20%	0.199	C	C	.	.	H	α-helix	trans	-78.2	-35.2	179.6	-58	4.2	0	0	0	111.7	T802 T803 L809 F810 A813 Y838 F842 L863 F866	T802-W805 HydrophobicContact CG2-CD2 3.98Å; T802-W805 HydrophobicContact CG2-CE3 3.76Å; T802-W805 HydrophobicContact CG2-CH2 3.99Å; T802-W805 HydrophobicContact CG2-CZ2 4.19Å; T802-W805 HydrophobicContact CG2-CZ3 3.76Å; T802-W805 VanDerWaalsContact O-CB 3.3Å; T802-W805 WeakPolarHBondContact O-CB 3.38Å; T802-W805 PolarHBondContact O-N 2.83Å; T803-W805 PolarHBondContact O-N 2.81Å; W805-L809 CarbonylContact O-C 3.54Å; W805-L809 WeakPolarHBondContact O-CA 3.39Å; W805-L809 PolarHBondContact O-N 3.09Å; W805-F810 HydrophobicContact CB-CD1 3.67Å; W805-F810 HydrophobicContact CB-CE1 3.66Å; W805-F810 HydrophobicContact CD2-CE1 4.49Å; W805-F810 HydrophobicContact CE3-CE1 4.24Å; W805-F810 HydrophobicContact CG-CD1 4.2Å; W805-F810 HydrophobicContact CG-CE1 4.31Å; W805-F810 PolarHBondContact O-N 3.41Å; W805-A813 HydrophobicContact CG-CB 4.41Å; W805-Y838 HydrophobicContact CE3-CD2 4.26Å; W805-Y838 AromaticContact CE3-CE2 3.97Å; W805-Y838 HydrophobicContact CE3-CE2 3.97Å; W805-F842 HydrophobicContact CZ3-CE2 4.14Å; W805-L863 HydrophobicContact CH2-CD2 4.06Å; W805-L863 VanDerWaalsContact CZ2-O 3.31Å; W805-L863 WeakPolarHBondContact CZ2-O 3.26Å; W805-F866 HydrophobicContact CD2-CD2 4.04Å; W805-F866 HydrophobicContact CD2-CE2 4.08Å; W805-F866 AromaticContact CE2-CD2 3.56Å; W805-F866 HydrophobicContact CE3-CE2 4.34Å; W805-F866 HydrophobicContact CG-CD2 4.47Å; W805-F866 HydrophobicContact CG-CE2 4.5Å; W805-F866 HydrophobicContact CH2-CD2 4.31Å; W805-F866 AromaticContact CZ2-CD2 3.72Å; W805-F866 HydrophobicContact CZ2-CD2 3.72Å; W805-F866 HydrophobicContact CZ2-CE2 4.33Å; W805-F866 AromaticContact NE1-CD2 3.74Å
806	I	91	Very high	91.8	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-85.9	-61.6	-168.1	-68.8	164.7	0	0	0	111.3	F759 L769 Y772 F773 L776 T803 T808 L809 Y838	F759-I806 HydrophobicContact CZ-CG2 4.21Å; L769-I806 HydrophobicContact CD2-CG2 4.38Å; Y772-I806 HydrophobicContact CD1-CD1 3.94Å; Y772-I806 HydrophobicContact CD1-CG1 4.41Å; Y772-I806 HydrophobicContact CD1-CG2 3.51Å; Y772-I806 HydrophobicContact CD2-CG2 4.2Å; Y772-I806 HydrophobicContact CE1-CB 4.21Å; Y772-I806 HydrophobicContact CE1-CD1 3.77Å; Y772-I806 HydrophobicContact CE1-CG1 3.86Å; Y772-I806 HydrophobicContact CE1-CG2 3.29Å; Y772-I806 HydrophobicContact CE2-CG2 4Å; Y772-I806 HydrophobicContact CG-CG2 3.95Å; F773-I806 HydrophobicContact CD1-CD1 4.3Å; F773-I806 HydrophobicContact CD2-CD1 4.13Å; F773-I806 HydrophobicContact CE1-CD1 3.66Å; F773-I806 HydrophobicContact CE2-CD1 3.47Å; F773-I806 VanDerWaalsContact CE2-CD1 3.47Å; F773-I806 HydrophobicContact CZ-CD1 3.22Å; L776-I806 HydrophobicContact CD2-CD1 3.93Å; T803-I806 PolarHBondContact O-N 3.45Å; T803-I806 VanDerWaalsContact O-N 3.07Å; I806-T808 PolarHBondContact O-N 3.3Å; I806-T808 VanDerWaalsContact O-N 3.15Å; I806-L809 PolarHBondContact O-N 2.82Å; I806-Y838 HydrophobicContact CD1-CD2 4.33Å; I806-Y838 HydrophobicContact CD1-CE2 4.06Å; I806-Y838 HydrophobicContact CG1-CD2 4.14Å; I806-Y838 HydrophobicContact CG1-CE2 4.25Å
807	Y	92.1	Very high	91.9	Very high	19 Å²	19	30.2 Å²	30.2	8%	0.075	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-7	-172.9	78.7	-83.8	0	0	0	113	T723 Q724 L756 F760 L765 L769 T803	T723-Y807 HydrophobicContact CG2-CE2 4.28Å; Q724-Y807 VanDerWaalsContact O-CE2 3.28Å; Q724-Y807 WeakPolarHBondContact O-CE2 3.49Å; Q724-Y807 PolarHBondContact O-OH 2.9Å; L756-Y807 VanDerWaalsContact CD1-O 3.29Å; L756-Y807 WeakPolarHBondContact CD1-O 3.46Å; F760-Y807 HydrophobicContact CE1-CD2 4.04Å; F760-Y807 HydrophobicContact CE1-CE2 4.28Å; F760-Y807 HydrophobicContact CE2-CD2 4.35Å; F760-Y807 WeakPolarHBondContact CE2-O 3.17Å; F760-Y807 AromaticContact CZ-CD2 3.63Å; F760-Y807 HydrophobicContact CZ-CD2 3.63Å; F760-Y807 HydrophobicContact CZ-CE2 4.19Å; F760-Y807 WeakPolarHBondContact CZ-O 3.43Å; L765-Y807 HydrophobicContact CD1-CD1 4.22Å; L765-Y807 HydrophobicContact CD1-CD2 4.1Å; L765-Y807 HydrophobicContact CD1-CG 3.89Å; L769-Y807 HydrophobicContact CD2-CD1 4.49Å; T803-Y807 HydrophobicContact CG2-CD1 3.66Å; T803-Y807 HydrophobicContact CG2-CE1 3.5Å; T803-Y807 VanDerWaalsContact CG2-CE1 3.5Å; T803-Y807 WeakPolarHBondContact O-CD1 3.38Å; T803-Y807 WeakPolarHBondContact O-CE1 3.49Å; T803-Y807 PolarHBondContact O-N 3.46Å
808	T	95.4	Very high	92	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	2.6	170.4	79.9	0	0	0	0	113.1	V729 G804 I806 F810 A811 H812	V729-T808 HydrophobicContact CG2-CG2 4.41Å; G804-T808 PolarHBondContact O-OG1 2.92Å; I806-T808 PolarHBondContact O-N 3.3Å; I806-T808 VanDerWaalsContact O-N 3.15Å; T808-F810 PolarHBondContact O-N 3.14Å; T808-A811 WeakPolarHBondContact O-CB 3.48Å; T808-A811 PolarHBondContact O-N 3.4Å; T808-A811 PolarHBondContact OG1-N 3.44Å; T808-H812 HydrophobicContact CG2-CB 4.02Å; T808-H812 WeakPolarHBondContact OG1-CB 3.31Å; T808-H812 PolarHBondContact OG1-N 3.34Å; T808-H812 VanDerWaalsContact OG1-N 3.12Å
809	L	95.7	Very high	92.3	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	51.2	-172.3	-66	172.7	0	0	0	111.7	F751 K755 L756 W805 I806 A811 W823 I826	F751-L809 HydrophobicContact CE1-CD1 3.69Å; F751-L809 HydrophobicContact CE2-CD1 4.22Å; F751-L809 HydrophobicContact CZ-CB 4.44Å; F751-L809 HydrophobicContact CZ-CD1 3.31Å; F751-L809 HydrophobicContact CZ-CG 4.42Å; K755-L809 HydrophobicContact CB-CD1 4Å; L756-L809 HydrophobicContact CD1-CD1 3.99Å; L756-L809 HydrophobicContact CD1-CG 4.09Å; L756-L809 HydrophobicContact CD2-CD1 4.17Å; L756-L809 HydrophobicContact CD2-CD2 4.33Å; L756-L809 HydrophobicContact CD2-CG 3.88Å; L756-L809 HydrophobicContact CG-CD1 3.88Å; L756-L809 HydrophobicContact CG-CG 4.08Å; W805-L809 CarbonylContact O-C 3.54Å; W805-L809 WeakPolarHBondContact O-CA 3.39Å; W805-L809 PolarHBondContact O-N 3.09Å; I806-L809 PolarHBondContact O-N 2.82Å; L809-A811 PolarHBondContact O-N 3.47Å; L809-A811 VanDerWaalsContact O-N 3.16Å; L809-W823 HydrophobicContact CB-CZ2 4.35Å; L809-W823 PolarHBondContact O-NE1 3.21Å; L809-I826 HydrophobicContact CD1-CG2 4.1Å
810	F	95.7	Very high	92.7	Very high	2 Å²	2	27 Å²	27	1%	0.009	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.8	-2.4	179	-50.5	-87.1	0	0	0	115.6	W805 T808 H812 A813 M814 I819 L822 F837 F841 F866	W805-F810 HydrophobicContact CB-CD1 3.67Å; W805-F810 HydrophobicContact CB-CE1 3.66Å; W805-F810 HydrophobicContact CD2-CE1 4.49Å; W805-F810 HydrophobicContact CE3-CE1 4.24Å; W805-F810 HydrophobicContact CG-CD1 4.2Å; W805-F810 HydrophobicContact CG-CE1 4.31Å; W805-F810 PolarHBondContact O-N 3.41Å; T808-F810 PolarHBondContact O-N 3.14Å; F810-H812 PolarHBondContact O-N 3.22Å; F810-H812 VanDerWaalsContact O-N 3.13Å; F810-A813 PolarHBondContact O-N 2.61Å; F810-M814 PolarHBondContact O-N 3.18Å; F810-I819 HydrophobicContact CB-CD1 3.69Å; F810-I819 WeakPolarHBondContact O-CD1 3.25Å; F810-L822 HydrophobicContact CB-CD2 4.02Å; F810-L822 HydrophobicContact CD2-CD2 3.48Å; F810-L822 VanDerWaalsContact CD2-CD2 3.48Å; F810-L822 HydrophobicContact CE2-CD2 4.25Å; F810-L822 HydrophobicContact CG-CD2 4Å; F810-F837 HydrophobicContact CE2-CB 4.34Å; F810-F841 HydrophobicContact CD1-CD2 4.23Å; F810-F841 AromaticContact CD1-CE2 3.66Å; F810-F841 HydrophobicContact CD1-CE2 3.66Å; F810-F841 HydrophobicContact CD2-CE2 4.37Å; F810-F841 AromaticContact CE1-CD2 3.54Å; F810-F841 HydrophobicContact CE1-CD2 3.54Å; F810-F841 AromaticContact CE1-CE2 3.3Å; F810-F841 HydrophobicContact CE1-CE2 3.3Å; F810-F841 HydrophobicContact CE2-CE2 4.08Å; F810-F841 HydrophobicContact CG-CE2 4.18Å; F810-F841 AromaticContact CZ-CD2 3.88Å; F810-F841 HydrophobicContact CZ-CD2 3.88Å; F810-F841 AromaticContact CZ-CE2 3.53Å; F810-F841 HydrophobicContact CZ-CE2 3.53Å; F810-F866 AromaticContact CD1-CE2 3.87Å; F810-F866 HydrophobicContact CD1-CE2 3.87Å; F810-F866 HydrophobicContact CD1-CZ 4.26Å; F810-F866 HydrophobicContact CE1-CE2 4.43Å
811	A	96.3	Very high	93	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-34.7	-176.6	0	0	0	0	0	112.4	H690 V732 T808 L809 W823	H690-A811 PolarHBondContact CE1-O 3.38Å; H690-A811 PolarHBondContact NE2-O 2.63Å; V732-A811 HydrophobicContact CG2-CB 4.1Å; T808-A811 WeakPolarHBondContact O-CB 3.48Å; T808-A811 PolarHBondContact O-N 3.4Å; T808-A811 PolarHBondContact OG1-N 3.44Å; L809-A811 PolarHBondContact O-N 3.47Å; L809-A811 VanDerWaalsContact O-N 3.16Å; A811-W823 HydrophobicContact CB-CZ2 4.05Å
812	H	92.4	Very high	93.2	Very high	95 Å²	95	24.3 Å²	24.3	44%	0.44	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-24	177.7	-165.2	67.2	0	0	0	114.4	S728 T808 F810	S728-H812 PolarHBondContact OG-ND1 3.36Å; T808-H812 HydrophobicContact CG2-CB 4.02Å; T808-H812 WeakPolarHBondContact OG1-CB 3.31Å; T808-H812 PolarHBondContact OG1-N 3.34Å; T808-H812 VanDerWaalsContact OG1-N 3.12Å; F810-H812 PolarHBondContact O-N 3.22Å; F810-H812 VanDerWaalsContact O-N 3.13Å
813	A	90.5	Very high	93.5	Very high	30 Å²	30	24.3 Å²	24.3	25%	0.248	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-20.7	-168.7	0	0	0	0	0	114	W805 F810 F866	W805-A813 HydrophobicContact CG-CB 4.41Å; F810-A813 PolarHBondContact O-N 2.61Å; A813-F866 HydrophobicContact CB-CB 4.17Å; A813-F866 HydrophobicContact CB-CD2 3.66Å; A813-F866 HydrophobicContact CB-CE2 4.29Å; A813-F866 HydrophobicContact CB-CG 4Å; A813-F866 WeakPolarHBondContact O-CB 3.25Å
814	M	91.6	Very high	93.7	Very high	5 Å²	5	23.4 Å²	23.4	3%	0.025	12%	0.124	C	C	.	.	S	Bend	trans	-123.2	151.9	-172	-164.6	171.7	62.8	0	0	111.7	F810 R818 I819 L822 F866 L871	F810-M814 PolarHBondContact O-N 3.18Å; M814-R818 HydrophobicContact CE-CB 3.62Å; M814-R818 WeakPolarHBondContact CE-O 3.45Å; M814-R818 HydrophobicContact CG-CB 3.72Å; M814-R818 HydrophobicContact SD-CB 3.65Å; M814-I819 HydrophobicContact CB-CD1 3.98Å; M814-I819 HydrophobicContact CB-CG1 4.08Å; M814-I819 HydrophobicContact CE-CB 4.49Å; M814-I819 HydrophobicContact CE-CD1 3.46Å; M814-I819 VanDerWaalsContact CE-CD1 3.46Å; M814-I819 HydrophobicContact CE-CG1 3.82Å; M814-L822 HydrophobicContact CE-CB 4.14Å; M814-L822 HydrophobicContact CE-CD2 3.94Å; M814-F866 HydrophobicContact CB-CD1 4.41Å; M814-F866 HydrophobicContact CB-CE1 4.08Å; M814-F866 HydrophobicContact CB-CZ 4.48Å; M814-F866 HydrophobicContact CG-CD1 4.47Å; M814-F866 HydrophobicContact CG-CE1 3.96Å; M814-F866 HydrophobicContact SD-CE1 3.92Å; M814-F866 HydrophobicContact SD-CZ 4.28Å; M814-L871 HydrophobicContact CE-CD1 4.27Å; M814-L871 HydrophobicContact CE-CD2 4.32Å; M814-L871 HydrophobicContact SD-CD1 4.29Å; M814-L871 HydrophobicContact SD-CD2 4.07Å
815	P	93.4	Very high	93.9	Very high	57 Å²	57	22.9 Å²	22.9	37%	0.37	12%	0.118	S	C	.	.			trans	-56.3	144.7	173.5	-29	37.5	0	0	0	114	Y692 D817 R818 I819	Y692-P815 WeakPolarHBondContact OH-CA 3.26Å; P815-D817 VanDerWaalsContact C-N 3.33Å; P815-D817 WeakPolarHBondContact CB-OD1 3.4Å; P815-D817 PolarHBondContact O-N 3.34Å; P815-R818 WeakPolarHBondContact O-CB 3.26Å; P815-R818 PolarHBondContact O-N 2.93Å; P815-I819 WeakPolarHBondContact O-CG1 3.23Å; P815-I819 PolarHBondContact O-N 3.16Å
816	L	95.1	Very high	93.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.2	-39.4	-174.5	-71.5	170.5	0	0	0	113.4	H690 Y692 D693 L696 V732 R735 R818 I819 E820	H690-L816 HydrophobicContact CB-CD1 3.98Å; Y692-L816 PolarHBondContact OH-N 3.2Å; Y692-L816 VanDerWaalsContact OH-N 3.09Å; D693-L816 HydrophobicContact CB-CD1 4.23Å; L696-L816 HydrophobicContact CD1-CD1 3.51Å; V732-L816 HydrophobicContact CB-CD2 4.43Å; V732-L816 HydrophobicContact CG2-CD2 3.68Å; R735-L816 VanDerWaalsContact CD-CD1 3.5Å; L816-R818 VanDerWaalsContact C-N 3.29Å; L816-R818 PolarHBondContact O-N 3.47Å; L816-I819 WeakPolarHBondContact O-CB 3.47Å; L816-I819 PolarHBondContact O-N 2.89Å; L816-I819 VanDerWaalsContact O-N 3.08Å; L816-E820 WeakPolarHBondContact O-CG 3.07Å; L816-E820 PolarHBondContact O-N 3.19Å
817	D	92.4	Very high	94.1	Very high	85 Å²	85	22.4 Å²	22.4	46%	0.455	12%	0.116	S	C	.	.	H	α-helix	trans	-58.7	-39.8	175.4	55.1	-55.3	0	0	0	112.3	P815	P815-D817 VanDerWaalsContact C-N 3.33Å; P815-D817 WeakPolarHBondContact CB-OD1 3.4Å; P815-D817 PolarHBondContact O-N 3.34Å
818	R	92.8	Very high	94.2	Very high	74 Å²	74	22 Å²	22	28%	0.279	12%	0.115	S	C	.	.	H	α-helix	trans	-73	-33.1	174.1	-75.3	-165.2	179.9	-170.5	4.4	112.4	M814 P815 L816 L821 L822 D868 L871	M814-R818 HydrophobicContact CE-CB 3.62Å; M814-R818 WeakPolarHBondContact CE-O 3.45Å; M814-R818 HydrophobicContact CG-CB 3.72Å; M814-R818 HydrophobicContact SD-CB 3.65Å; P815-R818 WeakPolarHBondContact O-CB 3.26Å; P815-R818 PolarHBondContact O-N 2.93Å; L816-R818 VanDerWaalsContact C-N 3.29Å; L816-R818 PolarHBondContact O-N 3.47Å; R818-L821 PolarHBondContact O-N 3.49Å; R818-L822 PolarHBondContact O-N 2.97Å; R818-L822 VanDerWaalsContact O-N 3.07Å; R818-D868 IonicContact CZ-OD1 3.91Å; R818-D868 VanDerWaalsContact CZ-OD1 3.25Å; R818-D868 IonicContact NH1-OD1 3.73Å; R818-D868 PolarHBondContact NH1-OD1 2.93Å; R818-D868 IonicContact NH2-OD1 3.49Å; R818-D868 PolarHBondContact NH2-OD1 2.99Å; R818-L871 HydrophobicContact CB-CD1 3.81Å; R818-L871 HydrophobicContact CG-CD1 4.02Å
819	I	95.5	Very high	93.9	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67.2	-38.5	176.5	-70.2	-71.4	0	0	0	111.3	V732 F810 M814 P815 L816 L821 L822 W823	V732-I819 HydrophobicContact CG1-CG2 4.23Å; V732-I819 HydrophobicContact CG2-CG2 3.73Å; F810-I819 HydrophobicContact CB-CD1 3.69Å; F810-I819 WeakPolarHBondContact O-CD1 3.25Å; M814-I819 HydrophobicContact CB-CD1 3.98Å; M814-I819 HydrophobicContact CB-CG1 4.08Å; M814-I819 HydrophobicContact CE-CB 4.49Å; M814-I819 HydrophobicContact CE-CD1 3.46Å; M814-I819 VanDerWaalsContact CE-CD1 3.46Å; M814-I819 HydrophobicContact CE-CG1 3.82Å; P815-I819 WeakPolarHBondContact O-CG1 3.23Å; P815-I819 PolarHBondContact O-N 3.16Å; L816-I819 WeakPolarHBondContact O-CB 3.47Å; L816-I819 PolarHBondContact O-N 2.89Å; L816-I819 VanDerWaalsContact O-N 3.08Å; I819-L821 VanDerWaalsContact C-N 3.33Å; I819-L821 PolarHBondContact O-N 3.24Å; I819-L822 HydrophobicContact CD1-CD2 4.34Å; I819-L822 PolarHBondContact O-N 2.87Å; I819-W823 HydrophobicContact CG2-CD2 3.9Å; I819-W823 HydrophobicContact CG2-CG 4.11Å; I819-W823 HydrophobicContact CG2-CZ2 4.09Å; I819-W823 WeakPolarHBondContact O-CB 3.31Å; I819-W823 PolarHBondContact O-N 3.16Å
820	E	95.2	Very high	93.5	Very high	25 Å²	25	22.5 Å²	22.5	12%	0.117	12%	0.12	C	C	.	.	H	α-helix	trans	-55.7	-47	173.1	-69.8	172.3	-141.5	0	0	111.4	R610 W614 R735 I736 L816 L822 W823 D824	R610-E820 IonicContact CZ-OE2 2.69Å; R610-E820 IonicContact NH1-OE2 3.48Å; R610-E820 PolarHBondContact NH1-OE2 2.95Å; W614-E820 HydrophobicContact CH2-CB 4.43Å; W614-E820 HydrophobicContact CH2-CG 4.35Å; W614-E820 WeakPolarHBondContact CZ2-O 3.11Å; R735-E820 IonicContact CZ-OE1 2.69Å; R735-E820 IonicContact NE-OE1 3.63Å; R735-E820 PolarHBondContact NE-OE1 3.29Å; R735-E820 IonicContact NH2-OE1 3.86Å; R735-E820 PolarHBondContact NH2-OE1 3.19Å; R735-E820 VanDerWaalsContact NH2-OE1 3.12Å; I736-E820 HydrophobicContact CG2-CG 4.3Å; L816-E820 WeakPolarHBondContact O-CG 3.07Å; L816-E820 PolarHBondContact O-N 3.19Å; E820-L822 PolarHBondContact O-N 3.4Å; E820-W823 PolarHBondContact O-N 2.82Å; E820-D824 VanDerWaalsContact O-CG 3.28Å; E820-D824 PolarHBondContact O-N 3.31Å
821	L	92.9	Very high	93.1	Very high	49 Å²	49	23.6 Å²	23.6	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-65.2	-39.3	177	-58.4	176.9	0	0	0	113	L566 E570 R818 I819 L871	L566-L821 HydrophobicContact CD2-CD2 3.89Å; E570-L821 VanDerWaalsContact OE1-CD2 3.25Å; E570-L821 WeakPolarHBondContact OE1-CD2 3.26Å; R818-L821 PolarHBondContact O-N 3.49Å; I819-L821 VanDerWaalsContact C-N 3.33Å; I819-L821 PolarHBondContact O-N 3.24Å; L821-L871 HydrophobicContact CB-CD1 4.49Å
822	L	94.6	Very high	92.8	Very high	4 Å²	4	24 Å²	24	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-66	-45.9	178.4	179.3	61.9	0	0	0	111.2	F810 M814 R818 I819 E820 D824 T825 I826 F837	F810-L822 HydrophobicContact CB-CD2 4.02Å; F810-L822 HydrophobicContact CD2-CD2 3.48Å; F810-L822 VanDerWaalsContact CD2-CD2 3.48Å; F810-L822 HydrophobicContact CE2-CD2 4.25Å; F810-L822 HydrophobicContact CG-CD2 4Å; M814-L822 HydrophobicContact CE-CB 4.14Å; M814-L822 HydrophobicContact CE-CD2 3.94Å; R818-L822 PolarHBondContact O-N 2.97Å; R818-L822 VanDerWaalsContact O-N 3.07Å; I819-L822 HydrophobicContact CD1-CD2 4.34Å; I819-L822 PolarHBondContact O-N 2.87Å; E820-L822 PolarHBondContact O-N 3.4Å; L822-D824 VanDerWaalsContact C-N 3.3Å; L822-D824 PolarHBondContact O-N 2.91Å; L822-T825 PolarHBondContact O-N 3.2Å; L822-T825 VanDerWaalsContact O-N 3.1Å; L822-I826 HydrophobicContact CD1-CD1 3.95Å; L822-I826 HydrophobicContact CD1-CG1 4.38Å; L822-I826 HydrophobicContact CD2-CD1 4.12Å; L822-I826 HydrophobicContact CG-CD1 3.69Å; L822-I826 HydrophobicContact CG-CG1 4.37Å; L822-I826 PolarHBondContact O-N 2.96Å; L822-I826 VanDerWaalsContact O-N 3.12Å; L822-F837 HydrophobicContact CD1-CD1 3.29Å; L822-F837 HydrophobicContact CD1-CD2 4.08Å; L822-F837 HydrophobicContact CD1-CE1 3.22Å; L822-F837 HydrophobicContact CD1-CE2 4.02Å; L822-F837 HydrophobicContact CD1-CG 3.73Å; L822-F837 HydrophobicContact CD1-CZ 3.6Å
823	W	97	Very high	92.8	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-71.7	-24.1	-178.3	-75.3	18.6	0	0	0	112.9	W614 V729 V732 F733 F751 L809 A811 I819 E820 T825 I826 I827	W614-W823 HydrophobicContact CE3-CE3 4.41Å; W614-W823 HydrophobicContact CH2-CB 3.63Å; W614-W823 HydrophobicContact CH2-CD2 4.4Å; W614-W823 AromaticContact CH2-CE3 3.84Å; W614-W823 HydrophobicContact CH2-CE3 3.84Å; W614-W823 HydrophobicContact CH2-CG 4.39Å; W614-W823 HydrophobicContact CZ2-CB 3.59Å; W614-W823 HydrophobicContact CZ3-CB 4.42Å; W614-W823 AromaticContact CZ3-CE3 3.62Å; W614-W823 HydrophobicContact CZ3-CE3 3.62Å; W614-W823 HydrophobicContact CZ3-CZ3 4.29Å; V729-W823 HydrophobicContact CG1-CH2 3.85Å; V729-W823 HydrophobicContact CG1-CZ2 4.48Å; V732-W823 HydrophobicContact CB-CE3 4.35Å; V732-W823 HydrophobicContact CB-CH2 3.81Å; V732-W823 HydrophobicContact CB-CZ3 3.6Å; V732-W823 HydrophobicContact CG1-CE3 3.79Å; V732-W823 HydrophobicContact CG1-CH2 4.16Å; V732-W823 HydrophobicContact CG1-CZ3 3.53Å; V732-W823 HydrophobicContact CG2-CH2 3.62Å; V732-W823 HydrophobicContact CG2-CZ2 4.14Å; V732-W823 HydrophobicContact CG2-CZ3 3.89Å; F733-W823 HydrophobicContact CD2-CZ3 4.42Å; F733-W823 HydrophobicContact CE1-CZ3 4.43Å; F733-W823 HydrophobicContact CE2-CH2 4.32Å; F733-W823 AromaticContact CE2-CZ3 3.79Å; F733-W823 HydrophobicContact CE2-CZ3 3.79Å; F733-W823 HydrophobicContact CZ-CE3 4.42Å; F733-W823 AromaticContact CZ-CZ3 3.8Å; F733-W823 HydrophobicContact CZ-CZ3 3.8Å; F751-W823 AromaticContact CE1-CH2 3.81Å; F751-W823 HydrophobicContact CE1-CH2 3.81Å; F751-W823 AromaticContact CE1-CZ2 3.86Å; F751-W823 HydrophobicContact CE1-CZ2 3.86Å; F751-W823 HydrophobicContact CE1-CZ3 4.28Å; F751-W823 HydrophobicContact CE2-CD2 4.12Å; F751-W823 HydrophobicContact CE2-CE3 4Å; F751-W823 HydrophobicContact CE2-CH2 4.43Å; F751-W823 HydrophobicContact CE2-CZ3 4.17Å; F751-W823 AromaticContact CZ-CD2 3.89Å; F751-W823 HydrophobicContact CZ-CD2 3.89Å; F751-W823 AromaticContact CZ-CE2 3.66Å; F751-W823 AromaticContact CZ-CE3 4Å; F751-W823 HydrophobicContact CZ-CE3 4Å; F751-W823 AromaticContact CZ-CH2 3.74Å; F751-W823 HydrophobicContact CZ-CH2 3.74Å; F751-W823 AromaticContact CZ-CZ2 3.59Å; F751-W823 HydrophobicContact CZ-CZ2 3.59Å; F751-W823 AromaticContact CZ-CZ3 3.93Å; F751-W823 HydrophobicContact CZ-CZ3 3.93Å; L809-W823 HydrophobicContact CB-CZ2 4.35Å; L809-W823 PolarHBondContact O-NE1 3.21Å; A811-W823 HydrophobicContact CB-CZ2 4.05Å; I819-W823 HydrophobicContact CG2-CD2 3.9Å; I819-W823 HydrophobicContact CG2-CG 4.11Å; I819-W823 HydrophobicContact CG2-CZ2 4.09Å; I819-W823 WeakPolarHBondContact O-CB 3.31Å; I819-W823 PolarHBondContact O-N 3.16Å; E820-W823 PolarHBondContact O-N 2.82Å; W823-T825 PolarHBondContact O-N 3.07Å; W823-T825 VanDerWaalsContact O-N 3.09Å; W823-I826 PolarHBondContact O-N 2.82Å; W823-I827 HydrophobicContact CB-CD1 3.99Å; W823-I827 HydrophobicContact CB-CG1 4.27Å; W823-I827 HydrophobicContact CE3-CD1 4.22Å; W823-I827 WeakPolarHBondContact O-CB 2.73Å; W823-I827 WeakPolarHBondContact O-CG1 2.92Å; W823-I827 PolarHBondContact O-N 3.12Å
824	D	95.3	Very high	92.9	Very high	9 Å²	9	18.2 Å²	18.2	5%	0.048	10%	0.1	C	C	.	.	H	α-helix	trans	-56.3	-23.9	168.3	-77.2	-17.7	0	0	0	112.5	I605 R610 W614 E820 L822 P828	I605-D824 HydrophobicContact CB-CB 4.38Å; I605-D824 HydrophobicContact CD1-CB 4.17Å; I605-D824 HydrophobicContact CG1-CB 4.44Å; R610-D824 IonicContact CZ-OD2 3.67Å; R610-D824 IonicContact NE-OD1 2.78Å; R610-D824 PolarHBondContact NE-OD1 2.84Å; R610-D824 IonicContact NE-OD2 3.75Å; R610-D824 PolarHBondContact NE-OD2 2.94Å; R610-D824 IonicContact NH2-OD2 2.84Å; R610-D824 PolarHBondContact NH2-OD2 2.87Å; W614-D824 WeakPolarHBondContact CZ2-OD1 3.39Å; W614-D824 PolarHBondContact NE1-OD1 3.49Å; E820-D824 VanDerWaalsContact O-CG 3.28Å; E820-D824 PolarHBondContact O-N 3.31Å; L822-D824 VanDerWaalsContact C-N 3.3Å; L822-D824 PolarHBondContact O-N 2.91Å; D824-P828 VanDerWaalsContact O-CD 3.26Å; D824-P828 WeakPolarHBondContact O-CD 3.35Å; D824-P828 WeakPolarHBondContact O-CG 3.48Å
825	T	93.4	Very high	93	Very high	8 Å²	8	18 Å²	18	5%	0.049	10%	0.099	C	C	.	.	H	α-helix	trans	-99.5	-38.4	173.1	-55.1	0	0	0	0	113.1	L822 W823 P828 G829 L833 F837 R875 W937	L822-T825 PolarHBondContact O-N 3.2Å; L822-T825 VanDerWaalsContact O-N 3.1Å; W823-T825 PolarHBondContact O-N 3.07Å; W823-T825 VanDerWaalsContact O-N 3.09Å; T825-P828 WeakPolarHBondContact O-CD 3.14Å; T825-G829 PolarHBondContact O-N 3.29Å; T825-L833 HydrophobicContact CG2-CD2 4Å; T825-F837 HydrophobicContact CG2-CE2 4.1Å; T825-F837 HydrophobicContact CG2-CZ 4.09Å; T825-R875 HydrophobicContact CG2-CG 4.25Å; T825-R875 WeakPolarHBondContact OG1-CD 3.25Å; T825-R875 PolarHBondContact OG1-NE 3.39Å; T825-W937 HydrophobicContact CG2-CH2 4.05Å; T825-W937 HydrophobicContact CG2-CZ3 4.17Å
826	I	94.6	Very high	93.1	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.081	C	C	.	.	H	α-helix	trans	-70.1	-40.8	-177.3	-65	179.4	0	0	0	112.2	L809 L822 W823 G829 F837	L809-I826 HydrophobicContact CD1-CG2 4.1Å; L822-I826 HydrophobicContact CD1-CD1 3.95Å; L822-I826 HydrophobicContact CD1-CG1 4.38Å; L822-I826 HydrophobicContact CD2-CD1 4.12Å; L822-I826 HydrophobicContact CG-CD1 3.69Å; L822-I826 HydrophobicContact CG-CG1 4.37Å; L822-I826 PolarHBondContact O-N 2.96Å; L822-I826 VanDerWaalsContact O-N 3.12Å; W823-I826 PolarHBondContact O-N 2.82Å; I826-G829 PolarHBondContact O-N 3.43Å; I826-F837 HydrophobicContact CD1-CD2 4.38Å; I826-F837 HydrophobicContact CG1-CD2 4.17Å; I826-F837 HydrophobicContact CG1-CE2 4.08Å
827	I	95.3	Very high	93.1	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.021	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-48.8	-177.8	-69.3	172.9	0	0	0	112.5	W614 L617 L618 F751 K755 W823 G829	W614-I827 HydrophobicContact CB-CD1 4.14Å; W614-I827 HydrophobicContact CD2-CD1 3.33Å; W614-I827 HydrophobicContact CE3-CD1 3.62Å; W614-I827 HydrophobicContact CG-CD1 3.57Å; W614-I827 HydrophobicContact CH2-CD1 4.44Å; W614-I827 HydrophobicContact CZ2-CD1 4.21Å; W614-I827 HydrophobicContact CZ3-CD1 4.17Å; L617-I827 HydrophobicContact CB-CG2 3.78Å; L617-I827 HydrophobicContact CD1-CG2 3.97Å; L618-I827 HydrophobicContact CD2-CG2 4.39Å; L618-I827 HydrophobicContact CG-CG2 4.27Å; F751-I827 HydrophobicContact CD2-CD1 4.44Å; F751-I827 HydrophobicContact CD2-CG1 4.19Å; F751-I827 HydrophobicContact CE2-CD1 4.21Å; F751-I827 HydrophobicContact CE2-CG1 3.8Å; K755-I827 WeakPolarHBondContact CE-O 3.04Å; K755-I827 PolarHBondContact NZ-O 2.74Å; W823-I827 HydrophobicContact CB-CD1 3.99Å; W823-I827 HydrophobicContact CB-CG1 4.27Å; W823-I827 HydrophobicContact CE3-CD1 4.22Å; W823-I827 WeakPolarHBondContact O-CB 2.73Å; W823-I827 WeakPolarHBondContact O-CG1 2.92Å; W823-I827 PolarHBondContact O-N 3.12Å; I827-G829 VanDerWaalsContact C-N 3.25Å; I827-G829 PolarHBondContact O-N 2.76Å
828	P	92.7	Very high	93.2	Very high	10 Å²	10	11.5 Å²	11.5	7%	0.065	6%	0.061	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.1	175.8	25.1	-32.7	0	0	0	113.8	A601 R602 L617 D824 T825 W937	A601-P828 HydrophobicContact CB-CB 4.16Å; A601-P828 HydrophobicContact CB-CG 4.48Å; R602-P828 HydrophobicContact CG-CB 4.44Å; L617-P828 HydrophobicContact CD1-CB 4.1Å; D824-P828 VanDerWaalsContact O-CD 3.26Å; D824-P828 WeakPolarHBondContact O-CD 3.35Å; D824-P828 WeakPolarHBondContact O-CG 3.48Å; T825-P828 WeakPolarHBondContact O-CD 3.14Å; P828-W937 HydrophobicContact CB-CH2 4.5Å; P828-W937 HydrophobicContact CB-CZ2 4.38Å; P828-W937 HydrophobicContact CG-CH2 4.13Å; P828-W937 HydrophobicContact CG-CZ2 4.46Å
829	G	90.4	Very high	93.3	Very high	2 Å²	2	8 Å²	8	2%	0.021	5%	0.048	C	C	.	.	S	Bend	trans	-91.8	174.5	-175.2	0	0	0	0	0	115.9	K755 T825 I826 I827 W937	K755-G829 PolarHBondContact NZ-O 2.88Å; T825-G829 PolarHBondContact O-N 3.29Å; I826-G829 PolarHBondContact O-N 3.43Å; I827-G829 VanDerWaalsContact C-N 3.25Å; I827-G829 PolarHBondContact O-N 2.76Å; G829-W937 VanDerWaalsContact CA-CZ2 3.4Å
830	P	87.6	Confident	93.3	Very high	13 Å²	13	8 Å²	8	8%	0.084	5%	0.048	C	C	.	.			trans	-65.1	153.6	175.1	27.8	-33.6	0	0	0	111	S832 L833 L941 E942	P830-S832 PolarHBondContact O-N 3.42Å; P830-S832 VanDerWaalsContact O-N 3.16Å; P830-L833 HydrophobicContact CG-CB 4.21Å; P830-L833 WeakPolarHBondContact O-CB 3.48Å; P830-L833 PolarHBondContact O-N 2.9Å; P830-L941 HydrophobicContact CB-CB 4.27Å; P830-L941 WeakPolarHBondContact CB-O 3.49Å; P830-L941 HydrophobicContact CG-CB 3.89Å; P830-E942 HydrophobicContact CB-CG 4.27Å; P830-E942 HydrophobicContact CG-CG 4.32Å
831	A	86.3	Confident	93.2	Very high	25 Å²	25	6.9 Å²	6.9	21%	0.207	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.7	179.4	0	0	0	0	0	112.6	L833 S834 W892	A831-L833 PolarHBondContact O-N 3.02Å; A831-S834 PolarHBondContact O-OG 3.32Å; A831-W892 HydrophobicContact CB-CH2 4.07Å; A831-W892 HydrophobicContact CB-CZ2 4.41Å
832	S	89	Confident	93.2	Very high	8 Å²	8	4.5 Å²	4.5	6%	0.056	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-16.1	176.7	59.1	0	0	0	0	114	P830 S834 M835	P830-S832 PolarHBondContact O-N 3.42Å; P830-S832 VanDerWaalsContact O-N 3.16Å; S832-S834 PolarHBondContact O-N 3.11Å; S832-S834 VanDerWaalsContact O-N 3.14Å; S832-M835 WeakPolarHBondContact O-CB 3.32Å; S832-M835 PolarHBondContact O-N 2.9Å
833	L	92.5	Very high	93	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.5	-31.9	-178.3	-170.8	55.1	0	0	0	112.4	T825 P830 A831 M835 F836 F837 L879 A882 W937 P938	T825-L833 HydrophobicContact CG2-CD2 4Å; P830-L833 HydrophobicContact CG-CB 4.21Å; P830-L833 WeakPolarHBondContact O-CB 3.48Å; P830-L833 PolarHBondContact O-N 2.9Å; A831-L833 PolarHBondContact O-N 3.02Å; L833-M835 PolarHBondContact O-N 3.47Å; L833-F836 HydrophobicContact CD1-CD2 4.33Å; L833-F836 PolarHBondContact O-N 2.85Å; L833-F836 VanDerWaalsContact O-N 3.11Å; L833-F837 HydrophobicContact CG-CD2 4.4Å; L833-F837 HydrophobicContact CG-CE2 4.23Å; L833-F837 PolarHBondContact O-N 2.89Å; L833-L879 HydrophobicContact CD1-CD2 4.36Å; L833-A882 HydrophobicContact CD1-CB 4.15Å; L833-W937 HydrophobicContact CD2-CH2 4.44Å; L833-P938 HydrophobicContact CD1-CG 4.48Å
834	S	93.1	Very high	92.7	Very high	4 Å²	4	6.8 Å²	6.8	3%	0.028	4%	0.041	C	C	.	.	H	α-helix	trans	-56.5	-34.1	175.8	60.3	0	0	0	0	113.8	Y772 A831 S832 F836 F837 Y838	Y772-S834 PolarHBondContact OH-OG 3.4Å; A831-S834 PolarHBondContact O-OG 3.32Å; S832-S834 PolarHBondContact O-N 3.11Å; S832-S834 VanDerWaalsContact O-N 3.14Å; S834-F836 VanDerWaalsContact C-N 3.3Å; S834-F836 PolarHBondContact O-N 2.82Å; S834-F837 PolarHBondContact O-N 2.98Å; S834-Y838 PolarHBondContact O-N 3.06Å; S834-Y838 VanDerWaalsContact O-N 3.12Å
835	M	94	Very high	92.4	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-64.8	-35.8	178	-65.6	-179.1	165.9	0	0	111.6	Y772 T775 L776 L779 S832 L833 Y838 I839 W892	Y772-M835 HydrophobicContact CD1-CE 4.03Å; Y772-M835 HydrophobicContact CD2-CE 3.35Å; Y772-M835 HydrophobicContact CE1-CE 4.02Å; Y772-M835 HydrophobicContact CE1-CG 3.95Å; Y772-M835 HydrophobicContact CE2-CE 3.36Å; Y772-M835 HydrophobicContact CE2-CG 3.85Å; Y772-M835 HydrophobicContact CE2-SD 4.47Å; Y772-M835 HydrophobicContact CG-CE 3.72Å; Y772-M835 VanDerWaalsContact CZ-CG 3.41Å; Y772-M835 VanDerWaalsContact OH-CG 3.22Å; Y772-M835 WeakPolarHBondContact OH-CG 3.38Å; Y772-M835 PolarHBondContact OH-N 3.06Å; T775-M835 HydrophobicContact CG2-CE 4.01Å; T775-M835 HydrophobicContact CG2-SD 4.07Å; L776-M835 HydrophobicContact CD1-CB 3.79Å; L776-M835 HydrophobicContact CD1-CG 4.09Å; L779-M835 HydrophobicContact CD1-CB 4.03Å; L779-M835 HydrophobicContact CD1-CG 4.43Å; L779-M835 HydrophobicContact CD1-SD 3.56Å; L779-M835 VanDerWaalsContact CD1-SD 3.56Å; S832-M835 WeakPolarHBondContact O-CB 3.32Å; S832-M835 PolarHBondContact O-N 2.9Å; L833-M835 PolarHBondContact O-N 3.47Å; M835-Y838 WeakPolarHBondContact O-CB 3.42Å; M835-Y838 PolarHBondContact O-N 3.29Å; M835-I839 WeakPolarHBondContact O-CG1 3.49Å; M835-I839 PolarHBondContact O-N 3.22Å; M835-W892 HydrophobicContact CE-CD2 3.73Å; M835-W892 HydrophobicContact CE-CE3 3.15Å; M835-W892 HydrophobicContact CE-CG 4.33Å; M835-W892 HydrophobicContact CE-CH2 4.36Å; M835-W892 HydrophobicContact CE-CZ3 3.52Å; M835-W892 HydrophobicContact SD-CE3 3.96Å; M835-W892 HydrophobicContact SD-CZ3 3.93Å
836	F	95.6	Very high	92.2	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-76.9	-29.6	-179.9	-57.1	-72.5	0	0	0	112.4	L779 H783 L833 S834 Y838 I839 A840 A878 L881 A882 T885 T890 L941	L779-F836 HydrophobicContact CD2-CE1 4.45Å; H783-F836 AromaticContact NE2-CE1 3.95Å; L833-F836 HydrophobicContact CD1-CD2 4.33Å; L833-F836 PolarHBondContact O-N 2.85Å; L833-F836 VanDerWaalsContact O-N 3.11Å; S834-F836 VanDerWaalsContact C-N 3.3Å; S834-F836 PolarHBondContact O-N 2.82Å; F836-Y838 VanDerWaalsContact C-N 3.34Å; F836-I839 HydrophobicContact CD1-CD1 4.36Å; F836-I839 PolarHBondContact O-N 3.43Å; F836-A840 VanDerWaalsContact O-CB 3.26Å; F836-A840 WeakPolarHBondContact O-CB 3.3Å; F836-A840 PolarHBondContact O-N 2.77Å; F836-A878 HydrophobicContact CB-CB 3.89Å; F836-A878 WeakPolarHBondContact CB-O 3.5Å; F836-L881 HydrophobicContact CB-CB 4.41Å; F836-L881 HydrophobicContact CD1-CB 3.73Å; F836-L881 HydrophobicContact CE1-CB 4.49Å; F836-L881 HydrophobicContact CG-CB 4.4Å; F836-A882 HydrophobicContact CD1-CB 4.4Å; F836-A882 HydrophobicContact CD2-CB 3.58Å; F836-A882 HydrophobicContact CE2-CB 3.71Å; F836-A882 HydrophobicContact CG-CB 3.93Å; F836-A882 HydrophobicContact CZ-CB 4.18Å; F836-T885 HydrophobicContact CE1-CG2 4Å; F836-T885 WeakPolarHBondContact CE1-OG1 3.48Å; F836-T885 HydrophobicContact CZ-CG2 3.85Å; F836-T890 HydrophobicContact CE2-CG2 4.06Å; F836-T890 HydrophobicContact CZ-CG2 3.63Å; F836-L941 HydrophobicContact CE2-CD1 3.76Å; F836-L941 HydrophobicContact CZ-CD1 4.15Å
837	F	95.1	Very high	91.7	Very high	3 Å²	3	13.9 Å²	13.9	1%	0.013	7%	0.069	C	C	.	.	H	α-helix	trans	-62.5	-44	167.2	-86.6	-81	0	0	0	111.2	F810 L822 T825 I826 L833 S834 I839 A840 F841 C874 R875 A878	F810-F837 HydrophobicContact CE2-CB 4.34Å; L822-F837 HydrophobicContact CD1-CD1 3.29Å; L822-F837 HydrophobicContact CD1-CD2 4.08Å; L822-F837 HydrophobicContact CD1-CE1 3.22Å; L822-F837 HydrophobicContact CD1-CE2 4.02Å; L822-F837 HydrophobicContact CD1-CG 3.73Å; L822-F837 HydrophobicContact CD1-CZ 3.6Å; T825-F837 HydrophobicContact CG2-CE2 4.1Å; T825-F837 HydrophobicContact CG2-CZ 4.09Å; I826-F837 HydrophobicContact CD1-CD2 4.38Å; I826-F837 HydrophobicContact CG1-CD2 4.17Å; I826-F837 HydrophobicContact CG1-CE2 4.08Å; L833-F837 HydrophobicContact CG-CD2 4.4Å; L833-F837 HydrophobicContact CG-CE2 4.23Å; L833-F837 PolarHBondContact O-N 2.89Å; S834-F837 PolarHBondContact O-N 2.98Å; F837-I839 PolarHBondContact O-N 2.76Å; F837-A840 PolarHBondContact O-N 3.16Å; F837-F841 HydrophobicContact CB-CZ 4.48Å; F837-F841 HydrophobicContact CD1-CE1 4.16Å; F837-F841 HydrophobicContact CD1-CZ 4.24Å; F837-F841 VanDerWaalsContact O-CD1 3.25Å; F837-F841 WeakPolarHBondContact O-CD1 3.45Å; F837-F841 WeakPolarHBondContact O-CG 3.36Å; F837-F841 PolarHBondContact O-N 3.07Å; F837-C874 HydrophobicContact CD1-CB 4.47Å; F837-R875 HydrophobicContact CE1-CB 4.08Å; F837-R875 HydrophobicContact CZ-CB 4.07Å; F837-R875 HydrophobicContact CZ-CG 4.3Å; F837-A878 HydrophobicContact CD1-CB 4.29Å; F837-A878 HydrophobicContact CD2-CB 4.01Å; F837-A878 HydrophobicContact CE1-CB 4.46Å; F837-A878 HydrophobicContact CE2-CB 4.19Å; F837-A878 HydrophobicContact CG-CB 4.08Å; F837-A878 HydrophobicContact CZ-CB 4.42Å
838	Y	95	Very high	91.3	Very high	3 Å²	3	18.8 Å²	18.8	1%	0.012	9%	0.091	C	C	.	.	H	α-helix	trans	-56.7	-49.3	174.1	-173.2	-81.7	0	0	0	111.6	L776 T802 W805 I806 S834 M835 F836 A840 F841 F842	L776-Y838 HydrophobicContact CD1-CD1 3.8Å; L776-Y838 HydrophobicContact CD1-CE1 4.48Å; L776-Y838 HydrophobicContact CD1-CG 4.11Å; L776-Y838 HydrophobicContact CD2-CD1 3.54Å; L776-Y838 HydrophobicContact CD2-CD2 4.08Å; L776-Y838 HydrophobicContact CD2-CE1 3.5Å; L776-Y838 HydrophobicContact CD2-CE2 4.06Å; L776-Y838 HydrophobicContact CD2-CG 3.83Å; L776-Y838 HydrophobicContact CG-CD1 3.91Å; L776-Y838 HydrophobicContact CG-CE1 4.08Å; L776-Y838 HydrophobicContact CG-CG 4.45Å; T802-Y838 HydrophobicContact CG2-CE2 4.24Å; T802-Y838 WeakPolarHBondContact OG1-CE2 3.4Å; T802-Y838 PolarHBondContact OG1-OH 3.07Å; W805-Y838 HydrophobicContact CE3-CD2 4.26Å; W805-Y838 AromaticContact CE3-CE2 3.97Å; W805-Y838 HydrophobicContact CE3-CE2 3.97Å; I806-Y838 HydrophobicContact CD1-CD2 4.33Å; I806-Y838 HydrophobicContact CD1-CE2 4.06Å; I806-Y838 HydrophobicContact CG1-CD2 4.14Å; I806-Y838 HydrophobicContact CG1-CE2 4.25Å; S834-Y838 PolarHBondContact O-N 3.06Å; S834-Y838 VanDerWaalsContact O-N 3.12Å; M835-Y838 WeakPolarHBondContact O-CB 3.42Å; M835-Y838 PolarHBondContact O-N 3.29Å; F836-Y838 VanDerWaalsContact C-N 3.34Å; Y838-A840 PolarHBondContact O-N 3.12Å; Y838-F841 WeakPolarHBondContact O-CB 3.25Å; Y838-F841 PolarHBondContact O-N 3.08Å; Y838-F842 AromaticContact CD1-CD2 3.69Å; Y838-F842 HydrophobicContact CD1-CD2 3.69Å; Y838-F842 AromaticContact CD1-CE2 3.85Å; Y838-F842 HydrophobicContact CD1-CE2 3.85Å; Y838-F842 AromaticContact CE1-CD2 3.42Å; Y838-F842 HydrophobicContact CE1-CD2 3.42Å; Y838-F842 VanDerWaalsContact CE1-CD2 3.42Å; Y838-F842 AromaticContact CE1-CE2 3.16Å; Y838-F842 HydrophobicContact CE1-CE2 3.16Å; Y838-F842 HydrophobicContact CE1-CZ 4.06Å; Y838-F842 AromaticContact CE2-CE2 3.92Å; Y838-F842 HydrophobicContact CE2-CE2 3.92Å; Y838-F842 HydrophobicContact CG-CD2 4.44Å; Y838-F842 HydrophobicContact CG-CE2 4.48Å; Y838-F842 AromaticContact CZ-CD2 3.96Å; Y838-F842 AromaticContact CZ-CE2 3.22Å; Y838-F842 AromaticContact CZ-CZ 3.96Å; Y838-F842 WeakPolarHBondContact O-CD2 3.3Å; Y838-F842 PolarHBondContact O-N 3.35Å; Y838-F842 VanDerWaalsContact O-N 3.11Å; Y838-F842 WeakPolarHBondContact OH-CE2 3.31Å
839	I	95.2	Very high	90.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.6	-42.9	178.2	-64	165.1	0	0	0	111.2	L776 L779 L780 H783 V784 M835 F836 F837 F841 F842 I843 L881	L776-I839 HydrophobicContact CD1-CG1 4.32Å; L779-I839 HydrophobicContact CB-CD1 3.65Å; L780-I839 HydrophobicContact CD1-CG1 4.21Å; L780-I839 HydrophobicContact CD1-CG2 4.05Å; H783-I839 HydrophobicContact CB-CG2 4.49Å; V784-I839 HydrophobicContact CG2-CG2 4.35Å; M835-I839 WeakPolarHBondContact O-CG1 3.49Å; M835-I839 PolarHBondContact O-N 3.22Å; F836-I839 HydrophobicContact CD1-CD1 4.36Å; F836-I839 PolarHBondContact O-N 3.43Å; F837-I839 PolarHBondContact O-N 2.76Å; I839-F841 VanDerWaalsContact C-N 3.26Å; I839-F841 PolarHBondContact O-N 3.44Å; I839-F842 PolarHBondContact O-N 2.85Å; I839-I843 HydrophobicContact CG2-CD1 3.93Å; I839-I843 HydrophobicContact CG2-CG1 4.41Å; I839-I843 WeakPolarHBondContact O-CG1 3.47Å; I839-I843 PolarHBondContact O-N 2.93Å; I839-L881 HydrophobicContact CB-CD1 4.18Å; I839-L881 HydrophobicContact CG2-CD1 3.74Å
840	A	94.6	Very high	90.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-35.4	177.4	0	0	0	0	0	112.3	F836 F837 Y838 I843 Q844 C874 D877 A878	F836-A840 VanDerWaalsContact O-CB 3.26Å; F836-A840 WeakPolarHBondContact O-CB 3.3Å; F836-A840 PolarHBondContact O-N 2.77Å; F837-A840 PolarHBondContact O-N 3.16Å; Y838-A840 PolarHBondContact O-N 3.12Å; A840-I843 PolarHBondContact O-N 3.2Å; A840-Q844 PolarHBondContact O-N 2.93Å; A840-C874 HydrophobicContact CB-CB 4.1Å; A840-D877 HydrophobicContact CB-CB 4.02Å; A840-A878 HydrophobicContact CB-CB 4.38Å
841	F	93.4	Very high	90.1	Very high	1 Å²	1	23.8 Å²	23.8	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-65	-45.3	174	-63.9	-11.5	0	0	0	111.4	F810 F837 Y838 I839 I843 Q844 L845 F866 I869 L871 C874	F810-F841 HydrophobicContact CD1-CD2 4.23Å; F810-F841 AromaticContact CD1-CE2 3.66Å; F810-F841 HydrophobicContact CD1-CE2 3.66Å; F810-F841 HydrophobicContact CD2-CE2 4.37Å; F810-F841 AromaticContact CE1-CD2 3.54Å; F810-F841 HydrophobicContact CE1-CD2 3.54Å; F810-F841 AromaticContact CE1-CE2 3.3Å; F810-F841 HydrophobicContact CE1-CE2 3.3Å; F810-F841 HydrophobicContact CE2-CE2 4.08Å; F810-F841 HydrophobicContact CG-CE2 4.18Å; F810-F841 AromaticContact CZ-CD2 3.88Å; F810-F841 HydrophobicContact CZ-CD2 3.88Å; F810-F841 AromaticContact CZ-CE2 3.53Å; F810-F841 HydrophobicContact CZ-CE2 3.53Å; F837-F841 HydrophobicContact CB-CZ 4.48Å; F837-F841 HydrophobicContact CD1-CE1 4.16Å; F837-F841 HydrophobicContact CD1-CZ 4.24Å; F837-F841 VanDerWaalsContact O-CD1 3.25Å; F837-F841 WeakPolarHBondContact O-CD1 3.45Å; F837-F841 WeakPolarHBondContact O-CG 3.36Å; F837-F841 PolarHBondContact O-N 3.07Å; Y838-F841 WeakPolarHBondContact O-CB 3.25Å; Y838-F841 PolarHBondContact O-N 3.08Å; I839-F841 VanDerWaalsContact C-N 3.26Å; I839-F841 PolarHBondContact O-N 3.44Å; F841-I843 PolarHBondContact O-N 3.24Å; F841-Q844 PolarHBondContact O-N 3.33Å; F841-L845 WeakPolarHBondContact O-CB 3.48Å; F841-L845 WeakPolarHBondContact O-CG 3.33Å; F841-L845 PolarHBondContact O-N 3.47Å; F841-F866 HydrophobicContact CD2-CE2 4.47Å; F841-F866 HydrophobicContact CD2-CZ 4.29Å; F841-F866 HydrophobicContact CE2-CE2 4.43Å; F841-F866 AromaticContact CE2-CZ 3.99Å; F841-F866 HydrophobicContact CE2-CZ 3.99Å; F841-I869 HydrophobicContact CB-CD1 3.81Å; F841-I869 HydrophobicContact CD1-CD1 3.65Å; F841-I869 HydrophobicContact CD1-CG2 3.6Å; F841-I869 HydrophobicContact CD2-CD1 3.77Å; F841-I869 HydrophobicContact CE1-CD1 4.08Å; F841-I869 HydrophobicContact CE1-CG2 3.63Å; F841-I869 HydrophobicContact CE2-CD1 4.18Å; F841-I869 HydrophobicContact CG-CD1 3.48Å; F841-I869 VanDerWaalsContact CG-CD1 3.48Å; F841-I869 HydrophobicContact CG-CG2 4.47Å; F841-I869 HydrophobicContact CZ-CD1 4.33Å; F841-L871 HydrophobicContact CE1-CD2 4.22Å; F841-L871 HydrophobicContact CZ-CD2 4.16Å; F841-C874 HydrophobicContact CD1-CB 3.83Å; F841-C874 VanDerWaalsContact CD1-SG 3.51Å; F841-C874 HydrophobicContact CE1-CB 3.59Å
842	F	92	Very high	89.5	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.8	-39.3	175.3	-89	-90.2	0	0	0	112.8	L780 L787 L791 L798 W805 Y838 I839 L845 D846 L851 L863	L780-F842 HydrophobicContact CD1-CB 4.49Å; L787-F842 HydrophobicContact CD2-CB 3.98Å; L787-F842 HydrophobicContact CD2-CD1 4.27Å; L791-F842 HydrophobicContact CD1-CD1 4.12Å; L791-F842 HydrophobicContact CD1-CE1 3.97Å; L798-F842 HydrophobicContact CD2-CE1 4.13Å; L798-F842 HydrophobicContact CD2-CZ 3.79Å; W805-F842 HydrophobicContact CZ3-CE2 4.14Å; Y838-F842 AromaticContact CD1-CD2 3.69Å; Y838-F842 HydrophobicContact CD1-CD2 3.69Å; Y838-F842 AromaticContact CD1-CE2 3.85Å; Y838-F842 HydrophobicContact CD1-CE2 3.85Å; Y838-F842 AromaticContact CE1-CD2 3.42Å; Y838-F842 HydrophobicContact CE1-CD2 3.42Å; Y838-F842 VanDerWaalsContact CE1-CD2 3.42Å; Y838-F842 AromaticContact CE1-CE2 3.16Å; Y838-F842 HydrophobicContact CE1-CE2 3.16Å; Y838-F842 HydrophobicContact CE1-CZ 4.06Å; Y838-F842 AromaticContact CE2-CE2 3.92Å; Y838-F842 HydrophobicContact CE2-CE2 3.92Å; Y838-F842 HydrophobicContact CG-CD2 4.44Å; Y838-F842 HydrophobicContact CG-CE2 4.48Å; Y838-F842 AromaticContact CZ-CD2 3.96Å; Y838-F842 AromaticContact CZ-CE2 3.22Å; Y838-F842 AromaticContact CZ-CZ 3.96Å; Y838-F842 WeakPolarHBondContact O-CD2 3.3Å; Y838-F842 PolarHBondContact O-N 3.35Å; Y838-F842 VanDerWaalsContact O-N 3.11Å; Y838-F842 WeakPolarHBondContact OH-CE2 3.31Å; I839-F842 PolarHBondContact O-N 2.85Å; F842-L845 PolarHBondContact O-N 3.36Å; F842-D846 VanDerWaalsContact O-CB 3.25Å; F842-D846 WeakPolarHBondContact O-CB 3.34Å; F842-D846 PolarHBondContact O-N 3.07Å; F842-L851 HydrophobicContact CD1-CD1 4.22Å; F842-L863 HydrophobicContact CE1-CD1 4.21Å; F842-L863 HydrophobicContact CE1-CD2 3.97Å; F842-L863 HydrophobicContact CZ-CD1 4.16Å; F842-L863 HydrophobicContact CZ-CD2 3.84Å
843	I	90.4	Very high	89.1	Confident	22 Å²	22	30.8 Å²	30.8	11%	0.113	15%	0.147	C	C	.	.	H	α-helix	trans	-62.2	-44	174.4	-69.7	168	0	0	0	111	V784 I839 A840 F841 R847 L881	V784-I843 HydrophobicContact CG2-CD1 3.77Å; V784-I843 HydrophobicContact CG2-CG1 3.64Å; I839-I843 HydrophobicContact CG2-CD1 3.93Å; I839-I843 HydrophobicContact CG2-CG1 4.41Å; I839-I843 WeakPolarHBondContact O-CG1 3.47Å; I839-I843 PolarHBondContact O-N 2.93Å; A840-I843 PolarHBondContact O-N 3.2Å; F841-I843 PolarHBondContact O-N 3.24Å; I843-R847 WeakPolarHBondContact O-CG 3.32Å; I843-R847 PolarHBondContact O-N 2.86Å; I843-R847 VanDerWaalsContact O-N 3.1Å; I843-L881 HydrophobicContact CD1-CD1 4Å; I843-L881 HydrophobicContact CD1-CD2 4.46Å
844	Q	91.4	Very high	88.8	Confident	29 Å²	29	32 Å²	32	14%	0.136	15%	0.153	C	C	.	.	H	α-helix	trans	-67.7	-43.1	179.6	-173.3	168.6	32.1	0	0	111.7	A840 F841 R847 Q848 N870 C874	A840-Q844 PolarHBondContact O-N 2.93Å; F841-Q844 PolarHBondContact O-N 3.33Å; Q844-R847 PolarHBondContact O-N 2.82Å; Q844-Q848 WeakPolarHBondContact O-CG 3.25Å; Q844-Q848 PolarHBondContact O-N 3.27Å; Q844-Q848 VanDerWaalsContact O-N 3.08Å; Q844-N870 VanDerWaalsContact NE2-CB 3.27Å; Q844-C874 PolarHBondContact OE1-SG 3.26Å
845	L	89	Confident	88.5	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-47.6	175.2	-81.4	173.9	0	0	0	112.3	F841 F842 R847 Q848 I849 L851 L863 P867	F841-L845 WeakPolarHBondContact O-CB 3.48Å; F841-L845 WeakPolarHBondContact O-CG 3.33Å; F841-L845 PolarHBondContact O-N 3.47Å; F842-L845 PolarHBondContact O-N 3.36Å; L845-R847 VanDerWaalsContact C-N 3.28Å; L845-R847 PolarHBondContact O-N 3.38Å; L845-Q848 PolarHBondContact O-N 2.99Å; L845-Q848 VanDerWaalsContact O-N 3.12Å; L845-I849 HydrophobicContact CD2-CD1 4.43Å; L845-I849 PolarHBondContact O-N 3.43Å; L845-L851 HydrophobicContact CB-CD1 4.19Å; L845-L863 HydrophobicContact CD1-CD2 4.07Å; L845-P867 HydrophobicContact CD1-CG 3.9Å; L845-P867 HydrophobicContact CD2-CB 3.36Å; L845-P867 HydrophobicContact CD2-CG 3.39Å; L845-P867 HydrophobicContact CG-CB 4.38Å; L845-P867 HydrophobicContact CG-CG 3.89Å
846	D	88.2	Confident	88.3	Confident	29 Å²	29	37.1 Å²	37.1	16%	0.155	19%	0.189	C	C	.	.	H	α-helix	trans	-62.7	-37.5	179.7	-172.1	53.7	0	0	0	111.4	L787 F842 Q848 N850 L851	L787-D846 HydrophobicContact CD2-CB 4.21Å; F842-D846 VanDerWaalsContact O-CB 3.25Å; F842-D846 WeakPolarHBondContact O-CB 3.34Å; F842-D846 PolarHBondContact O-N 3.07Å; D846-Q848 VanDerWaalsContact C-N 3.34Å; D846-Q848 PolarHBondContact O-N 3.18Å; D846-N850 WeakPolarHBondContact O-CA 3.47Å; D846-N850 PolarHBondContact O-N 3.48Å; D846-L851 HydrophobicContact CB-CD1 4.26Å; D846-L851 WeakPolarHBondContact OD1-CB 3.31Å; D846-L851 PolarHBondContact OD1-N 3.24Å
847	R	85.9	Confident	88	Confident	138 Å²	138	44.7 Å²	44.7	52%	0.521	22%	0.224	S	C	.	.	H	α-helix	trans	-66.8	-32.4	173.5	-74.4	176.4	178.7	157.7	5.4	114.2	I843 Q844 L845 D877	I843-R847 WeakPolarHBondContact O-CG 3.32Å; I843-R847 PolarHBondContact O-N 2.86Å; I843-R847 VanDerWaalsContact O-N 3.1Å; Q844-R847 PolarHBondContact O-N 2.82Å; L845-R847 VanDerWaalsContact C-N 3.28Å; L845-R847 PolarHBondContact O-N 3.38Å; R847-D877 IonicContact NH1-OD2 2.84Å
848	Q	85.3	Confident	87.7	Confident	107 Å²	107	50.9 Å²	50.9	50%	0.5	25%	0.251	S	S	.	.	H	α-helix	trans	-79.2	-41.9	-178.2	-75	173.8	-8.8	0	0	112.2	Q844 L845 D846	Q844-Q848 WeakPolarHBondContact O-CG 3.25Å; Q844-Q848 PolarHBondContact O-N 3.27Å; Q844-Q848 VanDerWaalsContact O-N 3.08Å; L845-Q848 PolarHBondContact O-N 2.99Å; L845-Q848 VanDerWaalsContact O-N 3.12Å; D846-Q848 VanDerWaalsContact C-N 3.34Å; D846-Q848 PolarHBondContact O-N 3.18Å
849	I	82.7	Confident	87.4	Confident	68 Å²	68	50.8 Å²	50.8	35%	0.349	25%	0.251	S	S	.	.	H	α-helix	trans	-119	-14.7	-166.7	-43.1	177.5	0	0	0	112.1	L845 L854 I862	L845-I849 HydrophobicContact CD2-CD1 4.43Å; L845-I849 PolarHBondContact O-N 3.43Å; I849-L854 HydrophobicContact CG2-CD1 3.63Å; I849-I862 HydrophobicContact CD1-CD1 4.03Å; I849-I862 HydrophobicContact CD1-CG1 4.5Å; I849-I862 HydrophobicContact CD1-CG2 3.98Å; I849-I862 HydrophobicContact CG2-CD1 4.03Å
850	N	82.3	Confident	87.1	Confident	59 Å²	59	52.1 Å²	52.1	32%	0.316	26%	0.26	S	S	.	.			trans	55.6	75.4	-172.5	-165.1	-9.5	0	0	0	110.8	D846 E852 L853	D846-N850 WeakPolarHBondContact O-CA 3.47Å; D846-N850 PolarHBondContact O-N 3.48Å; N850-E852 PolarHBondContact O-N 3.33Å; N850-E852 WeakPolarHBondContact OD1-CB 3.44Å; N850-L853 HydrophobicContact CB-CD1 4.33Å; N850-L853 HydrophobicContact CB-CG 4.48Å; N850-L853 VanDerWaalsContact ND2-CD1 3.31Å; N850-L853 WeakPolarHBondContact ND2-CD1 3.29Å; N850-L853 PolarHBondContact O-N 2.99Å
851	L	81.5	Confident	86.9	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-56.6	-25.1	-175.9	-74.7	167.6	0	0	0	111.3	L787 F842 L845 D846 L853 L854 I859	L787-L851 HydrophobicContact CD1-CB 4.09Å; L787-L851 HydrophobicContact CD1-CD1 4.1Å; F842-L851 HydrophobicContact CD1-CD1 4.22Å; L845-L851 HydrophobicContact CB-CD1 4.19Å; D846-L851 HydrophobicContact CB-CD1 4.26Å; D846-L851 WeakPolarHBondContact OD1-CB 3.31Å; D846-L851 PolarHBondContact OD1-N 3.24Å; L851-L853 VanDerWaalsContact C-N 3.31Å; L851-L853 PolarHBondContact O-N 2.91Å; L851-L854 HydrophobicContact CD2-CD1 4.39Å; L851-L854 PolarHBondContact O-N 3.46Å; L851-I859 HydrophobicContact CD2-CG1 4.15Å; L851-I859 HydrophobicContact CD2-CG2 4.37Å
852	E	74.1	Confident	86.6	Confident	39 Å²	39	57.6 Å²	57.6	18%	0.182	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-60.3	-37	177.8	-51.4	-175.6	154.9	0	0	113.3	R786 R790 N850 L854	R786-E852 VanDerWaalsContact CD-OE1 3.26Å; R786-E852 WeakPolarHBondContact CD-OE1 3.27Å; R786-E852 WeakPolarHBondContact CG-OE1 3.4Å; R786-E852 IonicContact CZ-OE1 2.87Å; R786-E852 IonicContact CZ-OE2 3.63Å; R786-E852 IonicContact NE-OE1 3.7Å; R786-E852 IonicContact NE-OE2 3.73Å; R786-E852 IonicContact NH1-OE1 3.83Å; R786-E852 PolarHBondContact NH1-OE1 3.41Å; R786-E852 IonicContact NH1-OE2 2.72Å; R786-E852 PolarHBondContact NH1-OE2 3.31Å; R786-E852 IonicContact NH2-OE2 3.9Å; R786-E852 PolarHBondContact NH2-OE2 3.21Å; R790-E852 PolarHBondContact NE-O 3.45Å; N850-E852 PolarHBondContact O-N 3.33Å; N850-E852 WeakPolarHBondContact OD1-CB 3.44Å; E852-L854 VanDerWaalsContact C-N 3.32Å
853	L	80.4	Confident	86.4	Confident	141 Å²	141	57.7 Å²	57.7	74%	0.738	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-83.6	-7.6	-177.6	-63.9	-179.7	0	0	0	113.4	N850 L851	N850-L853 HydrophobicContact CB-CD1 4.33Å; N850-L853 HydrophobicContact CB-CG 4.48Å; N850-L853 VanDerWaalsContact ND2-CD1 3.31Å; N850-L853 WeakPolarHBondContact ND2-CD1 3.29Å; N850-L853 PolarHBondContact O-N 2.99Å; L851-L853 VanDerWaalsContact C-N 3.31Å; L851-L853 PolarHBondContact O-N 2.91Å
854	L	85.2	Confident	86.2	Confident	26 Å²	26	60 Å²	60	14%	0.136	31%	0.311	C	S	.	.	S	Bend	trans	-91.9	148.3	-176.9	-64.5	179.1	0	0	0	111.9	R790 I849 L851 E852 K858 I859 I862	R790-L854 PolarHBondContact NH2-O 3.42Å; I849-L854 HydrophobicContact CG2-CD1 3.63Å; L851-L854 HydrophobicContact CD2-CD1 4.39Å; L851-L854 PolarHBondContact O-N 3.46Å; E852-L854 VanDerWaalsContact C-N 3.32Å; L854-K858 HydrophobicContact CB-CB 4.3Å; L854-K858 HydrophobicContact CD2-CB 4.29Å; L854-K858 HydrophobicContact CD2-CD 3.79Å; L854-I859 HydrophobicContact CB-CD1 4.32Å; L854-I859 HydrophobicContact CB-CG1 3.79Å; L854-I862 HydrophobicContact CD1-CD1 3.45Å; L854-I862 VanDerWaalsContact CD1-CD1 3.45Å
855	G	87.5	Confident	85.7	Confident	39 Å²	39	63.8 Å²	63.8	40%	0.402	33%	0.332	S	S	.	.			trans	-79.1	163.2	169.6	0	0	0	0	0	112	E857 K858 I859	G855-E857 VanDerWaalsContact C-N 3.3Å; G855-E857 PolarHBondContact O-N 2.79Å; G855-K858 PolarHBondContact O-N 3.48Å; G855-I859 WeakPolarHBondContact O-CG1 3.4Å; G855-I859 PolarHBondContact O-N 3.25Å; G855-I859 VanDerWaalsContact O-N 3.11Å
856	L	90	Very high	85.4	Confident	72 Å²	72	65.9 Å²	65.9	38%	0.377	34%	0.341	S	S	.	.	H	α-helix	trans	-48	-50	-178.5	179.2	56.5	0	0	0	112.8	I794 V796 K858 I859 C860	I794-L856 HydrophobicContact CG2-CB 3.52Å; I794-L856 HydrophobicContact CG2-CD1 3.93Å; I794-L856 HydrophobicContact CG2-CD2 4.46Å; I794-L856 HydrophobicContact CG2-CG 4.13Å; V796-L856 HydrophobicContact CB-CD1 4.41Å; V796-L856 HydrophobicContact CG2-CD1 3.94Å; L856-K858 PolarHBondContact O-N 2.9Å; L856-I859 PolarHBondContact O-N 3.43Å; L856-C860 PolarHBondContact O-N 3.24Å; L856-C860 PolarHBondContact O-SG 3.47Å
857	E	89.7	Confident	85	Confident	159 Å²	159	65.5 Å²	65.5	74%	0.743	34%	0.34	S	S	*	.	H	α-helix	trans	-58.2	-49.3	-176.5	-173.4	-177.8	-179.7	0	0	111.7	G855 I859 C860 T861	G855-E857 VanDerWaalsContact C-N 3.3Å; G855-E857 PolarHBondContact O-N 2.79Å; E857-I859 VanDerWaalsContact C-N 3.34Å; E857-I859 PolarHBondContact O-N 3.15Å; E857-C860 WeakPolarHBondContact O-CB 3.5Å; E857-C860 PolarHBondContact O-N 2.96Å; E857-T861 PolarHBondContact O-N 2.58Å; E857-T861 PolarHBondContact O-OG1 3.02Å
858	K	88.2	Confident	84.9	Confident	133 Å²	133	64.4 Å²	64.4	58%	0.578	34%	0.344	S	S	*	.	H	α-helix	trans	-62.7	-41.2	178.9	-66.5	-176.4	-177.2	178.1	0	111.8	L854 G855 L856 T861 I862	L854-K858 HydrophobicContact CB-CB 4.3Å; L854-K858 HydrophobicContact CD2-CB 4.29Å; L854-K858 HydrophobicContact CD2-CD 3.79Å; G855-K858 PolarHBondContact O-N 3.48Å; L856-K858 PolarHBondContact O-N 2.9Å; K858-T861 PolarHBondContact O-N 3.17Å; K858-I862 WeakPolarHBondContact O-CD1 3.22Å; K858-I862 VanDerWaalsContact O-CG1 3.26Å; K858-I862 WeakPolarHBondContact O-CG1 3.45Å; K858-I862 PolarHBondContact O-N 3.17Å
859	I	88.2	Confident	84.9	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-61.2	-46.8	175.9	-65.4	171.1	0	0	0	109.9	L791 I794 V796 L851 L854 G855 L856 E857 T861 I862 L863	L791-I859 HydrophobicContact CD2-CG2 4.5Å; I794-I859 HydrophobicContact CD1-CD1 3.87Å; V796-I859 HydrophobicContact CG1-CG2 4.1Å; V796-I859 HydrophobicContact CG2-CG2 4.13Å; L851-I859 HydrophobicContact CD2-CG1 4.15Å; L851-I859 HydrophobicContact CD2-CG2 4.37Å; L854-I859 HydrophobicContact CB-CD1 4.32Å; L854-I859 HydrophobicContact CB-CG1 3.79Å; G855-I859 WeakPolarHBondContact O-CG1 3.4Å; G855-I859 PolarHBondContact O-N 3.25Å; G855-I859 VanDerWaalsContact O-N 3.11Å; L856-I859 PolarHBondContact O-N 3.43Å; E857-I859 VanDerWaalsContact C-N 3.34Å; E857-I859 PolarHBondContact O-N 3.15Å; I859-T861 PolarHBondContact O-N 3.32Å; I859-I862 PolarHBondContact O-N 3.16Å; I859-L863 HydrophobicContact CG2-CD1 3.79Å; I859-L863 HydrophobicContact CG2-CG 4.25Å; I859-L863 WeakPolarHBondContact O-CB 3.34Å; I859-L863 WeakPolarHBondContact O-CG 3.32Å; I859-L863 PolarHBondContact O-N 2.81Å
860	C	89.8	Confident	85.3	Confident	29 Å²	29	60.5 Å²	60.5	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-59.9	-44.2	177.2	-69	0	0	0	0	112	L801 L856 E857 I862 L863 S864	L801-C860 HydrophobicContact CD1-CB 4.33Å; L801-C860 HydrophobicContact CD2-CB 4.46Å; L856-C860 PolarHBondContact O-N 3.24Å; L856-C860 PolarHBondContact O-SG 3.47Å; E857-C860 WeakPolarHBondContact O-CB 3.5Å; E857-C860 PolarHBondContact O-N 2.96Å; C860-I862 VanDerWaalsContact C-N 3.34Å; C860-I862 PolarHBondContact O-N 3.21Å; C860-L863 PolarHBondContact O-N 2.71Å; C860-S864 WeakPolarHBondContact O-CB 3.2Å; C860-S864 PolarHBondContact O-N 3.37Å; C860-S864 PolarHBondContact O-OG 3.17Å
861	T	88.8	Confident	85.6	Confident	77 Å²	77	58.8 Å²	58.8	47%	0.472	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-38.6	177.7	-51.6	0	0	0	0	112.7	E857 K858 I859 S864 N865	E857-T861 PolarHBondContact O-N 2.58Å; E857-T861 PolarHBondContact O-OG1 3.02Å; K858-T861 PolarHBondContact O-N 3.17Å; I859-T861 PolarHBondContact O-N 3.32Å; T861-S864 WeakPolarHBondContact CA-OG 3.45Å; T861-S864 PolarHBondContact O-OG 3.49Å; T861-N865 PolarHBondContact O-ND2 3.23Å
862	I	87.2	Confident	85.8	Confident	39 Å²	39	61.2 Å²	61.2	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-68.7	-49.1	176.6	-68.6	162.5	0	0	0	109.8	I849 L854 K858 I859 C860 S864 N865	I849-I862 HydrophobicContact CD1-CD1 4.03Å; I849-I862 HydrophobicContact CD1-CG1 4.5Å; I849-I862 HydrophobicContact CD1-CG2 3.98Å; I849-I862 HydrophobicContact CG2-CD1 4.03Å; L854-I862 HydrophobicContact CD1-CD1 3.45Å; L854-I862 VanDerWaalsContact CD1-CD1 3.45Å; K858-I862 WeakPolarHBondContact O-CD1 3.22Å; K858-I862 VanDerWaalsContact O-CG1 3.26Å; K858-I862 WeakPolarHBondContact O-CG1 3.45Å; K858-I862 PolarHBondContact O-N 3.17Å; I859-I862 PolarHBondContact O-N 3.16Å; C860-I862 VanDerWaalsContact C-N 3.34Å; C860-I862 PolarHBondContact O-N 3.21Å; I862-S864 VanDerWaalsContact C-N 3.28Å; I862-S864 PolarHBondContact O-N 2.93Å; I862-N865 CarbonylContact O-C 3.58Å; I862-N865 PolarHBondContact O-N 3.1Å
863	L	88.1	Confident	86.4	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-69.4	-24.1	-177.2	-65.9	179.9	0	0	0	113.3	V796 L798 L801 W805 F842 L845 I859 C860 N865	V796-L863 HydrophobicContact CG1-CD1 4.14Å; L798-L863 HydrophobicContact CD2-CD1 3.91Å; L801-L863 HydrophobicContact CB-CB 4.32Å; L801-L863 HydrophobicContact CD1-CB 4.2Å; L801-L863 HydrophobicContact CD1-CD1 4.12Å; W805-L863 HydrophobicContact CH2-CD2 4.06Å; W805-L863 VanDerWaalsContact CZ2-O 3.31Å; W805-L863 WeakPolarHBondContact CZ2-O 3.26Å; F842-L863 HydrophobicContact CE1-CD1 4.21Å; F842-L863 HydrophobicContact CE1-CD2 3.97Å; F842-L863 HydrophobicContact CZ-CD1 4.16Å; F842-L863 HydrophobicContact CZ-CD2 3.84Å; L845-L863 HydrophobicContact CD1-CD2 4.07Å; I859-L863 HydrophobicContact CG2-CD1 3.79Å; I859-L863 HydrophobicContact CG2-CG 4.25Å; I859-L863 WeakPolarHBondContact O-CB 3.34Å; I859-L863 WeakPolarHBondContact O-CG 3.32Å; I859-L863 PolarHBondContact O-N 2.81Å; C860-L863 PolarHBondContact O-N 2.71Å; L863-N865 VanDerWaalsContact C-N 3.29Å; L863-N865 PolarHBondContact O-N 3.49Å
864	S	85.7	Confident	86.9	Confident	71 Å²	71	56.4 Å²	56.4	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-70.3	-24.4	174	58.2	0	0	0	0	113.7	C860 T861 I862	C860-S864 WeakPolarHBondContact O-CB 3.2Å; C860-S864 PolarHBondContact O-N 3.37Å; C860-S864 PolarHBondContact O-OG 3.17Å; T861-S864 WeakPolarHBondContact CA-OG 3.45Å; T861-S864 PolarHBondContact O-OG 3.49Å; I862-S864 VanDerWaalsContact C-N 3.28Å; I862-S864 PolarHBondContact O-N 2.93Å
865	N	82.9	Confident	87.2	Confident	109 Å²	109	56.3 Å²	56.3	58%	0.583	30%	0.302	S	S	*	.	S	Bend	trans	-107.8	108.8	176.5	-66	-49.7	0	0	0	108.4	T861 I862 L863 P867	T861-N865 PolarHBondContact O-ND2 3.23Å; I862-N865 CarbonylContact O-C 3.58Å; I862-N865 PolarHBondContact O-N 3.1Å; L863-N865 VanDerWaalsContact C-N 3.29Å; L863-N865 PolarHBondContact O-N 3.49Å; N865-P867 VanDerWaalsContact O-N 3.1Å
866	F	81.7	Confident	87.2	Confident	45 Å²	45	56.1 Å²	56.1	20%	0.197	29%	0.293	C	S	.	.			trans	-53.5	123	-177.2	-168.5	-94.8	0	0	0	110.5	W805 F810 A813 M814 F841 I869	W805-F866 HydrophobicContact CD2-CD2 4.04Å; W805-F866 HydrophobicContact CD2-CE2 4.08Å; W805-F866 AromaticContact CE2-CD2 3.56Å; W805-F866 HydrophobicContact CE3-CE2 4.34Å; W805-F866 HydrophobicContact CG-CD2 4.47Å; W805-F866 HydrophobicContact CG-CE2 4.5Å; W805-F866 HydrophobicContact CH2-CD2 4.31Å; W805-F866 AromaticContact CZ2-CD2 3.72Å; W805-F866 HydrophobicContact CZ2-CD2 3.72Å; W805-F866 HydrophobicContact CZ2-CE2 4.33Å; W805-F866 AromaticContact NE1-CD2 3.74Å; F810-F866 AromaticContact CD1-CE2 3.87Å; F810-F866 HydrophobicContact CD1-CE2 3.87Å; F810-F866 HydrophobicContact CD1-CZ 4.26Å; F810-F866 HydrophobicContact CE1-CE2 4.43Å; A813-F866 HydrophobicContact CB-CB 4.17Å; A813-F866 HydrophobicContact CB-CD2 3.66Å; A813-F866 HydrophobicContact CB-CE2 4.29Å; A813-F866 HydrophobicContact CB-CG 4Å; A813-F866 WeakPolarHBondContact O-CB 3.25Å; M814-F866 HydrophobicContact CB-CD1 4.41Å; M814-F866 HydrophobicContact CB-CE1 4.08Å; M814-F866 HydrophobicContact CB-CZ 4.48Å; M814-F866 HydrophobicContact CG-CD1 4.47Å; M814-F866 HydrophobicContact CG-CE1 3.96Å; M814-F866 HydrophobicContact SD-CE1 3.92Å; M814-F866 HydrophobicContact SD-CZ 4.28Å; F841-F866 HydrophobicContact CD2-CE2 4.47Å; F841-F866 HydrophobicContact CD2-CZ 4.29Å; F841-F866 HydrophobicContact CE2-CE2 4.43Å; F841-F866 AromaticContact CE2-CZ 3.99Å; F841-F866 HydrophobicContact CE2-CZ 3.99Å; F866-I869 HydrophobicContact CE1-CD1 3.92Å; F866-I869 HydrophobicContact CE2-CD1 4.39Å; F866-I869 HydrophobicContact CZ-CD1 3.66Å
867	P	79.9	Confident	87.2	Confident	20 Å²	20	53.7 Å²	53.7	13%	0.13	28%	0.28	C	S	.	.			trans	-78	166.3	-169.1	32.4	-37.5	0	0	0	112	L845 N865 I869	L845-P867 HydrophobicContact CD1-CG 3.9Å; L845-P867 HydrophobicContact CD2-CB 3.36Å; L845-P867 HydrophobicContact CD2-CG 3.39Å; L845-P867 HydrophobicContact CG-CB 4.38Å; L845-P867 HydrophobicContact CG-CG 3.89Å; N865-P867 VanDerWaalsContact O-N 3.1Å; P867-I869 HydrophobicContact CG-CD1 3.93Å; P867-I869 HydrophobicContact CG-CG1 3.93Å; P867-I869 PolarHBondContact O-N 3.47Å
868	D	82.9	Confident	87.3	Confident	115 Å²	115	46.1 Å²	46.1	62%	0.615	25%	0.245	S	C	*	.			trans	-82.4	115.1	174.1	-155.2	4.6	0	0	0	110.7	R818	R818-D868 IonicContact CZ-OD1 3.91Å; R818-D868 VanDerWaalsContact CZ-OD1 3.25Å; R818-D868 IonicContact NH1-OD1 3.73Å; R818-D868 PolarHBondContact NH1-OD1 2.93Å; R818-D868 IonicContact NH2-OD1 3.49Å; R818-D868 PolarHBondContact NH2-OD1 2.99Å
869	I	86.9	Confident	87.5	Confident	8 Å²	8	39.9 Å²	39.9	4%	0.041	22%	0.218	C	C	.	.			trans	-119	140.2	-167.2	-63.2	-179.5	0	0	0	110.1	F841 F866 P867 L871 C874	F841-I869 HydrophobicContact CB-CD1 3.81Å; F841-I869 HydrophobicContact CD1-CD1 3.65Å; F841-I869 HydrophobicContact CD1-CG2 3.6Å; F841-I869 HydrophobicContact CD2-CD1 3.77Å; F841-I869 HydrophobicContact CE1-CD1 4.08Å; F841-I869 HydrophobicContact CE1-CG2 3.63Å; F841-I869 HydrophobicContact CE2-CD1 4.18Å; F841-I869 HydrophobicContact CG-CD1 3.48Å; F841-I869 VanDerWaalsContact CG-CD1 3.48Å; F841-I869 HydrophobicContact CG-CG2 4.47Å; F841-I869 HydrophobicContact CZ-CD1 4.33Å; F866-I869 HydrophobicContact CE1-CD1 3.92Å; F866-I869 HydrophobicContact CE2-CD1 4.39Å; F866-I869 HydrophobicContact CZ-CD1 3.66Å; P867-I869 HydrophobicContact CG-CD1 3.93Å; P867-I869 HydrophobicContact CG-CG1 3.93Å; P867-I869 PolarHBondContact O-N 3.47Å; I869-L871 PolarHBondContact O-N 3.06Å; I869-C874 HydrophobicContact CG2-CB 4.34Å; I869-C874 WeakPolarHBondContact CG2-SG 3.47Å
870	N	89.5	Confident	87.5	Confident	85 Å²	85	43.7 Å²	43.7	46%	0.455	23%	0.234	S	C	.	.			trans	-84.4	99.2	170.3	-175.8	-37.4	0	0	0	109.6	Q844 D872 K873 C874	Q844-N870 VanDerWaalsContact NE2-CB 3.27Å; N870-D872 VanDerWaalsContact C-N 3.34Å; N870-D872 PolarHBondContact O-N 3.18Å; N870-D872 PolarHBondContact OD1-N 3.34Å; N870-K873 HydrophobicContact CB-CB 4.11Å; N870-K873 PolarHBondContact O-N 2.91Å; N870-K873 PolarHBondContact OD1-N 3.05Å; N870-C874 PolarHBondContact O-N 2.97Å; N870-C874 PolarHBondContact O-SG 3.12Å; N870-C874 VanDerWaalsContact O-SG 3.33Å
871	L	88.9	Confident	87.6	Confident	24 Å²	24	43.4 Å²	43.4	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-35.7	-176.2	-70.2	178.5	0	0	0	114.2	M814 R818 L821 F841 I869 K873 C874 R875	M814-L871 HydrophobicContact CE-CD1 4.27Å; M814-L871 HydrophobicContact CE-CD2 4.32Å; M814-L871 HydrophobicContact SD-CD1 4.29Å; M814-L871 HydrophobicContact SD-CD2 4.07Å; R818-L871 HydrophobicContact CB-CD1 3.81Å; R818-L871 HydrophobicContact CG-CD1 4.02Å; L821-L871 HydrophobicContact CB-CD1 4.49Å; F841-L871 HydrophobicContact CE1-CD2 4.22Å; F841-L871 HydrophobicContact CZ-CD2 4.16Å; I869-L871 PolarHBondContact O-N 3.06Å; L871-K873 VanDerWaalsContact C-N 3.34Å; L871-K873 PolarHBondContact O-N 3.09Å; L871-C874 PolarHBondContact O-N 3.23Å; L871-R875 WeakPolarHBondContact O-CB 3.22Å; L871-R875 PolarHBondContact O-N 3.22Å
872	D	86.6	Confident	87.7	Confident	52 Å²	52	39.8 Å²	39.8	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-64.2	-42.7	177.8	-79.1	-36.6	0	0	0	111.1	L566 N870 T876	L566-D872 WeakPolarHBondContact CB-OD1 3.2Å; N870-D872 VanDerWaalsContact C-N 3.34Å; N870-D872 PolarHBondContact O-N 3.18Å; N870-D872 PolarHBondContact OD1-N 3.34Å; D872-T876 PolarHBondContact O-N 3.4Å; D872-T876 PolarHBondContact O-OG1 3.45Å
873	K	86.6	Confident	87.8	Confident	79 Å²	79	38.4 Å²	38.4	34%	0.343	20%	0.201	S	C	.	.	H	α-helix	trans	-65.6	-44.5	175.6	-171.5	65	173.8	75.9	0	111	N870 L871 R875 T876 D877	N870-K873 HydrophobicContact CB-CB 4.11Å; N870-K873 PolarHBondContact O-N 2.91Å; N870-K873 PolarHBondContact OD1-N 3.05Å; L871-K873 VanDerWaalsContact C-N 3.34Å; L871-K873 PolarHBondContact O-N 3.09Å; K873-R875 PolarHBondContact O-N 2.99Å; K873-T876 PolarHBondContact O-N 2.94Å; K873-D877 IonicContact NZ-OD1 3.42Å; K873-D877 PolarHBondContact NZ-OD1 3.44Å; K873-D877 IonicContact NZ-OD2 2.78Å; K873-D877 PolarHBondContact NZ-OD2 3.03Å; K873-D877 WeakPolarHBondContact O-CB 3.47Å; K873-D877 PolarHBondContact O-N 2.84Å
874	C	91.4	Very high	87.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-37.7	179.2	-68.1	0	0	0	0	112.7	F837 A840 F841 Q844 I869 N870 L871 D877 A878	F837-C874 HydrophobicContact CD1-CB 4.47Å; A840-C874 HydrophobicContact CB-CB 4.1Å; F841-C874 HydrophobicContact CD1-CB 3.83Å; F841-C874 VanDerWaalsContact CD1-SG 3.51Å; F841-C874 HydrophobicContact CE1-CB 3.59Å; Q844-C874 PolarHBondContact OE1-SG 3.26Å; I869-C874 HydrophobicContact CG2-CB 4.34Å; I869-C874 WeakPolarHBondContact CG2-SG 3.47Å; N870-C874 PolarHBondContact O-N 2.97Å; N870-C874 PolarHBondContact O-SG 3.12Å; N870-C874 VanDerWaalsContact O-SG 3.33Å; L871-C874 PolarHBondContact O-N 3.23Å; C874-D877 PolarHBondContact O-N 3.32Å; C874-A878 WeakPolarHBondContact O-CB 3.42Å; C874-A878 PolarHBondContact O-N 2.87Å
875	R	90.4	Very high	87.8	Confident	24 Å²	24	35.2 Å²	35.2	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-49.1	171.9	176.6	178	177.2	-94.9	2.4	111	R602 K603 T825 F837 L871 K873 D877 A878 L879	R602-R875 PolarHBondContact O-NH2 3.28Å; R602-R875 VanDerWaalsContact O-NH2 3.12Å; K603-R875 PolarHBondContact O-NH2 3.37Å; T825-R875 HydrophobicContact CG2-CG 4.25Å; T825-R875 WeakPolarHBondContact OG1-CD 3.25Å; T825-R875 PolarHBondContact OG1-NE 3.39Å; F837-R875 HydrophobicContact CE1-CB 4.08Å; F837-R875 HydrophobicContact CZ-CB 4.07Å; F837-R875 HydrophobicContact CZ-CG 4.3Å; L871-R875 WeakPolarHBondContact O-CB 3.22Å; L871-R875 PolarHBondContact O-N 3.22Å; K873-R875 PolarHBondContact O-N 2.99Å; R875-D877 VanDerWaalsContact C-N 3.33Å; R875-D877 PolarHBondContact O-N 3.41Å; R875-A878 PolarHBondContact O-N 3.18Å; R875-L879 HydrophobicContact CG-CD1 4.2Å; R875-L879 WeakPolarHBondContact O-CG 3.28Å; R875-L879 PolarHBondContact O-N 3.47Å
876	T	87.3	Confident	88.1	Confident	36 Å²	36	30.5 Å²	30.5	22%	0.221	16%	0.155	C	C	.	.	H	α-helix	trans	-60.7	-44.4	179.5	-54.1	0	0	0	0	111.3	D872 K873 K880	D872-T876 PolarHBondContact O-N 3.4Å; D872-T876 PolarHBondContact O-OG1 3.45Å; K873-T876 PolarHBondContact O-N 2.94Å; T876-K880 HydrophobicContact CG2-CD 4.44Å; T876-K880 WeakPolarHBondContact O-CG 3.43Å; T876-K880 PolarHBondContact O-N 3.18Å; T876-K880 VanDerWaalsContact O-N 3.11Å
877	D	89.8	Confident	88.1	Confident	20 Å²	20	31 Å²	31	11%	0.107	16%	0.155	C	C	.	.	H	α-helix	trans	-69	-43.6	178.9	-72.3	-9.9	0	0	0	111.3	A840 R847 K873 C874 R875 L879 K880 L881	A840-D877 HydrophobicContact CB-CB 4.02Å; R847-D877 IonicContact NH1-OD2 2.84Å; K873-D877 IonicContact NZ-OD1 3.42Å; K873-D877 PolarHBondContact NZ-OD1 3.44Å; K873-D877 IonicContact NZ-OD2 2.78Å; K873-D877 PolarHBondContact NZ-OD2 3.03Å; K873-D877 WeakPolarHBondContact O-CB 3.47Å; K873-D877 PolarHBondContact O-N 2.84Å; C874-D877 PolarHBondContact O-N 3.32Å; R875-D877 VanDerWaalsContact C-N 3.33Å; R875-D877 PolarHBondContact O-N 3.41Å; D877-L879 PolarHBondContact O-N 2.92Å; D877-K880 PolarHBondContact O-N 3.39Å; D877-L881 WeakPolarHBondContact O-CB 3.4Å; D877-L881 WeakPolarHBondContact O-CG 3.47Å; D877-L881 PolarHBondContact O-N 3.48Å
878	A	93.4	Very high	88.3	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.8	-44.8	177.5	0	0	0	0	0	111.9	F836 F837 A840 C874 R875 L881 A882	F836-A878 HydrophobicContact CB-CB 3.89Å; F836-A878 WeakPolarHBondContact CB-O 3.5Å; F837-A878 HydrophobicContact CD1-CB 4.29Å; F837-A878 HydrophobicContact CD2-CB 4.01Å; F837-A878 HydrophobicContact CE1-CB 4.46Å; F837-A878 HydrophobicContact CE2-CB 4.19Å; F837-A878 HydrophobicContact CG-CB 4.08Å; F837-A878 HydrophobicContact CZ-CB 4.42Å; A840-A878 HydrophobicContact CB-CB 4.38Å; C874-A878 WeakPolarHBondContact O-CB 3.42Å; C874-A878 PolarHBondContact O-N 2.87Å; R875-A878 PolarHBondContact O-N 3.18Å; A878-L881 PolarHBondContact O-N 3.3Å; A878-A882 VanDerWaalsContact O-CB 3.27Å; A878-A882 WeakPolarHBondContact O-CB 2.96Å; A878-A882 PolarHBondContact O-N 3.43Å
879	L	91.6	Very high	88.5	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-44.4	175.8	-69.6	173.3	0	0	0	111.6	L833 R875 D877 L881 A882 L883 W937 P938	L833-L879 HydrophobicContact CD1-CD2 4.36Å; R875-L879 HydrophobicContact CG-CD1 4.2Å; R875-L879 WeakPolarHBondContact O-CG 3.28Å; R875-L879 PolarHBondContact O-N 3.47Å; D877-L879 PolarHBondContact O-N 2.92Å; L879-L881 PolarHBondContact O-N 2.86Å; L879-A882 PolarHBondContact O-N 3.01Å; L879-L883 WeakPolarHBondContact O-CB 3.02Å; L879-L883 VanDerWaalsContact O-CG 3.24Å; L879-L883 WeakPolarHBondContact O-CG 3.42Å; L879-L883 PolarHBondContact O-N 3.46Å; L879-W937 HydrophobicContact CD2-CE3 3.97Å; L879-W937 HydrophobicContact CD2-CZ3 4.03Å; L879-P938 HydrophobicContact CD2-CG 4.44Å
880	K	87.7	Confident	88.5	Confident	81 Å²	81	26 Å²	26	35%	0.352	13%	0.129	S	C	.	.	H	α-helix	trans	-61.8	-42.7	176.5	-75.3	-179.8	178.8	-170	0	112.6	T876 D877 A884	T876-K880 HydrophobicContact CG2-CD 4.44Å; T876-K880 WeakPolarHBondContact O-CG 3.43Å; T876-K880 PolarHBondContact O-N 3.18Å; T876-K880 VanDerWaalsContact O-N 3.11Å; D877-K880 PolarHBondContact O-N 3.39Å; K880-A884 WeakPolarHBondContact O-CB 3.43Å; K880-A884 PolarHBondContact O-N 3.48Å; K880-A884 VanDerWaalsContact O-N 3.14Å
881	L	91.4	Very high	87.7	Confident	24 Å²	24	23.4 Å²	23.4	13%	0.126	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-46	176.4	-66.6	167.7	0	0	0	110.5	H783 F836 I839 I843 D877 A878 L879 L883 A884 T885	H783-L881 HydrophobicContact CB-CD2 3.87Å; H783-L881 PolarHBondContact CE1-O 3.49Å; H783-L881 WeakPolarHBondContact ND1-CD2 3.11Å; F836-L881 HydrophobicContact CB-CB 4.41Å; F836-L881 HydrophobicContact CD1-CB 3.73Å; F836-L881 HydrophobicContact CE1-CB 4.49Å; F836-L881 HydrophobicContact CG-CB 4.4Å; I839-L881 HydrophobicContact CB-CD1 4.18Å; I839-L881 HydrophobicContact CG2-CD1 3.74Å; I843-L881 HydrophobicContact CD1-CD1 4Å; I843-L881 HydrophobicContact CD1-CD2 4.46Å; D877-L881 WeakPolarHBondContact O-CB 3.4Å; D877-L881 WeakPolarHBondContact O-CG 3.47Å; D877-L881 PolarHBondContact O-N 3.48Å; A878-L881 PolarHBondContact O-N 3.3Å; L879-L881 PolarHBondContact O-N 2.86Å; L881-L883 PolarHBondContact O-N 2.9Å; L881-A884 PolarHBondContact O-N 3.28Å; L881-T885 WeakPolarHBondContact O-CB 3.19Å; L881-T885 PolarHBondContact O-N 3.24Å; L881-T885 VanDerWaalsContact O-N 3.17Å; L881-T885 PolarHBondContact O-OG1 3.48Å
882	A	91.7	Very high	86.8	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-59.9	-45.5	177.7	0	0	0	0	0	112.2	L833 F836 A878 L879 A884 T885 P938 H940 L941	L833-A882 HydrophobicContact CD1-CB 4.15Å; F836-A882 HydrophobicContact CD1-CB 4.4Å; F836-A882 HydrophobicContact CD2-CB 3.58Å; F836-A882 HydrophobicContact CE2-CB 3.71Å; F836-A882 HydrophobicContact CG-CB 3.93Å; F836-A882 HydrophobicContact CZ-CB 4.18Å; A878-A882 VanDerWaalsContact O-CB 3.27Å; A878-A882 WeakPolarHBondContact O-CB 2.96Å; A878-A882 PolarHBondContact O-N 3.43Å; L879-A882 PolarHBondContact O-N 3.01Å; A882-A884 VanDerWaalsContact C-N 3.29Å; A882-A884 PolarHBondContact O-N 2.99Å; A882-T885 PolarHBondContact O-N 3.24Å; A882-T885 VanDerWaalsContact O-N 3.15Å; A882-P938 HydrophobicContact CB-CB 3.75Å; A882-P938 HydrophobicContact CB-CG 3.85Å; A882-H940 PolarHBondContact O-CE1 3.33Å; A882-L941 HydrophobicContact CB-CD1 4Å
883	L	88.5	Confident	85.3	Confident	10 Å²	10	22.8 Å²	22.8	5%	0.052	12%	0.116	C	C	.	.	H	α-helix	trans	-58.4	-39.7	175.4	-74.5	167.6	0	0	0	112.9	L879 L881 T885 R930 L931 A936 W937 P938	L879-L883 WeakPolarHBondContact O-CB 3.02Å; L879-L883 VanDerWaalsContact O-CG 3.24Å; L879-L883 WeakPolarHBondContact O-CG 3.42Å; L879-L883 PolarHBondContact O-N 3.46Å; L881-L883 PolarHBondContact O-N 2.9Å; L883-T885 VanDerWaalsContact C-N 3.28Å; L883-T885 PolarHBondContact O-N 3.12Å; L883-R930 HydrophobicContact CD2-CB 4.48Å; L883-L931 HydrophobicContact CB-CD2 4.43Å; L883-A936 HydrophobicContact CD1-CB 3.56Å; L883-A936 WeakPolarHBondContact CD1-O 3.07Å; L883-A936 HydrophobicContact CD2-CB 4.05Å; L883-A936 HydrophobicContact CG-CB 4.43Å; L883-W937 WeakPolarHBondContact CD2-O 3.19Å; L883-P938 HydrophobicContact CD2-CB 4.37Å
884	A	85.4	Confident	83.7	Confident	3 Å²	3	22.1 Å²	22.1	3%	0.025	12%	0.116	C	C	.	.	H	α-helix	trans	-77	-12.7	-179.8	0	0	0	0	0	114	K880 L881 A882 L931	K880-A884 WeakPolarHBondContact O-CB 3.43Å; K880-A884 PolarHBondContact O-N 3.48Å; K880-A884 VanDerWaalsContact O-N 3.14Å; L881-A884 PolarHBondContact O-N 3.28Å; A882-A884 VanDerWaalsContact C-N 3.29Å; A882-A884 PolarHBondContact O-N 2.99Å; A884-L931 HydrophobicContact CB-CD2 4.25Å
885	T	89.8	Confident	81.5	Confident	2 Å²	2	23.5 Å²	23.5	1%	0.012	13%	0.125	C	C	.	.	S	Bend	trans	-94.2	125.6	-170.5	-57.8	0	0	0	0	111.6	L779 H783 F836 L881 A882 L883 L889 T890 H940	L779-T885 HydrophobicContact CD2-CG2 3.6Å; H783-T885 PolarHBondContact CE1-OG1 3.42Å; H783-T885 PolarHBondContact NE2-OG1 2.97Å; F836-T885 HydrophobicContact CE1-CG2 4Å; F836-T885 WeakPolarHBondContact CE1-OG1 3.48Å; F836-T885 HydrophobicContact CZ-CG2 3.85Å; L881-T885 WeakPolarHBondContact O-CB 3.19Å; L881-T885 PolarHBondContact O-N 3.24Å; L881-T885 VanDerWaalsContact O-N 3.17Å; L881-T885 PolarHBondContact O-OG1 3.48Å; A882-T885 PolarHBondContact O-N 3.24Å; A882-T885 VanDerWaalsContact O-N 3.15Å; L883-T885 VanDerWaalsContact C-N 3.28Å; L883-T885 PolarHBondContact O-N 3.12Å; T885-L889 HydrophobicContact CG2-CB 3.98Å; T885-L889 HydrophobicContact CG2-CD1 4.45Å; T885-T890 HydrophobicContact CG2-CG2 3.89Å; T885-H940 PolarHBondContact O-NE2 3.47Å
886	P	87.9	Confident	79.3	Confident	10 Å²	10	27.1 Å²	27.1	7%	0.065	15%	0.146	C	C	.	.			trans	-61.3	147.8	168.9	-20.3	31.6	0	0	0	112.3	S888 L889 L977 D981	P886-S888 PolarHBondContact O-N 3.44Å; P886-L889 HydrophobicContact CB-CG 4.3Å; P886-L889 HydrophobicContact CG-CD1 4.23Å; P886-L889 HydrophobicContact CG-CG 4.43Å; P886-L889 PolarHBondContact O-N 2.81Å; P886-L977 HydrophobicContact CB-CD1 3.43Å; P886-L977 VanDerWaalsContact CB-CD1 3.43Å; P886-L977 HydrophobicContact CG-CD1 3.71Å; P886-D981 HydrophobicContact CB-CB 4.15Å
887	R	82.5	Confident	76.9	Confident	57 Å²	57	34.7 Å²	34.7	22%	0.215	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63.6	-40.6	-171.4	-175.3	178.6	174.2	-160.4	-14.7	112.9	L889 T890 H940 L941 C943 D944 F945 D981	R887-L889 PolarHBondContact O-N 3.28Å; R887-T890 PolarHBondContact O-N 2.97Å; R887-T890 PolarHBondContact O-OG1 3.36Å; R887-H940 WeakPolarHBondContact CD-O 3.4Å; R887-L941 HydrophobicContact CB-CD2 4.12Å; R887-L941 HydrophobicContact CG-CD2 4.3Å; R887-C943 PolarHBondContact NE-O 2.68Å; R887-C943 PolarHBondContact NH2-O 3.3Å; R887-D944 PolarHBondContact NH2-O 2.9Å; R887-F945 HydrophobicContact CG-CD2 4.32Å; R887-F945 VanDerWaalsContact NH2-CA 3.32Å; R887-F945 VanDerWaalsContact NH2-N 3.13Å; R887-D981 PolarHBondContact N-OD2 3.25Å
888	S	83.5	Confident	74.4	Confident	15 Å²	15	41.6 Å²	41.6	11%	0.105	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-63.7	-21.7	-179.1	74.2	0	0	0	0	113	P886 T890 L977 S978 D981	P886-S888 PolarHBondContact O-N 3.44Å; S888-T890 PolarHBondContact O-N 3.35Å; S888-L977 WeakPolarHBondContact OG-CA 3.38Å; S888-S978 WeakPolarHBondContact CB-OG 3.46Å; S888-S978 PolarHBondContact OG-N 3.09Å; S888-D981 WeakPolarHBondContact CB-OD2 3.28Å; S888-D981 PolarHBondContact N-OD2 3.3Å; S888-D981 PolarHBondContact OG-OD2 3.25Å
889	L	88.1	Confident	71.6	Confident	11 Å²	11	50 Å²	50	6%	0.058	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-76.1	-12.5	174.5	-56.2	-167.6	0	0	0	112.9	T775 L779 F782 T885 P886 R887 P975 L976 L977	T775-L889 VanDerWaalsContact CG2-O 3.3Å; T775-L889 WeakPolarHBondContact CG2-O 2.92Å; L779-L889 HydrophobicContact CD2-CB 3.77Å; L779-L889 WeakPolarHBondContact CD2-O 3.37Å; F782-L889 HydrophobicContact CD1-CD1 4.28Å; F782-L889 HydrophobicContact CD2-CD1 3.53Å; F782-L889 HydrophobicContact CE1-CD1 4.34Å; F782-L889 HydrophobicContact CE2-CD1 3.61Å; F782-L889 HydrophobicContact CG-CD1 3.89Å; F782-L889 HydrophobicContact CZ-CD1 4.03Å; T885-L889 HydrophobicContact CG2-CB 3.98Å; T885-L889 HydrophobicContact CG2-CD1 4.45Å; P886-L889 HydrophobicContact CB-CG 4.3Å; P886-L889 HydrophobicContact CG-CD1 4.23Å; P886-L889 HydrophobicContact CG-CG 4.43Å; P886-L889 PolarHBondContact O-N 2.81Å; R887-L889 PolarHBondContact O-N 3.28Å; L889-P975 HydrophobicContact CD1-CB 4.17Å; L889-P975 HydrophobicContact CD2-CB 3.77Å; L889-L976 WeakPolarHBondContact CD2-O 3.13Å; L889-L977 HydrophobicContact CD2-CD1 4.38Å; L889-L977 HydrophobicContact CG-CD1 4.45Å
890	T	86.2	Confident	68.6	Low	11 Å²	11	56.4 Å²	56.4	7%	0.067	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-104.3	-1.7	178.7	67.8	0	0	0	0	113.2	L779 F836 T885 R887 S888 W892 L941	L779-T890 HydrophobicContact CD1-CG2 4.47Å; L779-T890 HydrophobicContact CD2-CG2 4.49Å; F836-T890 HydrophobicContact CE2-CG2 4.06Å; F836-T890 HydrophobicContact CZ-CG2 3.63Å; T885-T890 HydrophobicContact CG2-CG2 3.89Å; R887-T890 PolarHBondContact O-N 2.97Å; R887-T890 PolarHBondContact O-OG1 3.36Å; S888-T890 PolarHBondContact O-N 3.35Å; T890-W892 WeakPolarHBondContact O-CZ3 3.37Å; T890-W892 PolarHBondContact O-N 3.3Å; T890-L941 HydrophobicContact CG2-CD1 4.35Å; T890-L941 HydrophobicContact CG2-CD2 4.14Å
891	A	72.6	Confident	66	Low	31 Å²	31	59.2 Å²	59.2	26%	0.256	29%	0.287	S	S	.	.			trans	-77.4	110	178.6	0	0	0	0	0	109.9	L949	A891-L949 HydrophobicContact CB-CD1 4.45Å
892	W	69.8	Low	63.2	Low	33 Å²	33	65.2 Å²	65.2	13%	0.125	32%	0.315	C	S	.	.			trans	-110.2	150.1	166.3	72.1	89.8	0	0	0	109.8	Y772 T775 A831 M835 T890 I894	Y772-W892 HydrophobicContact CD2-CD2 4.26Å; Y772-W892 HydrophobicContact CD2-CZ2 4.36Å; Y772-W892 HydrophobicContact CE2-CH2 4.43Å; Y772-W892 HydrophobicContact CE2-CZ2 4.39Å; T775-W892 HydrophobicContact CG2-CB 4.47Å; T775-W892 WeakPolarHBondContact OG1-CB 3.34Å; A831-W892 HydrophobicContact CB-CH2 4.07Å; A831-W892 HydrophobicContact CB-CZ2 4.41Å; M835-W892 HydrophobicContact CE-CD2 3.73Å; M835-W892 HydrophobicContact CE-CE3 3.15Å; M835-W892 HydrophobicContact CE-CG 4.33Å; M835-W892 HydrophobicContact CE-CH2 4.36Å; M835-W892 HydrophobicContact CE-CZ3 3.52Å; M835-W892 HydrophobicContact SD-CE3 3.96Å; M835-W892 HydrophobicContact SD-CZ3 3.93Å; T890-W892 WeakPolarHBondContact O-CZ3 3.37Å; T890-W892 PolarHBondContact O-N 3.3Å; W892-I894 PolarHBondContact O-N 3Å
893	S	55.8	Low	60.3	Low	29 Å²	29	74.8 Å²	74.8	20%	0.203	36%	0.356	C	S	.	.			trans	-68.2	119.6	177.6	55	0	0	0	0	110.7	S771	S771-S893 WeakPolarHBondContact CB-OG 3.26Å; S771-S893 PolarHBondContact OG-N 3.27Å; S771-S893 VanDerWaalsContact OG-N 3.1Å; S771-S893 PolarHBondContact OG-OG 2.9Å
894	I	53.9	Low	57.5	Low	66 Å²	66	79.4 Å²	79.4	34%	0.338	39%	0.388	S	S	.	.			trans	-88.9	122.9	165.3	-59.4	167.9	0	0	0	106.1	P757 W892 N896	P757-I894 HydrophobicContact CB-CD1 4.12Å; P757-I894 HydrophobicContact CB-CG1 4.47Å; P757-I894 HydrophobicContact CB-CG2 3.84Å; P757-I894 HydrophobicContact CG-CD1 3.6Å; P757-I894 HydrophobicContact CG-CG1 4.03Å; P757-I894 HydrophobicContact CG-CG2 4.31Å; W892-I894 PolarHBondContact O-N 3Å; I894-N896 VanDerWaalsContact C-N 3.28Å; I894-N896 PolarHBondContact O-N 3.12Å
895	P	44.9	Very low	54.7	Low	29 Å²	29	86.6 Å²	86.6	19%	0.188	42%	0.423	C	S	.	.			trans	-62.9	85.5	175.4	-20.4	31.9	0	0	0	111.2	V767 R897	V767-P895 HydrophobicContact CB-CG 4.45Å; V767-P895 HydrophobicContact CG1-CG 4.05Å; P895-R897 PolarHBondContact O-N 3.49Å; P895-R897 VanDerWaalsContact O-N 3.1Å
896	N	44.4	Very low	51.7	Low	99 Å²	99	94.5 Å²	94.5	53%	0.529	46%	0.46	S	S	.	.			trans	-83.1	86.2	-178.2	-114.9	-7.7	0	0	0	109.8	I894 Q898	I894-N896 VanDerWaalsContact C-N 3.28Å; I894-N896 PolarHBondContact O-N 3.12Å; N896-Q898 PolarHBondContact O-N 3.05Å
897	R	36.7	Very low	48.8	Very low	196 Å²	196	102.4 Å²	102.4	74%	0.74	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-65.8	-21.5	171.2	-91.9	-166.3	-173.3	-175.3	4.6	113.3	P895 Y899 L900	P895-R897 PolarHBondContact O-N 3.49Å; P895-R897 VanDerWaalsContact O-N 3.1Å; R897-Y899 PolarHBondContact O-N 3.4Å; R897-L900 PolarHBondContact O-N 3.18Å
898	Q	36.7	Very low	46.2	Very low	164 Å²	164	107.8 Å²	107.8	77%	0.766	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-70.6	-25.8	-171.7	-72.4	-172.4	-8	0	0	114.3	N896	N896-Q898 PolarHBondContact O-N 3.05Å
899	Y	34.2	Very low	43.5	Very low	177 Å²	177	116.5 Å²	116.5	69%	0.694	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-84.8	-16.5	179.3	-92.5	-83.6	0	0	0	114.9	R897	R897-Y899 PolarHBondContact O-N 3.4Å
900	L	29.4	Very low	40.5	Very low	137 Å²	137	123.8 Å²	123.8	72%	0.717	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-26.9	-179.1	-103.5	145.7	0	0	0	113.1	R897	R897-L900 PolarHBondContact O-N 3.18Å
901	N	31.8	Very low	37.5	Very low	139 Å²	139	132.5 Å²	132.5	74%	0.743	64%	0.64	S	S	*	*	S	Bend	trans	-83	-19	-178.6	-78.1	-5.5	0	0	0	114.1
902	Q	33.6	Very low	35.2	Very low	151 Å²	151	136.7 Å²	136.7	71%	0.706	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-84.2	-12.2	-177.5	-141.8	167.8	8.4	0	0	113.5
903	K	30.2	Very low	33	Very low	201 Å²	201	143.3 Å²	143.3	87%	0.874	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-82.2	-11.7	174.7	-102.5	-176.9	177.9	176.9	0	114.6
904	C	30.1	Very low	31.4	Very low	106 Å²	106	149.8 Å²	149.8	72%	0.716	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-96.6	-0.4	179.2	-83.5	0	0	0	0	114.8
905	M	26.2	Very low	30	Very low	155 Å²	155	152.2 Å²	152.2	76%	0.764	74%	0.739	S	S	*	*	S	Bend	trans	-136.3	124	173	-75.1	-70.8	151.1	0	0	109.8
906	E	27.3	Very low	29	Very low	168 Å²	168	157.7 Å²	157.7	79%	0.785	77%	0.767	S	S	*	*			trans	85.3	80.2	169.3	-53.2	-169.8	158.4	0	0	117	K908	E906-K908 PolarHBondContact O-N 3.09Å
907	N	27.1	Very low	28.1	Very low	175 Å²	175	162.1 Å²	162.1	94%	0.936	78%	0.782	S	S	*	*			trans	-57.4	83.8	142.9	-77.8	-23.6	0	0	0	109.4
908	K	28.3	Very low	27.6	Very low	170 Å²	170	161.6 Å²	161.6	74%	0.739	79%	0.785	S	S	*	*			trans	-134.7	120.6	156	-79.5	-172.5	179	170.1	0	108.6	E906 L910	E906-K908 PolarHBondContact O-N 3.09Å; K908-L910 PolarHBondContact O-N 3.35Å
909	E	26	Very low	27	Very low	199 Å²	199	163.5 Å²	163.5	93%	0.93	79%	0.785	S	S	*	*			trans	-49.1	95.9	179.1	-63.8	171.5	155.5	0	0	110.8	K911	E909-K911 PolarHBondContact O-N 3.11Å
910	L	25.3	Very low	26.7	Very low	163 Å²	163	161.3 Å²	161.3	85%	0.853	79%	0.786	S	S	*	*			trans	-73.3	108.1	168.8	-107.1	117.2	0	0	0	107.8	K908 V912	K908-L910 PolarHBondContact O-N 3.35Å; L910-V912 PolarHBondContact O-N 3.28Å
911	K	23	Very low	26.7	Very low	194 Å²	194	161.3 Å²	161.3	84%	0.843	78%	0.782	S	S	*	*			trans	-55.4	118.4	167.4	-74.2	179.2	176.2	177.9	0	108.5	E909 E913	E909-K911 PolarHBondContact O-N 3.11Å; K911-E913 VanDerWaalsContact C-N 3.35Å; K911-E913 PolarHBondContact O-N 3.04Å
912	V	25.2	Very low	26.7	Very low	120 Å²	120	160.2 Å²	160.2	73%	0.727	79%	0.785	S	S	*	*			trans	-64.7	94.2	174	-180	0	0	0	0	107.7	L910 H914	L910-V912 PolarHBondContact O-N 3.28Å; V912-H914 PolarHBondContact O-N 3.34Å
913	E	22.4	Very low	26.8	Very low	171 Å²	171	157.5 Å²	157.5	80%	0.799	78%	0.782	S	S	*	*			trans	-66.8	115	163.4	-76.4	-171.5	163.7	0	0	107.5	K911 V915	K911-E913 VanDerWaalsContact C-N 3.35Å; K911-E913 PolarHBondContact O-N 3.04Å; E913-V915 VanDerWaalsContact C-N 3.26Å; E913-V915 PolarHBondContact O-N 3.21Å
914	H	23.5	Very low	27.1	Very low	166 Å²	166	152 Å²	152	77%	0.769	77%	0.774	S	S	*	*			trans	-60.3	86.6	174.9	-75.9	-83.7	0	0	0	109.9	V912 N916	V912-H914 PolarHBondContact O-N 3.34Å; H914-N916 VanDerWaalsContact C-N 3.29Å; H914-N916 PolarHBondContact O-N 3.43Å
915	V	24.5	Very low	27.9	Very low	117 Å²	117	149.1 Å²	149.1	71%	0.709	76%	0.755	S	S	*	*			trans	-66.3	97.2	161.9	179.7	0	0	0	0	106.2	E913 F917	E913-V915 VanDerWaalsContact C-N 3.26Å; E913-V915 PolarHBondContact O-N 3.21Å; V915-F917 VanDerWaalsContact C-N 3.34Å; V915-F917 PolarHBondContact O-N 3.12Å
916	N	22.6	Very low	29.4	Very low	143 Å²	143	146.3 Å²	146.3	77%	0.765	74%	0.744	S	S	*	*			trans	-56.6	95.5	172.4	-84.8	-31.6	0	0	0	109.1	H914 K918	H914-N916 VanDerWaalsContact C-N 3.29Å; H914-N916 PolarHBondContact O-N 3.43Å; N916-K918 PolarHBondContact O-N 3.04Å
917	F	25.3	Very low	31.3	Very low	193 Å²	193	140.1 Å²	140.1	85%	0.846	71%	0.714	S	S	*	*			trans	-60.3	92.3	158.8	-85.4	-87.2	0	0	0	107.2	V915 R919	V915-F917 VanDerWaalsContact C-N 3.34Å; V915-F917 PolarHBondContact O-N 3.12Å; F917-R919 VanDerWaalsContact C-N 3.35Å; F917-R919 PolarHBondContact O-N 2.98Å
918	K	26.2	Very low	33.1	Very low	184 Å²	184	133.8 Å²	133.8	80%	0.8	68%	0.677	S	S	*	*			trans	-57	106.9	158.9	-80	-174.9	175.4	-178.7	0	105.8	N916 N920	N916-K918 PolarHBondContact O-N 3.04Å; K918-N920 PolarHBondContact O-N 2.83Å
919	R	25.5	Very low	34.8	Very low	205 Å²	205	131.3 Å²	131.3	77%	0.774	67%	0.669	S	S	*	*			trans	-52.8	102.7	167.7	-84	-176.3	179.3	176.8	1.1	107.2	F917 E921	F917-R919 VanDerWaalsContact C-N 3.35Å; F917-R919 PolarHBondContact O-N 2.98Å; R919-E921 HydrophobicContact CB-CG 4.25Å; R919-E921 WeakPolarHBondContact CD-OE1 3.25Å; R919-E921 IonicContact NH1-OE1 3.6Å; R919-E921 PolarHBondContact NH1-OE1 2.95Å; R919-E921 PolarHBondContact O-N 3.28Å
920	N	27.3	Very low	36.7	Very low	131 Å²	131	124.7 Å²	124.7	70%	0.701	64%	0.635	S	S	*	*			trans	-71.2	76.7	164.7	-77.7	-14.6	0	0	0	107.3	K918 S922	K918-N920 PolarHBondContact O-N 2.83Å; N920-S922 PolarHBondContact O-N 2.81Å
921	E	30.3	Very low	38.7	Very low	137 Å²	137	118.5 Å²	118.5	64%	0.64	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-73.5	-2.8	169.6	-83.7	172.7	-170.3	0	0	111.8	R919 S923	R919-E921 HydrophobicContact CB-CG 4.25Å; R919-E921 WeakPolarHBondContact CD-OE1 3.25Å; R919-E921 IonicContact NH1-OE1 3.6Å; R919-E921 PolarHBondContact NH1-OE1 2.95Å; R919-E921 PolarHBondContact O-N 3.28Å; E921-S923 VanDerWaalsContact C-N 3.35Å; E921-S923 PolarHBondContact O-N 2.61Å
922	S	31.6	Very low	40.7	Very low	115 Å²	115	111.8 Å²	111.8	80%	0.804	58%	0.578	S	S	*	*	G	3₁₀ helix	trans	-80.2	0.8	-173.7	51.4	0	0	0	0	116.2	N920	N920-S922 PolarHBondContact O-N 2.81Å
923	S	36	Very low	42.6	Very low	94 Å²	94	108.8 Å²	108.8	66%	0.657	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-111.4	12.5	176.6	66.9	0	0	0	0	114.7	E921 S925	E921-S923 VanDerWaalsContact C-N 3.35Å; E921-S923 PolarHBondContact O-N 2.61Å; S923-S925 PolarHBondContact O-N 3.24Å
924	A	36.1	Very low	44.5	Very low	85 Å²	85	106.2 Å²	106.2	70%	0.702	55%	0.55	S	S	*	*			trans	-72.8	55.1	176.9	0	0	0	0	0	112.5	D926	A924-D926 PolarHBondContact O-N 3.47Å
925	S	47.5	Very low	46.5	Very low	46 Å²	46	101.4 Å²	101.4	32%	0.322	53%	0.53	S	S	.	.			trans	-55.2	128.1	154.5	167.8	0	0	0	0	107.2	S923 F927 E929 R930	S923-S925 PolarHBondContact O-N 3.24Å; S925-F927 PolarHBondContact O-N 3.13Å; S925-E929 WeakPolarHBondContact OG-CB 3.46Å; S925-E929 PolarHBondContact OG-OE2 3.31Å; S925-R930 PolarHBondContact O-NE 3.37Å; S925-R930 PolarHBondContact O-NH2 2.91Å
926	D	57.6	Low	49.2	Very low	97 Å²	97	96.5 Å²	96.5	52%	0.519	50%	0.502	S	S	.	.			trans	-53.1	136.5	-176	-158.9	-2.8	0	0	0	108.4	A924 Y928 E929 R930	A924-D926 PolarHBondContact O-N 3.47Å; D926-Y928 PolarHBondContact O-N 3.3Å; D926-E929 HydrophobicContact CB-CG 4.31Å; D926-E929 PolarHBondContact O-N 3.28Å; D926-R930 PolarHBondContact O-N 2.89Å
927	F	66	Low	52.3	Low	38 Å²	38	90.7 Å²	90.7	17%	0.167	47%	0.469	C	S	.	.	H	α-helix	trans	-49.1	-32.2	-176.5	165.8	-98.6	0	0	0	111.8	S925 L931 R988	S925-F927 PolarHBondContact O-N 3.13Å; F927-L931 HydrophobicContact CD1-CD1 3.92Å; F927-L931 HydrophobicContact CE1-CD1 3.14Å; F927-L931 HydrophobicContact CE1-CG 4.08Å; F927-L931 HydrophobicContact CE2-CD1 4.17Å; F927-L931 HydrophobicContact CE2-CG 4.28Å; F927-L931 HydrophobicContact CZ-CD1 3.27Å; F927-L931 HydrophobicContact CZ-CD2 4.29Å; F927-L931 HydrophobicContact CZ-CG 3.82Å; F927-L931 PolarHBondContact O-N 3.31Å; F927-R988 HydrophobicContact CD1-CG 4.21Å; F927-R988 HydrophobicContact CE1-CG 4.37Å; F927-R988 VanDerWaalsContact CE1-NE 3.26Å; F927-R988 VanDerWaalsContact CZ-NH2 3.35Å
928	Y	64.7	Low	55.3	Low	41 Å²	41	81.5 Å²	81.5	16%	0.161	43%	0.429	C	S	.	.	H	α-helix	trans	-71.5	-38.9	177.5	-64.1	-61.6	0	0	0	115.2	D926 R930 L931 T932 R988 P989 D990 L1089	D926-Y928 PolarHBondContact O-N 3.3Å; Y928-R930 VanDerWaalsContact C-N 3.28Å; Y928-R930 PolarHBondContact O-N 3.43Å; Y928-L931 HydrophobicContact CD1-CD1 4.41Å; Y928-L931 PolarHBondContact O-N 3.45Å; Y928-T932 PolarHBondContact O-N 2.69Å; Y928-T932 PolarHBondContact O-OG1 2.8Å; Y928-R988 WeakPolarHBondContact OH-CA 3.49Å; Y928-R988 WeakPolarHBondContact OH-CB 3.11Å; Y928-P989 HydrophobicContact CE1-CG 4.37Å; Y928-P989 HydrophobicContact CE2-CG 3.92Å; Y928-P989 WeakPolarHBondContact OH-CD 3.17Å; Y928-P989 VanDerWaalsContact OH-CG 3.23Å; Y928-P989 WeakPolarHBondContact OH-CG 3.43Å; Y928-P989 VanDerWaalsContact OH-N 3.17Å; Y928-D990 PolarHBondContact OH-OD1 3.1Å; Y928-L1089 HydrophobicContact CD1-CD1 3.67Å; Y928-L1089 HydrophobicContact CD1-CD2 3.43Å; Y928-L1089 VanDerWaalsContact CD1-CD2 3.43Å; Y928-L1089 HydrophobicContact CD1-CG 4.18Å; Y928-L1089 HydrophobicContact CE1-CD1 3.39Å; Y928-L1089 HydrophobicContact CE1-CD2 4.03Å; Y928-L1089 HydrophobicContact CE1-CG 4.33Å; Y928-L1089 HydrophobicContact CG-CD2 4.29Å
929	E	64.5	Low	58	Low	118 Å²	118	75.9 Å²	75.9	55%	0.551	41%	0.408	S	S	*	.	H	α-helix	trans	-60.6	-44	175.7	-73.6	-177.6	159.2	0	0	110.3	S925 D926 L931 T932 S933	S925-E929 WeakPolarHBondContact OG-CB 3.46Å; S925-E929 PolarHBondContact OG-OE2 3.31Å; D926-E929 HydrophobicContact CB-CG 4.31Å; D926-E929 PolarHBondContact O-N 3.28Å; E929-L931 PolarHBondContact O-N 3.16Å; E929-T932 PolarHBondContact O-N 3.08Å; E929-T932 PolarHBondContact O-OG1 3.16Å; E929-S933 PolarHBondContact O-N 2.86Å; E929-S933 PolarHBondContact O-OG 2.84Å
930	R	66.3	Low	60.8	Low	61 Å²	61	68.7 Å²	68.7	23%	0.23	38%	0.383	C	S	.	.	H	α-helix	trans	-63.5	-37.8	177.4	-72.4	-175	-81.3	165.2	-6.1	113.6	L883 S925 D926 Y928 T932 S933 A936	L883-R930 HydrophobicContact CD2-CB 4.48Å; S925-R930 PolarHBondContact O-NE 3.37Å; S925-R930 PolarHBondContact O-NH2 2.91Å; D926-R930 PolarHBondContact O-N 2.89Å; Y928-R930 VanDerWaalsContact C-N 3.28Å; Y928-R930 PolarHBondContact O-N 3.43Å; R930-T932 VanDerWaalsContact C-N 3.28Å; R930-T932 PolarHBondContact O-N 3.41Å; R930-S933 PolarHBondContact O-OG 2.97Å; R930-A936 WeakPolarHBondContact O-CB 3.12Å
931	L	67.6	Low	63.5	Low	32 Å²	32	63 Å²	63	17%	0.168	35%	0.352	C	S	.	.	H	α-helix	trans	-68.3	-28.8	176.2	-84.3	173.5	0	0	0	113.1	L883 A884 F927 Y928 E929	L883-L931 HydrophobicContact CB-CD2 4.43Å; A884-L931 HydrophobicContact CB-CD2 4.25Å; F927-L931 HydrophobicContact CD1-CD1 3.92Å; F927-L931 HydrophobicContact CE1-CD1 3.14Å; F927-L931 HydrophobicContact CE1-CG 4.08Å; F927-L931 HydrophobicContact CE2-CD1 4.17Å; F927-L931 HydrophobicContact CE2-CG 4.28Å; F927-L931 HydrophobicContact CZ-CD1 3.27Å; F927-L931 HydrophobicContact CZ-CD2 4.29Å; F927-L931 HydrophobicContact CZ-CG 3.82Å; F927-L931 PolarHBondContact O-N 3.31Å; Y928-L931 HydrophobicContact CD1-CD1 4.41Å; Y928-L931 PolarHBondContact O-N 3.45Å; E929-L931 PolarHBondContact O-N 3.16Å
932	T	64.5	Low	65.8	Low	54 Å²	54	59.4 Å²	59.4	33%	0.331	34%	0.336	S	S	.	.	H	α-helix	trans	-87.9	-22.2	-178.7	53.7	0	0	0	0	113.5	Y928 E929 R930 K1092	Y928-T932 PolarHBondContact O-N 2.69Å; Y928-T932 PolarHBondContact O-OG1 2.8Å; E929-T932 PolarHBondContact O-N 3.08Å; E929-T932 PolarHBondContact O-OG1 3.16Å; R930-T932 VanDerWaalsContact C-N 3.28Å; R930-T932 PolarHBondContact O-N 3.41Å; T932-K1092 HydrophobicContact CG2-CB 3.86Å
933	S	64.6	Low	67.4	Low	57 Å²	57	57.7 Å²	57.7	40%	0.399	32%	0.323	S	S	.	.	S	Bend	trans	-74.8	129.7	179.8	55.8	0	0	0	0	111.8	E929 R930 N935 A936	E929-S933 PolarHBondContact O-N 2.86Å; E929-S933 PolarHBondContact O-OG 2.84Å; R930-S933 PolarHBondContact O-OG 2.97Å; S933-N935 PolarHBondContact O-N 2.82Å; S933-A936 PolarHBondContact O-N 2.95Å; S933-A936 WeakPolarHBondContact OG-CB 3.41Å
934	Q	63	Low	68.2	Low	116 Å²	116	59.8 Å²	59.8	54%	0.542	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	124.2	177.3	-169.6	172.6	-0.8	0	0	109.1
935	N	65.9	Low	68.6	Low	65 Å²	65	59.5 Å²	59.5	35%	0.348	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	30.4	-178	-53.2	-36.9	0	0	0	115.4	S933	S933-N935 PolarHBondContact O-N 2.82Å
936	A	80.4	Confident	68.2	Low	14 Å²	14	63.2 Å²	63.2	12%	0.116	33%	0.331	C	S	.	.			trans	-56.9	145.1	171.6	0	0	0	0	0	111.8	L883 R930 S933	L883-A936 HydrophobicContact CD1-CB 3.56Å; L883-A936 WeakPolarHBondContact CD1-O 3.07Å; L883-A936 HydrophobicContact CD2-CB 4.05Å; L883-A936 HydrophobicContact CG-CB 4.43Å; R930-A936 WeakPolarHBondContact O-CB 3.12Å; S933-A936 PolarHBondContact O-N 2.95Å; S933-A936 WeakPolarHBondContact OG-CB 3.41Å
937	W	88.1	Confident	67.2	Low	21 Å²	21	63.7 Å²	63.7	8%	0.08	33%	0.33	C	S	.	.			trans	-91.9	137.7	-177.7	-161.4	-99.1	0	0	0	111.6	R602 T825 P828 G829 L833 L879 L883 D939 E942	R602-W937 HydrophobicContact CB-CD2 3.95Å; R602-W937 HydrophobicContact CB-CE3 3.66Å; R602-W937 HydrophobicContact CB-CH2 4.19Å; R602-W937 HydrophobicContact CB-CZ2 4.42Å; R602-W937 HydrophobicContact CB-CZ3 3.8Å; R602-W937 HydrophobicContact CG-CD2 3.52Å; R602-W937 VanDerWaalsContact CG-CE2 3.46Å; R602-W937 HydrophobicContact CG-CE3 3.72Å; R602-W937 HydrophobicContact CG-CG 4.1Å; R602-W937 HydrophobicContact CG-CH2 3.79Å; R602-W937 HydrophobicContact CG-CZ2 3.57Å; R602-W937 HydrophobicContact CG-CZ3 3.86Å; R602-W937 VanDerWaalsContact NE-CD1 3.33Å; R602-W937 VanDerWaalsContact NE-NE1 3.15Å; T825-W937 HydrophobicContact CG2-CH2 4.05Å; T825-W937 HydrophobicContact CG2-CZ3 4.17Å; P828-W937 HydrophobicContact CB-CH2 4.5Å; P828-W937 HydrophobicContact CB-CZ2 4.38Å; P828-W937 HydrophobicContact CG-CH2 4.13Å; P828-W937 HydrophobicContact CG-CZ2 4.46Å; G829-W937 VanDerWaalsContact CA-CZ2 3.4Å; L833-W937 HydrophobicContact CD2-CH2 4.44Å; L879-W937 HydrophobicContact CD2-CE3 3.97Å; L879-W937 HydrophobicContact CD2-CZ3 4.03Å; L883-W937 WeakPolarHBondContact CD2-O 3.19Å; W937-D939 VanDerWaalsContact CD1-OD1 3.31Å; W937-D939 PolarHBondContact O-N 3.15Å; W937-E942 PolarHBondContact NE1-OE1 2.85Å
938	P	88.2	Confident	65.6	Low	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.35	C	S	.	.			trans	-79.4	61.8	-179.6	34.5	-37.6	0	0	0	112.4	L833 L879 A882 L883 H940 L941	L833-P938 HydrophobicContact CD1-CG 4.48Å; L879-P938 HydrophobicContact CD2-CG 4.44Å; A882-P938 HydrophobicContact CB-CB 3.75Å; A882-P938 HydrophobicContact CB-CG 3.85Å; L883-P938 HydrophobicContact CD2-CB 4.37Å; P938-H940 PolarHBondContact O-N 3.09Å; P938-H940 VanDerWaalsContact O-N 3.15Å; P938-L941 HydrophobicContact CB-CD1 4.09Å; P938-L941 HydrophobicContact CB-CG 4.31Å; P938-L941 PolarHBondContact O-N 3.37Å
939	D	83.5	Confident	64.4	Low	67 Å²	67	67.4 Å²	67.4	36%	0.358	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-56.3	-31.5	-177.6	-70	-45.6	0	0	0	113.6	R602 W937 L941 E942	R602-D939 IonicContact CZ-OD1 3.38Å; R602-D939 IonicContact NH1-OD1 3.12Å; R602-D939 PolarHBondContact NH1-OD1 3.43Å; R602-D939 IonicContact NH1-OD2 2.75Å; R602-D939 IonicContact NH2-OD1 2.71Å; R602-D939 PolarHBondContact NH2-OD1 3.31Å; W937-D939 VanDerWaalsContact CD1-OD1 3.31Å; W937-D939 PolarHBondContact O-N 3.15Å; D939-L941 PolarHBondContact O-N 2.67Å; D939-E942 PolarHBondContact O-N 3.03Å; D939-E942 VanDerWaalsContact O-N 3.1Å
940	H	83.4	Confident	62.9	Low	54 Å²	54	67.8 Å²	67.8	25%	0.25	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-66.6	-17.4	-179.9	67.1	-69.6	0	0	0	113.3	A882 T885 R887 P938	A882-H940 PolarHBondContact O-CE1 3.33Å; T885-H940 PolarHBondContact O-NE2 3.47Å; R887-H940 WeakPolarHBondContact CD-O 3.4Å; P938-H940 PolarHBondContact O-N 3.09Å; P938-H940 VanDerWaalsContact O-N 3.15Å
941	L	84.1	Confident	61.3	Low	11 Å²	11	70.5 Å²	70.5	6%	0.058	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-89.8	-8.1	176.1	-60.7	-175.1	0	0	0	113.3	P830 F836 A882 R887 T890 P938 D939	P830-L941 HydrophobicContact CB-CB 4.27Å; P830-L941 WeakPolarHBondContact CB-O 3.49Å; P830-L941 HydrophobicContact CG-CB 3.89Å; F836-L941 HydrophobicContact CE2-CD1 3.76Å; F836-L941 HydrophobicContact CZ-CD1 4.15Å; A882-L941 HydrophobicContact CB-CD1 4Å; R887-L941 HydrophobicContact CB-CD2 4.12Å; R887-L941 HydrophobicContact CG-CD2 4.3Å; T890-L941 HydrophobicContact CG2-CD1 4.35Å; T890-L941 HydrophobicContact CG2-CD2 4.14Å; P938-L941 HydrophobicContact CB-CD1 4.09Å; P938-L941 HydrophobicContact CB-CG 4.31Å; P938-L941 PolarHBondContact O-N 3.37Å; D939-L941 PolarHBondContact O-N 2.67Å
942	E	78.2	Confident	59.9	Low	62 Å²	62	71.2 Å²	71.2	29%	0.29	38%	0.381	S	S	.	.			trans	-84.9	-21.3	-176.1	-66.1	-170.3	166.3	0	0	114.4	R602 P830 W937 D939 D944	R602-E942 IonicContact CZ-OE1 3.44Å; R602-E942 IonicContact CZ-OE2 2.85Å; R602-E942 IonicContact NE-OE1 3.16Å; R602-E942 IonicContact NH2-OE1 2.88Å; R602-E942 PolarHBondContact NH2-OE1 2.56Å; R602-E942 IonicContact NH2-OE2 2.85Å; R602-E942 PolarHBondContact NH2-OE2 2.93Å; P830-E942 HydrophobicContact CB-CG 4.27Å; P830-E942 HydrophobicContact CG-CG 4.32Å; W937-E942 PolarHBondContact NE1-OE1 2.85Å; D939-E942 PolarHBondContact O-N 3.03Å; D939-E942 VanDerWaalsContact O-N 3.1Å; E942-D944 PolarHBondContact O-N 3.37Å
943	C	64.8	Low	58.8	Low	78 Å²	78	71.1 Å²	71.1	53%	0.527	38%	0.378	S	S	.	.	S	Bend	trans	-64.4	131.2	174.7	-62.8	0	0	0	0	109.3	R887 F945	R887-C943 PolarHBondContact NE-O 2.68Å; R887-C943 PolarHBondContact NH2-O 3.3Å; C943-F945 PolarHBondContact O-N 3.37Å
944	D	54.4	Low	57.9	Low	139 Å²	139	71 Å²	71	74%	0.743	37%	0.372	S	S	*	.			trans	-65.7	133.2	174.5	-76.1	-35.7	0	0	0	110.5	R887 E942 T946	R887-D944 PolarHBondContact NH2-O 2.9Å; E942-D944 PolarHBondContact O-N 3.37Å; D944-T946 HydrophobicContact CB-CG2 4.17Å; D944-T946 PolarHBondContact O-N 2.95Å
945	F	43.8	Very low	56.9	Low	78 Å²	78	69.7 Å²	69.7	34%	0.342	37%	0.369	S	S	.	.			trans	-76.9	77.8	174.8	-144.2	-83.1	0	0	0	107.4	R887 C943 E947 L949	R887-F945 HydrophobicContact CG-CD2 4.32Å; R887-F945 VanDerWaalsContact NH2-CA 3.32Å; R887-F945 VanDerWaalsContact NH2-N 3.13Å; C943-F945 PolarHBondContact O-N 3.37Å; F945-E947 VanDerWaalsContact C-N 3.31Å; F945-E947 WeakPolarHBondContact CD1-O 3.38Å; F945-E947 HydrophobicContact CE1-CB 4.46Å; F945-E947 VanDerWaalsContact CE1-O 3.24Å; F945-E947 WeakPolarHBondContact CE1-O 3.37Å; F945-L949 HydrophobicContact CD1-CD1 4.13Å; F945-L949 HydrophobicContact CE1-CD1 3.51Å; F945-L949 HydrophobicContact CZ-CD1 3.95Å
946	T	39.1	Very low	56.1	Low	125 Å²	125	69.4 Å²	69.4	77%	0.767	37%	0.37	S	S	*	.			trans	-76.7	-19.7	178.9	52.2	0	0	0	0	112.8	D944 S948	D944-T946 HydrophobicContact CB-CG2 4.17Å; D944-T946 PolarHBondContact O-N 2.95Å; T946-S948 PolarHBondContact O-N 3.15Å; T946-S948 VanDerWaalsContact O-N 3.17Å
947	E	36.8	Very low	54.8	Low	106 Å²	106	68.9 Å²	68.9	50%	0.495	37%	0.365	S	S	.	.	S	Bend	trans	-76	107.2	171.1	-76	176.9	-175.2	0	0	107.8	F945 L949 K980	F945-E947 VanDerWaalsContact C-N 3.31Å; F945-E947 WeakPolarHBondContact CD1-O 3.38Å; F945-E947 HydrophobicContact CE1-CB 4.46Å; F945-E947 VanDerWaalsContact CE1-O 3.24Å; F945-E947 WeakPolarHBondContact CE1-O 3.37Å; E947-L949 VanDerWaalsContact C-N 3.35Å; E947-L949 PolarHBondContact O-N 3.29Å; E947-K980 IonicContact OE1-NZ 3.28Å; E947-K980 PolarHBondContact OE1-NZ 3.5Å; E947-K980 WeakPolarHBondContact OE2-CE 3.33Å; E947-K980 IonicContact OE2-NZ 3.11Å; E947-K980 PolarHBondContact OE2-NZ 2.97Å
948	S	32.5	Very low	53.3	Low	84 Å²	84	69.8 Å²	69.8	59%	0.587	38%	0.375	S	S	*	.			trans	-37.2	96.6	163.9	52.6	0	0	0	0	111.3	T946 E950	T946-S948 PolarHBondContact O-N 3.15Å; T946-S948 VanDerWaalsContact O-N 3.17Å; S948-E950 PolarHBondContact O-N 3.36Å
949	L	37.7	Very low	51.8	Low	74 Å²	74	73.5 Å²	73.5	39%	0.387	40%	0.395	S	S	.	.				-57.9	87.7	123.4	-91.7	116.5	0	0	0	102.6	A891 F945 E947 Y951 D953	A891-L949 HydrophobicContact CB-CD1 4.45Å; F945-L949 HydrophobicContact CD1-CD1 4.13Å; F945-L949 HydrophobicContact CE1-CD1 3.51Å; F945-L949 HydrophobicContact CZ-CD1 3.95Å; E947-L949 VanDerWaalsContact C-N 3.35Å; E947-L949 PolarHBondContact O-N 3.29Å; L949-Y951 PolarHBondContact O-N 2.97Å; L949-D953 HydrophobicContact CD2-CB 4.07Å
950	E	33.4	Very low	50.7	Low	125 Å²	125	71.9 Å²	71.9	58%	0.584	39%	0.387	S	S	*	.			trans	-48.9	139.1	172.5	-75.5	-173.1	161.6	0	0	105	S948 S952 D953	S948-E950 PolarHBondContact O-N 3.36Å; E950-S952 WeakPolarHBondContact CB-OG 3.29Å; E950-S952 CarbonylContact O-C 3.59Å; E950-S952 PolarHBondContact O-N 3Å; E950-S952 PolarHBondContact O-OG 2.76Å; E950-S952 PolarHBondContact OE2-OG 3.49Å; E950-D953 PolarHBondContact O-N 3.07Å
951	Y	33.2	Very low	49.7	Very low	119 Å²	119	69.9 Å²	69.9	47%	0.467	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-22.9	177.9	-136.5	-92.4	0	0	0	112.4	L949 D953	L949-Y951 PolarHBondContact O-N 2.97Å; Y951-D953 PolarHBondContact O-N 3.33Å
952	S	39.3	Very low	48.7	Very low	47 Å²	47	76.5 Å²	76.5	33%	0.329	41%	0.41	S	S	.	.	H	α-helix	trans	-51.4	-42.3	168.3	52.9	0	0	0	0	114.1	E950 I954 D955 V956	E950-S952 WeakPolarHBondContact CB-OG 3.29Å; E950-S952 CarbonylContact O-C 3.59Å; E950-S952 PolarHBondContact O-N 3Å; E950-S952 PolarHBondContact O-OG 2.76Å; E950-S952 PolarHBondContact OE2-OG 3.49Å; S952-I954 PolarHBondContact O-N 2.84Å; S952-D955 PolarHBondContact O-N 3.16Å; S952-V956 WeakPolarHBondContact O-CA 3.45Å; S952-V956 WeakPolarHBondContact O-CB 3.2Å; S952-V956 WeakPolarHBondContact O-CG2 3.47Å; S952-V956 PolarHBondContact O-N 3.22Å
953	D	40.7	Very low	48	Very low	52 Å²	52	81.9 Å²	81.9	28%	0.278	43%	0.432	S	S	.	.	H	α-helix	trans	-74	-32.2	-165.1	-76.9	-22.5	0	0	0	115.6	L949 E950 Y951 A957 F1142	L949-D953 HydrophobicContact CD2-CB 4.07Å; E950-D953 PolarHBondContact O-N 3.07Å; Y951-D953 PolarHBondContact O-N 3.33Å; D953-A957 WeakPolarHBondContact O-CB 3.37Å; D953-A957 PolarHBondContact O-N 2.72Å; D953-F1142 HydrophobicContact CB-CE1 4.16Å; D953-F1142 HydrophobicContact CB-CZ 4.42Å
954	I	45.5	Very low	48.2	Very low	53 Å²	53	80.6 Å²	80.6	27%	0.272	42%	0.42	S	S	.	.	H	α-helix	trans	-80.3	-37.1	176.2	-62.5	174.3	0	0	0	111	S952 V956 A957 S958	S952-I954 PolarHBondContact O-N 2.84Å; I954-V956 VanDerWaalsContact C-N 3.31Å; I954-A957 WeakPolarHBondContact O-CB 3.38Å; I954-A957 PolarHBondContact O-N 3.44Å; I954-S958 PolarHBondContact O-N 3.27Å
955	D	42.9	Very low	49	Very low	89 Å²	89	79.8 Å²	79.8	48%	0.476	42%	0.416	S	S	.	.	H	α-helix	trans	-67.7	-35.4	170.4	-80.8	-17.4	0	0	0	110.5	S952 S958 N959	S952-D955 PolarHBondContact O-N 3.16Å; D955-S958 PolarHBondContact O-N 2.81Å; D955-S958 PolarHBondContact O-OG 3.35Å; D955-N959 WeakPolarHBondContact O-CB 3.45Å; D955-N959 VanDerWaalsContact O-CG 3.29Å; D955-N959 PolarHBondContact O-N 2.92Å; D955-N959 PolarHBondContact O-ND2 3.37Å
956	V	47.3	Very low	50.6	Low	59 Å²	59	76.8 Å²	76.8	36%	0.358	40%	0.403	S	S	.	.	H	α-helix	trans	-61.1	-43.7	168.1	166.7	0	0	0	0	109.2	S952 I954 S958 N959 V960	S952-V956 WeakPolarHBondContact O-CA 3.45Å; S952-V956 WeakPolarHBondContact O-CB 3.2Å; S952-V956 WeakPolarHBondContact O-CG2 3.47Å; S952-V956 PolarHBondContact O-N 3.22Å; I954-V956 VanDerWaalsContact C-N 3.31Å; V956-S958 VanDerWaalsContact C-N 3.3Å; V956-S958 PolarHBondContact O-N 3.02Å; V956-N959 CarbonylContact O-C 3.56Å; V956-N959 PolarHBondContact O-N 3.39Å; V956-V960 HydrophobicContact CG1-CG2 3.74Å; V956-V960 WeakPolarHBondContact O-CA 3.24Å; V956-V960 WeakPolarHBondContact O-CB 3.42Å; V956-V960 WeakPolarHBondContact O-CG2 3.49Å; V956-V960 PolarHBondContact O-N 2.84Å
957	A	53	Low	52.3	Low	3 Å²	3	73.2 Å²	73.2	3%	0.025	38%	0.383	C	S	.	.	H	α-helix	trans	-61.1	-37.7	175.7	0	0	0	0	0	112.3	D953 I954 C961 F971	D953-A957 WeakPolarHBondContact O-CB 3.37Å; D953-A957 PolarHBondContact O-N 2.72Å; I954-A957 WeakPolarHBondContact O-CB 3.38Å; I954-A957 PolarHBondContact O-N 3.44Å; A957-C961 WeakPolarHBondContact O-CB 3.49Å; A957-C961 PolarHBondContact O-N 3.22Å; A957-C961 PolarHBondContact O-SG 3.35Å; A957-F971 HydrophobicContact CB-CE2 4.04Å
958	S	57.6	Low	54.4	Low	41 Å²	41	71.6 Å²	71.6	29%	0.287	38%	0.384	S	S	.	.	H	α-helix	trans	-67.5	-43.5	173.5	85.3	0	0	0	0	112.3	I954 D955 V956 V960 C961 E962	I954-S958 PolarHBondContact O-N 3.27Å; D955-S958 PolarHBondContact O-N 2.81Å; D955-S958 PolarHBondContact O-OG 3.35Å; V956-S958 VanDerWaalsContact C-N 3.3Å; V956-S958 PolarHBondContact O-N 3.02Å; S958-V960 VanDerWaalsContact C-N 3.32Å; S958-V960 PolarHBondContact O-N 2.79Å; S958-C961 WeakPolarHBondContact O-CB 3.45Å; S958-C961 PolarHBondContact O-N 3.31Å; S958-E962 PolarHBondContact O-N 3.42Å
959	N	56.8	Low	56.7	Low	78 Å²	78	69.5 Å²	69.5	42%	0.417	37%	0.366	S	S	.	.	H	α-helix	trans	-65.8	-35.5	176.2	-74.5	-35.3	0	0	0	111.8	D955 V956 K963	D955-N959 WeakPolarHBondContact O-CB 3.45Å; D955-N959 VanDerWaalsContact O-CG 3.29Å; D955-N959 PolarHBondContact O-N 2.92Å; D955-N959 PolarHBondContact O-ND2 3.37Å; V956-N959 CarbonylContact O-C 3.56Å; V956-N959 PolarHBondContact O-N 3.39Å; N959-K963 VanDerWaalsContact O-CB 3.26Å; N959-K963 WeakPolarHBondContact O-CB 3.5Å; N959-K963 WeakPolarHBondContact O-CG 3.18Å; N959-K963 PolarHBondContact O-N 2.89Å
960	V	60.9	Low	58.8	Low	32 Å²	32	66 Å²	66	19%	0.194	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-42.9	174.4	166.5	0	0	0	0	108.9	V956 S958 K963 L964	V956-V960 HydrophobicContact CG1-CG2 3.74Å; V956-V960 WeakPolarHBondContact O-CA 3.24Å; V956-V960 WeakPolarHBondContact O-CB 3.42Å; V956-V960 WeakPolarHBondContact O-CG2 3.49Å; V956-V960 PolarHBondContact O-N 2.84Å; S958-V960 VanDerWaalsContact C-N 3.32Å; S958-V960 PolarHBondContact O-N 2.79Å; V960-K963 PolarHBondContact O-N 3.45Å; V960-L964 HydrophobicContact CG1-CD1 3.46Å; V960-L964 VanDerWaalsContact CG1-CD1 3.46Å; V960-L964 HydrophobicContact CG1-CG 4.09Å; V960-L964 WeakPolarHBondContact O-CB 3.35Å; V960-L964 VanDerWaalsContact O-CG 3.24Å; V960-L964 WeakPolarHBondContact O-CG 3.03Å; V960-L964 PolarHBondContact O-N 2.85Å
961	C	60.7	Low	61.1	Low	13 Å²	13	61.8 Å²	61.8	9%	0.088	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-44.2	173.8	-81.5	0	0	0	0	113.5	A957 S958 L964 N965 I966 F971	A957-C961 WeakPolarHBondContact O-CB 3.49Å; A957-C961 PolarHBondContact O-N 3.22Å; A957-C961 PolarHBondContact O-SG 3.35Å; S958-C961 WeakPolarHBondContact O-CB 3.45Å; S958-C961 PolarHBondContact O-N 3.31Å; C961-L964 PolarHBondContact O-N 3.16Å; C961-N965 WeakPolarHBondContact O-CA 3.22Å; C961-N965 PolarHBondContact O-N 3.45Å; C961-I966 HydrophobicContact CB-CB 4.22Å; C961-I966 PolarHBondContact O-N 2.99Å; C961-I966 VanDerWaalsContact O-N 3.13Å; C961-F971 HydrophobicContact CB-CD2 4.23Å; C961-F971 WeakPolarHBondContact SG-CD2 3.5Å
962	E	63.2	Low	63.5	Low	150 Å²	150	59.3 Å²	59.3	70%	0.701	32%	0.319	S	S	*	.	H	α-helix	trans	-64.4	-42.8	174.7	-73.3	-172.4	176.1	0	0	111.6	S958 L964	S958-E962 PolarHBondContact O-N 3.42Å; E962-L964 PolarHBondContact O-N 2.99Å
963	K	65	Low	65.9	Low	174 Å²	174	57 Å²	57	76%	0.757	30%	0.303	S	S	*	.	H	α-helix	trans	-65.3	-36.6	177	-77.6	174.6	-178.6	-179.6	0	113.2	N959 V960	N959-K963 VanDerWaalsContact O-CB 3.26Å; N959-K963 WeakPolarHBondContact O-CB 3.5Å; N959-K963 WeakPolarHBondContact O-CG 3.18Å; N959-K963 PolarHBondContact O-N 2.89Å; V960-K963 PolarHBondContact O-N 3.45Å
964	L	67.5	Low	68.3	Low	52 Å²	52	54.6 Å²	54.6	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-94.5	-2.7	-175.6	-64.8	-179.1	0	0	0	113.5	V960 C961 E962 I966 E1120 R1121	V960-L964 HydrophobicContact CG1-CD1 3.46Å; V960-L964 VanDerWaalsContact CG1-CD1 3.46Å; V960-L964 HydrophobicContact CG1-CG 4.09Å; V960-L964 WeakPolarHBondContact O-CB 3.35Å; V960-L964 VanDerWaalsContact O-CG 3.24Å; V960-L964 WeakPolarHBondContact O-CG 3.03Å; V960-L964 PolarHBondContact O-N 2.85Å; C961-L964 PolarHBondContact O-N 3.16Å; E962-L964 PolarHBondContact O-N 2.99Å; L964-I966 VanDerWaalsContact C-N 3.25Å; L964-I966 HydrophobicContact CB-CD1 3.92Å; L964-I966 HydrophobicContact CB-CG1 3.86Å; L964-I966 HydrophobicContact CD1-CD1 3.91Å; L964-I966 PolarHBondContact O-N 3.18Å; L964-E1120 HydrophobicContact CD1-CB 3.69Å; L964-R1121 HydrophobicContact CB-CB 4.46Å; L964-R1121 VanDerWaalsContact O-CD 3.28Å; L964-R1121 WeakPolarHBondContact O-CD 3.33Å
965	N	72.9	Confident	70.4	Confident	121 Å²	121	52 Å²	52	65%	0.647	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	41.8	-173.5	-75.9	-34	0	0	0	113	C961	C961-N965 WeakPolarHBondContact O-CA 3.22Å; C961-N965 PolarHBondContact O-N 3.45Å
966	I	75.6	Confident	72.5	Confident	15 Å²	15	49.1 Å²	49.1	8%	0.077	26%	0.262	C	S	.	.			trans	-70.9	138.8	175.6	-66.8	165.4	0	0	0	109.1	C961 L964 A970 R1121 W1124	C961-I966 HydrophobicContact CB-CB 4.22Å; C961-I966 PolarHBondContact O-N 2.99Å; C961-I966 VanDerWaalsContact O-N 3.13Å; L964-I966 VanDerWaalsContact C-N 3.25Å; L964-I966 HydrophobicContact CB-CD1 3.92Å; L964-I966 HydrophobicContact CB-CG1 3.86Å; L964-I966 HydrophobicContact CD1-CD1 3.91Å; L964-I966 PolarHBondContact O-N 3.18Å; I966-A970 HydrophobicContact CG2-CB 3.97Å; I966-R1121 HydrophobicContact CG1-CG 4.46Å; I966-W1124 HydrophobicContact CD1-CB 4.15Å; I966-W1124 VanDerWaalsContact CD1-CD1 3.43Å; I966-W1124 HydrophobicContact CD1-CD2 3.96Å; I966-W1124 HydrophobicContact CD1-CG 3.61Å; I966-W1124 HydrophobicContact CG1-CB 4.26Å; I966-W1124 HydrophobicContact CG1-CG 4.25Å; I966-W1124 HydrophobicContact CG2-CB 4.05Å; I966-W1124 HydrophobicContact CG2-CD2 4.32Å; I966-W1124 HydrophobicContact CG2-CE3 4.28Å; I966-W1124 HydrophobicContact CG2-CG 4.26Å
967	S	76.4	Confident	74.3	Confident	50 Å²	50	46.3 Å²	46.3	35%	0.35	24%	0.244	S	C	.	.			trans	-62	142.3	179.5	77.2	0	0	0	0	112.2	N969 A970 F971	S967-N969 PolarHBondContact O-N 2.93Å; S967-A970 PolarHBondContact O-N 3.4Å; S967-A970 VanDerWaalsContact O-N 3.13Å; S967-A970 WeakPolarHBondContact OG-CB 3.23Å; S967-A970 PolarHBondContact OG-N 3.23Å; S967-F971 PolarHBondContact O-N 3.3Å; S967-F971 VanDerWaalsContact O-N 3.08Å
968	S	79.8	Confident	75.7	Confident	73 Å²	73	47.4 Å²	47.4	51%	0.51	25%	0.252	S	S	.	.	H	α-helix	trans	-56.7	-35.3	-178.9	-173.9	0	0	0	0	112.7	K972	S968-K972 VanDerWaalsContact O-CG 3.26Å; S968-K972 WeakPolarHBondContact O-CG 3.15Å; S968-K972 PolarHBondContact O-N 2.87Å
969	N	82.3	Confident	76.8	Confident	40 Å²	40	47.1 Å²	47.1	21%	0.214	25%	0.248	C	C	.	.	H	α-helix	trans	-74	-39.2	179.5	-69	0.7	0	0	0	112	V792 S967 F971 K972 L973 F1128	V792-N969 HydrophobicContact CG1-CB 4.09Å; V792-N969 VanDerWaalsContact CG1-CG 3.43Å; V792-N969 WeakPolarHBondContact CG1-OD1 3.37Å; S967-N969 PolarHBondContact O-N 2.93Å; N969-F971 VanDerWaalsContact C-N 3.32Å; N969-F971 PolarHBondContact O-N 3.5Å; N969-K972 PolarHBondContact O-N 3.35Å; N969-L973 PolarHBondContact O-N 3.24Å; N969-F1128 HydrophobicContact CB-CE1 4.37Å; N969-F1128 HydrophobicContact CB-CE2 3.77Å; N969-F1128 HydrophobicContact CB-CZ 3.47Å; N969-F1128 VanDerWaalsContact CB-CZ 3.47Å
970	A	80.1	Confident	77.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-46	173	0	0	0	0	0	111	I966 S967 K972 L973 V974 F1128	I966-A970 HydrophobicContact CG2-CB 3.97Å; S967-A970 PolarHBondContact O-N 3.4Å; S967-A970 VanDerWaalsContact O-N 3.13Å; S967-A970 WeakPolarHBondContact OG-CB 3.23Å; S967-A970 PolarHBondContact OG-N 3.23Å; A970-K972 VanDerWaalsContact C-N 3.28Å; A970-K972 PolarHBondContact O-N 3.02Å; A970-L973 PolarHBondContact O-N 3.46Å; A970-V974 WeakPolarHBondContact O-CB 3.25Å; A970-V974 VanDerWaalsContact O-CG2 3.25Å; A970-V974 WeakPolarHBondContact O-CG2 3.42Å; A970-V974 PolarHBondContact O-N 2.67Å; A970-F1128 HydrophobicContact CB-CB 3.65Å; A970-F1128 HydrophobicContact CB-CD1 4.08Å; A970-F1128 HydrophobicContact CB-CD2 4.14Å; A970-F1128 HydrophobicContact CB-CG 3.7Å
971	F	81.6	Confident	78.8	Confident	36 Å²	36	48.9 Å²	48.9	16%	0.158	25%	0.251	C	S	.	.	H	α-helix	trans	-59.5	-37.2	177.6	179.7	-113.2	0	0	0	113.7	R778 A957 C961 S967 N969 W1124	R778-F971 PolarHBondContact NE-O 3.38Å; R778-F971 PolarHBondContact NH2-O 3.15Å; A957-F971 HydrophobicContact CB-CE2 4.04Å; C961-F971 HydrophobicContact CB-CD2 4.23Å; C961-F971 WeakPolarHBondContact SG-CD2 3.5Å; S967-F971 PolarHBondContact O-N 3.3Å; S967-F971 VanDerWaalsContact O-N 3.08Å; N969-F971 VanDerWaalsContact C-N 3.32Å; N969-F971 PolarHBondContact O-N 3.5Å; F971-W1124 HydrophobicContact CD2-CH2 4.11Å; F971-W1124 HydrophobicContact CD2-CZ3 4.28Å
972	K	84.2	Confident	79.9	Confident	67 Å²	67	48.2 Å²	48.2	29%	0.291	25%	0.247	S	C	.	.	H	α-helix	trans	-74	-34.7	-179.7	-74.1	170.7	-174	172	0	113.4	R778 S968 N969 A970	R778-K972 VanDerWaalsContact CG-O 3.29Å; R778-K972 WeakPolarHBondContact CG-O 3.46Å; S968-K972 VanDerWaalsContact O-CG 3.26Å; S968-K972 WeakPolarHBondContact O-CG 3.15Å; S968-K972 PolarHBondContact O-N 2.87Å; N969-K972 PolarHBondContact O-N 3.35Å; A970-K972 VanDerWaalsContact C-N 3.28Å; A970-K972 PolarHBondContact O-N 3.02Å
973	L	90.2	Very high	80.8	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-104.2	-26.3	-168.8	-64.6	-171.2	0	0	0	114.4	L777 A781 A788 V789 V792 N969 A970 P975 F1128	L777-L973 HydrophobicContact CB-CD2 4.47Å; A781-L973 HydrophobicContact CB-CB 4.08Å; A781-L973 HydrophobicContact CB-CD2 4.23Å; A781-L973 VanDerWaalsContact CB-O 3.25Å; A781-L973 WeakPolarHBondContact CB-O 3.44Å; A788-L973 HydrophobicContact CB-CD2 4.15Å; V789-L973 HydrophobicContact CB-CD1 4.44Å; V789-L973 HydrophobicContact CG2-CD1 3.85Å; V792-L973 HydrophobicContact CB-CD1 4.35Å; V792-L973 HydrophobicContact CG2-CD1 4.28Å; V792-L973 HydrophobicContact CG2-CD2 3.67Å; V792-L973 HydrophobicContact CG2-CG 4.19Å; N969-L973 PolarHBondContact O-N 3.24Å; A970-L973 PolarHBondContact O-N 3.46Å; L973-P975 WeakPolarHBondContact O-CD 3.05Å; L973-F1128 HydrophobicContact CD1-CE2 4.01Å
974	V	90.3	Very high	81.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.213	C	C	.	.			trans	-76.1	119.7	-174.2	175.4	0	0	0	0	111.2	R778 A970 W1124 A1127 F1128 I1131 I1140	R778-V974 WeakPolarHBondContact CD-O 3.47Å; R778-V974 PolarHBondContact NE-O 2.94Å; A970-V974 WeakPolarHBondContact O-CB 3.25Å; A970-V974 VanDerWaalsContact O-CG2 3.25Å; A970-V974 WeakPolarHBondContact O-CG2 3.42Å; A970-V974 PolarHBondContact O-N 2.67Å; V974-W1124 HydrophobicContact CB-CE3 3.78Å; V974-W1124 HydrophobicContact CB-CZ3 3.77Å; V974-W1124 HydrophobicContact CG1-CE3 4Å; V974-W1124 HydrophobicContact CG1-CZ3 4.12Å; V974-W1124 HydrophobicContact CG2-CE3 4.18Å; V974-A1127 HydrophobicContact CG1-CB 3.76Å; V974-A1127 HydrophobicContact CG2-CB 3.92Å; V974-F1128 HydrophobicContact CG2-CB 3.96Å; V974-I1131 HydrophobicContact CG2-CD1 4.09Å; V974-I1140 HydrophobicContact CG1-CD1 3.48Å; V974-I1140 VanDerWaalsContact CG1-CD1 3.48Å; V974-I1140 HydrophobicContact CG1-CG1 3.74Å
975	P	90.4	Very high	82.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.201	C	C	.	.			trans	-75.8	143.3	176.6	-15.2	32.3	0	0	0	112.6	R778 F782 L889 L973 V1138 C1139 I1140	R778-P975 HydrophobicContact CB-CB 4.48Å; R778-P975 HydrophobicContact CB-CG 4.43Å; F782-P975 HydrophobicContact CB-CG 3.92Å; F782-P975 HydrophobicContact CD2-CB 4.42Å; F782-P975 HydrophobicContact CD2-CG 4.19Å; L889-P975 HydrophobicContact CD1-CB 4.17Å; L889-P975 HydrophobicContact CD2-CB 3.77Å; L973-P975 WeakPolarHBondContact O-CD 3.05Å; P975-V1138 VanDerWaalsContact CD-O 3.23Å; P975-V1138 WeakPolarHBondContact CD-O 3.45Å; P975-V1138 VanDerWaalsContact CG-O 3.3Å; P975-V1138 WeakPolarHBondContact CG-O 3.21Å; P975-C1139 HydrophobicContact CB-CB 4.36Å; P975-C1139 WeakPolarHBondContact O-CA 3.49Å; P975-I1140 PolarHBondContact O-N 3.33Å
976	L	85.8	Confident	82.7	Confident	28 Å²	28	31.3 Å²	31.3	15%	0.147	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.4	-176.1	-64.3	-179.3	0	0	0	111.2	L889 W1124 I1140 F1142	L889-L976 WeakPolarHBondContact CD2-O 3.13Å; L976-W1124 HydrophobicContact CD1-CH2 3.98Å; L976-W1124 HydrophobicContact CD1-CZ2 4.24Å; L976-W1124 HydrophobicContact CD2-CH2 3.72Å; L976-W1124 HydrophobicContact CD2-CZ2 3.73Å; L976-W1124 HydrophobicContact CD2-CZ3 4.48Å; L976-W1124 HydrophobicContact CG-CH2 4.15Å; L976-W1124 HydrophobicContact CG-CZ2 4.5Å; L976-I1140 HydrophobicContact CD2-CB 4.24Å; L976-F1142 HydrophobicContact CB-CB 4.07Å; L976-F1142 HydrophobicContact CD1-CD2 3.81Å; L976-F1142 HydrophobicContact CD1-CE2 4.2Å; L976-F1142 HydrophobicContact CD1-CG 4.39Å; L976-F1142 HydrophobicContact CD2-CB 4.45Å; L976-F1142 HydrophobicContact CD2-CD2 4.21Å; L976-F1142 HydrophobicContact CG-CD2 4.43Å
977	L	86.7	Confident	83	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.6	-177.9	-161.9	69.7	0	0	0	110.8	P886 S888 L889 D981 A982 H985 L1113 C1139 I1140 F1142	P886-L977 HydrophobicContact CB-CD1 3.43Å; P886-L977 VanDerWaalsContact CB-CD1 3.43Å; P886-L977 HydrophobicContact CG-CD1 3.71Å; S888-L977 WeakPolarHBondContact OG-CA 3.38Å; L889-L977 HydrophobicContact CD2-CD1 4.38Å; L889-L977 HydrophobicContact CG-CD1 4.45Å; L977-D981 HydrophobicContact CD1-CB 3.69Å; L977-D981 HydrophobicContact CG-CB 4.02Å; L977-A982 HydrophobicContact CD2-CB 3.79Å; L977-A982 HydrophobicContact CG-CB 4.31Å; L977-H985 HydrophobicContact CD2-CB 4.14Å; L977-L1113 HydrophobicContact CB-CD1 4.39Å; L977-L1113 HydrophobicContact CD2-CD1 3.72Å; L977-C1139 HydrophobicContact CB-CB 4.27Å; L977-I1140 PolarHBondContact N-O 3.37Å; L977-F1142 PolarHBondContact O-N 3.49Å
978	S	81.8	Confident	83.2	Confident	26 Å²	26	36.6 Å²	36.6	18%	0.182	19%	0.189	C	C	.	.			trans	-71.1	157.2	173.5	71.5	0	0	0	0	112	S888 K980 D981 A982	S888-S978 WeakPolarHBondContact CB-OG 3.46Å; S888-S978 PolarHBondContact OG-N 3.09Å; S978-K980 VanDerWaalsContact C-N 3.29Å; S978-K980 PolarHBondContact O-N 3.25Å; S978-D981 PolarHBondContact O-N 3.25Å; S978-D981 PolarHBondContact OG-N 2.98Å; S978-A982 WeakPolarHBondContact O-CB 3.38Å; S978-A982 PolarHBondContact O-N 3.16Å
979	V	80.3	Confident	83.3	Confident	34 Å²	34	36.2 Å²	36.2	21%	0.206	19%	0.185	C	C	.	.	H	α-helix	trans	-52.6	-45	174.4	174.7	0	0	0	0	112.1	A982 V983 L1141 S1147 F1151	V979-A982 PolarHBondContact O-N 2.73Å; V979-V983 WeakPolarHBondContact O-CG2 3.42Å; V979-V983 PolarHBondContact O-N 3.03Å; V979-V983 VanDerWaalsContact O-N 3.07Å; V979-L1141 HydrophobicContact CG2-CD1 4.23Å; V979-S1147 WeakPolarHBondContact CG2-OG 3.33Å; V979-F1151 HydrophobicContact CG1-CB 3.94Å; V979-F1151 HydrophobicContact CG1-CD2 3.86Å; V979-F1151 HydrophobicContact CG1-CG 4.36Å
980	K	77.7	Confident	83.5	Confident	118 Å²	118	34.4 Å²	34.4	51%	0.513	18%	0.175	S	C	.	.	H	α-helix	trans	-61.9	-47.3	-179.1	-70.8	-175.1	175	-175.8	0	112.3	E947 S978 A982 V983 V984	E947-K980 IonicContact OE1-NZ 3.28Å; E947-K980 PolarHBondContact OE1-NZ 3.5Å; E947-K980 WeakPolarHBondContact OE2-CE 3.33Å; E947-K980 IonicContact OE2-NZ 3.11Å; E947-K980 PolarHBondContact OE2-NZ 2.97Å; S978-K980 VanDerWaalsContact C-N 3.29Å; S978-K980 PolarHBondContact O-N 3.25Å; K980-A982 VanDerWaalsContact C-N 3.33Å; K980-V983 PolarHBondContact O-N 2.9Å; K980-V984 PolarHBondContact O-N 3.18Å
981	D	82.5	Confident	83.8	Confident	29 Å²	29	34.5 Å²	34.5	16%	0.155	18%	0.176	C	C	.	.	H	α-helix	trans	-69.4	-34.7	178.4	-80.4	-12	0	0	0	111.8	P886 R887 S888 L977 S978 V983 V984 H985	P886-D981 HydrophobicContact CB-CB 4.15Å; R887-D981 PolarHBondContact N-OD2 3.25Å; S888-D981 WeakPolarHBondContact CB-OD2 3.28Å; S888-D981 PolarHBondContact N-OD2 3.3Å; S888-D981 PolarHBondContact OG-OD2 3.25Å; L977-D981 HydrophobicContact CD1-CB 3.69Å; L977-D981 HydrophobicContact CG-CB 4.02Å; S978-D981 PolarHBondContact O-N 3.25Å; S978-D981 PolarHBondContact OG-N 2.98Å; D981-V983 VanDerWaalsContact C-N 3.33Å; D981-V983 PolarHBondContact O-N 2.87Å; D981-V984 PolarHBondContact O-N 2.74Å; D981-H985 WeakPolarHBondContact O-CB 3.39Å; D981-H985 PolarHBondContact O-N 3.32Å
982	A	83.6	Confident	84.3	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-38.9	176.3	0	0	0	0	0	112.4	L977 S978 V979 K980 V984 H985 I986 L1113 L1141 F1151	L977-A982 HydrophobicContact CD2-CB 3.79Å; L977-A982 HydrophobicContact CG-CB 4.31Å; S978-A982 WeakPolarHBondContact O-CB 3.38Å; S978-A982 PolarHBondContact O-N 3.16Å; V979-A982 PolarHBondContact O-N 2.73Å; K980-A982 VanDerWaalsContact C-N 3.33Å; A982-V984 VanDerWaalsContact C-N 3.29Å; A982-V984 PolarHBondContact O-N 2.97Å; A982-H985 PolarHBondContact O-N 3.14Å; A982-H985 VanDerWaalsContact O-N 3.14Å; A982-I986 PolarHBondContact O-N 3.07Å; A982-L1113 HydrophobicContact CB-CD2 4.09Å; A982-L1141 HydrophobicContact CB-CD1 3.55Å; A982-F1151 HydrophobicContact CB-CD2 4.26Å; A982-F1151 HydrophobicContact CB-CE2 3.39Å; A982-F1151 HydrophobicContact CB-CZ 3.66Å
983	V	82	Confident	84.5	Confident	31 Å²	31	29.7 Å²	29.7	19%	0.188	16%	0.155	C	C	.	.	H	α-helix	trans	-62.3	-38.8	176.2	172.3	0	0	0	0	110.9	V979 K980 D981 F1151	V979-V983 WeakPolarHBondContact O-CG2 3.42Å; V979-V983 PolarHBondContact O-N 3.03Å; V979-V983 VanDerWaalsContact O-N 3.07Å; K980-V983 PolarHBondContact O-N 2.9Å; D981-V983 VanDerWaalsContact C-N 3.33Å; D981-V983 PolarHBondContact O-N 2.87Å; V983-F1151 HydrophobicContact CG2-CD2 3.77Å; V983-F1151 HydrophobicContact CG2-CE2 3.74Å
984	V	80.3	Confident	84.5	Confident	93 Å²	93	29.7 Å²	29.7	56%	0.564	16%	0.155	S	C	*	.	H	α-helix	trans	-71.6	-38.8	174.8	-179.5	0	0	0	0	110.8	K980 D981 A982 K987	K980-V984 PolarHBondContact O-N 3.18Å; D981-V984 PolarHBondContact O-N 2.74Å; A982-V984 VanDerWaalsContact C-N 3.29Å; A982-V984 PolarHBondContact O-N 2.97Å; V984-K987 PolarHBondContact O-N 3Å
985	H	81.9	Confident	84.2	Confident	6 Å²	6	29.7 Å²	29.7	3%	0.028	16%	0.155	C	C	.	.	H	α-helix	trans	-70.1	-37.8	-175.2	-144.5	72.9	0	0	0	113	L977 D981 A982 K987 R988 C991	L977-H985 HydrophobicContact CD2-CB 4.14Å; D981-H985 WeakPolarHBondContact O-CB 3.39Å; D981-H985 PolarHBondContact O-N 3.32Å; A982-H985 PolarHBondContact O-N 3.14Å; A982-H985 VanDerWaalsContact O-N 3.14Å; H985-K987 PolarHBondContact O-N 2.73Å; H985-R988 PolarHBondContact CE1-NH1 3.35Å; H985-R988 PolarHBondContact ND1-NH1 2.87Å; H985-R988 VanDerWaalsContact O-CB 3.24Å; H985-R988 WeakPolarHBondContact O-CB 3.27Å; H985-R988 WeakPolarHBondContact O-CG 3.43Å; H985-R988 PolarHBondContact O-N 3.35Å; H985-R988 VanDerWaalsContact O-N 3.11Å; H985-C991 PolarHBondContact CD2-SG 3.17Å; H985-C991 VanDerWaalsContact O-CB 3.26Å; H985-C991 WeakPolarHBondContact O-CB 3.24Å
986	I	83.2	Confident	84	Confident	12 Å²	12	30.8 Å²	30.8	6%	0.062	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-29.3	178.6	-80	-171.1	0	0	0	112.8	A982 R988 V993 L1007 P1008 L1113 F1151	A982-I986 PolarHBondContact O-N 3.07Å; I986-R988 PolarHBondContact O-N 3.15Å; I986-V993 HydrophobicContact CD1-CG2 3.85Å; I986-V993 HydrophobicContact CG1-CG2 3.73Å; I986-L1007 HydrophobicContact CD1-CB 4.36Å; I986-L1007 HydrophobicContact CD1-CD1 3.86Å; I986-L1007 HydrophobicContact CD1-CD2 3.96Å; I986-L1007 HydrophobicContact CD1-CG 4.28Å; I986-P1008 HydrophobicContact CG2-CG 3.71Å; I986-L1113 HydrophobicContact CD1-CD2 4.06Å; I986-L1113 HydrophobicContact CG1-CD2 3.73Å; I986-F1151 HydrophobicContact CD1-CE1 3.93Å; I986-F1151 HydrophobicContact CD1-CE2 4.42Å; I986-F1151 HydrophobicContact CD1-CZ 3.41Å; I986-F1151 VanDerWaalsContact CD1-CZ 3.41Å; I986-F1151 HydrophobicContact CG1-CZ 4.31Å
987	K	81.4	Confident	83.8	Confident	163 Å²	163	29.9 Å²	29.9	71%	0.709	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-10.1	178.3	-64.9	-179.8	-178.3	-175.7	0	112.8	V984 H985 P989	V984-K987 PolarHBondContact O-N 3Å; H985-K987 PolarHBondContact O-N 2.73Å; K987-P989 WeakPolarHBondContact O-CD 3.38Å
988	R	81.6	Confident	83.5	Confident	13 Å²	13	33.1 Å²	33.1	5%	0.049	17%	0.174	C	C	.	.			trans	-83.7	123.8	-175.1	-67	169.6	57.8	159.9	-7.5	111.7	F927 Y928 H985 I986 D990 C991	F927-R988 HydrophobicContact CD1-CG 4.21Å; F927-R988 HydrophobicContact CE1-CG 4.37Å; F927-R988 VanDerWaalsContact CE1-NE 3.26Å; F927-R988 VanDerWaalsContact CZ-NH2 3.35Å; Y928-R988 WeakPolarHBondContact OH-CA 3.49Å; Y928-R988 WeakPolarHBondContact OH-CB 3.11Å; H985-R988 PolarHBondContact CE1-NH1 3.35Å; H985-R988 PolarHBondContact ND1-NH1 2.87Å; H985-R988 VanDerWaalsContact O-CB 3.24Å; H985-R988 WeakPolarHBondContact O-CB 3.27Å; H985-R988 WeakPolarHBondContact O-CG 3.43Å; H985-R988 PolarHBondContact O-N 3.35Å; H985-R988 VanDerWaalsContact O-N 3.11Å; I986-R988 PolarHBondContact O-N 3.15Å; R988-D990 WeakPolarHBondContact CB-OD1 3.31Å; R988-D990 IonicContact CZ-OD1 2.93Å; R988-D990 IonicContact CZ-OD2 3.32Å; R988-D990 IonicContact NE-OD1 2.83Å; R988-D990 PolarHBondContact NE-OD1 3.28Å; R988-D990 IonicContact NH2-OD1 3.18Å; R988-D990 PolarHBondContact NH2-OD1 3.3Å; R988-D990 VanDerWaalsContact NH2-OD1 3.16Å; R988-D990 IonicContact NH2-OD2 2.85Å; R988-D990 PolarHBondContact NH2-OD2 3.5Å; R988-D990 PolarHBondContact O-N 2.96Å; R988-D990 VanDerWaalsContact O-N 3.09Å; R988-C991 HydrophobicContact CB-CB 4.04Å; R988-C991 WeakPolarHBondContact O-CB 3.18Å; R988-C991 PolarHBondContact O-N 3.31Å
989	P	81.8	Confident	83.4	Confident	65 Å²	65	35.1 Å²	35.1	42%	0.422	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-17.8	169.6	18	-37.1	0	0	0	116.3	Y928 K987 T1082 A1085	Y928-P989 HydrophobicContact CE1-CG 4.37Å; Y928-P989 HydrophobicContact CE2-CG 3.92Å; Y928-P989 WeakPolarHBondContact OH-CD 3.17Å; Y928-P989 VanDerWaalsContact OH-CG 3.23Å; Y928-P989 WeakPolarHBondContact OH-CG 3.43Å; Y928-P989 VanDerWaalsContact OH-N 3.17Å; K987-P989 WeakPolarHBondContact O-CD 3.38Å; P989-T1082 WeakPolarHBondContact O-CG2 3.19Å; P989-A1085 HydrophobicContact CB-CB 4.07Å; P989-A1085 WeakPolarHBondContact O-CB 3.35Å
990	D	85.4	Confident	83.4	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.011	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	3.9	174.5	76.8	-39.4	0	0	0	114.2	Y928 R988 T1082 R1086 L1089 G1111 R1137	Y928-D990 PolarHBondContact OH-OD1 3.1Å; R988-D990 WeakPolarHBondContact CB-OD1 3.31Å; R988-D990 IonicContact CZ-OD1 2.93Å; R988-D990 IonicContact CZ-OD2 3.32Å; R988-D990 IonicContact NE-OD1 2.83Å; R988-D990 PolarHBondContact NE-OD1 3.28Å; R988-D990 IonicContact NH2-OD1 3.18Å; R988-D990 PolarHBondContact NH2-OD1 3.3Å; R988-D990 VanDerWaalsContact NH2-OD1 3.16Å; R988-D990 IonicContact NH2-OD2 2.85Å; R988-D990 PolarHBondContact NH2-OD2 3.5Å; R988-D990 PolarHBondContact O-N 2.96Å; R988-D990 VanDerWaalsContact O-N 3.09Å; D990-T1082 VanDerWaalsContact O-CG2 3.23Å; D990-T1082 WeakPolarHBondContact O-CG2 3.49Å; D990-R1086 HydrophobicContact CB-CB 3.9Å; D990-R1086 HydrophobicContact CB-CG 4.12Å; D990-L1089 HydrophobicContact CB-CD1 4.24Å; D990-G1111 PolarHBondContact O-N 3.2Å; D990-R1137 IonicContact OD2-NH1 3.86Å; D990-R1137 PolarHBondContact OD2-NH1 2.9Å
991	C	87.9	Confident	83.4	Confident	2 Å²	2	39 Å²	39	1%	0.014	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135	175.1	-177.2	0	0	0	0	111	H985 R988 G1111	H985-C991 PolarHBondContact CD2-SG 3.17Å; H985-C991 VanDerWaalsContact O-CB 3.26Å; H985-C991 WeakPolarHBondContact O-CB 3.24Å; R988-C991 HydrophobicContact CB-CB 4.04Å; R988-C991 WeakPolarHBondContact O-CB 3.18Å; R988-C991 PolarHBondContact O-N 3.31Å; C991-G1111 WeakPolarHBondContact CA-O 3.4Å
992	L	90.6	Very high	83.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.4	173.5	176.2	69.3	0	0	0	108.5	L994 I1011 L1078 W1079 T1082 P1110 G1111 L1112 L1113	L992-L994 HydrophobicContact CD2-CD2 4.42Å; L992-I1011 HydrophobicContact CD1-CD1 3.79Å; L992-I1011 HydrophobicContact CD1-CG1 4.09Å; L992-I1011 HydrophobicContact CD2-CD1 3.91Å; L992-I1011 HydrophobicContact CG-CD1 4.26Å; L992-L1078 HydrophobicContact CD1-CB 4.25Å; L992-L1078 HydrophobicContact CD1-CD2 3.29Å; L992-L1078 HydrophobicContact CD1-CG 3.53Å; L992-W1079 HydrophobicContact CD2-CB 4.41Å; L992-W1079 HydrophobicContact CD2-CD2 4.38Å; L992-W1079 HydrophobicContact CD2-CE3 3.6Å; L992-W1079 HydrophobicContact CD2-CZ3 4.28Å; L992-T1082 HydrophobicContact CB-CG2 4.1Å; L992-P1110 HydrophobicContact CB-CB 4.06Å; L992-P1110 HydrophobicContact CB-CG 4.22Å; L992-P1110 HydrophobicContact CD2-CG 3.92Å; L992-G1111 PolarHBondContact N-O 3.24Å; L992-L1112 HydrophobicContact CB-CD2 3.89Å; L992-L1112 HydrophobicContact CD2-CD2 3.71Å; L992-L1112 HydrophobicContact CG-CD2 4.06Å; L992-L1112 WeakPolarHBondContact O-CA 3.46Å; L992-L1113 PolarHBondContact O-N 2.92Å
993	V	89.7	Confident	83.2	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.5	178.9	-178.2	0	0	0	0	109.4	I986 L1007 N1009 S1010 I1011 L1113 V1115	I986-V993 HydrophobicContact CD1-CG2 3.85Å; I986-V993 HydrophobicContact CG1-CG2 3.73Å; V993-L1007 HydrophobicContact CG1-CB 4.49Å; V993-L1007 HydrophobicContact CG1-CD1 3.99Å; V993-N1009 PolarHBondContact N-O 3.25Å; V993-S1010 CarbonylContact O-C 3.52Å; V993-S1010 VanDerWaalsContact O-CA 3.25Å; V993-S1010 WeakPolarHBondContact O-CA 3.44Å; V993-I1011 PolarHBondContact O-N 3.15Å; V993-L1113 CarbonylContact C-O 3.54Å; V993-L1113 WeakPolarHBondContact CA-O 3.45Å; V993-L1113 HydrophobicContact CG2-CD2 4.46Å; V993-V1115 HydrophobicContact CG1-CG2 3.77Å
994	L	88.8	Confident	83.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	109.8	169	-62	-177.2	0	0	0	108.2	L992 I1011 L1073 L1112 L1113 I1114 V1115 L1130	L992-L994 HydrophobicContact CD2-CD2 4.42Å; L994-I1011 HydrophobicContact CD2-CB 4.18Å; L994-I1011 HydrophobicContact CD2-CD1 4.44Å; L994-L1073 HydrophobicContact CD2-CD2 4.05Å; L994-L1112 HydrophobicContact CD1-CD1 4.04Å; L994-L1112 HydrophobicContact CD1-CD2 4.3Å; L994-L1112 HydrophobicContact CG-CD2 4.34Å; L994-L1113 PolarHBondContact N-O 3.49Å; L994-I1114 HydrophobicContact CB-CG1 4.21Å; L994-I1114 HydrophobicContact CD1-CG1 4.37Å; L994-I1114 WeakPolarHBondContact O-CA 3.39Å; L994-V1115 PolarHBondContact O-N 3.27Å; L994-L1130 HydrophobicContact CD1-CD1 3.99Å
995	D	85.8	Confident	82.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	105.7	-175.3	-159.9	-33.1	0	0	0	110.6	R997 Y1002 I1011 H1012 C1013	D995-R997 WeakPolarHBondContact OD1-CB 3.33Å; D995-R997 WeakPolarHBondContact OD1-CG 3.47Å; D995-R997 IonicContact OD1-CZ 2.75Å; D995-R997 PolarHBondContact OD1-N 3.48Å; D995-R997 VanDerWaalsContact OD1-N 3.1Å; D995-R997 IonicContact OD1-NE 3.5Å; D995-R997 PolarHBondContact OD1-NE 3.48Å; D995-R997 IonicContact OD1-NH2 2.73Å; D995-R997 IonicContact OD2-CZ 2.62Å; D995-R997 VanDerWaalsContact OD2-CZ 3.28Å; D995-R997 IonicContact OD2-NE 2.6Å; D995-R997 PolarHBondContact OD2-NE 3.08Å; D995-R997 VanDerWaalsContact OD2-NE 3.11Å; D995-R997 IonicContact OD2-NH2 2.65Å; D995-R997 PolarHBondContact OD2-NH2 3.48Å; D995-Y1002 HydrophobicContact CB-CD2 3.78Å; D995-Y1002 HydrophobicContact CB-CE2 3.95Å; D995-I1011 PolarHBondContact N-O 2.8Å; D995-H1012 WeakPolarHBondContact O-CA 3.06Å; D995-H1012 PolarHBondContact O-ND1 3.1Å; D995-H1012 VanDerWaalsContact O-ND1 3.09Å; D995-C1013 PolarHBondContact O-N 2.85Å
996	V	84.3	Confident	82.7	Confident	23 Å²	23	57.2 Å²	57.2	14%	0.139	27%	0.27	C	S	.	.			trans	-98.9	9.9	-176.1	-162.4	0	0	0	0	110.9	V1015 I1114 V1115 L1126	V996-V1015 HydrophobicContact CG1-CG2 3.7Å; V996-I1114 HydrophobicContact CG2-CG2 3.88Å; V996-V1115 PolarHBondContact N-O 3.23Å; V996-L1126 HydrophobicContact CG2-CD2 3.96Å
997	R	82.7	Confident	82.5	Confident	10 Å²	10	56.9 Å²	56.9	4%	0.038	27%	0.269	C	S	.	.	S	Bend	trans	-65.4	161.9	171.4	-63	179.9	-63.1	143.8	-2.9	110.4	D995 E1001 F1005 H1012 V1115 C1116	D995-R997 WeakPolarHBondContact OD1-CB 3.33Å; D995-R997 WeakPolarHBondContact OD1-CG 3.47Å; D995-R997 IonicContact OD1-CZ 2.75Å; D995-R997 PolarHBondContact OD1-N 3.48Å; D995-R997 VanDerWaalsContact OD1-N 3.1Å; D995-R997 IonicContact OD1-NE 3.5Å; D995-R997 PolarHBondContact OD1-NE 3.48Å; D995-R997 IonicContact OD1-NH2 2.73Å; D995-R997 IonicContact OD2-CZ 2.62Å; D995-R997 VanDerWaalsContact OD2-CZ 3.28Å; D995-R997 IonicContact OD2-NE 2.6Å; D995-R997 PolarHBondContact OD2-NE 3.08Å; D995-R997 VanDerWaalsContact OD2-NE 3.11Å; D995-R997 IonicContact OD2-NH2 2.65Å; D995-R997 PolarHBondContact OD2-NH2 3.48Å; R997-E1001 HydrophobicContact CB-CB 4.17Å; R997-F1005 PolarHBondContact NH2-O 2.95Å; R997-H1012 PolarHBondContact O-CE1 3.37Å; R997-V1115 HydrophobicContact CG-CG1 4.33Å; R997-C1116 WeakPolarHBondContact CG-O 3.25Å
998	N	79.3	Confident	82	Confident	68 Å²	68	52.7 Å²	52.7	36%	0.364	26%	0.258	S	S	.	.			trans	-62.2	151	178.7	69.3	50.1	0	0	0	110.9	K1000 E1001 Y1002	N998-K1000 PolarHBondContact O-N 3.33Å; N998-K1000 WeakPolarHBondContact OD1-CB 2.94Å; N998-K1000 PolarHBondContact OD1-N 2.86Å; N998-E1001 PolarHBondContact ND2-OE1 3.34Å; N998-E1001 PolarHBondContact ND2-OE2 3.24Å; N998-E1001 PolarHBondContact O-N 3.46Å; N998-E1001 WeakPolarHBondContact OD1-CB 3.17Å; N998-E1001 VanDerWaalsContact OD1-CG 3.27Å; N998-E1001 WeakPolarHBondContact OD1-CG 2.98Å; N998-E1001 PolarHBondContact OD1-N 2.98Å; N998-Y1002 PolarHBondContact O-N 3.16Å
999	I	80.6	Confident	81.9	Confident	67 Å²	67	55.4 Å²	55.4	34%	0.344	27%	0.274	S	S	.	.	H	α-helix	trans	-55.2	-30	-177.1	-173.2	64.4	0	0	0	112.9	Y1002 N1003 H1012	I999-Y1002 HydrophobicContact CD1-CD1 4.46Å; I999-N1003 VanDerWaalsContact O-CB 3.23Å; I999-N1003 WeakPolarHBondContact O-CB 3.37Å; I999-N1003 PolarHBondContact O-N 2.93Å; I999-N1003 PolarHBondContact O-ND2 3.49Å; I999-H1012 WeakPolarHBondContact CD1-CD2 3.28Å; I999-H1012 WeakPolarHBondContact CD1-NE2 3.3Å
1000	K	79.9	Confident	82.1	Confident	174 Å²	174	53 Å²	53	76%	0.757	26%	0.259	S	S	*	.	H	α-helix	trans	-70	-42	178.2	-64.6	-178.5	179.9	177.3	0	112	N998 K1004	N998-K1000 PolarHBondContact O-N 3.33Å; N998-K1000 WeakPolarHBondContact OD1-CB 2.94Å; N998-K1000 PolarHBondContact OD1-N 2.86Å; K1000-K1004 WeakPolarHBondContact O-CB 3.48Å; K1000-K1004 PolarHBondContact O-N 2.95Å; K1000-K1004 VanDerWaalsContact O-N 3.12Å
1001	E	77.8	Confident	82.1	Confident	60 Å²	60	53.6 Å²	53.6	28%	0.28	26%	0.262	S	S	.	.	H	α-helix	trans	-69	-41.9	176.3	-77.9	164.2	-164.1	0	0	111.3	R997 N998 K1004 F1005	R997-E1001 HydrophobicContact CB-CB 4.17Å; N998-E1001 PolarHBondContact ND2-OE1 3.34Å; N998-E1001 PolarHBondContact ND2-OE2 3.24Å; N998-E1001 PolarHBondContact O-N 3.46Å; N998-E1001 WeakPolarHBondContact OD1-CB 3.17Å; N998-E1001 VanDerWaalsContact OD1-CG 3.27Å; N998-E1001 WeakPolarHBondContact OD1-CG 2.98Å; N998-E1001 PolarHBondContact OD1-N 2.98Å; E1001-K1004 PolarHBondContact O-N 3.45Å; E1001-F1005 PolarHBondContact O-N 3.2Å; E1001-F1005 VanDerWaalsContact O-N 3.16Å
1002	Y	80.9	Confident	81.9	Confident	36 Å²	36	55.3 Å²	55.3	14%	0.141	27%	0.269	C	S	.	.	H	α-helix	trans	-60.6	-50.9	174.5	179.6	-98.9	0	0	0	111.5	D995 N998 I999 K1004 F1005 H1006 S1010 H1012	D995-Y1002 HydrophobicContact CB-CD2 3.78Å; D995-Y1002 HydrophobicContact CB-CE2 3.95Å; N998-Y1002 PolarHBondContact O-N 3.16Å; I999-Y1002 HydrophobicContact CD1-CD1 4.46Å; Y1002-K1004 PolarHBondContact O-N 3.01Å; Y1002-F1005 CarbonylContact O-C 3.35Å; Y1002-F1005 PolarHBondContact O-N 2.96Å; Y1002-H1006 HydrophobicContact CD2-CB 4.07Å; Y1002-H1006 HydrophobicContact CE1-CB 4.08Å; Y1002-H1006 HydrophobicContact CE2-CB 3.59Å; Y1002-H1006 PolarHBondContact O-N 3.09Å; Y1002-H1006 VanDerWaalsContact O-N 3.14Å; Y1002-S1010 WeakPolarHBondContact CE2-OG 3.39Å; Y1002-S1010 PolarHBondContact OH-O 2.91Å; Y1002-S1010 PolarHBondContact OH-OG 3.49Å; Y1002-H1012 HydrophobicContact CD1-CB 3.64Å; Y1002-H1012 AromaticContact CD1-CG 3.9Å; Y1002-H1012 HydrophobicContact CD2-CB 3.85Å; Y1002-H1012 HydrophobicContact CE1-CB 3.58Å; Y1002-H1012 HydrophobicContact CE2-CB 3.78Å; Y1002-H1012 HydrophobicContact CG-CB 3.77Å; Y1002-H1012 AromaticContact CG-CG 3.84Å; Y1002-H1012 AromaticContact CG-ND1 3.94Å
1003	N	81.5	Confident	81.2	Confident	110 Å²	110	55.5 Å²	55.5	59%	0.588	27%	0.271	S	S	*	.	H	α-helix	trans	-64.5	-24.8	179.4	-72.2	-16.5	0	0	0	112.9	I999	I999-N1003 VanDerWaalsContact O-CB 3.23Å; I999-N1003 WeakPolarHBondContact O-CB 3.37Å; I999-N1003 PolarHBondContact O-N 2.93Å; I999-N1003 PolarHBondContact O-ND2 3.49Å
1004	K	79.5	Confident	80.2	Confident	161 Å²	161	62.3 Å²	62.3	70%	0.7	30%	0.302	S	S	*	.	H	α-helix	trans	-72.8	-43.6	175.7	-168.4	-176.8	178.8	-177.1	0	111.6	K1000 E1001 Y1002	K1000-K1004 WeakPolarHBondContact O-CB 3.48Å; K1000-K1004 PolarHBondContact O-N 2.95Å; K1000-K1004 VanDerWaalsContact O-N 3.12Å; E1001-K1004 PolarHBondContact O-N 3.45Å; Y1002-K1004 PolarHBondContact O-N 3.01Å
1005	F	76.1	Confident	78.8	Confident	107 Å²	107	63.3 Å²	63.3	47%	0.469	31%	0.308	S	S	.	.	S	Bend	trans	-150	106.2	176	-78.3	-78.6	0	0	0	109.7	R997 E1001 Y1002 I1152	R997-F1005 PolarHBondContact NH2-O 2.95Å; E1001-F1005 PolarHBondContact O-N 3.2Å; E1001-F1005 VanDerWaalsContact O-N 3.16Å; Y1002-F1005 CarbonylContact O-C 3.35Å; Y1002-F1005 PolarHBondContact O-N 2.96Å; F1005-I1152 HydrophobicContact CB-CG2 3.77Å; F1005-I1152 HydrophobicContact CD1-CG2 4.41Å; F1005-I1152 HydrophobicContact CG-CG2 4.04Å
1006	H	77.3	Confident	77.3	Confident	127 Å²	127	70.4 Å²	70.4	59%	0.588	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-95.6	142	172.2	65.5	78	0	0	0	110.2	Y1002	Y1002-H1006 HydrophobicContact CD2-CB 4.07Å; Y1002-H1006 HydrophobicContact CE1-CB 4.08Å; Y1002-H1006 HydrophobicContact CE2-CB 3.59Å; Y1002-H1006 PolarHBondContact O-N 3.09Å; Y1002-H1006 VanDerWaalsContact O-N 3.14Å
1007	L	79.3	Confident	75.7	Confident	6 Å²	6	77.6 Å²	77.6	3%	0.031	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-77.1	154.6	175.5	-69.3	162.4	0	0	0	110.2	I986 V993 S1010 V1115 F1151 C1155	I986-L1007 HydrophobicContact CD1-CB 4.36Å; I986-L1007 HydrophobicContact CD1-CD1 3.86Å; I986-L1007 HydrophobicContact CD1-CD2 3.96Å; I986-L1007 HydrophobicContact CD1-CG 4.28Å; V993-L1007 HydrophobicContact CG1-CB 4.49Å; V993-L1007 HydrophobicContact CG1-CD1 3.99Å; L1007-S1010 PolarHBondContact N-OG 3.09Å; L1007-S1010 VanDerWaalsContact O-CB 3.32Å; L1007-S1010 WeakPolarHBondContact O-CB 3.42Å; L1007-S1010 PolarHBondContact O-N 2.98Å; L1007-S1010 PolarHBondContact O-OG 3.29Å; L1007-V1115 HydrophobicContact CD1-CG2 3.89Å; L1007-F1151 HydrophobicContact CD1-CE1 3.83Å; L1007-F1151 HydrophobicContact CD2-CE1 4.36Å; L1007-C1155 HydrophobicContact CD2-CB 3.83Å
1008	P	72.1	Confident	74.1	Confident	74 Å²	74	81.1 Å²	81.1	48%	0.481	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	144.4	171.9	25.2	-31.3	0	0	0	110.4	I986 S1010	I986-P1008 HydrophobicContact CG2-CG 3.71Å; P1008-S1010 PolarHBondContact O-N 2.92Å
1009	N	78.3	Confident	72.7	Confident	71 Å²	71	80.5 Å²	80.5	38%	0.38	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	41.8	-175.4	-60.5	-19.9	0	0	0	113.4	V993 L1078	V993-N1009 PolarHBondContact N-O 3.25Å; N1009-L1078 VanDerWaalsContact C-CD2 3.46Å; N1009-L1078 HydrophobicContact CB-CD1 4.15Å; N1009-L1078 HydrophobicContact CB-CD2 4.11Å
1010	S	87	Confident	71.2	Confident	15 Å²	15	78.7 Å²	78.7	11%	0.105	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	140.4	175.9	64.5	0	0	0	0	112.7	V993 Y1002 L1007 P1008	V993-S1010 CarbonylContact O-C 3.52Å; V993-S1010 VanDerWaalsContact O-CA 3.25Å; V993-S1010 WeakPolarHBondContact O-CA 3.44Å; Y1002-S1010 WeakPolarHBondContact CE2-OG 3.39Å; Y1002-S1010 PolarHBondContact OH-O 2.91Å; Y1002-S1010 PolarHBondContact OH-OG 3.49Å; L1007-S1010 PolarHBondContact N-OG 3.09Å; L1007-S1010 VanDerWaalsContact O-CB 3.32Å; L1007-S1010 WeakPolarHBondContact O-CB 3.42Å; L1007-S1010 PolarHBondContact O-N 2.98Å; L1007-S1010 PolarHBondContact O-OG 3.29Å; P1008-S1010 PolarHBondContact O-N 2.92Å
1011	I	85.2	Confident	69.4	Low	14 Å²	14	77.1 Å²	77.1	7%	0.072	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.7	167.4	-59.2	168.5	0	0	0	106.4	L992 V993 L994 D995 L1073 Q1076 L1078	L992-I1011 HydrophobicContact CD1-CD1 3.79Å; L992-I1011 HydrophobicContact CD1-CG1 4.09Å; L992-I1011 HydrophobicContact CD2-CD1 3.91Å; L992-I1011 HydrophobicContact CG-CD1 4.26Å; V993-I1011 PolarHBondContact O-N 3.15Å; L994-I1011 HydrophobicContact CD2-CB 4.18Å; L994-I1011 HydrophobicContact CD2-CD1 4.44Å; D995-I1011 PolarHBondContact N-O 2.8Å; I1011-L1073 HydrophobicContact CG2-CD2 4.46Å; I1011-Q1076 HydrophobicContact CD1-CB 3.91Å; I1011-Q1076 HydrophobicContact CD1-CG 3.96Å; I1011-L1078 HydrophobicContact CD1-CD2 4.49Å; I1011-L1078 HydrophobicContact CG1-CD2 4.01Å
1012	H	83.9	Confident	67.7	Low	37 Å²	37	78.1 Å²	78.1	17%	0.171	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	127.7	169.3	179.8	50.7	0	0	0	110	D995 R997 I999 Y1002	D995-H1012 WeakPolarHBondContact O-CA 3.06Å; D995-H1012 PolarHBondContact O-ND1 3.1Å; D995-H1012 VanDerWaalsContact O-ND1 3.09Å; R997-H1012 PolarHBondContact O-CE1 3.37Å; I999-H1012 WeakPolarHBondContact CD1-CD2 3.28Å; I999-H1012 WeakPolarHBondContact CD1-NE2 3.3Å; Y1002-H1012 HydrophobicContact CD1-CB 3.64Å; Y1002-H1012 AromaticContact CD1-CG 3.9Å; Y1002-H1012 HydrophobicContact CD2-CB 3.85Å; Y1002-H1012 HydrophobicContact CE1-CB 3.58Å; Y1002-H1012 HydrophobicContact CE2-CB 3.78Å; Y1002-H1012 HydrophobicContact CG-CB 3.77Å; Y1002-H1012 AromaticContact CG-CG 3.84Å; Y1002-H1012 AromaticContact CG-ND1 3.94Å
1013	C	76	Confident	65.7	Low	5 Å²	5	80.2 Å²	80.2	3%	0.034	41%	0.406	C	S	.	.			trans	-121.6	100.1	177.5	-68.7	0	0	0	0	109	D995 V1015	D995-C1013 PolarHBondContact O-N 2.85Å; C1013-V1015 VanDerWaalsContact C-N 3.31Å; C1013-V1015 PolarHBondContact O-N 2.87Å
1014	E	68	Low	63.7	Low	143 Å²	143	79.9 Å²	79.9	67%	0.668	41%	0.412	S	S	*	.			trans	-74.9	92.3	163.7	-164	166.8	-154.2	0	0	106.9	F1016	E1014-F1016 PolarHBondContact O-N 3.5Å
1015	V	59.6	Low	61.5	Low	21 Å²	21	78.1 Å²	78.1	13%	0.127	41%	0.41	C	S	.	.			trans	-61.3	107.5	-174.3	177.3	0	0	0	0	108.8	V996 C1013 R1017 M1020 L1126	V996-V1015 HydrophobicContact CG1-CG2 3.7Å; C1013-V1015 VanDerWaalsContact C-N 3.31Å; C1013-V1015 PolarHBondContact O-N 2.87Å; V1015-R1017 PolarHBondContact O-N 2.97Å; V1015-M1020 HydrophobicContact CG1-CG 4.36Å; V1015-L1126 HydrophobicContact CG2-CD2 4.12Å
1016	F	53.8	Low	59.5	Low	150 Å²	150	79.4 Å²	79.4	66%	0.658	42%	0.42	S	S	*	.			trans	-59	108	169.8	-80.2	-87.2	0	0	0	108.2	E1014 S1018 V1019	E1014-F1016 PolarHBondContact O-N 3.5Å; F1016-S1018 PolarHBondContact O-N 3.18Å; F1016-V1019 HydrophobicContact CB-CG2 4.26Å; F1016-V1019 PolarHBondContact O-N 3.29Å
1017	R	50.9	Low	57.2	Low	173 Å²	173	76.2 Å²	76.2	65%	0.653	42%	0.422	S	S	*	.	H	α-helix	trans	-47.7	-25.9	176.6	-86.8	-177.8	174.7	173.1	-1.1	113.2	V1015 V1019 D1119	V1015-R1017 PolarHBondContact O-N 2.97Å; R1017-V1019 PolarHBondContact O-N 3.49Å; R1017-D1119 IonicContact NH2-OD2 2.72Å
1018	S	48.3	Very low	54.8	Low	85 Å²	85	83.6 Å²	83.6	59%	0.594	46%	0.459	S	S	*	.	H	α-helix	trans	-64.7	-33.2	179.5	56	0	0	0	0	114.2	F1016 M1020	F1016-S1018 PolarHBondContact O-N 3.18Å; S1018-M1020 VanDerWaalsContact C-N 3.34Å; S1018-M1020 PolarHBondContact O-N 3.26Å
1019	V	51.2	Low	52.7	Low	55 Å²	55	88.3 Å²	88.3	33%	0.333	47%	0.473	S	S	.	.	H	α-helix	trans	-73.1	-26.7	-173.9	179.7	0	0	0	0	112.4	F1016 R1017 F1069	F1016-V1019 HydrophobicContact CB-CG2 4.26Å; F1016-V1019 PolarHBondContact O-N 3.29Å; R1017-V1019 PolarHBondContact O-N 3.49Å; V1019-F1069 HydrophobicContact CG1-CB 3.99Å; V1019-F1069 HydrophobicContact CG2-CB 4.36Å
1020	M	48.6	Very low	50.3	Low	29 Å²	29	93.7 Å²	93.7	14%	0.143	50%	0.495	C	S	.	.	H	α-helix	trans	-90.6	-17.6	-171.7	-71.2	-73.9	159.8	0	0	114.4	V1015 S1018 D1022 L1126 W1129	V1015-M1020 HydrophobicContact CG1-CG 4.36Å; S1018-M1020 VanDerWaalsContact C-N 3.34Å; S1018-M1020 PolarHBondContact O-N 3.26Å; M1020-D1022 VanDerWaalsContact C-N 3.28Å; M1020-D1022 PolarHBondContact O-N 3.44Å; M1020-L1126 HydrophobicContact CE-CB 4.16Å; M1020-L1126 HydrophobicContact CE-CD1 3.53Å; M1020-L1126 HydrophobicContact CE-CG 4.46Å; M1020-W1129 HydrophobicContact CE-CB 4.08Å; M1020-W1129 HydrophobicContact CE-CD2 3.99Å; M1020-W1129 HydrophobicContact CE-CE3 4.03Å; M1020-W1129 HydrophobicContact CE-CG 4.03Å; M1020-W1129 HydrophobicContact SD-CB 4.07Å; M1020-W1129 HydrophobicContact SD-CG 4.21Å
1021	L	42.7	Very low	47.4	Very low	141 Å²	141	99.6 Å²	99.6	74%	0.738	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-14.8	-172	-93.5	147	0	0	0	114.7
1022	D	42.3	Very low	44.7	Very low	80 Å²	80	105.8 Å²	105.8	43%	0.428	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-110.2	24.9	-171.6	-88.6	-11	0	0	0	115.4	M1020 S1024 L1025	M1020-D1022 VanDerWaalsContact C-N 3.28Å; M1020-D1022 PolarHBondContact O-N 3.44Å; D1022-S1024 PolarHBondContact O-N 3.19Å; D1022-L1025 PolarHBondContact O-N 3.32Å
1023	S	39	Very low	42	Very low	80 Å²	80	111.3 Å²	111.3	56%	0.559	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	1.6	177.3	65.8	0	0	0	0	115.8
1024	S	38.3	Very low	39.7	Very low	104 Å²	104	119.7 Å²	119.7	73%	0.727	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-6.4	175.1	58	0	0	0	0	115.3	D1022	D1022-S1024 PolarHBondContact O-N 3.19Å
1025	L	33.3	Very low	37.6	Very low	123 Å²	123	117.7 Å²	117.7	64%	0.644	63%	0.634	S	S	*	*			trans	-109.3	8.2	-169.6	-86.3	159.6	0	0	0	117.6	D1022 G1027	D1022-L1025 PolarHBondContact O-N 3.32Å; L1025-G1027 PolarHBondContact O-N 3.44Å
1026	I	34.2	Very low	36	Very low	135 Å²	135	121.3 Å²	121.3	69%	0.692	66%	0.66	S	S	*	*			trans	-79.9	68.8	169.7	-50.8	174.4	0	0	0	109.2
1027	G	29.9	Very low	34.7	Very low	60 Å²	60	120 Å²	120	62%	0.619	67%	0.665	S	S	*	*			trans	-145.5	52.4	176.8	0	0	0	0	0	109.3	L1025 K1029	L1025-G1027 PolarHBondContact O-N 3.44Å; G1027-K1029 VanDerWaalsContact C-N 3.25Å; G1027-K1029 PolarHBondContact O-N 3.12Å
1028	I	28.9	Very low	33.4	Very low	160 Å²	160	117.3 Å²	117.3	82%	0.821	67%	0.668	S	S	*	*			trans	-67.9	93.2	170.9	-59.1	175.2	0	0	0	106.3	E1030	I1028-E1030 PolarHBondContact O-N 3.43Å; I1028-E1030 VanDerWaalsContact O-N 3.14Å
1029	K	27.1	Very low	32.3	Very low	174 Å²	174	118.8 Å²	118.8	76%	0.757	67%	0.673	S	S	*	*			trans	-59	111.3	164.8	-78.1	179.6	173.9	176.8	0	107	G1027 N1031	G1027-K1029 VanDerWaalsContact C-N 3.25Å; G1027-K1029 PolarHBondContact O-N 3.12Å; K1029-N1031 PolarHBondContact O-N 3.21Å
1030	E	27.9	Very low	30.9	Very low	184 Å²	184	122.7 Å²	122.7	86%	0.86	69%	0.692	S	S	*	*			trans	-58.5	91.8	157.8	-69.1	-178.5	156.7	0	0	107.1	I1028	I1028-E1030 PolarHBondContact O-N 3.43Å; I1028-E1030 VanDerWaalsContact O-N 3.14Å
1031	N	27.2	Very low	29.9	Very low	138 Å²	138	131.6 Å²	131.6	74%	0.738	73%	0.726	S	S	*	*			trans	-130.6	126.2	172.1	-95.2	-6.5	0	0	0	110	K1029	K1029-N1031 PolarHBondContact O-N 3.21Å
1032	N	28.5	Very low	29.1	Very low	145 Å²	145	132 Å²	132	78%	0.775	73%	0.729	S	S	*	*			trans	-60.7	162.1	-178.9	-63.5	-40	0	0	0	112.9
1033	D	27.1	Very low	28.3	Very low	152 Å²	152	135.8 Å²	135.8	81%	0.813	75%	0.749	S	S	*	*			trans	76.1	91.2	158	-54.8	-28.4	0	0	0	116.9	S1035	D1033-S1035 PolarHBondContact O-N 2.89Å
1034	I	26.6	Very low	27.8	Very low	182 Å²	182	138 Å²	138	93%	0.933	76%	0.759	S	S	*	*			trans	-68.7	103	164.6	-62.7	162.4	0	0	0	108
1035	S	24.8	Very low	27.4	Very low	100 Å²	100	141 Å²	141	70%	0.699	76%	0.759	S	S	*	*			trans	-144	100.2	156.9	66.6	0	0	0	0	111.8	D1033	D1033-S1035 PolarHBondContact O-N 2.89Å
1036	S	25.8	Very low	27.5	Very low	97 Å²	97	137.5 Å²	137.5	68%	0.678	75%	0.749	S	S	*	*			trans	41.2	121.9	143.2	59.3	0	0	0	0	121.6
1037	T	26	Very low	27.8	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	75%	0.751	S	S	*	*			trans	67.5	125.7	140.4	51.7	0	0	0	0	116.8
1038	T	24.4	Very low	28.5	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	76%	0.759	S	S	*	*			cis	-175.4	148.6	35.7	10.6	0	0	0	0	109
1039	T	23.9	Very low	29.5	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	75%	0.745	S	S	*	*			trans	56.3	135.9	149.5	57.9	0	0	0	0	118.9
1040	D	23.6	Very low	30.4	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	73%	0.731	S	S	*	*			cis	-167.2	160.9	3.8	-97.8	-33.2	0	0	0	105.7
1041	Y	26.1	Very low	31.6	Very low	216 Å²	216	131.6 Å²	131.6	85%	0.847	71%	0.709	S	S	*	*			trans	71.7	83.6	177.8	-68.8	-85.5	0	0	0	117
1042	N	26.1	Very low	32.6	Very low	149 Å²	149	129.5 Å²	129.5	80%	0.797	70%	0.701	S	S	*	*			trans	-152.1	115.4	135.5	-92.5	-32.5	0	0	0	109.3	T1044	N1042-T1044 PolarHBondContact O-N 3.18Å; N1042-T1044 PolarHBondContact O-OG1 3.25Å
1043	N	26.9	Very low	33.7	Very low	160 Å²	160	123.9 Å²	123.9	86%	0.856	67%	0.671	S	S	*	*			trans	-58.6	81	169.3	-78.9	-22.7	0	0	0	110	F1045	N1043-F1045 PolarHBondContact O-N 3.44Å
1044	T	26.8	Very low	34.7	Very low	126 Å²	126	121.9 Å²	121.9	77%	0.773	66%	0.66	S	S	*	*			trans	-78.6	105.1	167.5	28.3	0	0	0	0	106.8	N1042	N1042-T1044 PolarHBondContact O-N 3.18Å; N1042-T1044 PolarHBondContact O-OG1 3.25Å
1045	F	30.4	Very low	35.4	Very low	168 Å²	168	122.8 Å²	122.8	74%	0.737	65%	0.653	S	S	*	*			trans	-59.4	141.9	174.2	-92.8	-84.1	0	0	0	110.7	N1043	N1043-F1045 PolarHBondContact O-N 3.44Å
1046	A	35.1	Very low	36.1	Very low	50 Å²	50	119.1 Å²	119.1	41%	0.413	63%	0.627	S	S	.	*			trans	-63.9	143.2	-167.7	0	0	0	0	0	112.6	E1048	A1046-E1048 HydrophobicContact CB-CG 4.26Å; A1046-E1048 PolarHBondContact O-N 3.47Å
1047	P	41.4	Very low	36.6	Very low	115 Å²	115	116.4 Å²	116.4	75%	0.747	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-62.4	7.1	175	24.6	-33	0	0	0	115.1	N1049	P1047-N1049 VanDerWaalsContact C-N 3.33Å; P1047-N1049 PolarHBondContact O-N 3.44Å
1048	E	44.6	Very low	37.2	Very low	169 Å²	169	112.3 Å²	112.3	79%	0.79	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-71.7	-18.1	-176.1	-65.4	-177.9	177.3	0	0	114.2	A1046	A1046-E1048 HydrophobicContact CB-CG 4.26Å; A1046-E1048 PolarHBondContact O-N 3.47Å
1049	N	48.8	Very low	37.9	Very low	98 Å²	98	113.4 Å²	113.4	52%	0.524	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-101	17.5	-178.7	-61.4	-11	0	0	0	114	P1047 E1068	P1047-N1049 VanDerWaalsContact C-N 3.33Å; P1047-N1049 PolarHBondContact O-N 3.44Å; N1049-E1068 WeakPolarHBondContact O-CB 3.36Å; N1049-E1068 PolarHBondContact O-N 2.92Å
1050	W	46.7	Very low	38.6	Very low	121 Å²	121	112.4 Å²	112.4	46%	0.458	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127	118.3	-173.5	-74.6	85	0	0	0	109.1	I1065 P1067	W1050-I1065 HydrophobicContact CB-CG2 3.55Å; W1050-I1065 HydrophobicContact CD2-CG2 4.15Å; W1050-I1065 HydrophobicContact CE3-CB 4.34Å; W1050-I1065 HydrophobicContact CE3-CG2 3.67Å; W1050-I1065 HydrophobicContact CG-CG2 4.16Å; W1050-P1067 HydrophobicContact CE3-CG 4.03Å; W1050-P1067 HydrophobicContact CH2-CG 3.89Å; W1050-P1067 HydrophobicContact CZ2-CG 4.41Å; W1050-P1067 HydrophobicContact CZ3-CG 3.68Å
1051	E	52.8	Low	39.4	Very low	86 Å²	86	113.8 Å²	113.8	40%	0.402	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	129.1	178.3	-67.4	-167.1	163.5	0	0	109.7	I1053 I1066 A1071	E1051-I1053 PolarHBondContact O-N 3.25Å; E1051-I1066 PolarHBondContact N-O 3Å; E1051-I1066 PolarHBondContact O-N 3.21Å; E1051-A1071 HydrophobicContact CB-CB 4.03Å; E1051-A1071 HydrophobicContact CG-CB 4.29Å; E1051-A1071 WeakPolarHBondContact OE2-CB 3.24Å
1052	V	49.4	Very low	40.1	Very low	93 Å²	93	113.5 Å²	113.5	56%	0.564	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.2	109.4	167.8	-175.6	0	0	0	0	107	P1063 I1065	V1052-P1063 HydrophobicContact CG1-CB 4.09Å; V1052-I1065 HydrophobicContact CG2-CG1 4.25Å
1053	I	50.3	Low	41	Very low	28 Å²	28	110.3 Å²	110.3	14%	0.144	57%	0.567	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97	118.8	173.1	-49.3	-167.9	0	0	0	107.4	E1051 Y1055 Q1064 I1066 A1071 I1074	E1051-I1053 PolarHBondContact O-N 3.25Å; I1053-Y1055 PolarHBondContact O-N 3.11Å; I1053-Q1064 PolarHBondContact N-O 3.01Å; I1053-Q1064 VanDerWaalsContact N-O 3.17Å; I1053-I1066 HydrophobicContact CB-CD1 3.96Å; I1053-I1066 HydrophobicContact CB-CG1 4.42Å; I1053-I1066 HydrophobicContact CD1-CB 4.47Å; I1053-I1066 HydrophobicContact CD1-CD1 3.54Å; I1053-I1066 HydrophobicContact CD1-CG1 4.22Å; I1053-I1066 HydrophobicContact CG1-CD1 3.79Å; I1053-I1066 HydrophobicContact CG1-CG1 4.09Å; I1053-A1071 HydrophobicContact CD1-CB 3.76Å; I1053-I1074 HydrophobicContact CD1-CD1 4.45Å
1054	D	48.1	Very low	42.3	Very low	110 Å²	110	106.9 Å²	106.9	59%	0.588	55%	0.546	S	S	*	.	S	Bend	trans	-62	-24	179.5	-82.1	-29.8	0	0	0	112.3
1055	Y	40.8	Very low	43.9	Very low	200 Å²	200	105.6 Å²	105.6	78%	0.784	53%	0.534	S	S	*	.			trans	-155.9	83.6	-174.7	-65.8	-78.2	0	0	0	115.2	I1053 S1057	I1053-Y1055 PolarHBondContact O-N 3.11Å; Y1055-S1057 PolarHBondContact O-N 2.87Å
1056	P	40	Very low	45.6	Very low	24 Å²	24	98.2 Å²	98.2	16%	0.156	50%	0.501	C	S	.	.			trans	-87.8	96.4	157	36	-29.6	0	0	0	107.7	I1066	P1056-I1066 HydrophobicContact CB-CD1 3.99Å; P1056-I1066 HydrophobicContact CG-CD1 3.8Å
1057	S	37	Very low	47.1	Very low	39 Å²	39	96.8 Å²	96.8	27%	0.273	49%	0.488	S	S	.	.	S	Bend	trans	51.3	112.2	148.5	56.8	0	0	0	0	120	Y1055 R1087 S1108	Y1055-S1057 PolarHBondContact O-N 2.87Å; S1057-R1087 VanDerWaalsContact CB-NH2 3.28Å; S1057-S1108 WeakPolarHBondContact CB-O 3.43Å; S1057-S1108 WeakPolarHBondContact OG-CB 3.5Å; S1057-S1108 PolarHBondContact OG-O 3.19Å
1058	G	37.4	Very low	48.5	Very low	38 Å²	38	96.1 Å²	96.1	39%	0.392	48%	0.475	S	S	.	.	S	Bend	trans	72.8	108.5	151.7	0	0	0	0	0	116.8	R1060	G1058-R1060 VanDerWaalsContact C-N 3.25Å; G1058-R1060 PolarHBondContact O-N 3.33Å
1059	N	39.4	Very low	49.9	Very low	139 Å²	139	89.4 Å²	89.4	74%	0.743	44%	0.443	S	S	*	.	S	Bend	trans	57.6	1.9	170.5	-94	8.7	0	0	0	120.3
1060	R	39.1	Very low	51.2	Low	96 Å²	96	85.1 Å²	85.1	36%	0.362	42%	0.42	S	S	.	.			trans	-94.8	109.5	174.2	-64	-175.8	-178.8	179	4.8	110.7	G1058 R1062 D1134	G1058-R1060 VanDerWaalsContact C-N 3.25Å; G1058-R1060 PolarHBondContact O-N 3.33Å; R1060-R1062 PolarHBondContact O-N 2.73Å; R1060-D1134 IonicContact CZ-OD2 3.74Å; R1060-D1134 IonicContact NH2-OD2 2.91Å; R1060-D1134 PolarHBondContact NH2-OD2 3.5Å
1061	N	41.4	Very low	52.5	Low	164 Å²	164	79.3 Å²	79.3	88%	0.877	40%	0.398	S	S	*	.			trans	-83.5	22	178	-74.9	-11.9	0	0	0	113.8
1062	R	39.9	Very low	53.9	Low	210 Å²	210	79.9 Å²	79.9	79%	0.792	40%	0.399	S	S	*	.	S	Bend	trans	-136.2	134.1	-179.7	-66.6	-172.4	-177.8	-175.2	1	111.2	R1060	R1060-R1062 PolarHBondContact O-N 2.73Å
1063	P	44.2	Very low	55.4	Low	83 Å²	83	75.4 Å²	75.4	54%	0.539	37%	0.373	S	S	.	.			trans	-58.6	138.1	171.8	23.5	-31.1	0	0	0	109.5	V1052	V1052-P1063 HydrophobicContact CG1-CB 4.09Å
1064	Q	55.7	Low	56.9	Low	88 Å²	88	75.1 Å²	75.1	41%	0.411	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.4	-179.2	-164.6	170.8	4.4	0	0	109.2	I1053 I1066	I1053-Q1064 PolarHBondContact N-O 3.01Å; I1053-Q1064 VanDerWaalsContact N-O 3.17Å; Q1064-I1066 HydrophobicContact CB-CG1 4.48Å
1065	I	58.8	Low	58.5	Low	99 Å²	99	74.6 Å²	74.6	51%	0.508	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	116.7	171.3	-45.4	-173.7	0	0	0	107	W1050 V1052	W1050-I1065 HydrophobicContact CB-CG2 3.55Å; W1050-I1065 HydrophobicContact CD2-CG2 4.15Å; W1050-I1065 HydrophobicContact CE3-CB 4.34Å; W1050-I1065 HydrophobicContact CE3-CG2 3.67Å; W1050-I1065 HydrophobicContact CG-CG2 4.16Å; V1052-I1065 HydrophobicContact CG2-CG1 4.25Å
1066	I	66.7	Low	60.6	Low	12 Å²	12	67.9 Å²	67.9	6%	0.062	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.4	-177	-36.6	-173.5	0	0	0	109	E1051 I1053 P1056 Q1064 E1068 L1070 I1074	E1051-I1066 PolarHBondContact N-O 3Å; E1051-I1066 PolarHBondContact O-N 3.21Å; I1053-I1066 HydrophobicContact CB-CD1 3.96Å; I1053-I1066 HydrophobicContact CB-CG1 4.42Å; I1053-I1066 HydrophobicContact CD1-CB 4.47Å; I1053-I1066 HydrophobicContact CD1-CD1 3.54Å; I1053-I1066 HydrophobicContact CD1-CG1 4.22Å; I1053-I1066 HydrophobicContact CG1-CD1 3.79Å; I1053-I1066 HydrophobicContact CG1-CG1 4.09Å; P1056-I1066 HydrophobicContact CB-CD1 3.99Å; P1056-I1066 HydrophobicContact CG-CD1 3.8Å; Q1064-I1066 HydrophobicContact CB-CG1 4.48Å; I1066-E1068 PolarHBondContact O-N 3.22Å; I1066-L1070 HydrophobicContact CG2-CB 3.81Å; I1066-L1070 HydrophobicContact CG2-CD2 3.47Å; I1066-L1070 VanDerWaalsContact CG2-CD2 3.47Å; I1066-L1070 HydrophobicContact CG2-CG 3.74Å; I1066-I1074 HydrophobicContact CD1-CD1 4.28Å
1067	P	66.8	Low	62.8	Low	21 Å²	21	74.1 Å²	74.1	14%	0.136	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	139.7	174.1	-29.2	39.7	0	0	0	111.8	W1050 F1069 L1070 A1071 W1129	W1050-P1067 HydrophobicContact CE3-CG 4.03Å; W1050-P1067 HydrophobicContact CH2-CG 3.89Å; W1050-P1067 HydrophobicContact CZ2-CG 4.41Å; W1050-P1067 HydrophobicContact CZ3-CG 3.68Å; P1067-F1069 PolarHBondContact O-N 3.49Å; P1067-L1070 PolarHBondContact O-N 3.05Å; P1067-A1071 PolarHBondContact O-N 2.96Å; P1067-W1129 HydrophobicContact CB-CH2 4.39Å; P1067-W1129 HydrophobicContact CB-CZ2 3.84Å; P1067-W1129 HydrophobicContact CG-CZ2 3.79Å
1068	E	69.7	Low	65.2	Low	100 Å²	100	73.7 Å²	73.7	47%	0.467	36%	0.363	S	S	.	.	H	α-helix	trans	-48.9	-38.1	-178.4	-175.7	-173.5	176.7	0	0	112.7	N1049 I1066 L1070 A1071 F1072	N1049-E1068 WeakPolarHBondContact O-CB 3.36Å; N1049-E1068 PolarHBondContact O-N 2.92Å; I1066-E1068 PolarHBondContact O-N 3.22Å; E1068-L1070 PolarHBondContact O-N 3.22Å; E1068-A1071 CarbonylContact O-C 3.44Å; E1068-A1071 WeakPolarHBondContact O-CB 3.09Å; E1068-A1071 PolarHBondContact O-N 3.05Å; E1068-F1072 WeakPolarHBondContact O-CB 3.39Å; E1068-F1072 PolarHBondContact O-N 3.41Å
1069	F	75.4	Confident	67.5	Low	29 Å²	29	72.4 Å²	72.4	13%	0.127	35%	0.346	C	S	.	.	H	α-helix	trans	-62.5	-42.9	177.3	174.9	-106.3	0	0	0	113.6	V1019 P1067 A1071 F1072 L1073 L1126 W1129	V1019-F1069 HydrophobicContact CG1-CB 3.99Å; V1019-F1069 HydrophobicContact CG2-CB 4.36Å; P1067-F1069 PolarHBondContact O-N 3.49Å; F1069-A1071 VanDerWaalsContact C-N 3.33Å; F1069-F1072 WeakPolarHBondContact O-CB 3.49Å; F1069-F1072 PolarHBondContact O-N 3.46Å; F1069-L1073 HydrophobicContact CD1-CD1 4.25Å; F1069-L1073 HydrophobicContact CE1-CD1 3.53Å; F1069-L1073 HydrophobicContact CE1-CG 4.24Å; F1069-L1073 HydrophobicContact CE2-CD1 4.42Å; F1069-L1073 HydrophobicContact CE2-CG 4.34Å; F1069-L1073 HydrophobicContact CZ-CD1 3.64Å; F1069-L1073 HydrophobicContact CZ-CD2 4.38Å; F1069-L1073 HydrophobicContact CZ-CG 4.04Å; F1069-L1073 PolarHBondContact O-N 3.04Å; F1069-L1126 HydrophobicContact CE1-CD1 3.73Å; F1069-L1126 HydrophobicContact CZ-CD1 4.22Å; F1069-W1129 AromaticContact CD1-CH2 3.72Å; F1069-W1129 HydrophobicContact CD1-CH2 3.72Å; F1069-W1129 AromaticContact CD1-CZ3 3.67Å; F1069-W1129 HydrophobicContact CD1-CZ3 3.67Å; F1069-W1129 HydrophobicContact CE1-CH2 4.48Å; F1069-W1129 AromaticContact CE1-CZ3 3.98Å; F1069-W1129 HydrophobicContact CE1-CZ3 3.98Å
1070	L	75.9	Confident	69.7	Low	7 Å²	7	70.3 Å²	70.3	4%	0.037	33%	0.332	C	S	.	.	H	α-helix	trans	-72.4	-33.5	176.4	177.9	58.6	0	0	0	110.4	I1066 P1067 E1068 F1072 L1073 I1074 W1079 W1129 L1130 C1133	I1066-L1070 HydrophobicContact CG2-CB 3.81Å; I1066-L1070 HydrophobicContact CG2-CD2 3.47Å; I1066-L1070 VanDerWaalsContact CG2-CD2 3.47Å; I1066-L1070 HydrophobicContact CG2-CG 3.74Å; P1067-L1070 PolarHBondContact O-N 3.05Å; E1068-L1070 PolarHBondContact O-N 3.22Å; L1070-F1072 VanDerWaalsContact C-N 3.35Å; L1070-L1073 PolarHBondContact O-N 3.39Å; L1070-I1074 HydrophobicContact CD1-CD1 3.99Å; L1070-I1074 HydrophobicContact CD1-CG1 4.02Å; L1070-I1074 HydrophobicContact CD2-CD1 4.47Å; L1070-I1074 HydrophobicContact CG-CD1 3.74Å; L1070-I1074 HydrophobicContact CG-CG1 4.27Å; L1070-I1074 WeakPolarHBondContact O-CB 3.49Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.36Å; L1070-I1074 PolarHBondContact O-N 3.06Å; L1070-W1079 HydrophobicContact CD1-CH2 4.34Å; L1070-W1129 HydrophobicContact CB-CH2 3.59Å; L1070-W1129 HydrophobicContact CB-CZ3 4.16Å; L1070-L1130 HydrophobicContact CD1-CD2 4.4Å; L1070-C1133 HydrophobicContact CD2-CB 3.9Å
1071	A	73.8	Confident	72	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-44.4	171.6	0	0	0	0	0	111.5	E1051 I1053 P1067 E1068 F1069 L1073 I1074 N1075	E1051-A1071 HydrophobicContact CB-CB 4.03Å; E1051-A1071 HydrophobicContact CG-CB 4.29Å; E1051-A1071 WeakPolarHBondContact OE2-CB 3.24Å; I1053-A1071 HydrophobicContact CD1-CB 3.76Å; P1067-A1071 PolarHBondContact O-N 2.96Å; E1068-A1071 CarbonylContact O-C 3.44Å; E1068-A1071 WeakPolarHBondContact O-CB 3.09Å; E1068-A1071 PolarHBondContact O-N 3.05Å; F1069-A1071 VanDerWaalsContact C-N 3.33Å; A1071-L1073 PolarHBondContact O-N 3.3Å; A1071-I1074 PolarHBondContact O-N 3.23Å; A1071-N1075 VanDerWaalsContact O-CB 3.28Å; A1071-N1075 WeakPolarHBondContact O-CB 3.25Å; A1071-N1075 PolarHBondContact O-N 3.23Å; A1071-N1075 PolarHBondContact O-ND2 3.08Å; A1071-N1075 VanDerWaalsContact O-ND2 3.15Å
1072	F	81.7	Confident	74.1	Confident	97 Å²	97	62.6 Å²	62.6	43%	0.425	30%	0.295	S	S	.	.	H	α-helix	trans	-55.1	-49.9	171.8	164.3	-96.4	0	0	0	111.8	E1068 F1069 L1070 N1075 Q1076	E1068-F1072 WeakPolarHBondContact O-CB 3.39Å; E1068-F1072 PolarHBondContact O-N 3.41Å; F1069-F1072 WeakPolarHBondContact O-CB 3.49Å; F1069-F1072 PolarHBondContact O-N 3.46Å; L1070-F1072 VanDerWaalsContact C-N 3.35Å; F1072-N1075 PolarHBondContact O-N 3.19Å; F1072-Q1076 WeakPolarHBondContact O-CG 3.28Å; F1072-Q1076 PolarHBondContact O-N 3.36Å
1073	L	81.5	Confident	76.3	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-45.4	178.2	-73.7	179	0	0	0	112.1	L994 I1011 F1069 L1070 A1071 N1075 Q1076 W1079	L994-L1073 HydrophobicContact CD2-CD2 4.05Å; I1011-L1073 HydrophobicContact CG2-CD2 4.46Å; F1069-L1073 HydrophobicContact CD1-CD1 4.25Å; F1069-L1073 HydrophobicContact CE1-CD1 3.53Å; F1069-L1073 HydrophobicContact CE1-CG 4.24Å; F1069-L1073 HydrophobicContact CE2-CD1 4.42Å; F1069-L1073 HydrophobicContact CE2-CG 4.34Å; F1069-L1073 HydrophobicContact CZ-CD1 3.64Å; F1069-L1073 HydrophobicContact CZ-CD2 4.38Å; F1069-L1073 HydrophobicContact CZ-CG 4.04Å; F1069-L1073 PolarHBondContact O-N 3.04Å; L1070-L1073 PolarHBondContact O-N 3.39Å; A1071-L1073 PolarHBondContact O-N 3.3Å; L1073-N1075 VanDerWaalsContact C-N 3.28Å; L1073-N1075 PolarHBondContact O-N 3.41Å; L1073-Q1076 VanDerWaalsContact O-CB 3.28Å; L1073-Q1076 WeakPolarHBondContact O-CB 3.35Å; L1073-Q1076 PolarHBondContact O-N 3.02Å; L1073-Q1076 VanDerWaalsContact O-N 3.12Å; L1073-W1079 HydrophobicContact CB-CE3 4.26Å; L1073-W1079 HydrophobicContact CB-CZ3 4.35Å; L1073-W1079 VanDerWaalsContact O-CB 3.23Å; L1073-W1079 WeakPolarHBondContact O-CB 3.41Å
1074	I	80.7	Confident	78.2	Confident	21 Å²	21	54.8 Å²	54.8	11%	0.108	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-38.3	179.9	-71.5	168.6	0	0	0	110.7	I1053 I1066 L1070 A1071 Q1076 W1079 H1080	I1053-I1074 HydrophobicContact CD1-CD1 4.45Å; I1066-I1074 HydrophobicContact CD1-CD1 4.28Å; L1070-I1074 HydrophobicContact CD1-CD1 3.99Å; L1070-I1074 HydrophobicContact CD1-CG1 4.02Å; L1070-I1074 HydrophobicContact CD2-CD1 4.47Å; L1070-I1074 HydrophobicContact CG-CD1 3.74Å; L1070-I1074 HydrophobicContact CG-CG1 4.27Å; L1070-I1074 WeakPolarHBondContact O-CB 3.49Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.36Å; L1070-I1074 PolarHBondContact O-N 3.06Å; A1071-I1074 PolarHBondContact O-N 3.23Å; I1074-Q1076 PolarHBondContact O-N 3.39Å; I1074-W1079 HydrophobicContact CG1-CZ2 4.06Å; I1074-H1080 PolarHBondContact O-CE1 2.86Å; I1074-H1080 PolarHBondContact O-NE2 3.18Å; I1074-H1080 VanDerWaalsContact O-NE2 3.11Å
1075	N	82.1	Confident	79.5	Confident	99 Å²	99	51.6 Å²	51.6	53%	0.529	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-8.1	178.9	-71.2	-25.2	0	0	0	113.3	A1071 F1072 L1073 K1077	A1071-N1075 VanDerWaalsContact O-CB 3.28Å; A1071-N1075 WeakPolarHBondContact O-CB 3.25Å; A1071-N1075 PolarHBondContact O-N 3.23Å; A1071-N1075 PolarHBondContact O-ND2 3.08Å; A1071-N1075 VanDerWaalsContact O-ND2 3.15Å; F1072-N1075 PolarHBondContact O-N 3.19Å; L1073-N1075 VanDerWaalsContact C-N 3.28Å; L1073-N1075 PolarHBondContact O-N 3.41Å; N1075-K1077 PolarHBondContact O-N 2.66Å
1076	Q	85.4	Confident	80.6	Confident	60 Å²	60	47.6 Å²	47.6	28%	0.28	23%	0.228	S	C	.	.	S	Bend	trans	-66.7	131	174	-67.1	-63.6	-28.3	0	0	110.6	I1011 F1072 L1073 I1074 L1078 W1079 H1080	I1011-Q1076 HydrophobicContact CD1-CB 3.91Å; I1011-Q1076 HydrophobicContact CD1-CG 3.96Å; F1072-Q1076 WeakPolarHBondContact O-CG 3.28Å; F1072-Q1076 PolarHBondContact O-N 3.36Å; L1073-Q1076 VanDerWaalsContact O-CB 3.28Å; L1073-Q1076 WeakPolarHBondContact O-CB 3.35Å; L1073-Q1076 PolarHBondContact O-N 3.02Å; L1073-Q1076 VanDerWaalsContact O-N 3.12Å; I1074-Q1076 PolarHBondContact O-N 3.39Å; Q1076-L1078 PolarHBondContact O-N 3Å; Q1076-L1078 VanDerWaalsContact O-N 3.13Å; Q1076-W1079 HydrophobicContact CB-CB 4.24Å; Q1076-W1079 WeakPolarHBondContact O-CB 3.49Å; Q1076-W1079 PolarHBondContact O-N 3.07Å; Q1076-H1080 PolarHBondContact O-N 3.4Å
1077	K	86.2	Confident	81.3	Confident	154 Å²	154	51.2 Å²	51.2	67%	0.67	24%	0.241	S	C	*	.	H	α-helix	trans	-52.8	-39.6	176.1	-174.9	-179.1	-178.9	-177	0	111.9	N1075 H1080 Q1081	N1075-K1077 PolarHBondContact O-N 2.66Å; K1077-H1080 PolarHBondContact O-N 3.44Å; K1077-Q1081 HydrophobicContact CG-CG 4.5Å; K1077-Q1081 VanDerWaalsContact O-CG 3.31Å; K1077-Q1081 WeakPolarHBondContact O-CG 3.5Å; K1077-Q1081 PolarHBondContact O-N 3.32Å
1078	L	86.5	Confident	81.8	Confident	31 Å²	31	54.5 Å²	54.5	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-39.5	-179.6	-168.1	66.7	0	0	0	111.9	L992 N1009 I1011 Q1076 H1080 Q1081 T1082	L992-L1078 HydrophobicContact CD1-CB 4.25Å; L992-L1078 HydrophobicContact CD1-CD2 3.29Å; L992-L1078 HydrophobicContact CD1-CG 3.53Å; N1009-L1078 VanDerWaalsContact C-CD2 3.46Å; N1009-L1078 HydrophobicContact CB-CD1 4.15Å; N1009-L1078 HydrophobicContact CB-CD2 4.11Å; I1011-L1078 HydrophobicContact CD1-CD2 4.49Å; I1011-L1078 HydrophobicContact CG1-CD2 4.01Å; Q1076-L1078 PolarHBondContact O-N 3Å; Q1076-L1078 VanDerWaalsContact O-N 3.13Å; L1078-H1080 VanDerWaalsContact C-N 3.34Å; L1078-H1080 PolarHBondContact O-N 3.27Å; L1078-Q1081 PolarHBondContact O-N 3.22Å; L1078-T1082 WeakPolarHBondContact O-CB 3.34Å; L1078-T1082 PolarHBondContact O-N 2.93Å; L1078-T1082 PolarHBondContact O-OG1 3.07Å
1079	W	87.7	Confident	81.8	Confident	10 Å²	10	51.1 Å²	51.1	4%	0.038	24%	0.242	C	C	.	.	H	α-helix	trans	-57	-48.3	174	-179.8	-80.1	0	0	0	111.4	L992 L1070 L1073 I1074 Q1076 T1082 T1083 P1110 L1112 I1135	L992-W1079 HydrophobicContact CD2-CB 4.41Å; L992-W1079 HydrophobicContact CD2-CD2 4.38Å; L992-W1079 HydrophobicContact CD2-CE3 3.6Å; L992-W1079 HydrophobicContact CD2-CZ3 4.28Å; L1070-W1079 HydrophobicContact CD1-CH2 4.34Å; L1073-W1079 HydrophobicContact CB-CE3 4.26Å; L1073-W1079 HydrophobicContact CB-CZ3 4.35Å; L1073-W1079 VanDerWaalsContact O-CB 3.23Å; L1073-W1079 WeakPolarHBondContact O-CB 3.41Å; I1074-W1079 HydrophobicContact CG1-CZ2 4.06Å; Q1076-W1079 HydrophobicContact CB-CB 4.24Å; Q1076-W1079 WeakPolarHBondContact O-CB 3.49Å; Q1076-W1079 PolarHBondContact O-N 3.07Å; W1079-T1082 PolarHBondContact O-N 2.72Å; W1079-T1083 VanDerWaalsContact O-CB 3.3Å; W1079-T1083 WeakPolarHBondContact O-CB 3.13Å; W1079-T1083 PolarHBondContact O-N 3.35Å; W1079-T1083 PolarHBondContact O-OG1 3.4Å; W1079-P1110 HydrophobicContact CD2-CG 3.78Å; W1079-P1110 VanDerWaalsContact CE2-CD 3.41Å; W1079-P1110 HydrophobicContact CE3-CG 3.78Å; W1079-P1110 HydrophobicContact CG-CG 4.39Å; W1079-P1110 HydrophobicContact CH2-CG 4.16Å; W1079-P1110 VanDerWaalsContact CZ2-CD 3.46Å; W1079-P1110 HydrophobicContact CZ2-CG 4.17Å; W1079-P1110 HydrophobicContact CZ3-CG 3.98Å; W1079-L1112 HydrophobicContact CH2-CD1 4.25Å; W1079-L1112 HydrophobicContact CZ3-CD1 4.05Å; W1079-L1112 HydrophobicContact CZ3-CD2 3.94Å; W1079-I1135 HydrophobicContact CH2-CD1 4.04Å; W1079-I1135 HydrophobicContact CH2-CG2 4.45Å; W1079-I1135 HydrophobicContact CZ2-CD1 4.09Å
1080	H	85	Confident	81.5	Confident	96 Å²	96	51.2 Å²	51.2	44%	0.444	25%	0.246	S	C	.	.	H	α-helix	trans	-62.4	-43.5	177.2	-68.3	-50.4	0	0	0	112.6	I1074 Q1076 K1077 L1078 T1083 Q1084	I1074-H1080 PolarHBondContact O-CE1 2.86Å; I1074-H1080 PolarHBondContact O-NE2 3.18Å; I1074-H1080 VanDerWaalsContact O-NE2 3.11Å; Q1076-H1080 PolarHBondContact O-N 3.4Å; K1077-H1080 PolarHBondContact O-N 3.44Å; L1078-H1080 VanDerWaalsContact C-N 3.34Å; L1078-H1080 PolarHBondContact O-N 3.27Å; H1080-T1083 PolarHBondContact O-N 2.97Å; H1080-Q1084 VanDerWaalsContact O-CB 3.28Å; H1080-Q1084 WeakPolarHBondContact O-CB 3.31Å; H1080-Q1084 PolarHBondContact O-N 2.84Å
1081	Q	86.3	Confident	81.1	Confident	95 Å²	95	54.6 Å²	54.6	44%	0.444	26%	0.263	S	S	.	.	H	α-helix	trans	-60.6	-48.8	178.1	-74.3	174.8	-23.1	0	0	111.9	K1077 L1078 Q1084 A1085	K1077-Q1081 HydrophobicContact CG-CG 4.5Å; K1077-Q1081 VanDerWaalsContact O-CG 3.31Å; K1077-Q1081 WeakPolarHBondContact O-CG 3.5Å; K1077-Q1081 PolarHBondContact O-N 3.32Å; L1078-Q1081 PolarHBondContact O-N 3.22Å; Q1081-Q1084 PolarHBondContact O-N 3.18Å; Q1081-A1085 PolarHBondContact O-N 2.66Å
1082	T	86.6	Confident	80.8	Confident	3 Å²	3	61 Å²	61	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-67.4	-39.9	-179.8	-53.9	0	0	0	0	111.7	P989 D990 L992 L1078 W1079 Q1084 A1085 R1086 P1110	P989-T1082 WeakPolarHBondContact O-CG2 3.19Å; D990-T1082 VanDerWaalsContact O-CG2 3.23Å; D990-T1082 WeakPolarHBondContact O-CG2 3.49Å; L992-T1082 HydrophobicContact CB-CG2 4.1Å; L1078-T1082 WeakPolarHBondContact O-CB 3.34Å; L1078-T1082 PolarHBondContact O-N 2.93Å; L1078-T1082 PolarHBondContact O-OG1 3.07Å; W1079-T1082 PolarHBondContact O-N 2.72Å; T1082-Q1084 VanDerWaalsContact C-N 3.34Å; T1082-Q1084 PolarHBondContact O-N 3Å; T1082-A1085 WeakPolarHBondContact O-CB 3.42Å; T1082-A1085 PolarHBondContact O-N 3.29Å; T1082-R1086 PolarHBondContact O-N 2.85Å; T1082-P1110 HydrophobicContact CG2-CB 3.34Å
1083	T	85.9	Confident	79.8	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.043	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-43.5	174	-56.4	0	0	0	0	111.3	W1079 H1080 R1086 R1087 S1108 P1110	W1079-T1083 VanDerWaalsContact O-CB 3.3Å; W1079-T1083 WeakPolarHBondContact O-CB 3.13Å; W1079-T1083 PolarHBondContact O-N 3.35Å; W1079-T1083 PolarHBondContact O-OG1 3.4Å; H1080-T1083 PolarHBondContact O-N 2.97Å; T1083-R1086 WeakPolarHBondContact O-CB 3.42Å; T1083-R1086 PolarHBondContact O-N 2.81Å; T1083-R1087 WeakPolarHBondContact O-CG 3.16Å; T1083-R1087 PolarHBondContact O-N 3Å; T1083-S1108 WeakPolarHBondContact CG2-O 3.47Å; T1083-P1110 WeakPolarHBondContact OG1-CD 2.99Å
1084	Q	83.8	Confident	78.6	Confident	121 Å²	121	60 Å²	60	57%	0.565	30%	0.296	S	S	*	.	H	α-helix	trans	-64.6	-42.4	177.8	-172.7	177.9	9	0	0	111.4	H1080 Q1081 T1082 R1086 R1087 L1088	H1080-Q1084 VanDerWaalsContact O-CB 3.28Å; H1080-Q1084 WeakPolarHBondContact O-CB 3.31Å; H1080-Q1084 PolarHBondContact O-N 2.84Å; Q1081-Q1084 PolarHBondContact O-N 3.18Å; T1082-Q1084 VanDerWaalsContact C-N 3.34Å; T1082-Q1084 PolarHBondContact O-N 3Å; Q1084-R1086 VanDerWaalsContact C-N 3.27Å; Q1084-R1086 PolarHBondContact O-N 3.39Å; Q1084-R1087 PolarHBondContact O-N 3.11Å; Q1084-L1088 HydrophobicContact CG-CD1 4.24Å; Q1084-L1088 HydrophobicContact CG-CG 4.47Å; Q1084-L1088 VanDerWaalsContact O-CG 3.31Å; Q1084-L1088 WeakPolarHBondContact O-CG 3.32Å; Q1084-L1088 PolarHBondContact O-N 3.37Å
1085	A	83	Confident	77	Confident	21 Å²	21	66.4 Å²	66.4	17%	0.174	33%	0.326	C	S	.	.	H	α-helix	trans	-55	-45.8	173.5	0	0	0	0	0	110.9	P989 Q1081 T1082 L1088 L1089	P989-A1085 HydrophobicContact CB-CB 4.07Å; P989-A1085 WeakPolarHBondContact O-CB 3.35Å; Q1081-A1085 PolarHBondContact O-N 2.66Å; T1082-A1085 WeakPolarHBondContact O-CB 3.42Å; T1082-A1085 PolarHBondContact O-N 3.29Å; A1085-L1088 PolarHBondContact O-N 2.81Å; A1085-L1089 VanDerWaalsContact O-CG 3.3Å; A1085-L1089 WeakPolarHBondContact O-CG 3.49Å; A1085-L1089 PolarHBondContact O-N 2.86Å
1086	R	82.3	Confident	75.5	Confident	15 Å²	15	64.7 Å²	64.7	6%	0.057	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-41.6	177.4	-159.3	176.9	170.1	-169.2	-4.8	113.8	D990 T1082 T1083 Q1084 L1089 S1090 P1107 S1109 D1136 R1137	D990-R1086 HydrophobicContact CB-CB 3.9Å; D990-R1086 HydrophobicContact CB-CG 4.12Å; T1082-R1086 PolarHBondContact O-N 2.85Å; T1083-R1086 WeakPolarHBondContact O-CB 3.42Å; T1083-R1086 PolarHBondContact O-N 2.81Å; Q1084-R1086 VanDerWaalsContact C-N 3.27Å; Q1084-R1086 PolarHBondContact O-N 3.39Å; R1086-L1089 WeakPolarHBondContact O-CB 3.49Å; R1086-L1089 PolarHBondContact O-N 3.48Å; R1086-S1090 PolarHBondContact O-N 3.41Å; R1086-P1107 HydrophobicContact CB-CG 4.44Å; R1086-P1107 HydrophobicContact CG-CB 4.02Å; R1086-P1107 HydrophobicContact CG-CG 3.97Å; R1086-S1109 VanDerWaalsContact CD-O 3.28Å; R1086-S1109 WeakPolarHBondContact CD-O 3.41Å; R1086-S1109 PolarHBondContact NH1-O 3.01Å; R1086-D1136 IonicContact CZ-OD1 2.99Å; R1086-D1136 IonicContact CZ-OD2 3.25Å; R1086-D1136 IonicContact NH1-OD1 3.36Å; R1086-D1136 PolarHBondContact NH1-OD1 2.85Å; R1086-D1136 IonicContact NH1-OD2 3.14Å; R1086-D1136 PolarHBondContact NH1-OD2 2.87Å; R1086-D1136 IonicContact NH2-OD1 3.88Å; R1086-D1136 PolarHBondContact NH2-OD1 3.49Å; R1086-D1136 IonicContact NH2-OD2 3.99Å; R1086-D1136 PolarHBondContact NH2-OD2 3.22Å; R1086-R1137 VanDerWaalsContact NH2-NE 3.14Å
1087	R	80.7	Confident	73.6	Confident	89 Å²	89	65.3 Å²	65.3	34%	0.336	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-42.2	176.5	-73.6	-178.6	-174.8	169.5	8.8	112.2	S1057 T1083 Q1084 L1089 S1090 I1091 P1107	S1057-R1087 VanDerWaalsContact CB-NH2 3.28Å; T1083-R1087 WeakPolarHBondContact O-CG 3.16Å; T1083-R1087 PolarHBondContact O-N 3Å; Q1084-R1087 PolarHBondContact O-N 3.11Å; R1087-L1089 PolarHBondContact O-N 3.19Å; R1087-S1090 WeakPolarHBondContact CA-OG 3.24Å; R1087-S1090 PolarHBondContact O-N 3.3Å; R1087-S1090 VanDerWaalsContact O-N 3.17Å; R1087-S1090 PolarHBondContact O-OG 3.28Å; R1087-I1091 VanDerWaalsContact O-CG1 3.27Å; R1087-I1091 WeakPolarHBondContact O-CG1 3.25Å; R1087-I1091 PolarHBondContact O-N 3.46Å; R1087-P1107 HydrophobicContact CG-CG 4.14Å; R1087-P1107 VanDerWaalsContact CG-O 3.32Å; R1087-P1107 WeakPolarHBondContact CG-O 2.98Å; R1087-P1107 PolarHBondContact NE-O 2.91Å
1088	L	77.7	Confident	71.2	Confident	90 Å²	90	63.7 Å²	63.7	47%	0.471	34%	0.342	S	S	.	.	H	α-helix	trans	-59.2	-36.2	176.1	-71.4	171.1	0	0	0	111	Q1084 A1085 I1091 K1092	Q1084-L1088 HydrophobicContact CG-CD1 4.24Å; Q1084-L1088 HydrophobicContact CG-CG 4.47Å; Q1084-L1088 VanDerWaalsContact O-CG 3.31Å; Q1084-L1088 WeakPolarHBondContact O-CG 3.32Å; Q1084-L1088 PolarHBondContact O-N 3.37Å; A1085-L1088 PolarHBondContact O-N 2.81Å; L1088-I1091 PolarHBondContact O-N 3.08Å; L1088-K1092 WeakPolarHBondContact O-CB 3.03Å; L1088-K1092 VanDerWaalsContact O-CG 3.32Å; L1088-K1092 WeakPolarHBondContact O-CG 3.02Å; L1088-K1092 PolarHBondContact O-N 2.91Å
1089	L	69.7	Low	68.8	Low	29 Å²	29	72.7 Å²	72.7	15%	0.152	38%	0.38	C	S	.	.	H	α-helix	trans	-69.4	-42.1	174.7	-63.6	168.4	0	0	0	112.8	Y928 D990 A1085 R1086 R1087 I1091 K1092 S1093	Y928-L1089 HydrophobicContact CD1-CD1 3.67Å; Y928-L1089 HydrophobicContact CD1-CD2 3.43Å; Y928-L1089 VanDerWaalsContact CD1-CD2 3.43Å; Y928-L1089 HydrophobicContact CD1-CG 4.18Å; Y928-L1089 HydrophobicContact CE1-CD1 3.39Å; Y928-L1089 HydrophobicContact CE1-CD2 4.03Å; Y928-L1089 HydrophobicContact CE1-CG 4.33Å; Y928-L1089 HydrophobicContact CG-CD2 4.29Å; D990-L1089 HydrophobicContact CB-CD1 4.24Å; A1085-L1089 VanDerWaalsContact O-CG 3.3Å; A1085-L1089 WeakPolarHBondContact O-CG 3.49Å; A1085-L1089 PolarHBondContact O-N 2.86Å; R1086-L1089 WeakPolarHBondContact O-CB 3.49Å; R1086-L1089 PolarHBondContact O-N 3.48Å; R1087-L1089 PolarHBondContact O-N 3.19Å; L1089-I1091 VanDerWaalsContact C-N 3.26Å; L1089-I1091 PolarHBondContact O-N 3.18Å; L1089-K1092 PolarHBondContact O-N 3.48Å; L1089-S1093 WeakPolarHBondContact O-CB 3.35Å; L1089-S1093 PolarHBondContact O-N 3.35Å; L1089-S1093 PolarHBondContact O-OG 2.99Å
1090	S	69	Low	66.2	Low	30 Å²	30	79.7 Å²	79.7	21%	0.21	41%	0.413	C	S	.	.	H	α-helix	trans	-64.1	-33.5	175.1	62.8	0	0	0	0	112.4	R1086 R1087 S1093 S1094 P1107	R1086-S1090 PolarHBondContact O-N 3.41Å; R1087-S1090 WeakPolarHBondContact CA-OG 3.24Å; R1087-S1090 PolarHBondContact O-N 3.3Å; R1087-S1090 VanDerWaalsContact O-N 3.17Å; R1087-S1090 PolarHBondContact O-OG 3.28Å; S1090-S1093 WeakPolarHBondContact CA-OG 3.45Å; S1090-S1093 PolarHBondContact O-OG 3.06Å; S1090-S1094 PolarHBondContact O-N 3.15Å; S1090-S1094 PolarHBondContact O-OG 2.71Å; S1090-P1107 VanDerWaalsContact OG-CD 3.25Å; S1090-P1107 WeakPolarHBondContact OG-CD 3.46Å
1091	I	68.8	Low	63.7	Low	78 Å²	78	81 Å²	81	40%	0.4	43%	0.43	S	S	.	.	H	α-helix	trans	-73.4	-44.7	177.2	-66.6	163.7	0	0	0	110.4	R1087 L1088 L1089 S1093 S1094 Q1095	R1087-I1091 VanDerWaalsContact O-CG1 3.27Å; R1087-I1091 WeakPolarHBondContact O-CG1 3.25Å; R1087-I1091 PolarHBondContact O-N 3.46Å; L1088-I1091 PolarHBondContact O-N 3.08Å; L1089-I1091 VanDerWaalsContact C-N 3.26Å; L1089-I1091 PolarHBondContact O-N 3.18Å; I1091-S1093 VanDerWaalsContact C-N 3.27Å; I1091-S1093 PolarHBondContact O-N 2.92Å; I1091-S1094 PolarHBondContact O-N 2.93Å; I1091-S1094 VanDerWaalsContact O-N 3.12Å; I1091-S1094 PolarHBondContact O-OG 3.37Å; I1091-Q1095 WeakPolarHBondContact O-CG 3.3Å; I1091-Q1095 PolarHBondContact O-N 2.95Å; I1091-Q1095 VanDerWaalsContact O-N 3.13Å
1092	K	66	Low	61.3	Low	134 Å²	134	79.8 Å²	79.8	58%	0.583	43%	0.429	S	S	*	.	H	α-helix	trans	-59.9	-38.4	175.5	-76.6	-179.4	178	-172.2	0	112.1	T932 L1088 L1089 S1094	T932-K1092 HydrophobicContact CG2-CB 3.86Å; L1088-K1092 WeakPolarHBondContact O-CB 3.03Å; L1088-K1092 VanDerWaalsContact O-CG 3.32Å; L1088-K1092 WeakPolarHBondContact O-CG 3.02Å; L1088-K1092 PolarHBondContact O-N 2.91Å; L1089-K1092 PolarHBondContact O-N 3.48Å; K1092-S1094 VanDerWaalsContact C-N 3.3Å; K1092-S1094 PolarHBondContact O-N 2.79Å
1093	S	61.2	Low	58.9	Low	38 Å²	38	85.8 Å²	85.8	27%	0.266	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-11.1	177.4	61.9	0	0	0	0	114.7	L1089 S1090 I1091	L1089-S1093 WeakPolarHBondContact O-CB 3.35Å; L1089-S1093 PolarHBondContact O-N 3.35Å; L1089-S1093 PolarHBondContact O-OG 2.99Å; S1090-S1093 WeakPolarHBondContact CA-OG 3.45Å; S1090-S1093 PolarHBondContact O-OG 3.06Å; I1091-S1093 VanDerWaalsContact C-N 3.27Å; I1091-S1093 PolarHBondContact O-N 2.92Å
1094	S	55.8	Low	56.7	Low	38 Å²	38	88.5 Å²	88.5	27%	0.266	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-20.1	176.7	65	0	0	0	0	114.1	S1090 I1091 K1092 G1096 V1097	S1090-S1094 PolarHBondContact O-N 3.15Å; S1090-S1094 PolarHBondContact O-OG 2.71Å; I1091-S1094 PolarHBondContact O-N 2.93Å; I1091-S1094 VanDerWaalsContact O-N 3.12Å; I1091-S1094 PolarHBondContact O-OG 3.37Å; K1092-S1094 VanDerWaalsContact C-N 3.3Å; K1092-S1094 PolarHBondContact O-N 2.79Å; S1094-G1096 VanDerWaalsContact C-N 3.3Å; S1094-G1096 PolarHBondContact O-N 3.46Å; S1094-V1097 PolarHBondContact O-N 3.01Å
1095	Q	47.2	Very low	55	Low	156 Å²	156	88 Å²	88	73%	0.729	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	84.7	172.6	-73.7	-177.1	-8.3	0	0	110.6	I1091	I1091-Q1095 WeakPolarHBondContact O-CG 3.3Å; I1091-Q1095 PolarHBondContact O-N 2.95Å; I1091-Q1095 VanDerWaalsContact O-N 3.13Å
1096	G	51.7	Low	53.6	Low	63 Å²	63	89.8 Å²	89.8	65%	0.649	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	160.9	-18	-177.6	0	0	0	0	0	112.6	S1094	S1094-G1096 VanDerWaalsContact C-N 3.3Å; S1094-G1096 PolarHBondContact O-N 3.46Å
1097	V	43.8	Very low	52.6	Low	73 Å²	73	89.8 Å²	89.8	44%	0.442	49%	0.493	S	S	.	.	S	Bend	trans	-83.3	128	177.6	-172.2	0	0	0	0	109.7	S1094 V1102	S1094-V1097 PolarHBondContact O-N 3.01Å; V1097-V1102 HydrophobicContact CG1-CG2 4.06Å
1098	T	37.4	Very low	52	Low	120 Å²	120	87.1 Å²	87.1	74%	0.736	49%	0.488	S	S	*	.			trans	-51.4	152.9	174.7	39.1	0	0	0	0	112.2	E1100	T1098-E1100 PolarHBondContact O-N 3.38Å
1099	K	35.4	Very low	52	Low	220 Å²	220	82.9 Å²	82.9	96%	0.957	47%	0.466	S	S	*	.	S	Bend	trans	-61.6	48.4	-169.1	-62.5	179.7	175.2	177.9	0	116.4
1100	E	33.3	Very low	52.7	Low	157 Å²	157	81.5 Å²	81.5	73%	0.734	46%	0.459	S	S	*	.	S	Bend	trans	-81.8	144.5	152.1	-74.3	-169.3	163	0	0	108.4	T1098 V1102	T1098-E1100 PolarHBondContact O-N 3.38Å; E1100-V1102 WeakPolarHBondContact O-CG2 3.35Å; E1100-V1102 PolarHBondContact O-N 3.49Å
1101	P	32.3	Very low	53.5	Low	123 Å²	123	80.1 Å²	80.1	80%	0.799	45%	0.45	S	S	*	.			trans	-65.5	86	170.5	28.8	-32.2	0	0	0	107.2	N1103	P1101-N1103 VanDerWaalsContact C-N 3.32Å; P1101-N1103 PolarHBondContact O-N 3.41Å
1102	V	36.5	Very low	54.5	Low	71 Å²	71	76.4 Å²	76.4	43%	0.43	43%	0.431	S	S	.	.			trans	-67.6	102.7	174.2	-163.8	0	0	0	0	104.7	V1097 E1100 T1104	V1097-V1102 HydrophobicContact CG1-CG2 4.06Å; E1100-V1102 WeakPolarHBondContact O-CG2 3.35Å; E1100-V1102 PolarHBondContact O-N 3.49Å; V1102-T1104 HydrophobicContact CB-CG2 4.04Å; V1102-T1104 HydrophobicContact CG1-CG2 3.31Å; V1102-T1104 PolarHBondContact O-N 2.97Å
1103	N	34.7	Very low	55.6	Low	129 Å²	129	70 Å²	70	69%	0.69	40%	0.403	S	S	*	.			trans	-63.8	60	157.5	-78.8	-20	0	0	0	107.9	P1101 V1105	P1101-N1103 VanDerWaalsContact C-N 3.32Å; P1101-N1103 PolarHBondContact O-N 3.41Å; N1103-V1105 PolarHBondContact O-N 3.47Å
1104	T	39.7	Very low	57	Low	64 Å²	64	68.2 Å²	68.2	39%	0.393	39%	0.39	S	S	.	.			trans	-62.4	110.3	166.8	40.4	0	0	0	0	105	V1102 T1106	V1102-T1104 HydrophobicContact CB-CG2 4.04Å; V1102-T1104 HydrophobicContact CG1-CG2 3.31Å; V1102-T1104 PolarHBondContact O-N 2.97Å; T1104-T1106 VanDerWaalsContact C-N 3.32Å; T1104-T1106 PolarHBondContact O-N 2.9Å
1105	V	49.2	Very low	58.4	Low	110 Å²	110	66.4 Å²	66.4	67%	0.667	38%	0.377	S	S	*	.			trans	-54.1	102.6	168.9	-179.5	0	0	0	0	106.1	N1103	N1103-V1105 PolarHBondContact O-N 3.47Å
1106	T	53.4	Low	59.8	Low	58 Å²	58	59.4 Å²	59.4	36%	0.356	35%	0.346	S	S	.	.			trans	-67.7	125.4	178.5	47	0	0	0	0	107.3	T1104 S1108	T1104-T1106 VanDerWaalsContact C-N 3.32Å; T1104-T1106 PolarHBondContact O-N 2.9Å; T1106-S1108 PolarHBondContact O-N 3.39Å
1107	P	60.8	Low	60.8	Low	15 Å²	15	56.9 Å²	56.9	10%	0.097	32%	0.32	C	S	.	.			trans	-58	126.6	-178.2	21.7	-30.2	0	0	0	110	R1086 R1087 S1090	R1086-P1107 HydrophobicContact CB-CG 4.44Å; R1086-P1107 HydrophobicContact CG-CB 4.02Å; R1086-P1107 HydrophobicContact CG-CG 3.97Å; R1087-P1107 HydrophobicContact CG-CG 4.14Å; R1087-P1107 VanDerWaalsContact CG-O 3.32Å; R1087-P1107 WeakPolarHBondContact CG-O 2.98Å; R1087-P1107 PolarHBondContact NE-O 2.91Å; S1090-P1107 VanDerWaalsContact OG-CD 3.25Å; S1090-P1107 WeakPolarHBondContact OG-CD 3.46Å
1108	S	67.7	Low	61.9	Low	33 Å²	33	60.2 Å²	60.2	23%	0.231	34%	0.335	C	S	.	.			trans	-88.5	-24.5	-175.5	32.9	0	0	0	0	112.9	S1057 T1083 T1106	S1057-S1108 WeakPolarHBondContact CB-O 3.43Å; S1057-S1108 WeakPolarHBondContact OG-CB 3.5Å; S1057-S1108 PolarHBondContact OG-O 3.19Å; T1083-S1108 WeakPolarHBondContact CG2-O 3.47Å; T1106-S1108 PolarHBondContact O-N 3.39Å
1109	S	78.8	Confident	63.4	Low	1 Å²	1	57.5 Å²	57.5	1%	0.007	32%	0.316	C	S	.	.	S	Bend	trans	-133	158.2	-170	44.9	0	0	0	0	113.2	R1086 D1136	R1086-S1109 VanDerWaalsContact CD-O 3.28Å; R1086-S1109 WeakPolarHBondContact CD-O 3.41Å; R1086-S1109 PolarHBondContact NH1-O 3.01Å; S1109-D1136 PolarHBondContact OG-OD1 3.41Å
1110	P	84.3	Confident	65.2	Low	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.284	C	S	.	.			trans	-70.7	163	168.8	32.8	-32.7	0	0	0	111	L992 W1079 T1082 T1083 L1112	L992-P1110 HydrophobicContact CB-CB 4.06Å; L992-P1110 HydrophobicContact CB-CG 4.22Å; L992-P1110 HydrophobicContact CD2-CG 3.92Å; W1079-P1110 HydrophobicContact CD2-CG 3.78Å; W1079-P1110 VanDerWaalsContact CE2-CD 3.41Å; W1079-P1110 HydrophobicContact CE3-CG 3.78Å; W1079-P1110 HydrophobicContact CG-CG 4.39Å; W1079-P1110 HydrophobicContact CH2-CG 4.16Å; W1079-P1110 VanDerWaalsContact CZ2-CD 3.46Å; W1079-P1110 HydrophobicContact CZ2-CG 4.17Å; W1079-P1110 HydrophobicContact CZ3-CG 3.98Å; T1082-P1110 HydrophobicContact CG2-CB 3.34Å; T1083-P1110 WeakPolarHBondContact OG1-CD 2.99Å; P1110-L1112 HydrophobicContact CG-CD2 3.83Å
1111	G	85.8	Confident	67.2	Low	1 Å²	1	47.5 Å²	47.5	1%	0.01	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	134.2	162.8	0	0	0	0	0	109.6	D990 C991 L992	D990-G1111 PolarHBondContact O-N 3.2Å; C991-G1111 WeakPolarHBondContact CA-O 3.4Å; L992-G1111 PolarHBondContact N-O 3.24Å
1112	L	89.6	Confident	69.3	Low	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.3	-174.6	-63.1	-176.1	0	0	0	110.9	L992 L994 W1079 P1110 L1130 I1135 R1137 V1138 C1139	L992-L1112 HydrophobicContact CB-CD2 3.89Å; L992-L1112 HydrophobicContact CD2-CD2 3.71Å; L992-L1112 HydrophobicContact CG-CD2 4.06Å; L992-L1112 WeakPolarHBondContact O-CA 3.46Å; L994-L1112 HydrophobicContact CD1-CD1 4.04Å; L994-L1112 HydrophobicContact CD1-CD2 4.3Å; L994-L1112 HydrophobicContact CG-CD2 4.34Å; W1079-L1112 HydrophobicContact CH2-CD1 4.25Å; W1079-L1112 HydrophobicContact CZ3-CD1 4.05Å; W1079-L1112 HydrophobicContact CZ3-CD2 3.94Å; P1110-L1112 HydrophobicContact CG-CD2 3.83Å; L1112-L1130 HydrophobicContact CD1-CD1 3.82Å; L1112-L1130 HydrophobicContact CD1-CD2 4.33Å; L1112-I1135 HydrophobicContact CD1-CG2 3.7Å; L1112-I1135 HydrophobicContact CG-CG2 4.23Å; L1112-R1137 PolarHBondContact N-O 3.43Å; L1112-V1138 HydrophobicContact CB-CG2 4.27Å; L1112-V1138 HydrophobicContact CD1-CG2 4.21Å; L1112-V1138 CarbonylContact O-C 3.53Å; L1112-V1138 WeakPolarHBondContact O-CA 3.11Å; L1112-C1139 PolarHBondContact O-N 3.1Å; L1112-C1139 PolarHBondContact O-SG 3.01Å; L1112-C1139 VanDerWaalsContact O-SG 3.33Å
1113	L	89.8	Confident	71.5	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	116	167.2	175.7	61.1	0	0	0	109.2	L977 A982 I986 L992 V993 L994 V1115 L1141 F1151	L977-L1113 HydrophobicContact CB-CD1 4.39Å; L977-L1113 HydrophobicContact CD2-CD1 3.72Å; A982-L1113 HydrophobicContact CB-CD2 4.09Å; I986-L1113 HydrophobicContact CD1-CD2 4.06Å; I986-L1113 HydrophobicContact CG1-CD2 3.73Å; L992-L1113 PolarHBondContact O-N 2.92Å; V993-L1113 CarbonylContact C-O 3.54Å; V993-L1113 WeakPolarHBondContact CA-O 3.45Å; V993-L1113 HydrophobicContact CG2-CD2 4.46Å; L994-L1113 PolarHBondContact N-O 3.49Å; L1113-V1115 HydrophobicContact CG-CG2 4.44Å; L1113-L1141 HydrophobicContact CD1-CB 4.22Å; L1113-F1151 HydrophobicContact CD2-CZ 4.46Å
1114	I	89	Confident	73.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	121	177.9	-60.9	166.1	0	0	0	108.7	L994 V996 C1123 L1126 A1127 L1130 V1138 C1139 I1140 L1141	L994-I1114 HydrophobicContact CB-CG1 4.21Å; L994-I1114 HydrophobicContact CD1-CG1 4.37Å; L994-I1114 WeakPolarHBondContact O-CA 3.39Å; V996-I1114 HydrophobicContact CG2-CG2 3.88Å; I1114-C1123 HydrophobicContact CG2-CB 4.26Å; I1114-L1126 HydrophobicContact CD1-CG 4.43Å; I1114-A1127 HydrophobicContact CD1-CB 3.59Å; I1114-L1130 HydrophobicContact CD1-CD1 4.07Å; I1114-V1138 HydrophobicContact CD1-CG1 3.93Å; I1114-C1139 PolarHBondContact N-O 3.2Å; I1114-I1140 HydrophobicContact CB-CG1 4.29Å; I1114-L1141 PolarHBondContact O-N 3.4Å
1115	V	85.3	Confident	75.8	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	121.6	175.6	177.5	0	0	0	0	108.7	V993 L994 V996 R997 L1007 L1113 L1141 F1151	V993-V1115 HydrophobicContact CG1-CG2 3.77Å; L994-V1115 PolarHBondContact O-N 3.27Å; V996-V1115 PolarHBondContact N-O 3.23Å; R997-V1115 HydrophobicContact CG-CG1 4.33Å; L1007-V1115 HydrophobicContact CD1-CG2 3.89Å; L1113-V1115 HydrophobicContact CG-CG2 4.44Å; V1115-L1141 HydrophobicContact CG1-CD2 4.3Å; V1115-L1141 HydrophobicContact CG2-CD2 4.33Å; V1115-F1151 HydrophobicContact CG2-CE1 4.27Å
1116	C	78.2	Confident	77.5	Confident	10 Å²	10	27.8 Å²	27.8	7%	0.068	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-87.5	143.2	-175.3	-65.5	0	0	0	0	112.9	R997 C1123 I1148	R997-C1116 WeakPolarHBondContact CG-O 3.25Å; C1116-C1123 WeakPolarHBondContact CA-SG 3.27Å; C1116-C1123 HydrophobicContact CB-CB 4.3Å; C1116-C1123 WeakPolarHBondContact CB-SG 3.34Å; C1116-C1123 WeakPolarHBondContact SG-CB 3.07Å; C1116-C1123 CovalentContact SG-SG 2.04Å; C1116-C1123 PolarHBondContact SG-SG 3.01Å; C1116-I1148 VanDerWaalsContact O-CD1 3.26Å; C1116-I1148 WeakPolarHBondContact O-CD1 3.33Å
1117	G	71.1	Confident	79.2	Confident	10 Å²	10	25 Å²	25	10%	0.103	13%	0.129	C	C	.	.			trans	-91.9	-152.6	160.4	0	0	0	0	0	111.5	D1119	G1117-D1119 PolarHBondContact O-N 2.98Å
1118	N	66.9	Low	80.6	Confident	142 Å²	142	25.2 Å²	25.2	76%	0.759	13%	0.129	S	C	*	.	S	Bend	trans	-67.2	-17.4	-176.1	-60.6	-26.9	0	0	0	114.7
1119	D	69.4	Low	81.5	Confident	64 Å²	64	24.8 Å²	24.8	34%	0.342	12%	0.122	S	C	.	.			trans	-102.8	79.2	-179.5	-160.8	-21.4	0	0	0	110.4	R1017 G1117 R1121 L1122	R1017-D1119 IonicContact NH2-OD2 2.72Å; G1117-D1119 PolarHBondContact O-N 2.98Å; D1119-R1121 VanDerWaalsContact C-N 3.25Å; D1119-R1121 PolarHBondContact O-N 3.39Å; D1119-L1122 HydrophobicContact CB-CD1 3.99Å; D1119-L1122 HydrophobicContact CB-CG 4.41Å; D1119-L1122 PolarHBondContact O-N 3.47Å; D1119-L1122 WeakPolarHBondContact OD2-CD1 3.45Å
1120	E	73.7	Confident	81.9	Confident	58 Å²	58	24.7 Å²	24.7	27%	0.271	12%	0.122	S	C	.	.	H	α-helix	trans	-58.1	-36.9	-178.5	-72.1	-176.4	177.2	0	0	112.3	L964 L1122 C1123 W1124	L964-E1120 HydrophobicContact CD1-CB 3.69Å; E1120-L1122 VanDerWaalsContact C-N 3.32Å; E1120-L1122 PolarHBondContact O-N 3.07Å; E1120-C1123 VanDerWaalsContact O-CB 3.31Å; E1120-C1123 WeakPolarHBondContact O-CB 3.16Å; E1120-C1123 PolarHBondContact O-N 3.33Å; E1120-C1123 VanDerWaalsContact O-N 3.09Å; E1120-W1124 VanDerWaalsContact O-CD1 3.25Å; E1120-W1124 PolarHBondContact O-N 3.35Å
1121	R	76	Confident	82.1	Confident	108 Å²	108	24.8 Å²	24.8	41%	0.408	12%	0.122	S	C	.	.	H	α-helix	trans	-57.4	-45.4	-177	-176.9	-173.4	175	165.4	-1.2	111.8	L964 I966 D1119 C1123 W1124 D1125	L964-R1121 HydrophobicContact CB-CB 4.46Å; L964-R1121 VanDerWaalsContact O-CD 3.28Å; L964-R1121 WeakPolarHBondContact O-CD 3.33Å; I966-R1121 HydrophobicContact CG1-CG 4.46Å; D1119-R1121 VanDerWaalsContact C-N 3.25Å; D1119-R1121 PolarHBondContact O-N 3.39Å; R1121-C1123 PolarHBondContact O-N 3.05Å; R1121-W1124 PolarHBondContact O-N 3.01Å; R1121-W1124 VanDerWaalsContact O-N 3.16Å; R1121-D1125 IonicContact NE-OD2 3.44Å; R1121-D1125 PolarHBondContact O-N 3.08Å; R1121-D1125 VanDerWaalsContact O-N 3.12Å
1122	L	75.8	Confident	82.1	Confident	34 Å²	34	28.4 Å²	28.4	18%	0.178	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-35.6	179.4	-73	174.1	0	0	0	112.3	D1119 E1120 L1126	D1119-L1122 HydrophobicContact CB-CD1 3.99Å; D1119-L1122 HydrophobicContact CB-CG 4.41Å; D1119-L1122 PolarHBondContact O-N 3.47Å; D1119-L1122 WeakPolarHBondContact OD2-CD1 3.45Å; E1120-L1122 VanDerWaalsContact C-N 3.32Å; E1120-L1122 PolarHBondContact O-N 3.07Å; L1122-L1126 VanDerWaalsContact O-CB 3.28Å; L1122-L1126 WeakPolarHBondContact O-CB 3.23Å; L1122-L1126 PolarHBondContact O-N 3.46Å
1123	C	81.7	Confident	81.8	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-44.7	175.6	-72.7	0	0	0	0	112.7	I1114 C1116 E1120 R1121 L1126 A1127 I1140	I1114-C1123 HydrophobicContact CG2-CB 4.26Å; C1116-C1123 WeakPolarHBondContact CA-SG 3.27Å; C1116-C1123 HydrophobicContact CB-CB 4.3Å; C1116-C1123 WeakPolarHBondContact CB-SG 3.34Å; C1116-C1123 WeakPolarHBondContact SG-CB 3.07Å; C1116-C1123 CovalentContact SG-SG 2.04Å; C1116-C1123 PolarHBondContact SG-SG 3.01Å; E1120-C1123 VanDerWaalsContact O-CB 3.31Å; E1120-C1123 WeakPolarHBondContact O-CB 3.16Å; E1120-C1123 PolarHBondContact O-N 3.33Å; E1120-C1123 VanDerWaalsContact O-N 3.09Å; R1121-C1123 PolarHBondContact O-N 3.05Å; C1123-L1126 PolarHBondContact O-N 2.9Å; C1123-A1127 VanDerWaalsContact O-CB 3.32Å; C1123-A1127 WeakPolarHBondContact O-CB 3.3Å; C1123-A1127 PolarHBondContact O-N 3.28Å; C1123-I1140 HydrophobicContact CB-CD1 4.1Å
1124	W	84.1	Confident	81.5	Confident	11 Å²	11	32.2 Å²	32.2	4%	0.042	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-45.2	-179.9	-78.6	91.2	0	0	0	111.3	I966 F971 V974 L976 E1120 R1121 A1127 F1128 I1140	I966-W1124 HydrophobicContact CD1-CB 4.15Å; I966-W1124 VanDerWaalsContact CD1-CD1 3.43Å; I966-W1124 HydrophobicContact CD1-CD2 3.96Å; I966-W1124 HydrophobicContact CD1-CG 3.61Å; I966-W1124 HydrophobicContact CG1-CB 4.26Å; I966-W1124 HydrophobicContact CG1-CG 4.25Å; I966-W1124 HydrophobicContact CG2-CB 4.05Å; I966-W1124 HydrophobicContact CG2-CD2 4.32Å; I966-W1124 HydrophobicContact CG2-CE3 4.28Å; I966-W1124 HydrophobicContact CG2-CG 4.26Å; F971-W1124 HydrophobicContact CD2-CH2 4.11Å; F971-W1124 HydrophobicContact CD2-CZ3 4.28Å; V974-W1124 HydrophobicContact CB-CE3 3.78Å; V974-W1124 HydrophobicContact CB-CZ3 3.77Å; V974-W1124 HydrophobicContact CG1-CE3 4Å; V974-W1124 HydrophobicContact CG1-CZ3 4.12Å; V974-W1124 HydrophobicContact CG2-CE3 4.18Å; L976-W1124 HydrophobicContact CD1-CH2 3.98Å; L976-W1124 HydrophobicContact CD1-CZ2 4.24Å; L976-W1124 HydrophobicContact CD2-CH2 3.72Å; L976-W1124 HydrophobicContact CD2-CZ2 3.73Å; L976-W1124 HydrophobicContact CD2-CZ3 4.48Å; L976-W1124 HydrophobicContact CG-CH2 4.15Å; L976-W1124 HydrophobicContact CG-CZ2 4.5Å; E1120-W1124 VanDerWaalsContact O-CD1 3.25Å; E1120-W1124 PolarHBondContact O-N 3.35Å; R1121-W1124 PolarHBondContact O-N 3.01Å; R1121-W1124 VanDerWaalsContact O-N 3.16Å; W1124-A1127 PolarHBondContact O-N 3.08Å; W1124-F1128 VanDerWaalsContact O-CB 3.29Å; W1124-F1128 WeakPolarHBondContact O-CB 3.37Å; W1124-F1128 PolarHBondContact O-N 3.18Å; W1124-I1140 HydrophobicContact CD2-CD1 4.21Å; W1124-I1140 HydrophobicContact CG-CD1 4.16Å
1125	D	81.9	Confident	81.4	Confident	38 Å²	38	32.8 Å²	32.8	20%	0.203	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-42.6	178.6	-69.4	-25.8	0	0	0	111.1	R1121 F1128 W1129	R1121-D1125 IonicContact NE-OD2 3.44Å; R1121-D1125 PolarHBondContact O-N 3.08Å; R1121-D1125 VanDerWaalsContact O-N 3.12Å; D1125-F1128 PolarHBondContact O-N 3.06Å; D1125-W1129 VanDerWaalsContact O-CB 3.26Å; D1125-W1129 WeakPolarHBondContact O-CB 3.28Å; D1125-W1129 PolarHBondContact O-N 3.19Å
1126	L	85.1	Confident	81.5	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-48.8	174.8	174.8	63.9	0	0	0	112.2	V996 V1015 M1020 F1069 I1114 L1122 C1123 F1128 W1129 L1130	V996-L1126 HydrophobicContact CG2-CD2 3.96Å; V1015-L1126 HydrophobicContact CG2-CD2 4.12Å; M1020-L1126 HydrophobicContact CE-CB 4.16Å; M1020-L1126 HydrophobicContact CE-CD1 3.53Å; M1020-L1126 HydrophobicContact CE-CG 4.46Å; F1069-L1126 HydrophobicContact CE1-CD1 3.73Å; F1069-L1126 HydrophobicContact CZ-CD1 4.22Å; I1114-L1126 HydrophobicContact CD1-CG 4.43Å; L1122-L1126 VanDerWaalsContact O-CB 3.28Å; L1122-L1126 WeakPolarHBondContact O-CB 3.23Å; L1122-L1126 PolarHBondContact O-N 3.46Å; C1123-L1126 PolarHBondContact O-N 2.9Å; L1126-F1128 VanDerWaalsContact C-N 3.33Å; L1126-F1128 PolarHBondContact O-N 3.09Å; L1126-W1129 HydrophobicContact CD1-CE3 4.36Å; L1126-W1129 PolarHBondContact O-N 2.87Å; L1126-L1130 HydrophobicContact CD1-CD1 4.11Å; L1126-L1130 HydrophobicContact CD1-CG 4.26Å; L1126-L1130 HydrophobicContact CG-CD1 4.08Å; L1126-L1130 WeakPolarHBondContact O-CG 3.32Å; L1126-L1130 PolarHBondContact O-N 3.14Å
1127	A	89.2	Confident	82	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.6	-45.6	179.8	0	0	0	0	0	111.2	V974 I1114 C1123 W1124 W1129 L1130 I1131 V1138 I1140	V974-A1127 HydrophobicContact CG1-CB 3.76Å; V974-A1127 HydrophobicContact CG2-CB 3.92Å; I1114-A1127 HydrophobicContact CD1-CB 3.59Å; C1123-A1127 VanDerWaalsContact O-CB 3.32Å; C1123-A1127 WeakPolarHBondContact O-CB 3.3Å; C1123-A1127 PolarHBondContact O-N 3.28Å; W1124-A1127 PolarHBondContact O-N 3.08Å; A1127-W1129 VanDerWaalsContact C-N 3.34Å; A1127-W1129 PolarHBondContact O-N 2.71Å; A1127-L1130 PolarHBondContact O-N 3.37Å; A1127-I1131 VanDerWaalsContact O-CG1 3.28Å; A1127-I1131 WeakPolarHBondContact O-CG1 3.27Å; A1127-I1131 PolarHBondContact O-N 3.32Å; A1127-V1138 HydrophobicContact CB-CG1 4.08Å; A1127-I1140 HydrophobicContact CB-CD1 3.71Å; A1127-I1140 HydrophobicContact CB-CG1 3.8Å
1128	F	89.4	Confident	83	Confident	19 Å²	19	34.7 Å²	34.7	8%	0.083	17%	0.168	C	C	.	.	H	α-helix	trans	-63.7	-40.4	177.7	178.9	-119.5	0	0	0	112.3	N969 A970 L973 V974 W1124 D1125 L1126 I1131 K1132	N969-F1128 HydrophobicContact CB-CE1 4.37Å; N969-F1128 HydrophobicContact CB-CE2 3.77Å; N969-F1128 HydrophobicContact CB-CZ 3.47Å; N969-F1128 VanDerWaalsContact CB-CZ 3.47Å; A970-F1128 HydrophobicContact CB-CB 3.65Å; A970-F1128 HydrophobicContact CB-CD1 4.08Å; A970-F1128 HydrophobicContact CB-CD2 4.14Å; A970-F1128 HydrophobicContact CB-CG 3.7Å; L973-F1128 HydrophobicContact CD1-CE2 4.01Å; V974-F1128 HydrophobicContact CG2-CB 3.96Å; W1124-F1128 VanDerWaalsContact O-CB 3.29Å; W1124-F1128 WeakPolarHBondContact O-CB 3.37Å; W1124-F1128 PolarHBondContact O-N 3.18Å; D1125-F1128 PolarHBondContact O-N 3.06Å; L1126-F1128 VanDerWaalsContact C-N 3.33Å; L1126-F1128 PolarHBondContact O-N 3.09Å; F1128-I1131 PolarHBondContact O-N 3.33Å; F1128-K1132 HydrophobicContact CD1-CD 4.46Å; F1128-K1132 HydrophobicContact CE1-CD 3.92Å; F1128-K1132 HydrophobicContact CE2-CG 4.47Å; F1128-K1132 HydrophobicContact CZ-CD 4.05Å; F1128-K1132 HydrophobicContact CZ-CG 4.32Å; F1128-K1132 PolarHBondContact O-N 2.98Å
1129	W	85.9	Confident	84.2	Confident	24 Å²	24	27.9 Å²	27.9	9%	0.091	13%	0.132	C	C	.	.	H	α-helix	trans	-63.7	-41.9	175.9	178.5	86.7	0	0	0	112.5	M1020 P1067 F1069 L1070 D1125 L1126 A1127 I1131 K1132 C1133	M1020-W1129 HydrophobicContact CE-CB 4.08Å; M1020-W1129 HydrophobicContact CE-CD2 3.99Å; M1020-W1129 HydrophobicContact CE-CE3 4.03Å; M1020-W1129 HydrophobicContact CE-CG 4.03Å; M1020-W1129 HydrophobicContact SD-CB 4.07Å; M1020-W1129 HydrophobicContact SD-CG 4.21Å; P1067-W1129 HydrophobicContact CB-CH2 4.39Å; P1067-W1129 HydrophobicContact CB-CZ2 3.84Å; P1067-W1129 HydrophobicContact CG-CZ2 3.79Å; F1069-W1129 AromaticContact CD1-CH2 3.72Å; F1069-W1129 HydrophobicContact CD1-CH2 3.72Å; F1069-W1129 AromaticContact CD1-CZ3 3.67Å; F1069-W1129 HydrophobicContact CD1-CZ3 3.67Å; F1069-W1129 HydrophobicContact CE1-CH2 4.48Å; F1069-W1129 AromaticContact CE1-CZ3 3.98Å; F1069-W1129 HydrophobicContact CE1-CZ3 3.98Å; L1070-W1129 HydrophobicContact CB-CH2 3.59Å; L1070-W1129 HydrophobicContact CB-CZ3 4.16Å; D1125-W1129 VanDerWaalsContact O-CB 3.26Å; D1125-W1129 WeakPolarHBondContact O-CB 3.28Å; D1125-W1129 PolarHBondContact O-N 3.19Å; L1126-W1129 HydrophobicContact CD1-CE3 4.36Å; L1126-W1129 PolarHBondContact O-N 2.87Å; A1127-W1129 VanDerWaalsContact C-N 3.34Å; A1127-W1129 PolarHBondContact O-N 2.71Å; W1129-I1131 PolarHBondContact O-N 2.84Å; W1129-K1132 WeakPolarHBondContact O-CB 3.44Å; W1129-K1132 PolarHBondContact O-N 3.36Å; W1129-C1133 PolarHBondContact O-N 2.84Å; W1129-C1133 PolarHBondContact O-SG 2.85Å
1130	L	87.8	Confident	85.1	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.2	-42.3	174.5	-71.2	166.2	0	0	0	111.6	L994 L1070 L1112 I1114 L1126 A1127 K1132 C1133 I1135 V1138	L994-L1130 HydrophobicContact CD1-CD1 3.99Å; L1070-L1130 HydrophobicContact CD1-CD2 4.4Å; L1112-L1130 HydrophobicContact CD1-CD1 3.82Å; L1112-L1130 HydrophobicContact CD1-CD2 4.33Å; I1114-L1130 HydrophobicContact CD1-CD1 4.07Å; L1126-L1130 HydrophobicContact CD1-CD1 4.11Å; L1126-L1130 HydrophobicContact CD1-CG 4.26Å; L1126-L1130 HydrophobicContact CG-CD1 4.08Å; L1126-L1130 WeakPolarHBondContact O-CG 3.32Å; L1126-L1130 PolarHBondContact O-N 3.14Å; A1127-L1130 PolarHBondContact O-N 3.37Å; L1130-K1132 VanDerWaalsContact C-N 3.33Å; L1130-K1132 PolarHBondContact O-N 2.8Å; L1130-C1133 CarbonylContact O-C 3.48Å; L1130-C1133 WeakPolarHBondContact O-CA 3.4Å; L1130-C1133 WeakPolarHBondContact O-CB 3.07Å; L1130-C1133 PolarHBondContact O-N 3.46Å; L1130-C1133 VanDerWaalsContact O-N 3.07Å; L1130-I1135 HydrophobicContact CB-CB 4.42Å; L1130-I1135 HydrophobicContact CD2-CG1 4.44Å; L1130-I1135 WeakPolarHBondContact O-CB 2.89Å; L1130-I1135 WeakPolarHBondContact O-CG1 3.1Å; L1130-I1135 PolarHBondContact O-N 3.28Å; L1130-I1135 VanDerWaalsContact O-N 3.15Å; L1130-V1138 HydrophobicContact CB-CG1 4.49Å; L1130-V1138 HydrophobicContact CB-CG2 4.17Å
1131	I	88.7	Confident	85.7	Confident	2 Å²	2	22.6 Å²	22.6	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-60.8	-42.3	174.5	-69.7	166.8	0	0	0	110.8	A781 P785 V789 V974 A1127 F1128 W1129 C1133 D1134 V1138	A781-I1131 HydrophobicContact CB-CG2 4.34Å; P785-I1131 HydrophobicContact CB-CG2 3.84Å; V789-I1131 HydrophobicContact CG2-CG2 3.71Å; V974-I1131 HydrophobicContact CG2-CD1 4.09Å; A1127-I1131 VanDerWaalsContact O-CG1 3.28Å; A1127-I1131 WeakPolarHBondContact O-CG1 3.27Å; A1127-I1131 PolarHBondContact O-N 3.32Å; F1128-I1131 PolarHBondContact O-N 3.33Å; W1129-I1131 PolarHBondContact O-N 2.84Å; I1131-C1133 PolarHBondContact O-N 3.41Å; I1131-D1134 PolarHBondContact O-N 3.36Å; I1131-V1138 HydrophobicContact CD1-CB 4.41Å; I1131-V1138 HydrophobicContact CG1-CB 3.96Å; I1131-V1138 HydrophobicContact CG1-CG1 4.39Å; I1131-V1138 HydrophobicContact CG1-CG2 4.22Å
1132	K	85.6	Confident	85.4	Confident	77 Å²	77	20.2 Å²	20.2	34%	0.335	10%	0.098	S	C	.	.	H	α-helix	trans	-61.8	-30.2	173.5	-82.3	-172.2	160.1	-176.4	0	113.4	V789 F1128 W1129 L1130 D1134	V789-K1132 HydrophobicContact CG1-CG 4.05Å; V789-K1132 HydrophobicContact CG2-CG 4.22Å; F1128-K1132 HydrophobicContact CD1-CD 4.46Å; F1128-K1132 HydrophobicContact CE1-CD 3.92Å; F1128-K1132 HydrophobicContact CE2-CG 4.47Å; F1128-K1132 HydrophobicContact CZ-CD 4.05Å; F1128-K1132 HydrophobicContact CZ-CG 4.32Å; F1128-K1132 PolarHBondContact O-N 2.98Å; W1129-K1132 WeakPolarHBondContact O-CB 3.44Å; W1129-K1132 PolarHBondContact O-N 3.36Å; L1130-K1132 VanDerWaalsContact C-N 3.33Å; L1130-K1132 PolarHBondContact O-N 2.8Å; K1132-D1134 PolarHBondContact O-N 2.93Å
1133	C	83.2	Confident	85	Confident	37 Å²	37	19.2 Å²	19.2	25%	0.25	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	10.8	173.8	-62.3	0	0	0	0	113.3	L1070 W1129 L1130 I1131 I1135	L1070-C1133 HydrophobicContact CD2-CB 3.9Å; W1129-C1133 PolarHBondContact O-N 2.84Å; W1129-C1133 PolarHBondContact O-SG 2.85Å; L1130-C1133 CarbonylContact O-C 3.48Å; L1130-C1133 WeakPolarHBondContact O-CA 3.4Å; L1130-C1133 WeakPolarHBondContact O-CB 3.07Å; L1130-C1133 PolarHBondContact O-N 3.46Å; L1130-C1133 VanDerWaalsContact O-N 3.07Å; I1131-C1133 PolarHBondContact O-N 3.41Å; C1133-I1135 VanDerWaalsContact C-N 3.27Å; C1133-I1135 HydrophobicContact CB-CG1 4.35Å; C1133-I1135 PolarHBondContact O-N 3.36Å
1134	D	83.5	Confident	83.8	Confident	42 Å²	42	23.3 Å²	23.3	23%	0.225	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	30.4	-178.7	-164.9	31.9	0	0	0	113.2	P785 R786 R1060 I1131 K1132	P785-D1134 WeakPolarHBondContact CG-OD1 3.15Å; R786-D1134 HydrophobicContact CB-CB 4.29Å; R786-D1134 WeakPolarHBondContact CB-OD1 3.25Å; R786-D1134 PolarHBondContact N-OD1 3.49Å; R1060-D1134 IonicContact CZ-OD2 3.74Å; R1060-D1134 IonicContact NH2-OD2 2.91Å; R1060-D1134 PolarHBondContact NH2-OD2 3.5Å; I1131-D1134 PolarHBondContact O-N 3.36Å; K1132-D1134 PolarHBondContact O-N 2.93Å
1135	I	86.4	Confident	82.3	Confident	13 Å²	13	29.4 Å²	29.4	7%	0.067	16%	0.156	C	C	.	.			trans	-85.7	117.7	168.8	-53.2	-61.2	0	0	0	108.2	W1079 L1112 L1130 C1133 V1138	W1079-I1135 HydrophobicContact CH2-CD1 4.04Å; W1079-I1135 HydrophobicContact CH2-CG2 4.45Å; W1079-I1135 HydrophobicContact CZ2-CD1 4.09Å; L1112-I1135 HydrophobicContact CD1-CG2 3.7Å; L1112-I1135 HydrophobicContact CG-CG2 4.23Å; L1130-I1135 HydrophobicContact CB-CB 4.42Å; L1130-I1135 HydrophobicContact CD2-CG1 4.44Å; L1130-I1135 WeakPolarHBondContact O-CB 2.89Å; L1130-I1135 WeakPolarHBondContact O-CG1 3.1Å; L1130-I1135 PolarHBondContact O-N 3.28Å; L1130-I1135 VanDerWaalsContact O-N 3.15Å; C1133-I1135 VanDerWaalsContact C-N 3.27Å; C1133-I1135 HydrophobicContact CB-CG1 4.35Å; C1133-I1135 PolarHBondContact O-N 3.36Å; I1135-V1138 HydrophobicContact CB-CG2 4.06Å; I1135-V1138 HydrophobicContact CG2-CG2 3.72Å; I1135-V1138 WeakPolarHBondContact O-CG2 3.34Å
1136	D	87.3	Confident	81	Confident	25 Å²	25	34 Å²	34	13%	0.134	18%	0.18	C	C	.	.			trans	-90.4	166	179.4	72.4	-25.4	0	0	0	112.1	P785 R1086 S1109 V1138	P785-D1136 HydrophobicContact CG-CB 3.78Å; R1086-D1136 IonicContact CZ-OD1 2.99Å; R1086-D1136 IonicContact CZ-OD2 3.25Å; R1086-D1136 IonicContact NH1-OD1 3.36Å; R1086-D1136 PolarHBondContact NH1-OD1 2.85Å; R1086-D1136 IonicContact NH1-OD2 3.14Å; R1086-D1136 PolarHBondContact NH1-OD2 2.87Å; R1086-D1136 IonicContact NH2-OD1 3.88Å; R1086-D1136 PolarHBondContact NH2-OD1 3.49Å; R1086-D1136 IonicContact NH2-OD2 3.99Å; R1086-D1136 PolarHBondContact NH2-OD2 3.22Å; S1109-D1136 PolarHBondContact OG-OD1 3.41Å; D1136-V1138 PolarHBondContact O-N 3.35Å
1137	R	90	Very high	80	Confident	33 Å²	33	35 Å²	35	13%	0.125	19%	0.187	C	C	.	.	S	Bend	trans	54.4	34.7	-176.5	-57.1	-170.1	179.3	170.6	1.5	114.7	F782 D990 R1086 L1112	F782-R1137 HydrophobicContact CD1-CG 4.32Å; F782-R1137 HydrophobicContact CD2-CB 4.33Å; F782-R1137 HydrophobicContact CE1-CB 4.35Å; F782-R1137 HydrophobicContact CE1-CG 3.79Å; F782-R1137 VanDerWaalsContact CE2-CA 3.46Å; F782-R1137 HydrophobicContact CE2-CB 3.76Å; F782-R1137 HydrophobicContact CE2-CG 4.13Å; F782-R1137 HydrophobicContact CZ-CB 3.78Å; F782-R1137 HydrophobicContact CZ-CG 3.68Å; F782-R1137 WeakPolarHBondContact O-CA 3.43Å; F782-R1137 PolarHBondContact O-N 2.92Å; D990-R1137 IonicContact OD2-NH1 3.86Å; D990-R1137 PolarHBondContact OD2-NH1 2.9Å; R1086-R1137 VanDerWaalsContact NH2-NE 3.14Å; L1112-R1137 PolarHBondContact N-O 3.43Å
1138	V	91.9	Very high	79	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	131.2	170.4	-176.2	0	0	0	0	109	P975 L1112 I1114 A1127 L1130 I1131 I1135 D1136	P975-V1138 VanDerWaalsContact CD-O 3.23Å; P975-V1138 WeakPolarHBondContact CD-O 3.45Å; P975-V1138 VanDerWaalsContact CG-O 3.3Å; P975-V1138 WeakPolarHBondContact CG-O 3.21Å; L1112-V1138 HydrophobicContact CB-CG2 4.27Å; L1112-V1138 HydrophobicContact CD1-CG2 4.21Å; L1112-V1138 CarbonylContact O-C 3.53Å; L1112-V1138 WeakPolarHBondContact O-CA 3.11Å; I1114-V1138 HydrophobicContact CD1-CG1 3.93Å; A1127-V1138 HydrophobicContact CB-CG1 4.08Å; L1130-V1138 HydrophobicContact CB-CG1 4.49Å; L1130-V1138 HydrophobicContact CB-CG2 4.17Å; I1131-V1138 HydrophobicContact CD1-CB 4.41Å; I1131-V1138 HydrophobicContact CG1-CB 3.96Å; I1131-V1138 HydrophobicContact CG1-CG1 4.39Å; I1131-V1138 HydrophobicContact CG1-CG2 4.22Å; I1135-V1138 HydrophobicContact CB-CG2 4.06Å; I1135-V1138 HydrophobicContact CG2-CG2 3.72Å; I1135-V1138 WeakPolarHBondContact O-CG2 3.34Å; D1136-V1138 PolarHBondContact O-N 3.35Å
1139	C	91.2	Very high	78.1	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	151.1	175.2	58.3	0	0	0	0	111.4	P975 L977 L1112 I1114	P975-C1139 HydrophobicContact CB-CB 4.36Å; P975-C1139 WeakPolarHBondContact O-CA 3.49Å; L977-C1139 HydrophobicContact CB-CB 4.27Å; L1112-C1139 PolarHBondContact O-N 3.1Å; L1112-C1139 PolarHBondContact O-SG 3.01Å; L1112-C1139 VanDerWaalsContact O-SG 3.33Å; I1114-C1139 PolarHBondContact N-O 3.2Å
1140	I	89.3	Confident	77.3	Confident	4 Å²	4	42 Å²	42	2%	0.021	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	136.9	173.8	-61.6	-178.8	0	0	0	108.8	V974 P975 L976 L977 I1114 C1123 W1124 A1127 F1142	V974-I1140 HydrophobicContact CG1-CD1 3.48Å; V974-I1140 VanDerWaalsContact CG1-CD1 3.48Å; V974-I1140 HydrophobicContact CG1-CG1 3.74Å; P975-I1140 PolarHBondContact O-N 3.33Å; L976-I1140 HydrophobicContact CD2-CB 4.24Å; L977-I1140 PolarHBondContact N-O 3.37Å; I1114-I1140 HydrophobicContact CB-CG1 4.29Å; C1123-I1140 HydrophobicContact CB-CD1 4.1Å; W1124-I1140 HydrophobicContact CD2-CD1 4.21Å; W1124-I1140 HydrophobicContact CG-CD1 4.16Å; A1127-I1140 HydrophobicContact CB-CD1 3.71Å; A1127-I1140 HydrophobicContact CB-CG1 3.8Å; I1140-F1142 PolarHBondContact O-N 3.03Å; I1140-F1142 VanDerWaalsContact O-N 3.15Å
1141	L	85.2	Confident	76.7	Confident	6 Å²	6	42 Å²	42	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	109	166.3	177.9	67.2	0	0	0	109.5	V979 A982 L1113 I1114 V1115 F1151	V979-L1141 HydrophobicContact CG2-CD1 4.23Å; A982-L1141 HydrophobicContact CB-CD1 3.55Å; L1113-L1141 HydrophobicContact CD1-CB 4.22Å; I1114-L1141 PolarHBondContact O-N 3.4Å; V1115-L1141 HydrophobicContact CG1-CD2 4.3Å; V1115-L1141 HydrophobicContact CG2-CD2 4.33Å; L1141-F1151 HydrophobicContact CD2-CB 4.41Å; L1141-F1151 HydrophobicContact CD2-CD1 3.41Å; L1141-F1151 VanDerWaalsContact CD2-CD1 3.41Å; L1141-F1151 HydrophobicContact CD2-CE1 3.66Å; L1141-F1151 HydrophobicContact CD2-CG 3.88Å; L1141-F1151 HydrophobicContact CD2-CZ 4.32Å
1142	F	71.4	Confident	76.1	Confident	58 Å²	58	42.8 Å²	42.8	25%	0.254	24%	0.236	S	C	.	.			trans	-81.7	121.1	175.5	-173.6	-102.8	0	0	0	109.9	D953 L976 L977 I1140	D953-F1142 HydrophobicContact CB-CE1 4.16Å; D953-F1142 HydrophobicContact CB-CZ 4.42Å; L976-F1142 HydrophobicContact CB-CB 4.07Å; L976-F1142 HydrophobicContact CD1-CD2 3.81Å; L976-F1142 HydrophobicContact CD1-CE2 4.2Å; L976-F1142 HydrophobicContact CD1-CG 4.39Å; L976-F1142 HydrophobicContact CD2-CB 4.45Å; L976-F1142 HydrophobicContact CD2-CD2 4.21Å; L976-F1142 HydrophobicContact CG-CD2 4.43Å; L977-F1142 PolarHBondContact O-N 3.49Å; I1140-F1142 PolarHBondContact O-N 3.03Å; I1140-F1142 VanDerWaalsContact O-N 3.15Å
1143	S	66.1	Low	75.5	Confident	14 Å²	14	42.7 Å²	42.7	10%	0.098	24%	0.239	C	C	.	.			trans	-145.3	128.7	-175.2	170.6	0	0	0	0	110.4	S1147 I1148	S1143-S1147 WeakPolarHBondContact CA-OG 3.34Å; S1143-S1147 WeakPolarHBondContact CB-OG 3.41Å; S1143-S1147 WeakPolarHBondContact OG-CB 3.09Å; S1143-S1147 PolarHBondContact OG-OG 2.88Å; S1143-I1148 WeakPolarHBondContact OG-CG1 3.48Å; S1143-I1148 PolarHBondContact OG-N 2.89Å
1144	S	56.7	Low	74.9	Confident	85 Å²	85	43.3 Å²	43.3	59%	0.594	24%	0.244	S	C	*	.			trans	-69.8	148.1	155.8	55.8	0	0	0	0	109.1	D1146 S1147	S1144-D1146 PolarHBondContact O-N 3.44Å; S1144-S1147 PolarHBondContact O-N 3.28Å
1145	N	52.7	Low	74.4	Confident	139 Å²	139	43 Å²	43	74%	0.743	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-43.6	-30.9	-165.6	-80.1	-24.4	0	0	0	117
1146	D	55	Low	73.5	Confident	134 Å²	134	46.1 Å²	46.1	72%	0.717	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-12.7	-179.4	-69.8	-33.6	0	0	0	114.4	S1144 S1149	S1144-D1146 PolarHBondContact O-N 3.44Å; D1146-S1149 PolarHBondContact O-OG 3.18Å
1147	S	62.9	Low	72.3	Confident	21 Å²	21	54.6 Å²	54.6	15%	0.147	31%	0.306	C	S	.	.	H	α-helix	trans	-92.1	-21.5	-166	104.3	0	0	0	0	115.9	V979 S1143 S1144 S1149 N1150 F1151	V979-S1147 WeakPolarHBondContact CG2-OG 3.33Å; S1143-S1147 WeakPolarHBondContact CA-OG 3.34Å; S1143-S1147 WeakPolarHBondContact CB-OG 3.41Å; S1143-S1147 WeakPolarHBondContact OG-CB 3.09Å; S1143-S1147 PolarHBondContact OG-OG 2.88Å; S1144-S1147 PolarHBondContact O-N 3.28Å; S1147-S1149 VanDerWaalsContact C-N 3.29Å; S1147-S1149 PolarHBondContact O-N 3.37Å; S1147-N1150 CarbonylContact O-C 3.58Å; S1147-N1150 WeakPolarHBondContact O-CB 3.36Å; S1147-N1150 PolarHBondContact O-N 3.05Å; S1147-N1150 VanDerWaalsContact O-N 3.15Å; S1147-F1151 WeakPolarHBondContact O-CB 3.27Å; S1147-F1151 PolarHBondContact O-N 2.98Å
1148	I	69.7	Low	71.4	Confident	35 Å²	35	55.7 Å²	55.7	18%	0.179	32%	0.316	C	S	.	.	H	α-helix	trans	-62.5	-39.5	175.4	-71	154.3	0	0	0	110.7	C1116 S1143 N1150 F1151 I1152	C1116-I1148 VanDerWaalsContact O-CD1 3.26Å; C1116-I1148 WeakPolarHBondContact O-CD1 3.33Å; S1143-I1148 WeakPolarHBondContact OG-CG1 3.48Å; S1143-I1148 PolarHBondContact OG-N 2.89Å; I1148-N1150 VanDerWaalsContact C-N 3.33Å; I1148-N1150 PolarHBondContact O-N 3.18Å; I1148-F1151 WeakPolarHBondContact O-CB 3.45Å; I1148-F1151 PolarHBondContact O-N 3.47Å; I1148-I1152 HydrophobicContact CG2-CD1 3.7Å; I1148-I1152 HydrophobicContact CG2-CG1 4.37Å; I1148-I1152 WeakPolarHBondContact O-CD1 3.32Å; I1148-I1152 VanDerWaalsContact O-CG1 3.29Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.44Å; I1148-I1152 PolarHBondContact O-N 3.42Å
1149	S	70.1	Confident	70.3	Confident	64 Å²	64	58.5 Å²	58.5	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-43.2	175.5	70.8	0	0	0	0	111	D1146 S1147 F1151 I1152 N1153	D1146-S1149 PolarHBondContact O-OG 3.18Å; S1147-S1149 VanDerWaalsContact C-N 3.29Å; S1147-S1149 PolarHBondContact O-N 3.37Å; S1149-F1151 PolarHBondContact O-N 3.28Å; S1149-I1152 PolarHBondContact O-N 2.92Å; S1149-N1153 VanDerWaalsContact O-CB 3.29Å; S1149-N1153 WeakPolarHBondContact O-CB 3.45Å; S1149-N1153 PolarHBondContact O-N 3.18Å; S1149-N1153 PolarHBondContact O-ND2 2.79Å
1150	N	69.8	Low	69.1	Low	91 Å²	91	61.8 Å²	61.8	49%	0.487	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-37.7	174.3	-68.9	-25.6	0	0	0	112.6	S1147 I1148 N1153 S1154	S1147-N1150 CarbonylContact O-C 3.58Å; S1147-N1150 WeakPolarHBondContact O-CB 3.36Å; S1147-N1150 PolarHBondContact O-N 3.05Å; S1147-N1150 VanDerWaalsContact O-N 3.15Å; I1148-N1150 VanDerWaalsContact C-N 3.33Å; I1148-N1150 PolarHBondContact O-N 3.18Å; N1150-N1153 PolarHBondContact O-N 2.99Å; N1150-S1154 VanDerWaalsContact O-CB 3.29Å; N1150-S1154 WeakPolarHBondContact O-CB 3.49Å; N1150-S1154 PolarHBondContact O-N 2.97Å; N1150-S1154 PolarHBondContact O-OG 2.92Å
1151	F	74.3	Confident	68	Low	0 Å²	0	65.2 Å²	65.2	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-50.8	175.3	175.2	-117.8	0	0	0	111.2	V979 A982 V983 I986 L1007 L1113 V1115 L1141 S1147 I1148 S1149 N1153 S1154 C1155	V979-F1151 HydrophobicContact CG1-CB 3.94Å; V979-F1151 HydrophobicContact CG1-CD2 3.86Å; V979-F1151 HydrophobicContact CG1-CG 4.36Å; A982-F1151 HydrophobicContact CB-CD2 4.26Å; A982-F1151 HydrophobicContact CB-CE2 3.39Å; A982-F1151 HydrophobicContact CB-CZ 3.66Å; V983-F1151 HydrophobicContact CG2-CD2 3.77Å; V983-F1151 HydrophobicContact CG2-CE2 3.74Å; I986-F1151 HydrophobicContact CD1-CE1 3.93Å; I986-F1151 HydrophobicContact CD1-CE2 4.42Å; I986-F1151 HydrophobicContact CD1-CZ 3.41Å; I986-F1151 VanDerWaalsContact CD1-CZ 3.41Å; I986-F1151 HydrophobicContact CG1-CZ 4.31Å; L1007-F1151 HydrophobicContact CD1-CE1 3.83Å; L1007-F1151 HydrophobicContact CD2-CE1 4.36Å; L1113-F1151 HydrophobicContact CD2-CZ 4.46Å; V1115-F1151 HydrophobicContact CG2-CE1 4.27Å; L1141-F1151 HydrophobicContact CD2-CB 4.41Å; L1141-F1151 HydrophobicContact CD2-CD1 3.41Å; L1141-F1151 VanDerWaalsContact CD2-CD1 3.41Å; L1141-F1151 HydrophobicContact CD2-CE1 3.66Å; L1141-F1151 HydrophobicContact CD2-CG 3.88Å; L1141-F1151 HydrophobicContact CD2-CZ 4.32Å; S1147-F1151 WeakPolarHBondContact O-CB 3.27Å; S1147-F1151 PolarHBondContact O-N 2.98Å; I1148-F1151 WeakPolarHBondContact O-CB 3.45Å; I1148-F1151 PolarHBondContact O-N 3.47Å; S1149-F1151 PolarHBondContact O-N 3.28Å; F1151-N1153 VanDerWaalsContact C-N 3.3Å; F1151-N1153 PolarHBondContact O-N 3.39Å; F1151-S1154 CarbonylContact O-C 3.06Å; F1151-S1154 PolarHBondContact O-N 3.15Å; F1151-S1154 VanDerWaalsContact O-N 3.1Å; F1151-C1155 PolarHBondContact O-N 2.98Å; F1151-C1155 PolarHBondContact O-SG 2.97Å; F1151-C1155 VanDerWaalsContact O-SG 3.37Å
1152	I	75.5	Confident	66.9	Low	19 Å²	19	68.9 Å²	68.9	10%	0.097	39%	0.391	C	S	.	.	H	α-helix	trans	-61.3	-42.3	177.5	-65.3	161.2	0	0	0	110.4	F1005 I1148 S1149 S1154 C1155 S1156	F1005-I1152 HydrophobicContact CB-CG2 3.77Å; F1005-I1152 HydrophobicContact CD1-CG2 4.41Å; F1005-I1152 HydrophobicContact CG-CG2 4.04Å; I1148-I1152 HydrophobicContact CG2-CD1 3.7Å; I1148-I1152 HydrophobicContact CG2-CG1 4.37Å; I1148-I1152 WeakPolarHBondContact O-CD1 3.32Å; I1148-I1152 VanDerWaalsContact O-CG1 3.29Å; I1148-I1152 WeakPolarHBondContact O-CG1 3.44Å; I1148-I1152 PolarHBondContact O-N 3.42Å; S1149-I1152 PolarHBondContact O-N 2.92Å; I1152-S1154 VanDerWaalsContact C-N 3.31Å; I1152-S1154 PolarHBondContact O-N 2.84Å; I1152-C1155 PolarHBondContact O-N 2.94Å; I1152-S1156 WeakPolarHBondContact O-CB 3.29Å; I1152-S1156 PolarHBondContact O-N 2.75Å; I1152-S1156 PolarHBondContact O-OG 2.8Å
1153	N	72.9	Confident	66.6	Low	75 Å²	75	69.6 Å²	69.6	40%	0.401	40%	0.4	S	S	.	.	H	α-helix	trans	-63.4	-36.3	175.4	-71.5	-21.7	0	0	0	112.2	S1149 N1150 F1151 C1155 S1156 Q1157	S1149-N1153 VanDerWaalsContact O-CB 3.29Å; S1149-N1153 WeakPolarHBondContact O-CB 3.45Å; S1149-N1153 PolarHBondContact O-N 3.18Å; S1149-N1153 PolarHBondContact O-ND2 2.79Å; N1150-N1153 PolarHBondContact O-N 2.99Å; F1151-N1153 VanDerWaalsContact C-N 3.3Å; F1151-N1153 PolarHBondContact O-N 3.39Å; N1153-C1155 VanDerWaalsContact C-N 3.34Å; N1153-S1156 WeakPolarHBondContact CA-OG 3.23Å; N1153-S1156 PolarHBondContact O-N 3.24Å; N1153-S1156 PolarHBondContact O-OG 3.08Å; N1153-Q1157 WeakPolarHBondContact O-CB 3.46Å; N1153-Q1157 VanDerWaalsContact O-CG 3.31Å; N1153-Q1157 WeakPolarHBondContact O-CG 3.5Å; N1153-Q1157 PolarHBondContact O-N 2.74Å; N1153-Q1157 VanDerWaalsContact O-N 3.1Å
1154	S	71.8	Confident	66.6	Low	50 Å²	50	73.6 Å²	73.6	35%	0.35	42%	0.421	S	S	.	.	H	α-helix	trans	-75.3	-22.7	176.7	-57.9	0	0	0	0	113.1	N1150 F1151 I1152	N1150-S1154 VanDerWaalsContact O-CB 3.29Å; N1150-S1154 WeakPolarHBondContact O-CB 3.49Å; N1150-S1154 PolarHBondContact O-N 2.97Å; N1150-S1154 PolarHBondContact O-OG 2.92Å; F1151-S1154 CarbonylContact O-C 3.06Å; F1151-S1154 PolarHBondContact O-N 3.15Å; F1151-S1154 VanDerWaalsContact O-N 3.1Å; I1152-S1154 VanDerWaalsContact C-N 3.31Å; I1152-S1154 PolarHBondContact O-N 2.84Å
1155	C	71.9	Confident	67.4	Low	37 Å²	37	72.7 Å²	72.7	25%	0.25	41%	0.408	C	S	.	.	H	α-helix	trans	-85.3	-25.1	172.5	-68.6	0	0	0	0	112.9	L1007 F1151 I1152 N1153	L1007-C1155 HydrophobicContact CD2-CB 3.83Å; F1151-C1155 PolarHBondContact O-N 2.98Å; F1151-C1155 PolarHBondContact O-SG 2.97Å; F1151-C1155 VanDerWaalsContact O-SG 3.37Å; I1152-C1155 PolarHBondContact O-N 2.94Å; N1153-C1155 VanDerWaalsContact C-N 3.34Å
1156	S	68.2	Low	68.6	Low	77 Å²	77	67.2 Å²	67.2	54%	0.538	38%	0.38	S	S	.	.	H	α-helix	trans	-82.5	-29	176.4	65.4	0	0	0	0	112.9	I1152 N1153	I1152-S1156 WeakPolarHBondContact O-CB 3.29Å; I1152-S1156 PolarHBondContact O-N 2.75Å; I1152-S1156 PolarHBondContact O-OG 2.8Å; N1153-S1156 WeakPolarHBondContact CA-OG 3.23Å; N1153-S1156 PolarHBondContact O-N 3.24Å; N1153-S1156 PolarHBondContact O-OG 3.08Å
1157	Q	61.2	Low	69.8	Low	203 Å²	203	61.1 Å²	61.1	95%	0.949	35%	0.35	S	S	*	.			trans	-71.7	0	163.2	-70.8	178.2	5.8	0	0	111	N1153	N1153-Q1157 WeakPolarHBondContact O-CB 3.46Å; N1153-Q1157 VanDerWaalsContact O-CG 3.31Å; N1153-Q1157 WeakPolarHBondContact O-CG 3.5Å; N1153-Q1157 PolarHBondContact O-N 2.74Å; N1153-Q1157 VanDerWaalsContact O-N 3.1Å

Retrieved 1,157 of 1,157 residues in 968.9 ms (Link to these results)

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