A0A3Q0KQX0_SCHMA Loading...

glycogenin glucosyltransferase

Self-glucosylating initiator of glycogen synthesis. It catalyzes the formation of a short alpha (1,4)-glucosyl chain covalently attached via a glucose 1-O-tyrosyl linkage to internal tyrosine residues and these chains act as primers for the elongation reaction catalyzed by glycogen synthase.

AlphaFold DB , UniProt , Accession A0A3Q0KQX0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 934 aa.

						>A0A3Q0KQX0_SCHMA|A0A3Q0KQX0
MGRESFVTLATNDEYGVGALVLAASLKQSETSKELTILVTPGLSSHMRELLCNTYDNVIEVQPVITKSWSNPVISGRTELIETFTKIQVWSLIQFTKVVFMDADTLVLQNVDELFNRFEFTAAPDPLWPDCFNAGVFVLEPTMNTYNGLLRMLFDSGSFDGREQGLLNTYFSNWLEGDISHRLPCIYNCICRISDDTNFEFYTSRSAWVYFGGSIRVVHFAGPIKPWHKTSAAKTCSQAAFRTFFNTEKNRRSICRVAGMLAYWWSLFLILVRPKLYPDMYLSHISLDSLRKYDPIQDSFNRCDQSHLYTNENLSYNHNNSFTQMYPSPHEEYIDNANRRNHSLITPEDNLQLPYHPEFHDTNWDYLHRGQRIDESNRFVEHHQTCVETPLPPQFDLSLSGVNYCREEHTMKKNSSHENQYHANDHEYQQHEISHKLDEKHSSHHENPPFNHYTDREEFHEHHFEKNNLDIVQHHGTTEQNNQQYESDIVKDDFQHKTEPQSQEPKSADIQAIPKQPSPTSVANASLINSVQSESVEKSKSASQYSLNCHKCYEKLIREHQRLLCPIRMRKLSSGYNSKTRQVFKKHRRYSFETSFKPTMKTFHPIKSDCKKLTKTTSLTDMLKKKLIKNDSKNFSVSCNTLPNNFDLGAEQLQRFPIVNFGFETNYKHRITNNRSSNIQLNQTLELNNQLSNQYRGLDIAYLNGKQFDHIITTTTTTNVTTHSKRKPHHQNFKSCLYNEDNLKRKRNNILSSHLKQSYSAENIIQLDNDTMITSSHSTDYLNQAKAKRSSSICNGLQTNDATIPNPMKFDQKTWQSKVKRKTKHGCPRKLYENQLINHESLNKGYHKSNSFNRMIATGIAGDLANIDYGAKNLCLYHTQLEIESNERMYAWERGEIDYTGIDRFINILNKLCITLRNIGGDTNLPIGTDIMNE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	63	Low	93.1	Very high	245 Å²	245	45.1 Å²	45.1	100%	1.207	24%	0.236	S	C	*	.				0	146.9	0	-75.8	176.2	172	0	0	107.7
2	G	87.4	Confident	92.9	Very high	43 Å²	43	45.8 Å²	45.8	44%	0.443	24%	0.241	S	C	.	.			trans	-65.8	155.6	176.6	0	0	0	0	0	112.2	T96	G2-T96 WeakPolarHBondContact CA-OG1 3.42Å
3	R	96.5	Very high	92.6	Very high	98 Å²	98	46.2 Å²	46.2	37%	0.37	24%	0.243	S	C	.	.			trans	-80.1	138.4	174.8	-68.4	175.8	66.7	-162.2	2.9	109.7	E34 N57 F95 T96	R3-E34 IonicContact CZ-OE1 3.78Å; R3-E34 IonicContact CZ-OE2 3.23Å; R3-E34 IonicContact NE-OE1 3.7Å; R3-E34 PolarHBondContact NE-OE1 3.12Å; R3-E34 IonicContact NE-OE2 2.78Å; R3-E34 PolarHBondContact NE-OE2 3.35Å; R3-E34 IonicContact NH2-OE1 3.7Å; R3-E34 PolarHBondContact NH2-OE1 3.07Å; R3-E34 IonicContact NH2-OE2 3.53Å; R3-E34 PolarHBondContact NH2-OE2 2.66Å; R3-N57 PolarHBondContact NH2-OD1 3.25Å; R3-F95 HydrophobicContact CB-CD1 3.73Å; R3-F95 HydrophobicContact CB-CE1 4.25Å; R3-F95 CarbonylContact O-C 2.98Å; R3-F95 VanDerWaalsContact O-CA 3.27Å; R3-F95 WeakPolarHBondContact O-CA 3.16Å; R3-T96 PolarHBondContact O-N 3.23Å; R3-T96 PolarHBondContact O-OG1 3.44Å; R3-T96 VanDerWaalsContact O-OG1 3.14Å
4	E	98.2	Very high	92.3	Very high	49 Å²	49	47.7 Å²	47.7	23%	0.229	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.9	-178.4	-66.7	-179.2	147.5	0	0	109.3	K33 E34 K97 F115	E4-K33 HydrophobicContact CB-CD 4.23Å; E4-K33 IonicContact OE2-NZ 3.61Å; E4-K33 PolarHBondContact OE2-NZ 3.15Å; E4-E34 PolarHBondContact O-N 2.93Å; E4-K97 WeakPolarHBondContact CA-O 3.44Å; E4-K97 HydrophobicContact CG-CB 4.26Å; E4-F115 HydrophobicContact CB-CD1 3.67Å; E4-F115 HydrophobicContact CB-CE1 3.8Å; E4-F115 HydrophobicContact CB-CG 4.4Å; E4-F115 HydrophobicContact CG-CD1 4.07Å
5	S	98.6	Very high	92.4	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	142.1	-174.7	-170.8	0	0	0	0	113.8	E34 T36 K97 V98 V99	S5-E34 CarbonylContact C-O 3.31Å; S5-E34 WeakPolarHBondContact CA-O 3.07Å; S5-E34 WeakPolarHBondContact CB-O 3.42Å; S5-E34 VanDerWaalsContact OG-C 3.29Å; S5-E34 PolarHBondContact OG-O 3.37Å; S5-T36 WeakPolarHBondContact OG-CB 3.43Å; S5-T36 PolarHBondContact OG-N 3.39Å; S5-T36 PolarHBondContact OG-OG1 3.2Å; S5-K97 PolarHBondContact N-O 3.5Å; S5-V98 WeakPolarHBondContact O-CA 3.19Å; S5-V99 PolarHBondContact O-N 3.38Å; S5-V99 VanDerWaalsContact O-N 3.12Å
6	F	98.8	Very high	92.5	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.6	159.6	-71.8	-76.8	0	0	0	108.6	L26 T31 K33 E34 L35 T36 V99 M101 V111 F115	F6-L26 HydrophobicContact CB-CD1 4.01Å; F6-L26 HydrophobicContact CD1-CD2 4.13Å; F6-L26 HydrophobicContact CD2-CD1 4.47Å; F6-L26 HydrophobicContact CD2-CD2 3.86Å; F6-L26 HydrophobicContact CE1-CD2 4.14Å; F6-L26 HydrophobicContact CE2-CD2 3.87Å; F6-L26 HydrophobicContact CG-CD1 4.14Å; F6-L26 HydrophobicContact CG-CD2 3.99Å; F6-L26 HydrophobicContact CZ-CD2 4.01Å; F6-T31 WeakPolarHBondContact CE2-OG1 3.29Å; F6-K33 HydrophobicContact CD2-CB 3.88Å; F6-K33 HydrophobicContact CE2-CB 3.88Å; F6-K33 HydrophobicContact CE2-CG 4.05Å; F6-E34 PolarHBondContact N-O 3.07Å; F6-L35 HydrophobicContact CB-CD2 3.94Å; F6-L35 HydrophobicContact CD2-CD2 4.08Å; F6-L35 HydrophobicContact CG-CD2 4.44Å; F6-T36 PolarHBondContact O-N 3.41Å; F6-V99 CarbonylContact C-O 3.11Å; F6-V99 WeakPolarHBondContact CA-O 3.42Å; F6-V99 HydrophobicContact CD1-CB 3.66Å; F6-V99 HydrophobicContact CD1-CG1 3.83Å; F6-V99 HydrophobicContact CD1-CG2 4.5Å; F6-V99 HydrophobicContact CE1-CB 3.8Å; F6-V99 HydrophobicContact CE1-CG1 3.78Å; F6-V99 HydrophobicContact CE1-CG2 4.24Å; F6-M101 HydrophobicContact CD1-CG 4.29Å; F6-M101 HydrophobicContact CD1-SD 3.62Å; F6-M101 HydrophobicContact CE1-SD 3.98Å; F6-V111 HydrophobicContact CE1-CG2 4.01Å; F6-V111 HydrophobicContact CZ-CG2 3.88Å; F6-F115 HydrophobicContact CD1-CE2 4.28Å; F6-F115 HydrophobicContact CD1-CZ 4.25Å; F6-F115 HydrophobicContact CD2-CE2 4.02Å; F6-F115 HydrophobicContact CD2-CZ 4.11Å; F6-F115 AromaticContact CE1-CE2 3.86Å; F6-F115 HydrophobicContact CE1-CE2 3.86Å; F6-F115 HydrophobicContact CE1-CZ 4.27Å; F6-F115 AromaticContact CE2-CE2 3.57Å; F6-F115 HydrophobicContact CE2-CE2 3.57Å; F6-F115 HydrophobicContact CE2-CZ 4.13Å; F6-F115 HydrophobicContact CG-CE2 4.35Å; F6-F115 HydrophobicContact CG-CZ 4.17Å; F6-F115 HydrophobicContact CZ-CD2 4.43Å; F6-F115 AromaticContact CZ-CE2 3.49Å; F6-F115 HydrophobicContact CZ-CE2 3.49Å; F6-F115 VanDerWaalsContact CZ-CE2 3.49Å; F6-F115 HydrophobicContact CZ-CZ 4.23Å
7	V	98.8	Very high	92.6	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.012	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	134.5	-178.6	177.7	0	0	0	0	109.9	T36 L38 V89 L92 V98 V99 F100 M101	V7-T36 VanDerWaalsContact CA-O 3.3Å; V7-T36 WeakPolarHBondContact CA-O 3.46Å; V7-T36 HydrophobicContact CG2-CG2 4.14Å; V7-L38 HydrophobicContact CG1-CG 4.12Å; V7-V89 HydrophobicContact CB-CG1 4.46Å; V7-V89 HydrophobicContact CG1-CG1 4.21Å; V7-V89 HydrophobicContact CG1-CG2 4.1Å; V7-L92 HydrophobicContact CG1-CD1 3.94Å; V7-L92 HydrophobicContact CG2-CD1 3.82Å; V7-V98 HydrophobicContact CB-CG1 3.59Å; V7-V98 HydrophobicContact CG2-CB 4.26Å; V7-V98 HydrophobicContact CG2-CG1 3.33Å; V7-V98 HydrophobicContact CG2-CG2 3.92Å; V7-V99 PolarHBondContact N-O 3.04Å; V7-F100 HydrophobicContact CB-CD2 4.43Å; V7-F100 HydrophobicContact CG1-CD2 4.18Å; V7-F100 CarbonylContact O-C 3.58Å; V7-F100 VanDerWaalsContact O-CA 3.31Å; V7-F100 WeakPolarHBondContact O-CA 3.36Å; V7-F100 WeakPolarHBondContact O-CD2 3.34Å; V7-M101 PolarHBondContact O-N 2.99Å
8	T	98.6	Very high	92.7	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	172.3	167.6	-162.7	0	0	0	0	111.1	A19 L22 T36 I37 L38 Y55 M101 A103	T8-A19 HydrophobicContact CG2-CB 3.94Å; T8-L22 HydrophobicContact CG2-CD2 4.28Å; T8-T36 PolarHBondContact N-O 3.17Å; T8-I37 HydrophobicContact CG2-CB 4.06Å; T8-I37 HydrophobicContact CG2-CD1 3.83Å; T8-I37 HydrophobicContact CG2-CG1 3.72Å; T8-I37 WeakPolarHBondContact O-CA 3.33Å; T8-L38 PolarHBondContact O-N 3.49Å; T8-Y55 HydrophobicContact CG2-CE1 4.01Å; T8-Y55 VanDerWaalsContact CG2-OH 3.27Å; T8-Y55 WeakPolarHBondContact CG2-OH 3.5Å; T8-M101 WeakPolarHBondContact CA-O 3.44Å; T8-M101 WeakPolarHBondContact CB-O 3.35Å; T8-M101 PolarHBondContact OG1-O 3.02Å; T8-A103 PolarHBondContact OG1-N 3.3Å
9	L	97.9	Very high	93	Very high	18 Å²	18	39.5 Å²	39.5	9%	0.094	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	128.5	179.8	170.5	66.2	0	0	0	109.9	T11 L38 T40 T85 K86 F100	L9-T11 HydrophobicContact CD1-CG2 4.15Å; L9-T11 HydrophobicContact CD2-CG2 4.22Å; L9-T11 HydrophobicContact CG-CG2 4.09Å; L9-L38 WeakPolarHBondContact CA-O 3.48Å; L9-L38 HydrophobicContact CB-CB 4.41Å; L9-L38 HydrophobicContact CD1-CB 3.68Å; L9-T40 HydrophobicContact CD1-CG2 4.48Å; L9-T85 HydrophobicContact CD1-CG2 3.83Å; L9-T85 HydrophobicContact CD2-CG2 4.08Å; L9-K86 HydrophobicContact CD2-CB 4.39Å; L9-F100 HydrophobicContact CB-CE2 4.14Å; L9-F100 HydrophobicContact CB-CZ 4.24Å
10	A	95.6	Very high	93.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	116.7	169.9	0	0	0	0	0	110.4	I37 L38 T40 L43	A10-I37 HydrophobicContact CB-CD1 3.8Å; A10-I37 HydrophobicContact CB-CG1 4.5Å; A10-L38 PolarHBondContact N-O 3.31Å; A10-T40 PolarHBondContact O-N 3.28Å; A10-L43 HydrophobicContact CB-CD1 4.19Å; A10-L43 HydrophobicContact CB-CD2 4.4Å; A10-L43 WeakPolarHBondContact O-CD1 3.39Å
11	T	91.2	Very high	93.3	Very high	35 Å²	35	36.1 Å²	36.1	22%	0.215	18%	0.183	C	C	.	.	S	Bend	trans	-96.5	-14.6	-179.8	56.5	0	0	0	0	113.5	L9 T40	L9-T11 HydrophobicContact CD1-CG2 4.15Å; L9-T11 HydrophobicContact CD2-CG2 4.22Å; L9-T11 HydrophobicContact CG-CG2 4.09Å; T11-T40 WeakPolarHBondContact CA-OG1 3.46Å; T11-T40 HydrophobicContact CG2-CG2 3.92Å; T11-T40 PolarHBondContact O-OG1 3.09Å
12	N	89.8	Confident	95	Very high	54 Å²	54	24.5 Å²	24.5	29%	0.289	13%	0.126	S	C	.	.	S	Bend	trans	-155.5	171.5	178.9	64.1	40.8	0	0	0	110	E14 Y15 G16 L43	N12-E14 VanDerWaalsContact C-N 3.28Å; N12-E14 PolarHBondContact O-N 3.07Å; N12-E14 WeakPolarHBondContact OD1-CB 3.38Å; N12-E14 PolarHBondContact OD1-N 3.22Å; N12-E14 VanDerWaalsContact OD1-N 3.09Å; N12-Y15 PolarHBondContact O-N 2.94Å; N12-Y15 WeakPolarHBondContact OD1-CD2 3.41Å; N12-Y15 PolarHBondContact OD1-N 3.3Å; N12-G16 PolarHBondContact O-N 3.26Å; N12-L43 WeakPolarHBondContact O-CD2 3.47Å
13	D	90	Very high	95.6	Very high	51 Å²	51	22.5 Å²	22.5	27%	0.273	11%	0.105	S	C	.	.	H	α-helix	trans	-63.9	-29.1	-175.3	-73.9	14.3	0	0	0	113.5	G16 V17 L43 S44 M47	D13-G16 WeakPolarHBondContact O-CA 3.18Å; D13-G16 PolarHBondContact O-N 3.22Å; D13-G16 VanDerWaalsContact O-N 3.16Å; D13-V17 PolarHBondContact O-N 2.97Å; D13-L43 WeakPolarHBondContact OD1-CA 3.35Å; D13-L43 WeakPolarHBondContact OD1-CD2 3.05Å; D13-S44 PolarHBondContact OD1-N 3.19Å; D13-S44 PolarHBondContact OD1-OG 3.28Å; D13-S44 WeakPolarHBondContact OD2-CB 3.25Å; D13-S44 PolarHBondContact OD2-OG 3.33Å; D13-M47 HydrophobicContact CB-CE 4.2Å; D13-M47 WeakPolarHBondContact O-CE 3.37Å; D13-M47 WeakPolarHBondContact OD1-CB 3.38Å
14	E	88.5	Confident	95.5	Very high	67 Å²	67	18.3 Å²	18.3	31%	0.313	9%	0.092	S	C	.	.	H	α-helix	trans	-64.4	-48.1	177.3	-62.6	-174.5	163.1	0	0	111	N12 G16 V17 G18 H228	N12-E14 VanDerWaalsContact C-N 3.28Å; N12-E14 PolarHBondContact O-N 3.07Å; N12-E14 WeakPolarHBondContact OD1-CB 3.38Å; N12-E14 PolarHBondContact OD1-N 3.22Å; N12-E14 VanDerWaalsContact OD1-N 3.09Å; E14-G16 VanDerWaalsContact C-N 3.26Å; E14-G16 PolarHBondContact O-N 3.41Å; E14-V17 WeakPolarHBondContact O-CB 3.34Å; E14-V17 PolarHBondContact O-N 3.26Å; E14-G18 PolarHBondContact O-N 2.88Å; E14-H228 IonicContact OE2-NE2 2.86Å
15	Y	92.7	Very high	95.3	Very high	75 Å²	75	16 Å²	16	29%	0.294	8%	0.081	S	C	.	.	H	α-helix	trans	-69.3	-25.7	172.5	-78.7	-88.3	0	0	0	112.2	N12 V17 G18 A19 A103 W227	N12-Y15 PolarHBondContact O-N 2.94Å; N12-Y15 WeakPolarHBondContact OD1-CD2 3.41Å; N12-Y15 PolarHBondContact OD1-N 3.3Å; Y15-V17 VanDerWaalsContact C-N 3.34Å; Y15-G18 PolarHBondContact O-N 3.46Å; Y15-A19 WeakPolarHBondContact O-CB 3.46Å; Y15-A19 PolarHBondContact O-N 2.86Å; Y15-A103 HydrophobicContact CD1-CB 4.11Å; Y15-W227 HydrophobicContact CD1-CH2 4.32Å; Y15-W227 HydrophobicContact CD1-CZ2 4.33Å; Y15-W227 HydrophobicContact CE1-CZ2 4.49Å; Y15-W227 HydrophobicContact CG-CZ2 4.48Å
16	G	95	Very high	95.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.7	-42	169.5	0	0	0	0	0	112.5	N12 D13 E14 A19 L20	N12-G16 PolarHBondContact O-N 3.26Å; D13-G16 WeakPolarHBondContact O-CA 3.18Å; D13-G16 PolarHBondContact O-N 3.22Å; D13-G16 VanDerWaalsContact O-N 3.16Å; E14-G16 VanDerWaalsContact C-N 3.26Å; E14-G16 PolarHBondContact O-N 3.41Å; G16-A19 PolarHBondContact O-N 3.39Å; G16-L20 WeakPolarHBondContact O-CG 3.06Å; G16-L20 PolarHBondContact O-N 3.49Å
17	V	93.1	Very high	95.1	Very high	7 Å²	7	20.6 Å²	20.6	4%	0.042	10%	0.101	C	C	.	.	H	α-helix	trans	-62.3	-46.7	173.2	170.7	0	0	0	0	111.2	D13 E14 Y15 A19 L20 V21 M47 W227 W264 F268 L282	D13-V17 PolarHBondContact O-N 2.97Å; E14-V17 WeakPolarHBondContact O-CB 3.34Å; E14-V17 PolarHBondContact O-N 3.26Å; Y15-V17 VanDerWaalsContact C-N 3.34Å; V17-A19 VanDerWaalsContact C-N 3.3Å; V17-A19 PolarHBondContact O-N 2.81Å; V17-L20 PolarHBondContact O-N 3.47Å; V17-V21 PolarHBondContact O-N 3.24Å; V17-V21 VanDerWaalsContact O-N 3.13Å; V17-M47 HydrophobicContact CG2-CE 3.82Å; V17-W227 HydrophobicContact CG1-CB 4.4Å; V17-W264 HydrophobicContact CG1-CH2 4.19Å; V17-W264 HydrophobicContact CG1-CZ2 4.31Å; V17-F268 HydrophobicContact CG1-CD2 3.95Å; V17-F268 HydrophobicContact CG1-CE2 3.76Å; V17-L282 HydrophobicContact CB-CD2 4.31Å; V17-L282 HydrophobicContact CG1-CD2 3.51Å; V17-L282 HydrophobicContact CG2-CD2 4.07Å
18	G	95.6	Very high	94.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-54.6	-48.9	175.9	0	0	0	0	0	111.7	E14 Y15 L20 V21 L22 A103	E14-G18 PolarHBondContact O-N 2.88Å; Y15-G18 PolarHBondContact O-N 3.46Å; G18-L20 PolarHBondContact O-N 3.05Å; G18-V21 PolarHBondContact O-N 3.29Å; G18-V21 VanDerWaalsContact O-N 3.11Å; G18-L22 PolarHBondContact O-N 3.44Å; G18-A103 CarbonylContact C-O 3.28Å; G18-A103 WeakPolarHBondContact CA-O 3.31Å
19	A	98.1	Very high	94.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.2	-42.7	177.3	0	0	0	0	0	112.3	T8 Y15 G16 V17 V21 L22 A23 I37 L51 Y55 A103	T8-A19 HydrophobicContact CG2-CB 3.94Å; Y15-A19 WeakPolarHBondContact O-CB 3.46Å; Y15-A19 PolarHBondContact O-N 2.86Å; G16-A19 PolarHBondContact O-N 3.39Å; V17-A19 VanDerWaalsContact C-N 3.3Å; V17-A19 PolarHBondContact O-N 2.81Å; A19-V21 VanDerWaalsContact C-N 3.3Å; A19-V21 PolarHBondContact O-N 3.43Å; A19-L22 WeakPolarHBondContact O-CB 3.31Å; A19-L22 PolarHBondContact O-N 3.16Å; A19-A23 WeakPolarHBondContact O-CB 3.4Å; A19-A23 PolarHBondContact O-N 3.17Å; A19-I37 HydrophobicContact CB-CD1 3.58Å; A19-L51 HydrophobicContact CB-CD2 4.37Å; A19-Y55 HydrophobicContact CB-CE2 4.37Å; A19-Y55 PolarHBondContact O-OH 3.2Å; A19-A103 HydrophobicContact CB-CB 4.07Å
20	L	97.7	Very high	94	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.042	15%	0.146	C	C	.	.	H	α-helix	trans	-59.7	-39.7	175.6	-70.5	170.6	0	0	0	112.4	G16 V17 G18 A24 M47 L51 T54 V272 L276	G16-L20 WeakPolarHBondContact O-CG 3.06Å; G16-L20 PolarHBondContact O-N 3.49Å; V17-L20 PolarHBondContact O-N 3.47Å; G18-L20 PolarHBondContact O-N 3.05Å; L20-A24 WeakPolarHBondContact O-CB 3.4Å; L20-A24 PolarHBondContact O-N 3.4Å; L20-M47 HydrophobicContact CD1-CE 4.42Å; L20-M47 HydrophobicContact CD1-SD 3.84Å; L20-L51 HydrophobicContact CD2-CD2 3.88Å; L20-L51 HydrophobicContact CG-CD2 4.04Å; L20-T54 HydrophobicContact CD2-CG2 3.94Å; L20-T54 WeakPolarHBondContact CD2-OG1 3.17Å; L20-V272 HydrophobicContact CB-CB 4.49Å; L20-V272 HydrophobicContact CB-CG1 3.67Å; L20-V272 HydrophobicContact CB-CG2 3.97Å; L20-V272 HydrophobicContact CD1-CG1 3.8Å; L20-V272 HydrophobicContact CG-CG1 4.36Å; L20-L276 HydrophobicContact CD1-CD2 4.09Å
21	V	95.2	Very high	94	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-71.9	-37.8	175.7	179.5	0	0	0	0	111.6	V17 G18 A19 A24 S25 L106 W264 L267 F268 V272	V17-V21 PolarHBondContact O-N 3.24Å; V17-V21 VanDerWaalsContact O-N 3.13Å; G18-V21 PolarHBondContact O-N 3.29Å; G18-V21 VanDerWaalsContact O-N 3.11Å; A19-V21 VanDerWaalsContact C-N 3.3Å; A19-V21 PolarHBondContact O-N 3.43Å; V21-A24 WeakPolarHBondContact O-CB 3.47Å; V21-A24 PolarHBondContact O-N 2.93Å; V21-S25 WeakPolarHBondContact O-CB 3.47Å; V21-S25 PolarHBondContact O-N 3.35Å; V21-L106 HydrophobicContact CG1-CD1 4.44Å; V21-W264 HydrophobicContact CB-CZ2 4.11Å; V21-W264 HydrophobicContact CG1-CD2 4.18Å; V21-W264 HydrophobicContact CG1-CG 4Å; V21-W264 HydrophobicContact CG1-CZ2 4.46Å; V21-W264 HydrophobicContact CG2-CH2 4.19Å; V21-W264 HydrophobicContact CG2-CZ2 3.59Å; V21-L267 HydrophobicContact CG1-CB 3.98Å; V21-L267 HydrophobicContact CG1-CD1 4.19Å; V21-F268 HydrophobicContact CG2-CB 3.86Å; V21-F268 HydrophobicContact CG2-CD2 3.98Å; V21-F268 HydrophobicContact CG2-CG 4.44Å; V21-V272 HydrophobicContact CG2-CG2 3.86Å
22	L	98.4	Very high	94.3	Very high	2 Å²	2	34 Å²	34	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-50.5	173	172.7	59	0	0	0	110.9	T8 G18 A19 A24 S25 L26 M101 T105 V107	T8-L22 HydrophobicContact CG2-CD2 4.28Å; G18-L22 PolarHBondContact O-N 3.44Å; A19-L22 WeakPolarHBondContact O-CB 3.31Å; A19-L22 PolarHBondContact O-N 3.16Å; L22-A24 VanDerWaalsContact C-N 3.3Å; L22-A24 PolarHBondContact O-N 2.87Å; L22-S25 PolarHBondContact O-N 3.13Å; L22-S25 PolarHBondContact O-OG 3.33Å; L22-L26 HydrophobicContact CD1-CD1 3.97Å; L22-L26 HydrophobicContact CD1-CG 4.26Å; L22-L26 HydrophobicContact CG-CD1 4.07Å; L22-L26 PolarHBondContact O-N 3.45Å; L22-M101 HydrophobicContact CD1-CE 4.26Å; L22-M101 HydrophobicContact CD1-SD 4.32Å; L22-M101 HydrophobicContact CD2-CB 4Å; L22-T105 WeakPolarHBondContact CD1-OG1 3.26Å; L22-V107 HydrophobicContact CD1-CG2 4.05Å
23	A	98.3	Very high	94.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-42.1	175.4	0	0	0	0	0	111.9	A19 L26 K27 L35 T54 Y55	A19-A23 WeakPolarHBondContact O-CB 3.4Å; A19-A23 PolarHBondContact O-N 3.17Å; A23-L26 PolarHBondContact O-N 3.01Å; A23-K27 WeakPolarHBondContact O-CB 3.43Å; A23-K27 VanDerWaalsContact O-CG 3.31Å; A23-K27 WeakPolarHBondContact O-CG 3.31Å; A23-K27 PolarHBondContact O-N 3.29Å; A23-L35 HydrophobicContact CB-CD1 4.25Å; A23-T54 HydrophobicContact CB-CG2 3.65Å; A23-Y55 HydrophobicContact CB-CD2 4.46Å; A23-Y55 HydrophobicContact CB-CE1 4.25Å; A23-Y55 HydrophobicContact CB-CE2 3.77Å
24	A	94.5	Very high	95	Very high	10 Å²	10	33.8 Å²	33.8	8%	0.083	17%	0.17	C	C	.	.	H	α-helix	trans	-59	-47.7	173	0	0	0	0	0	110.6	L20 V21 L22 L26 K27 Q28 L267 L271	L20-A24 WeakPolarHBondContact O-CB 3.4Å; L20-A24 PolarHBondContact O-N 3.4Å; V21-A24 WeakPolarHBondContact O-CB 3.47Å; V21-A24 PolarHBondContact O-N 2.93Å; L22-A24 VanDerWaalsContact C-N 3.3Å; L22-A24 PolarHBondContact O-N 2.87Å; A24-L26 PolarHBondContact O-N 3.34Å; A24-K27 PolarHBondContact O-N 3.26Å; A24-Q28 VanDerWaalsContact O-CB 3.24Å; A24-Q28 WeakPolarHBondContact O-CB 3.35Å; A24-Q28 WeakPolarHBondContact O-CG 3.22Å; A24-Q28 PolarHBondContact O-N 3.16Å; A24-L267 HydrophobicContact CB-CD2 4.5Å; A24-L271 HydrophobicContact CB-CB 4.29Å; A24-L271 HydrophobicContact CB-CD1 4.02Å
25	S	95.1	Very high	95.5	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.007	16%	0.155	C	C	.	.	H	α-helix	trans	-62.9	-39.2	-179.6	75.8	0	0	0	0	113.5	V21 L22 Q28 S29 V107	V21-S25 WeakPolarHBondContact O-CB 3.47Å; V21-S25 PolarHBondContact O-N 3.35Å; L22-S25 PolarHBondContact O-N 3.13Å; L22-S25 PolarHBondContact O-OG 3.33Å; S25-Q28 PolarHBondContact O-N 3.3Å; S25-S29 PolarHBondContact O-N 2.87Å; S25-V107 WeakPolarHBondContact CB-O 3.48Å; S25-V107 PolarHBondContact OG-N 2.91Å; S25-V107 VanDerWaalsContact OG-N 3.09Å
26	L	97.3	Very high	95.8	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.021	14%	0.141	C	C	.	.	H	α-helix	trans	-66.7	-46.5	175.5	-79.5	164.7	0	0	0	112.3	F6 L22 A23 A24 Q28 S29 T31 L35 M101 V107	F6-L26 HydrophobicContact CB-CD1 4.01Å; F6-L26 HydrophobicContact CD1-CD2 4.13Å; F6-L26 HydrophobicContact CD2-CD1 4.47Å; F6-L26 HydrophobicContact CD2-CD2 3.86Å; F6-L26 HydrophobicContact CE1-CD2 4.14Å; F6-L26 HydrophobicContact CE2-CD2 3.87Å; F6-L26 HydrophobicContact CG-CD1 4.14Å; F6-L26 HydrophobicContact CG-CD2 3.99Å; F6-L26 HydrophobicContact CZ-CD2 4.01Å; L22-L26 HydrophobicContact CD1-CD1 3.97Å; L22-L26 HydrophobicContact CD1-CG 4.26Å; L22-L26 HydrophobicContact CG-CD1 4.07Å; L22-L26 PolarHBondContact O-N 3.45Å; A23-L26 PolarHBondContact O-N 3.01Å; A24-L26 PolarHBondContact O-N 3.34Å; L26-Q28 PolarHBondContact O-N 3.39Å; L26-S29 PolarHBondContact O-N 3.13Å; L26-S29 VanDerWaalsContact O-N 3.16Å; L26-S29 PolarHBondContact O-OG 3.04Å; L26-T31 HydrophobicContact CB-CG2 4.22Å; L26-T31 WeakPolarHBondContact O-CG2 3.36Å; L26-T31 PolarHBondContact O-N 2.97Å; L26-L35 HydrophobicContact CB-CD1 4.4Å; L26-L35 HydrophobicContact CB-CD2 4.15Å; L26-L35 HydrophobicContact CD1-CD2 3.83Å; L26-M101 HydrophobicContact CD1-SD 4.4Å; L26-M101 HydrophobicContact CD2-SD 4.33Å; L26-V107 HydrophobicContact CD2-CB 4.37Å; L26-V107 HydrophobicContact CD2-CG1 4.34Å; L26-V107 HydrophobicContact CD2-CG2 3.75Å; L26-V107 HydrophobicContact CG-CB 4.47Å; L26-V107 HydrophobicContact CG-CG2 3.91Å
27	K	95	Very high	96	Very high	97 Å²	97	27.1 Å²	27.1	42%	0.422	14%	0.141	S	C	.	.	H	α-helix	trans	-61.6	-35	176	-71.3	-177.9	-176.3	-165.7	0	111.6	A23 A24 S29 E30 L35 T54	A23-K27 WeakPolarHBondContact O-CB 3.43Å; A23-K27 VanDerWaalsContact O-CG 3.31Å; A23-K27 WeakPolarHBondContact O-CG 3.31Å; A23-K27 PolarHBondContact O-N 3.29Å; A24-K27 PolarHBondContact O-N 3.26Å; K27-S29 VanDerWaalsContact C-N 3.31Å; K27-E30 PolarHBondContact O-N 3.45Å; K27-E30 VanDerWaalsContact O-N 3.12Å; K27-L35 HydrophobicContact CD-CD1 4.41Å; K27-L35 HydrophobicContact CG-CD1 3.88Å; K27-T54 WeakPolarHBondContact CE-O 2.82Å; K27-T54 PolarHBondContact NZ-O 2.91Å
28	Q	88.7	Confident	96.2	Very high	65 Å²	65	26.8 Å²	26.8	30%	0.304	14%	0.139	S	C	.	.	H	α-helix	trans	-81	-11.8	-178.9	-63.7	-60.2	-10.9	0	0	113.7	A24 S25 L26 L267 L271	A24-Q28 VanDerWaalsContact O-CB 3.24Å; A24-Q28 WeakPolarHBondContact O-CB 3.35Å; A24-Q28 WeakPolarHBondContact O-CG 3.22Å; A24-Q28 PolarHBondContact O-N 3.16Å; S25-Q28 PolarHBondContact O-N 3.3Å; L26-Q28 PolarHBondContact O-N 3.39Å; Q28-L267 HydrophobicContact CG-CD2 4.32Å; Q28-L271 HydrophobicContact CG-CD1 3.87Å
29	S	90.6	Very high	96.3	Very high	17 Å²	17	26.8 Å²	26.8	12%	0.119	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	8.5	164.3	70.1	0	0	0	0	112.9	S25 L26 K27 T31 N110	S25-S29 PolarHBondContact O-N 2.87Å; L26-S29 PolarHBondContact O-N 3.13Å; L26-S29 VanDerWaalsContact O-N 3.16Å; L26-S29 PolarHBondContact O-OG 3.04Å; K27-S29 VanDerWaalsContact C-N 3.31Å; S29-T31 VanDerWaalsContact C-N 3.28Å; S29-T31 PolarHBondContact O-N 2.77Å; S29-N110 VanDerWaalsContact O-CB 3.3Å; S29-N110 WeakPolarHBondContact O-CB 3.13Å; S29-N110 PolarHBondContact O-ND2 3.46Å
30	E	92.8	Very high	96.1	Very high	135 Å²	135	27 Å²	27	63%	0.631	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	40.4	179.5	-57.1	179	-179.3	0	0	112.3	K27 N110	K27-E30 PolarHBondContact O-N 3.45Å; K27-E30 VanDerWaalsContact O-N 3.12Å; E30-N110 PolarHBondContact O-ND2 3.39Å; E30-N110 VanDerWaalsContact O-ND2 3.14Å
31	T	96.9	Very high	95.8	Very high	26 Å²	26	29.9 Å²	29.9	16%	0.16	16%	0.16	C	C	.	.			trans	-58.1	139.8	174.3	-176.2	0	0	0	0	111.6	F6 L26 S29 K33 L35 D112	F6-T31 WeakPolarHBondContact CE2-OG1 3.29Å; L26-T31 HydrophobicContact CB-CG2 4.22Å; L26-T31 WeakPolarHBondContact O-CG2 3.36Å; L26-T31 PolarHBondContact O-N 2.97Å; S29-T31 VanDerWaalsContact C-N 3.28Å; S29-T31 PolarHBondContact O-N 2.77Å; T31-K33 PolarHBondContact OG1-N 3.2Å; T31-K33 VanDerWaalsContact OG1-N 3.16Å; T31-L35 HydrophobicContact CG2-CD2 4.25Å; T31-D112 WeakPolarHBondContact CB-OD1 3.37Å; T31-D112 PolarHBondContact OG1-OD1 3.24Å
32	S	96.4	Very high	95.4	Very high	96 Å²	96	32.4 Å²	32.4	67%	0.671	19%	0.186	S	C	*	.			trans	-90.5	-3.5	173.3	63.3	0	0	0	0	113.4	D112	S32-D112 WeakPolarHBondContact CB-OD2 3.41Å; S32-D112 PolarHBondContact N-OD2 3.19Å; S32-D112 PolarHBondContact OG-OD2 2.86Å
33	K	97.7	Very high	95	Very high	47 Å²	47	32.8 Å²	32.8	20%	0.204	19%	0.188	C	C	.	.	S	Bend	trans	-97.5	152.7	-169.3	-52.3	-66.5	179.9	-178.8	0	110.9	E4 F6 T31 D112 F115	E4-K33 HydrophobicContact CB-CD 4.23Å; E4-K33 IonicContact OE2-NZ 3.61Å; E4-K33 PolarHBondContact OE2-NZ 3.15Å; F6-K33 HydrophobicContact CD2-CB 3.88Å; F6-K33 HydrophobicContact CE2-CB 3.88Å; F6-K33 HydrophobicContact CE2-CG 4.05Å; T31-K33 PolarHBondContact OG1-N 3.2Å; T31-K33 VanDerWaalsContact OG1-N 3.16Å; K33-D112 HydrophobicContact CG-CB 4.34Å; K33-F115 HydrophobicContact CB-CE2 3.99Å; K33-F115 HydrophobicContact CB-CZ 4.16Å; K33-F115 HydrophobicContact CD-CD2 3.96Å; K33-F115 HydrophobicContact CD-CE2 4.06Å; K33-F115 HydrophobicContact CD-CG 4.36Å; K33-F115 HydrophobicContact CG-CD2 3.82Å; K33-F115 HydrophobicContact CG-CE2 3.51Å; K33-F115 HydrophobicContact CG-CZ 4.11Å
34	E	98.2	Very high	94.7	Very high	52 Å²	52	34.6 Å²	34.6	24%	0.243	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	146.9	177.8	-61.4	-176	-153	0	0	110.9	R3 E4 S5 F6 N57	R3-E34 IonicContact CZ-OE1 3.78Å; R3-E34 IonicContact CZ-OE2 3.23Å; R3-E34 IonicContact NE-OE1 3.7Å; R3-E34 PolarHBondContact NE-OE1 3.12Å; R3-E34 IonicContact NE-OE2 2.78Å; R3-E34 PolarHBondContact NE-OE2 3.35Å; R3-E34 IonicContact NH2-OE1 3.7Å; R3-E34 PolarHBondContact NH2-OE1 3.07Å; R3-E34 IonicContact NH2-OE2 3.53Å; R3-E34 PolarHBondContact NH2-OE2 2.66Å; E4-E34 PolarHBondContact O-N 2.93Å; S5-E34 CarbonylContact C-O 3.31Å; S5-E34 WeakPolarHBondContact CA-O 3.07Å; S5-E34 WeakPolarHBondContact CB-O 3.42Å; S5-E34 VanDerWaalsContact OG-C 3.29Å; S5-E34 PolarHBondContact OG-O 3.37Å; F6-E34 PolarHBondContact N-O 3.07Å; E34-N57 PolarHBondContact OE2-ND2 2.96Å
35	L	98.8	Very high	94.6	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	120.9	174.2	-55	-171.7	0	0	0	110	F6 A23 L26 K27 T31 Y55 D56 N57	F6-L35 HydrophobicContact CB-CD2 3.94Å; F6-L35 HydrophobicContact CD2-CD2 4.08Å; F6-L35 HydrophobicContact CG-CD2 4.44Å; A23-L35 HydrophobicContact CB-CD1 4.25Å; L26-L35 HydrophobicContact CB-CD1 4.4Å; L26-L35 HydrophobicContact CB-CD2 4.15Å; L26-L35 HydrophobicContact CD1-CD2 3.83Å; K27-L35 HydrophobicContact CD-CD1 4.41Å; K27-L35 HydrophobicContact CG-CD1 3.88Å; T31-L35 HydrophobicContact CG2-CD2 4.25Å; L35-Y55 HydrophobicContact CB-CD1 3.69Å; L35-Y55 HydrophobicContact CB-CE1 4.14Å; L35-D56 PolarHBondContact N-OD2 3.04Å; L35-D56 PolarHBondContact O-N 3.1Å; L35-N57 PolarHBondContact O-N 3.5Å; L35-N57 VanDerWaalsContact O-N 3.11Å
36	T	98.8	Very high	94.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.3	178.4	-61.4	0	0	0	0	110.6	S5 F6 V7 T8 N57 I59 L92 F95	S5-T36 WeakPolarHBondContact OG-CB 3.43Å; S5-T36 PolarHBondContact OG-N 3.39Å; S5-T36 PolarHBondContact OG-OG1 3.2Å; F6-T36 PolarHBondContact O-N 3.41Å; V7-T36 VanDerWaalsContact CA-O 3.3Å; V7-T36 WeakPolarHBondContact CA-O 3.46Å; V7-T36 HydrophobicContact CG2-CG2 4.14Å; T8-T36 PolarHBondContact N-O 3.17Å; T36-N57 CarbonylContact C-O 3.56Å; T36-N57 VanDerWaalsContact CA-O 3.31Å; T36-N57 WeakPolarHBondContact CA-O 3.42Å; T36-N57 HydrophobicContact CG2-CB 3.97Å; T36-N57 WeakPolarHBondContact OG1-CB 3.49Å; T36-N57 PolarHBondContact OG1-ND2 3.41Å; T36-N57 VanDerWaalsContact OG1-ND2 3.11Å; T36-I59 HydrophobicContact CG2-CD1 3.83Å; T36-I59 HydrophobicContact CG2-CG1 4.34Å; T36-L92 HydrophobicContact CG2-CD1 4.47Å; T36-F95 HydrophobicContact CG2-CE2 4.19Å; T36-F95 HydrophobicContact CG2-CZ 4.46Å; T36-F95 VanDerWaalsContact OG1-CZ 3.25Å; T36-F95 WeakPolarHBondContact OG1-CZ 3.23Å
37	I	98.7	Very high	94.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	132	171.4	-174.7	167.6	0	0	0	111.1	T8 A10 A19 V39 L51 Y55 N57 V58 I59	T8-I37 HydrophobicContact CG2-CB 4.06Å; T8-I37 HydrophobicContact CG2-CD1 3.83Å; T8-I37 HydrophobicContact CG2-CG1 3.72Å; T8-I37 WeakPolarHBondContact O-CA 3.33Å; A10-I37 HydrophobicContact CB-CD1 3.8Å; A10-I37 HydrophobicContact CB-CG1 4.5Å; A19-I37 HydrophobicContact CB-CD1 3.58Å; I37-V39 HydrophobicContact CD1-CG1 4.31Å; I37-V39 HydrophobicContact CG1-CG1 4.04Å; I37-V39 HydrophobicContact CG2-CG1 4.23Å; I37-L51 HydrophobicContact CD1-CD1 4.01Å; I37-L51 HydrophobicContact CD1-CD2 3.67Å; I37-L51 HydrophobicContact CD1-CG 4.38Å; I37-Y55 HydrophobicContact CB-CD1 3.81Å; I37-Y55 HydrophobicContact CB-CD2 4.14Å; I37-Y55 HydrophobicContact CB-CE1 3.9Å; I37-Y55 HydrophobicContact CB-CE2 4.22Å; I37-Y55 HydrophobicContact CB-CG 3.94Å; I37-Y55 HydrophobicContact CD1-CE2 4.04Å; I37-Y55 HydrophobicContact CG2-CD1 3.94Å; I37-Y55 HydrophobicContact CG2-CD2 3.72Å; I37-Y55 HydrophobicContact CG2-CE1 4.44Å; I37-Y55 HydrophobicContact CG2-CE2 4.24Å; I37-Y55 HydrophobicContact CG2-CG 3.55Å; I37-N57 PolarHBondContact N-O 3.08Å; I37-V58 HydrophobicContact CG2-CB 4.25Å; I37-V58 HydrophobicContact CG2-CG1 4.19Å; I37-V58 HydrophobicContact CG2-CG2 3.75Å; I37-I59 PolarHBondContact O-N 3.09Å
38	L	98.5	Very high	94.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.6	165.6	-59.4	-172.1	0	0	0	109.2	V7 T8 L9 A10 I59 V61 Q88 V89 L92	V7-L38 HydrophobicContact CG1-CG 4.12Å; T8-L38 PolarHBondContact O-N 3.49Å; L9-L38 WeakPolarHBondContact CA-O 3.48Å; L9-L38 HydrophobicContact CB-CB 4.41Å; L9-L38 HydrophobicContact CD1-CB 3.68Å; A10-L38 PolarHBondContact N-O 3.31Å; L38-I59 WeakPolarHBondContact CA-O 3.35Å; L38-I59 HydrophobicContact CD2-CB 3.85Å; L38-I59 HydrophobicContact CD2-CG2 4.12Å; L38-V61 HydrophobicContact CB-CG2 4.09Å; L38-V61 HydrophobicContact CD2-CG1 3.96Å; L38-Q88 HydrophobicContact CD1-CB 3.93Å; L38-V89 HydrophobicContact CD1-CG2 3.62Å; L38-L92 HydrophobicContact CD2-CD1 4.01Å; L38-L92 HydrophobicContact CD2-CD2 3.97Å; L38-L92 HydrophobicContact CD2-CG 4.43Å
39	V	96.8	Very high	94.6	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.006	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	144.1	-178.6	-65.8	0	0	0	0	110.5	I37 L43 L51 V58 I59 E60 V61	I37-V39 HydrophobicContact CD1-CG1 4.31Å; I37-V39 HydrophobicContact CG1-CG1 4.04Å; I37-V39 HydrophobicContact CG2-CG1 4.23Å; V39-L43 HydrophobicContact CB-CD1 3.45Å; V39-L43 VanDerWaalsContact CB-CD1 3.45Å; V39-L43 HydrophobicContact CG1-CD1 3.49Å; V39-L43 VanDerWaalsContact CG1-CD1 3.49Å; V39-L51 HydrophobicContact CG1-CD1 3.95Å; V39-V58 HydrophobicContact CB-CG1 4.41Å; V39-V58 HydrophobicContact CG1-CG1 3.86Å; V39-V58 HydrophobicContact CG2-CG1 3.62Å; V39-I59 PolarHBondContact N-O 3.28Å; V39-E60 HydrophobicContact CG2-CB 4.08Å; V39-E60 CarbonylContact O-C 3.54Å; V39-E60 WeakPolarHBondContact O-CA 3.38Å; V39-V61 PolarHBondContact O-N 3.14Å
40	T	93.8	Very high	94.8	Very high	4 Å²	4	40 Å²	40	3%	0.025	23%	0.232	C	C	.	.			trans	-109.4	164.1	174.9	73.5	0	0	0	0	111.6	L9 A10 T11 G42 L43 R48 V61 P63 T85	L9-T40 HydrophobicContact CD1-CG2 4.48Å; A10-T40 PolarHBondContact O-N 3.28Å; T11-T40 WeakPolarHBondContact CA-OG1 3.46Å; T11-T40 HydrophobicContact CG2-CG2 3.92Å; T11-T40 PolarHBondContact O-OG1 3.09Å; T40-G42 PolarHBondContact O-N 3.29Å; T40-G42 PolarHBondContact OG1-N 3.46Å; T40-L43 PolarHBondContact O-N 3.46Å; T40-R48 PolarHBondContact O-NH2 3.49Å; T40-V61 HydrophobicContact CG2-CG2 4.45Å; T40-P63 HydrophobicContact CG2-CG 4.02Å; T40-T85 HydrophobicContact CG2-CG2 3.99Å
41	P	90.8	Very high	95	Very high	69 Å²	69	33.6 Å²	33.6	45%	0.448	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	-13.5	170.8	-30.8	37.9	0	0	0	116.2	L43	P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 3.38Å
42	G	87.6	Confident	95.1	Very high	52 Å²	52	35.7 Å²	35.7	54%	0.536	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-12.3	178.7	0	0	0	0	0	115.4	T40	T40-G42 PolarHBondContact O-N 3.29Å; T40-G42 PolarHBondContact OG1-N 3.46Å
43	L	90.6	Very high	95.1	Very high	10 Å²	10	36.9 Å²	36.9	5%	0.052	22%	0.215	C	C	.	.	S	Bend	trans	-81.4	140.5	177.2	-74.1	159.6	0	0	0	112.4	A10 N12 D13 V39 T40 P41 M47 R48 L51	A10-L43 HydrophobicContact CB-CD1 4.19Å; A10-L43 HydrophobicContact CB-CD2 4.4Å; A10-L43 WeakPolarHBondContact O-CD1 3.39Å; N12-L43 WeakPolarHBondContact O-CD2 3.47Å; D13-L43 WeakPolarHBondContact OD1-CA 3.35Å; D13-L43 WeakPolarHBondContact OD1-CD2 3.05Å; V39-L43 HydrophobicContact CB-CD1 3.45Å; V39-L43 VanDerWaalsContact CB-CD1 3.45Å; V39-L43 HydrophobicContact CG1-CD1 3.49Å; V39-L43 VanDerWaalsContact CG1-CD1 3.49Å; T40-L43 PolarHBondContact O-N 3.46Å; P41-L43 VanDerWaalsContact C-N 3.29Å; P41-L43 PolarHBondContact O-N 3.38Å; L43-M47 HydrophobicContact CD2-CB 4.24Å; L43-M47 HydrophobicContact CD2-CG 3.59Å; L43-R48 HydrophobicContact CB-CG 3.83Å; L43-R48 PolarHBondContact O-NE 2.94Å; L43-L51 HydrophobicContact CD1-CD1 4.04Å; L43-L51 HydrophobicContact CD2-CD1 4.39Å
44	S	91.3	Very high	95	Very high	39 Å²	39	35.2 Å²	35.2	27%	0.273	21%	0.209	S	C	.	.			trans	-65.4	157.2	172.1	71.1	0	0	0	0	111.9	D13 H46 M47 R48	D13-S44 PolarHBondContact OD1-N 3.19Å; D13-S44 PolarHBondContact OD1-OG 3.28Å; D13-S44 WeakPolarHBondContact OD2-CB 3.25Å; D13-S44 PolarHBondContact OD2-OG 3.33Å; S44-H46 VanDerWaalsContact C-N 3.3Å; S44-H46 PolarHBondContact O-N 3.23Å; S44-M47 PolarHBondContact O-N 3.4Å; S44-M47 WeakPolarHBondContact OG-CB 3.47Å; S44-M47 PolarHBondContact OG-N 3.03Å; S44-R48 WeakPolarHBondContact O-CG 3.18Å; S44-R48 PolarHBondContact O-N 3.45Å
45	S	91.9	Very high	95.1	Very high	89 Å²	89	33.4 Å²	33.4	62%	0.622	20%	0.2	S	C	*	.	H	α-helix	trans	-59.1	-41.4	176.6	51	0	0	0	0	112.1	R48 E49	S45-R48 PolarHBondContact O-N 3.22Å; S45-E49 PolarHBondContact O-N 3.13Å
46	H	91.6	Very high	95	Very high	65 Å²	65	38 Å²	38	30%	0.301	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-44.8	178	-65.3	124.3	0	0	0	111.8	S44 R48 E49 L50 Y277 D279 M280	S44-H46 VanDerWaalsContact C-N 3.3Å; S44-H46 PolarHBondContact O-N 3.23Å; H46-R48 PolarHBondContact O-N 2.95Å; H46-E49 PolarHBondContact O-N 3.44Å; H46-L50 WeakPolarHBondContact O-CG 3.14Å; H46-L50 PolarHBondContact O-N 2.98Å; H46-L50 VanDerWaalsContact O-N 3.13Å; H46-Y277 HydrophobicContact CB-CD2 3.72Å; H46-Y277 HydrophobicContact CB-CE2 4.12Å; H46-Y277 HydrophobicContact CB-CG 4.39Å; H46-Y277 AromaticContact CD2-CD2 3.84Å; H46-Y277 AromaticContact CD2-CE2 3.86Å; H46-Y277 AromaticContact CD2-CG 3.99Å; H46-D279 IonicContact CE1-OD2 3.45Å; H46-D279 PolarHBondContact CE1-OD2 2.63Å; H46-D279 IonicContact ND1-OD2 3.32Å; H46-D279 PolarHBondContact ND1-OD2 2.7Å; H46-M280 HydrophobicContact CB-CG 4.42Å; H46-M280 HydrophobicContact CB-SD 3.97Å
47	M	93.5	Very high	95	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-63.6	-42.1	176.6	-175.6	57.1	81.6	0	0	111.6	D13 V17 L20 L43 S44 E49 L50 L51 M280	D13-M47 HydrophobicContact CB-CE 4.2Å; D13-M47 WeakPolarHBondContact O-CE 3.37Å; D13-M47 WeakPolarHBondContact OD1-CB 3.38Å; V17-M47 HydrophobicContact CG2-CE 3.82Å; L20-M47 HydrophobicContact CD1-CE 4.42Å; L20-M47 HydrophobicContact CD1-SD 3.84Å; L43-M47 HydrophobicContact CD2-CB 4.24Å; L43-M47 HydrophobicContact CD2-CG 3.59Å; S44-M47 PolarHBondContact O-N 3.4Å; S44-M47 WeakPolarHBondContact OG-CB 3.47Å; S44-M47 PolarHBondContact OG-N 3.03Å; M47-E49 VanDerWaalsContact C-N 3.34Å; M47-E49 PolarHBondContact O-N 2.91Å; M47-L50 PolarHBondContact O-N 3.3Å; M47-L51 HydrophobicContact CG-CD1 3.99Å; M47-L51 HydrophobicContact CG-CG 4.37Å; M47-L51 VanDerWaalsContact O-CG 3.29Å; M47-L51 WeakPolarHBondContact O-CG 3.42Å; M47-L51 PolarHBondContact O-N 3.41Å; M47-L51 HydrophobicContact SD-CD1 4.49Å; M47-L51 HydrophobicContact SD-CG 4.32Å; M47-M280 HydrophobicContact CB-CE 3.86Å; M47-M280 HydrophobicContact CE-CE 3.2Å; M47-M280 HydrophobicContact CG-CE 4.36Å; M47-M280 HydrophobicContact SD-CE 3.76Å
48	R	95.5	Very high	95	Very high	48 Å²	48	41.8 Å²	41.8	18%	0.181	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-44.3	176.5	-75.6	168.3	171	-100.3	9.9	112.3	T40 L43 S44 S45 H46 L50 L51 C52 E60	T40-R48 PolarHBondContact O-NH2 3.49Å; L43-R48 HydrophobicContact CB-CG 3.83Å; L43-R48 PolarHBondContact O-NE 2.94Å; S44-R48 WeakPolarHBondContact O-CG 3.18Å; S44-R48 PolarHBondContact O-N 3.45Å; S45-R48 PolarHBondContact O-N 3.22Å; H46-R48 PolarHBondContact O-N 2.95Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.41Å; R48-L51 PolarHBondContact O-N 3.45Å; R48-C52 PolarHBondContact O-N 2.94Å; R48-C52 PolarHBondContact O-SG 3.28Å; R48-E60 IonicContact CZ-OE1 3.25Å; R48-E60 IonicContact CZ-OE2 3.35Å; R48-E60 VanDerWaalsContact NH1-CD 3.26Å; R48-E60 IonicContact NH1-OE1 3.43Å; R48-E60 PolarHBondContact NH1-OE1 2.82Å; R48-E60 IonicContact NH1-OE2 2.72Å; R48-E60 PolarHBondContact NH1-OE2 3.11Å; R48-E60 IonicContact NH2-OE1 3.71Å; R48-E60 PolarHBondContact NH2-OE1 3.28Å; R48-E60 IonicContact NH2-OE2 2.71Å
49	E	95.4	Very high	95	Very high	91 Å²	91	43.8 Å²	43.8	43%	0.425	26%	0.257	S	S	.	.	H	α-helix	trans	-60.3	-44	176.5	-172.9	-176.6	-172.2	0	0	111.8	S45 H46 M47 L51 C52 N53 Y277	S45-E49 PolarHBondContact O-N 3.13Å; H46-E49 PolarHBondContact O-N 3.44Å; M47-E49 VanDerWaalsContact C-N 3.34Å; M47-E49 PolarHBondContact O-N 2.91Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.45Å; E49-C52 WeakPolarHBondContact O-CB 3.28Å; E49-C52 PolarHBondContact O-N 2.85Å; E49-N53 PolarHBondContact O-N 3.31Å; E49-N53 PolarHBondContact O-ND2 3.1Å; E49-Y277 VanDerWaalsContact CD-OH 3.22Å; E49-Y277 PolarHBondContact OE1-OH 3.04Å; E49-Y277 PolarHBondContact OE2-OH 2.59Å
50	L	95.3	Very high	95	Very high	12 Å²	12	48.5 Å²	48.5	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-37.6	177.8	-69.9	171.8	0	0	0	113.1	H46 M47 R48 N53 T54 K275 L276 Y277 M280	H46-L50 WeakPolarHBondContact O-CG 3.14Å; H46-L50 PolarHBondContact O-N 2.98Å; H46-L50 VanDerWaalsContact O-N 3.13Å; M47-L50 PolarHBondContact O-N 3.3Å; R48-L50 VanDerWaalsContact C-N 3.34Å; R48-L50 PolarHBondContact O-N 3.41Å; L50-N53 PolarHBondContact O-N 2.84Å; L50-T54 WeakPolarHBondContact O-CB 3.48Å; L50-T54 PolarHBondContact O-N 3.47Å; L50-T54 PolarHBondContact O-OG1 3.42Å; L50-K275 HydrophobicContact CD2-CB 4.09Å; L50-K275 WeakPolarHBondContact CD2-O 3.47Å; L50-L276 HydrophobicContact CD1-CD2 3.83Å; L50-Y277 HydrophobicContact CD1-CD2 4.16Å; L50-Y277 HydrophobicContact CD2-CE2 4.4Å; L50-Y277 HydrophobicContact CG-CD2 4.38Å; L50-Y277 HydrophobicContact CG-CE2 4.25Å; L50-M280 HydrophobicContact CD1-CE 3.73Å; L50-M280 HydrophobicContact CD1-SD 3.42Å; L50-M280 WeakPolarHBondContact CD1-SD 3.05Å
51	L	97.7	Very high	95	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.8	-42.9	173.8	-68.5	169.7	0	0	0	111	A19 L20 I37 V39 L43 M47 R48 E49 N53 T54 Y55 V58	A19-L51 HydrophobicContact CB-CD2 4.37Å; L20-L51 HydrophobicContact CD2-CD2 3.88Å; L20-L51 HydrophobicContact CG-CD2 4.04Å; I37-L51 HydrophobicContact CD1-CD1 4.01Å; I37-L51 HydrophobicContact CD1-CD2 3.67Å; I37-L51 HydrophobicContact CD1-CG 4.38Å; V39-L51 HydrophobicContact CG1-CD1 3.95Å; L43-L51 HydrophobicContact CD1-CD1 4.04Å; L43-L51 HydrophobicContact CD2-CD1 4.39Å; M47-L51 HydrophobicContact CG-CD1 3.99Å; M47-L51 HydrophobicContact CG-CG 4.37Å; M47-L51 VanDerWaalsContact O-CG 3.29Å; M47-L51 WeakPolarHBondContact O-CG 3.42Å; M47-L51 PolarHBondContact O-N 3.41Å; M47-L51 HydrophobicContact SD-CD1 4.49Å; M47-L51 HydrophobicContact SD-CG 4.32Å; R48-L51 PolarHBondContact O-N 3.45Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.45Å; L51-N53 VanDerWaalsContact C-N 3.26Å; L51-N53 PolarHBondContact O-N 3.04Å; L51-T54 PolarHBondContact O-N 3.48Å; L51-Y55 HydrophobicContact CD2-CD2 4.05Å; L51-Y55 HydrophobicContact CD2-CE2 3.84Å; L51-Y55 PolarHBondContact O-N 3.14Å; L51-V58 HydrophobicContact CB-CG2 4.49Å
52	C	97.6	Very high	95	Very high	71 Å²	71	51.6 Å²	51.6	48%	0.48	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-33.7	174.2	-70.4	0	0	0	0	113	R48 E49 T54 V58	R48-C52 PolarHBondContact O-N 2.94Å; R48-C52 PolarHBondContact O-SG 3.28Å; E49-C52 WeakPolarHBondContact O-CB 3.28Å; E49-C52 PolarHBondContact O-N 2.85Å; C52-T54 VanDerWaalsContact C-N 3.29Å; C52-V58 HydrophobicContact CB-CG2 4.37Å
53	N	96.7	Very high	95	Very high	120 Å²	120	51.1 Å²	51.1	64%	0.642	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-12.2	175.6	-68	-29	0	0	0	113.3	E49 L50 L51	E49-N53 PolarHBondContact O-N 3.31Å; E49-N53 PolarHBondContact O-ND2 3.1Å; L50-N53 PolarHBondContact O-N 2.84Å; L51-N53 VanDerWaalsContact C-N 3.26Å; L51-N53 PolarHBondContact O-N 3.04Å
54	T	97	Very high	94.7	Very high	13 Å²	13	51.4 Å²	51.4	8%	0.08	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-38.6	-173	-59	0	0	0	0	113.1	L20 A23 K27 L50 L51 C52	L20-T54 HydrophobicContact CD2-CG2 3.94Å; L20-T54 WeakPolarHBondContact CD2-OG1 3.17Å; A23-T54 HydrophobicContact CB-CG2 3.65Å; K27-T54 WeakPolarHBondContact CE-O 2.82Å; K27-T54 PolarHBondContact NZ-O 2.91Å; L50-T54 WeakPolarHBondContact O-CB 3.48Å; L50-T54 PolarHBondContact O-N 3.47Å; L50-T54 PolarHBondContact O-OG1 3.42Å; L51-T54 PolarHBondContact O-N 3.48Å; C52-T54 VanDerWaalsContact C-N 3.29Å
55	Y	98.6	Very high	93.9	Very high	13 Å²	13	53.3 Å²	53.3	5%	0.051	28%	0.284	C	S	.	.			trans	-98.5	150.3	-179.2	-77.4	-96.1	0	0	0	111.2	T8 A19 A23 L35 I37 L51	T8-Y55 HydrophobicContact CG2-CE1 4.01Å; T8-Y55 VanDerWaalsContact CG2-OH 3.27Å; T8-Y55 WeakPolarHBondContact CG2-OH 3.5Å; A19-Y55 HydrophobicContact CB-CE2 4.37Å; A19-Y55 PolarHBondContact O-OH 3.2Å; A23-Y55 HydrophobicContact CB-CD2 4.46Å; A23-Y55 HydrophobicContact CB-CE1 4.25Å; A23-Y55 HydrophobicContact CB-CE2 3.77Å; L35-Y55 HydrophobicContact CB-CD1 3.69Å; L35-Y55 HydrophobicContact CB-CE1 4.14Å; I37-Y55 HydrophobicContact CB-CD1 3.81Å; I37-Y55 HydrophobicContact CB-CD2 4.14Å; I37-Y55 HydrophobicContact CB-CE1 3.9Å; I37-Y55 HydrophobicContact CB-CE2 4.22Å; I37-Y55 HydrophobicContact CB-CG 3.94Å; I37-Y55 HydrophobicContact CD1-CE2 4.04Å; I37-Y55 HydrophobicContact CG2-CD1 3.94Å; I37-Y55 HydrophobicContact CG2-CD2 3.72Å; I37-Y55 HydrophobicContact CG2-CE1 4.44Å; I37-Y55 HydrophobicContact CG2-CE2 4.24Å; I37-Y55 HydrophobicContact CG2-CG 3.55Å; L51-Y55 HydrophobicContact CD2-CD2 4.05Å; L51-Y55 HydrophobicContact CD2-CE2 3.84Å; L51-Y55 PolarHBondContact O-N 3.14Å
56	D	98.2	Very high	92.8	Very high	99 Å²	99	49.5 Å²	49.5	53%	0.529	26%	0.257	S	S	.	.	S	Bend	trans	-72.3	-35.1	176.9	-54.4	-56.9	0	0	0	110.9	L35	L35-D56 PolarHBondContact N-OD2 3.04Å; L35-D56 PolarHBondContact O-N 3.1Å
57	N	98.3	Very high	91.1	Very high	35 Å²	35	55.9 Å²	55.9	19%	0.187	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	127.1	176.5	-48.2	-91.1	0	0	0	110.5	R3 E34 L35 T36 I37	R3-N57 PolarHBondContact NH2-OD1 3.25Å; E34-N57 PolarHBondContact OE2-ND2 2.96Å; L35-N57 PolarHBondContact O-N 3.5Å; L35-N57 VanDerWaalsContact O-N 3.11Å; T36-N57 CarbonylContact C-O 3.56Å; T36-N57 VanDerWaalsContact CA-O 3.31Å; T36-N57 WeakPolarHBondContact CA-O 3.42Å; T36-N57 HydrophobicContact CG2-CB 3.97Å; T36-N57 WeakPolarHBondContact OG1-CB 3.49Å; T36-N57 PolarHBondContact OG1-ND2 3.41Å; T36-N57 VanDerWaalsContact OG1-ND2 3.11Å; I37-N57 PolarHBondContact N-O 3.08Å
58	V	98.2	Very high	89	Confident	44 Å²	44	59.6 Å²	59.6	27%	0.267	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	113.2	170.7	-179.1	0	0	0	0	108.1	I37 V39 L51 C52	I37-V58 HydrophobicContact CG2-CB 4.25Å; I37-V58 HydrophobicContact CG2-CG1 4.19Å; I37-V58 HydrophobicContact CG2-CG2 3.75Å; V39-V58 HydrophobicContact CB-CG1 4.41Å; V39-V58 HydrophobicContact CG1-CG1 3.86Å; V39-V58 HydrophobicContact CG2-CG1 3.62Å; L51-V58 HydrophobicContact CB-CG2 4.49Å; C52-V58 HydrophobicContact CB-CG2 4.37Å
59	I	97.8	Very high	86.9	Confident	42 Å²	42	61.7 Å²	61.7	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.5	-173.5	-57.8	174.2	0	0	0	108.5	T36 I37 L38 V39 V61 L92 Q94	T36-I59 HydrophobicContact CG2-CD1 3.83Å; T36-I59 HydrophobicContact CG2-CG1 4.34Å; I37-I59 PolarHBondContact O-N 3.09Å; L38-I59 WeakPolarHBondContact CA-O 3.35Å; L38-I59 HydrophobicContact CD2-CB 3.85Å; L38-I59 HydrophobicContact CD2-CG2 4.12Å; V39-I59 PolarHBondContact N-O 3.28Å; I59-V61 HydrophobicContact CG2-CG1 4.13Å; I59-L92 HydrophobicContact CD1-CD2 3.61Å; I59-L92 HydrophobicContact CG2-CD2 4.45Å; I59-Q94 VanDerWaalsContact CD1-NE2 3.27Å
60	E	96.6	Very high	84.6	Confident	101 Å²	101	63 Å²	63	47%	0.472	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.3	174.6	-178.5	154.4	-161.4	0	0	111	V39 R48	V39-E60 HydrophobicContact CG2-CB 4.08Å; V39-E60 CarbonylContact O-C 3.54Å; V39-E60 WeakPolarHBondContact O-CA 3.38Å; R48-E60 IonicContact CZ-OE1 3.25Å; R48-E60 IonicContact CZ-OE2 3.35Å; R48-E60 VanDerWaalsContact NH1-CD 3.26Å; R48-E60 IonicContact NH1-OE1 3.43Å; R48-E60 PolarHBondContact NH1-OE1 2.82Å; R48-E60 IonicContact NH1-OE2 2.72Å; R48-E60 PolarHBondContact NH1-OE2 3.11Å; R48-E60 IonicContact NH2-OE1 3.71Å; R48-E60 PolarHBondContact NH2-OE1 3.28Å; R48-E60 IonicContact NH2-OE2 2.71Å
61	V	94.8	Very high	82.3	Confident	13 Å²	13	64.8 Å²	64.8	8%	0.079	35%	0.347	C	S	.	.			trans	-126.9	147.1	179.3	-61.8	0	0	0	0	110.4	L38 V39 T40 I59 T85 Q88	L38-V61 HydrophobicContact CB-CG2 4.09Å; L38-V61 HydrophobicContact CD2-CG1 3.96Å; V39-V61 PolarHBondContact O-N 3.14Å; T40-V61 HydrophobicContact CG2-CG2 4.45Å; I59-V61 HydrophobicContact CG2-CG1 4.13Å; V61-T85 HydrophobicContact CG2-CG2 3.86Å; V61-Q88 HydrophobicContact CB-CB 4.3Å; V61-Q88 HydrophobicContact CB-CG 4.02Å; V61-Q88 HydrophobicContact CG1-CB 4.15Å; V61-Q88 HydrophobicContact CG1-CG 4.37Å; V61-Q88 HydrophobicContact CG2-CB 4.38Å; V61-Q88 HydrophobicContact CG2-CG 4.17Å
62	Q	90.2	Very high	80	Confident	125 Å²	125	69.2 Å²	69.2	58%	0.584	38%	0.375	S	S	*	.			trans	-76.4	136.3	172.6	-64.5	-57.1	-28.5	0	0	110.1	V64 Q88	Q62-V64 PolarHBondContact O-N 3.13Å; Q62-Q88 PolarHBondContact O-NE2 3.13Å; Q62-Q88 VanDerWaalsContact O-NE2 3.11Å
63	P	88.2	Confident	77.7	Confident	41 Å²	41	71.3 Å²	71.3	27%	0.266	39%	0.385	S	S	.	.			trans	-56.9	128.8	173.4	-23.7	32.8	0	0	0	111	T40 I65 T85	T40-P63 HydrophobicContact CG2-CG 4.02Å; P63-I65 HydrophobicContact CB-CD1 3.92Å; P63-I65 HydrophobicContact CB-CG1 3.89Å; P63-I65 PolarHBondContact O-N 2.96Å; P63-T85 WeakPolarHBondContact CA-OG1 3.48Å
64	V	85	Confident	75.2	Confident	16 Å²	16	66.2 Å²	66.2	10%	0.097	36%	0.358	C	S	.	.			trans	-84	102.6	170.9	-177.5	0	0	0	0	106.6	Q62 T83 F84 T85 Q88 L150 L153	Q62-V64 PolarHBondContact O-N 3.13Å; V64-T83 CarbonylContact O-C 3.47Å; V64-T83 WeakPolarHBondContact O-CA 3.02Å; V64-F84 HydrophobicContact CB-CB 4.23Å; V64-F84 HydrophobicContact CG1-CB 4.04Å; V64-F84 PolarHBondContact O-N 3.46Å; V64-T85 PolarHBondContact N-OG1 3.01Å; V64-Q88 HydrophobicContact CG2-CG 4.15Å; V64-L150 HydrophobicContact CG1-CD2 4.12Å; V64-L153 HydrophobicContact CG1-CD2 3.88Å
65	I	74.6	Confident	72.5	Confident	80 Å²	80	69 Å²	69	41%	0.41	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-108.3	126.2	-174.9	-67.9	166.4	0	0	0	108.8	P63 I81 T83	P63-I65 HydrophobicContact CB-CD1 3.92Å; P63-I65 HydrophobicContact CB-CG1 3.89Å; P63-I65 PolarHBondContact O-N 2.96Å; I65-I81 HydrophobicContact CB-CG2 4.08Å; I65-I81 HydrophobicContact CD1-CG2 3.94Å; I65-I81 HydrophobicContact CG1-CG2 3.63Å; I65-I81 HydrophobicContact CG2-CG2 3.44Å; I65-I81 VanDerWaalsContact CG2-CG2 3.44Å; I65-T83 HydrophobicContact CG1-CG2 4.4Å
66	T	67.9	Low	70	Confident	9 Å²	9	71.3 Å²	71.3	6%	0.055	41%	0.406	C	S	.	.			trans	-101.8	127.9	163.5	63.8	0	0	0	0	109.3	S68 F84 L153 F154	T66-S68 PolarHBondContact O-N 2.63Å; T66-F84 HydrophobicContact CG2-CD2 4.12Å; T66-F84 HydrophobicContact CG2-CE2 4.3Å; T66-F84 VanDerWaalsContact OG1-CE2 3.31Å; T66-F84 WeakPolarHBondContact OG1-CE2 3.2Å; T66-L153 HydrophobicContact CG2-CD1 3.83Å; T66-L153 HydrophobicContact CG2-CD2 3.83Å; T66-L153 HydrophobicContact CG2-CG 3.79Å; T66-F154 HydrophobicContact CG2-CE1 4.4Å
67	K	55.8	Low	67.4	Low	198 Å²	198	74.3 Å²	74.3	86%	0.861	41%	0.41	S	S	*	.			trans	-79.9	107.6	174	-72.8	-179.9	-179.5	174.1	0	107.7	W69	K67-W69 PolarHBondContact O-N 3.38Å
68	S	50.6	Low	64.6	Low	80 Å²	80	78.6 Å²	78.6	56%	0.559	44%	0.437	S	S	*	.			trans	28.5	81.1	161.6	-177.3	0	0	0	0	114	T66 S70	T66-S68 PolarHBondContact O-N 2.63Å; S68-S70 PolarHBondContact O-N 3.06Å
69	W	50.5	Low	61.9	Low	93 Å²	93	84 Å²	84	35%	0.352	46%	0.46	S	S	.	.			trans	-51.8	138.7	159.4	-67.8	94.2	0	0	0	108.6	K67 N71 L153 F154	K67-W69 PolarHBondContact O-N 3.38Å; W69-N71 HydrophobicContact CB-CB 4.45Å; W69-N71 PolarHBondContact O-N 3.39Å; W69-L153 VanDerWaalsContact CZ2-O 3.3Å; W69-L153 WeakPolarHBondContact CZ2-O 3.37Å; W69-F154 VanDerWaalsContact CH2-O 3.22Å; W69-F154 WeakPolarHBondContact CH2-O 3.32Å
70	S	46.7	Very low	59.1	Low	117 Å²	117	86 Å²	86	82%	0.818	47%	0.47	S	S	*	.			trans	-69.1	35.7	173.4	58	0	0	0	0	112.1	S68	S68-S70 PolarHBondContact O-N 3.06Å
71	N	48.1	Very low	56.8	Low	51 Å²	51	86.1 Å²	86.1	27%	0.273	47%	0.473	S	S	.	.			trans	-73.7	123.7	171.7	-163	-17.5	0	0	0	106.8	W69 V73 I74 S75	W69-N71 HydrophobicContact CB-CB 4.45Å; W69-N71 PolarHBondContact O-N 3.39Å; N71-V73 PolarHBondContact O-N 3.09Å; N71-I74 HydrophobicContact CB-CD1 4.17Å; N71-I74 PolarHBondContact O-N 2.76Å; N71-S75 PolarHBondContact O-N 3.29Å
72	P	48.2	Very low	54.9	Low	93 Å²	93	87.4 Å²	87.4	60%	0.604	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-18.4	-177.9	17.1	-31.3	0	0	0	114.3
73	V	50.2	Low	53.9	Low	114 Å²	114	83.6 Å²	83.6	69%	0.691	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-32.2	174.3	-175.8	0	0	0	0	112.7	N71	N71-V73 PolarHBondContact O-N 3.09Å
74	I	44.2	Very low	54	Low	13 Å²	13	81.8 Å²	81.8	7%	0.067	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-21.2	-173.1	-58	163.9	0	0	0	111.6	N71 G76 R77 E82	N71-I74 HydrophobicContact CB-CD1 4.17Å; N71-I74 PolarHBondContact O-N 2.76Å; I74-G76 PolarHBondContact O-N 3.24Å; I74-R77 PolarHBondContact O-N 3.45Å; I74-E82 VanDerWaalsContact CD1-OE2 3.28Å; I74-E82 WeakPolarHBondContact CD1-OE2 3.44Å
75	S	39.7	Very low	54.4	Low	73 Å²	73	81 Å²	81	51%	0.51	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	99.9	-178.8	-166.9	0	0	0	0	111.7	N71	N71-S75 PolarHBondContact O-N 3.29Å
76	G	46	Very low	55.3	Low	61 Å²	61	78 Å²	78	63%	0.629	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	130.1	-4.7	175.2	0	0	0	0	0	116.4	I74	I74-G76 PolarHBondContact O-N 3.24Å
77	R	43.4	Very low	56.7	Low	162 Å²	162	77.6 Å²	77.6	61%	0.611	43%	0.429	S	S	*	.			trans	-120.7	72.9	-179.4	-64.8	-170.5	-179.9	178.4	0.8	112.8	I74 E79 L80	I74-R77 PolarHBondContact O-N 3.45Å; R77-E79 PolarHBondContact O-N 2.94Å; R77-L80 HydrophobicContact CB-CB 4.43Å; R77-L80 HydrophobicContact CB-CD1 3.66Å; R77-L80 HydrophobicContact CB-CG 3.99Å; R77-L80 HydrophobicContact CG-CD1 4.25Å; R77-L80 WeakPolarHBondContact O-CB 3.37Å; R77-L80 PolarHBondContact O-N 3.5Å
78	T	39.4	Very low	58.6	Low	124 Å²	124	69.1 Å²	69.1	76%	0.761	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.2	179.1	42.4	0	0	0	0	114.5	L80	T78-L80 PolarHBondContact O-N 3Å
79	E	43.1	Very low	60.9	Low	159 Å²	159	65.3 Å²	65.3	74%	0.743	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.3	169.7	43.5	-93.7	-174	0	0	113.8	R77 I81	R77-E79 PolarHBondContact O-N 2.94Å; E79-I81 PolarHBondContact O-N 3.07Å
80	L	38.5	Very low	63.1	Low	83 Å²	83	60.9 Å²	60.9	44%	0.435	35%	0.349	S	S	.	.			trans	-94.9	67.5	177.7	-58.8	176.4	0	0	0	110	R77 T78 E82	R77-L80 HydrophobicContact CB-CB 4.43Å; R77-L80 HydrophobicContact CB-CD1 3.66Å; R77-L80 HydrophobicContact CB-CG 3.99Å; R77-L80 HydrophobicContact CG-CD1 4.25Å; R77-L80 WeakPolarHBondContact O-CB 3.37Å; R77-L80 PolarHBondContact O-N 3.5Å; T78-L80 PolarHBondContact O-N 3Å; L80-E82 HydrophobicContact CB-CG 4.42Å; L80-E82 PolarHBondContact O-N 3.27Å
81	I	47.1	Very low	65.5	Low	104 Å²	104	56.9 Å²	56.9	53%	0.533	32%	0.32	S	S	.	.			trans	-58.3	96.7	154.2	-71.6	173.9	0	0	0	105.7	I65 E79 T83	I65-I81 HydrophobicContact CB-CG2 4.08Å; I65-I81 HydrophobicContact CD1-CG2 3.94Å; I65-I81 HydrophobicContact CG1-CG2 3.63Å; I65-I81 HydrophobicContact CG2-CG2 3.44Å; I65-I81 VanDerWaalsContact CG2-CG2 3.44Å; E79-I81 PolarHBondContact O-N 3.07Å; I81-T83 HydrophobicContact CG2-CG2 4.27Å; I81-T83 PolarHBondContact O-N 2.89Å
82	E	56.8	Low	67.9	Low	39 Å²	39	54.6 Å²	54.6	18%	0.182	31%	0.308	C	S	.	.			trans	-70.9	104.5	177.2	-75.3	172	161	0	0	106.7	I74 L80 F84	I74-E82 VanDerWaalsContact CD1-OE2 3.28Å; I74-E82 WeakPolarHBondContact CD1-OE2 3.44Å; L80-E82 HydrophobicContact CB-CG 4.42Å; L80-E82 PolarHBondContact O-N 3.27Å; E82-F84 HydrophobicContact CB-CE2 3.96Å; E82-F84 WeakPolarHBondContact O-CD2 3.36Å
83	T	68.8	Low	70.2	Confident	45 Å²	45	55.2 Å²	55.2	28%	0.276	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-81.4	121	176.4	57.1	0	0	0	0	107.9	V64 I65 I81 T85	V64-T83 CarbonylContact O-C 3.47Å; V64-T83 WeakPolarHBondContact O-CA 3.02Å; I65-T83 HydrophobicContact CG1-CG2 4.4Å; I81-T83 HydrophobicContact CG2-CG2 4.27Å; I81-T83 PolarHBondContact O-N 2.89Å; T83-T85 PolarHBondContact O-N 3.1Å
84	F	89.7	Confident	72.5	Confident	3 Å²	3	53.6 Å²	53.6	1%	0.013	29%	0.29	C	S	.	.			trans	-92.9	26.5	171.6	-70.6	-97.8	0	0	0	112	V64 T66 E82 K86 I87 L153 G161 E163 L166	V64-F84 HydrophobicContact CB-CB 4.23Å; V64-F84 HydrophobicContact CG1-CB 4.04Å; V64-F84 PolarHBondContact O-N 3.46Å; T66-F84 HydrophobicContact CG2-CD2 4.12Å; T66-F84 HydrophobicContact CG2-CE2 4.3Å; T66-F84 VanDerWaalsContact OG1-CE2 3.31Å; T66-F84 WeakPolarHBondContact OG1-CE2 3.2Å; E82-F84 HydrophobicContact CB-CE2 3.96Å; E82-F84 WeakPolarHBondContact O-CD2 3.36Å; F84-K86 PolarHBondContact O-N 2.87Å; F84-K86 VanDerWaalsContact O-N 3.1Å; F84-I87 HydrophobicContact CB-CD1 3.87Å; F84-I87 WeakPolarHBondContact O-CB 3.3Å; F84-I87 WeakPolarHBondContact O-CG1 3.27Å; F84-I87 PolarHBondContact O-N 2.85Å; F84-I87 VanDerWaalsContact O-N 3.12Å; F84-L153 HydrophobicContact CB-CD2 3.71Å; F84-L153 HydrophobicContact CD1-CD1 3.57Å; F84-L153 HydrophobicContact CD1-CD2 4.16Å; F84-L153 HydrophobicContact CD2-CD1 3.91Å; F84-L153 HydrophobicContact CD2-CD2 4.19Å; F84-L153 HydrophobicContact CE1-CD1 3.55Å; F84-L153 HydrophobicContact CE2-CD1 3.89Å; F84-L153 HydrophobicContact CG-CD1 3.76Å; F84-L153 HydrophobicContact CG-CD2 3.75Å; F84-L153 HydrophobicContact CG-CG 4.43Å; F84-L153 HydrophobicContact CZ-CD1 3.71Å; F84-G161 VanDerWaalsContact CZ-O 3.22Å; F84-G161 WeakPolarHBondContact CZ-O 3.36Å; F84-E163 VanDerWaalsContact C-OE1 3.29Å; F84-E163 VanDerWaalsContact CA-CG 3.48Å; F84-E163 VanDerWaalsContact CA-OE1 3.31Å; F84-E163 WeakPolarHBondContact CA-OE1 3.48Å; F84-E163 HydrophobicContact CB-CG 4.03Å; F84-E163 HydrophobicContact CD1-CB 4.41Å; F84-E163 HydrophobicContact CD1-CG 3.62Å; F84-E163 HydrophobicContact CE1-CG 4.37Å; F84-E163 HydrophobicContact CG-CG 4.05Å; F84-L166 HydrophobicContact CD1-CB 4.4Å; F84-L166 HydrophobicContact CD1-CD2 3.95Å; F84-L166 HydrophobicContact CE1-CB 4.18Å; F84-L166 HydrophobicContact CE1-CD2 4.42Å
85	T	92.5	Very high	75	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-63.8	-22.1	-167.8	-52.5	0	0	0	0	112.1	L9 T40 V61 P63 V64 T83 I87 Q88 E163	L9-T85 HydrophobicContact CD1-CG2 3.83Å; L9-T85 HydrophobicContact CD2-CG2 4.08Å; T40-T85 HydrophobicContact CG2-CG2 3.99Å; V61-T85 HydrophobicContact CG2-CG2 3.86Å; P63-T85 WeakPolarHBondContact CA-OG1 3.48Å; V64-T85 PolarHBondContact N-OG1 3.01Å; T83-T85 PolarHBondContact O-N 3.1Å; T85-I87 PolarHBondContact O-N 3.49Å; T85-I87 VanDerWaalsContact O-N 3.13Å; T85-Q88 HydrophobicContact CG2-CG 4.24Å; T85-Q88 VanDerWaalsContact O-CB 3.27Å; T85-Q88 WeakPolarHBondContact O-CB 3.11Å; T85-Q88 VanDerWaalsContact O-CG 3.24Å; T85-Q88 WeakPolarHBondContact O-CG 3.41Å; T85-Q88 PolarHBondContact O-N 3.46Å; T85-E163 PolarHBondContact N-OE1 3.5Å
86	K	95	Very high	77.8	Confident	16 Å²	16	53.2 Å²	53.2	7%	0.07	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-57	-26.6	175.3	-169.2	177.8	-68.8	-168.6	0	113.1	L9 F84 Q88 V89 F100 D102 A134 F137 E163 L167	L9-K86 HydrophobicContact CD2-CB 4.39Å; F84-K86 PolarHBondContact O-N 2.87Å; F84-K86 VanDerWaalsContact O-N 3.1Å; K86-Q88 PolarHBondContact O-N 3.37Å; K86-Q88 VanDerWaalsContact O-N 3.15Å; K86-V89 WeakPolarHBondContact O-CB 3.4Å; K86-V89 WeakPolarHBondContact O-CG2 3.43Å; K86-V89 PolarHBondContact O-N 3.41Å; K86-F100 HydrophobicContact CD-CD1 4.13Å; K86-F100 HydrophobicContact CD-CE1 3.59Å; K86-F100 HydrophobicContact CD-CZ 3.84Å; K86-F100 HydrophobicContact CG-CD1 4.47Å; K86-F100 HydrophobicContact CG-CE1 3.98Å; K86-F100 HydrophobicContact CG-CE2 4.04Å; K86-F100 HydrophobicContact CG-CZ 3.74Å; K86-D102 WeakPolarHBondContact CE-OD1 3.49Å; K86-D102 VanDerWaalsContact NZ-CG 3.26Å; K86-D102 IonicContact NZ-OD1 2.98Å; K86-D102 PolarHBondContact NZ-OD1 3.37Å; K86-D102 IonicContact NZ-OD2 3.11Å; K86-D102 PolarHBondContact NZ-OD2 3.24Å; K86-A134 PolarHBondContact NZ-O 3.12Å; K86-F137 HydrophobicContact CD-CE1 3.99Å; K86-F137 HydrophobicContact CD-CZ 4.19Å; K86-F137 HydrophobicContact CG-CZ 4.41Å; K86-E163 HydrophobicContact CB-CG 4.3Å; K86-E163 WeakPolarHBondContact CB-OE1 3.44Å; K86-E163 PolarHBondContact N-OE1 2.87Å; K86-L167 HydrophobicContact CD-CD1 4.48Å
87	I	95.8	Very high	80.3	Confident	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59	-27.6	176.1	-61.1	168.7	0	0	0	112	F84 T85 V89 W90 Y146 L149 L150 L153 L166	F84-I87 HydrophobicContact CB-CD1 3.87Å; F84-I87 WeakPolarHBondContact O-CB 3.3Å; F84-I87 WeakPolarHBondContact O-CG1 3.27Å; F84-I87 PolarHBondContact O-N 2.85Å; F84-I87 VanDerWaalsContact O-N 3.12Å; T85-I87 PolarHBondContact O-N 3.49Å; T85-I87 VanDerWaalsContact O-N 3.13Å; I87-V89 PolarHBondContact O-N 3.46Å; I87-W90 PolarHBondContact O-N 2.96Å; I87-W90 VanDerWaalsContact O-N 3.15Å; I87-Y146 HydrophobicContact CG2-CD2 3.78Å; I87-Y146 HydrophobicContact CG2-CE2 3.94Å; I87-Y146 WeakPolarHBondContact O-CD2 3.06Å; I87-L149 HydrophobicContact CD1-CB 4.44Å; I87-L149 HydrophobicContact CG1-CB 4.45Å; I87-L149 HydrophobicContact CG2-CB 3.72Å; I87-L149 HydrophobicContact CG2-CD1 4.05Å; I87-L150 HydrophobicContact CG2-CD2 4.45Å; I87-L153 HydrophobicContact CD1-CD2 3.91Å; I87-L166 HydrophobicContact CD1-CD2 3.33Å; I87-L166 HydrophobicContact CG1-CD2 4.05Å
88	Q	96.5	Very high	82.9	Confident	20 Å²	20	43.8 Å²	43.8	9%	0.093	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-57.7	-20.4	179.1	-62.7	-72	18.6	0	0	113.2	L38 V61 Q62 V64 T85 K86 W90 S91 Y146	L38-Q88 HydrophobicContact CD1-CB 3.93Å; V61-Q88 HydrophobicContact CB-CB 4.3Å; V61-Q88 HydrophobicContact CB-CG 4.02Å; V61-Q88 HydrophobicContact CG1-CB 4.15Å; V61-Q88 HydrophobicContact CG1-CG 4.37Å; V61-Q88 HydrophobicContact CG2-CB 4.38Å; V61-Q88 HydrophobicContact CG2-CG 4.17Å; Q62-Q88 PolarHBondContact O-NE2 3.13Å; Q62-Q88 VanDerWaalsContact O-NE2 3.11Å; V64-Q88 HydrophobicContact CG2-CG 4.15Å; T85-Q88 HydrophobicContact CG2-CG 4.24Å; T85-Q88 VanDerWaalsContact O-CB 3.27Å; T85-Q88 WeakPolarHBondContact O-CB 3.11Å; T85-Q88 VanDerWaalsContact O-CG 3.24Å; T85-Q88 WeakPolarHBondContact O-CG 3.41Å; T85-Q88 PolarHBondContact O-N 3.46Å; K86-Q88 PolarHBondContact O-N 3.37Å; K86-Q88 VanDerWaalsContact O-N 3.15Å; Q88-W90 PolarHBondContact O-N 3.05Å; Q88-S91 WeakPolarHBondContact O-CB 3.44Å; Q88-S91 PolarHBondContact O-N 3.09Å; Q88-S91 PolarHBondContact O-OG 2.8Å; Q88-Y146 VanDerWaalsContact OE1-CE2 3.3Å; Q88-Y146 PolarHBondContact OE1-OH 3.03Å
89	V	97.8	Very high	85.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-61.1	-31.6	178.7	-177.7	0	0	0	0	112.3	V7 L38 K86 I87 S91 L92 V98 F100 L139	V7-V89 HydrophobicContact CB-CG1 4.46Å; V7-V89 HydrophobicContact CG1-CG1 4.21Å; V7-V89 HydrophobicContact CG1-CG2 4.1Å; L38-V89 HydrophobicContact CD1-CG2 3.62Å; K86-V89 WeakPolarHBondContact O-CB 3.4Å; K86-V89 WeakPolarHBondContact O-CG2 3.43Å; K86-V89 PolarHBondContact O-N 3.41Å; I87-V89 PolarHBondContact O-N 3.46Å; V89-S91 PolarHBondContact O-N 2.74Å; V89-L92 HydrophobicContact CG1-CD1 4.45Å; V89-L92 WeakPolarHBondContact O-CB 3.08Å; V89-L92 WeakPolarHBondContact O-CG 3.29Å; V89-L92 PolarHBondContact O-N 3.48Å; V89-V98 HydrophobicContact CG1-CG1 3.79Å; V89-F100 HydrophobicContact CB-CD2 4.42Å; V89-F100 HydrophobicContact CG1-CD2 4.22Å; V89-F100 HydrophobicContact CG2-CD2 3.45Å; V89-F100 VanDerWaalsContact CG2-CD2 3.45Å; V89-F100 HydrophobicContact CG2-CE2 3.72Å; V89-F100 HydrophobicContact CG2-CG 4.46Å; V89-L139 HydrophobicContact CG1-CD1 4.09Å; V89-L139 HydrophobicContact CG1-CD2 3.56Å; V89-L139 HydrophobicContact CG1-CG 4.44Å
90	W	98.2	Very high	88.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-73.2	-14	175.7	-78.2	-87.2	0	0	0	114	I87 Q88 L92 E119 F120 F137 L139 T142 T145 Y146 L149 L167 F171	I87-W90 PolarHBondContact O-N 2.96Å; I87-W90 VanDerWaalsContact O-N 3.15Å; Q88-W90 PolarHBondContact O-N 3.05Å; W90-L92 VanDerWaalsContact C-N 3.26Å; W90-L92 PolarHBondContact O-N 2.59Å; W90-E119 PolarHBondContact NE1-OE1 2.96Å; W90-E119 VanDerWaalsContact NE1-OE1 3.1Å; W90-F120 HydrophobicContact CH2-CE2 4.07Å; W90-F120 AromaticContact CZ2-CD2 3.99Å; W90-F120 HydrophobicContact CZ2-CD2 3.99Å; W90-F120 AromaticContact CZ2-CE2 3.78Å; W90-F120 HydrophobicContact CZ2-CE2 3.78Å; W90-F137 AromaticContact CH2-CE2 3.56Å; W90-F137 HydrophobicContact CH2-CE2 3.56Å; W90-F137 AromaticContact CH2-CZ 3.93Å; W90-F137 HydrophobicContact CH2-CZ 3.93Å; W90-F137 AromaticContact CZ2-CE2 3.93Å; W90-F137 HydrophobicContact CZ2-CE2 3.93Å; W90-F137 HydrophobicContact CZ3-CE2 4.29Å; W90-F137 HydrophobicContact CZ3-CZ 4.36Å; W90-L139 HydrophobicContact CD2-CD1 4.2Å; W90-L139 HydrophobicContact CG-CD1 4.03Å; W90-L139 HydrophobicContact CZ2-CB 4.36Å; W90-T142 CarbonylContact O-C 3.45Å; W90-T142 PolarHBondContact O-N 2.89Å; W90-T145 HydrophobicContact CD2-CG2 4.2Å; W90-T145 HydrophobicContact CG-CG2 3.84Å; W90-T145 VanDerWaalsContact NE1-CG2 3.32Å; W90-Y146 HydrophobicContact CB-CD2 4.44Å; W90-L149 HydrophobicContact CD2-CD1 3.58Å; W90-L149 HydrophobicContact CE3-CD1 3.38Å; W90-L149 HydrophobicContact CG-CD1 4.24Å; W90-L149 HydrophobicContact CH2-CD1 4.06Å; W90-L149 HydrophobicContact CZ2-CD1 4.22Å; W90-L149 HydrophobicContact CZ3-CD1 3.65Å; W90-L167 HydrophobicContact CH2-CD1 4.18Å; W90-L167 HydrophobicContact CH2-CD2 3.39Å; W90-L167 HydrophobicContact CH2-CG 4.43Å; W90-L167 HydrophobicContact CZ2-CD2 4.34Å; W90-L167 HydrophobicContact CZ3-CD2 3.71Å; W90-F171 HydrophobicContact CH2-CE2 4.1Å; W90-F171 AromaticContact CZ2-CE2 3.57Å; W90-F171 HydrophobicContact CZ2-CE2 3.57Å; W90-F171 AromaticContact CZ2-CZ 3.64Å; W90-F171 HydrophobicContact CZ2-CZ 3.64Å
91	S	97.3	Very high	91.2	Very high	32 Å²	32	26.4 Å²	26.4	22%	0.224	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-79.6	-7.7	173.8	75.9	0	0	0	0	113.3	Q88 V89 I93	Q88-S91 WeakPolarHBondContact O-CB 3.44Å; Q88-S91 PolarHBondContact O-N 3.09Å; Q88-S91 PolarHBondContact O-OG 2.8Å; V89-S91 PolarHBondContact O-N 2.74Å; S91-I93 PolarHBondContact O-N 3.32Å
92	L	97.9	Very high	93.6	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.021	12%	0.123	C	C	.	.			trans	-78.8	51.2	-176.4	-57.3	-175.3	0	0	0	113.3	V7 T36 L38 I59 V89 W90 Q94 F95 P141	V7-L92 HydrophobicContact CG1-CD1 3.94Å; V7-L92 HydrophobicContact CG2-CD1 3.82Å; T36-L92 HydrophobicContact CG2-CD1 4.47Å; L38-L92 HydrophobicContact CD2-CD1 4.01Å; L38-L92 HydrophobicContact CD2-CD2 3.97Å; L38-L92 HydrophobicContact CD2-CG 4.43Å; I59-L92 HydrophobicContact CD1-CD2 3.61Å; I59-L92 HydrophobicContact CG2-CD2 4.45Å; V89-L92 HydrophobicContact CG1-CD1 4.45Å; V89-L92 WeakPolarHBondContact O-CB 3.08Å; V89-L92 WeakPolarHBondContact O-CG 3.29Å; V89-L92 PolarHBondContact O-N 3.48Å; W90-L92 VanDerWaalsContact C-N 3.26Å; W90-L92 PolarHBondContact O-N 2.59Å; L92-Q94 VanDerWaalsContact CA-OE1 3.26Å; L92-Q94 PolarHBondContact O-N 3.36Å; L92-Q94 PolarHBondContact O-OE1 3.26Å; L92-F95 HydrophobicContact CB-CD2 3.94Å; L92-F95 HydrophobicContact CB-CE2 4.44Å; L92-F95 HydrophobicContact CD1-CD2 4.47Å; L92-F95 HydrophobicContact CD1-CE2 4.45Å; L92-F95 PolarHBondContact O-N 3.39Å; L92-P141 HydrophobicContact CB-CB 4.46Å; L92-P141 HydrophobicContact CB-CG 4.43Å; L92-P141 WeakPolarHBondContact O-CB 3.27Å
93	I	97.2	Very high	95.6	Very high	105 Å²	105	21.4 Å²	21.4	54%	0.538	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-5.3	-174.2	62.4	172.1	0	0	0	114.7	S91 F95 M143	S91-I93 PolarHBondContact O-N 3.32Å; I93-F95 PolarHBondContact O-N 3.37Å; I93-M143 HydrophobicContact CD1-CG 4.47Å; I93-M143 HydrophobicContact CG2-CG 4.14Å; I93-M143 HydrophobicContact CG2-SD 4.49Å
94	Q	97.1	Very high	96.8	Very high	80 Å²	80	19.4 Å²	19.4	37%	0.374	10%	0.103	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-16.3	168.6	72.4	-84	15.8	0	0	113.4	I59 L92	I59-Q94 VanDerWaalsContact CD1-NE2 3.27Å; L92-Q94 VanDerWaalsContact CA-OE1 3.26Å; L92-Q94 PolarHBondContact O-N 3.36Å; L92-Q94 PolarHBondContact O-OE1 3.26Å
95	F	98.3	Very high	97.2	Very high	3 Å²	3	19.3 Å²	19.3	1%	0.013	10%	0.102	C	C	.	.			trans	-104	138.5	174.2	-57.6	-67.2	0	0	0	110.1	R3 T36 L92 I93 V98	R3-F95 HydrophobicContact CB-CD1 3.73Å; R3-F95 HydrophobicContact CB-CE1 4.25Å; R3-F95 CarbonylContact O-C 2.98Å; R3-F95 VanDerWaalsContact O-CA 3.27Å; R3-F95 WeakPolarHBondContact O-CA 3.16Å; T36-F95 HydrophobicContact CG2-CE2 4.19Å; T36-F95 HydrophobicContact CG2-CZ 4.46Å; T36-F95 VanDerWaalsContact OG1-CZ 3.25Å; T36-F95 WeakPolarHBondContact OG1-CZ 3.23Å; L92-F95 HydrophobicContact CB-CD2 3.94Å; L92-F95 HydrophobicContact CB-CE2 4.44Å; L92-F95 HydrophobicContact CD1-CD2 4.47Å; L92-F95 HydrophobicContact CD1-CE2 4.45Å; L92-F95 PolarHBondContact O-N 3.39Å; I93-F95 PolarHBondContact O-N 3.37Å; F95-V98 HydrophobicContact CB-CG2 3.79Å; F95-V98 HydrophobicContact CD2-CG2 4.07Å; F95-V98 HydrophobicContact CG-CG2 4.18Å
96	T	97.5	Very high	97.3	Very high	75 Å²	75	19.3 Å²	19.3	46%	0.46	10%	0.102	S	C	.	.	S	Bend	trans	-78	-28.1	173.3	49.2	0	0	0	0	112.1	G2 R3	G2-T96 WeakPolarHBondContact CA-OG1 3.42Å; R3-T96 PolarHBondContact O-N 3.23Å; R3-T96 PolarHBondContact O-OG1 3.44Å; R3-T96 VanDerWaalsContact O-OG1 3.14Å
97	K	98	Very high	97.3	Very high	26 Å²	26	18.6 Å²	18.6	11%	0.113	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	141.2	176.6	-166.2	169.3	-70.2	-176.9	0	111.1	E4 S5 F115 R117 V138 E140	E4-K97 WeakPolarHBondContact CA-O 3.44Å; E4-K97 HydrophobicContact CG-CB 4.26Å; S5-K97 PolarHBondContact N-O 3.5Å; K97-F115 HydrophobicContact CB-CD1 4.2Å; K97-F115 HydrophobicContact CD-CB 4.32Å; K97-F115 HydrophobicContact CD-CD1 4.36Å; K97-F115 WeakPolarHBondContact CD-O 3.46Å; K97-F115 WeakPolarHBondContact CE-O 2.98Å; K97-F115 HydrophobicContact CG-CD1 4.12Å; K97-F115 PolarHBondContact NZ-O 2.92Å; K97-R117 PolarHBondContact NZ-O 2.78Å; K97-V138 HydrophobicContact CD-CG1 3.89Å; K97-V138 HydrophobicContact CG-CG1 3.96Å; K97-E140 VanDerWaalsContact CE-OE1 3.3Å; K97-E140 WeakPolarHBondContact CE-OE1 3.22Å; K97-E140 HydrophobicContact CG-CG 4.48Å; K97-E140 IonicContact NZ-OE1 2.87Å
98	V	98.6	Very high	97	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.9	179.6	166.7	0	0	0	0	109.4	S5 V7 V89 F95 V138 L139 P141	S5-V98 WeakPolarHBondContact O-CA 3.19Å; V7-V98 HydrophobicContact CB-CG1 3.59Å; V7-V98 HydrophobicContact CG2-CB 4.26Å; V7-V98 HydrophobicContact CG2-CG1 3.33Å; V7-V98 HydrophobicContact CG2-CG2 3.92Å; V89-V98 HydrophobicContact CG1-CG1 3.79Å; F95-V98 HydrophobicContact CB-CG2 3.79Å; F95-V98 HydrophobicContact CD2-CG2 4.07Å; F95-V98 HydrophobicContact CG-CG2 4.18Å; V98-V138 WeakPolarHBondContact O-CA 3.29Å; V98-L139 HydrophobicContact CB-CD1 4.33Å; V98-L139 HydrophobicContact CB-CD2 4.14Å; V98-L139 HydrophobicContact CB-CG 4Å; V98-L139 HydrophobicContact CG1-CD2 3.89Å; V98-L139 HydrophobicContact CG1-CG 4.31Å; V98-L139 PolarHBondContact N-O 3.34Å; V98-L139 PolarHBondContact O-N 3.26Å; V98-P141 HydrophobicContact CB-CG 4.25Å; V98-P141 HydrophobicContact CG2-CG 3.67Å
99	V	98.7	Very high	96.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	108.9	161.8	179.7	0	0	0	0	107.1	S5 F6 V7 M101 L114 F115 V136 F137 V138	S5-V99 PolarHBondContact O-N 3.38Å; S5-V99 VanDerWaalsContact O-N 3.12Å; F6-V99 CarbonylContact C-O 3.11Å; F6-V99 WeakPolarHBondContact CA-O 3.42Å; F6-V99 HydrophobicContact CD1-CB 3.66Å; F6-V99 HydrophobicContact CD1-CG1 3.83Å; F6-V99 HydrophobicContact CD1-CG2 4.5Å; F6-V99 HydrophobicContact CE1-CB 3.8Å; F6-V99 HydrophobicContact CE1-CG1 3.78Å; F6-V99 HydrophobicContact CE1-CG2 4.24Å; V7-V99 PolarHBondContact N-O 3.04Å; V99-M101 HydrophobicContact CG1-CG 4.15Å; V99-L114 HydrophobicContact CG1-CD1 3.93Å; V99-L114 HydrophobicContact CG2-CB 3.79Å; V99-F115 HydrophobicContact CB-CE1 4.35Å; V99-F115 HydrophobicContact CB-CE2 4.34Å; V99-F115 HydrophobicContact CB-CZ 3.96Å; V99-F115 HydrophobicContact CG2-CD1 4.04Å; V99-F115 HydrophobicContact CG2-CD2 4.02Å; V99-F115 HydrophobicContact CG2-CE1 3.74Å; V99-F115 HydrophobicContact CG2-CE2 3.7Å; V99-F115 HydrophobicContact CG2-CG 4.18Å; V99-F115 HydrophobicContact CG2-CZ 3.57Å; V99-V136 HydrophobicContact CG1-CG1 4.37Å; V99-F137 CarbonylContact C-O 3.36Å; V99-F137 WeakPolarHBondContact CA-O 3.33Å; V99-V138 HydrophobicContact CG2-CG1 4.45Å; V99-V138 HydrophobicContact CG2-CG2 4.19Å
100	F	98.7	Very high	96.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	138.6	174.3	-177.8	-89.5	0	0	0	110.1	V7 L9 K86 V89 D102 V136 F137 L139	V7-F100 HydrophobicContact CB-CD2 4.43Å; V7-F100 HydrophobicContact CG1-CD2 4.18Å; V7-F100 CarbonylContact O-C 3.58Å; V7-F100 VanDerWaalsContact O-CA 3.31Å; V7-F100 WeakPolarHBondContact O-CA 3.36Å; V7-F100 WeakPolarHBondContact O-CD2 3.34Å; L9-F100 HydrophobicContact CB-CE2 4.14Å; L9-F100 HydrophobicContact CB-CZ 4.24Å; K86-F100 HydrophobicContact CD-CD1 4.13Å; K86-F100 HydrophobicContact CD-CE1 3.59Å; K86-F100 HydrophobicContact CD-CZ 3.84Å; K86-F100 HydrophobicContact CG-CD1 4.47Å; K86-F100 HydrophobicContact CG-CE1 3.98Å; K86-F100 HydrophobicContact CG-CE2 4.04Å; K86-F100 HydrophobicContact CG-CZ 3.74Å; V89-F100 HydrophobicContact CB-CD2 4.42Å; V89-F100 HydrophobicContact CG1-CD2 4.22Å; V89-F100 HydrophobicContact CG2-CD2 3.45Å; V89-F100 VanDerWaalsContact CG2-CD2 3.45Å; V89-F100 HydrophobicContact CG2-CE2 3.72Å; V89-F100 HydrophobicContact CG2-CG 4.46Å; F100-D102 VanDerWaalsContact CE1-OD1 3.23Å; F100-D102 WeakPolarHBondContact CE1-OD1 3.46Å; F100-V136 VanDerWaalsContact O-CA 3.32Å; F100-V136 WeakPolarHBondContact O-CA 3.36Å; F100-F137 HydrophobicContact CB-CD1 4.15Å; F100-F137 HydrophobicContact CB-CD2 4.17Å; F100-F137 HydrophobicContact CB-CE1 3.75Å; F100-F137 HydrophobicContact CB-CE2 3.81Å; F100-F137 HydrophobicContact CB-CG 4.35Å; F100-F137 HydrophobicContact CB-CZ 3.56Å; F100-F137 AromaticContact CD1-CD1 3.96Å; F100-F137 HydrophobicContact CD1-CD1 3.96Å; F100-F137 AromaticContact CD1-CE1 3.24Å; F100-F137 HydrophobicContact CD1-CE1 3.24Å; F100-F137 AromaticContact CD1-CZ 3.7Å; F100-F137 HydrophobicContact CD1-CZ 3.7Å; F100-F137 HydrophobicContact CE1-CE1 4.1Å; F100-F137 HydrophobicContact CG-CD1 4.45Å; F100-F137 AromaticContact CG-CE1 3.7Å; F100-F137 HydrophobicContact CG-CE1 3.7Å; F100-F137 HydrophobicContact CG-CE2 4.4Å; F100-F137 AromaticContact CG-CZ 3.67Å; F100-F137 HydrophobicContact CG-CZ 3.67Å; F100-F137 PolarHBondContact N-O 3.33Å; F100-F137 PolarHBondContact O-N 3.01Å; F100-F137 VanDerWaalsContact O-N 3.13Å; F100-L139 HydrophobicContact CB-CD2 4.18Å
101	M	98.7	Very high	96.4	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	125.8	176.6	-54.8	-171.2	73.2	0	0	110.2	F6 V7 T8 L22 L26 V99 V107 G135 V136 V217	F6-M101 HydrophobicContact CD1-CG 4.29Å; F6-M101 HydrophobicContact CD1-SD 3.62Å; F6-M101 HydrophobicContact CE1-SD 3.98Å; V7-M101 PolarHBondContact O-N 2.99Å; T8-M101 WeakPolarHBondContact CA-O 3.44Å; T8-M101 WeakPolarHBondContact CB-O 3.35Å; T8-M101 PolarHBondContact OG1-O 3.02Å; L22-M101 HydrophobicContact CD1-CE 4.26Å; L22-M101 HydrophobicContact CD1-SD 4.32Å; L22-M101 HydrophobicContact CD2-CB 4Å; L26-M101 HydrophobicContact CD1-SD 4.4Å; L26-M101 HydrophobicContact CD2-SD 4.33Å; V99-M101 HydrophobicContact CG1-CG 4.15Å; M101-V107 HydrophobicContact CE-CG2 3.56Å; M101-V107 HydrophobicContact SD-CG2 4.22Å; M101-G135 CarbonylContact C-O 3.57Å; M101-G135 WeakPolarHBondContact CA-O 3.28Å; M101-V136 HydrophobicContact CE-CG2 4.21Å; M101-V136 HydrophobicContact CG-CG1 4.41Å; M101-V217 HydrophobicContact CE-CB 4.37Å; M101-V217 HydrophobicContact CE-CG1 3.5Å; M101-V217 HydrophobicContact CE-CG2 3.93Å
102	D	97.7	Very high	96.5	Very high	36 Å²	36	22.3 Å²	22.3	19%	0.193	12%	0.116	C	C	.	.			trans	-60.6	145.6	173.3	-84.7	-24.3	0	0	0	110.6	K86 F100 D104 T105 G135	K86-D102 WeakPolarHBondContact CE-OD1 3.49Å; K86-D102 VanDerWaalsContact NZ-CG 3.26Å; K86-D102 IonicContact NZ-OD1 2.98Å; K86-D102 PolarHBondContact NZ-OD1 3.37Å; K86-D102 IonicContact NZ-OD2 3.11Å; K86-D102 PolarHBondContact NZ-OD2 3.24Å; F100-D102 VanDerWaalsContact CE1-OD1 3.23Å; F100-D102 WeakPolarHBondContact CE1-OD1 3.46Å; D102-D104 WeakPolarHBondContact CB-OD1 3.32Å; D102-D104 PolarHBondContact O-N 2.97Å; D102-T105 HydrophobicContact CB-CG2 4.19Å; D102-T105 WeakPolarHBondContact O-CB 3.35Å; D102-T105 WeakPolarHBondContact O-CG2 3.35Å; D102-T105 PolarHBondContact O-N 3.19Å; D102-T105 PolarHBondContact O-OG1 2.61Å; D102-G135 PolarHBondContact N-O 3Å; D102-G135 WeakPolarHBondContact OD2-CA 3.01Å
103	A	97.1	Very high	96.4	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.7	-175.3	0	0	0	0	0	114	T8 Y15 G18 A19	T8-A103 PolarHBondContact OG1-N 3.3Å; Y15-A103 HydrophobicContact CD1-CB 4.11Å; G18-A103 CarbonylContact C-O 3.28Å; G18-A103 WeakPolarHBondContact CA-O 3.31Å; A19-A103 HydrophobicContact CB-CB 4.07Å
104	D	94.9	Very high	96.4	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.021	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99	18.7	171.1	63	-3.2	0	0	0	112.9	D102 H219 F220 K225 W227	D102-D104 WeakPolarHBondContact CB-OD1 3.32Å; D102-D104 PolarHBondContact O-N 2.97Å; D104-H219 IonicContact OD1-CD2 2.59Å; D104-H219 PolarHBondContact OD1-CD2 3.02Å; D104-H219 IonicContact OD1-NE2 3.47Å; D104-H219 PolarHBondContact OD1-NE2 3.26Å; D104-H219 IonicContact OD2-NE2 3.48Å; D104-F220 HydrophobicContact CB-CB 4.49Å; D104-F220 WeakPolarHBondContact O-CB 3.37Å; D104-F220 VanDerWaalsContact O-CD2 3.31Å; D104-F220 WeakPolarHBondContact O-CD2 3.09Å; D104-F220 PolarHBondContact O-N 3.07Å; D104-K225 HydrophobicContact CB-CD 4.01Å; D104-K225 WeakPolarHBondContact OD2-CE 3.1Å; D104-K225 IonicContact OD2-NZ 2.65Å; D104-K225 PolarHBondContact OD2-NZ 3.48Å; D104-W227 HydrophobicContact CB-CH2 3.95Å; D104-W227 HydrophobicContact CB-CZ3 4.24Å
105	T	97.3	Very high	96.5	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	156.4	169.5	63.4	0	0	0	0	111.6	L22 D102 V136 V217 V218 H219	L22-T105 WeakPolarHBondContact CD1-OG1 3.26Å; D102-T105 HydrophobicContact CB-CG2 4.19Å; D102-T105 WeakPolarHBondContact O-CB 3.35Å; D102-T105 WeakPolarHBondContact O-CG2 3.35Å; D102-T105 PolarHBondContact O-N 3.19Å; D102-T105 PolarHBondContact O-OG1 2.61Å; T105-V136 HydrophobicContact CG2-CG2 3.93Å; T105-V217 HydrophobicContact CG2-CG1 4.47Å; T105-V218 CarbonylContact C-O 3.56Å; T105-V218 WeakPolarHBondContact CA-O 3.43Å; T105-H219 HydrophobicContact CG2-CB 4.05Å
106	L	94.4	Very high	96.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	120.8	-179.6	173.8	71	0	0	0	109.8	V21 L108 V217 V218 F220 Y263 W264 L267	V21-L106 HydrophobicContact CG1-CD1 4.44Å; L106-L108 HydrophobicContact CD2-CD2 4.04Å; L106-L108 HydrophobicContact CG-CD2 4.06Å; L106-V217 WeakPolarHBondContact O-CA 3.06Å; L106-V218 HydrophobicContact CB-CB 4.22Å; L106-V218 PolarHBondContact N-O 3.48Å; L106-V218 PolarHBondContact O-N 3.27Å; L106-F220 HydrophobicContact CB-CE2 3.88Å; L106-F220 HydrophobicContact CD2-CE2 4.04Å; L106-F220 HydrophobicContact CD2-CZ 4.21Å; L106-Y263 HydrophobicContact CD1-CD1 4.23Å; L106-Y263 HydrophobicContact CD1-CE1 4.28Å; L106-Y263 HydrophobicContact CD2-CD1 3.89Å; L106-Y263 HydrophobicContact CG-CD1 4.32Å; L106-W264 HydrophobicContact CD2-CB 4.13Å; L106-L267 HydrophobicContact CD1-CD1 3.53Å
107	V	95.2	Very high	96.3	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.006	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.5	-179.4	-178.9	0	0	0	0	110.5	L22 S25 L26 M101 Q109 V111 V217	L22-V107 HydrophobicContact CD1-CG2 4.05Å; S25-V107 WeakPolarHBondContact CB-O 3.48Å; S25-V107 PolarHBondContact OG-N 2.91Å; S25-V107 VanDerWaalsContact OG-N 3.09Å; L26-V107 HydrophobicContact CD2-CB 4.37Å; L26-V107 HydrophobicContact CD2-CG1 4.34Å; L26-V107 HydrophobicContact CD2-CG2 3.75Å; L26-V107 HydrophobicContact CG-CB 4.47Å; L26-V107 HydrophobicContact CG-CG2 3.91Å; M101-V107 HydrophobicContact CE-CG2 3.56Å; M101-V107 HydrophobicContact SD-CG2 4.22Å; V107-Q109 WeakPolarHBondContact CG1-O 3.45Å; V107-V111 HydrophobicContact CG1-CG2 4.23Å; V107-V217 HydrophobicContact CG2-CG2 4.39Å
108	L	89.6	Confident	96.1	Very high	23 Å²	23	25.8 Å²	25.8	12%	0.12	13%	0.125	C	C	.	.			trans	-101.1	-24.7	-178.9	-53.9	-175.2	0	0	0	112.8	L106 I215 R216 V218 M260 Y263	L106-L108 HydrophobicContact CD2-CD2 4.04Å; L106-L108 HydrophobicContact CG-CD2 4.06Å; L108-I215 HydrophobicContact CD1-CB 4.25Å; L108-I215 HydrophobicContact CD1-CG2 3.88Å; L108-R216 PolarHBondContact N-O 3.38Å; L108-V218 HydrophobicContact CD1-CG2 3.89Å; L108-V218 HydrophobicContact CD2-CG2 4.5Å; L108-V218 HydrophobicContact CG-CG2 4.28Å; L108-M260 HydrophobicContact CD1-CE 3.39Å; L108-M260 HydrophobicContact CD1-SD 3.42Å; L108-M260 WeakPolarHBondContact CD1-SD 3.45Å; L108-M260 HydrophobicContact CD2-SD 3.73Å; L108-M260 HydrophobicContact CG-SD 4.21Å; L108-Y263 HydrophobicContact CD2-CD1 3.77Å; L108-Y263 HydrophobicContact CD2-CE1 3.94Å
109	Q	88.7	Confident	95.8	Very high	37 Å²	37	27.9 Å²	27.9	17%	0.173	14%	0.135	C	C	.	.	S	Bend	trans	-145.1	158.7	-175.6	-70.4	173.7	78.7	0	0	109.6	V107 V111 I215 R216 R252	V107-Q109 WeakPolarHBondContact CG1-O 3.45Å; Q109-V111 PolarHBondContact O-N 2.99Å; Q109-I215 PolarHBondContact NE2-O 2.59Å; Q109-R216 HydrophobicContact CB-CG 4.44Å; Q109-R252 VanDerWaalsContact CD-NH2 3.34Å
110	N	94.8	Very high	95.7	Very high	54 Å²	54	28.3 Å²	28.3	29%	0.289	14%	0.137	S	C	.	.			trans	-59.5	133.4	173.6	-164.8	-54.6	0	0	0	109	S29 E30 D112 R216	S29-N110 VanDerWaalsContact O-CB 3.3Å; S29-N110 WeakPolarHBondContact O-CB 3.13Å; S29-N110 PolarHBondContact O-ND2 3.46Å; E30-N110 PolarHBondContact O-ND2 3.39Å; E30-N110 VanDerWaalsContact O-ND2 3.14Å; N110-D112 WeakPolarHBondContact OD1-CB 3.06Å; N110-D112 PolarHBondContact OD1-N 3.13Å; N110-D112 PolarHBondContact OD1-OD1 3.34Å; N110-R216 PolarHBondContact O-NH1 3.33Å
111	V	97.3	Very high	95.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.137	C	C	.	.			trans	-129.1	24.7	-178.7	-69.6	0	0	0	0	110.9	F6 V107 Q109 E113 L114 Y187 R216 V217	F6-V111 HydrophobicContact CE1-CG2 4.01Å; F6-V111 HydrophobicContact CZ-CG2 3.88Å; V107-V111 HydrophobicContact CG1-CG2 4.23Å; Q109-V111 PolarHBondContact O-N 2.99Å; V111-E113 WeakPolarHBondContact CA-OE2 3.42Å; V111-E113 PolarHBondContact O-N 3.37Å; V111-E113 VanDerWaalsContact O-N 3.16Å; V111-L114 HydrophobicContact CB-CD1 3.84Å; V111-L114 HydrophobicContact CB-CG 4.1Å; V111-L114 HydrophobicContact CG2-CD1 4.08Å; V111-L114 VanDerWaalsContact O-CB 3.25Å; V111-L114 WeakPolarHBondContact O-CB 3.47Å; V111-L114 VanDerWaalsContact O-CG 3.25Å; V111-L114 WeakPolarHBondContact O-CG 3.29Å; V111-L114 PolarHBondContact O-N 3.4Å; V111-Y187 HydrophobicContact CG1-CD1 3.94Å; V111-Y187 HydrophobicContact CG1-CE1 4.03Å; V111-R216 HydrophobicContact CG1-CB 3.69Å; V111-R216 HydrophobicContact CG1-CG 4.45Å; V111-V217 HydrophobicContact CG1-CG2 4.1Å; V111-V217 HydrophobicContact CG2-CG2 4.42Å
112	D	98.2	Very high	95.5	Very high	19 Å²	19	28.3 Å²	28.3	10%	0.102	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-60.6	-22	177.7	-74	5	0	0	0	111.9	T31 S32 K33 N110 L114 F115	T31-D112 WeakPolarHBondContact CB-OD1 3.37Å; T31-D112 PolarHBondContact OG1-OD1 3.24Å; S32-D112 WeakPolarHBondContact CB-OD2 3.41Å; S32-D112 PolarHBondContact N-OD2 3.19Å; S32-D112 PolarHBondContact OG-OD2 2.86Å; K33-D112 HydrophobicContact CG-CB 4.34Å; N110-D112 WeakPolarHBondContact OD1-CB 3.06Å; N110-D112 PolarHBondContact OD1-N 3.13Å; N110-D112 PolarHBondContact OD1-OD1 3.34Å; D112-L114 PolarHBondContact O-N 3.03Å; D112-F115 WeakPolarHBondContact O-CD2 3.24Å; D112-F115 PolarHBondContact O-N 3.38Å
113	E	96.9	Very high	95.4	Very high	54 Å²	54	26.6 Å²	26.6	25%	0.252	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-66.1	-13.7	173.7	76.2	-78.2	-175.8	0	0	113.6	V111 F115 N116 Y187 R216	V111-E113 WeakPolarHBondContact CA-OE2 3.42Å; V111-E113 PolarHBondContact O-N 3.37Å; V111-E113 VanDerWaalsContact O-N 3.16Å; E113-F115 PolarHBondContact O-N 2.88Å; E113-N116 WeakPolarHBondContact O-CB 3.27Å; E113-N116 PolarHBondContact O-N 3.15Å; E113-Y187 VanDerWaalsContact OE1-CE1 3.31Å; E113-Y187 WeakPolarHBondContact OE1-CE1 3.17Å; E113-Y187 PolarHBondContact OE1-OH 2.99Å; E113-Y187 VanDerWaalsContact OE1-OH 3.12Å; E113-R216 IonicContact OE1-CZ 3.9Å; E113-R216 VanDerWaalsContact OE1-CZ 3.25Å; E113-R216 IonicContact OE1-NE 3.58Å; E113-R216 IonicContact OE1-NH1 2.72Å; E113-R216 PolarHBondContact OE1-NH1 3.43Å; E113-R216 IonicContact OE1-NH2 3.01Å; E113-R216 IonicContact OE2-NH1 3.38Å
114	L	97.8	Very high	95.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-60.3	-28.5	172.7	-69.6	179.1	0	0	0	112.1	V99 V111 D112 N116 R117 V138 L183 Y187	V99-L114 HydrophobicContact CG1-CD1 3.93Å; V99-L114 HydrophobicContact CG2-CB 3.79Å; V111-L114 HydrophobicContact CB-CD1 3.84Å; V111-L114 HydrophobicContact CB-CG 4.1Å; V111-L114 HydrophobicContact CG2-CD1 4.08Å; V111-L114 VanDerWaalsContact O-CB 3.25Å; V111-L114 WeakPolarHBondContact O-CB 3.47Å; V111-L114 VanDerWaalsContact O-CG 3.25Å; V111-L114 WeakPolarHBondContact O-CG 3.29Å; V111-L114 PolarHBondContact O-N 3.4Å; D112-L114 PolarHBondContact O-N 3.03Å; L114-N116 PolarHBondContact O-N 3.08Å; L114-R117 VanDerWaalsContact O-CB 3.3Å; L114-R117 WeakPolarHBondContact O-CB 3.22Å; L114-R117 WeakPolarHBondContact O-CG 3.31Å; L114-R117 PolarHBondContact O-N 2.71Å; L114-V138 HydrophobicContact CB-CG2 4.33Å; L114-L183 HydrophobicContact CD2-CD1 3.44Å; L114-L183 VanDerWaalsContact CD2-CD1 3.44Å; L114-L183 HydrophobicContact CD2-CD2 3.99Å; L114-L183 HydrophobicContact CD2-CG 4.35Å; L114-Y187 HydrophobicContact CD1-CD1 4.21Å; L114-Y187 HydrophobicContact CD2-CD1 3.67Å; L114-Y187 HydrophobicContact CD2-CE1 3.88Å; L114-Y187 HydrophobicContact CD2-CG 4.2Å; L114-Y187 HydrophobicContact CG-CD1 4.15Å; L114-Y187 HydrophobicContact CG-CE1 4.32Å
115	F	97.6	Very high	95	Very high	1 Å²	1	30.5 Å²	30.5	0%	0.004	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-69.7	-11.8	175.4	-66.6	-87.4	0	0	0	113.2	E4 F6 K33 K97 V99 D112 E113 R117	E4-F115 HydrophobicContact CB-CD1 3.67Å; E4-F115 HydrophobicContact CB-CE1 3.8Å; E4-F115 HydrophobicContact CB-CG 4.4Å; E4-F115 HydrophobicContact CG-CD1 4.07Å; F6-F115 HydrophobicContact CD1-CE2 4.28Å; F6-F115 HydrophobicContact CD1-CZ 4.25Å; F6-F115 HydrophobicContact CD2-CE2 4.02Å; F6-F115 HydrophobicContact CD2-CZ 4.11Å; F6-F115 AromaticContact CE1-CE2 3.86Å; F6-F115 HydrophobicContact CE1-CE2 3.86Å; F6-F115 HydrophobicContact CE1-CZ 4.27Å; F6-F115 AromaticContact CE2-CE2 3.57Å; F6-F115 HydrophobicContact CE2-CE2 3.57Å; F6-F115 HydrophobicContact CE2-CZ 4.13Å; F6-F115 HydrophobicContact CG-CE2 4.35Å; F6-F115 HydrophobicContact CG-CZ 4.17Å; F6-F115 HydrophobicContact CZ-CD2 4.43Å; F6-F115 AromaticContact CZ-CE2 3.49Å; F6-F115 HydrophobicContact CZ-CE2 3.49Å; F6-F115 VanDerWaalsContact CZ-CE2 3.49Å; F6-F115 HydrophobicContact CZ-CZ 4.23Å; K33-F115 HydrophobicContact CB-CE2 3.99Å; K33-F115 HydrophobicContact CB-CZ 4.16Å; K33-F115 HydrophobicContact CD-CD2 3.96Å; K33-F115 HydrophobicContact CD-CE2 4.06Å; K33-F115 HydrophobicContact CD-CG 4.36Å; K33-F115 HydrophobicContact CG-CD2 3.82Å; K33-F115 HydrophobicContact CG-CE2 3.51Å; K33-F115 HydrophobicContact CG-CZ 4.11Å; K97-F115 HydrophobicContact CB-CD1 4.2Å; K97-F115 HydrophobicContact CD-CB 4.32Å; K97-F115 HydrophobicContact CD-CD1 4.36Å; K97-F115 WeakPolarHBondContact CD-O 3.46Å; K97-F115 WeakPolarHBondContact CE-O 2.98Å; K97-F115 HydrophobicContact CG-CD1 4.12Å; K97-F115 PolarHBondContact NZ-O 2.92Å; V99-F115 HydrophobicContact CB-CE1 4.35Å; V99-F115 HydrophobicContact CB-CE2 4.34Å; V99-F115 HydrophobicContact CB-CZ 3.96Å; V99-F115 HydrophobicContact CG2-CD1 4.04Å; V99-F115 HydrophobicContact CG2-CD2 4.02Å; V99-F115 HydrophobicContact CG2-CE1 3.74Å; V99-F115 HydrophobicContact CG2-CE2 3.7Å; V99-F115 HydrophobicContact CG2-CG 4.18Å; V99-F115 HydrophobicContact CG2-CZ 3.57Å; D112-F115 WeakPolarHBondContact O-CD2 3.24Å; D112-F115 PolarHBondContact O-N 3.38Å; E113-F115 PolarHBondContact O-N 2.88Å; F115-R117 VanDerWaalsContact C-N 3.31Å
116	N	95.7	Very high	94.3	Very high	128 Å²	128	34.1 Å²	34.1	68%	0.684	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-85.1	-5	172.1	-57.5	-35.2	0	0	0	112.7	E113 L114	E113-N116 WeakPolarHBondContact O-CB 3.27Å; E113-N116 PolarHBondContact O-N 3.15Å; L114-N116 PolarHBondContact O-N 3.08Å
117	R	95.6	Very high	93.6	Very high	59 Å²	59	39.2 Å²	39.2	22%	0.223	20%	0.202	C	C	.	.	S	Bend	trans	-80.7	160	177.7	-58.9	-60	-166.3	102.2	-1.6	111.9	K97 L114 F115 T121 V138 R182	K97-R117 PolarHBondContact NZ-O 2.78Å; L114-R117 VanDerWaalsContact O-CB 3.3Å; L114-R117 WeakPolarHBondContact O-CB 3.22Å; L114-R117 WeakPolarHBondContact O-CG 3.31Å; L114-R117 PolarHBondContact O-N 2.71Å; F115-R117 VanDerWaalsContact C-N 3.31Å; R117-T121 HydrophobicContact CB-CG2 4.14Å; R117-T121 HydrophobicContact CG-CG2 4.25Å; R117-V138 HydrophobicContact CB-CB 4.5Å; R117-V138 HydrophobicContact CB-CG1 4.44Å; R117-V138 HydrophobicContact CB-CG2 4.16Å; R117-R182 PolarHBondContact NH1-O 3.43Å
118	F	94.2	Very high	92.9	Very high	123 Å²	123	50.2 Å²	50.2	54%	0.539	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-78.4	162.5	174.8	-63	-71.3	0	0	0	111.5	T121	F118-T121 WeakPolarHBondContact O-CB 3.1Å; F118-T121 PolarHBondContact O-N 3.3Å; F118-T121 PolarHBondContact O-OG1 2.95Å
119	E	93.2	Very high	92.7	Very high	45 Å²	45	51.4 Å²	51.4	21%	0.21	25%	0.252	C	S	.	.	S	Bend	trans	-85.1	141.8	162.1	174	174.6	-156.6	0	0	109.7	W90 L139 E140 H181	W90-E119 PolarHBondContact NE1-OE1 2.96Å; W90-E119 VanDerWaalsContact NE1-OE1 3.1Å; E119-L139 HydrophobicContact CG-CB 4.4Å; E119-E140 HydrophobicContact CB-CB 4.41Å; E119-E140 HydrophobicContact CB-CG 4.07Å; E119-E140 WeakPolarHBondContact OE2-CA 3.43Å; E119-E140 WeakPolarHBondContact OE2-CB 3.34Å; E119-E140 PolarHBondContact OE2-N 2.84Å; E119-H181 PolarHBondContact O-CE1 2.92Å; E119-H181 PolarHBondContact O-ND1 3.27Å
120	F	95.3	Very high	92.7	Very high	9 Å²	9	55.4 Å²	55.4	4%	0.039	28%	0.275	C	S	.	.	S	Bend	cis	-96.3	115.9	-11.5	177.8	-89.7	0	0	0	108.1	W90 A122 F132 F137 F171	W90-F120 HydrophobicContact CH2-CE2 4.07Å; W90-F120 AromaticContact CZ2-CD2 3.99Å; W90-F120 HydrophobicContact CZ2-CD2 3.99Å; W90-F120 AromaticContact CZ2-CE2 3.78Å; W90-F120 HydrophobicContact CZ2-CE2 3.78Å; F120-A122 HydrophobicContact CD1-CB 4.29Å; F120-A122 HydrophobicContact CE1-CB 3.63Å; F120-A122 HydrophobicContact CZ-CB 4.31Å; F120-F132 HydrophobicContact CD1-CE1 4.34Å; F120-F132 HydrophobicContact CD1-CZ 4.27Å; F120-F132 HydrophobicContact CE1-CD1 4.14Å; F120-F132 AromaticContact CE1-CD2 3.78Å; F120-F132 HydrophobicContact CE1-CD2 3.78Å; F120-F132 AromaticContact CE1-CE1 3.79Å; F120-F132 HydrophobicContact CE1-CE1 3.79Å; F120-F132 AromaticContact CE1-CE2 3.42Å; F120-F132 HydrophobicContact CE1-CE2 3.42Å; F120-F132 VanDerWaalsContact CE1-CE2 3.42Å; F120-F132 HydrophobicContact CE1-CG 4.12Å; F120-F132 AromaticContact CE1-CZ 3.4Å; F120-F132 HydrophobicContact CE1-CZ 3.4Å; F120-F132 HydrophobicContact CZ-CD2 4.18Å; F120-F132 AromaticContact CZ-CE2 3.56Å; F120-F132 HydrophobicContact CZ-CE2 3.56Å; F120-F132 AromaticContact CZ-CZ 3.77Å; F120-F132 HydrophobicContact CZ-CZ 3.77Å; F120-F137 HydrophobicContact CD2-CD2 4.01Å; F120-F137 HydrophobicContact CE1-CB 4.22Å; F120-F137 HydrophobicContact CE2-CB 3.97Å; F120-F137 AromaticContact CE2-CD2 3.16Å; F120-F137 HydrophobicContact CE2-CD2 3.16Å; F120-F137 AromaticContact CE2-CE2 3.65Å; F120-F137 HydrophobicContact CE2-CE2 3.65Å; F120-F137 AromaticContact CE2-CG 3.66Å; F120-F137 HydrophobicContact CE2-CG 3.66Å; F120-F137 HydrophobicContact CZ-CB 3.66Å; F120-F137 HydrophobicContact CZ-CD1 4.27Å; F120-F137 AromaticContact CZ-CD2 3.67Å; F120-F137 HydrophobicContact CZ-CD2 3.67Å; F120-F137 HydrophobicContact CZ-CE2 4.3Å; F120-F137 AromaticContact CZ-CG 3.62Å; F120-F137 HydrophobicContact CZ-CG 3.62Å; F120-F171 HydrophobicContact CB-CD1 3.77Å; F120-F171 HydrophobicContact CB-CE1 3.86Å; F120-F171 HydrophobicContact CB-CG 4.16Å; F120-F171 HydrophobicContact CB-CZ 4.34Å; F120-F171 HydrophobicContact CD1-CB 4.46Å; F120-F171 HydrophobicContact CD1-CD2 4.31Å; F120-F171 HydrophobicContact CD1-CG 4.25Å; F120-F171 HydrophobicContact CD2-CD1 4.45Å; F120-F171 AromaticContact CD2-CD2 3.95Å; F120-F171 HydrophobicContact CD2-CD2 3.95Å; F120-F171 HydrophobicContact CD2-CE1 4.18Å; F120-F171 AromaticContact CD2-CE2 3.66Å; F120-F171 HydrophobicContact CD2-CE2 3.66Å; F120-F171 HydrophobicContact CD2-CG 4.34Å; F120-F171 AromaticContact CD2-CZ 3.78Å; F120-F171 HydrophobicContact CD2-CZ 3.78Å; F120-F171 HydrophobicContact CE1-CD2 4.47Å; F120-F171 HydrophobicContact CE2-CD2 4.1Å; F120-F171 AromaticContact CE2-CE2 3.85Å; F120-F171 HydrophobicContact CE2-CE2 3.85Å; F120-F171 HydrophobicContact CE2-CZ 4.38Å; F120-F171 HydrophobicContact CG-CD1 4.1Å; F120-F171 HydrophobicContact CG-CD2 4.05Å; F120-F171 HydrophobicContact CG-CE1 4.21Å; F120-F171 HydrophobicContact CG-CE2 4.18Å; F120-F171 HydrophobicContact CG-CG 4.02Å; F120-F171 HydrophobicContact CG-CZ 4.25Å; F120-F171 HydrophobicContact CZ-CD2 4.37Å
121	T	97.2	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	124.9	178.9	-68.9	0	0	0	0	110.6	R117 F118 F137 V138 S180 H181 L183	R117-T121 HydrophobicContact CB-CG2 4.14Å; R117-T121 HydrophobicContact CG-CG2 4.25Å; F118-T121 WeakPolarHBondContact O-CB 3.1Å; F118-T121 PolarHBondContact O-N 3.3Å; F118-T121 PolarHBondContact O-OG1 2.95Å; T121-F137 CarbonylContact O-C 3.33Å; T121-F137 WeakPolarHBondContact O-CA 3.22Å; T121-F137 WeakPolarHBondContact O-CB 3.36Å; T121-V138 HydrophobicContact CG2-CG2 4.48Å; T121-V138 PolarHBondContact N-O 3.23Å; T121-V138 PolarHBondContact O-N 2.72Å; T121-S180 PolarHBondContact OG1-O 3.47Å; T121-H181 VanDerWaalsContact CA-O 3.32Å; T121-H181 WeakPolarHBondContact CA-O 3.44Å; T121-L183 HydrophobicContact CG2-CB 3.9Å; T121-L183 HydrophobicContact CG2-CD1 4.19Å
122	A	97.7	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	166.6	179	0	0	0	0	0	110.7	F120 F132 F137 W174 H181 L183	F120-A122 HydrophobicContact CD1-CB 4.29Å; F120-A122 HydrophobicContact CE1-CB 3.63Å; F120-A122 HydrophobicContact CZ-CB 4.31Å; A122-F132 HydrophobicContact CB-CB 3.84Å; A122-F132 HydrophobicContact CB-CD2 4.02Å; A122-F132 HydrophobicContact CB-CG 4.03Å; A122-F137 HydrophobicContact CB-CB 3.85Å; A122-W174 WeakPolarHBondContact O-CZ2 3.49Å; A122-H181 PolarHBondContact N-O 3.22Å; A122-L183 VanDerWaalsContact C-CB 3.44Å; A122-L183 WeakPolarHBondContact O-CB 3.35Å; A122-L183 PolarHBondContact O-N 2.87Å
123	A	95.4	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	147.3	174.8	0	0	0	0	0	111.2	F132 N133 L183 N188	A123-F132 WeakPolarHBondContact O-CA 3.34Å; A123-F132 WeakPolarHBondContact O-CB 3.45Å; A123-N133 PolarHBondContact O-N 2.93Å; A123-L183 WeakPolarHBondContact CA-O 3.24Å; A123-L183 HydrophobicContact CB-CB 4.2Å; A123-N188 HydrophobicContact CB-CB 3.63Å
124	P	93.3	Very high	92.3	Very high	60 Å²	60	50.8 Å²	50.8	39%	0.39	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	141.4	173	26	-33.2	0	0	0	111.2	W174 L183	P124-W174 HydrophobicContact CB-CH2 4.07Å; P124-L183 WeakPolarHBondContact CD-O 3.19Å
125	D	90.4	Very high	92.3	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.144	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-74.5	131.8	165.4	-156.8	-53.8	0	0	0	108.2	L127 C131 N133 Q164	D125-L127 PolarHBondContact O-N 2.78Å; D125-L127 PolarHBondContact OD1-N 3.17Å; D125-C131 PolarHBondContact N-O 3.43Å; D125-N133 HydrophobicContact CB-CB 3.96Å; D125-N133 PolarHBondContact OD2-ND2 3.3Å; D125-Q164 PolarHBondContact OD2-NE2 3.15Å
126	P	82.3	Confident	92.3	Very high	77 Å²	77	50.8 Å²	50.8	50%	0.5	25%	0.253	S	S	.	.	S	Bend	trans	-70.4	-10.3	179	27.9	-36.4	0	0	0	113.9	I190	P126-I190 HydrophobicContact CG-CB 4.45Å; P126-I190 HydrophobicContact CG-CG1 4.12Å
127	L	80	Confident	92.4	Very high	107 Å²	107	44.7 Å²	44.7	56%	0.56	22%	0.221	S	C	*	.	S	Bend	trans	-95.4	149.8	179.8	-61.1	176.4	0	0	0	111.6	D125	D125-L127 PolarHBondContact O-N 2.78Å; D125-L127 PolarHBondContact OD1-N 3.17Å
128	W	79.8	Confident	92.5	Very high	232 Å²	232	41.9 Å²	41.9	88%	0.879	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	142.3	174.9	-178.8	90.5	0	0	0	111.6
129	P	86.2	Confident	92.7	Very high	48 Å²	48	36 Å²	36	31%	0.312	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	cis	-82.3	178.8	-0.5	34.4	-35.6	0	0	0	113.7	C131	P129-C131 PolarHBondContact O-N 3.38Å
130	D	87.8	Confident	92.9	Very high	120 Å²	120	37.6 Å²	37.6	64%	0.642	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	68.4	179.7	-72.1	-2.5	0	0	0	112.8	L175	D130-L175 HydrophobicContact CB-CD1 4.07Å; D130-L175 HydrophobicContact CB-CD2 3.82Å
131	C	93.6	Very high	93	Very high	19 Å²	19	37.7 Å²	37.7	13%	0.128	19%	0.194	C	C	.	.			trans	-109.1	163.9	-179.4	-77.4	0	0	0	0	110.4	D125 P129 N168	D125-C131 PolarHBondContact N-O 3.43Å; P129-C131 PolarHBondContact O-N 3.38Å; C131-N168 WeakPolarHBondContact CA-OD1 3.13Å; C131-N168 WeakPolarHBondContact CB-OD1 3.3Å
132	F	95.8	Very high	93.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	151.9	165.7	61.5	-98.9	0	0	0	111.6	F120 A122 A123 A134 L167 N168 F171 W174	F120-F132 HydrophobicContact CD1-CE1 4.34Å; F120-F132 HydrophobicContact CD1-CZ 4.27Å; F120-F132 HydrophobicContact CE1-CD1 4.14Å; F120-F132 AromaticContact CE1-CD2 3.78Å; F120-F132 HydrophobicContact CE1-CD2 3.78Å; F120-F132 AromaticContact CE1-CE1 3.79Å; F120-F132 HydrophobicContact CE1-CE1 3.79Å; F120-F132 AromaticContact CE1-CE2 3.42Å; F120-F132 HydrophobicContact CE1-CE2 3.42Å; F120-F132 VanDerWaalsContact CE1-CE2 3.42Å; F120-F132 HydrophobicContact CE1-CG 4.12Å; F120-F132 AromaticContact CE1-CZ 3.4Å; F120-F132 HydrophobicContact CE1-CZ 3.4Å; F120-F132 HydrophobicContact CZ-CD2 4.18Å; F120-F132 AromaticContact CZ-CE2 3.56Å; F120-F132 HydrophobicContact CZ-CE2 3.56Å; F120-F132 AromaticContact CZ-CZ 3.77Å; F120-F132 HydrophobicContact CZ-CZ 3.77Å; A122-F132 HydrophobicContact CB-CB 3.84Å; A122-F132 HydrophobicContact CB-CD2 4.02Å; A122-F132 HydrophobicContact CB-CG 4.03Å; A123-F132 WeakPolarHBondContact O-CA 3.34Å; A123-F132 WeakPolarHBondContact O-CB 3.45Å; F132-A134 HydrophobicContact CE2-CB 4.29Å; F132-L167 HydrophobicContact CE2-CB 3.84Å; F132-L167 VanDerWaalsContact CZ-C 3.44Å; F132-L167 HydrophobicContact CZ-CB 3.72Å; F132-N168 WeakPolarHBondContact CD1-OD1 3.42Å; F132-N168 HydrophobicContact CE1-CB 4.23Å; F132-N168 VanDerWaalsContact CE1-OD1 3.27Å; F132-N168 WeakPolarHBondContact CE1-OD1 3.46Å; F132-N168 WeakPolarHBondContact CG-OD1 3.17Å; F132-N168 HydrophobicContact CZ-CB 4.38Å; F132-N168 PolarHBondContact N-OD1 3.42Å; F132-N168 PolarHBondContact O-ND2 3.41Å; F132-F171 HydrophobicContact CE1-CB 4.12Å; F132-F171 HydrophobicContact CZ-CB 4.4Å; F132-F171 HydrophobicContact CZ-CD2 4.39Å; F132-W174 HydrophobicContact CB-CD2 3.93Å; F132-W174 HydrophobicContact CB-CE3 3.96Å; F132-W174 HydrophobicContact CB-CH2 3.64Å; F132-W174 HydrophobicContact CB-CZ2 3.58Å; F132-W174 HydrophobicContact CB-CZ3 3.83Å; F132-W174 HydrophobicContact CD1-CB 4.05Å; F132-W174 AromaticContact CD1-CD2 3.51Å; F132-W174 HydrophobicContact CD1-CD2 3.51Å; F132-W174 AromaticContact CD1-CE3 3.74Å; F132-W174 HydrophobicContact CD1-CE3 3.74Å; F132-W174 AromaticContact CD1-CG 3.66Å; F132-W174 HydrophobicContact CD1-CG 3.66Å; F132-W174 HydrophobicContact CD1-CZ3 4.43Å; F132-W174 HydrophobicContact CE1-CB 4.14Å; F132-W174 HydrophobicContact CE1-CD2 4.44Å; F132-W174 HydrophobicContact CE1-CG 4.17Å; F132-W174 HydrophobicContact CG-CD2 4.15Å; F132-W174 HydrophobicContact CG-CE3 4.36Å
133	N	95.2	Very high	93.1	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126	168.8	-176.6	-86.5	0	0	0	110	A123 D125 G135 Q164 N188 H219	A123-N133 PolarHBondContact O-N 2.93Å; D125-N133 HydrophobicContact CB-CB 3.96Å; D125-N133 PolarHBondContact OD2-ND2 3.3Å; N133-G135 PolarHBondContact O-N 2.8Å; N133-G135 WeakPolarHBondContact OD1-CA 3.33Å; N133-G135 PolarHBondContact OD1-N 3.38Å; N133-Q164 PolarHBondContact ND2-OE1 3.02Å; N133-N188 PolarHBondContact O-ND2 3.3Å; N133-N188 PolarHBondContact OD1-ND2 3.41Å; N133-H219 PolarHBondContact OD1-CE1 2.84Å; N133-H219 PolarHBondContact OD1-ND1 2.77Å
134	A	95.3	Very high	93.2	Very high	2 Å²	2	50.3 Å²	50.3	2%	0.017	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	20.6	-175.3	0	0	0	0	0	114.3	K86 F132 F137 Q164 L167	K86-A134 PolarHBondContact NZ-O 3.12Å; F132-A134 HydrophobicContact CE2-CB 4.29Å; A134-F137 WeakPolarHBondContact O-CE1 3.41Å; A134-Q164 HydrophobicContact CB-CB 4.26Å; A134-Q164 HydrophobicContact CB-CG 4.32Å; A134-Q164 VanDerWaalsContact N-OE1 3.17Å; A134-L167 HydrophobicContact CB-CD1 3.84Å
135	G	95.8	Very high	93.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-32.6	177.2	0	0	0	0	0	114.4	M101 D102 N133	M101-G135 CarbonylContact C-O 3.57Å; M101-G135 WeakPolarHBondContact CA-O 3.28Å; D102-G135 PolarHBondContact N-O 3Å; D102-G135 WeakPolarHBondContact OD2-CA 3.01Å; N133-G135 PolarHBondContact O-N 2.8Å; N133-G135 WeakPolarHBondContact OD1-CA 3.33Å; N133-G135 PolarHBondContact OD1-N 3.38Å
136	V	98.3	Very high	93.8	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	123.2	174.3	-177.6	0	0	0	0	109.2	V99 F100 M101 T105 N188 V217	V99-V136 HydrophobicContact CG1-CG1 4.37Å; F100-V136 VanDerWaalsContact O-CA 3.32Å; F100-V136 WeakPolarHBondContact O-CA 3.36Å; M101-V136 HydrophobicContact CE-CG2 4.21Å; M101-V136 HydrophobicContact CG-CG1 4.41Å; T105-V136 HydrophobicContact CG2-CG2 3.93Å; V136-N188 HydrophobicContact CB-CB 4.06Å; V136-N188 HydrophobicContact CG2-CB 4.21Å; V136-N188 PolarHBondContact N-ND2 3.26Å; V136-V217 HydrophobicContact CG2-CG1 4.08Å
137	F	98.1	Very high	94.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	157	177.2	59.8	-88.6	0	0	0	112.9	K86 W90 V99 F100 F120 T121 A122 A134 L139 L167	K86-F137 HydrophobicContact CD-CE1 3.99Å; K86-F137 HydrophobicContact CD-CZ 4.19Å; K86-F137 HydrophobicContact CG-CZ 4.41Å; W90-F137 AromaticContact CH2-CE2 3.56Å; W90-F137 HydrophobicContact CH2-CE2 3.56Å; W90-F137 AromaticContact CH2-CZ 3.93Å; W90-F137 HydrophobicContact CH2-CZ 3.93Å; W90-F137 AromaticContact CZ2-CE2 3.93Å; W90-F137 HydrophobicContact CZ2-CE2 3.93Å; W90-F137 HydrophobicContact CZ3-CE2 4.29Å; W90-F137 HydrophobicContact CZ3-CZ 4.36Å; V99-F137 CarbonylContact C-O 3.36Å; V99-F137 WeakPolarHBondContact CA-O 3.33Å; F100-F137 HydrophobicContact CB-CD1 4.15Å; F100-F137 HydrophobicContact CB-CD2 4.17Å; F100-F137 HydrophobicContact CB-CE1 3.75Å; F100-F137 HydrophobicContact CB-CE2 3.81Å; F100-F137 HydrophobicContact CB-CG 4.35Å; F100-F137 HydrophobicContact CB-CZ 3.56Å; F100-F137 AromaticContact CD1-CD1 3.96Å; F100-F137 HydrophobicContact CD1-CD1 3.96Å; F100-F137 AromaticContact CD1-CE1 3.24Å; F100-F137 HydrophobicContact CD1-CE1 3.24Å; F100-F137 AromaticContact CD1-CZ 3.7Å; F100-F137 HydrophobicContact CD1-CZ 3.7Å; F100-F137 HydrophobicContact CE1-CE1 4.1Å; F100-F137 HydrophobicContact CG-CD1 4.45Å; F100-F137 AromaticContact CG-CE1 3.7Å; F100-F137 HydrophobicContact CG-CE1 3.7Å; F100-F137 HydrophobicContact CG-CE2 4.4Å; F100-F137 AromaticContact CG-CZ 3.67Å; F100-F137 HydrophobicContact CG-CZ 3.67Å; F100-F137 PolarHBondContact N-O 3.33Å; F100-F137 PolarHBondContact O-N 3.01Å; F100-F137 VanDerWaalsContact O-N 3.13Å; F120-F137 HydrophobicContact CD2-CD2 4.01Å; F120-F137 HydrophobicContact CE1-CB 4.22Å; F120-F137 HydrophobicContact CE2-CB 3.97Å; F120-F137 AromaticContact CE2-CD2 3.16Å; F120-F137 HydrophobicContact CE2-CD2 3.16Å; F120-F137 AromaticContact CE2-CE2 3.65Å; F120-F137 HydrophobicContact CE2-CE2 3.65Å; F120-F137 AromaticContact CE2-CG 3.66Å; F120-F137 HydrophobicContact CE2-CG 3.66Å; F120-F137 HydrophobicContact CZ-CB 3.66Å; F120-F137 HydrophobicContact CZ-CD1 4.27Å; F120-F137 AromaticContact CZ-CD2 3.67Å; F120-F137 HydrophobicContact CZ-CD2 3.67Å; F120-F137 HydrophobicContact CZ-CE2 4.3Å; F120-F137 AromaticContact CZ-CG 3.62Å; F120-F137 HydrophobicContact CZ-CG 3.62Å; T121-F137 CarbonylContact O-C 3.33Å; T121-F137 WeakPolarHBondContact O-CA 3.22Å; T121-F137 WeakPolarHBondContact O-CB 3.36Å; A122-F137 HydrophobicContact CB-CB 3.85Å; A134-F137 WeakPolarHBondContact O-CE1 3.41Å; F137-L139 HydrophobicContact CD2-CB 4.46Å; F137-L139 HydrophobicContact CD2-CD2 3.75Å; F137-L139 HydrophobicContact CE2-CD2 3.35Å; F137-L139 HydrophobicContact CZ-CD2 4.35Å; F137-L167 HydrophobicContact CE1-CD1 4.46Å; F137-L167 HydrophobicContact CZ-CD1 4.4Å
138	V	98.4	Very high	95.4	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	133.2	178.1	-168.9	0	0	0	0	109.3	K97 V98 V99 L114 R117 T121	K97-V138 HydrophobicContact CD-CG1 3.89Å; K97-V138 HydrophobicContact CG-CG1 3.96Å; V98-V138 WeakPolarHBondContact O-CA 3.29Å; V99-V138 HydrophobicContact CG2-CG1 4.45Å; V99-V138 HydrophobicContact CG2-CG2 4.19Å; L114-V138 HydrophobicContact CB-CG2 4.33Å; R117-V138 HydrophobicContact CB-CB 4.5Å; R117-V138 HydrophobicContact CB-CG1 4.44Å; R117-V138 HydrophobicContact CB-CG2 4.16Å; T121-V138 HydrophobicContact CG2-CG2 4.48Å; T121-V138 PolarHBondContact N-O 3.23Å; T121-V138 PolarHBondContact O-N 2.72Å
139	L	97.6	Very high	96.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	158.5	178.5	71	118.2	0	0	0	112	V89 W90 V98 F100 E119 F137 P141	V89-L139 HydrophobicContact CG1-CD1 4.09Å; V89-L139 HydrophobicContact CG1-CD2 3.56Å; V89-L139 HydrophobicContact CG1-CG 4.44Å; W90-L139 HydrophobicContact CD2-CD1 4.2Å; W90-L139 HydrophobicContact CG-CD1 4.03Å; W90-L139 HydrophobicContact CZ2-CB 4.36Å; V98-L139 HydrophobicContact CB-CD1 4.33Å; V98-L139 HydrophobicContact CB-CD2 4.14Å; V98-L139 HydrophobicContact CB-CG 4Å; V98-L139 HydrophobicContact CG1-CD2 3.89Å; V98-L139 HydrophobicContact CG1-CG 4.31Å; V98-L139 PolarHBondContact N-O 3.34Å; V98-L139 PolarHBondContact O-N 3.26Å; F100-L139 HydrophobicContact CB-CD2 4.18Å; E119-L139 HydrophobicContact CG-CB 4.4Å; F137-L139 HydrophobicContact CD2-CB 4.46Å; F137-L139 HydrophobicContact CD2-CD2 3.75Å; F137-L139 HydrophobicContact CE2-CD2 3.35Å; F137-L139 HydrophobicContact CZ-CD2 4.35Å; L139-P141 HydrophobicContact CD1-CB 4.28Å; L139-P141 HydrophobicContact CD1-CG 3.81Å
140	E	97.8	Very high	96.5	Very high	78 Å²	78	33 Å²	33	36%	0.364	18%	0.179	S	C	.	.			trans	-109.9	108.1	167.1	-57.5	-178.2	172.9	0	0	107.5	K97 E119 T142	K97-E140 VanDerWaalsContact CE-OE1 3.3Å; K97-E140 WeakPolarHBondContact CE-OE1 3.22Å; K97-E140 HydrophobicContact CG-CG 4.48Å; K97-E140 IonicContact NZ-OE1 2.87Å; E119-E140 HydrophobicContact CB-CB 4.41Å; E119-E140 HydrophobicContact CB-CG 4.07Å; E119-E140 WeakPolarHBondContact OE2-CA 3.43Å; E119-E140 WeakPolarHBondContact OE2-CB 3.34Å; E119-E140 PolarHBondContact OE2-N 2.84Å; E140-T142 PolarHBondContact O-N 2.99Å
141	P	98.1	Very high	96.7	Very high	12 Å²	12	35.5 Å²	35.5	8%	0.078	18%	0.18	C	C	.	.			trans	-60	124.6	-173.2	-23.3	31.6	0	0	0	112.3	L92 V98 L139	L92-P141 HydrophobicContact CB-CB 4.46Å; L92-P141 HydrophobicContact CB-CG 4.43Å; L92-P141 WeakPolarHBondContact O-CB 3.27Å; V98-P141 HydrophobicContact CB-CG 4.25Å; V98-P141 HydrophobicContact CG2-CG 3.67Å; L139-P141 HydrophobicContact CD1-CB 4.28Å; L139-P141 HydrophobicContact CD1-CG 3.81Å
142	T	97.9	Very high	96.7	Very high	52 Å²	52	36 Å²	36	32%	0.319	18%	0.181	S	C	.	.			trans	-140.1	143.6	171.4	75.2	0	0	0	0	111.3	W90 E140 N144 T145 Y146	W90-T142 CarbonylContact O-C 3.45Å; W90-T142 PolarHBondContact O-N 2.89Å; E140-T142 PolarHBondContact O-N 2.99Å; T142-N144 PolarHBondContact O-N 2.66Å; T142-T145 PolarHBondContact O-N 3Å; T142-T145 WeakPolarHBondContact OG1-CB 3.45Å; T142-T145 PolarHBondContact OG1-N 2.82Å; T142-T145 VanDerWaalsContact OG1-N 3.14Å; T142-T145 PolarHBondContact OG1-OG1 3.38Å; T142-T145 VanDerWaalsContact OG1-OG1 3.07Å; T142-Y146 PolarHBondContact O-N 3.28Å
143	M	98.1	Very high	96.5	Very high	75 Å²	75	36 Å²	36	37%	0.369	18%	0.181	S	C	.	.	H	α-helix	trans	-63.8	-25.9	174	-70.3	-55.3	-63.1	0	0	112.5	I93 Y146 N147	I93-M143 HydrophobicContact CD1-CG 4.47Å; I93-M143 HydrophobicContact CG2-CG 4.14Å; I93-M143 HydrophobicContact CG2-SD 4.49Å; M143-Y146 HydrophobicContact CE-CD1 3.62Å; M143-Y146 HydrophobicContact CE-CE1 4.11Å; M143-Y146 HydrophobicContact CE-CG 4.47Å; M143-Y146 HydrophobicContact SD-CD1 4.31Å; M143-N147 VanDerWaalsContact O-CB 3.28Å; M143-N147 WeakPolarHBondContact O-CB 3.17Å; M143-N147 PolarHBondContact O-N 3.41Å; M143-N147 PolarHBondContact O-ND2 3.27Å; M143-N147 VanDerWaalsContact O-ND2 3.09Å
144	N	98.2	Very high	96.1	Very high	137 Å²	137	40.9 Å²	40.9	73%	0.733	20%	0.202	S	C	*	.	H	α-helix	trans	-64.5	-50.1	175.4	-71.5	-2.9	0	0	0	110.9	T142 N147 G148	T142-N144 PolarHBondContact O-N 2.66Å; N144-N147 PolarHBondContact O-N 3.1Å; N144-G148 PolarHBondContact O-N 3.27Å
145	T	97.9	Very high	95.8	Very high	20 Å²	20	45.6 Å²	45.6	12%	0.123	23%	0.227	C	C	.	.	H	α-helix	trans	-64.7	-42	176.6	-56.9	0	0	0	0	111.5	W90 T142 G148 L149 Y170 F171	W90-T145 HydrophobicContact CD2-CG2 4.2Å; W90-T145 HydrophobicContact CG-CG2 3.84Å; W90-T145 VanDerWaalsContact NE1-CG2 3.32Å; T142-T145 PolarHBondContact O-N 3Å; T142-T145 WeakPolarHBondContact OG1-CB 3.45Å; T142-T145 PolarHBondContact OG1-N 2.82Å; T142-T145 VanDerWaalsContact OG1-N 3.14Å; T142-T145 PolarHBondContact OG1-OG1 3.38Å; T142-T145 VanDerWaalsContact OG1-OG1 3.07Å; T145-G148 PolarHBondContact O-N 3.04Å; T145-L149 HydrophobicContact CG2-CD1 4.06Å; T145-L149 HydrophobicContact CG2-CG 4.45Å; T145-L149 WeakPolarHBondContact O-CB 3.4Å; T145-L149 WeakPolarHBondContact O-CG 3.4Å; T145-L149 PolarHBondContact O-N 2.67Å; T145-Y170 HydrophobicContact CG2-CD1 4.5Å; T145-Y170 HydrophobicContact CG2-CE1 3.74Å; T145-F171 HydrophobicContact CG2-CE1 4.49Å; T145-F171 HydrophobicContact CG2-CZ 3.92Å
146	Y	97.8	Very high	95.3	Very high	31 Å²	31	50.2 Å²	50.2	12%	0.122	26%	0.259	C	S	.	.	H	α-helix	trans	-56.4	-52.5	175.4	177.5	-104.7	0	0	0	112.6	I87 Q88 W90 T142 M143 G148 L149 L150	I87-Y146 HydrophobicContact CG2-CD2 3.78Å; I87-Y146 HydrophobicContact CG2-CE2 3.94Å; I87-Y146 WeakPolarHBondContact O-CD2 3.06Å; Q88-Y146 VanDerWaalsContact OE1-CE2 3.3Å; Q88-Y146 PolarHBondContact OE1-OH 3.03Å; W90-Y146 HydrophobicContact CB-CD2 4.44Å; T142-Y146 PolarHBondContact O-N 3.28Å; M143-Y146 HydrophobicContact CE-CD1 3.62Å; M143-Y146 HydrophobicContact CE-CE1 4.11Å; M143-Y146 HydrophobicContact CE-CG 4.47Å; M143-Y146 HydrophobicContact SD-CD1 4.31Å; Y146-G148 VanDerWaalsContact C-N 3.33Å; Y146-G148 PolarHBondContact O-N 2.73Å; Y146-L149 PolarHBondContact O-N 3.46Å; Y146-L150 HydrophobicContact CD1-CD1 4.05Å; Y146-L150 HydrophobicContact CE1-CD1 3.44Å; Y146-L150 VanDerWaalsContact CE1-CD1 3.44Å; Y146-L150 HydrophobicContact CE1-CG 4.35Å; Y146-L150 HydrophobicContact CE2-CD1 4.35Å; Y146-L150 PolarHBondContact O-N 2.91Å
147	N	97.6	Very high	94.6	Very high	84 Å²	84	50.5 Å²	50.5	45%	0.449	26%	0.262	S	S	.	.	H	α-helix	trans	-66.4	-35.7	179.6	-70.1	-29.7	0	0	0	111.8	M143 N144 L150 R151	M143-N147 VanDerWaalsContact O-CB 3.28Å; M143-N147 WeakPolarHBondContact O-CB 3.17Å; M143-N147 PolarHBondContact O-N 3.41Å; M143-N147 PolarHBondContact O-ND2 3.27Å; M143-N147 VanDerWaalsContact O-ND2 3.09Å; N144-N147 PolarHBondContact O-N 3.1Å; N147-L150 PolarHBondContact O-N 3.04Å; N147-R151 WeakPolarHBondContact O-CB 3.12Å; N147-R151 PolarHBondContact O-N 2.75Å
148	G	97.1	Very high	94.2	Very high	19 Å²	19	51 Å²	51	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-62.1	-44.7	174.1	0	0	0	0	0	112.5	N144 T145 Y146 R151 M152	N144-G148 PolarHBondContact O-N 3.27Å; T145-G148 PolarHBondContact O-N 3.04Å; Y146-G148 VanDerWaalsContact C-N 3.33Å; Y146-G148 PolarHBondContact O-N 2.73Å; G148-R151 PolarHBondContact O-N 2.95Å; G148-M152 WeakPolarHBondContact O-CB 3.42Å; G148-M152 PolarHBondContact O-N 2.97Å
149	L	96.5	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-44.3	175.7	-77	167.6	0	0	0	112	I87 W90 T145 Y146 M152 L153 L166 L167 Y170	I87-L149 HydrophobicContact CD1-CB 4.44Å; I87-L149 HydrophobicContact CG1-CB 4.45Å; I87-L149 HydrophobicContact CG2-CB 3.72Å; I87-L149 HydrophobicContact CG2-CD1 4.05Å; W90-L149 HydrophobicContact CD2-CD1 3.58Å; W90-L149 HydrophobicContact CE3-CD1 3.38Å; W90-L149 HydrophobicContact CG-CD1 4.24Å; W90-L149 HydrophobicContact CH2-CD1 4.06Å; W90-L149 HydrophobicContact CZ2-CD1 4.22Å; W90-L149 HydrophobicContact CZ3-CD1 3.65Å; T145-L149 HydrophobicContact CG2-CD1 4.06Å; T145-L149 HydrophobicContact CG2-CG 4.45Å; T145-L149 WeakPolarHBondContact O-CB 3.4Å; T145-L149 WeakPolarHBondContact O-CG 3.4Å; T145-L149 PolarHBondContact O-N 2.67Å; Y146-L149 PolarHBondContact O-N 3.46Å; L149-M152 PolarHBondContact O-N 3.38Å; L149-L153 WeakPolarHBondContact O-CB 3.31Å; L149-L153 PolarHBondContact O-N 3.41Å; L149-L166 HydrophobicContact CD2-CD2 4.44Å; L149-L167 HydrophobicContact CD1-CD2 4.18Å; L149-L167 HydrophobicContact CD2-CD2 3.72Å; L149-Y170 HydrophobicContact CD2-CD1 3.93Å; L149-Y170 HydrophobicContact CD2-CD2 3.76Å; L149-Y170 HydrophobicContact CD2-CE2 4.47Å; L149-Y170 HydrophobicContact CD2-CG 3.43Å; L149-Y170 VanDerWaalsContact CD2-CG 3.43Å; L149-Y170 HydrophobicContact CG-CD1 4.22Å; L149-Y170 HydrophobicContact CG-CD2 4.08Å; L149-Y170 HydrophobicContact CG-CE1 4.45Å; L149-Y170 HydrophobicContact CG-CE2 4.31Å; L149-Y170 HydrophobicContact CG-CG 4.03Å
150	L	93	Very high	92.9	Very high	33 Å²	33	58.4 Å²	58.4	17%	0.173	30%	0.3	C	S	.	.	H	α-helix	trans	-60.8	-47.1	174.8	-73.7	-179.9	0	0	0	111.5	V64 I87 Y146 N147 M152 L153 F154	V64-L150 HydrophobicContact CG1-CD2 4.12Å; I87-L150 HydrophobicContact CG2-CD2 4.45Å; Y146-L150 HydrophobicContact CD1-CD1 4.05Å; Y146-L150 HydrophobicContact CE1-CD1 3.44Å; Y146-L150 VanDerWaalsContact CE1-CD1 3.44Å; Y146-L150 HydrophobicContact CE1-CG 4.35Å; Y146-L150 HydrophobicContact CE2-CD1 4.35Å; Y146-L150 PolarHBondContact O-N 2.91Å; N147-L150 PolarHBondContact O-N 3.04Å; L150-M152 VanDerWaalsContact C-N 3.35Å; L150-M152 PolarHBondContact O-N 3.29Å; L150-L153 WeakPolarHBondContact O-CB 3.27Å; L150-L153 PolarHBondContact O-N 2.89Å; L150-F154 HydrophobicContact CB-CE2 4.45Å; L150-F154 HydrophobicContact CD2-CE2 4.29Å; L150-F154 WeakPolarHBondContact O-CD2 3.46Å; L150-F154 PolarHBondContact O-N 3.21Å
151	R	93.5	Very high	92.2	Very high	173 Å²	173	54.8 Å²	54.8	65%	0.653	28%	0.284	S	S	*	.	H	α-helix	trans	-58.1	-48.6	177.8	179.8	176.2	179.2	176.8	2.4	111	N147 G148 L153 F154 D155	N147-R151 WeakPolarHBondContact O-CB 3.12Å; N147-R151 PolarHBondContact O-N 2.75Å; G148-R151 PolarHBondContact O-N 2.95Å; R151-L153 VanDerWaalsContact C-N 3.31Å; R151-L153 PolarHBondContact O-N 3.38Å; R151-F154 CarbonylContact O-C 3.59Å; R151-F154 PolarHBondContact O-N 2.88Å; R151-F154 VanDerWaalsContact O-N 3.17Å; R151-D155 WeakPolarHBondContact CG-OD2 3.5Å; R151-D155 IonicContact NE-OD2 3.25Å; R151-D155 PolarHBondContact NE-OD2 3.45Å; R151-D155 VanDerWaalsContact NE-OD2 3.11Å; R151-D155 VanDerWaalsContact O-CB 3.27Å; R151-D155 WeakPolarHBondContact O-CB 3.43Å; R151-D155 VanDerWaalsContact O-CG 3.24Å; R151-D155 PolarHBondContact O-N 2.94Å
152	M	93.4	Very high	91.5	Very high	29 Å²	29	61.9 Å²	61.9	14%	0.143	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-36	179.6	-167.9	177.3	66.4	0	0	112.5	G148 L149 L150 F154 S156 G157 L166 T169 Y170	G148-M152 WeakPolarHBondContact O-CB 3.42Å; G148-M152 PolarHBondContact O-N 2.97Å; L149-M152 PolarHBondContact O-N 3.38Å; L150-M152 VanDerWaalsContact C-N 3.35Å; L150-M152 PolarHBondContact O-N 3.29Å; M152-F154 VanDerWaalsContact C-N 3.32Å; M152-F154 PolarHBondContact O-N 3.23Å; M152-S156 PolarHBondContact O-N 3.07Å; M152-G157 PolarHBondContact O-N 3.18Å; M152-L166 HydrophobicContact CE-CD1 3.55Å; M152-L166 HydrophobicContact CE-CG 3.83Å; M152-L166 WeakPolarHBondContact CE-O 3.15Å; M152-L166 HydrophobicContact CG-CD1 4.5Å; M152-T169 HydrophobicContact CE-CG2 4.3Å; M152-T169 HydrophobicContact SD-CG2 3.71Å; M152-Y170 HydrophobicContact CB-CD2 4.48Å; M152-Y170 HydrophobicContact CE-CD2 3.82Å; M152-Y170 HydrophobicContact CE-CG 4.08Å; M152-Y170 HydrophobicContact SD-CD2 4.03Å
153	L	90.1	Very high	91.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.1	-40.2	173.5	176.9	61.5	0	0	0	112.1	V64 T66 W69 F84 I87 L149 L150 R151 G157 L166	V64-L153 HydrophobicContact CG1-CD2 3.88Å; T66-L153 HydrophobicContact CG2-CD1 3.83Å; T66-L153 HydrophobicContact CG2-CD2 3.83Å; T66-L153 HydrophobicContact CG2-CG 3.79Å; W69-L153 VanDerWaalsContact CZ2-O 3.3Å; W69-L153 WeakPolarHBondContact CZ2-O 3.37Å; F84-L153 HydrophobicContact CB-CD2 3.71Å; F84-L153 HydrophobicContact CD1-CD1 3.57Å; F84-L153 HydrophobicContact CD1-CD2 4.16Å; F84-L153 HydrophobicContact CD2-CD1 3.91Å; F84-L153 HydrophobicContact CD2-CD2 4.19Å; F84-L153 HydrophobicContact CE1-CD1 3.55Å; F84-L153 HydrophobicContact CE2-CD1 3.89Å; F84-L153 HydrophobicContact CG-CD1 3.76Å; F84-L153 HydrophobicContact CG-CD2 3.75Å; F84-L153 HydrophobicContact CG-CG 4.43Å; F84-L153 HydrophobicContact CZ-CD1 3.71Å; I87-L153 HydrophobicContact CD1-CD2 3.91Å; L149-L153 WeakPolarHBondContact O-CB 3.31Å; L149-L153 PolarHBondContact O-N 3.41Å; L150-L153 WeakPolarHBondContact O-CB 3.27Å; L150-L153 PolarHBondContact O-N 2.89Å; R151-L153 VanDerWaalsContact C-N 3.31Å; R151-L153 PolarHBondContact O-N 3.38Å; L153-G157 WeakPolarHBondContact O-CA 3.49Å; L153-G157 PolarHBondContact O-N 2.91Å; L153-L166 HydrophobicContact CB-CD1 3.87Å; L153-L166 HydrophobicContact CB-CD2 4.01Å; L153-L166 HydrophobicContact CD1-CD1 4.15Å; L153-L166 HydrophobicContact CD1-CD2 4.27Å
154	F	87.1	Confident	90.8	Very high	113 Å²	113	59.7 Å²	59.7	50%	0.496	30%	0.295	S	S	.	.	H	α-helix	trans	-86.1	-22.6	179.8	-67.9	-61.5	0	0	0	114.4	T66 W69 L150 R151 M152	T66-F154 HydrophobicContact CG2-CE1 4.4Å; W69-F154 VanDerWaalsContact CH2-O 3.22Å; W69-F154 WeakPolarHBondContact CH2-O 3.32Å; L150-F154 HydrophobicContact CB-CE2 4.45Å; L150-F154 HydrophobicContact CD2-CE2 4.29Å; L150-F154 WeakPolarHBondContact O-CD2 3.46Å; L150-F154 PolarHBondContact O-N 3.21Å; R151-F154 CarbonylContact O-C 3.59Å; R151-F154 PolarHBondContact O-N 2.88Å; R151-F154 VanDerWaalsContact O-N 3.17Å; M152-F154 VanDerWaalsContact C-N 3.32Å; M152-F154 PolarHBondContact O-N 3.23Å
155	D	88.7	Confident	90.4	Very high	100 Å²	100	53.1 Å²	53.1	54%	0.535	26%	0.26	S	S	.	.	H	α-helix	trans	-90.2	-46.8	-179.8	-70.6	-6.9	0	0	0	111.3	R151	R151-D155 WeakPolarHBondContact CG-OD2 3.5Å; R151-D155 IonicContact NE-OD2 3.25Å; R151-D155 PolarHBondContact NE-OD2 3.45Å; R151-D155 VanDerWaalsContact NE-OD2 3.11Å; R151-D155 VanDerWaalsContact O-CB 3.27Å; R151-D155 WeakPolarHBondContact O-CB 3.43Å; R151-D155 VanDerWaalsContact O-CG 3.24Å; R151-D155 PolarHBondContact O-N 2.94Å
156	S	85.5	Confident	90.2	Very high	98 Å²	98	52.2 Å²	52.2	69%	0.685	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-25.5	-170.8	-57.3	0	0	0	0	113.8	M152	M152-S156 PolarHBondContact O-N 3.07Å
157	G	85.1	Confident	90.2	Very high	6 Å²	6	50.8 Å²	50.8	6%	0.062	25%	0.249	C	C	.	.			trans	74.6	-160.6	-174.2	0	0	0	0	0	113.5	M152 L153 L166	M152-G157 PolarHBondContact O-N 3.18Å; L153-G157 WeakPolarHBondContact O-CA 3.49Å; L153-G157 PolarHBondContact O-N 2.91Å; G157-L166 WeakPolarHBondContact O-CD1 3.47Å
158	S	87.8	Confident	90.1	Very high	12 Å²	12	47.6 Å²	47.6	8%	0.084	23%	0.232	C	C	.	.			trans	-112.8	136.1	176.1	177.5	0	0	0	0	110.9	D160 G161 R162 G165 L166	S158-D160 VanDerWaalsContact C-N 3.27Å; S158-D160 PolarHBondContact O-N 2.91Å; S158-D160 PolarHBondContact OG-N 3.37Å; S158-D160 PolarHBondContact OG-OD1 3.43Å; S158-G161 PolarHBondContact O-N 2.97Å; S158-R162 WeakPolarHBondContact CB-O 2.92Å; S158-R162 PolarHBondContact OG-N 3.16Å; S158-R162 PolarHBondContact OG-O 3.1Å; S158-G165 VanDerWaalsContact OG-C 3.25Å; S158-G165 WeakPolarHBondContact OG-CA 3.44Å; S158-L166 PolarHBondContact OG-N 3.12Å
159	F	86.4	Confident	90	Very high	104 Å²	104	49.2 Å²	49.2	46%	0.456	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-29	179.6	70.3	-106.3	0	0	0	113.5	G165 N168 T169	F159-G165 WeakPolarHBondContact CD1-O 3.49Å; F159-G165 VanDerWaalsContact CE1-O 3.23Å; F159-G165 WeakPolarHBondContact CE1-O 3.25Å; F159-G165 VanDerWaalsContact CZ-CA 3.49Å; F159-N168 HydrophobicContact CE1-CB 3.89Å; F159-N168 HydrophobicContact CZ-CB 4.26Å; F159-T169 WeakPolarHBondContact CD1-OG1 3.37Å
160	D	83.1	Confident	90	Very high	50 Å²	50	52.6 Å²	52.6	27%	0.267	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	3.1	177.9	71.7	-7.7	0	0	0	112.8	S158 R162 G165	S158-D160 VanDerWaalsContact C-N 3.27Å; S158-D160 PolarHBondContact O-N 2.91Å; S158-D160 PolarHBondContact OG-N 3.37Å; S158-D160 PolarHBondContact OG-OD1 3.43Å; D160-R162 PolarHBondContact O-N 2.84Å; D160-R162 WeakPolarHBondContact OD1-CA 3.33Å; D160-R162 WeakPolarHBondContact OD1-CB 3.32Å; D160-R162 PolarHBondContact OD1-N 3.32Å; D160-R162 VanDerWaalsContact OD1-O 3.05Å; D160-G165 VanDerWaalsContact CG-N 3.33Å; D160-G165 WeakPolarHBondContact OD1-CA 3.07Å; D160-G165 PolarHBondContact OD1-N 2.9Å; D160-G165 PolarHBondContact OD2-N 3.16Å; D160-G165 VanDerWaalsContact OD2-N 3.16Å
161	G	82.3	Confident	90.2	Very high	3 Å²	3	52 Å²	52	3%	0.031	25%	0.247	C	C	.	.	S	Bend	trans	75.2	-3.9	-173.4	0	0	0	0	0	114.3	F84 S158	F84-G161 VanDerWaalsContact CZ-O 3.22Å; F84-G161 WeakPolarHBondContact CZ-O 3.36Å; S158-G161 PolarHBondContact O-N 2.97Å
162	R	85	Confident	90.2	Very high	161 Å²	161	47.9 Å²	47.9	61%	0.608	24%	0.244	S	C	*	.	S	Bend	trans	-118.8	170.6	-171.5	-52.9	-178.1	75.6	-160.6	-0.4	111	S158 D160 Q164 G165 L166	S158-R162 WeakPolarHBondContact CB-O 2.92Å; S158-R162 PolarHBondContact OG-N 3.16Å; S158-R162 PolarHBondContact OG-O 3.1Å; D160-R162 PolarHBondContact O-N 2.84Å; D160-R162 WeakPolarHBondContact OD1-CA 3.33Å; D160-R162 WeakPolarHBondContact OD1-CB 3.32Å; D160-R162 PolarHBondContact OD1-N 3.32Å; D160-R162 VanDerWaalsContact OD1-O 3.05Å; R162-Q164 PolarHBondContact O-N 3.47Å; R162-G165 PolarHBondContact O-N 3.14Å; R162-L166 PolarHBondContact O-N 3.07Å
163	E	88.4	Confident	90.1	Very high	32 Å²	32	51.4 Å²	51.4	15%	0.15	26%	0.264	C	S	.	.	H	α-helix	trans	-62.2	-30.8	177.7	-65.2	120.8	126.7	0	0	112.7	F84 T85 K86 G165 L166 L167	F84-E163 VanDerWaalsContact C-OE1 3.29Å; F84-E163 VanDerWaalsContact CA-CG 3.48Å; F84-E163 VanDerWaalsContact CA-OE1 3.31Å; F84-E163 WeakPolarHBondContact CA-OE1 3.48Å; F84-E163 HydrophobicContact CB-CG 4.03Å; F84-E163 HydrophobicContact CD1-CB 4.41Å; F84-E163 HydrophobicContact CD1-CG 3.62Å; F84-E163 HydrophobicContact CE1-CG 4.37Å; F84-E163 HydrophobicContact CG-CG 4.05Å; T85-E163 PolarHBondContact N-OE1 3.5Å; K86-E163 HydrophobicContact CB-CG 4.3Å; K86-E163 WeakPolarHBondContact CB-OE1 3.44Å; K86-E163 PolarHBondContact N-OE1 2.87Å; E163-G165 PolarHBondContact O-N 3.1Å; E163-L166 PolarHBondContact O-N 3.13Å; E163-L167 WeakPolarHBondContact O-CB 3.33Å; E163-L167 VanDerWaalsContact O-CG 3.23Å; E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 3.08Å
164	Q	91.4	Very high	90.4	Very high	48 Å²	48	51.9 Å²	51.9	22%	0.224	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-46	179.3	-179.3	162.3	-57.1	0	0	111.7	D125 N133 A134 R162 L167 N168	D125-Q164 PolarHBondContact OD2-NE2 3.15Å; N133-Q164 PolarHBondContact ND2-OE1 3.02Å; A134-Q164 HydrophobicContact CB-CB 4.26Å; A134-Q164 HydrophobicContact CB-CG 4.32Å; A134-Q164 VanDerWaalsContact N-OE1 3.17Å; R162-Q164 PolarHBondContact O-N 3.47Å; Q164-L167 PolarHBondContact O-N 2.7Å; Q164-N168 WeakPolarHBondContact O-CB 3.33Å; Q164-N168 PolarHBondContact O-N 2.84Å; Q164-N168 PolarHBondContact O-ND2 3.22Å
165	G	91.5	Very high	90.5	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-36.7	176.1	0	0	0	0	0	113.2	S158 F159 D160 R162 E163 N168 T169	S158-G165 VanDerWaalsContact OG-C 3.25Å; S158-G165 WeakPolarHBondContact OG-CA 3.44Å; F159-G165 WeakPolarHBondContact CD1-O 3.49Å; F159-G165 VanDerWaalsContact CE1-O 3.23Å; F159-G165 WeakPolarHBondContact CE1-O 3.25Å; F159-G165 VanDerWaalsContact CZ-CA 3.49Å; D160-G165 VanDerWaalsContact CG-N 3.33Å; D160-G165 WeakPolarHBondContact OD1-CA 3.07Å; D160-G165 PolarHBondContact OD1-N 2.9Å; D160-G165 PolarHBondContact OD2-N 3.16Å; D160-G165 VanDerWaalsContact OD2-N 3.16Å; R162-G165 PolarHBondContact O-N 3.14Å; E163-G165 PolarHBondContact O-N 3.1Å; G165-N168 PolarHBondContact O-N 3.47Å; G165-T169 WeakPolarHBondContact O-CB 2.98Å; G165-T169 PolarHBondContact O-N 2.85Å; G165-T169 PolarHBondContact O-OG1 3.04Å
166	L	93.7	Very high	90.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-50.9	174	-174.6	77.8	0	0	0	110	F84 I87 L149 M152 L153 G157 S158 R162 E163 N168 T169 Y170	F84-L166 HydrophobicContact CD1-CB 4.4Å; F84-L166 HydrophobicContact CD1-CD2 3.95Å; F84-L166 HydrophobicContact CE1-CB 4.18Å; F84-L166 HydrophobicContact CE1-CD2 4.42Å; I87-L166 HydrophobicContact CD1-CD2 3.33Å; I87-L166 HydrophobicContact CG1-CD2 4.05Å; L149-L166 HydrophobicContact CD2-CD2 4.44Å; M152-L166 HydrophobicContact CE-CD1 3.55Å; M152-L166 HydrophobicContact CE-CG 3.83Å; M152-L166 WeakPolarHBondContact CE-O 3.15Å; M152-L166 HydrophobicContact CG-CD1 4.5Å; L153-L166 HydrophobicContact CB-CD1 3.87Å; L153-L166 HydrophobicContact CB-CD2 4.01Å; L153-L166 HydrophobicContact CD1-CD1 4.15Å; L153-L166 HydrophobicContact CD1-CD2 4.27Å; G157-L166 WeakPolarHBondContact O-CD1 3.47Å; S158-L166 PolarHBondContact OG-N 3.12Å; R162-L166 PolarHBondContact O-N 3.07Å; E163-L166 PolarHBondContact O-N 3.13Å; L166-N168 PolarHBondContact O-N 2.78Å; L166-T169 WeakPolarHBondContact O-CB 3.2Å; L166-T169 PolarHBondContact O-N 3.36Å; L166-T169 VanDerWaalsContact O-N 3.1Å; L166-Y170 PolarHBondContact O-N 2.75Å
167	L	96.4	Very high	90.6	Very high	2 Å²	2	51 Å²	51	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-42.2	-178.8	-65.9	179	0	0	0	111.5	K86 W90 F132 A134 F137 L149 E163 Q164 T169 Y170 F171	K86-L167 HydrophobicContact CD-CD1 4.48Å; W90-L167 HydrophobicContact CH2-CD1 4.18Å; W90-L167 HydrophobicContact CH2-CD2 3.39Å; W90-L167 HydrophobicContact CH2-CG 4.43Å; W90-L167 HydrophobicContact CZ2-CD2 4.34Å; W90-L167 HydrophobicContact CZ3-CD2 3.71Å; F132-L167 HydrophobicContact CE2-CB 3.84Å; F132-L167 VanDerWaalsContact CZ-C 3.44Å; F132-L167 HydrophobicContact CZ-CB 3.72Å; A134-L167 HydrophobicContact CB-CD1 3.84Å; F137-L167 HydrophobicContact CE1-CD1 4.46Å; F137-L167 HydrophobicContact CZ-CD1 4.4Å; L149-L167 HydrophobicContact CD1-CD2 4.18Å; L149-L167 HydrophobicContact CD2-CD2 3.72Å; E163-L167 WeakPolarHBondContact O-CB 3.33Å; E163-L167 VanDerWaalsContact O-CG 3.23Å; E163-L167 WeakPolarHBondContact O-CG 3.45Å; E163-L167 PolarHBondContact O-N 3.08Å; Q164-L167 PolarHBondContact O-N 2.7Å; L167-T169 PolarHBondContact O-N 3.16Å; L167-Y170 PolarHBondContact O-N 2.92Å; L167-F171 HydrophobicContact CD2-CE2 4.18Å; L167-F171 WeakPolarHBondContact O-CD2 3.35Å; L167-F171 PolarHBondContact O-N 3.44Å
168	N	96	Very high	90.9	Very high	17 Å²	17	55.2 Å²	55.2	9%	0.091	28%	0.28	C	S	.	.	H	α-helix	trans	-65	-28.4	175.6	-82.5	-83.7	0	0	0	112.6	C131 F132 F159 Q164 G165 L166 S172	C131-N168 WeakPolarHBondContact CA-OD1 3.13Å; C131-N168 WeakPolarHBondContact CB-OD1 3.3Å; F132-N168 WeakPolarHBondContact CD1-OD1 3.42Å; F132-N168 HydrophobicContact CE1-CB 4.23Å; F132-N168 VanDerWaalsContact CE1-OD1 3.27Å; F132-N168 WeakPolarHBondContact CE1-OD1 3.46Å; F132-N168 WeakPolarHBondContact CG-OD1 3.17Å; F132-N168 HydrophobicContact CZ-CB 4.38Å; F132-N168 PolarHBondContact N-OD1 3.42Å; F132-N168 PolarHBondContact O-ND2 3.41Å; F159-N168 HydrophobicContact CE1-CB 3.89Å; F159-N168 HydrophobicContact CZ-CB 4.26Å; Q164-N168 WeakPolarHBondContact O-CB 3.33Å; Q164-N168 PolarHBondContact O-N 2.84Å; Q164-N168 PolarHBondContact O-ND2 3.22Å; G165-N168 PolarHBondContact O-N 3.47Å; L166-N168 PolarHBondContact O-N 2.78Å; N168-S172 WeakPolarHBondContact O-CA 3.34Å; N168-S172 PolarHBondContact O-N 2.97Å
169	T	95	Very high	91	Very high	53 Å²	53	61 Å²	61	33%	0.325	31%	0.309	S	S	.	.	H	α-helix	trans	-74.2	-38.3	173.1	-50.9	0	0	0	0	111.5	M152 F159 G165 L166 L167 S172	M152-T169 HydrophobicContact CE-CG2 4.3Å; M152-T169 HydrophobicContact SD-CG2 3.71Å; F159-T169 WeakPolarHBondContact CD1-OG1 3.37Å; G165-T169 WeakPolarHBondContact O-CB 2.98Å; G165-T169 PolarHBondContact O-N 2.85Å; G165-T169 PolarHBondContact O-OG1 3.04Å; L166-T169 WeakPolarHBondContact O-CB 3.2Å; L166-T169 PolarHBondContact O-N 3.36Å; L166-T169 VanDerWaalsContact O-N 3.1Å; L167-T169 PolarHBondContact O-N 3.16Å; T169-S172 WeakPolarHBondContact O-CB 3.29Å
170	Y	97	Very high	91.1	Very high	71 Å²	71	57.6 Å²	57.6	28%	0.278	30%	0.298	S	S	.	.	H	α-helix	trans	-72.1	-48.5	-177.4	-166.6	-97.3	0	0	0	111	T145 L149 M152 L166 L167 S172	T145-Y170 HydrophobicContact CG2-CD1 4.5Å; T145-Y170 HydrophobicContact CG2-CE1 3.74Å; L149-Y170 HydrophobicContact CD2-CD1 3.93Å; L149-Y170 HydrophobicContact CD2-CD2 3.76Å; L149-Y170 HydrophobicContact CD2-CE2 4.47Å; L149-Y170 HydrophobicContact CD2-CG 3.43Å; L149-Y170 VanDerWaalsContact CD2-CG 3.43Å; L149-Y170 HydrophobicContact CG-CD1 4.22Å; L149-Y170 HydrophobicContact CG-CD2 4.08Å; L149-Y170 HydrophobicContact CG-CE1 4.45Å; L149-Y170 HydrophobicContact CG-CE2 4.31Å; L149-Y170 HydrophobicContact CG-CG 4.03Å; M152-Y170 HydrophobicContact CB-CD2 4.48Å; M152-Y170 HydrophobicContact CE-CD2 3.82Å; M152-Y170 HydrophobicContact CE-CG 4.08Å; M152-Y170 HydrophobicContact SD-CD2 4.03Å; L166-Y170 PolarHBondContact O-N 2.75Å; L167-Y170 PolarHBondContact O-N 2.92Å; Y170-S172 PolarHBondContact O-N 3.24Å
171	F	96.1	Very high	91.6	Very high	21 Å²	21	57.6 Å²	57.6	9%	0.092	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	48.1	176.6	-57.8	-74.8	0	0	0	109.6	W90 F120 F132 T145 L167 N173 W174	W90-F171 HydrophobicContact CH2-CE2 4.1Å; W90-F171 AromaticContact CZ2-CE2 3.57Å; W90-F171 HydrophobicContact CZ2-CE2 3.57Å; W90-F171 AromaticContact CZ2-CZ 3.64Å; W90-F171 HydrophobicContact CZ2-CZ 3.64Å; F120-F171 HydrophobicContact CB-CD1 3.77Å; F120-F171 HydrophobicContact CB-CE1 3.86Å; F120-F171 HydrophobicContact CB-CG 4.16Å; F120-F171 HydrophobicContact CB-CZ 4.34Å; F120-F171 HydrophobicContact CD1-CB 4.46Å; F120-F171 HydrophobicContact CD1-CD2 4.31Å; F120-F171 HydrophobicContact CD1-CG 4.25Å; F120-F171 HydrophobicContact CD2-CD1 4.45Å; F120-F171 AromaticContact CD2-CD2 3.95Å; F120-F171 HydrophobicContact CD2-CD2 3.95Å; F120-F171 HydrophobicContact CD2-CE1 4.18Å; F120-F171 AromaticContact CD2-CE2 3.66Å; F120-F171 HydrophobicContact CD2-CE2 3.66Å; F120-F171 HydrophobicContact CD2-CG 4.34Å; F120-F171 AromaticContact CD2-CZ 3.78Å; F120-F171 HydrophobicContact CD2-CZ 3.78Å; F120-F171 HydrophobicContact CE1-CD2 4.47Å; F120-F171 HydrophobicContact CE2-CD2 4.1Å; F120-F171 AromaticContact CE2-CE2 3.85Å; F120-F171 HydrophobicContact CE2-CE2 3.85Å; F120-F171 HydrophobicContact CE2-CZ 4.38Å; F120-F171 HydrophobicContact CG-CD1 4.1Å; F120-F171 HydrophobicContact CG-CD2 4.05Å; F120-F171 HydrophobicContact CG-CE1 4.21Å; F120-F171 HydrophobicContact CG-CE2 4.18Å; F120-F171 HydrophobicContact CG-CG 4.02Å; F120-F171 HydrophobicContact CG-CZ 4.25Å; F120-F171 HydrophobicContact CZ-CD2 4.37Å; F132-F171 HydrophobicContact CE1-CB 4.12Å; F132-F171 HydrophobicContact CZ-CB 4.4Å; F132-F171 HydrophobicContact CZ-CD2 4.39Å; T145-F171 HydrophobicContact CG2-CE1 4.49Å; T145-F171 HydrophobicContact CG2-CZ 3.92Å; L167-F171 HydrophobicContact CD2-CE2 4.18Å; L167-F171 WeakPolarHBondContact O-CD2 3.35Å; L167-F171 PolarHBondContact O-N 3.44Å; F171-N173 PolarHBondContact O-N 3.09Å; F171-W174 HydrophobicContact CB-CB 4.4Å; F171-W174 WeakPolarHBondContact O-CB 3.33Å; F171-W174 PolarHBondContact O-N 3.29Å
172	S	93.6	Very high	92.2	Very high	85 Å²	85	59.8 Å²	59.8	59%	0.594	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-28	-176.8	61.5	0	0	0	0	112.9	N168 T169 Y170 W174	N168-S172 WeakPolarHBondContact O-CA 3.34Å; N168-S172 PolarHBondContact O-N 2.97Å; T169-S172 WeakPolarHBondContact O-CB 3.29Å; Y170-S172 PolarHBondContact O-N 3.24Å; S172-W174 PolarHBondContact O-N 3.41Å
173	N	92.3	Very high	92.6	Very high	103 Å²	103	52.2 Å²	52.2	55%	0.551	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-2.7	173.7	71.8	-33.3	0	0	0	113.1	F171 L175 E176 G177	F171-N173 PolarHBondContact O-N 3.09Å; N173-L175 PolarHBondContact O-N 2.75Å; N173-E176 PolarHBondContact O-N 3.28Å; N173-G177 WeakPolarHBondContact O-CA 3.49Å; N173-G177 PolarHBondContact O-N 3.19Å
174	W	95.2	Very high	92.8	Very high	10 Å²	10	53.7 Å²	53.7	4%	0.038	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-54.8	178.2	178	83	0	0	0	109.2	A122 P124 F132 F171 S172 E176 G177 H181 R182	A122-W174 WeakPolarHBondContact O-CZ2 3.49Å; P124-W174 HydrophobicContact CB-CH2 4.07Å; F132-W174 HydrophobicContact CB-CD2 3.93Å; F132-W174 HydrophobicContact CB-CE3 3.96Å; F132-W174 HydrophobicContact CB-CH2 3.64Å; F132-W174 HydrophobicContact CB-CZ2 3.58Å; F132-W174 HydrophobicContact CB-CZ3 3.83Å; F132-W174 HydrophobicContact CD1-CB 4.05Å; F132-W174 AromaticContact CD1-CD2 3.51Å; F132-W174 HydrophobicContact CD1-CD2 3.51Å; F132-W174 AromaticContact CD1-CE3 3.74Å; F132-W174 HydrophobicContact CD1-CE3 3.74Å; F132-W174 AromaticContact CD1-CG 3.66Å; F132-W174 HydrophobicContact CD1-CG 3.66Å; F132-W174 HydrophobicContact CD1-CZ3 4.43Å; F132-W174 HydrophobicContact CE1-CB 4.14Å; F132-W174 HydrophobicContact CE1-CD2 4.44Å; F132-W174 HydrophobicContact CE1-CG 4.17Å; F132-W174 HydrophobicContact CG-CD2 4.15Å; F132-W174 HydrophobicContact CG-CE3 4.36Å; F171-W174 HydrophobicContact CB-CB 4.4Å; F171-W174 WeakPolarHBondContact O-CB 3.33Å; F171-W174 PolarHBondContact O-N 3.29Å; S172-W174 PolarHBondContact O-N 3.41Å; W174-E176 VanDerWaalsContact C-N 3.34Å; W174-E176 PolarHBondContact O-N 3.39Å; W174-G177 PolarHBondContact O-N 3.4Å; W174-H181 PolarHBondContact NE1-O 3Å; W174-R182 VanDerWaalsContact C-NH1 3.33Å; W174-R182 PolarHBondContact O-NH1 3.45Å; W174-R182 PolarHBondContact O-NH2 3.45Å
175	L	89.5	Confident	92.8	Very high	84 Å²	84	54 Å²	54	44%	0.44	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-35.1	-175	-176.4	63.2	0	0	0	114.4	D130 N173 R182	D130-L175 HydrophobicContact CB-CD1 4.07Å; D130-L175 HydrophobicContact CB-CD2 3.82Å; N173-L175 PolarHBondContact O-N 2.75Å; L175-R182 PolarHBondContact O-NH2 2.88Å
176	E	88.9	Confident	92.8	Very high	179 Å²	179	55.9 Å²	55.9	84%	0.836	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-13.3	-178.6	-62.8	177.1	177.1	0	0	112.9	N173 W174	N173-E176 PolarHBondContact O-N 3.28Å; W174-E176 VanDerWaalsContact C-N 3.34Å; W174-E176 PolarHBondContact O-N 3.39Å
177	G	87.6	Confident	92.9	Very high	30 Å²	30	56.7 Å²	56.7	31%	0.309	31%	0.308	S	S	.	.	S	Bend	trans	-70.9	176.2	-179.9	0	0	0	0	0	113.6	N173 W174	N173-G177 WeakPolarHBondContact O-CA 3.49Å; N173-G177 PolarHBondContact O-N 3.19Å; W174-G177 PolarHBondContact O-N 3.4Å
178	D	91.4	Very high	92.9	Very high	94 Å²	94	56.8 Å²	56.8	50%	0.503	31%	0.308	S	S	.	.			trans	-59.1	147.1	-178.4	-178.3	63.5	0	0	0	112.7	S180 H181	D178-S180 PolarHBondContact O-N 2.97Å; D178-S180 WeakPolarHBondContact OD2-CB 3.48Å; D178-S180 PolarHBondContact OD2-N 3.37Å; D178-S180 PolarHBondContact OD2-OG 3.11Å; D178-H181 WeakPolarHBondContact O-CB 3.16Å; D178-H181 PolarHBondContact O-CD2 3.4Å; D178-H181 PolarHBondContact O-N 3.13Å
179	I	90.4	Very high	92.6	Very high	134 Å²	134	56.3 Å²	56.3	69%	0.687	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-60.7	-20.1	-179.5	-169.4	162.2	0	0	0	112.9	H181 R182	I179-H181 PolarHBondContact O-N 3.34Å; I179-R182 HydrophobicContact CG1-CB 4.34Å; I179-R182 HydrophobicContact CG1-CG 4.41Å; I179-R182 VanDerWaalsContact O-CB 3.29Å; I179-R182 WeakPolarHBondContact O-CB 3.43Å; I179-R182 PolarHBondContact O-N 3.22Å
180	S	89.3	Confident	92.2	Very high	33 Å²	33	54.7 Å²	54.7	23%	0.231	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-61.4	-22.6	173.2	65.1	0	0	0	0	113.7	T121 D178 R182	T121-S180 PolarHBondContact OG1-O 3.47Å; D178-S180 PolarHBondContact O-N 2.97Å; D178-S180 WeakPolarHBondContact OD2-CB 3.48Å; D178-S180 PolarHBondContact OD2-N 3.37Å; D178-S180 PolarHBondContact OD2-OG 3.11Å; S180-R182 VanDerWaalsContact C-N 3.28Å
181	H	93.1	Very high	91.5	Very high	49 Å²	49	51.9 Å²	51.9	23%	0.227	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-80.1	-6.2	171.8	-61.1	-76.3	0	0	0	113.4	E119 T121 A122 W174 D178 I179	E119-H181 PolarHBondContact O-CE1 2.92Å; E119-H181 PolarHBondContact O-ND1 3.27Å; T121-H181 VanDerWaalsContact CA-O 3.32Å; T121-H181 WeakPolarHBondContact CA-O 3.44Å; A122-H181 PolarHBondContact N-O 3.22Å; W174-H181 PolarHBondContact NE1-O 3Å; D178-H181 WeakPolarHBondContact O-CB 3.16Å; D178-H181 PolarHBondContact O-CD2 3.4Å; D178-H181 PolarHBondContact O-N 3.13Å; I179-H181 PolarHBondContact O-N 3.34Å
182	R	93.9	Very high	90.6	Very high	49 Å²	49	56.8 Å²	56.8	19%	0.185	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-91	126.8	175.1	-61.7	-71.7	176.6	-69.6	-29.2	111	R117 W174 L175 I179 S180	R117-R182 PolarHBondContact NH1-O 3.43Å; W174-R182 VanDerWaalsContact C-NH1 3.33Å; W174-R182 PolarHBondContact O-NH1 3.45Å; W174-R182 PolarHBondContact O-NH2 3.45Å; L175-R182 PolarHBondContact O-NH2 2.88Å; I179-R182 HydrophobicContact CG1-CB 4.34Å; I179-R182 HydrophobicContact CG1-CG 4.41Å; I179-R182 VanDerWaalsContact O-CB 3.29Å; I179-R182 WeakPolarHBondContact O-CB 3.43Å; I179-R182 PolarHBondContact O-N 3.22Å; S180-R182 VanDerWaalsContact C-N 3.28Å
183	L	94.1	Very high	89.6	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.01	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-97.5	130.9	169.1	-161.9	63	0	0	0	109.7	L114 T121 A122 A123 P124 Y187	L114-L183 HydrophobicContact CD2-CD1 3.44Å; L114-L183 VanDerWaalsContact CD2-CD1 3.44Å; L114-L183 HydrophobicContact CD2-CD2 3.99Å; L114-L183 HydrophobicContact CD2-CG 4.35Å; T121-L183 HydrophobicContact CG2-CB 3.9Å; T121-L183 HydrophobicContact CG2-CD1 4.19Å; A122-L183 VanDerWaalsContact C-CB 3.44Å; A122-L183 WeakPolarHBondContact O-CB 3.35Å; A122-L183 PolarHBondContact O-N 2.87Å; A123-L183 WeakPolarHBondContact CA-O 3.24Å; A123-L183 HydrophobicContact CB-CB 4.2Å; P124-L183 WeakPolarHBondContact CD-O 3.19Å; L183-Y187 HydrophobicContact CD1-CD1 4.47Å; L183-Y187 HydrophobicContact CD1-CD2 3.67Å; L183-Y187 HydrophobicContact CD1-CE2 4.17Å; L183-Y187 HydrophobicContact CD1-CG 3.87Å; L183-Y187 HydrophobicContact CD2-CD2 4.45Å; L183-Y187 HydrophobicContact CD2-CG 4.01Å; L183-Y187 HydrophobicContact CG-CD2 3.78Å; L183-Y187 HydrophobicContact CG-CG 3.85Å
184	P	93.2	Very high	88.2	Confident	64 Å²	64	49 Å²	49	42%	0.416	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-56.1	143	171.7	-27.8	37.1	0	0	0	111.5	I186 Y187	P184-I186 HydrophobicContact CB-CG1 3.91Å; P184-I186 PolarHBondContact O-N 3.32Å; P184-Y187 HydrophobicContact CB-CD2 4.11Å; P184-Y187 HydrophobicContact CB-CE2 4.3Å; P184-Y187 HydrophobicContact CG-CD2 4.33Å; P184-Y187 HydrophobicContact CG-CE2 4.18Å; P184-Y187 PolarHBondContact O-N 2.92Å
185	C	90.4	Very high	86.5	Confident	53 Å²	53	54.6 Å²	54.6	36%	0.358	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-58.4	-19.6	-176.8	62.6	0	0	0	0	114	Y187 N188 C189	C185-Y187 PolarHBondContact O-N 3.28Å; C185-Y187 VanDerWaalsContact O-N 3.15Å; C185-N188 CarbonylContact O-C 3.44Å; C185-N188 PolarHBondContact O-N 3.46Å; C185-C189 WeakPolarHBondContact O-CA 3.35Å; C185-C189 WeakPolarHBondContact O-CB 3.46Å; C185-C189 PolarHBondContact O-N 2.94Å
186	I	91.5	Very high	84.7	Confident	40 Å²	40	53.7 Å²	53.7	21%	0.205	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-61.8	-18.3	174.8	62.6	168.5	0	0	0	114	P184 R216 V217	P184-I186 HydrophobicContact CB-CG1 3.91Å; P184-I186 PolarHBondContact O-N 3.32Å; I186-R216 HydrophobicContact CD1-CG 4.48Å; I186-R216 PolarHBondContact O-N 3.16Å; I186-V217 PolarHBondContact O-N 3.29Å
187	Y	96.3	Very high	82.7	Confident	18 Å²	18	49.4 Å²	49.4	7%	0.071	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-96	-0.4	175.5	-63.6	-90.3	0	0	0	113.5	V111 E113 L114 L183 P184 C185 R216 V217	V111-Y187 HydrophobicContact CG1-CD1 3.94Å; V111-Y187 HydrophobicContact CG1-CE1 4.03Å; E113-Y187 VanDerWaalsContact OE1-CE1 3.31Å; E113-Y187 WeakPolarHBondContact OE1-CE1 3.17Å; E113-Y187 PolarHBondContact OE1-OH 2.99Å; E113-Y187 VanDerWaalsContact OE1-OH 3.12Å; L114-Y187 HydrophobicContact CD1-CD1 4.21Å; L114-Y187 HydrophobicContact CD2-CD1 3.67Å; L114-Y187 HydrophobicContact CD2-CE1 3.88Å; L114-Y187 HydrophobicContact CD2-CG 4.2Å; L114-Y187 HydrophobicContact CG-CD1 4.15Å; L114-Y187 HydrophobicContact CG-CE1 4.32Å; L183-Y187 HydrophobicContact CD1-CD1 4.47Å; L183-Y187 HydrophobicContact CD1-CD2 3.67Å; L183-Y187 HydrophobicContact CD1-CE2 4.17Å; L183-Y187 HydrophobicContact CD1-CG 3.87Å; L183-Y187 HydrophobicContact CD2-CD2 4.45Å; L183-Y187 HydrophobicContact CD2-CG 4.01Å; L183-Y187 HydrophobicContact CG-CD2 3.78Å; L183-Y187 HydrophobicContact CG-CG 3.85Å; P184-Y187 HydrophobicContact CB-CD2 4.11Å; P184-Y187 HydrophobicContact CB-CE2 4.3Å; P184-Y187 HydrophobicContact CG-CD2 4.33Å; P184-Y187 HydrophobicContact CG-CE2 4.18Å; P184-Y187 PolarHBondContact O-N 2.92Å; C185-Y187 PolarHBondContact O-N 3.28Å; C185-Y187 VanDerWaalsContact O-N 3.15Å; Y187-R216 HydrophobicContact CD1-CB 4.25Å; Y187-R216 HydrophobicContact CE1-CB 4.48Å; Y187-R216 VanDerWaalsContact CE1-CD 3.48Å; Y187-R216 HydrophobicContact CE1-CG 4.4Å; Y187-V217 VanDerWaalsContact O-CB 3.31Å; Y187-V217 WeakPolarHBondContact O-CB 3.27Å
188	N	95.3	Very high	80.6	Confident	4 Å²	4	52 Å²	52	2%	0.021	28%	0.276	C	S	.	.	S	Bend	trans	-154	57.5	172.6	-170	4.2	0	0	0	108.4	A123 N133 V136 C185 I190 H219	A123-N188 HydrophobicContact CB-CB 3.63Å; N133-N188 PolarHBondContact O-ND2 3.3Å; N133-N188 PolarHBondContact OD1-ND2 3.41Å; V136-N188 HydrophobicContact CB-CB 4.06Å; V136-N188 HydrophobicContact CG2-CB 4.21Å; V136-N188 PolarHBondContact N-ND2 3.26Å; C185-N188 CarbonylContact O-C 3.44Å; C185-N188 PolarHBondContact O-N 3.46Å; N188-I190 PolarHBondContact O-N 3.17Å; N188-H219 WeakPolarHBondContact OD1-CB 3.3Å; N188-H219 PolarHBondContact OD1-ND1 2.67Å
189	C	90.7	Very high	78.5	Confident	6 Å²	6	48.5 Å²	48.5	4%	0.041	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	107.2	-170	-173.2	0	0	0	0	109.9	C185 C191 I215 V217 H219	C185-C189 WeakPolarHBondContact O-CA 3.35Å; C185-C189 WeakPolarHBondContact O-CB 3.46Å; C185-C189 PolarHBondContact O-N 2.94Å; C189-C191 PolarHBondContact O-N 2.78Å; C189-C191 PolarHBondContact O-SG 2.88Å; C189-C191 VanDerWaalsContact O-SG 3.33Å; C189-I215 HydrophobicContact CB-CD1 4.24Å; C189-I215 HydrophobicContact CB-CG1 4.06Å; C189-I215 HydrophobicContact CB-CG2 3.77Å; C189-I215 VanDerWaalsContact SG-CD1 3.53Å; C189-V217 WeakPolarHBondContact CB-O 3.32Å; C189-V217 PolarHBondContact N-O 3.07Å; C189-H219 PolarHBondContact O-N 2.82Å
190	I	87.4	Confident	76.2	Confident	19 Å²	19	48.6 Å²	48.6	10%	0.097	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	114.1	-178.4	-57.9	-60.7	0	0	0	110.7	P126 N188 R192 H219 A221	P126-I190 HydrophobicContact CG-CB 4.45Å; P126-I190 HydrophobicContact CG-CG1 4.12Å; N188-I190 PolarHBondContact O-N 3.17Å; I190-R192 HydrophobicContact CG2-CG 3.87Å; I190-H219 WeakPolarHBondContact CA-O 3.31Å; I190-H219 HydrophobicContact CD1-CB 4.26Å; I190-H219 WeakPolarHBondContact CD1-ND1 3.35Å; I190-A221 HydrophobicContact CD1-CB 3.77Å; I190-A221 HydrophobicContact CG2-CB 4.02Å
191	C	81.5	Confident	74.2	Confident	13 Å²	13	50.1 Å²	50.1	9%	0.088	26%	0.256	C	S	.	.			trans	-122.6	83.2	178.8	-63.2	0	0	0	0	109.3	C189 W208 V218 H219 F220	C189-C191 PolarHBondContact O-N 2.78Å; C189-C191 PolarHBondContact O-SG 2.88Å; C189-C191 VanDerWaalsContact O-SG 3.33Å; C191-W208 VanDerWaalsContact SG-CH2 3.51Å; C191-V218 HydrophobicContact CB-CG1 3.69Å; C191-H219 PolarHBondContact N-O 3.32Å; C191-F220 HydrophobicContact CB-CD1 4.26Å; C191-F220 HydrophobicContact CB-CE1 4.42Å; C191-F220 WeakPolarHBondContact O-CA 3.31Å; C191-F220 WeakPolarHBondContact O-CD1 3.43Å
192	R	76.8	Confident	72.2	Confident	123 Å²	123	50.8 Å²	50.8	46%	0.464	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-67.8	141.8	-178.5	-56.7	-174.4	72.5	97.5	-7.7	110.3	I190 A221	I190-R192 HydrophobicContact CG2-CG 3.87Å; R192-A221 WeakPolarHBondContact CA-O 3.23Å; R192-A221 WeakPolarHBondContact CG-O 3.31Å
193	I	73	Confident	70.2	Confident	9 Å²	9	55 Å²	55	5%	0.046	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-101.7	117.7	170.5	-57.3	179.1	0	0	0	106.6	F199 F220 I224 P226 K229 L261	I193-F199 HydrophobicContact CB-CE1 4.4Å; I193-F199 HydrophobicContact CG1-CE1 4.17Å; I193-F199 HydrophobicContact CG2-CE1 3.93Å; I193-F220 HydrophobicContact CD1-CD1 3.85Å; I193-F220 HydrophobicContact CD1-CE1 4.43Å; I193-F220 HydrophobicContact CD1-CG 4.43Å; I193-F220 HydrophobicContact CG1-CD1 3.94Å; I193-I224 HydrophobicContact CB-CB 4.23Å; I193-I224 HydrophobicContact CB-CG2 4Å; I193-I224 HydrophobicContact CG2-CB 4.24Å; I193-I224 HydrophobicContact CG2-CG2 3.56Å; I193-P226 HydrophobicContact CD1-CB 4.47Å; I193-P226 HydrophobicContact CD1-CG 4.08Å; I193-K229 HydrophobicContact CG2-CD 4.29Å; I193-K229 HydrophobicContact CG2-CG 3.67Å; I193-L261 HydrophobicContact CD1-CD1 4.01Å
194	S	63	Low	68.6	Low	16 Å²	16	57.1 Å²	57.1	11%	0.112	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-86.7	159.8	172.5	54.8	0	0	0	0	111.3	D196 N198 E200 K229	S194-D196 WeakPolarHBondContact CB-OD1 3.36Å; S194-D196 PolarHBondContact OG-O 2.8Å; S194-D196 PolarHBondContact OG-OD1 2.83Å; S194-N198 PolarHBondContact OG-O 2.9Å; S194-E200 PolarHBondContact OG-N 2.91Å; S194-K229 WeakPolarHBondContact O-CE 3.27Å; S194-K229 PolarHBondContact O-NZ 3.44Å
195	D	59.9	Low	67.2	Low	128 Å²	128	58.4 Å²	58.4	68%	0.684	30%	0.3	S	S	*	.	S	Bend	trans	-73.7	-37.6	175.5	54.2	-17.2	0	0	0	111.7	I224 K229	D195-I224 HydrophobicContact CB-CD1 3.79Å; D195-K229 VanDerWaalsContact CA-NZ 3.33Å; D195-K229 PolarHBondContact O-NZ 3.15Å
196	D	51.2	Low	66.1	Low	64 Å²	64	59.9 Å²	59.9	34%	0.342	31%	0.311	S	S	.	.	S	Bend	trans	-61.4	150.9	169.5	69.8	-4.3	0	0	0	111.5	S194 N198	S194-D196 WeakPolarHBondContact CB-OD1 3.36Å; S194-D196 PolarHBondContact OG-O 2.8Å; S194-D196 PolarHBondContact OG-OD1 2.83Å; D196-N198 PolarHBondContact O-N 2.72Å
197	T	47	Very low	65.1	Low	89 Å²	89	59.1 Å²	59.1	55%	0.546	31%	0.311	S	S	.	.	S	Bend	trans	-64.9	-9	-179.6	47.6	0	0	0	0	113.1	F199	T197-F199 PolarHBondContact O-N 2.91Å
198	N	42.1	Very low	63.7	Low	86 Å²	86	58.9 Å²	58.9	46%	0.46	31%	0.309	S	S	.	.	S	Bend	trans	-91	89.6	177.2	-68.9	-6	0	0	0	107.2	S194 D196 E200	S194-N198 PolarHBondContact OG-O 2.9Å; D196-N198 PolarHBondContact O-N 2.72Å; N198-E200 VanDerWaalsContact C-N 3.32Å; N198-E200 PolarHBondContact O-N 3.09Å
199	F	48	Very low	62.3	Low	19 Å²	19	59.9 Å²	59.9	8%	0.083	32%	0.316	C	S	.	.			trans	-43.1	103.1	166.6	-79	-86.2	0	0	0	108.4	I193 T197 F201 L261 L367	I193-F199 HydrophobicContact CB-CE1 4.4Å; I193-F199 HydrophobicContact CG1-CE1 4.17Å; I193-F199 HydrophobicContact CG2-CE1 3.93Å; T197-F199 PolarHBondContact O-N 2.91Å; F199-F201 HydrophobicContact CB-CE2 4.41Å; F199-F201 HydrophobicContact CB-CZ 4.44Å; F199-F201 WeakPolarHBondContact O-CD2 3.25Å; F199-F201 VanDerWaalsContact O-CE2 3.26Å; F199-F201 WeakPolarHBondContact O-CE2 3.34Å; F199-F201 PolarHBondContact O-N 3.18Å; F199-L261 HydrophobicContact CE1-CD2 3.57Å; F199-L261 HydrophobicContact CE2-CD2 4.36Å; F199-L261 HydrophobicContact CZ-CD2 3.23Å; F199-L367 VanDerWaalsContact CD2-O 3.25Å; F199-L367 WeakPolarHBondContact CD2-O 3.41Å; F199-L367 HydrophobicContact CE2-CB 4.18Å; F199-L367 HydrophobicContact CE2-CD2 3.98Å; F199-L367 WeakPolarHBondContact CE2-O 3.5Å
200	E	42.6	Very low	61.4	Low	137 Å²	137	67 Å²	67	64%	0.64	34%	0.343	S	S	*	.			trans	-67.3	97.5	178.5	-82.6	-168.6	149.2	0	0	105.3	S194 N198	S194-E200 PolarHBondContact OG-N 2.91Å; N198-E200 VanDerWaalsContact C-N 3.32Å; N198-E200 PolarHBondContact O-N 3.09Å
201	F	47.5	Very low	61	Low	64 Å²	64	71.9 Å²	71.9	28%	0.281	36%	0.364	S	S	.	.			trans	-57.3	157.5	-173.6	-74.6	-87.6	0	0	0	109.2	F199 T203 G370 Q371	F199-F201 HydrophobicContact CB-CE2 4.41Å; F199-F201 HydrophobicContact CB-CZ 4.44Å; F199-F201 WeakPolarHBondContact O-CD2 3.25Å; F199-F201 VanDerWaalsContact O-CE2 3.26Å; F199-F201 WeakPolarHBondContact O-CE2 3.34Å; F199-F201 PolarHBondContact O-N 3.18Å; F201-T203 PolarHBondContact O-N 2.96Å; F201-G370 WeakPolarHBondContact CE1-O 3.46Å; F201-Q371 HydrophobicContact CE1-CG 4.29Å
202	Y	51.6	Low	60.7	Low	63 Å²	63	71.4 Å²	71.4	25%	0.247	36%	0.361	C	S	.	.			trans	-28.7	128.7	152.7	-164.5	-96.6	0	0	0	109.8	S204 A207 W208	Y202-S204 CarbonylContact O-C 3.58Å; Y202-S204 PolarHBondContact O-N 3.2Å; Y202-A207 HydrophobicContact CD1-CB 4.36Å; Y202-A207 HydrophobicContact CE1-CB 4.13Å; Y202-W208 HydrophobicContact CG-CE3 4.31Å
203	T	50.4	Low	60.7	Low	139 Å²	139	65.6 Å²	65.6	85%	0.853	34%	0.339	S	S	*	.	S	Bend	trans	-51.4	-20.3	-165.1	52.8	0	0	0	0	114.3	F201	F201-T203 PolarHBondContact O-N 2.96Å
204	S	61.2	Low	61.3	Low	46 Å²	46	67.7 Å²	67.7	32%	0.322	36%	0.355	S	S	.	.			trans	-117.2	105.1	170.3	179	0	0	0	0	112.2	Y202 S206 A207 W208	Y202-S204 CarbonylContact O-C 3.58Å; Y202-S204 PolarHBondContact O-N 3.2Å; S204-S206 VanDerWaalsContact C-N 3.26Å; S204-S206 PolarHBondContact O-N 2.95Å; S204-A207 WeakPolarHBondContact O-CB 3.31Å; S204-A207 PolarHBondContact O-N 3.05Å; S204-A207 WeakPolarHBondContact OG-CB 3.49Å; S204-A207 PolarHBondContact OG-N 3.11Å; S204-A207 VanDerWaalsContact OG-N 3.12Å; S204-W208 PolarHBondContact O-N 3.07Å; S204-W208 VanDerWaalsContact O-N 3.08Å
205	R	63.1	Low	62.4	Low	91 Å²	91	67.2 Å²	67.2	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-57.5	-37.8	169.5	-177.5	174.5	-180	175.8	-1.1	112.9	A207 W208 V209 H382	R205-A207 VanDerWaalsContact C-N 3.33Å; R205-W208 WeakPolarHBondContact O-CB 3.19Å; R205-W208 PolarHBondContact O-N 2.95Å; R205-V209 WeakPolarHBondContact O-CG2 3.33Å; R205-V209 PolarHBondContact O-N 3.11Å; R205-H382 PolarHBondContact NH1-CD2 3.27Å; R205-H382 PolarHBondContact NH2-CD2 3.2Å; R205-H382 PolarHBondContact NH2-ND1 2.95Å; R205-H382 PolarHBondContact NH2-NE2 3.22Å
206	S	68	Low	64	Low	83 Å²	83	64.3 Å²	64.3	58%	0.58	33%	0.331	S	S	*	.	H	α-helix	trans	-65.4	-38.6	177.6	-48.6	0	0	0	0	111.5	S204 W208 V209 Y210	S204-S206 VanDerWaalsContact C-N 3.26Å; S204-S206 PolarHBondContact O-N 2.95Å; S206-W208 VanDerWaalsContact C-N 3.3Å; S206-W208 PolarHBondContact O-N 2.84Å; S206-V209 PolarHBondContact O-N 3.05Å; S206-Y210 WeakPolarHBondContact O-CB 3.42Å; S206-Y210 PolarHBondContact O-N 2.8Å
207	A	69.6	Low	66.1	Low	24 Å²	24	61.3 Å²	61.3	20%	0.198	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-38.1	173.4	0	0	0	0	0	111.3	Y202 S204 R205 Y210 F211	Y202-A207 HydrophobicContact CD1-CB 4.36Å; Y202-A207 HydrophobicContact CE1-CB 4.13Å; S204-A207 WeakPolarHBondContact O-CB 3.31Å; S204-A207 PolarHBondContact O-N 3.05Å; S204-A207 WeakPolarHBondContact OG-CB 3.49Å; S204-A207 PolarHBondContact OG-N 3.11Å; S204-A207 VanDerWaalsContact OG-N 3.12Å; R205-A207 VanDerWaalsContact C-N 3.33Å; A207-Y210 PolarHBondContact O-N 2.75Å; A207-F211 HydrophobicContact CB-CD2 4.12Å; A207-F211 WeakPolarHBondContact O-CA 3.47Å; A207-F211 VanDerWaalsContact O-CB 3.31Å; A207-F211 WeakPolarHBondContact O-CB 3.36Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 2.68Å
208	W	67	Low	68.2	Low	13 Å²	13	57 Å²	57	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-47.4	175.5	-167.3	-101.2	0	0	0	112.1	C191 Y202 S204 R205 S206 Y210 G212 I215 G370 F379	C191-W208 VanDerWaalsContact SG-CH2 3.51Å; Y202-W208 HydrophobicContact CG-CE3 4.31Å; S204-W208 PolarHBondContact O-N 3.07Å; S204-W208 VanDerWaalsContact O-N 3.08Å; R205-W208 WeakPolarHBondContact O-CB 3.19Å; R205-W208 PolarHBondContact O-N 2.95Å; S206-W208 VanDerWaalsContact C-N 3.3Å; S206-W208 PolarHBondContact O-N 2.84Å; W208-Y210 PolarHBondContact O-N 3.3Å; W208-G212 VanDerWaalsContact O-CA 3.29Å; W208-G212 WeakPolarHBondContact O-CA 3.33Å; W208-G212 PolarHBondContact O-N 2.65Å; W208-I215 HydrophobicContact CE3-CD1 4.1Å; W208-I215 HydrophobicContact CH2-CD1 3.71Å; W208-I215 HydrophobicContact CZ3-CD1 3.48Å; W208-I215 VanDerWaalsContact CZ3-CD1 3.48Å; W208-G370 VanDerWaalsContact CD1-O 3.31Å; W208-G370 PolarHBondContact NE1-O 3.21Å; W208-F379 AromaticContact CD1-CD1 3.45Å; W208-F379 VanDerWaalsContact CD1-CD1 3.45Å; W208-F379 AromaticContact CD1-CE1 3.93Å; W208-F379 AromaticContact CD1-CG 3.51Å; W208-F379 HydrophobicContact CD2-CE1 4.36Å; W208-F379 HydrophobicContact CD2-CZ 4.38Å; W208-F379 AromaticContact CE2-CD1 3.7Å; W208-F379 AromaticContact CE2-CE1 3.29Å; W208-F379 AromaticContact CE2-CZ 3.56Å; W208-F379 HydrophobicContact CG-CD1 4.43Å; W208-F379 HydrophobicContact CG-CG 4.3Å; W208-F379 HydrophobicContact CH2-CZ 4.27Å; W208-F379 HydrophobicContact CZ2-CD1 4.26Å; W208-F379 AromaticContact CZ2-CE1 3.39Å; W208-F379 HydrophobicContact CZ2-CE1 3.39Å; W208-F379 HydrophobicContact CZ2-CE2 4.43Å; W208-F379 AromaticContact CZ2-CZ 3.5Å; W208-F379 HydrophobicContact CZ2-CZ 3.5Å; W208-F379 VanDerWaalsContact CZ2-CZ 3.5Å; W208-F379 AromaticContact NE1-CD1 2.93Å; W208-F379 AromaticContact NE1-CE1 3.02Å; W208-F379 AromaticContact NE1-CG 3.5Å; W208-F379 AromaticContact NE1-CZ 3.72Å; W208-F379 WeakPolarHBondContact O-CD2 3.28Å
209	V	66.4	Low	70.7	Confident	26 Å²	26	53.3 Å²	53.3	16%	0.158	27%	0.268	C	S	.	.	H	α-helix	trans	-55	-51.7	172.1	170	0	0	0	0	111.2	R205 S206 R378 F379 E381	R205-V209 WeakPolarHBondContact O-CG2 3.33Å; R205-V209 PolarHBondContact O-N 3.11Å; S206-V209 PolarHBondContact O-N 3.05Å; V209-R378 CarbonylContact O-C 3.51Å; V209-R378 VanDerWaalsContact O-C 3.28Å; V209-R378 WeakPolarHBondContact O-CA 3.49Å; V209-R378 WeakPolarHBondContact O-CB 3.42Å; V209-F379 WeakPolarHBondContact CG1-O 3.35Å; V209-F379 PolarHBondContact O-N 3.35Å; V209-E381 HydrophobicContact CG1-CG 4.33Å; V209-E381 HydrophobicContact CG2-CG 3.67Å
210	Y	72.3	Confident	72.7	Confident	154 Å²	154	52.5 Å²	52.5	60%	0.604	26%	0.264	S	S	*	.	H	α-helix	trans	-79	-46.1	-171.7	-165.3	-88.3	0	0	0	113.6	S206 A207 W208	S206-Y210 WeakPolarHBondContact O-CB 3.42Å; S206-Y210 PolarHBondContact O-N 2.8Å; A207-Y210 PolarHBondContact O-N 2.75Å; W208-Y210 PolarHBondContact O-N 3.3Å
211	F	78.4	Confident	74.7	Confident	122 Å²	122	46.5 Å²	46.5	54%	0.535	24%	0.238	S	C	.	.	H	α-helix	trans	-102	-18.9	-170.5	-62.2	-71.6	0	0	0	114.1	A207 G213 S214	A207-F211 HydrophobicContact CB-CD2 4.12Å; A207-F211 WeakPolarHBondContact O-CA 3.47Å; A207-F211 VanDerWaalsContact O-CB 3.31Å; A207-F211 WeakPolarHBondContact O-CB 3.36Å; A207-F211 WeakPolarHBondContact O-CD2 3.47Å; A207-F211 PolarHBondContact O-N 2.68Å; F211-G213 PolarHBondContact O-N 2.87Å; F211-G213 VanDerWaalsContact O-N 3.08Å; F211-S214 WeakPolarHBondContact O-CA 3.44Å; F211-S214 WeakPolarHBondContact O-CB 3.02Å; F211-S214 PolarHBondContact O-N 2.69Å; F211-S214 PolarHBondContact O-OG 3.3Å
212	G	75.5	Confident	76.3	Confident	3 Å²	3	44.5 Å²	44.5	3%	0.031	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-59.5	-35.1	-165.2	0	0	0	0	0	112	W208 S214 I215 F379	W208-G212 VanDerWaalsContact O-CA 3.29Å; W208-G212 WeakPolarHBondContact O-CA 3.33Å; W208-G212 PolarHBondContact O-N 2.65Å; G212-S214 PolarHBondContact O-N 3.48Å; G212-I215 VanDerWaalsContact O-CB 3.23Å; G212-I215 WeakPolarHBondContact O-CB 3.24Å; G212-I215 VanDerWaalsContact O-CD1 3.31Å; G212-I215 WeakPolarHBondContact O-CD1 3.19Å; G212-I215 WeakPolarHBondContact O-CG1 3.41Å; G212-I215 PolarHBondContact O-N 3.47Å; G212-F379 VanDerWaalsContact CA-CD2 3.47Å; G212-F379 WeakPolarHBondContact O-CE2 3.42Å
213	G	77.5	Confident	77.5	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.01	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-66.3	-11.8	-178.7	0	0	0	0	0	112.6	F211 I215 R252 N377	F211-G213 PolarHBondContact O-N 2.87Å; F211-G213 VanDerWaalsContact O-N 3.08Å; G213-I215 VanDerWaalsContact C-N 3.35Å; G213-R252 PolarHBondContact O-NE 3.08Å; G213-R252 PolarHBondContact O-NH2 3.19Å; G213-N377 WeakPolarHBondContact CA-O 3.34Å; G213-N377 PolarHBondContact N-O 2.88Å
214	S	84.1	Confident	78.9	Confident	54 Å²	54	41.6 Å²	41.6	38%	0.378	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-80.5	-9.7	170.5	-53.1	0	0	0	0	113.9	F211 G212 R216	F211-S214 WeakPolarHBondContact O-CA 3.44Å; F211-S214 WeakPolarHBondContact O-CB 3.02Å; F211-S214 PolarHBondContact O-N 2.69Å; F211-S214 PolarHBondContact O-OG 3.3Å; G212-S214 PolarHBondContact O-N 3.48Å; S214-R216 PolarHBondContact O-N 3.34Å
215	I	87.9	Confident	80.1	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	21%	0.213	C	C	.	.			trans	-58.1	132.4	178.8	-64.1	163.8	0	0	0	109.9	L108 Q109 C189 W208 G212 G213 V218	L108-I215 HydrophobicContact CD1-CB 4.25Å; L108-I215 HydrophobicContact CD1-CG2 3.88Å; Q109-I215 PolarHBondContact NE2-O 2.59Å; C189-I215 HydrophobicContact CB-CD1 4.24Å; C189-I215 HydrophobicContact CB-CG1 4.06Å; C189-I215 HydrophobicContact CB-CG2 3.77Å; C189-I215 VanDerWaalsContact SG-CD1 3.53Å; W208-I215 HydrophobicContact CE3-CD1 4.1Å; W208-I215 HydrophobicContact CH2-CD1 3.71Å; W208-I215 HydrophobicContact CZ3-CD1 3.48Å; W208-I215 VanDerWaalsContact CZ3-CD1 3.48Å; G212-I215 VanDerWaalsContact O-CB 3.23Å; G212-I215 WeakPolarHBondContact O-CB 3.24Å; G212-I215 VanDerWaalsContact O-CD1 3.31Å; G212-I215 WeakPolarHBondContact O-CD1 3.19Å; G212-I215 WeakPolarHBondContact O-CG1 3.41Å; G212-I215 PolarHBondContact O-N 3.47Å; G213-I215 VanDerWaalsContact C-N 3.35Å; I215-V218 HydrophobicContact CG2-CG2 3.78Å
216	R	92.6	Very high	81.1	Confident	68 Å²	68	35.9 Å²	35.9	26%	0.257	20%	0.197	S	C	.	.			trans	-108.5	-38.9	176.7	-59.3	-157.9	-174.5	-158.1	15.6	112.3	L108 Q109 N110 V111 E113 I186 Y187 S214	L108-R216 PolarHBondContact N-O 3.38Å; Q109-R216 HydrophobicContact CB-CG 4.44Å; N110-R216 PolarHBondContact O-NH1 3.33Å; V111-R216 HydrophobicContact CG1-CB 3.69Å; V111-R216 HydrophobicContact CG1-CG 4.45Å; E113-R216 IonicContact OE1-CZ 3.9Å; E113-R216 VanDerWaalsContact OE1-CZ 3.25Å; E113-R216 IonicContact OE1-NE 3.58Å; E113-R216 IonicContact OE1-NH1 2.72Å; E113-R216 PolarHBondContact OE1-NH1 3.43Å; E113-R216 IonicContact OE1-NH2 3.01Å; E113-R216 IonicContact OE2-NH1 3.38Å; I186-R216 HydrophobicContact CD1-CG 4.48Å; I186-R216 PolarHBondContact O-N 3.16Å; Y187-R216 HydrophobicContact CD1-CB 4.25Å; Y187-R216 HydrophobicContact CE1-CB 4.48Å; Y187-R216 VanDerWaalsContact CE1-CD 3.48Å; Y187-R216 HydrophobicContact CE1-CG 4.4Å; S214-R216 PolarHBondContact O-N 3.34Å
217	V	95	Very high	82	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.9	175.7	-173	0	0	0	0	109.1	M101 T105 L106 V107 V111 V136 I186 Y187 C189	M101-V217 HydrophobicContact CE-CB 4.37Å; M101-V217 HydrophobicContact CE-CG1 3.5Å; M101-V217 HydrophobicContact CE-CG2 3.93Å; T105-V217 HydrophobicContact CG2-CG1 4.47Å; L106-V217 WeakPolarHBondContact O-CA 3.06Å; V107-V217 HydrophobicContact CG2-CG2 4.39Å; V111-V217 HydrophobicContact CG1-CG2 4.1Å; V111-V217 HydrophobicContact CG2-CG2 4.42Å; V136-V217 HydrophobicContact CG2-CG1 4.08Å; I186-V217 PolarHBondContact O-N 3.29Å; Y187-V217 VanDerWaalsContact O-CB 3.31Å; Y187-V217 WeakPolarHBondContact O-CB 3.27Å; C189-V217 WeakPolarHBondContact CB-O 3.32Å; C189-V217 PolarHBondContact N-O 3.07Å
218	V	91.5	Very high	82.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.7	170.4	168.8	0	0	0	0	108	T105 L106 L108 C191 I215 F220 M260	T105-V218 CarbonylContact C-O 3.56Å; T105-V218 WeakPolarHBondContact CA-O 3.43Å; L106-V218 HydrophobicContact CB-CB 4.22Å; L106-V218 PolarHBondContact N-O 3.48Å; L106-V218 PolarHBondContact O-N 3.27Å; L108-V218 HydrophobicContact CD1-CG2 3.89Å; L108-V218 HydrophobicContact CD2-CG2 4.5Å; L108-V218 HydrophobicContact CG-CG2 4.28Å; C191-V218 HydrophobicContact CB-CG1 3.69Å; I215-V218 HydrophobicContact CG2-CG2 3.78Å; V218-F220 HydrophobicContact CG1-CD1 4.23Å; V218-F220 HydrophobicContact CG1-CD2 4.08Å; V218-F220 HydrophobicContact CG1-CE1 3.89Å; V218-F220 HydrophobicContact CG1-CE2 3.73Å; V218-F220 HydrophobicContact CG1-CG 4.33Å; V218-F220 HydrophobicContact CG1-CZ 3.63Å; V218-M260 HydrophobicContact CG2-CB 4.29Å; V218-M260 HydrophobicContact CG2-CG 3.89Å; V218-M260 HydrophobicContact CG2-SD 3.97Å
219	H	93.6	Very high	82.8	Confident	7 Å²	7	35 Å²	35	3%	0.032	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	111.2	173.8	177.7	-171	0	0	0	108.6	D104 T105 N133 N188 C189 I190 C191 A221	D104-H219 IonicContact OD1-CD2 2.59Å; D104-H219 PolarHBondContact OD1-CD2 3.02Å; D104-H219 IonicContact OD1-NE2 3.47Å; D104-H219 PolarHBondContact OD1-NE2 3.26Å; D104-H219 IonicContact OD2-NE2 3.48Å; T105-H219 HydrophobicContact CG2-CB 4.05Å; N133-H219 PolarHBondContact OD1-CE1 2.84Å; N133-H219 PolarHBondContact OD1-ND1 2.77Å; N188-H219 WeakPolarHBondContact OD1-CB 3.3Å; N188-H219 PolarHBondContact OD1-ND1 2.67Å; C189-H219 PolarHBondContact O-N 2.82Å; I190-H219 WeakPolarHBondContact CA-O 3.31Å; I190-H219 HydrophobicContact CD1-CB 4.26Å; I190-H219 WeakPolarHBondContact CD1-ND1 3.35Å; C191-H219 PolarHBondContact N-O 3.32Å; H219-A221 PolarHBondContact O-N 2.86Å
220	F	90.2	Very high	82.8	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.009	18%	0.182	C	C	.	.			trans	-78.1	57.8	178.6	-62.8	-78.3	0	0	0	111.6	D104 L106 C191 I193 V218 P226 M260 W264	D104-F220 HydrophobicContact CB-CB 4.49Å; D104-F220 WeakPolarHBondContact O-CB 3.37Å; D104-F220 VanDerWaalsContact O-CD2 3.31Å; D104-F220 WeakPolarHBondContact O-CD2 3.09Å; D104-F220 PolarHBondContact O-N 3.07Å; L106-F220 HydrophobicContact CB-CE2 3.88Å; L106-F220 HydrophobicContact CD2-CE2 4.04Å; L106-F220 HydrophobicContact CD2-CZ 4.21Å; C191-F220 HydrophobicContact CB-CD1 4.26Å; C191-F220 HydrophobicContact CB-CE1 4.42Å; C191-F220 WeakPolarHBondContact O-CA 3.31Å; C191-F220 WeakPolarHBondContact O-CD1 3.43Å; I193-F220 HydrophobicContact CD1-CD1 3.85Å; I193-F220 HydrophobicContact CD1-CE1 4.43Å; I193-F220 HydrophobicContact CD1-CG 4.43Å; I193-F220 HydrophobicContact CG1-CD1 3.94Å; V218-F220 HydrophobicContact CG1-CD1 4.23Å; V218-F220 HydrophobicContact CG1-CD2 4.08Å; V218-F220 HydrophobicContact CG1-CE1 3.89Å; V218-F220 HydrophobicContact CG1-CE2 3.73Å; V218-F220 HydrophobicContact CG1-CG 4.33Å; V218-F220 HydrophobicContact CG1-CZ 3.63Å; F220-P226 HydrophobicContact CB-CG 3.93Å; F220-P226 HydrophobicContact CD1-CG 4.05Å; F220-P226 HydrophobicContact CD2-CG 3.37Å; F220-P226 HydrophobicContact CE1-CG 4.4Å; F220-P226 HydrophobicContact CE2-CG 3.78Å; F220-P226 HydrophobicContact CG-CG 3.52Å; F220-P226 HydrophobicContact CZ-CG 4.27Å; F220-M260 HydrophobicContact CZ-CB 4.34Å; F220-W264 HydrophobicContact CE2-CB 4.42Å; F220-W264 HydrophobicContact CE2-CG 4.45Å; F220-W264 HydrophobicContact CZ-CB 4.48Å
221	A	84.9	Confident	82.2	Confident	11 Å²	11	30.1 Å²	30.1	9%	0.091	17%	0.167	C	C	.	.			trans	-65.5	147.7	-179.3	0	0	0	0	0	111.1	I190 R192 H219	I190-A221 HydrophobicContact CD1-CB 3.77Å; I190-A221 HydrophobicContact CG2-CB 4.02Å; R192-A221 WeakPolarHBondContact CA-O 3.23Å; R192-A221 WeakPolarHBondContact CG-O 3.31Å; H219-A221 PolarHBondContact O-N 2.86Å
222	G	82.5	Confident	81.2	Confident	23 Å²	23	24.3 Å²	24.3	24%	0.237	14%	0.142	C	C	.	.	S	Bend	trans	116.4	177.7	-175.3	0	0	0	0	0	112.9	K225	G222-K225 WeakPolarHBondContact O-CE 3.38Å; G222-K225 PolarHBondContact O-NZ 3.18Å
223	P	76.7	Confident	80.4	Confident	107 Å²	107	24.7 Å²	24.7	70%	0.695	15%	0.145	S	C	*	.	S	Bend	trans	-76.2	-29.5	-173.5	29.2	-34	0	0	0	113
224	I	79.7	Confident	79.1	Confident	34 Å²	34	27.3 Å²	27.3	17%	0.174	16%	0.156	C	C	.	.			trans	-91.6	122.1	179.8	-59.1	170.3	0	0	0	108.4	I193 D195 H228 K229	I193-I224 HydrophobicContact CB-CB 4.23Å; I193-I224 HydrophobicContact CB-CG2 4Å; I193-I224 HydrophobicContact CG2-CB 4.24Å; I193-I224 HydrophobicContact CG2-CG2 3.56Å; D195-I224 HydrophobicContact CB-CD1 3.79Å; I224-H228 HydrophobicContact CG2-CB 4.11Å; I224-K229 HydrophobicContact CG2-CD 4.32Å; I224-K229 HydrophobicContact CG2-CG 3.92Å
225	K	85.8	Confident	77.5	Confident	16 Å²	16	25 Å²	25	7%	0.07	14%	0.14	C	C	.	.			trans	-102.9	161	-179.7	-53.7	-58.9	-178.6	-173.2	0	110.2	D104 G222 W227 H228	D104-K225 HydrophobicContact CB-CD 4.01Å; D104-K225 WeakPolarHBondContact OD2-CE 3.1Å; D104-K225 IonicContact OD2-NZ 2.65Å; D104-K225 PolarHBondContact OD2-NZ 3.48Å; G222-K225 WeakPolarHBondContact O-CE 3.38Å; G222-K225 PolarHBondContact O-NZ 3.18Å; K225-W227 HydrophobicContact CB-CD2 3.6Å; K225-W227 HydrophobicContact CB-CE3 3.96Å; K225-W227 HydrophobicContact CB-CG 4.22Å; K225-W227 HydrophobicContact CB-CH2 3.86Å; K225-W227 HydrophobicContact CB-CZ2 3.46Å; K225-W227 VanDerWaalsContact CB-CZ2 3.46Å; K225-W227 HydrophobicContact CB-CZ3 4.08Å; K225-W227 HydrophobicContact CD-CH2 4.36Å; K225-W227 HydrophobicContact CD-CZ2 4.24Å; K225-W227 HydrophobicContact CG-CH2 4.02Å; K225-W227 HydrophobicContact CG-CZ2 3.48Å; K225-W227 VanDerWaalsContact CG-CZ2 3.48Å; K225-W227 PolarHBondContact O-N 3.47Å; K225-H228 PolarHBondContact N-ND1 3.21Å; K225-H228 VanDerWaalsContact N-ND1 3.15Å; K225-H228 WeakPolarHBondContact O-CB 3.06Å; K225-H228 PolarHBondContact O-N 3.47Å
226	P	84.6	Confident	75.8	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-52.9	-39.9	179.8	-30.6	37.4	0	0	0	114.1	I193 F220 H228 K229 L261 W264 W265	I193-P226 HydrophobicContact CD1-CB 4.47Å; I193-P226 HydrophobicContact CD1-CG 4.08Å; F220-P226 HydrophobicContact CB-CG 3.93Å; F220-P226 HydrophobicContact CD1-CG 4.05Å; F220-P226 HydrophobicContact CD2-CG 3.37Å; F220-P226 HydrophobicContact CE1-CG 4.4Å; F220-P226 HydrophobicContact CE2-CG 3.78Å; F220-P226 HydrophobicContact CG-CG 3.52Å; F220-P226 HydrophobicContact CZ-CG 4.27Å; P226-H228 PolarHBondContact O-N 3.27Å; P226-K229 PolarHBondContact O-N 3.48Å; P226-K229 VanDerWaalsContact O-N 3.1Å; P226-L261 HydrophobicContact CB-CD1 3.69Å; P226-L261 HydrophobicContact CG-CD1 4.26Å; P226-W264 HydrophobicContact CB-CD2 3.28Å; P226-W264 VanDerWaalsContact CB-CE2 3.46Å; P226-W264 HydrophobicContact CB-CE3 3.58Å; P226-W264 HydrophobicContact CB-CG 3.68Å; P226-W264 HydrophobicContact CB-CH2 4.25Å; P226-W264 HydrophobicContact CB-CZ2 3.96Å; P226-W264 HydrophobicContact CB-CZ3 4.06Å; P226-W264 HydrophobicContact CG-CD2 4.14Å; P226-W264 HydrophobicContact CG-CG 4.1Å; P226-W265 WeakPolarHBondContact O-CZ2 3.31Å; P226-W265 PolarHBondContact O-NE1 3.24Å
227	W	86.1	Confident	73.6	Confident	1 Å²	1	23 Å²	23	0%	0.004	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-67.6	-16.4	178.2	51.7	91	0	0	0	114.3	Y15 V17 D104 K225 W264 L282	Y15-W227 HydrophobicContact CD1-CH2 4.32Å; Y15-W227 HydrophobicContact CD1-CZ2 4.33Å; Y15-W227 HydrophobicContact CE1-CZ2 4.49Å; Y15-W227 HydrophobicContact CG-CZ2 4.48Å; V17-W227 HydrophobicContact CG1-CB 4.4Å; D104-W227 HydrophobicContact CB-CH2 3.95Å; D104-W227 HydrophobicContact CB-CZ3 4.24Å; K225-W227 HydrophobicContact CB-CD2 3.6Å; K225-W227 HydrophobicContact CB-CE3 3.96Å; K225-W227 HydrophobicContact CB-CG 4.22Å; K225-W227 HydrophobicContact CB-CH2 3.86Å; K225-W227 HydrophobicContact CB-CZ2 3.46Å; K225-W227 VanDerWaalsContact CB-CZ2 3.46Å; K225-W227 HydrophobicContact CB-CZ3 4.08Å; K225-W227 HydrophobicContact CD-CH2 4.36Å; K225-W227 HydrophobicContact CD-CZ2 4.24Å; K225-W227 HydrophobicContact CG-CH2 4.02Å; K225-W227 HydrophobicContact CG-CZ2 3.48Å; K225-W227 VanDerWaalsContact CG-CZ2 3.48Å; K225-W227 PolarHBondContact O-N 3.47Å; W227-W264 HydrophobicContact CB-CH2 3.84Å; W227-W264 HydrophobicContact CB-CZ2 4.37Å; W227-W264 HydrophobicContact CE3-CH2 4.38Å; W227-W264 AromaticContact CE3-CZ2 3.74Å; W227-W264 HydrophobicContact CE3-CZ2 3.74Å; W227-L282 HydrophobicContact CB-CD2 3.84Å
228	H	80	Confident	71.6	Confident	63 Å²	63	28.5 Å²	28.5	29%	0.292	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-79.4	-18.7	172.7	-58.1	156.2	0	0	0	112.8	E14 I224 K225 P226	E14-H228 IonicContact OE2-NE2 2.86Å; I224-H228 HydrophobicContact CG2-CB 4.11Å; K225-H228 PolarHBondContact N-ND1 3.21Å; K225-H228 VanDerWaalsContact N-ND1 3.15Å; K225-H228 WeakPolarHBondContact O-CB 3.06Å; K225-H228 PolarHBondContact O-N 3.47Å; P226-H228 PolarHBondContact O-N 3.27Å
229	K	73.7	Confident	69.8	Low	39 Å²	39	30.8 Å²	30.8	17%	0.17	18%	0.181	C	C	.	.			trans	-104.2	67.3	-176.9	-69.4	-67.8	-172.1	154.4	0	111.8	I193 S194 D195 I224 P226 S231 A232 L261 W265	I193-K229 HydrophobicContact CG2-CD 4.29Å; I193-K229 HydrophobicContact CG2-CG 3.67Å; S194-K229 WeakPolarHBondContact O-CE 3.27Å; S194-K229 PolarHBondContact O-NZ 3.44Å; D195-K229 VanDerWaalsContact CA-NZ 3.33Å; D195-K229 PolarHBondContact O-NZ 3.15Å; I224-K229 HydrophobicContact CG2-CD 4.32Å; I224-K229 HydrophobicContact CG2-CG 3.92Å; P226-K229 PolarHBondContact O-N 3.48Å; P226-K229 VanDerWaalsContact O-N 3.1Å; K229-S231 PolarHBondContact O-N 3.49Å; K229-S231 VanDerWaalsContact O-N 3.16Å; K229-A232 HydrophobicContact CB-CB 4.27Å; K229-A232 VanDerWaalsContact O-CB 3.28Å; K229-A232 WeakPolarHBondContact O-CB 3.43Å; K229-A232 PolarHBondContact O-N 3.32Å; K229-L261 HydrophobicContact CB-CD2 4.44Å; K229-W265 WeakPolarHBondContact O-CZ2 3.05Å; K229-W265 PolarHBondContact O-NE1 3.26Å; K229-W265 VanDerWaalsContact O-NE1 3.15Å
230	T	66.5	Low	67.9	Low	34 Å²	34	30.5 Å²	30.5	21%	0.209	18%	0.179	C	C	.	.	H	α-helix	trans	-59.5	-24.7	175.9	56.4	0	0	0	0	113.3	A232 A233 K234 W265 I285	T230-A232 PolarHBondContact O-N 2.93Å; T230-A233 WeakPolarHBondContact O-CA 3.35Å; T230-A233 WeakPolarHBondContact O-CB 3.25Å; T230-A233 PolarHBondContact O-N 3.27Å; T230-K234 PolarHBondContact O-N 2.89Å; T230-W265 HydrophobicContact CG2-CH2 4.02Å; T230-W265 HydrophobicContact CG2-CZ2 4.35Å; T230-I285 HydrophobicContact CG2-CD1 4.48Å
231	S	59	Low	66.5	Low	42 Å²	42	33.4 Å²	33.4	29%	0.294	19%	0.192	S	C	.	.	H	α-helix	trans	-63.6	-23	171	59.7	0	0	0	0	113.8	K229 A233 K234 T235 T362	K229-S231 PolarHBondContact O-N 3.49Å; K229-S231 VanDerWaalsContact O-N 3.16Å; S231-A233 VanDerWaalsContact C-N 3.34Å; S231-K234 WeakPolarHBondContact O-CB 3.25Å; S231-T235 PolarHBondContact O-N 3Å; S231-T235 PolarHBondContact O-OG1 2.8Å; S231-T362 PolarHBondContact O-OG1 3.26Å; S231-T362 VanDerWaalsContact O-OG1 3.07Å
232	A	58.5	Low	65.3	Low	1 Å²	1	39.5 Å²	39.5	1%	0.008	21%	0.213	C	C	.	.	H	α-helix	trans	-76.6	-23.7	170.8	0	0	0	0	0	112.5	K229 T230 T235 C236 L261	K229-A232 HydrophobicContact CB-CB 4.27Å; K229-A232 VanDerWaalsContact O-CB 3.28Å; K229-A232 WeakPolarHBondContact O-CB 3.43Å; K229-A232 PolarHBondContact O-N 3.32Å; T230-A232 PolarHBondContact O-N 2.93Å; A232-T235 VanDerWaalsContact C-OG1 3.24Å; A232-T235 WeakPolarHBondContact CA-OG1 3.4Å; A232-T235 PolarHBondContact O-OG1 3.41Å; A232-C236 PolarHBondContact O-N 3.31Å; A232-L261 HydrophobicContact CB-CD2 3.25Å; A232-L261 HydrophobicContact CB-CG 3.67Å
233	A	57.5	Low	64.2	Low	10 Å²	10	40.1 Å²	40.1	8%	0.083	21%	0.212	C	C	.	.	H	α-helix	trans	-68.1	-44.8	170	0	0	0	0	0	111.1	T230 S231 T235 C236 W265	T230-A233 WeakPolarHBondContact O-CA 3.35Å; T230-A233 WeakPolarHBondContact O-CB 3.25Å; T230-A233 PolarHBondContact O-N 3.27Å; S231-A233 VanDerWaalsContact C-N 3.34Å; A233-T235 PolarHBondContact O-N 3.21Å; A233-C236 PolarHBondContact O-N 2.86Å; A233-W265 HydrophobicContact CB-CD2 3.36Å; A233-W265 HydrophobicContact CB-CE3 3.21Å; A233-W265 HydrophobicContact CB-CG 4.01Å; A233-W265 HydrophobicContact CB-CH2 3.92Å; A233-W265 HydrophobicContact CB-CZ2 4.07Å; A233-W265 HydrophobicContact CB-CZ3 3.5Å
234	K	51.7	Low	63.4	Low	56 Å²	56	35.6 Å²	35.6	24%	0.243	18%	0.181	C	C	.	.	H	α-helix	trans	-51.5	-40	176.6	-67.3	-166.3	164.8	-154.7	0	112	T230 S231 E358 F359 H360 T362	T230-K234 PolarHBondContact O-N 2.89Å; S231-K234 WeakPolarHBondContact O-CB 3.25Å; K234-E358 WeakPolarHBondContact CE-O 3.45Å; K234-E358 PolarHBondContact NZ-O 3.06Å; K234-E358 VanDerWaalsContact NZ-O 3.13Å; K234-F359 HydrophobicContact CB-CB 4.45Å; K234-F359 VanDerWaalsContact CB-O 3.29Å; K234-F359 WeakPolarHBondContact CB-O 3.46Å; K234-F359 HydrophobicContact CG-CB 4.36Å; K234-F359 HydrophobicContact CG-CD1 3.99Å; K234-H360 PolarHBondContact NZ-O 3.34Å; K234-T362 WeakPolarHBondContact CB-OG1 3.33Å
235	T	48.6	Very low	62.6	Low	7 Å²	7	37.7 Å²	37.7	4%	0.043	19%	0.19	C	C	.	.	H	α-helix	trans	-71.9	-58.9	-176.2	33.7	0	0	0	0	110.2	S231 A232 A233 S237 T362 W364 L367 H368	S231-T235 PolarHBondContact O-N 3Å; S231-T235 PolarHBondContact O-OG1 2.8Å; A232-T235 VanDerWaalsContact C-OG1 3.24Å; A232-T235 WeakPolarHBondContact CA-OG1 3.4Å; A232-T235 PolarHBondContact O-OG1 3.41Å; A233-T235 PolarHBondContact O-N 3.21Å; T235-S237 WeakPolarHBondContact O-CA 3.09Å; T235-S237 PolarHBondContact O-N 2.98Å; T235-T362 VanDerWaalsContact CG2-O 3.29Å; T235-T362 WeakPolarHBondContact CG2-O 3.28Å; T235-T362 VanDerWaalsContact CG2-OG1 3.27Å; T235-T362 WeakPolarHBondContact CG2-OG1 3.38Å; T235-W364 VanDerWaalsContact CG2-CA 3.5Å; T235-W364 HydrophobicContact CG2-CB 4.44Å; T235-W364 PolarHBondContact O-NE1 3.31Å; T235-L367 HydrophobicContact CG2-CD1 3.72Å; T235-H368 WeakPolarHBondContact CB-NE2 3.46Å; T235-H368 PolarHBondContact OG1-NE2 3.03Å
236	C	53.4	Low	61.6	Low	10 Å²	10	43.2 Å²	43.2	7%	0.068	22%	0.22	C	C	.	.	S	Bend	trans	-23.3	100.7	-171.1	-166.9	0	0	0	0	114	A232 A233	A232-C236 PolarHBondContact O-N 3.31Å; A233-C236 PolarHBondContact O-N 2.86Å
237	S	46.8	Very low	60.3	Low	19 Å²	19	44.3 Å²	44.3	13%	0.133	23%	0.227	C	C	.	.			trans	-62.3	153.1	-163	60.6	0	0	0	0	110.4	T235 A239 A240 F241 W364	T235-S237 WeakPolarHBondContact O-CA 3.09Å; T235-S237 PolarHBondContact O-N 2.98Å; S237-A239 PolarHBondContact O-N 2.92Å; S237-A239 PolarHBondContact OG-N 2.94Å; S237-A240 WeakPolarHBondContact O-CB 3.37Å; S237-A240 PolarHBondContact O-N 3.07Å; S237-A240 WeakPolarHBondContact OG-CB 3.4Å; S237-A240 PolarHBondContact OG-N 3.37Å; S237-F241 WeakPolarHBondContact O-CB 3.48Å; S237-F241 PolarHBondContact O-N 2.99Å; S237-W364 VanDerWaalsContact CB-CD2 3.43Å; S237-W364 VanDerWaalsContact CB-CE2 3.41Å; S237-W364 VanDerWaalsContact CB-CZ2 3.47Å; S237-W364 WeakPolarHBondContact OG-CH2 3.48Å; S237-W364 WeakPolarHBondContact OG-CZ2 2.96Å; S237-W364 WeakPolarHBondContact OG-CZ3 3.36Å
238	Q	53	Low	58.9	Low	116 Å²	116	51.9 Å²	51.9	54%	0.542	26%	0.262	S	S	.	.	H	α-helix	trans	-53.8	-28.1	167.6	-156.1	175.2	23.8	0	0	111.2	R242	Q238-R242 VanDerWaalsContact CD-NH2 3.35Å; Q238-R242 WeakPolarHBondContact O-CB 3.18Å; Q238-R242 WeakPolarHBondContact O-CD 3.19Å; Q238-R242 WeakPolarHBondContact O-CG 2.93Å; Q238-R242 PolarHBondContact O-N 3.41Å
239	A	52	Low	57.7	Low	49 Å²	49	57 Å²	57	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-69.9	-46.5	172.4	0	0	0	0	0	112.6	S237 F241 R242 T243	S237-A239 PolarHBondContact O-N 2.92Å; S237-A239 PolarHBondContact OG-N 2.94Å; A239-F241 VanDerWaalsContact C-N 3.32Å; A239-F241 PolarHBondContact O-N 3.29Å; A239-R242 PolarHBondContact O-N 3.46Å; A239-T243 VanDerWaalsContact O-CB 3.32Å; A239-T243 WeakPolarHBondContact O-CB 3.43Å; A239-T243 PolarHBondContact O-N 2.68Å; A239-T243 PolarHBondContact O-OG1 2.96Å
240	A	54.6	Low	56.9	Low	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-60.9	-43.2	175	0	0	0	0	0	111.6	S237 T243 F244 I254 A258 W364	S237-A240 WeakPolarHBondContact O-CB 3.37Å; S237-A240 PolarHBondContact O-N 3.07Å; S237-A240 WeakPolarHBondContact OG-CB 3.4Å; S237-A240 PolarHBondContact OG-N 3.37Å; A240-T243 PolarHBondContact O-N 3.07Å; A240-F244 WeakPolarHBondContact O-CB 3.48Å; A240-F244 PolarHBondContact O-N 2.78Å; A240-I254 HydrophobicContact CB-CG2 4.32Å; A240-A258 HydrophobicContact CB-CB 3.42Å; A240-A258 VanDerWaalsContact CB-CB 3.42Å; A240-W364 HydrophobicContact CB-CH2 4Å; A240-W364 HydrophobicContact CB-CZ2 3.76Å
241	F	60	Low	56.6	Low	64 Å²	64	60.2 Å²	60.2	28%	0.281	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-51.7	173.9	-167.8	-93	0	0	0	110.6	S237 A239 T243 F244 F245 I270	S237-F241 WeakPolarHBondContact O-CB 3.48Å; S237-F241 PolarHBondContact O-N 2.99Å; A239-F241 VanDerWaalsContact C-N 3.32Å; A239-F241 PolarHBondContact O-N 3.29Å; F241-T243 PolarHBondContact O-N 2.66Å; F241-F244 WeakPolarHBondContact O-CA 3.43Å; F241-F244 WeakPolarHBondContact O-CB 3.46Å; F241-F244 PolarHBondContact O-N 2.87Å; F241-F244 VanDerWaalsContact O-N 3.09Å; F241-F245 AromaticContact CD1-CD2 3.62Å; F241-F245 HydrophobicContact CD1-CD2 3.62Å; F241-F245 AromaticContact CD1-CE2 3.66Å; F241-F245 HydrophobicContact CD1-CE2 3.66Å; F241-F245 HydrophobicContact CD2-CE2 4.1Å; F241-F245 AromaticContact CE1-CD2 3.52Å; F241-F245 HydrophobicContact CE1-CD2 3.52Å; F241-F245 AromaticContact CE1-CE2 3.12Å; F241-F245 HydrophobicContact CE1-CE2 3.12Å; F241-F245 AromaticContact CE1-CZ 3.91Å; F241-F245 HydrophobicContact CE1-CZ 3.91Å; F241-F245 HydrophobicContact CE2-CD2 4.43Å; F241-F245 AromaticContact CE2-CE2 3.62Å; F241-F245 HydrophobicContact CE2-CE2 3.62Å; F241-F245 HydrophobicContact CE2-CZ 4.46Å; F241-F245 HydrophobicContact CG-CD2 4.16Å; F241-F245 HydrophobicContact CG-CE2 4.14Å; F241-F245 AromaticContact CZ-CD2 3.98Å; F241-F245 HydrophobicContact CZ-CD2 3.98Å; F241-F245 AromaticContact CZ-CE2 3.12Å; F241-F245 HydrophobicContact CZ-CE2 3.12Å; F241-F245 AromaticContact CZ-CZ 3.76Å; F241-F245 HydrophobicContact CZ-CZ 3.76Å; F241-F245 VanDerWaalsContact O-CD2 3.31Å; F241-F245 WeakPolarHBondContact O-CD2 3.16Å; F241-F245 PolarHBondContact O-N 2.9Å; F241-I270 HydrophobicContact CD2-CD1 3.85Å; F241-I270 HydrophobicContact CD2-CG1 4.14Å; F241-I270 HydrophobicContact CE2-CD1 3.86Å; F241-I270 HydrophobicContact CE2-CG1 3.65Å; F241-I270 HydrophobicContact CZ-CG1 4.34Å
242	R	61	Low	56.6	Low	139 Å²	139	61.1 Å²	61.1	53%	0.525	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-44.8	176.1	-77.2	169.7	-176	178.7	6.2	112.2	Q238 A239 F244 F245 N246	Q238-R242 VanDerWaalsContact CD-NH2 3.35Å; Q238-R242 WeakPolarHBondContact O-CB 3.18Å; Q238-R242 WeakPolarHBondContact O-CD 3.19Å; Q238-R242 WeakPolarHBondContact O-CG 2.93Å; Q238-R242 PolarHBondContact O-N 3.41Å; A239-R242 PolarHBondContact O-N 3.46Å; R242-F244 VanDerWaalsContact C-N 3.3Å; R242-F244 PolarHBondContact O-N 3.34Å; R242-F245 PolarHBondContact O-N 3.28Å; R242-N246 VanDerWaalsContact O-CB 3.26Å; R242-N246 WeakPolarHBondContact O-CB 3.26Å; R242-N246 PolarHBondContact O-N 2.94Å; R242-N246 PolarHBondContact O-ND2 2.85Å
243	T	59.4	Low	56.6	Low	36 Å²	36	62.4 Å²	62.4	22%	0.221	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-41.4	175.5	-58.4	0	0	0	0	110	A239 A240 F241 N246 T247 S253 I254	A239-T243 VanDerWaalsContact O-CB 3.32Å; A239-T243 WeakPolarHBondContact O-CB 3.43Å; A239-T243 PolarHBondContact O-N 2.68Å; A239-T243 PolarHBondContact O-OG1 2.96Å; A240-T243 PolarHBondContact O-N 3.07Å; F241-T243 PolarHBondContact O-N 2.66Å; T243-N246 PolarHBondContact O-N 3.43Å; T243-T247 WeakPolarHBondContact CG2-OG1 3.33Å; T243-T247 WeakPolarHBondContact O-CA 3.23Å; T243-T247 WeakPolarHBondContact O-CB 3.43Å; T243-T247 PolarHBondContact O-N 2.88Å; T243-T247 PolarHBondContact O-OG1 3.39Å; T243-S253 VanDerWaalsContact CG2-OG 3.3Å; T243-S253 WeakPolarHBondContact CG2-OG 3.49Å; T243-I254 HydrophobicContact CG2-CG1 3.77Å
244	F	60.1	Low	56.6	Low	11 Å²	11	62 Å²	62	5%	0.048	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-50.7	173.8	-169.8	-78.6	0	0	0	112.2	A240 F241 R242 N246 T247 I254 Y263 S266 L267 I270 L271	A240-F244 WeakPolarHBondContact O-CB 3.48Å; A240-F244 PolarHBondContact O-N 2.78Å; F241-F244 WeakPolarHBondContact O-CA 3.43Å; F241-F244 WeakPolarHBondContact O-CB 3.46Å; F241-F244 PolarHBondContact O-N 2.87Å; F241-F244 VanDerWaalsContact O-N 3.09Å; R242-F244 VanDerWaalsContact C-N 3.3Å; R242-F244 PolarHBondContact O-N 3.34Å; F244-N246 VanDerWaalsContact C-N 3.34Å; F244-N246 PolarHBondContact O-N 2.86Å; F244-T247 PolarHBondContact O-N 3.04Å; F244-I254 HydrophobicContact CB-CD1 3.62Å; F244-I254 HydrophobicContact CB-CG1 4.46Å; F244-I254 HydrophobicContact CD2-CD1 3.39Å; F244-I254 HydrophobicContact CE2-CD1 4.32Å; F244-I254 HydrophobicContact CG-CD1 3.84Å; F244-Y263 HydrophobicContact CD2-CD2 4.49Å; F244-Y263 HydrophobicContact CD2-CE2 4.06Å; F244-Y263 AromaticContact CE2-CE2 3.93Å; F244-Y263 HydrophobicContact CE2-CE2 3.93Å; F244-S266 WeakPolarHBondContact CD2-OG 3.39Å; F244-L267 HydrophobicContact CE2-CD2 3.51Å; F244-L267 HydrophobicContact CE2-CG 4.12Å; F244-L267 HydrophobicContact CZ-CD2 3.71Å; F244-I270 HydrophobicContact CB-CD1 3.99Å; F244-I270 HydrophobicContact CD1-CB 4.44Å; F244-I270 HydrophobicContact CD1-CD1 3.19Å; F244-I270 HydrophobicContact CD1-CG1 4.38Å; F244-I270 HydrophobicContact CD1-CG2 4.17Å; F244-I270 HydrophobicContact CD2-CD1 4.39Å; F244-I270 HydrophobicContact CE1-CB 4.1Å; F244-I270 HydrophobicContact CE1-CD1 3.71Å; F244-I270 HydrophobicContact CE1-CG2 3.75Å; F244-I270 HydrophobicContact CG-CD1 3.61Å; F244-L271 HydrophobicContact CZ-CD1 3.97Å; F244-L271 HydrophobicContact CZ-CG 4.28Å
245	F	62.7	Low	56.9	Low	79 Å²	79	59.4 Å²	59.4	35%	0.346	29%	0.29	S	S	.	.	H	α-helix	trans	-64.3	-37	179.8	-88.3	-90.8	0	0	0	113	F241 R242 I270	F241-F245 AromaticContact CD1-CD2 3.62Å; F241-F245 HydrophobicContact CD1-CD2 3.62Å; F241-F245 AromaticContact CD1-CE2 3.66Å; F241-F245 HydrophobicContact CD1-CE2 3.66Å; F241-F245 HydrophobicContact CD2-CE2 4.1Å; F241-F245 AromaticContact CE1-CD2 3.52Å; F241-F245 HydrophobicContact CE1-CD2 3.52Å; F241-F245 AromaticContact CE1-CE2 3.12Å; F241-F245 HydrophobicContact CE1-CE2 3.12Å; F241-F245 AromaticContact CE1-CZ 3.91Å; F241-F245 HydrophobicContact CE1-CZ 3.91Å; F241-F245 HydrophobicContact CE2-CD2 4.43Å; F241-F245 AromaticContact CE2-CE2 3.62Å; F241-F245 HydrophobicContact CE2-CE2 3.62Å; F241-F245 HydrophobicContact CE2-CZ 4.46Å; F241-F245 HydrophobicContact CG-CD2 4.16Å; F241-F245 HydrophobicContact CG-CE2 4.14Å; F241-F245 AromaticContact CZ-CD2 3.98Å; F241-F245 HydrophobicContact CZ-CD2 3.98Å; F241-F245 AromaticContact CZ-CE2 3.12Å; F241-F245 HydrophobicContact CZ-CE2 3.12Å; F241-F245 AromaticContact CZ-CZ 3.76Å; F241-F245 HydrophobicContact CZ-CZ 3.76Å; F241-F245 VanDerWaalsContact O-CD2 3.31Å; F241-F245 WeakPolarHBondContact O-CD2 3.16Å; F241-F245 PolarHBondContact O-N 2.9Å; R242-F245 PolarHBondContact O-N 3.28Å; F245-I270 HydrophobicContact CD2-CD1 3.88Å; F245-I270 HydrophobicContact CE1-CG2 4.47Å; F245-I270 HydrophobicContact CE2-CB 4.49Å; F245-I270 HydrophobicContact CE2-CD1 3.4Å; F245-I270 VanDerWaalsContact CE2-CD1 3.4Å; F245-I270 HydrophobicContact CE2-CG1 3.64Å; F245-I270 HydrophobicContact CE2-CG2 4.03Å; F245-I270 HydrophobicContact CZ-CD1 4.26Å; F245-I270 HydrophobicContact CZ-CG1 4.11Å; F245-I270 HydrophobicContact CZ-CG2 3.8Å
246	N	63.5	Low	57.3	Low	131 Å²	131	62.2 Å²	62.2	70%	0.701	30%	0.3	S	S	*	.	H	α-helix	trans	-87.8	-15.9	-176.3	-64.4	-17.8	0	0	0	113.1	R242 T243 F244 E248	R242-N246 VanDerWaalsContact O-CB 3.26Å; R242-N246 WeakPolarHBondContact O-CB 3.26Å; R242-N246 PolarHBondContact O-N 2.94Å; R242-N246 PolarHBondContact O-ND2 2.85Å; T243-N246 PolarHBondContact O-N 3.43Å; F244-N246 VanDerWaalsContact C-N 3.34Å; F244-N246 PolarHBondContact O-N 2.86Å; N246-E248 PolarHBondContact O-N 2.89Å
247	T	59.1	Low	57.1	Low	24 Å²	24	64.5 Å²	64.5	15%	0.147	31%	0.313	C	S	.	.			trans	-95.6	95.2	-177.2	-55.7	0	0	0	0	109.7	T243 F244 K249 N250 R251	T243-T247 WeakPolarHBondContact CG2-OG1 3.33Å; T243-T247 WeakPolarHBondContact O-CA 3.23Å; T243-T247 WeakPolarHBondContact O-CB 3.43Å; T243-T247 PolarHBondContact O-N 2.88Å; T243-T247 PolarHBondContact O-OG1 3.39Å; F244-T247 PolarHBondContact O-N 3.04Å; T247-K249 VanDerWaalsContact C-N 3.31Å; T247-K249 PolarHBondContact O-N 2.82Å; T247-N250 HydrophobicContact CG2-CB 4.2Å; T247-N250 WeakPolarHBondContact CG2-O 3.37Å; T247-R251 HydrophobicContact CG2-CG 4.17Å; T247-R251 PolarHBondContact O-NE 2.91Å
248	E	56	Low	57.6	Low	160 Å²	160	63.6 Å²	63.6	75%	0.748	31%	0.307	S	S	*	.	S	Bend	trans	-62.7	-38.5	173.1	-72.7	-172	167.5	0	0	111.7	N246	N246-E248 PolarHBondContact O-N 2.89Å
249	K	54.4	Low	58.4	Low	171 Å²	171	58 Å²	58	74%	0.743	28%	0.281	S	S	*	.	S	Bend	trans	-124.8	-35.4	-165.1	-61.3	-173.3	179.1	-175	0	117.4	T247	T247-K249 VanDerWaalsContact C-N 3.31Å; T247-K249 PolarHBondContact O-N 2.82Å
250	N	57.3	Low	59.7	Low	104 Å²	104	55.7 Å²	55.7	56%	0.556	26%	0.262	S	S	*	.			trans	-108.2	61.1	-170.2	-166	-8.3	0	0	0	113.8	T247 R252 S253	T247-N250 HydrophobicContact CG2-CB 4.2Å; T247-N250 WeakPolarHBondContact CG2-O 3.37Å; N250-R252 PolarHBondContact O-N 2.9Å; N250-R252 VanDerWaalsContact O-N 3.07Å; N250-R252 WeakPolarHBondContact OD1-CB 3.18Å; N250-S253 VanDerWaalsContact O-CB 3.24Å; N250-S253 WeakPolarHBondContact O-CB 3.16Å; N250-S253 PolarHBondContact O-N 2.76Å; N250-S253 PolarHBondContact O-OG 3.01Å
251	R	59.3	Low	60.8	Low	36 Å²	36	55.7 Å²	55.7	14%	0.136	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-6.4	-173.6	-62.4	-155.6	-172.4	130.9	17.8	115.4	T247 S253 I254 Y263	T247-R251 HydrophobicContact CG2-CG 4.17Å; T247-R251 PolarHBondContact O-NE 2.91Å; R251-S253 PolarHBondContact O-N 3.49Å; R251-I254 HydrophobicContact CB-CD1 3.76Å; R251-I254 HydrophobicContact CB-CG1 4.5Å; R251-I254 HydrophobicContact CG-CD1 3.85Å; R251-I254 VanDerWaalsContact O-CB 3.29Å; R251-I254 WeakPolarHBondContact O-CB 3.33Å; R251-I254 PolarHBondContact O-N 3.12Å; R251-Y263 HydrophobicContact CB-CE2 4.18Å
252	R	58.9	Low	61.5	Low	60 Å²	60	52.7 Å²	52.7	23%	0.226	25%	0.248	C	C	.	.	H	α-helix	trans	-54.5	-31.6	162.8	-144.1	-177.9	-167.5	149.5	-6.2	111	Q109 G213 N250 I254 C255 R256	Q109-R252 VanDerWaalsContact CD-NH2 3.34Å; G213-R252 PolarHBondContact O-NE 3.08Å; G213-R252 PolarHBondContact O-NH2 3.19Å; N250-R252 PolarHBondContact O-N 2.9Å; N250-R252 VanDerWaalsContact O-N 3.07Å; N250-R252 WeakPolarHBondContact OD1-CB 3.18Å; R252-I254 PolarHBondContact O-N 3.27Å; R252-C255 PolarHBondContact O-N 2.99Å; R252-R256 WeakPolarHBondContact O-CB 3.39Å; R252-R256 WeakPolarHBondContact O-CG 3.5Å; R252-R256 PolarHBondContact O-N 3.05Å
253	S	58.7	Low	62.3	Low	29 Å²	29	46.4 Å²	46.4	20%	0.203	23%	0.225	C	C	.	.	H	α-helix	trans	-57	-28.4	172.2	71.7	0	0	0	0	113.3	T243 N250 R251 R256 V257	T243-S253 VanDerWaalsContact CG2-OG 3.3Å; T243-S253 WeakPolarHBondContact CG2-OG 3.49Å; N250-S253 VanDerWaalsContact O-CB 3.24Å; N250-S253 WeakPolarHBondContact O-CB 3.16Å; N250-S253 PolarHBondContact O-N 2.76Å; N250-S253 PolarHBondContact O-OG 3.01Å; R251-S253 PolarHBondContact O-N 3.49Å; S253-R256 WeakPolarHBondContact O-CB 3.37Å; S253-V257 VanDerWaalsContact O-CG2 3.27Å; S253-V257 WeakPolarHBondContact O-CG2 3.29Å; S253-V257 PolarHBondContact O-N 3.13Å; S253-V257 VanDerWaalsContact O-N 3.1Å
254	I	58.4	Low	63.6	Low	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-78.5	-47.4	-179.6	-53.1	164.2	0	0	0	109.3	A240 T243 F244 R251 R252 R256 V257 A258 Y263	A240-I254 HydrophobicContact CB-CG2 4.32Å; T243-I254 HydrophobicContact CG2-CG1 3.77Å; F244-I254 HydrophobicContact CB-CD1 3.62Å; F244-I254 HydrophobicContact CB-CG1 4.46Å; F244-I254 HydrophobicContact CD2-CD1 3.39Å; F244-I254 HydrophobicContact CE2-CD1 4.32Å; F244-I254 HydrophobicContact CG-CD1 3.84Å; R251-I254 HydrophobicContact CB-CD1 3.76Å; R251-I254 HydrophobicContact CB-CG1 4.5Å; R251-I254 HydrophobicContact CG-CD1 3.85Å; R251-I254 VanDerWaalsContact O-CB 3.29Å; R251-I254 WeakPolarHBondContact O-CB 3.33Å; R251-I254 PolarHBondContact O-N 3.12Å; R252-I254 PolarHBondContact O-N 3.27Å; I254-R256 PolarHBondContact O-N 3.16Å; I254-V257 CarbonylContact O-C 3.59Å; I254-V257 PolarHBondContact O-N 3.14Å; I254-A258 HydrophobicContact CG2-CB 4.18Å; I254-A258 WeakPolarHBondContact O-CA 3.49Å; I254-A258 WeakPolarHBondContact O-CB 3.31Å; I254-A258 PolarHBondContact O-N 2.66Å; I254-Y263 HydrophobicContact CB-CD2 4.1Å; I254-Y263 HydrophobicContact CD1-CD2 4.3Å; I254-Y263 HydrophobicContact CD1-CE2 4.02Å; I254-Y263 HydrophobicContact CG2-CD2 3.92Å
255	C	57	Low	64.6	Low	2 Å²	2	44.3 Å²	44.3	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-57.2	-38.4	172.5	-65	0	0	0	0	110.7	R252 V257 A258 G259 M260 Y263 I373	R252-C255 PolarHBondContact O-N 2.99Å; C255-V257 VanDerWaalsContact C-N 3.34Å; C255-V257 PolarHBondContact O-N 2.81Å; C255-A258 PolarHBondContact O-N 3.22Å; C255-G259 PolarHBondContact O-N 3.19Å; C255-M260 HydrophobicContact CB-CE 4.03Å; C255-M260 HydrophobicContact CB-SD 3.95Å; C255-M260 VanDerWaalsContact SG-SD 3.62Å; C255-Y263 WeakPolarHBondContact SG-CD1 3.38Å; C255-Y263 VanDerWaalsContact SG-CG 3.54Å; C255-I373 HydrophobicContact CB-CD1 4.47Å
256	R	57.8	Low	65.3	Low	66 Å²	66	40.6 Å²	40.6	25%	0.249	20%	0.196	C	C	.	.	H	α-helix	trans	-56.2	-43.6	173.4	-75.3	173.6	59	153	-12.7	113.2	R252 S253 I254 R372 I373 D374 E375	R252-R256 WeakPolarHBondContact O-CB 3.39Å; R252-R256 WeakPolarHBondContact O-CG 3.5Å; R252-R256 PolarHBondContact O-N 3.05Å; S253-R256 WeakPolarHBondContact O-CB 3.37Å; I254-R256 PolarHBondContact O-N 3.16Å; R256-R372 WeakPolarHBondContact O-CA 3.44Å; R256-R372 WeakPolarHBondContact O-CB 3.32Å; R256-R372 WeakPolarHBondContact O-CG 3.42Å; R256-I373 WeakPolarHBondContact CA-O 3.44Å; R256-I373 HydrophobicContact CB-CB 4.26Å; R256-I373 WeakPolarHBondContact CB-O 3.44Å; R256-I373 HydrophobicContact CG-CB 3.51Å; R256-I373 HydrophobicContact CG-CG2 3.83Å; R256-I373 WeakPolarHBondContact CG-O 3.46Å; R256-I373 PolarHBondContact O-N 3.39Å; R256-D374 VanDerWaalsContact CZ-C 3.49Å; R256-D374 PolarHBondContact NE-O 2.66Å; R256-D374 PolarHBondContact NH1-O 2.86Å; R256-D374 VanDerWaalsContact NH1-O 3.1Å; R256-D374 PolarHBondContact NH2-O 3.06Å; R256-E375 VanDerWaalsContact CZ-CA 3.46Å; R256-E375 PolarHBondContact NH1-O 3.45Å
257	V	48.3	Very low	66.3	Low	58 Å²	58	34.3 Å²	34.3	35%	0.352	16%	0.163	S	C	.	.	H	α-helix	trans	-89.1	-26.2	-177.5	179.2	0	0	0	0	112.5	S253 I254 C255 W364 R372	S253-V257 VanDerWaalsContact O-CG2 3.27Å; S253-V257 WeakPolarHBondContact O-CG2 3.29Å; S253-V257 PolarHBondContact O-N 3.13Å; S253-V257 VanDerWaalsContact O-N 3.1Å; I254-V257 CarbonylContact O-C 3.59Å; I254-V257 PolarHBondContact O-N 3.14Å; C255-V257 VanDerWaalsContact C-N 3.34Å; C255-V257 PolarHBondContact O-N 2.81Å; V257-W364 HydrophobicContact CG1-CH2 4.14Å; V257-W364 HydrophobicContact CG1-CZ3 4.4Å; V257-W364 WeakPolarHBondContact O-CH2 3.38Å; V257-W364 WeakPolarHBondContact O-CZ3 3.27Å; V257-R372 WeakPolarHBondContact O-CD 3.21Å; V257-R372 PolarHBondContact O-NE 3.36Å
258	A	57.7	Low	67.5	Low	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-127.4	-19.8	-159.1	0	0	0	0	0	115.9	A240 I254 C255 A262 W364 H368	A240-A258 HydrophobicContact CB-CB 3.42Å; A240-A258 VanDerWaalsContact CB-CB 3.42Å; I254-A258 HydrophobicContact CG2-CB 4.18Å; I254-A258 WeakPolarHBondContact O-CA 3.49Å; I254-A258 WeakPolarHBondContact O-CB 3.31Å; I254-A258 PolarHBondContact O-N 2.66Å; C255-A258 PolarHBondContact O-N 3.22Å; A258-A262 HydrophobicContact CB-CB 3.81Å; A258-A262 WeakPolarHBondContact O-CB 3.15Å; A258-W364 VanDerWaalsContact CA-CH2 3.43Å; A258-W364 HydrophobicContact CB-CH2 3.68Å; A258-W364 HydrophobicContact CB-CZ2 3.53Å; A258-H368 WeakPolarHBondContact O-CB 3.29Å
259	G	71.4	Confident	68.7	Low	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.			trans	87.2	164.1	-171.6	0	0	0	0	0	115.7	C255 Y263 Q371	C255-G259 PolarHBondContact O-N 3.19Å; G259-Y263 WeakPolarHBondContact O-CB 3.43Å; G259-Y263 PolarHBondContact O-N 3.12Å; G259-Q371 VanDerWaalsContact CA-O 3.32Å; G259-Q371 WeakPolarHBondContact CA-O 3.47Å
260	M	78	Confident	69.8	Low	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-70.6	-41.1	-175.4	-59.3	-55.6	172.2	0	0	112	L108 V218 F220 C255 Y263 W264 I373 F379	L108-M260 HydrophobicContact CD1-CE 3.39Å; L108-M260 HydrophobicContact CD1-SD 3.42Å; L108-M260 WeakPolarHBondContact CD1-SD 3.45Å; L108-M260 HydrophobicContact CD2-SD 3.73Å; L108-M260 HydrophobicContact CG-SD 4.21Å; V218-M260 HydrophobicContact CG2-CB 4.29Å; V218-M260 HydrophobicContact CG2-CG 3.89Å; V218-M260 HydrophobicContact CG2-SD 3.97Å; F220-M260 HydrophobicContact CZ-CB 4.34Å; C255-M260 HydrophobicContact CB-CE 4.03Å; C255-M260 HydrophobicContact CB-SD 3.95Å; C255-M260 VanDerWaalsContact SG-SD 3.62Å; M260-Y263 PolarHBondContact O-N 2.61Å; M260-W264 PolarHBondContact O-N 3.13Å; M260-I373 HydrophobicContact CE-CD1 3.86Å; M260-F379 HydrophobicContact CE-CE1 4.37Å; M260-F379 HydrophobicContact CE-CZ 3.64Å
261	L	78.5	Confident	71.1	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-70	-40.2	178.1	-177.5	62.1	0	0	0	111.5	I193 F199 P226 K229 A232 Y263 W264 W265	I193-L261 HydrophobicContact CD1-CD1 4.01Å; F199-L261 HydrophobicContact CE1-CD2 3.57Å; F199-L261 HydrophobicContact CE2-CD2 4.36Å; F199-L261 HydrophobicContact CZ-CD2 3.23Å; P226-L261 HydrophobicContact CB-CD1 3.69Å; P226-L261 HydrophobicContact CG-CD1 4.26Å; K229-L261 HydrophobicContact CB-CD2 4.44Å; A232-L261 HydrophobicContact CB-CD2 3.25Å; A232-L261 HydrophobicContact CB-CG 3.67Å; L261-Y263 VanDerWaalsContact C-N 3.28Å; L261-Y263 PolarHBondContact O-N 3.19Å; L261-W264 WeakPolarHBondContact O-CB 3.46Å; L261-W264 PolarHBondContact O-N 3.43Å; L261-W265 VanDerWaalsContact O-CD1 3.32Å; L261-W265 PolarHBondContact O-N 2.93Å
262	A	73.5	Confident	72.4	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.8	-36.8	172.9	0	0	0	0	0	111.5	A258 W265 S266	A258-A262 HydrophobicContact CB-CB 3.81Å; A258-A262 WeakPolarHBondContact O-CB 3.15Å; A262-W265 CarbonylContact O-C 3.54Å; A262-W265 PolarHBondContact O-N 3.01Å; A262-S266 WeakPolarHBondContact O-CB 3.17Å; A262-S266 PolarHBondContact O-N 3.33Å
263	Y	78.4	Confident	73.6	Confident	7 Å²	7	18 Å²	18	3%	0.027	9%	0.087	C	C	.	.	H	α-helix	trans	-63.2	-44.3	174.6	-176.8	-127.3	0	0	0	111.6	L106 L108 F244 R251 I254 C255 G259 M260 L261 W265 S266 L267	L106-Y263 HydrophobicContact CD1-CD1 4.23Å; L106-Y263 HydrophobicContact CD1-CE1 4.28Å; L106-Y263 HydrophobicContact CD2-CD1 3.89Å; L106-Y263 HydrophobicContact CG-CD1 4.32Å; L108-Y263 HydrophobicContact CD2-CD1 3.77Å; L108-Y263 HydrophobicContact CD2-CE1 3.94Å; F244-Y263 HydrophobicContact CD2-CD2 4.49Å; F244-Y263 HydrophobicContact CD2-CE2 4.06Å; F244-Y263 AromaticContact CE2-CE2 3.93Å; F244-Y263 HydrophobicContact CE2-CE2 3.93Å; R251-Y263 HydrophobicContact CB-CE2 4.18Å; I254-Y263 HydrophobicContact CB-CD2 4.1Å; I254-Y263 HydrophobicContact CD1-CD2 4.3Å; I254-Y263 HydrophobicContact CD1-CE2 4.02Å; I254-Y263 HydrophobicContact CG2-CD2 3.92Å; C255-Y263 WeakPolarHBondContact SG-CD1 3.38Å; C255-Y263 VanDerWaalsContact SG-CG 3.54Å; G259-Y263 WeakPolarHBondContact O-CB 3.43Å; G259-Y263 PolarHBondContact O-N 3.12Å; M260-Y263 PolarHBondContact O-N 2.61Å; L261-Y263 VanDerWaalsContact C-N 3.28Å; L261-Y263 PolarHBondContact O-N 3.19Å; Y263-W265 VanDerWaalsContact C-N 3.31Å; Y263-W265 PolarHBondContact O-N 3.41Å; Y263-S266 WeakPolarHBondContact CA-OG 3.43Å; Y263-S266 WeakPolarHBondContact CD2-OG 3.02Å; Y263-S266 PolarHBondContact O-N 3.37Å; Y263-S266 VanDerWaalsContact O-N 3.12Å; Y263-S266 PolarHBondContact O-OG 3.38Å; Y263-L267 HydrophobicContact CD1-CD1 4.36Å; Y263-L267 HydrophobicContact CE1-CD1 3.89Å; Y263-L267 HydrophobicContact CE2-CD1 4.35Å; Y263-L267 HydrophobicContact CE2-CD2 4.34Å; Y263-L267 HydrophobicContact CE2-CG 4.12Å; Y263-L267 PolarHBondContact O-N 3.01Å
264	W	86.2	Confident	74.8	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-53.5	-49.1	171.3	-173	97.5	0	0	0	111.4	V17 V21 L106 F220 P226 W227 M260 L261 S266 L267 F268	V17-W264 HydrophobicContact CG1-CH2 4.19Å; V17-W264 HydrophobicContact CG1-CZ2 4.31Å; V21-W264 HydrophobicContact CB-CZ2 4.11Å; V21-W264 HydrophobicContact CG1-CD2 4.18Å; V21-W264 HydrophobicContact CG1-CG 4Å; V21-W264 HydrophobicContact CG1-CZ2 4.46Å; V21-W264 HydrophobicContact CG2-CH2 4.19Å; V21-W264 HydrophobicContact CG2-CZ2 3.59Å; L106-W264 HydrophobicContact CD2-CB 4.13Å; F220-W264 HydrophobicContact CE2-CB 4.42Å; F220-W264 HydrophobicContact CE2-CG 4.45Å; F220-W264 HydrophobicContact CZ-CB 4.48Å; P226-W264 HydrophobicContact CB-CD2 3.28Å; P226-W264 VanDerWaalsContact CB-CE2 3.46Å; P226-W264 HydrophobicContact CB-CE3 3.58Å; P226-W264 HydrophobicContact CB-CG 3.68Å; P226-W264 HydrophobicContact CB-CH2 4.25Å; P226-W264 HydrophobicContact CB-CZ2 3.96Å; P226-W264 HydrophobicContact CB-CZ3 4.06Å; P226-W264 HydrophobicContact CG-CD2 4.14Å; P226-W264 HydrophobicContact CG-CG 4.1Å; W227-W264 HydrophobicContact CB-CH2 3.84Å; W227-W264 HydrophobicContact CB-CZ2 4.37Å; W227-W264 HydrophobicContact CE3-CH2 4.38Å; W227-W264 AromaticContact CE3-CZ2 3.74Å; W227-W264 HydrophobicContact CE3-CZ2 3.74Å; M260-W264 PolarHBondContact O-N 3.13Å; L261-W264 WeakPolarHBondContact O-CB 3.46Å; L261-W264 PolarHBondContact O-N 3.43Å; W264-S266 VanDerWaalsContact C-N 3.33Å; W264-S266 PolarHBondContact O-N 3.11Å; W264-L267 PolarHBondContact O-N 3.27Å; W264-F268 HydrophobicContact CE3-CB 4.21Å; W264-F268 HydrophobicContact CH2-CB 4.1Å; W264-F268 HydrophobicContact CH2-CD2 4.05Å; W264-F268 HydrophobicContact CH2-CG 4.09Å; W264-F268 HydrophobicContact CZ3-CB 3.83Å; W264-F268 HydrophobicContact CZ3-CD2 4.48Å; W264-F268 HydrophobicContact CZ3-CG 4.06Å; W264-F268 PolarHBondContact O-N 3.02Å
265	W	81.7	Confident	76.2	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-65.5	-33.5	178.3	-84.8	104.7	0	0	0	113.3	P226 K229 T230 A233 L261 A262 Y263 F268 L269 L282	P226-W265 WeakPolarHBondContact O-CZ2 3.31Å; P226-W265 PolarHBondContact O-NE1 3.24Å; K229-W265 WeakPolarHBondContact O-CZ2 3.05Å; K229-W265 PolarHBondContact O-NE1 3.26Å; K229-W265 VanDerWaalsContact O-NE1 3.15Å; T230-W265 HydrophobicContact CG2-CH2 4.02Å; T230-W265 HydrophobicContact CG2-CZ2 4.35Å; A233-W265 HydrophobicContact CB-CD2 3.36Å; A233-W265 HydrophobicContact CB-CE3 3.21Å; A233-W265 HydrophobicContact CB-CG 4.01Å; A233-W265 HydrophobicContact CB-CH2 3.92Å; A233-W265 HydrophobicContact CB-CZ2 4.07Å; A233-W265 HydrophobicContact CB-CZ3 3.5Å; L261-W265 VanDerWaalsContact O-CD1 3.32Å; L261-W265 PolarHBondContact O-N 2.93Å; A262-W265 CarbonylContact O-C 3.54Å; A262-W265 PolarHBondContact O-N 3.01Å; Y263-W265 VanDerWaalsContact C-N 3.31Å; Y263-W265 PolarHBondContact O-N 3.41Å; W265-F268 HydrophobicContact CE3-CB 4.45Å; W265-F268 AromaticContact CE3-CD1 3.72Å; W265-F268 HydrophobicContact CE3-CD1 3.72Å; W265-F268 HydrophobicContact CE3-CE1 4.47Å; W265-F268 HydrophobicContact CE3-CG 4.35Å; W265-F268 AromaticContact CZ3-CD1 3.58Å; W265-F268 HydrophobicContact CZ3-CD1 3.58Å; W265-F268 AromaticContact CZ3-CE1 3.9Å; W265-F268 HydrophobicContact CZ3-CE1 3.9Å; W265-F268 HydrophobicContact CZ3-CG 4.39Å; W265-F268 PolarHBondContact O-N 3.42Å; W265-L269 HydrophobicContact CE3-CG 4.3Å; W265-L269 WeakPolarHBondContact O-CB 3.3Å; W265-L269 VanDerWaalsContact O-CG 3.23Å; W265-L269 WeakPolarHBondContact O-CG 3.36Å; W265-L269 PolarHBondContact O-N 3.46Å; W265-L282 HydrophobicContact CH2-CD1 3.84Å; W265-L282 HydrophobicContact CZ3-CD1 3.95Å
266	S	77	Confident	77.4	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.3	-45.5	175.1	74.9	0	0	0	0	111.3	F244 A262 Y263 W264 F268 L269 I270	F244-S266 WeakPolarHBondContact CD2-OG 3.39Å; A262-S266 WeakPolarHBondContact O-CB 3.17Å; A262-S266 PolarHBondContact O-N 3.33Å; Y263-S266 WeakPolarHBondContact CA-OG 3.43Å; Y263-S266 WeakPolarHBondContact CD2-OG 3.02Å; Y263-S266 PolarHBondContact O-N 3.37Å; Y263-S266 VanDerWaalsContact O-N 3.12Å; Y263-S266 PolarHBondContact O-OG 3.38Å; W264-S266 VanDerWaalsContact C-N 3.33Å; W264-S266 PolarHBondContact O-N 3.11Å; S266-F268 VanDerWaalsContact C-N 3.35Å; S266-F268 PolarHBondContact O-N 2.91Å; S266-L269 PolarHBondContact O-N 3.45Å; S266-I270 VanDerWaalsContact O-CB 3.28Å; S266-I270 WeakPolarHBondContact O-CB 3.4Å; S266-I270 WeakPolarHBondContact O-CD1 3.27Å; S266-I270 WeakPolarHBondContact O-CG1 3.24Å; S266-I270 PolarHBondContact O-N 3.05Å; S266-I270 VanDerWaalsContact O-N 3.1Å
267	L	84	Confident	78.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.9	-45.4	174.7	-70.7	170.9	0	0	0	110.9	V21 A24 Q28 L106 F244 Y263 W264 L271 V272	V21-L267 HydrophobicContact CG1-CB 3.98Å; V21-L267 HydrophobicContact CG1-CD1 4.19Å; A24-L267 HydrophobicContact CB-CD2 4.5Å; Q28-L267 HydrophobicContact CG-CD2 4.32Å; L106-L267 HydrophobicContact CD1-CD1 3.53Å; F244-L267 HydrophobicContact CE2-CD2 3.51Å; F244-L267 HydrophobicContact CE2-CG 4.12Å; F244-L267 HydrophobicContact CZ-CD2 3.71Å; Y263-L267 HydrophobicContact CD1-CD1 4.36Å; Y263-L267 HydrophobicContact CE1-CD1 3.89Å; Y263-L267 HydrophobicContact CE2-CD1 4.35Å; Y263-L267 HydrophobicContact CE2-CD2 4.34Å; Y263-L267 HydrophobicContact CE2-CG 4.12Å; Y263-L267 PolarHBondContact O-N 3.01Å; W264-L267 PolarHBondContact O-N 3.27Å; L267-L271 HydrophobicContact CD2-CD1 3.81Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 PolarHBondContact O-N 3.45Å; L267-V272 PolarHBondContact O-N 3.2Å
268	F	85.3	Confident	79.2	Confident	4 Å²	4	31.6 Å²	31.6	2%	0.018	16%	0.16	C	C	.	.	I	π-helix	trans	-58.6	-56.4	177.8	176.1	-95.9	0	0	0	111.4	V17 V21 W264 W265 S266 I270 V272 R273 L276 L282	V17-F268 HydrophobicContact CG1-CD2 3.95Å; V17-F268 HydrophobicContact CG1-CE2 3.76Å; V21-F268 HydrophobicContact CG2-CB 3.86Å; V21-F268 HydrophobicContact CG2-CD2 3.98Å; V21-F268 HydrophobicContact CG2-CG 4.44Å; W264-F268 HydrophobicContact CE3-CB 4.21Å; W264-F268 HydrophobicContact CH2-CB 4.1Å; W264-F268 HydrophobicContact CH2-CD2 4.05Å; W264-F268 HydrophobicContact CH2-CG 4.09Å; W264-F268 HydrophobicContact CZ3-CB 3.83Å; W264-F268 HydrophobicContact CZ3-CD2 4.48Å; W264-F268 HydrophobicContact CZ3-CG 4.06Å; W264-F268 PolarHBondContact O-N 3.02Å; W265-F268 HydrophobicContact CE3-CB 4.45Å; W265-F268 AromaticContact CE3-CD1 3.72Å; W265-F268 HydrophobicContact CE3-CD1 3.72Å; W265-F268 HydrophobicContact CE3-CE1 4.47Å; W265-F268 HydrophobicContact CE3-CG 4.35Å; W265-F268 AromaticContact CZ3-CD1 3.58Å; W265-F268 HydrophobicContact CZ3-CD1 3.58Å; W265-F268 AromaticContact CZ3-CE1 3.9Å; W265-F268 HydrophobicContact CZ3-CE1 3.9Å; W265-F268 HydrophobicContact CZ3-CG 4.39Å; W265-F268 PolarHBondContact O-N 3.42Å; S266-F268 VanDerWaalsContact C-N 3.35Å; S266-F268 PolarHBondContact O-N 2.91Å; F268-I270 VanDerWaalsContact C-N 3.27Å; F268-I270 PolarHBondContact O-N 3.35Å; F268-V272 HydrophobicContact CD2-CB 3.9Å; F268-V272 HydrophobicContact CD2-CG1 3.88Å; F268-V272 HydrophobicContact CE2-CB 4.26Å; F268-V272 HydrophobicContact CE2-CG1 3.86Å; F268-V272 CarbonylContact O-C 3.44Å; F268-V272 WeakPolarHBondContact O-CA 3.47Å; F268-V272 WeakPolarHBondContact O-CB 3.42Å; F268-V272 PolarHBondContact O-N 3.16Å; F268-R273 HydrophobicContact CD1-CB 4.33Å; F268-R273 HydrophobicContact CE1-CB 3.83Å; F268-R273 HydrophobicContact CE1-CG 4.35Å; F268-R273 HydrophobicContact CZ-CB 4.04Å; F268-R273 WeakPolarHBondContact O-CB 3.31Å; F268-R273 PolarHBondContact O-N 3.07Å; F268-L276 HydrophobicContact CE2-CD1 3.86Å; F268-L276 HydrophobicContact CZ-CD1 3.7Å; F268-L282 HydrophobicContact CD1-CD1 4.42Å; F268-L282 HydrophobicContact CD2-CD2 4.45Å; F268-L282 HydrophobicContact CE1-CD1 3.49Å; F268-L282 VanDerWaalsContact CE1-CD1 3.49Å; F268-L282 HydrophobicContact CE1-CD2 4.4Å; F268-L282 HydrophobicContact CE1-CG 4.35Å; F268-L282 HydrophobicContact CE2-CD1 4.25Å; F268-L282 HydrophobicContact CE2-CD2 3.69Å; F268-L282 HydrophobicContact CE2-CG 4.28Å; F268-L282 HydrophobicContact CZ-CD1 3.4Å; F268-L282 HydrophobicContact CZ-CD2 3.66Å; F268-L282 HydrophobicContact CZ-CG 3.75Å
269	L	81.2	Confident	79.7	Confident	33 Å²	33	35.7 Å²	35.7	17%	0.173	18%	0.182	C	C	.	.	I	π-helix	trans	-64.3	-31.5	-173.7	-71.3	171.7	0	0	0	113.1	W265 S266 P274	W265-L269 HydrophobicContact CE3-CG 4.3Å; W265-L269 WeakPolarHBondContact O-CB 3.3Å; W265-L269 VanDerWaalsContact O-CG 3.23Å; W265-L269 WeakPolarHBondContact O-CG 3.36Å; W265-L269 PolarHBondContact O-N 3.46Å; S266-L269 PolarHBondContact O-N 3.45Å; L269-P274 WeakPolarHBondContact O-CD 3.33Å
270	I	77.6	Confident	79.5	Confident	28 Å²	28	36.8 Å²	36.8	14%	0.144	19%	0.188	C	C	.	.	I	π-helix	trans	-95.1	-41.2	-172.2	-60.2	169	0	0	0	111.7	F241 F244 F245 S266 F268 P274	F241-I270 HydrophobicContact CD2-CD1 3.85Å; F241-I270 HydrophobicContact CD2-CG1 4.14Å; F241-I270 HydrophobicContact CE2-CD1 3.86Å; F241-I270 HydrophobicContact CE2-CG1 3.65Å; F241-I270 HydrophobicContact CZ-CG1 4.34Å; F244-I270 HydrophobicContact CB-CD1 3.99Å; F244-I270 HydrophobicContact CD1-CB 4.44Å; F244-I270 HydrophobicContact CD1-CD1 3.19Å; F244-I270 HydrophobicContact CD1-CG1 4.38Å; F244-I270 HydrophobicContact CD1-CG2 4.17Å; F244-I270 HydrophobicContact CD2-CD1 4.39Å; F244-I270 HydrophobicContact CE1-CB 4.1Å; F244-I270 HydrophobicContact CE1-CD1 3.71Å; F244-I270 HydrophobicContact CE1-CG2 3.75Å; F244-I270 HydrophobicContact CG-CD1 3.61Å; F245-I270 HydrophobicContact CD2-CD1 3.88Å; F245-I270 HydrophobicContact CE1-CG2 4.47Å; F245-I270 HydrophobicContact CE2-CB 4.49Å; F245-I270 HydrophobicContact CE2-CD1 3.4Å; F245-I270 VanDerWaalsContact CE2-CD1 3.4Å; F245-I270 HydrophobicContact CE2-CG1 3.64Å; F245-I270 HydrophobicContact CE2-CG2 4.03Å; F245-I270 HydrophobicContact CZ-CD1 4.26Å; F245-I270 HydrophobicContact CZ-CG1 4.11Å; F245-I270 HydrophobicContact CZ-CG2 3.8Å; S266-I270 VanDerWaalsContact O-CB 3.28Å; S266-I270 WeakPolarHBondContact O-CB 3.4Å; S266-I270 WeakPolarHBondContact O-CD1 3.27Å; S266-I270 WeakPolarHBondContact O-CG1 3.24Å; S266-I270 PolarHBondContact O-N 3.05Å; S266-I270 VanDerWaalsContact O-N 3.1Å; F268-I270 VanDerWaalsContact C-N 3.27Å; F268-I270 PolarHBondContact O-N 3.35Å; I270-P274 WeakPolarHBondContact O-CG 3.48Å
271	L	84.6	Confident	78.7	Confident	43 Å²	43	41.9 Å²	41.9	23%	0.225	21%	0.207	C	C	.	.	I	π-helix	trans	-108.8	-23.9	-169.7	-57.6	180	0	0	0	113.9	A24 Q28 F244 L267 K275	A24-L271 HydrophobicContact CB-CB 4.29Å; A24-L271 HydrophobicContact CB-CD1 4.02Å; Q28-L271 HydrophobicContact CG-CD1 3.87Å; F244-L271 HydrophobicContact CZ-CD1 3.97Å; F244-L271 HydrophobicContact CZ-CG 4.28Å; L267-L271 HydrophobicContact CD2-CD1 3.81Å; L267-L271 WeakPolarHBondContact O-CB 3.3Å; L267-L271 PolarHBondContact O-N 3.45Å; L271-K275 WeakPolarHBondContact O-CD 3.41Å; L271-K275 VanDerWaalsContact O-CE 3.25Å; L271-K275 WeakPolarHBondContact O-CE 3.34Å
272	V	86.8	Confident	77.8	Confident	6 Å²	6	43 Å²	43	4%	0.036	21%	0.214	C	C	.	.	I	π-helix	trans	-105.5	-55.5	-175.6	-179.3	0	0	0	0	111.1	L20 V21 L267 F268 P274 K275 L276	L20-V272 HydrophobicContact CB-CB 4.49Å; L20-V272 HydrophobicContact CB-CG1 3.67Å; L20-V272 HydrophobicContact CB-CG2 3.97Å; L20-V272 HydrophobicContact CD1-CG1 3.8Å; L20-V272 HydrophobicContact CG-CG1 4.36Å; V21-V272 HydrophobicContact CG2-CG2 3.86Å; L267-V272 PolarHBondContact O-N 3.2Å; F268-V272 HydrophobicContact CD2-CB 3.9Å; F268-V272 HydrophobicContact CD2-CG1 3.88Å; F268-V272 HydrophobicContact CE2-CB 4.26Å; F268-V272 HydrophobicContact CE2-CG1 3.86Å; F268-V272 CarbonylContact O-C 3.44Å; F268-V272 WeakPolarHBondContact O-CA 3.47Å; F268-V272 WeakPolarHBondContact O-CB 3.42Å; F268-V272 PolarHBondContact O-N 3.16Å; V272-P274 VanDerWaalsContact C-CD 3.48Å; V272-K275 WeakPolarHBondContact O-CB 3.45Å; V272-K275 PolarHBondContact O-N 3.15Å; V272-L276 HydrophobicContact CG1-CD2 4.19Å; V272-L276 HydrophobicContact CG1-CG 4.41Å; V272-L276 PolarHBondContact O-N 3.12Å
273	R	83.5	Confident	76.7	Confident	97 Å²	97	44.1 Å²	44.1	37%	0.366	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-51.4	-45.1	-176.6	178.8	-178.8	177.8	168.6	1.7	113.6	F268 K275 L276	F268-R273 HydrophobicContact CD1-CB 4.33Å; F268-R273 HydrophobicContact CE1-CB 3.83Å; F268-R273 HydrophobicContact CE1-CG 4.35Å; F268-R273 HydrophobicContact CZ-CB 4.04Å; F268-R273 WeakPolarHBondContact O-CB 3.31Å; F268-R273 PolarHBondContact O-N 3.07Å; R273-K275 PolarHBondContact O-N 3.25Å; R273-K275 VanDerWaalsContact O-N 3.09Å; R273-L276 PolarHBondContact O-N 3.38Å
274	P	84.4	Confident	75	Confident	87 Å²	87	52.7 Å²	52.7	57%	0.565	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-64	-16.3	-179.3	-23.6	36.6	0	0	0	114	L269 I270 V272	L269-P274 WeakPolarHBondContact O-CD 3.33Å; I270-P274 WeakPolarHBondContact O-CG 3.48Å; V272-P274 VanDerWaalsContact C-CD 3.48Å
275	K	86.8	Confident	72.6	Confident	124 Å²	124	55.8 Å²	55.8	54%	0.539	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-94.1	-16.3	177.7	-54	179.4	-178.6	176.4	0	112.6	L50 L271 V272 R273	L50-K275 HydrophobicContact CD2-CB 4.09Å; L50-K275 WeakPolarHBondContact CD2-O 3.47Å; L271-K275 WeakPolarHBondContact O-CD 3.41Å; L271-K275 VanDerWaalsContact O-CE 3.25Å; L271-K275 WeakPolarHBondContact O-CE 3.34Å; V272-K275 WeakPolarHBondContact O-CB 3.45Å; V272-K275 PolarHBondContact O-N 3.15Å; R273-K275 PolarHBondContact O-N 3.25Å; R273-K275 VanDerWaalsContact O-N 3.09Å
276	L	83.2	Confident	70.3	Confident	31 Å²	31	57.1 Å²	57.1	16%	0.162	29%	0.287	C	S	.	.	S	Bend	trans	-69.7	140	-178.5	-62.4	-176.7	0	0	0	110.7	L20 L50 F268 V272 R273 M280	L20-L276 HydrophobicContact CD1-CD2 4.09Å; L50-L276 HydrophobicContact CD1-CD2 3.83Å; F268-L276 HydrophobicContact CE2-CD1 3.86Å; F268-L276 HydrophobicContact CZ-CD1 3.7Å; V272-L276 HydrophobicContact CG1-CD2 4.19Å; V272-L276 HydrophobicContact CG1-CG 4.41Å; V272-L276 PolarHBondContact O-N 3.12Å; R273-L276 PolarHBondContact O-N 3.38Å; L276-M280 HydrophobicContact CB-CB 4.46Å; L276-M280 HydrophobicContact CD2-CE 4.08Å; L276-M280 HydrophobicContact CD2-SD 4.32Å
277	Y	74.6	Confident	68.3	Low	79 Å²	79	59.9 Å²	59.9	31%	0.31	30%	0.301	S	S	.	.			trans	-68.6	149.6	171.5	-70.6	-87.9	0	0	0	110.8	H46 E49 L50 D279 M280	H46-Y277 HydrophobicContact CB-CD2 3.72Å; H46-Y277 HydrophobicContact CB-CE2 4.12Å; H46-Y277 HydrophobicContact CB-CG 4.39Å; H46-Y277 AromaticContact CD2-CD2 3.84Å; H46-Y277 AromaticContact CD2-CE2 3.86Å; H46-Y277 AromaticContact CD2-CG 3.99Å; E49-Y277 VanDerWaalsContact CD-OH 3.22Å; E49-Y277 PolarHBondContact OE1-OH 3.04Å; E49-Y277 PolarHBondContact OE2-OH 2.59Å; L50-Y277 HydrophobicContact CD1-CD2 4.16Å; L50-Y277 HydrophobicContact CD2-CE2 4.4Å; L50-Y277 HydrophobicContact CG-CD2 4.38Å; L50-Y277 HydrophobicContact CG-CE2 4.25Å; Y277-D279 WeakPolarHBondContact CB-OD1 3.17Å; Y277-D279 PolarHBondContact O-N 3.44Å; Y277-D279 VanDerWaalsContact O-N 3.09Å; Y277-M280 HydrophobicContact CD2-SD 3.92Å; Y277-M280 HydrophobicContact CG-SD 4.46Å; Y277-M280 WeakPolarHBondContact O-CB 3.47Å; Y277-M280 PolarHBondContact O-N 3.31Å
278	P	69.8	Low	65.8	Low	121 Å²	121	63.1 Å²	63.1	79%	0.786	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.9	-176.5	-25.8	34.7	0	0	0	115.4
279	D	66.9	Low	63.2	Low	85 Å²	85	65.8 Å²	65.8	46%	0.455	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-5.3	177.8	65.8	-38	0	0	0	113.5	H46 Y277 Y281	H46-D279 IonicContact CE1-OD2 3.45Å; H46-D279 PolarHBondContact CE1-OD2 2.63Å; H46-D279 IonicContact ND1-OD2 3.32Å; H46-D279 PolarHBondContact ND1-OD2 2.7Å; Y277-D279 WeakPolarHBondContact CB-OD1 3.17Å; Y277-D279 PolarHBondContact O-N 3.44Å; Y277-D279 VanDerWaalsContact O-N 3.09Å; D279-Y281 WeakPolarHBondContact O-CD2 3.47Å; D279-Y281 WeakPolarHBondContact O-CE2 3.4Å
280	M	68.1	Low	60.9	Low	24 Å²	24	66.7 Å²	66.7	12%	0.118	34%	0.342	C	S	.	.			trans	-87.5	114.7	176.6	-61.5	180	72.5	0	0	110.2	H46 M47 L50 L276 Y277	H46-M280 HydrophobicContact CB-CG 4.42Å; H46-M280 HydrophobicContact CB-SD 3.97Å; M47-M280 HydrophobicContact CB-CE 3.86Å; M47-M280 HydrophobicContact CE-CE 3.2Å; M47-M280 HydrophobicContact CG-CE 4.36Å; M47-M280 HydrophobicContact SD-CE 3.76Å; L50-M280 HydrophobicContact CD1-CE 3.73Å; L50-M280 HydrophobicContact CD1-SD 3.42Å; L50-M280 WeakPolarHBondContact CD1-SD 3.05Å; L276-M280 HydrophobicContact CB-CB 4.46Å; L276-M280 HydrophobicContact CD2-CE 4.08Å; L276-M280 HydrophobicContact CD2-SD 4.32Å; Y277-M280 HydrophobicContact CD2-SD 3.92Å; Y277-M280 HydrophobicContact CG-SD 4.46Å; Y277-M280 WeakPolarHBondContact O-CB 3.47Å; Y277-M280 PolarHBondContact O-N 3.31Å
281	Y	60.8	Low	58.6	Low	106 Å²	106	72.8 Å²	72.8	42%	0.416	36%	0.364	S	S	.	.			trans	-110.3	145.1	179.4	-57.4	-83.3	0	0	0	110.7	D279 S283 L287	D279-Y281 WeakPolarHBondContact O-CD2 3.47Å; D279-Y281 WeakPolarHBondContact O-CE2 3.4Å; Y281-S283 PolarHBondContact O-N 3.25Å; Y281-L287 HydrophobicContact CD1-CB 4.24Å; Y281-L287 HydrophobicContact CD1-CD1 4.05Å; Y281-L287 VanDerWaalsContact CD1-N 3.32Å; Y281-L287 HydrophobicContact CE1-CB 4.08Å
282	L	59.7	Low	56	Low	25 Å²	25	78.8 Å²	78.8	13%	0.131	39%	0.388	C	S	.	.	S	Bend	trans	-71.2	-8.2	-175.7	-86.7	164.4	0	0	0	115.3	V17 W227 W265 F268	V17-L282 HydrophobicContact CB-CD2 4.31Å; V17-L282 HydrophobicContact CG1-CD2 3.51Å; V17-L282 HydrophobicContact CG2-CD2 4.07Å; W227-L282 HydrophobicContact CB-CD2 3.84Å; W265-L282 HydrophobicContact CH2-CD1 3.84Å; W265-L282 HydrophobicContact CZ3-CD1 3.95Å; F268-L282 HydrophobicContact CD1-CD1 4.42Å; F268-L282 HydrophobicContact CD2-CD2 4.45Å; F268-L282 HydrophobicContact CE1-CD1 3.49Å; F268-L282 VanDerWaalsContact CE1-CD1 3.49Å; F268-L282 HydrophobicContact CE1-CD2 4.4Å; F268-L282 HydrophobicContact CE1-CG 4.35Å; F268-L282 HydrophobicContact CE2-CD1 4.25Å; F268-L282 HydrophobicContact CE2-CD2 3.69Å; F268-L282 HydrophobicContact CE2-CG 4.28Å; F268-L282 HydrophobicContact CZ-CD1 3.4Å; F268-L282 HydrophobicContact CZ-CD2 3.66Å; F268-L282 HydrophobicContact CZ-CG 3.75Å
283	S	51.1	Low	53	Low	23 Å²	23	88.7 Å²	88.7	16%	0.161	43%	0.426	C	S	.	.	S	Bend	trans	166.3	-178.4	173.6	43.2	0	0	0	0	106.5	Y281 I285	Y281-S283 PolarHBondContact O-N 3.25Å; S283-I285 CarbonylContact O-C 3.46Å; S283-I285 VanDerWaalsContact O-C 3.31Å; S283-I285 PolarHBondContact O-N 2.74Å
284	H	42	Very low	50.4	Low	186 Å²	186	90.5 Å²	90.5	86%	0.861	44%	0.443	S	S	*	.	S	Bend	trans	-49.6	-4.2	179.7	-71.6	-76.9	0	0	0	117.1	S286	H284-S286 VanDerWaalsContact C-N 3.3Å; H284-S286 PolarHBondContact O-N 2.69Å; H284-S286 VanDerWaalsContact O-N 3.08Å
285	I	36	Very low	48.2	Very low	65 Å²	65	90.7 Å²	90.7	33%	0.333	44%	0.444	S	S	.	.			trans	-76.2	86.4	161.7	-51.5	172.4	0	0	0	107.5	T230 S283 L287 L290	T230-I285 HydrophobicContact CG2-CD1 4.48Å; S283-I285 CarbonylContact O-C 3.46Å; S283-I285 VanDerWaalsContact O-C 3.31Å; S283-I285 PolarHBondContact O-N 2.74Å; I285-L287 PolarHBondContact O-N 3.11Å; I285-L290 HydrophobicContact CG2-CD1 4.2Å; I285-L290 HydrophobicContact CG2-CD2 4.18Å; I285-L290 HydrophobicContact CG2-CG 3.85Å
286	S	33.4	Very low	45.4	Very low	32 Å²	32	92.7 Å²	92.7	22%	0.224	46%	0.459	C	S	.	.			trans	-48.1	134.8	162.2	175.4	0	0	0	0	108.1	H284 D288 S289 L290	H284-S286 VanDerWaalsContact C-N 3.3Å; H284-S286 PolarHBondContact O-N 2.69Å; H284-S286 VanDerWaalsContact O-N 3.08Å; S286-D288 PolarHBondContact O-N 2.85Å; S286-D288 VanDerWaalsContact O-N 3.1Å; S286-D288 WeakPolarHBondContact OG-CB 3.37Å; S286-D288 PolarHBondContact OG-N 2.84Å; S286-S289 WeakPolarHBondContact O-CA 3.21Å; S286-S289 VanDerWaalsContact O-CB 3.27Å; S286-S289 WeakPolarHBondContact O-CB 3.38Å; S286-S289 PolarHBondContact O-N 3.01Å; S286-L290 PolarHBondContact O-N 2.76Å
287	L	34.7	Very low	42.9	Very low	58 Å²	58	99 Å²	99	30%	0.304	49%	0.488	S	S	.	.	H	α-helix	trans	-57.1	-24.2	169.2	-98.9	99.4	0	0	0	110.4	Y281 I285 S289 L290 R291	Y281-L287 HydrophobicContact CD1-CB 4.24Å; Y281-L287 HydrophobicContact CD1-CD1 4.05Å; Y281-L287 VanDerWaalsContact CD1-N 3.32Å; Y281-L287 HydrophobicContact CE1-CB 4.08Å; I285-L287 PolarHBondContact O-N 3.11Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.32Å; L287-L290 HydrophobicContact CG-CD1 4.27Å; L287-L290 CarbonylContact O-C 3.58Å; L287-L290 WeakPolarHBondContact O-CA 3.35Å; L287-L290 VanDerWaalsContact O-CB 3.31Å; L287-L290 WeakPolarHBondContact O-CB 3.45Å; L287-L290 PolarHBondContact O-N 3.45Å; L287-L290 VanDerWaalsContact O-N 3.08Å; L287-R291 WeakPolarHBondContact O-CG 3.33Å; L287-R291 PolarHBondContact O-N 3.32Å
288	D	30.7	Very low	40.7	Very low	69 Å²	69	101.6 Å²	101.6	37%	0.369	51%	0.507	S	S	.	.	H	α-helix	trans	-69.8	-26.5	170.4	-75.1	-18	0	0	0	113.4	S286 L290 R291 K292	S286-D288 PolarHBondContact O-N 2.85Å; S286-D288 VanDerWaalsContact O-N 3.1Å; S286-D288 WeakPolarHBondContact OG-CB 3.37Å; S286-D288 PolarHBondContact OG-N 2.84Å; D288-L290 VanDerWaalsContact C-N 3.26Å; D288-R291 CarbonylContact O-C 3.59Å; D288-R291 PolarHBondContact O-N 3.47Å; D288-R291 WeakPolarHBondContact OD1-CD 3.45Å; D288-R291 IonicContact OD1-CZ 3.89Å; D288-R291 IonicContact OD1-NE 3.69Å; D288-R291 IonicContact OD1-NH1 3.96Å; D288-K292 WeakPolarHBondContact O-CB 3.45Å; D288-K292 WeakPolarHBondContact O-CG 3.42Å; D288-K292 PolarHBondContact O-N 2.9Å
289	S	31.6	Very low	38.7	Very low	60 Å²	60	100.7 Å²	100.7	42%	0.42	50%	0.503	S	S	.	.	H	α-helix	trans	-70.1	-26.1	168.1	-63.8	0	0	0	0	111.6	S286 L287	S286-S289 WeakPolarHBondContact O-CA 3.21Å; S286-S289 VanDerWaalsContact O-CB 3.27Å; S286-S289 WeakPolarHBondContact O-CB 3.38Å; S286-S289 PolarHBondContact O-N 3.01Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.32Å
290	L	31.9	Very low	36.9	Very low	51 Å²	51	105.7 Å²	105.7	27%	0.267	52%	0.521	S	S	.	.	H	α-helix	trans	-72.9	-33.1	167	-66.2	166.5	0	0	0	111.3	I285 S286 L287 D288	I285-L290 HydrophobicContact CG2-CD1 4.2Å; I285-L290 HydrophobicContact CG2-CD2 4.18Å; I285-L290 HydrophobicContact CG2-CG 3.85Å; S286-L290 PolarHBondContact O-N 2.76Å; L287-L290 HydrophobicContact CG-CD1 4.27Å; L287-L290 CarbonylContact O-C 3.58Å; L287-L290 WeakPolarHBondContact O-CA 3.35Å; L287-L290 VanDerWaalsContact O-CB 3.31Å; L287-L290 WeakPolarHBondContact O-CB 3.45Å; L287-L290 PolarHBondContact O-N 3.45Å; L287-L290 VanDerWaalsContact O-N 3.08Å; D288-L290 VanDerWaalsContact C-N 3.26Å
291	R	29.9	Very low	35	Very low	156 Å²	156	111.3 Å²	111.3	59%	0.589	55%	0.552	S	S	*	*	H	α-helix	trans	-73.1	-28.3	175	-65.7	-179.3	-163.6	-174.5	4	115.1	L287 D288 E358	L287-R291 WeakPolarHBondContact O-CG 3.33Å; L287-R291 PolarHBondContact O-N 3.32Å; D288-R291 CarbonylContact O-C 3.59Å; D288-R291 PolarHBondContact O-N 3.47Å; D288-R291 WeakPolarHBondContact OD1-CD 3.45Å; D288-R291 IonicContact OD1-CZ 3.89Å; D288-R291 IonicContact OD1-NE 3.69Å; D288-R291 IonicContact OD1-NH1 3.96Å; R291-E358 WeakPolarHBondContact CA-OE1 3.32Å; R291-E358 WeakPolarHBondContact CG-OE1 3.34Å
292	K	29.5	Very low	33.4	Very low	169 Å²	169	118.1 Å²	118.1	74%	0.735	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	-6.2	-175	-78.3	179.3	-176.1	174.2	0	114.6	D288 D294	D288-K292 WeakPolarHBondContact O-CB 3.45Å; D288-K292 WeakPolarHBondContact O-CG 3.42Å; D288-K292 PolarHBondContact O-N 2.9Å; K292-D294 PolarHBondContact O-N 3Å; K292-D294 VanDerWaalsContact O-N 3.1Å
293	Y	25.2	Very low	31.6	Very low	215 Å²	215	122.3 Å²	122.3	84%	0.843	61%	0.607	S	S	*	*			trans	-86.3	59.7	172.5	-95.8	-87	0	0	0	110.9
294	D	27.8	Very low	30.5	Very low	135 Å²	135	127.8 Å²	127.8	72%	0.722	63%	0.634	S	S	*	*			trans	-157.7	130.3	168.1	-152.9	3.7	0	0	0	105.4	K292	K292-D294 PolarHBondContact O-N 3Å; K292-D294 VanDerWaalsContact O-N 3.1Å
295	P	38	Very low	29.9	Very low	91 Å²	91	128.3 Å²	128.3	59%	0.591	64%	0.638	S	S	*	*			cis	-129.1	117	5.7	35	-14.5	0	0	0	112.9	Q297	P295-Q297 HydrophobicContact CB-CG 4.27Å; P295-Q297 PolarHBondContact O-N 2.64Å; P295-Q297 VanDerWaalsContact O-N 3.14Å
296	I	28.1	Very low	29.4	Very low	166 Å²	166	129.8 Å²	129.8	85%	0.851	65%	0.653	S	S	*	*			trans	-84.7	78.6	151.6	-59.1	177.8	0	0	0	105.2	D298	I296-D298 PolarHBondContact O-N 2.99Å
297	Q	30.9	Very low	29	Very low	164 Å²	164	135.9 Å²	135.9	77%	0.766	68%	0.678	S	S	*	*			trans	-51.8	109.9	166.7	-94.1	174.6	-18.1	0	0	108.9	P295 S299	P295-Q297 HydrophobicContact CB-CG 4.27Å; P295-Q297 PolarHBondContact O-N 2.64Å; P295-Q297 VanDerWaalsContact O-N 3.14Å; Q297-S299 PolarHBondContact O-N 3.28Å
298	D	28.8	Very low	28.5	Very low	133 Å²	133	141.3 Å²	141.3	71%	0.711	71%	0.706	S	S	*	*			trans	20.1	73.1	140.2	-78.5	-31.4	0	0	0	115.3	I296 F300	I296-D298 PolarHBondContact O-N 2.99Å; D298-F300 PolarHBondContact O-N 3.17Å
299	S	28.7	Very low	28.1	Very low	101 Å²	101	147.4 Å²	147.4	71%	0.706	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	7.3	166.1	56.2	0	0	0	0	112.8	Q297	Q297-S299 PolarHBondContact O-N 3.28Å
300	F	28.5	Very low	27.9	Very low	190 Å²	190	151.1 Å²	151.1	83%	0.833	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	3	-178.2	-84.9	-75.9	0	0	0	115.7	D298	D298-F300 PolarHBondContact O-N 3.17Å
301	N	28.3	Very low	27.4	Very low	143 Å²	143	155.5 Å²	155.5	77%	0.765	77%	0.77	S	S	*	*	S	Bend	trans	-118.6	36.4	-179.9	-79.7	-26.8	0	0	0	115.2
302	R	26.4	Very low	27.3	Very low	249 Å²	249	156.3 Å²	156.3	94%	0.94	78%	0.78	S	S	*	*			trans	-126	73.1	167.9	-70.2	-166.3	-165.5	-151.5	4.7	112.6
303	C	22.9	Very low	27.2	Very low	112 Å²	112	154.5 Å²	154.5	76%	0.757	78%	0.778	S	S	*	*			trans	-145	147.7	146.6	-156.9	0	0	0	0	107.6
304	D	26.5	Very low	27.1	Very low	138 Å²	138	151.5 Å²	151.5	74%	0.738	78%	0.776	S	S	*	*			trans	84.1	67	173.1	-53.3	-9.2	0	0	0	116.9
305	Q	30.3	Very low	26.9	Very low	198 Å²	198	150 Å²	150	93%	0.925	78%	0.777	S	S	*	*			trans	-129.3	74	138.8	-74.2	-169	-8	0	0	109.6	H307	Q305-H307 PolarHBondContact O-N 2.83Å
306	S	25.3	Very low	26.2	Very low	95 Å²	95	155 Å²	155	66%	0.664	79%	0.785	S	S	*	*			trans	-73.5	110.6	162.2	42.7	0	0	0	0	109.3
307	H	24.7	Very low	26.3	Very low	161 Å²	161	154.7 Å²	154.7	75%	0.745	79%	0.785	S	S	*	*			trans	29	101.9	140	-54.1	-71.5	0	0	0	118	Q305	Q305-H307 PolarHBondContact O-N 2.83Å
308	L	24.4	Very low	26.1	Very low	171 Å²	171	154.9 Å²	154.9	90%	0.895	79%	0.786	S	S	*	*			trans	-132.3	103.4	147.1	-96.5	140.6	0	0	0	108.6	T310	L308-T310 PolarHBondContact O-N 3.04Å
309	Y	22.2	Very low	26.1	Very low	197 Å²	197	155.4 Å²	155.4	77%	0.773	79%	0.789	S	S	*	*			trans	-53.4	122	168.5	-81.6	-100	0	0	0	110.2
310	T	26.6	Very low	26.2	Very low	139 Å²	139	157.8 Å²	157.8	85%	0.853	79%	0.793	S	S	*	*			trans	-136.7	98.1	145	41.7	0	0	0	0	107.2	L308	L308-T310 PolarHBondContact O-N 3.04Å
311	N	22.3	Very low	26.2	Very low	143 Å²	143	154.2 Å²	154.2	77%	0.765	79%	0.792	S	S	*	*			trans	-57.9	131.9	158	-92	-33.2	0	0	0	107.7
312	E	28.2	Very low	26.3	Very low	173 Å²	173	157.2 Å²	157.2	81%	0.808	80%	0.798	S	S	*	*			trans	-168.3	105	133.1	-105	168.1	-156.2	0	0	110.4
313	N	26.3	Very low	26.4	Very low	130 Å²	130	151.6 Å²	151.6	70%	0.695	79%	0.792	S	S	*	*				50.9	102	129.2	-60.3	-31	0	0	0	117.4
314	L	23	Very low	26.9	Very low	152 Å²	152	153.8 Å²	153.8	80%	0.796	79%	0.791	S	S	*	*				67.6	106.2	97	-74	162.4	0	0	0	113.3
315	S	24.1	Very low	27.1	Very low	105 Å²	105	156.2 Å²	156.2	73%	0.734	80%	0.8	S	S	*	*				175.9	125.5	111.5	47.8	0	0	0	0	112.7
316	Y	24.3	Very low	27.4	Very low	196 Å²	196	156.2 Å²	156.2	77%	0.769	79%	0.793	S	S	*	*			trans	40.7	112.5	138.1	-70.5	-89.7	0	0	0	119.4
317	N	30.4	Very low	27.9	Very low	159 Å²	159	155.6 Å²	155.6	85%	0.85	79%	0.787	S	S	*	*				-168.5	109.6	103.6	-93.7	-32.8	0	0	0	111.3
318	H	26.2	Very low	28.5	Very low	168 Å²	168	151.1 Å²	151.1	78%	0.778	77%	0.774	S	S	*	*			trans	-59.4	135.9	154.7	-87	-85.8	0	0	0	108.9
319	N	28.3	Very low	29.5	Very low	144 Å²	144	148.1 Å²	148.1	77%	0.77	77%	0.765	S	S	*	*				-176.1	129.9	125.9	-86.8	-23.1	0	0	0	112.4
320	N	30.8	Very low	30.2	Very low	151 Å²	151	144.6 Å²	144.6	81%	0.807	76%	0.755	S	S	*	*			trans	72	82	153	-62.1	-13.2	0	0	0	119	F322	N320-F322 PolarHBondContact O-N 2.71Å
321	S	28.4	Very low	30.9	Very low	114 Å²	114	143.7 Å²	143.7	80%	0.797	74%	0.741	S	S	*	*			trans	-60.5	101.4	155.5	52.6	0	0	0	0	112.2
322	F	30.1	Very low	32	Very low	207 Å²	207	143.1 Å²	143.1	91%	0.908	73%	0.734	S	S	*	*			trans	-131.3	83.1	152.6	-117.9	-89.5	0	0	0	106.9	N320 Q324	N320-F322 PolarHBondContact O-N 2.71Å; F322-Q324 PolarHBondContact O-N 2.81Å; F322-Q324 VanDerWaalsContact O-N 3.12Å
323	T	29	Very low	32.5	Very low	131 Å²	131	143 Å²	143	80%	0.804	73%	0.727	S	S	*	*			trans	-73.3	100.7	173.2	16.4	0	0	0	0	108.4	M325	T323-M325 PolarHBondContact O-N 2.87Å; T323-M325 VanDerWaalsContact O-N 3.17Å
324	Q	33.8	Very low	32.9	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	71%	0.713	S	S	*	*			trans	-55.5	115.1	157.7	-94	177.8	-26.7	0	0	107.6	F322 Y326	F322-Q324 PolarHBondContact O-N 2.81Å; F322-Q324 VanDerWaalsContact O-N 3.12Å; Q324-Y326 PolarHBondContact O-N 3.19Å
325	M	31.2	Very low	33.8	Very low	189 Å²	189	137.3 Å²	137.3	93%	0.931	70%	0.697	S	S	*	*			trans	-65.7	103.1	168.3	-79.7	178.3	107	0	0	107.4	T323	T323-M325 PolarHBondContact O-N 2.87Å; T323-M325 VanDerWaalsContact O-N 3.17Å
326	Y	36.8	Very low	34.9	Very low	197 Å²	197	136.6 Å²	136.6	77%	0.773	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-63.7	127.6	164.3	-73.1	-86.1	0	0	0	107.8	Q324 S328	Q324-Y326 PolarHBondContact O-N 3.19Å; Y326-S328 PolarHBondContact O-N 3.17Å
327	P	35.9	Very low	35.8	Very low	83 Å²	83	130 Å²	130	54%	0.539	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-59.4	140.1	175.2	23.6	-29.9	0	0	0	108.9	E331	P327-E331 HydrophobicContact CB-CB 4.17Å; P327-E331 WeakPolarHBondContact CB-OE2 3.09Å
328	S	36.7	Very low	36.1	Very low	66 Å²	66	128.5 Å²	128.5	46%	0.462	66%	0.662	S	S	.	*	P	Polyproline II helix	trans	-57.7	146.1	178.9	166.6	0	0	0	0	109.5	Y326 H330 E331 E332	Y326-S328 PolarHBondContact O-N 3.17Å; S328-H330 PolarHBondContact O-N 3.33Å; S328-H330 PolarHBondContact OG-N 3.18Å; S328-E331 PolarHBondContact O-N 2.93Å; S328-E332 PolarHBondContact O-N 3.35Å
329	P	45.1	Very low	36.6	Very low	109 Å²	109	129.2 Å²	129.2	71%	0.708	66%	0.658	S	S	*	*	H	α-helix	trans	-49.5	-24.1	175.6	-27.3	33.7	0	0	0	113.9	Y333	P329-Y333 PolarHBondContact O-N 3.13Å
330	H	36.3	Very low	36.8	Very low	123 Å²	123	132.3 Å²	132.3	57%	0.569	66%	0.659	S	S	*	*	H	α-helix	trans	-69.9	-37.2	175.1	-170.4	-91.1	0	0	0	113.8	S328 Y333 I334	S328-H330 PolarHBondContact O-N 3.33Å; S328-H330 PolarHBondContact OG-N 3.18Å; H330-Y333 PolarHBondContact O-N 3.5Å; H330-I334 WeakPolarHBondContact CE1-CD1 3.41Å; H330-I334 WeakPolarHBondContact O-CG1 3.47Å; H330-I334 PolarHBondContact O-N 3.28Å; H330-I334 VanDerWaalsContact O-N 3.13Å
331	E	41.9	Very low	36.8	Very low	120 Å²	120	132.3 Å²	132.3	56%	0.561	66%	0.659	S	S	*	*	H	α-helix	trans	-72.1	-36.7	176.9	-75.9	178	148.6	0	0	111.4	P327 S328 Y333 I334 D335	P327-E331 HydrophobicContact CB-CB 4.17Å; P327-E331 WeakPolarHBondContact CB-OE2 3.09Å; S328-E331 PolarHBondContact O-N 2.93Å; E331-Y333 VanDerWaalsContact C-N 3.3Å; E331-Y333 PolarHBondContact O-N 2.94Å; E331-I334 PolarHBondContact O-N 2.86Å; E331-D335 PolarHBondContact O-N 3.49Å
332	E	44.5	Very low	36.8	Very low	130 Å²	130	136.2 Å²	136.2	61%	0.607	67%	0.665	S	S	*	*	H	α-helix	trans	-66.4	-33.2	174.4	-167.1	176.6	-168.5	0	0	112	S328 N336	S328-E332 PolarHBondContact O-N 3.35Å; E332-N336 WeakPolarHBondContact O-CB 3.31Å; E332-N336 PolarHBondContact O-N 3.49Å; E332-N336 VanDerWaalsContact O-N 3.16Å; E332-N336 PolarHBondContact O-ND2 2.83Å
333	Y	39.1	Very low	36.7	Very low	172 Å²	172	131.4 Å²	131.4	68%	0.675	66%	0.656	S	S	*	*	H	α-helix	trans	-69.2	-44.6	174.9	-176.8	-97.3	0	0	0	112.5	P329 H330 E331 N336 A337	P329-Y333 PolarHBondContact O-N 3.13Å; H330-Y333 PolarHBondContact O-N 3.5Å; E331-Y333 VanDerWaalsContact C-N 3.3Å; E331-Y333 PolarHBondContact O-N 2.94Å; Y333-N336 PolarHBondContact O-N 3.42Å; Y333-A337 PolarHBondContact O-N 2.99Å
334	I	36.2	Very low	36.7	Very low	77 Å²	77	133.6 Å²	133.6	40%	0.395	66%	0.662	S	S	.	*	H	α-helix	trans	-64.2	-41.8	178.6	-69.4	174.9	0	0	0	110.9	H330 E331 N336 A337 N338	H330-I334 WeakPolarHBondContact CE1-CD1 3.41Å; H330-I334 WeakPolarHBondContact O-CG1 3.47Å; H330-I334 PolarHBondContact O-N 3.28Å; H330-I334 VanDerWaalsContact O-N 3.13Å; E331-I334 PolarHBondContact O-N 2.86Å; I334-N336 VanDerWaalsContact C-N 3.3Å; I334-N336 PolarHBondContact O-N 3.03Å; I334-A337 PolarHBondContact O-N 2.93Å; I334-N338 PolarHBondContact O-N 2.78Å; I334-N338 PolarHBondContact O-ND2 2.94Å
335	D	41.1	Very low	36.4	Very low	85 Å²	85	132.7 Å²	132.7	46%	0.455	66%	0.661	S	S	.	*	H	α-helix	trans	-68.3	-32.5	-179.9	-147.1	51.6	0	0	0	111.8	E331 R339	E331-D335 PolarHBondContact O-N 3.49Å; D335-R339 IonicContact OD2-CZ 3.8Å; D335-R339 IonicContact OD2-NE 2.63Å; D335-R339 IonicContact OD2-NH2 2.94Å; D335-R339 PolarHBondContact OD2-NH2 2.9Å
336	N	47.6	Very low	36.2	Very low	90 Å²	90	127.3 Å²	127.3	48%	0.481	64%	0.639	S	S	.	*	H	α-helix	trans	-72.8	-34	173.9	-83.2	-41.6	0	0	0	113.4	E332 Y333 I334	E332-N336 WeakPolarHBondContact O-CB 3.31Å; E332-N336 PolarHBondContact O-N 3.49Å; E332-N336 VanDerWaalsContact O-N 3.16Å; E332-N336 PolarHBondContact O-ND2 2.83Å; Y333-N336 PolarHBondContact O-N 3.42Å; I334-N336 VanDerWaalsContact C-N 3.3Å; I334-N336 PolarHBondContact O-N 3.03Å
337	A	42.5	Very low	35.9	Very low	58 Å²	58	123.2 Å²	123.2	48%	0.479	64%	0.636	S	S	.	*	H	α-helix	trans	-66.5	-39.5	177.6	0	0	0	0	0	111.9	Y333 I334 R339	Y333-A337 PolarHBondContact O-N 2.99Å; I334-A337 PolarHBondContact O-N 2.93Å; A337-R339 VanDerWaalsContact C-N 3.29Å; A337-R339 PolarHBondContact O-N 3.42Å
338	N	37.5	Very low	35.7	Very low	126 Å²	126	126.4 Å²	126.4	67%	0.674	64%	0.644	S	S	*	*	H	α-helix	trans	-72.5	-16.6	-178.5	-72.7	-29.8	0	0	0	114.3	I334	I334-N338 PolarHBondContact O-N 2.78Å; I334-N338 PolarHBondContact O-ND2 2.94Å
339	R	36.6	Very low	35.5	Very low	184 Å²	184	127 Å²	127	69%	0.694	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	-10.3	-179.3	-70.5	-170.3	-155.9	-158	8.3	114.8	D335 A337 N341	D335-R339 IonicContact OD2-CZ 3.8Å; D335-R339 IonicContact OD2-NE 2.63Å; D335-R339 IonicContact OD2-NH2 2.94Å; D335-R339 PolarHBondContact OD2-NH2 2.9Å; A337-R339 VanDerWaalsContact C-N 3.29Å; A337-R339 PolarHBondContact O-N 3.42Å; R339-N341 PolarHBondContact O-N 2.99Å
340	R	32.7	Very low	34.9	Very low	209 Å²	209	125.6 Å²	125.6	79%	0.789	63%	0.629	S	S	*	*			trans	-86.3	82.9	-178.5	-70	-173.1	-178.9	174.5	1	110.7	H342	R340-H342 PolarHBondContact O-N 2.92Å
341	N	30.6	Very low	34.8	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	64%	0.636	S	S	*	*			trans	-54.6	126.2	165	-85.3	-33	0	0	0	110.2	R339 S343	R339-N341 PolarHBondContact O-N 2.99Å; N341-S343 PolarHBondContact O-N 3.03Å; N341-S343 VanDerWaalsContact O-N 3.13Å
342	H	28.1	Very low	34.3	Very low	197 Å²	197	128.1 Å²	128.1	91%	0.912	64%	0.644	S	S	*	*			trans	-59.7	105.3	-174.9	-68.1	-80.9	0	0	0	112.9	R340	R340-H342 PolarHBondContact O-N 2.92Å
343	S	26.8	Very low	33.7	Very low	105 Å²	105	127.1 Å²	127.1	73%	0.734	64%	0.642	S	S	*	*			trans	-118.1	112.6	164.4	49.5	0	0	0	0	109.8	N341	N341-S343 PolarHBondContact O-N 3.03Å; N341-S343 VanDerWaalsContact O-N 3.13Å
344	L	29.5	Very low	33.2	Very low	177 Å²	177	124.4 Å²	124.4	93%	0.927	65%	0.646	S	S	*	*			trans	-2.1	109	167.4	-64.3	156.4	0	0	0	116.3
345	I	27.3	Very low	33.1	Very low	140 Å²	140	127.1 Å²	127.1	72%	0.718	65%	0.652	S	S	*	*			trans	-70.7	127.4	-173.8	-61.4	166.4	0	0	0	110.8	D349	I345-D349 HydrophobicContact CG2-CB 3.95Å
346	T	27.5	Very low	32.6	Very low	76 Å²	76	126.5 Å²	126.5	47%	0.466	65%	0.647	S	S	.	*			trans	-96.4	154.8	176.4	43.6	0	0	0	0	111.9	E348 D349	T346-E348 PolarHBondContact O-N 3.38Å; T346-E348 VanDerWaalsContact O-N 3.07Å; T346-D349 PolarHBondContact N-OD2 2.96Å; T346-D349 WeakPolarHBondContact O-CB 3.22Å; T346-D349 PolarHBondContact O-N 3.05Å; T346-D349 PolarHBondContact OG1-OD2 3.01Å
347	P	31.1	Very low	31.9	Very low	110 Å²	110	126.9 Å²	126.9	71%	0.714	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-58.1	-25.4	-172.8	-25.3	34.3	0	0	0	115.5	D349 N350	P347-D349 PolarHBondContact O-N 3.22Å; P347-N350 PolarHBondContact O-N 3.28Å
348	E	31.5	Very low	31.7	Very low	151 Å²	151	126.6 Å²	126.6	71%	0.706	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-66.8	-22.7	175.1	-79.3	135.1	169.4	0	0	113	T346 N350 L351	T346-E348 PolarHBondContact O-N 3.38Å; T346-E348 VanDerWaalsContact O-N 3.07Å; E348-N350 VanDerWaalsContact C-N 3.29Å; E348-N350 PolarHBondContact O-N 2.82Å; E348-L351 PolarHBondContact O-N 2.8Å
349	D	32.6	Very low	31.7	Very low	78 Å²	78	122.6 Å²	122.6	42%	0.417	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-73.7	-19.3	177	-62.8	-48.3	0	0	0	112.7	I345 T346 P347 L351 Q352	I345-D349 HydrophobicContact CG2-CB 3.95Å; T346-D349 PolarHBondContact N-OD2 2.96Å; T346-D349 WeakPolarHBondContact O-CB 3.22Å; T346-D349 PolarHBondContact O-N 3.05Å; T346-D349 PolarHBondContact OG1-OD2 3.01Å; P347-D349 PolarHBondContact O-N 3.22Å; D349-L351 PolarHBondContact O-N 3.4Å; D349-Q352 PolarHBondContact O-N 3.29Å
350	N	31.8	Very low	31.4	Very low	80 Å²	80	118.7 Å²	118.7	43%	0.428	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-71	-17.6	176	-80.4	-25.3	0	0	0	113.2	P347 E348 Q352	P347-N350 PolarHBondContact O-N 3.28Å; E348-N350 VanDerWaalsContact C-N 3.29Å; E348-N350 PolarHBondContact O-N 2.82Å; N350-Q352 PolarHBondContact O-N 3.32Å
351	L	34.9	Very low	31.4	Very low	137 Å²	137	116.2 Å²	116.2	72%	0.717	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-76.9	-10.2	173.7	-80.4	160.8	0	0	0	113	E348 D349	E348-L351 PolarHBondContact O-N 2.8Å; D349-L351 PolarHBondContact O-N 3.4Å
352	Q	31.4	Very low	31.6	Very low	158 Å²	158	111.5 Å²	111.5	74%	0.738	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-105.1	19.3	175.9	-65.4	-168.7	23.9	0	0	113.5	D349 N350 P354	D349-Q352 PolarHBondContact O-N 3.29Å; N350-Q352 PolarHBondContact O-N 3.32Å; Q352-P354 WeakPolarHBondContact O-CD 3.22Å
353	L	30.5	Very low	32	Very low	109 Å²	109	107.2 Å²	107.2	57%	0.571	57%	0.572	S	S	*	*	S	Bend	trans	-57.9	111.8	162.8	-76.6	171.2	0	0	0	107.2	Y355	L353-Y355 PolarHBondContact O-N 3.46Å
354	P	29.1	Very low	32.6	Very low	116 Å²	116	103.9 Å²	103.9	75%	0.753	54%	0.543	S	S	*	.			trans	-62.5	114.2	-177.1	-17	30.9	0	0	0	106.7	Q352 H356	Q352-P354 WeakPolarHBondContact O-CD 3.22Å; P354-H356 PolarHBondContact O-N 3.31Å
355	Y	34.4	Very low	33.3	Very low	133 Å²	133	97.9 Å²	97.9	52%	0.522	51%	0.512	S	S	.	.			trans	-54	109.9	171.7	-178.9	-96.5	0	0	0	107.2	L353 H360	L353-Y355 PolarHBondContact O-N 3.46Å; Y355-H360 AromaticContact CE1-CE1 3.72Å; Y355-H360 AromaticContact CE1-NE2 3.86Å
356	H	30.4	Very low	33.9	Very low	73 Å²	73	98.1 Å²	98.1	34%	0.338	51%	0.505	S	S	.	.			trans	-70.9	128.5	-167.4	-155.1	-82.4	0	0	0	109.4	P354 E358 F359	P354-H356 PolarHBondContact O-N 3.31Å; H356-E358 WeakPolarHBondContact CE1-CG 3.23Å; H356-E358 IonicContact CE1-OE1 3.44Å; H356-E358 PolarHBondContact CE1-OE1 2.86Å; H356-E358 IonicContact CE1-OE2 3.95Å; H356-E358 PolarHBondContact CE1-OE2 3.31Å; H356-E358 VanDerWaalsContact ND1-CB 3.34Å; H356-E358 WeakPolarHBondContact ND1-CB 3.48Å; H356-E358 WeakPolarHBondContact ND1-CG 3.47Å; H356-E358 PolarHBondContact ND1-N 3.38Å; H356-E358 IonicContact ND1-OE1 3.4Å; H356-E358 IonicContact ND1-OE2 2.98Å; H356-E358 PolarHBondContact ND1-OE2 2.98Å; H356-E358 IonicContact NE2-OE1 3.55Å; H356-E358 PolarHBondContact O-N 3.34Å; H356-F359 HydrophobicContact CB-CD2 3.54Å; H356-F359 HydrophobicContact CB-CE2 3.36Å; H356-F359 HydrophobicContact CB-CZ 4.43Å; H356-F359 VanDerWaalsContact O-CD2 3.31Å; H356-F359 WeakPolarHBondContact O-CD2 3.38Å; H356-F359 PolarHBondContact O-N 3.29Å; H356-F359 VanDerWaalsContact O-N 3.13Å
357	P	32.6	Very low	34.6	Very low	98 Å²	98	95.5 Å²	95.5	64%	0.636	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-57.2	-20.5	179.9	-24.4	32.5	0	0	0	114.4	F359 H360	P357-F359 PolarHBondContact O-N 2.74Å; P357-F359 VanDerWaalsContact O-N 3.14Å; P357-H360 PolarHBondContact O-CD2 3.5Å; P357-H360 VanDerWaalsContact O-CD2 3.22Å; P357-H360 PolarHBondContact O-N 2.82Å
358	E	38	Very low	35.6	Very low	52 Å²	52	90.2 Å²	90.2	24%	0.243	45%	0.454	C	S	.	.	G	3₁₀ helix	trans	-66.4	-9.6	177.8	-67.1	170.9	-169.8	0	0	114.3	K234 R291 H356	K234-E358 WeakPolarHBondContact CE-O 3.45Å; K234-E358 PolarHBondContact NZ-O 3.06Å; K234-E358 VanDerWaalsContact NZ-O 3.13Å; R291-E358 WeakPolarHBondContact CA-OE1 3.32Å; R291-E358 WeakPolarHBondContact CG-OE1 3.34Å; H356-E358 WeakPolarHBondContact CE1-CG 3.23Å; H356-E358 IonicContact CE1-OE1 3.44Å; H356-E358 PolarHBondContact CE1-OE1 2.86Å; H356-E358 IonicContact CE1-OE2 3.95Å; H356-E358 PolarHBondContact CE1-OE2 3.31Å; H356-E358 VanDerWaalsContact ND1-CB 3.34Å; H356-E358 WeakPolarHBondContact ND1-CB 3.48Å; H356-E358 WeakPolarHBondContact ND1-CG 3.47Å; H356-E358 PolarHBondContact ND1-N 3.38Å; H356-E358 IonicContact ND1-OE1 3.4Å; H356-E358 IonicContact ND1-OE2 2.98Å; H356-E358 PolarHBondContact ND1-OE2 2.98Å; H356-E358 IonicContact NE2-OE1 3.55Å; H356-E358 PolarHBondContact O-N 3.34Å
359	F	38.3	Very low	36.6	Very low	41 Å²	41	88.4 Å²	88.4	18%	0.18	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-91	6.3	-179.2	-62.8	-60.7	0	0	0	114.6	K234 H356 P357	K234-F359 HydrophobicContact CB-CB 4.45Å; K234-F359 VanDerWaalsContact CB-O 3.29Å; K234-F359 WeakPolarHBondContact CB-O 3.46Å; K234-F359 HydrophobicContact CG-CB 4.36Å; K234-F359 HydrophobicContact CG-CD1 3.99Å; H356-F359 HydrophobicContact CB-CD2 3.54Å; H356-F359 HydrophobicContact CB-CE2 3.36Å; H356-F359 HydrophobicContact CB-CZ 4.43Å; H356-F359 VanDerWaalsContact O-CD2 3.31Å; H356-F359 WeakPolarHBondContact O-CD2 3.38Å; H356-F359 PolarHBondContact O-N 3.29Å; H356-F359 VanDerWaalsContact O-N 3.13Å; P357-F359 PolarHBondContact O-N 2.74Å; P357-F359 VanDerWaalsContact O-N 3.14Å
360	H	30.3	Very low	37.8	Very low	103 Å²	103	85 Å²	85	48%	0.477	42%	0.423	S	S	.	.			trans	-77.7	158.3	171	-64.9	-64.3	0	0	0	112.1	K234 Y355 P357	K234-H360 PolarHBondContact NZ-O 3.34Å; Y355-H360 AromaticContact CE1-CE1 3.72Å; Y355-H360 AromaticContact CE1-NE2 3.86Å; P357-H360 PolarHBondContact O-CD2 3.5Å; P357-H360 VanDerWaalsContact O-CD2 3.22Å; P357-H360 PolarHBondContact O-N 2.82Å
361	D	33.3	Very low	39.3	Very low	156 Å²	156	81.6 Å²	81.6	83%	0.834	41%	0.405	S	S	*	.	S	Bend	trans	92.7	24.6	171.1	-57.6	-19.3	0	0	0	121.2
362	T	33.6	Very low	40.8	Very low	51 Å²	51	76.8 Å²	76.8	31%	0.313	38%	0.377	S	S	.	.	S	Bend	trans	-125.6	127.6	154.4	36.1	0	0	0	0	110.3	S231 K234 T235 W364 L367	S231-T362 PolarHBondContact O-OG1 3.26Å; S231-T362 VanDerWaalsContact O-OG1 3.07Å; K234-T362 WeakPolarHBondContact CB-OG1 3.33Å; T235-T362 VanDerWaalsContact CG2-O 3.29Å; T235-T362 WeakPolarHBondContact CG2-O 3.28Å; T235-T362 VanDerWaalsContact CG2-OG1 3.27Å; T235-T362 WeakPolarHBondContact CG2-OG1 3.38Å; T362-W364 PolarHBondContact O-N 3.07Å; T362-L367 HydrophobicContact CG2-CD1 4.34Å
363	N	37.5	Very low	42.2	Very low	108 Å²	108	69.6 Å²	69.6	58%	0.578	34%	0.344	S	S	*	.			trans	-67.3	108.6	178.7	-173.9	-23.2	0	0	0	108.4	D365 Y366	N363-D365 PolarHBondContact O-N 3.13Å; N363-D365 VanDerWaalsContact O-N 3.08Å; N363-D365 VanDerWaalsContact OD1-CB 3.22Å; N363-D365 WeakPolarHBondContact OD1-CB 3.02Å; N363-D365 PolarHBondContact OD1-N 3.28Å; N363-D365 VanDerWaalsContact OD1-N 3.15Å; N363-Y366 PolarHBondContact O-N 3.27Å
364	W	39.2	Very low	43.9	Very low	35 Å²	35	66 Å²	66	13%	0.133	33%	0.326	C	S	.	.	H	α-helix	trans	-44.7	-43.4	-179.4	-163.8	56.3	0	0	0	114	T235 S237 A240 V257 A258 T362 Y366 H368	T235-W364 VanDerWaalsContact CG2-CA 3.5Å; T235-W364 HydrophobicContact CG2-CB 4.44Å; T235-W364 PolarHBondContact O-NE1 3.31Å; S237-W364 VanDerWaalsContact CB-CD2 3.43Å; S237-W364 VanDerWaalsContact CB-CE2 3.41Å; S237-W364 VanDerWaalsContact CB-CZ2 3.47Å; S237-W364 WeakPolarHBondContact OG-CH2 3.48Å; S237-W364 WeakPolarHBondContact OG-CZ2 2.96Å; S237-W364 WeakPolarHBondContact OG-CZ3 3.36Å; A240-W364 HydrophobicContact CB-CH2 4Å; A240-W364 HydrophobicContact CB-CZ2 3.76Å; V257-W364 HydrophobicContact CG1-CH2 4.14Å; V257-W364 HydrophobicContact CG1-CZ3 4.4Å; V257-W364 WeakPolarHBondContact O-CH2 3.38Å; V257-W364 WeakPolarHBondContact O-CZ3 3.27Å; A258-W364 VanDerWaalsContact CA-CH2 3.43Å; A258-W364 HydrophobicContact CB-CH2 3.68Å; A258-W364 HydrophobicContact CB-CZ2 3.53Å; T362-W364 PolarHBondContact O-N 3.07Å; W364-Y366 VanDerWaalsContact C-N 3.27Å; W364-Y366 PolarHBondContact O-N 3.1Å; W364-H368 AromaticContact CD1-CD2 3.71Å; W364-H368 AromaticContact NE1-CD2 3.43Å; W364-H368 PolarHBondContact NE1-CD2 3.02Å; W364-H368 PolarHBondContact O-CD2 2.96Å; W364-H368 PolarHBondContact O-N 2.79Å
365	D	43.5	Very low	45.8	Very low	50 Å²	50	68.5 Å²	68.5	27%	0.267	33%	0.327	S	S	.	.	H	α-helix	trans	-78.2	-19.8	-167.3	-112.9	9.5	0	0	0	109.8	N363 R369 R372	N363-D365 PolarHBondContact O-N 3.13Å; N363-D365 VanDerWaalsContact O-N 3.08Å; N363-D365 VanDerWaalsContact OD1-CB 3.22Å; N363-D365 WeakPolarHBondContact OD1-CB 3.02Å; N363-D365 PolarHBondContact OD1-N 3.28Å; N363-D365 VanDerWaalsContact OD1-N 3.15Å; D365-R369 WeakPolarHBondContact O-CB 3.49Å; D365-R369 WeakPolarHBondContact O-CD 3.35Å; D365-R369 WeakPolarHBondContact O-CG 3.42Å; D365-R369 PolarHBondContact O-NE 3.12Å; D365-R369 IonicContact OD1-NH1 2.98Å; D365-R369 IonicContact OD2-CZ 3.04Å; D365-R369 IonicContact OD2-NH1 3.7Å; D365-R369 PolarHBondContact OD2-NH1 3.23Å; D365-R369 IonicContact OD2-NH2 2.71Å; D365-R372 IonicContact OD1-CZ 3.65Å; D365-R372 IonicContact OD1-NH1 3.41Å; D365-R372 PolarHBondContact OD1-NH1 2.95Å; D365-R372 IonicContact OD1-NH2 3.68Å; D365-R372 PolarHBondContact OD1-NH2 3.2Å
366	Y	39.8	Very low	47.4	Very low	146 Å²	146	65.9 Å²	65.9	57%	0.573	33%	0.328	S	S	*	.	H	α-helix	trans	-80.9	-46.9	174.3	-160.8	-95.4	0	0	0	112.4	N363 W364 H368	N363-Y366 PolarHBondContact O-N 3.27Å; W364-Y366 VanDerWaalsContact C-N 3.27Å; W364-Y366 PolarHBondContact O-N 3.1Å; Y366-H368 PolarHBondContact O-N 3.15Å
367	L	42	Very low	49.1	Very low	20 Å²	20	65.1 Å²	65.1	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-72.1	-29.8	-173.1	-71.5	175	0	0	0	113.7	F199 T235 T362	F199-L367 VanDerWaalsContact CD2-O 3.25Å; F199-L367 WeakPolarHBondContact CD2-O 3.41Å; F199-L367 HydrophobicContact CE2-CB 4.18Å; F199-L367 HydrophobicContact CE2-CD2 3.98Å; F199-L367 WeakPolarHBondContact CE2-O 3.5Å; T235-L367 HydrophobicContact CG2-CD1 3.72Å; T362-L367 HydrophobicContact CG2-CD1 4.34Å
368	H	53.7	Low	50.5	Low	0 Å²	0	66 Å²	66	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-118.3	-13.7	-165.5	-63.3	-61.4	0	0	0	115.3	T235 A258 W364 Y366 G370 Q371	T235-H368 WeakPolarHBondContact CB-NE2 3.46Å; T235-H368 PolarHBondContact OG1-NE2 3.03Å; A258-H368 WeakPolarHBondContact O-CB 3.29Å; W364-H368 AromaticContact CD1-CD2 3.71Å; W364-H368 AromaticContact NE1-CD2 3.43Å; W364-H368 PolarHBondContact NE1-CD2 3.02Å; W364-H368 PolarHBondContact O-CD2 2.96Å; W364-H368 PolarHBondContact O-N 2.79Å; Y366-H368 PolarHBondContact O-N 3.15Å; H368-G370 PolarHBondContact O-N 3.15Å; H368-Q371 PolarHBondContact O-N 3.25Å
369	R	51.9	Low	51.7	Low	112 Å²	112	63.8 Å²	63.8	42%	0.423	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-56.2	-38.1	-173.8	-97.8	-168.1	-87.1	-126.1	7.1	112.9	D365 Q371 R372	D365-R369 WeakPolarHBondContact O-CB 3.49Å; D365-R369 WeakPolarHBondContact O-CD 3.35Å; D365-R369 WeakPolarHBondContact O-CG 3.42Å; D365-R369 PolarHBondContact O-NE 3.12Å; D365-R369 IonicContact OD1-NH1 2.98Å; D365-R369 IonicContact OD2-CZ 3.04Å; D365-R369 IonicContact OD2-NH1 3.7Å; D365-R369 PolarHBondContact OD2-NH1 3.23Å; D365-R369 IonicContact OD2-NH2 2.71Å; R369-Q371 PolarHBondContact O-N 2.83Å; R369-R372 WeakPolarHBondContact O-CB 3.34Å; R369-R372 PolarHBondContact O-N 2.86Å
370	G	57.2	Low	52.5	Low	6 Å²	6	63.5 Å²	63.5	6%	0.062	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-72.7	-9.3	177.8	0	0	0	0	0	114.7	F201 W208 H368 F379	F201-G370 WeakPolarHBondContact CE1-O 3.46Å; W208-G370 VanDerWaalsContact CD1-O 3.31Å; W208-G370 PolarHBondContact NE1-O 3.21Å; H368-G370 PolarHBondContact O-N 3.15Å; G370-F379 WeakPolarHBondContact O-CD1 3.26Å
371	Q	63.3	Low	53.7	Low	10 Å²	10	63 Å²	63	5%	0.047	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-100.3	6.7	176.9	-62.2	-176.5	-3.4	0	0	112.9	F201 G259 H368 R369 F379	F201-Q371 HydrophobicContact CE1-CG 4.29Å; G259-Q371 VanDerWaalsContact CA-O 3.32Å; G259-Q371 WeakPolarHBondContact CA-O 3.47Å; H368-Q371 PolarHBondContact O-N 3.25Å; R369-Q371 PolarHBondContact O-N 2.83Å; Q371-F379 VanDerWaalsContact CA-CE1 3.46Å; Q371-F379 HydrophobicContact CB-CE1 4.36Å; Q371-F379 WeakPolarHBondContact O-CD1 3.01Å; Q371-F379 WeakPolarHBondContact O-CE1 3.35Å
372	R	66.3	Low	54.5	Low	35 Å²	35	60 Å²	60	13%	0.132	29%	0.287	C	S	.	.			trans	-85.6	146.9	179.7	-69.7	-176	-167.8	170.8	4.9	111.8	R256 V257 D365 R369 F379 V380	R256-R372 WeakPolarHBondContact O-CA 3.44Å; R256-R372 WeakPolarHBondContact O-CB 3.32Å; R256-R372 WeakPolarHBondContact O-CG 3.42Å; V257-R372 WeakPolarHBondContact O-CD 3.21Å; V257-R372 PolarHBondContact O-NE 3.36Å; D365-R372 IonicContact OD1-CZ 3.65Å; D365-R372 IonicContact OD1-NH1 3.41Å; D365-R372 PolarHBondContact OD1-NH1 2.95Å; D365-R372 IonicContact OD1-NH2 3.68Å; D365-R372 PolarHBondContact OD1-NH2 3.2Å; R369-R372 WeakPolarHBondContact O-CB 3.34Å; R369-R372 PolarHBondContact O-N 2.86Å; R372-F379 CarbonylContact O-C 3.6Å; R372-F379 WeakPolarHBondContact O-CA 3.44Å; R372-F379 VanDerWaalsContact O-CB 3.24Å; R372-F379 WeakPolarHBondContact O-CB 3.29Å; R372-F379 WeakPolarHBondContact O-CD1 3.35Å; R372-F379 VanDerWaalsContact O-CG 3.27Å; R372-F379 WeakPolarHBondContact O-CG 3.35Å; R372-V380 HydrophobicContact CB-CB 4.49Å; R372-V380 HydrophobicContact CB-CG2 4.18Å; R372-V380 PolarHBondContact O-N 3.15Å
373	I	61.1	Low	54.7	Low	8 Å²	8	64.7 Å²	64.7	4%	0.041	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-117.3	139.3	-179.8	-61.9	155.8	0	0	0	109.2	C255 R256 M260 N377 R378 F379	C255-I373 HydrophobicContact CB-CD1 4.47Å; R256-I373 WeakPolarHBondContact CA-O 3.44Å; R256-I373 HydrophobicContact CB-CB 4.26Å; R256-I373 WeakPolarHBondContact CB-O 3.44Å; R256-I373 HydrophobicContact CG-CB 3.51Å; R256-I373 HydrophobicContact CG-CG2 3.83Å; R256-I373 WeakPolarHBondContact CG-O 3.46Å; R256-I373 PolarHBondContact O-N 3.39Å; M260-I373 HydrophobicContact CE-CD1 3.86Å; I373-N377 VanDerWaalsContact CG2-C 3.46Å; I373-N377 HydrophobicContact CG2-CB 4.35Å; I373-R378 CarbonylContact C-O 3.48Å; I373-R378 WeakPolarHBondContact CA-O 3.49Å; I373-F379 HydrophobicContact CD1-CD2 4.27Å; I373-F379 HydrophobicContact CD1-CE1 4.3Å; I373-F379 HydrophobicContact CD1-CE2 3.49Å; I373-F379 VanDerWaalsContact CD1-CE2 3.49Å; I373-F379 HydrophobicContact CD1-CZ 3.6Å; I373-F379 HydrophobicContact CG1-CD1 3.9Å; I373-F379 HydrophobicContact CG1-CD2 3.39Å; I373-F379 HydrophobicContact CG1-CE1 3.76Å; I373-F379 HydrophobicContact CG1-CE2 3.1Å; I373-F379 HydrophobicContact CG1-CG 3.79Å; I373-F379 HydrophobicContact CG1-CZ 3.4Å; I373-F379 VanDerWaalsContact CG1-CZ 3.4Å
374	D	66.6	Low	54.8	Low	34 Å²	34	65.7 Å²	65.7	18%	0.182	31%	0.306	C	S	.	.			trans	-82.2	-176.9	179	79.6	-1.1	0	0	0	112.6	R256 S376 N377 R378 V380	R256-D374 VanDerWaalsContact CZ-C 3.49Å; R256-D374 PolarHBondContact NE-O 2.66Å; R256-D374 PolarHBondContact NH1-O 2.86Å; R256-D374 VanDerWaalsContact NH1-O 3.1Å; R256-D374 PolarHBondContact NH2-O 3.06Å; D374-S376 PolarHBondContact O-N 3.38Å; D374-S376 VanDerWaalsContact OD1-C 3.25Å; D374-S376 VanDerWaalsContact OD1-CA 3.29Å; D374-S376 WeakPolarHBondContact OD1-CA 3.09Å; D374-S376 WeakPolarHBondContact OD1-CB 2.97Å; D374-S376 PolarHBondContact OD1-N 2.75Å; D374-N377 PolarHBondContact O-N 3.12Å; D374-N377 PolarHBondContact OD1-N 3.35Å; D374-R378 WeakPolarHBondContact CB-O 3.37Å; D374-R378 VanDerWaalsContact CG-O 3.28Å; D374-R378 PolarHBondContact N-O 3.08Å; D374-R378 WeakPolarHBondContact OD1-CB 3.39Å; D374-R378 PolarHBondContact OD1-N 3.19Å; D374-R378 IonicContact OD2-CZ 3.42Å; D374-R378 IonicContact OD2-NE 3.45Å; D374-R378 PolarHBondContact OD2-NE 3.1Å; D374-R378 VanDerWaalsContact OD2-NE 3.13Å; D374-R378 IonicContact OD2-NH2 2.85Å; D374-R378 PolarHBondContact OD2-NH2 3.42Å; D374-V380 HydrophobicContact CB-CG2 4.36Å
375	E	68.8	Low	54.7	Low	167 Å²	167	70.1 Å²	70.1	78%	0.78	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-31.7	175.7	-75.6	176.7	-166.2	0	0	115.1	R256 N377	R256-E375 VanDerWaalsContact CZ-CA 3.46Å; R256-E375 PolarHBondContact NH1-O 3.45Å; E375-N377 VanDerWaalsContact C-N 3.34Å
376	S	68.5	Low	54.3	Low	79 Å²	79	72.6 Å²	72.6	55%	0.552	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	14.3	-177.3	-57.1	0	0	0	0	113.2	D374 R378	D374-S376 PolarHBondContact O-N 3.38Å; D374-S376 VanDerWaalsContact OD1-C 3.25Å; D374-S376 VanDerWaalsContact OD1-CA 3.29Å; D374-S376 WeakPolarHBondContact OD1-CA 3.09Å; D374-S376 WeakPolarHBondContact OD1-CB 2.97Å; D374-S376 PolarHBondContact OD1-N 2.75Å; S376-R378 VanDerWaalsContact C-N 3.31Å; S376-R378 PolarHBondContact O-N 3.19Å
377	N	66.8	Low	54.2	Low	57 Å²	57	71.8 Å²	71.8	31%	0.305	37%	0.368	S	S	.	.	S	Bend	trans	62	32.3	-175.8	-61.6	-48.5	0	0	0	114.3	G213 I373 D374 E375	G213-N377 WeakPolarHBondContact CA-O 3.34Å; G213-N377 PolarHBondContact N-O 2.88Å; I373-N377 VanDerWaalsContact CG2-C 3.46Å; I373-N377 HydrophobicContact CG2-CB 4.35Å; D374-N377 PolarHBondContact O-N 3.12Å; D374-N377 PolarHBondContact OD1-N 3.35Å; E375-N377 VanDerWaalsContact C-N 3.34Å
378	R	60.8	Low	53.7	Low	117 Å²	117	79.4 Å²	79.4	44%	0.442	40%	0.403	S	S	.	.			trans	-110.4	143.3	173.3	-60.3	177.8	-58.4	-177.1	3	110.4	V209 I373 D374 S376	V209-R378 CarbonylContact O-C 3.51Å; V209-R378 VanDerWaalsContact O-C 3.28Å; V209-R378 WeakPolarHBondContact O-CA 3.49Å; V209-R378 WeakPolarHBondContact O-CB 3.42Å; I373-R378 CarbonylContact C-O 3.48Å; I373-R378 WeakPolarHBondContact CA-O 3.49Å; D374-R378 WeakPolarHBondContact CB-O 3.37Å; D374-R378 VanDerWaalsContact CG-O 3.28Å; D374-R378 PolarHBondContact N-O 3.08Å; D374-R378 WeakPolarHBondContact OD1-CB 3.39Å; D374-R378 PolarHBondContact OD1-N 3.19Å; D374-R378 IonicContact OD2-CZ 3.42Å; D374-R378 IonicContact OD2-NE 3.45Å; D374-R378 PolarHBondContact OD2-NE 3.1Å; D374-R378 VanDerWaalsContact OD2-NE 3.13Å; D374-R378 IonicContact OD2-NH2 2.85Å; D374-R378 PolarHBondContact OD2-NH2 3.42Å; S376-R378 VanDerWaalsContact C-N 3.31Å; S376-R378 PolarHBondContact O-N 3.19Å
379	F	62.8	Low	52.7	Low	5 Å²	5	85.5 Å²	85.5	2%	0.022	44%	0.44	C	S	.	.	B	Isolated β-bridge	trans	-71.5	144.5	177.8	-76.8	-113.2	0	0	0	112.9	W208 V209 G212 M260 G370 Q371 R372 I373	W208-F379 AromaticContact CD1-CD1 3.45Å; W208-F379 VanDerWaalsContact CD1-CD1 3.45Å; W208-F379 AromaticContact CD1-CE1 3.93Å; W208-F379 AromaticContact CD1-CG 3.51Å; W208-F379 HydrophobicContact CD2-CE1 4.36Å; W208-F379 HydrophobicContact CD2-CZ 4.38Å; W208-F379 AromaticContact CE2-CD1 3.7Å; W208-F379 AromaticContact CE2-CE1 3.29Å; W208-F379 AromaticContact CE2-CZ 3.56Å; W208-F379 HydrophobicContact CG-CD1 4.43Å; W208-F379 HydrophobicContact CG-CG 4.3Å; W208-F379 HydrophobicContact CH2-CZ 4.27Å; W208-F379 HydrophobicContact CZ2-CD1 4.26Å; W208-F379 AromaticContact CZ2-CE1 3.39Å; W208-F379 HydrophobicContact CZ2-CE1 3.39Å; W208-F379 HydrophobicContact CZ2-CE2 4.43Å; W208-F379 AromaticContact CZ2-CZ 3.5Å; W208-F379 HydrophobicContact CZ2-CZ 3.5Å; W208-F379 VanDerWaalsContact CZ2-CZ 3.5Å; W208-F379 AromaticContact NE1-CD1 2.93Å; W208-F379 AromaticContact NE1-CE1 3.02Å; W208-F379 AromaticContact NE1-CG 3.5Å; W208-F379 AromaticContact NE1-CZ 3.72Å; W208-F379 WeakPolarHBondContact O-CD2 3.28Å; V209-F379 WeakPolarHBondContact CG1-O 3.35Å; V209-F379 PolarHBondContact O-N 3.35Å; G212-F379 VanDerWaalsContact CA-CD2 3.47Å; G212-F379 WeakPolarHBondContact O-CE2 3.42Å; M260-F379 HydrophobicContact CE-CE1 4.37Å; M260-F379 HydrophobicContact CE-CZ 3.64Å; G370-F379 WeakPolarHBondContact O-CD1 3.26Å; Q371-F379 VanDerWaalsContact CA-CE1 3.46Å; Q371-F379 HydrophobicContact CB-CE1 4.36Å; Q371-F379 WeakPolarHBondContact O-CD1 3.01Å; Q371-F379 WeakPolarHBondContact O-CE1 3.35Å; R372-F379 CarbonylContact O-C 3.6Å; R372-F379 WeakPolarHBondContact O-CA 3.44Å; R372-F379 VanDerWaalsContact O-CB 3.24Å; R372-F379 WeakPolarHBondContact O-CB 3.29Å; R372-F379 WeakPolarHBondContact O-CD1 3.35Å; R372-F379 VanDerWaalsContact O-CG 3.27Å; R372-F379 WeakPolarHBondContact O-CG 3.35Å; I373-F379 HydrophobicContact CD1-CD2 4.27Å; I373-F379 HydrophobicContact CD1-CE1 4.3Å; I373-F379 HydrophobicContact CD1-CE2 3.49Å; I373-F379 VanDerWaalsContact CD1-CE2 3.49Å; I373-F379 HydrophobicContact CD1-CZ 3.6Å; I373-F379 HydrophobicContact CG1-CD1 3.9Å; I373-F379 HydrophobicContact CG1-CD2 3.39Å; I373-F379 HydrophobicContact CG1-CE1 3.76Å; I373-F379 HydrophobicContact CG1-CE2 3.1Å; I373-F379 HydrophobicContact CG1-CG 3.79Å; I373-F379 HydrophobicContact CG1-CZ 3.4Å; I373-F379 VanDerWaalsContact CG1-CZ 3.4Å
380	V	56.9	Low	51.7	Low	35 Å²	35	85.7 Å²	85.7	21%	0.212	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-76	123.8	-178.1	-172.6	0	0	0	0	110	R372 D374 Q384	R372-V380 HydrophobicContact CB-CB 4.49Å; R372-V380 HydrophobicContact CB-CG2 4.18Å; R372-V380 PolarHBondContact O-N 3.15Å; D374-V380 HydrophobicContact CB-CG2 4.36Å; V380-Q384 HydrophobicContact CG1-CB 4.26Å
381	E	54.2	Low	50.4	Low	91 Å²	91	92.7 Å²	92.7	43%	0.425	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-67.6	151	173.9	-78.9	-172.7	168.3	0	0	112.1	V209 H383 Q384	V209-E381 HydrophobicContact CG1-CG 4.33Å; V209-E381 HydrophobicContact CG2-CG 3.67Å; E381-H383 PolarHBondContact O-N 2.81Å; E381-Q384 PolarHBondContact O-N 3.28Å
382	H	49.8	Very low	48.8	Very low	94 Å²	94	97.1 Å²	97.1	44%	0.435	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-13.8	-178.9	-68.8	-25.8	0	0	0	112.6	R205	R205-H382 PolarHBondContact NH1-CD2 3.27Å; R205-H382 PolarHBondContact NH2-CD2 3.2Å; R205-H382 PolarHBondContact NH2-ND1 2.95Å; R205-H382 PolarHBondContact NH2-NE2 3.22Å
383	H	38.6	Very low	47.2	Very low	150 Å²	150	101.4 Å²	101.4	69%	0.694	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-5.3	-172.3	-58.3	-61.6	0	0	0	114.2	E381 T385	E381-H383 PolarHBondContact O-N 2.81Å; H383-T385 PolarHBondContact O-N 3.29Å
384	Q	39.4	Very low	45.7	Very low	129 Å²	129	109.5 Å²	109.5	60%	0.603	59%	0.591	S	S	*	*			trans	-79.8	92.4	168.3	-74.1	-177.4	-6.9	0	0	108.2	V380 E381 C386	V380-Q384 HydrophobicContact CG1-CB 4.26Å; E381-Q384 PolarHBondContact O-N 3.28Å; Q384-C386 PolarHBondContact O-N 3.38Å
385	T	36.3	Very low	44	Very low	127 Å²	127	117.2 Å²	117.2	78%	0.779	62%	0.623	S	S	*	*			trans	-51.4	108.5	162.2	43.4	0	0	0	0	107.3	H383 V387	H383-T385 PolarHBondContact O-N 3.29Å; T385-V387 PolarHBondContact O-N 2.82Å
386	C	36.4	Very low	42.1	Very low	102 Å²	102	116.1 Å²	116.1	69%	0.689	62%	0.622	S	S	*	*			trans	-54.2	118.7	165.1	-78.1	0	0	0	0	106.1	Q384 E388	Q384-C386 PolarHBondContact O-N 3.38Å; C386-E388 VanDerWaalsContact C-N 3.35Å; C386-E388 PolarHBondContact O-N 2.83Å
387	V	36.7	Very low	40.1	Very low	130 Å²	130	119.2 Å²	119.2	79%	0.788	63%	0.632	S	S	*	*			trans	-58.9	106.3	167.9	179.1	0	0	0	0	104.9	T385 T389	T385-V387 PolarHBondContact O-N 2.82Å; V387-T389 PolarHBondContact O-N 3.28Å
388	E	32.7	Very low	38.2	Very low	180 Å²	180	121.4 Å²	121.4	84%	0.841	65%	0.652	S	S	*	*			trans	-54.3	114.2	173.3	-78.1	-175	164.7	0	0	106.5	C386 P390	C386-E388 VanDerWaalsContact C-N 3.35Å; C386-E388 PolarHBondContact O-N 2.83Å; E388-P390 WeakPolarHBondContact O-CD 3.3Å; E388-P390 VanDerWaalsContact O-N 3.15Å
389	T	31.9	Very low	36.5	Very low	127 Å²	127	122.9 Å²	122.9	78%	0.779	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-61	120.6	175.8	-22.5	0	0	0	0	105.6	V387 L391	V387-T389 PolarHBondContact O-N 3.28Å; T389-L391 PolarHBondContact O-N 3.05Å; T389-L391 VanDerWaalsContact O-N 3.11Å
390	P	30.5	Very low	34.7	Very low	116 Å²	116	127.3 Å²	127.3	75%	0.753	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-56	125.9	-175.3	-3.7	3.4	0	0	0	108.6	E388	E388-P390 WeakPolarHBondContact O-CD 3.3Å; E388-P390 VanDerWaalsContact O-N 3.15Å
391	L	30.7	Very low	33.3	Very low	153 Å²	153	129.2 Å²	129.2	80%	0.801	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-51.5	134.6	175	-78.5	157.9	0	0	0	108.4	T389	T389-L391 PolarHBondContact O-N 3.05Å; T389-L391 VanDerWaalsContact O-N 3.11Å
392	P	29	Very low	31.9	Very low	104 Å²	104	130.5 Å²	130.5	68%	0.675	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-55	145.3	-178.1	21.1	-30.9	0	0	0	110.1	Q394	P392-Q394 PolarHBondContact O-N 3.31Å
393	P	32.8	Very low	30.8	Very low	125 Å²	125	133.6 Å²	133.6	81%	0.812	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-52.6	117.2	-169.2	18.8	-30.4	0	0	0	110	F395	P393-F395 PolarHBondContact O-N 3.33Å
394	Q	30.3	Very low	30	Very low	178 Å²	178	136.3 Å²	136.3	83%	0.832	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-58.9	122.3	173.9	-72.8	-177	-14.6	0	0	107.5	P392 D396	P392-Q394 PolarHBondContact O-N 3.31Å; Q394-D396 PolarHBondContact O-N 3.21Å
395	F	30.4	Very low	29.2	Very low	196 Å²	196	136 Å²	136	86%	0.86	78%	0.776	S	S	*	*			trans	-51.7	114.6	175.3	-100.6	-98.1	0	0	0	109.5	P393 L397	P393-F395 PolarHBondContact O-N 3.33Å; F395-L397 VanDerWaalsContact C-N 3.26Å; F395-L397 PolarHBondContact O-N 3.03Å
396	D	28.3	Very low	28.6	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	78%	0.775	S	S	*	*			trans	-72	80.6	-179.2	-159.3	2.7	0	0	0	109.4	Q394 S398	Q394-D396 PolarHBondContact O-N 3.21Å; D396-S398 PolarHBondContact O-N 3.08Å
397	L	26.5	Very low	28	Very low	143 Å²	143	143.1 Å²	143.1	75%	0.749	78%	0.781	S	S	*	*			trans	-75.1	73.7	173.3	-78.3	164.4	0	0	0	109	F395 L399	F395-L397 VanDerWaalsContact C-N 3.26Å; F395-L397 PolarHBondContact O-N 3.03Å; L397-L399 PolarHBondContact O-N 2.94Å
398	S	27.2	Very low	27.6	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	77%	0.771	S	S	*	*			trans	-70.9	71.2	168.6	51.5	0	0	0	0	110.7	D396 S400	D396-S398 PolarHBondContact O-N 3.08Å; S398-S400 PolarHBondContact O-N 2.95Å
399	L	25.5	Very low	27.3	Very low	147 Å²	147	143 Å²	143	77%	0.77	77%	0.772	S	S	*	*			trans	-85.9	87.3	167.4	-96.8	149.7	0	0	0	109.9	L397	L397-L399 PolarHBondContact O-N 2.94Å
400	S	24.9	Very low	27	Very low	98 Å²	98	142.3 Å²	142.3	69%	0.685	77%	0.768	S	S	*	*			trans	46.2	120.4	132.6	65.3	0	0	0	0	119.7	S398	S398-S400 PolarHBondContact O-N 2.95Å
401	G	27.4	Very low	26.7	Very low	75 Å²	75	145.9 Å²	145.9	77%	0.773	78%	0.777	S	S	*	*				82.1	68	126.3	0	0	0	0	0	116.8
402	V	25.4	Very low	26.4	Very low	119 Å²	119	147.5 Å²	147.5	72%	0.721	78%	0.777	S	S	*	*			trans	-137.8	97.3	150.4	-171	0	0	0	0	108.2	Y404	V402-Y404 HydrophobicContact CG1-CD2 4.05Å; V402-Y404 HydrophobicContact CG1-CE2 4.06Å; V402-Y404 PolarHBondContact O-N 3.05Å
403	N	26	Very low	26.5	Very low	158 Å²	158	152.2 Å²	152.2	85%	0.845	79%	0.787	S	S	*	*			trans	-58.9	98.7	169.8	-80.7	-26.2	0	0	0	109.3	C405	N403-C405 PolarHBondContact O-N 3.37Å
404	Y	22.6	Very low	26	Very low	208 Å²	208	153.5 Å²	153.5	82%	0.816	79%	0.787	S	S	*	*			trans	-82.4	94.5	162.9	-99.3	-91.7	0	0	0	108.2	V402 R406	V402-Y404 HydrophobicContact CG1-CD2 4.05Å; V402-Y404 HydrophobicContact CG1-CE2 4.06Å; V402-Y404 PolarHBondContact O-N 3.05Å; Y404-R406 VanDerWaalsContact C-N 3.27Å; Y404-R406 PolarHBondContact O-N 3.48Å
405	C	22.2	Very low	26	Very low	123 Å²	123	150.4 Å²	150.4	83%	0.831	79%	0.785	S	S	*	*			trans	-63.8	91.7	161.3	-69.1	0	0	0	0	108.1	N403	N403-C405 PolarHBondContact O-N 3.37Å
406	R	24.1	Very low	25.7	Very low	200 Å²	200	146 Å²	146	76%	0.755	78%	0.779	S	S	*	*			trans	-86.7	108.3	168.1	-167.6	178.4	-172.8	176.1	-0.4	107.3	Y404 E408	Y404-R406 VanDerWaalsContact C-N 3.27Å; Y404-R406 PolarHBondContact O-N 3.48Å; R406-E408 VanDerWaalsContact C-N 3.25Å; R406-E408 HydrophobicContact CG-CG 4.16Å; R406-E408 IonicContact NE-OE1 3.76Å; R406-E408 PolarHBondContact O-N 3.36Å
407	E	24	Very low	25.9	Very low	177 Å²	177	148.1 Å²	148.1	83%	0.827	78%	0.784	S	S	*	*			trans	-62.7	87	168.2	-69.8	179.3	157.8	0	0	109.1	H409	E407-H409 PolarHBondContact O-N 3.43Å
408	E	26.8	Very low	25.7	Very low	121 Å²	121	149.4 Å²	149.4	57%	0.565	79%	0.786	S	S	*	*			trans	-85	102.2	167.1	-72.6	-167.7	170.6	0	0	108.7	R406 T410	R406-E408 VanDerWaalsContact C-N 3.25Å; R406-E408 HydrophobicContact CG-CG 4.16Å; R406-E408 IonicContact NE-OE1 3.76Å; R406-E408 PolarHBondContact O-N 3.36Å; E408-T410 HydrophobicContact CB-CG2 4.37Å; E408-T410 PolarHBondContact O-N 2.89Å
409	H	25.9	Very low	25.9	Very low	188 Å²	188	151.6 Å²	151.6	87%	0.87	79%	0.789	S	S	*	*			trans	-56.6	81.6	158.1	-76.4	-84.3	0	0	0	109.7	E407	E407-H409 PolarHBondContact O-N 3.43Å
410	T	26.3	Very low	25.9	Very low	112 Å²	112	152.5 Å²	152.5	69%	0.687	79%	0.79	S	S	*	*			trans	-101.9	110.5	167.7	44.5	0	0	0	0	108.9	E408 K412	E408-T410 HydrophobicContact CB-CG2 4.37Å; E408-T410 PolarHBondContact O-N 2.89Å; T410-K412 PolarHBondContact O-N 3.03Å
411	M	25.1	Very low	26.2	Very low	190 Å²	190	158.5 Å²	158.5	94%	0.936	80%	0.799	S	S	*	*			trans	-44.2	119	167.3	-87.4	-89.7	177.5	0	0	110.5	K413	M411-K413 PolarHBondContact O-N 3.33Å
412	K	24.5	Very low	26.3	Very low	187 Å²	187	163 Å²	163	81%	0.813	80%	0.799	S	S	*	*			trans	-39.2	118.1	172.6	-69.8	171.8	173.6	176.2	0	112.6	T410	T410-K412 PolarHBondContact O-N 3.03Å
413	K	29.7	Very low	26.3	Very low	204 Å²	204	161 Å²	161	89%	0.887	80%	0.795	S	S	*	*			trans	-130.8	104.4	143.1	-87.3	-172.2	176.2	178.5	0	108.6	M411	M411-K413 PolarHBondContact O-N 3.33Å
414	N	23.9	Very low	26.5	Very low	152 Å²	152	160.4 Å²	160.4	81%	0.813	79%	0.792	S	S	*	*			trans	-62.7	127.8	173.2	-64.1	-22.9	0	0	0	110.2
415	S	30.1	Very low	26.7	Very low	113 Å²	113	156.8 Å²	156.8	79%	0.79	79%	0.787	S	S	*	*			trans	-161.5	100.8	138.8	61.2	0	0	0	0	109
416	S	24.2	Very low	27.1	Very low	103 Å²	103	158.4 Å²	158.4	72%	0.72	78%	0.782	S	S	*	*			trans	-47.7	135.5	162.3	46.4	0	0	0	0	112.1
417	H	31.1	Very low	27	Very low	189 Å²	189	156.6 Å²	156.6	88%	0.875	78%	0.782	S	S	*	*				-162.1	113	129.1	-101.2	-66	0	0	0	109.8
418	E	23.6	Very low	27	Very low	170 Å²	170	156.3 Å²	156.3	79%	0.794	78%	0.775	S	S	*	*			trans	-59.1	147.3	168	-62.9	163	140.8	0	0	110.5
419	N	31.6	Very low	26.9	Very low	149 Å²	149	157.5 Å²	157.5	80%	0.797	78%	0.78	S	S	*	*				-170.7	116.8	122.9	-90.5	-32.3	0	0	0	110.8
420	Q	24	Very low	26.8	Very low	167 Å²	167	156.9 Å²	156.9	78%	0.78	78%	0.778	S	S	*	*			trans	-66.2	138.3	166.8	-64.4	164	-36	0	0	109.8
421	Y	31.1	Very low	26.9	Very low	224 Å²	224	160.7 Å²	160.7	88%	0.878	79%	0.787	S	S	*	*			trans	-142.3	142.6	148.1	-86.3	-74.4	0	0	0	110.5
422	H	29.9	Very low	26.9	Very low	170 Å²	170	160.1 Å²	160.1	79%	0.787	78%	0.782	S	S	*	*			trans	-85.1	159.8	-154.7	-88.4	-98.2	0	0	0	114.6
423	A	26.3	Very low	27	Very low	77 Å²	77	159.2 Å²	159.2	64%	0.636	78%	0.784	S	S	*	*			trans	-51	157.5	162	0	0	0	0	0	114.8
424	N	30.4	Very low	26.7	Very low	144 Å²	144	154.1 Å²	154.1	77%	0.77	77%	0.774	S	S	*	*			trans	168.7	110.8	137.9	-83.1	-9	0	0	0	106.8
425	D	26	Very low	26.8	Very low	132 Å²	132	155.2 Å²	155.2	71%	0.706	77%	0.774	S	S	*	*				92.3	137.4	72.9	-89.8	-16	0	0	0	113.5
426	H	30	Very low	26.7	Very low	158 Å²	158	159.1 Å²	159.1	73%	0.731	78%	0.777	S	S	*	*			trans	81.1	104	167.9	-56.4	-62.1	0	0	0	118.2
427	E	23.6	Very low	26.7	Very low	161 Å²	161	162.8 Å²	162.8	75%	0.752	79%	0.788	S	S	*	*				64.8	126.8	73.7	-93.1	-167.4	146.5	0	0	116.1
428	Y	23.2	Very low	26.5	Very low	172 Å²	172	160.2 Å²	160.2	68%	0.675	78%	0.78	S	S	*	*			trans	102.6	110.8	140.9	-100.6	-122	0	0	0	120.8
429	Q	25.3	Very low	26.6	Very low	145 Å²	145	160 Å²	160	68%	0.678	78%	0.779	S	S	*	*			trans	84.1	102.5	133.8	-77.6	-179.6	-15	0	0	120.9
430	Q	22.7	Very low	26.5	Very low	176 Å²	176	162.1 Å²	162.1	82%	0.822	78%	0.782	S	S	*	*				18.7	114.3	121.9	-76.5	176.5	-30.5	0	0	116.4
431	H	29.4	Very low	26.6	Very low	192 Å²	192	162.1 Å²	162.1	89%	0.889	78%	0.781	S	S	*	*			trans	-150.2	123.6	133.2	-104.9	-81.8	0	0	0	109.4
432	E	25.1	Very low	26.3	Very low	177 Å²	177	155.8 Å²	155.8	83%	0.827	77%	0.77	S	S	*	*			trans	-52.2	147.2	166	-63.4	169.5	138.1	0	0	110.6
433	I	26.5	Very low	26.4	Very low	168 Å²	168	153.5 Å²	153.5	86%	0.862	77%	0.773	S	S	*	*				178.8	117.4	122.7	-86.1	151.1	0	0	0	108.1
434	S	22.2	Very low	26.4	Very low	97 Å²	97	157 Å²	157	68%	0.678	78%	0.776	S	S	*	*			trans	-59.2	159.4	168.6	-62	0	0	0	0	112.8
435	H	26.6	Very low	26.5	Very low	175 Å²	175	159.1 Å²	159.1	81%	0.81	78%	0.781	S	S	*	*			trans	86.5	98.8	168.4	-63.7	-86.3	0	0	0	116.9
436	K	28.6	Very low	26.5	Very low	196 Å²	196	160.1 Å²	160.1	85%	0.852	78%	0.781	S	S	*	*				177.2	89.4	113.6	-93.4	169.4	-178.1	-174.5	0	108.7	D438	K436-D438 PolarHBondContact O-N 3.25Å
437	L	24.2	Very low	26.5	Very low	179 Å²	179	159 Å²	159	94%	0.937	78%	0.78	S	S	*	*			trans	-90.7	86.3	163.2	-82.3	163.9	0	0	0	106.5
438	D	25.4	Very low	27.2	Very low	135 Å²	135	156.5 Å²	156.5	72%	0.722	78%	0.778	S	S	*	*			trans	-133.7	114.5	164.5	-81.4	-39.6	0	0	0	109.1	K436	K436-D438 PolarHBondContact O-N 3.25Å
439	E	26.4	Very low	28.3	Very low	166 Å²	166	153.1 Å²	153.1	78%	0.776	78%	0.777	S	S	*	*			trans	60	112.1	143.1	-58.1	-174.3	151.8	0	0	119.2
440	K	28.9	Very low	28.6	Very low	194 Å²	194	156.1 Å²	156.1	84%	0.843	79%	0.788	S	S	*	*				-168.2	108.8	124.6	-104.1	157	-171.4	-173.6	0	113.4
441	H	27.2	Very low	28.9	Very low	166 Å²	166	154.6 Å²	154.6	77%	0.769	79%	0.786	S	S	*	*			trans	39.3	111.2	132.4	-63.6	-64.3	0	0	0	118.9
442	S	25.3	Very low	28.9	Very low	92 Å²	92	153.8 Å²	153.8	64%	0.643	78%	0.782	S	S	*	*				80.6	105.6	85.7	-170.6	0	0	0	0	113.2
443	S	30.5	Very low	29	Very low	122 Å²	122	155.4 Å²	155.4	85%	0.853	78%	0.782	S	S	*	*			trans	-145.3	104.3	151.4	62.9	0	0	0	0	109.6
444	H	26.2	Very low	29	Very low	151 Å²	151	153 Å²	153	70%	0.699	78%	0.776	S	S	*	*			trans	-46.8	142.3	172.3	-70.6	-90.8	0	0	0	115.3
445	H	32.5	Very low	29.3	Very low	188 Å²	188	155.6 Å²	155.6	87%	0.87	78%	0.782	S	S	*	*			trans	-153.2	101	134.1	-100.1	-61.9	0	0	0	110.8
446	E	25.7	Very low	29.2	Very low	153 Å²	153	158.5 Å²	158.5	72%	0.715	79%	0.786	S	S	*	*			trans	-0.8	143.3	139.7	-66.6	-176.7	175.6	0	0	117.7
447	N	30.8	Very low	29.1	Very low	134 Å²	134	157.8 Å²	157.8	72%	0.717	79%	0.785	S	S	*	*			cis	-174.2	-176.9	34.5	-121.2	-20.8	0	0	0	110.4
448	P	39.5	Very low	29.2	Very low	108 Å²	108	156.8 Å²	156.8	70%	0.701	78%	0.776	S	S	*	*			trans	-122.8	-147.1	-130.1	35.5	-11.8	0	0	0	114.3
449	P	45.6	Very low	29.1	Very low	102 Å²	102	160.4 Å²	160.4	66%	0.662	79%	0.786	S	S	*	*				-124.3	161.8	-75.8	35.5	-19.3	0	0	0	113.1
450	F	30.9	Very low	29.1	Very low	207 Å²	207	159.4 Å²	159.4	91%	0.908	78%	0.781	S	S	*	*			trans	-129.9	128.9	159.3	-105.5	-89.4	0	0	0	111	H452	F450-H452 PolarHBondContact O-N 3.08Å
451	N	29.7	Very low	28.9	Very low	144 Å²	144	158.5 Å²	158.5	77%	0.77	78%	0.78	S	S	*	*			trans	-61.6	116.7	-167.4	-68.7	-35	0	0	0	113.2
452	H	29.9	Very low	28.8	Very low	176 Å²	176	158.4 Å²	158.4	82%	0.815	78%	0.779	S	S	*	*			trans	-99.1	109.5	160.5	-95.4	-71.5	0	0	0	109.1	F450 T454	F450-H452 PolarHBondContact O-N 3.08Å; H452-T454 PolarHBondContact O-N 3.34Å
453	Y	25.8	Very low	28.8	Very low	211 Å²	211	162 Å²	162	83%	0.827	79%	0.785	S	S	*	*			trans	-64.1	113.1	161.1	-92.7	-97.7	0	0	0	108.2
454	T	26.9	Very low	28.6	Very low	117 Å²	117	165.8 Å²	165.8	72%	0.718	79%	0.787	S	S	*	*			trans	-113.5	95.1	168.2	48.1	0	0	0	0	108	H452 R456	H452-T454 PolarHBondContact O-N 3.34Å; T454-R456 PolarHBondContact O-N 3.45Å
455	D	28	Very low	28.6	Very low	152 Å²	152	166.6 Å²	166.6	81%	0.813	79%	0.791	S	S	*	*			trans	-73.7	102.8	160.8	-77.5	-35.1	0	0	0	107.5	E457	D455-E457 PolarHBondContact O-N 3.35Å
456	R	24.2	Very low	28.2	Very low	235 Å²	235	167.3 Å²	167.3	89%	0.887	79%	0.791	S	S	*	*			trans	-72.9	101.7	164.5	-89.8	178.9	162.5	-173.5	-4.7	107.3	T454	T454-R456 PolarHBondContact O-N 3.45Å
457	E	26.8	Very low	28.3	Very low	181 Å²	181	167.2 Å²	167.2	85%	0.846	80%	0.796	S	S	*	*			trans	-87.1	112.2	156.9	-73.7	-171.7	160.7	0	0	108.1	D455 F459	D455-E457 PolarHBondContact O-N 3.35Å; E457-F459 PolarHBondContact O-N 2.81Å
458	E	26.1	Very low	28.1	Very low	158 Å²	158	167.8 Å²	167.8	74%	0.738	80%	0.799	S	S	*	*			trans	-60.6	118.5	177.1	-70.6	176.5	148.5	0	0	109.9	H460	E458-H460 PolarHBondContact O-N 2.89Å
459	F	25	Very low	27.4	Very low	211 Å²	211	170.8 Å²	170.8	93%	0.925	81%	0.808	S	S	*	*			trans	-64.5	94.5	167.9	-95.9	-99.7	0	0	0	109	E457 E461	E457-F459 PolarHBondContact O-N 2.81Å; F459-E461 PolarHBondContact O-N 3.2Å
460	H	25.9	Very low	26.5	Very low	146 Å²	146	173 Å²	173	68%	0.676	81%	0.814	S	S	*	*			trans	-75.5	107.8	163.5	-81.8	-49.9	0	0	0	109.4	E458 H462	E458-H460 PolarHBondContact O-N 2.89Å; H460-H462 PolarHBondContact O-N 3.18Å
461	E	23.7	Very low	26.3	Very low	175 Å²	175	170.5 Å²	170.5	82%	0.818	81%	0.809	S	S	*	*			trans	-58.2	95.9	166.3	-77.9	-178.3	140.5	0	0	109.8	F459 H463	F459-E461 PolarHBondContact O-N 3.2Å; E461-H463 PolarHBondContact O-N 2.78Å; E461-H463 VanDerWaalsContact O-N 3.08Å
462	H	25.8	Very low	26.2	Very low	163 Å²	163	168.9 Å²	168.9	76%	0.755	80%	0.804	S	S	*	*			trans	-73.6	96.7	166.1	-89	-78.6	0	0	0	109.2	H460 F464	H460-H462 PolarHBondContact O-N 3.18Å; H462-F464 PolarHBondContact O-N 3.3Å
463	H	26	Very low	25.9	Very low	168 Å²	168	167.8 Å²	167.8	78%	0.778	80%	0.799	S	S	*	*			trans	-52	106	159.5	-83.6	-80.2	0	0	0	109.6	E461 E465	E461-H463 PolarHBondContact O-N 2.78Å; E461-H463 VanDerWaalsContact O-N 3.08Å; H463-E465 PolarHBondContact O-N 3.06Å
464	F	25.8	Very low	26	Very low	202 Å²	202	166.3 Å²	166.3	89%	0.886	80%	0.799	S	S	*	*			trans	-72.3	91.2	166.4	-96.8	-92.2	0	0	0	108.8	H462	H462-F464 PolarHBondContact O-N 3.3Å
465	E	25.2	Very low	26.1	Very low	168 Å²	168	168.8 Å²	168.8	79%	0.785	80%	0.803	S	S	*	*			trans	-66.6	131.7	160.2	-84.8	-174.5	151.6	0	0	109.6	H463 N467	H463-E465 PolarHBondContact O-N 3.06Å; E465-N467 PolarHBondContact O-N 2.84Å
466	K	25.7	Very low	26	Very low	202 Å²	202	165 Å²	165	88%	0.878	80%	0.799	S	S	*	*			trans	-62.9	97.5	177.2	-77.3	174.8	173.4	175.5	0	109.8	N468	K466-N468 PolarHBondContact O-N 3.41Å
467	N	26.9	Very low	26.1	Very low	152 Å²	152	160.4 Å²	160.4	81%	0.813	80%	0.798	S	S	*	*			trans	-70.1	112.6	165.7	-79.4	-24.3	0	0	0	109.3	E465 L469	E465-N467 PolarHBondContact O-N 2.84Å; N467-L469 PolarHBondContact O-N 3.22Å
468	N	26.4	Very low	26.2	Very low	146 Å²	146	157.4 Å²	157.4	78%	0.781	79%	0.792	S	S	*	*			trans	-56.9	121.9	166.8	-75.8	-41.1	0	0	0	108.7	K466 D470	K466-N468 PolarHBondContact O-N 3.41Å; N468-D470 PolarHBondContact O-N 2.78Å
469	L	26.1	Very low	26.2	Very low	170 Å²	170	159.1 Å²	159.1	89%	0.89	80%	0.8	S	S	*	*			trans	-66.4	101.7	169.5	-91.7	137.1	0	0	0	108.2	N467 I471	N467-L469 PolarHBondContact O-N 3.22Å; L469-I471 PolarHBondContact O-N 3.32Å
470	D	26.6	Very low	26.3	Very low	148 Å²	148	157.1 Å²	157.1	79%	0.791	79%	0.794	S	S	*	*			trans	-60.5	114.3	169.6	-81.5	-36.2	0	0	0	109.6	N468 V472	N468-D470 PolarHBondContact O-N 2.78Å; D470-V472 PolarHBondContact O-N 3.28Å
471	I	26.3	Very low	26.4	Very low	155 Å²	155	157 Å²	157	80%	0.795	80%	0.798	S	S	*	*			trans	-67.3	98.4	170.6	-63.8	170.8	0	0	0	106.6	L469 Q473	L469-I471 PolarHBondContact O-N 3.32Å; I471-Q473 PolarHBondContact O-N 2.66Å
472	V	26.5	Very low	26.6	Very low	111 Å²	111	156.8 Å²	156.8	67%	0.673	80%	0.802	S	S	*	*			trans	-66.1	96.1	172.6	178.5	0	0	0	0	108.2	D470 H474	D470-V472 PolarHBondContact O-N 3.28Å; V472-H474 PolarHBondContact O-N 3.27Å; V472-H474 VanDerWaalsContact O-N 3.14Å
473	Q	24.8	Very low	26.6	Very low	152 Å²	152	157.2 Å²	157.2	71%	0.71	81%	0.805	S	S	*	*			trans	-66.4	104	165.6	-73.1	-175.9	-14	0	0	108.3	I471 H475	I471-Q473 PolarHBondContact O-N 2.66Å; Q473-H475 PolarHBondContact O-N 3.36Å
474	H	28.4	Very low	26.7	Very low	180 Å²	180	157.8 Å²	157.8	83%	0.833	81%	0.808	S	S	*	*			trans	-66.9	100.3	167.3	-84.9	-77.5	0	0	0	109.1	V472	V472-H474 PolarHBondContact O-N 3.27Å; V472-H474 VanDerWaalsContact O-N 3.14Å
475	H	27.5	Very low	26.8	Very low	169 Å²	169	159.7 Å²	159.7	78%	0.782	81%	0.811	S	S	*	*			trans	-60.7	142.8	166.8	-86.8	-77.3	0	0	0	111.1	Q473	Q473-H475 PolarHBondContact O-N 3.36Å
476	G	25.4	Very low	26.7	Very low	72 Å²	72	161 Å²	161	74%	0.742	82%	0.817	S	S	*	*			trans	-63.3	143.3	-166.9	0	0	0	0	0	115.4
477	T	28.1	Very low	26.8	Very low	139 Å²	139	155.8 Å²	155.8	85%	0.853	81%	0.806	S	S	*	*			trans	-112.8	96.9	158.8	42.2	0	0	0	0	108.5
478	T	27.9	Very low	26.8	Very low	119 Å²	119	155.3 Å²	155.3	73%	0.73	80%	0.803	S	S	*	*			trans	17.1	116.1	147.3	-37.4	0	0	0	0	117.8	Q480	T478-Q480 PolarHBondContact O-N 3.03Å
479	E	25.6	Very low	27	Very low	193 Å²	193	156.2 Å²	156.2	90%	0.902	81%	0.806	S	S	*	*			trans	-47.8	112.6	157.8	-65.5	172.7	151.3	0	0	110.8
480	Q	28.6	Very low	27.2	Very low	170 Å²	170	153.5 Å²	153.5	79%	0.794	80%	0.797	S	S	*	*			trans	-129.8	106.5	159.8	-76.5	-167.3	-9.4	0	0	109.5	T478 N482	T478-Q480 PolarHBondContact O-N 3.03Å; Q480-N482 PolarHBondContact O-N 3.46Å
481	N	27.7	Very low	27.3	Very low	142 Å²	142	155.2 Å²	155.2	76%	0.759	80%	0.797	S	S	*	*			trans	6.6	104.6	148	-68.5	-24.4	0	0	0	116.2
482	N	28.3	Very low	27.5	Very low	172 Å²	172	154.8 Å²	154.8	92%	0.92	80%	0.796	S	S	*	*			trans	-129.1	81.3	147.6	-91	-22.7	0	0	0	107.6	Q480	Q480-N482 PolarHBondContact O-N 3.46Å
483	Q	25.5	Very low	27.7	Very low	171 Å²	171	156 Å²	156	80%	0.799	80%	0.799	S	S	*	*			trans	-79.6	154.6	158.8	-71.5	-179.4	-13.1	0	0	108.9
484	Q	27.2	Very low	27.9	Very low	181 Å²	181	158.9 Å²	158.9	85%	0.846	81%	0.81	S	S	*	*			trans	79.4	90.3	174.1	-68.2	177.8	-59.2	0	0	117.2
485	Y	28.8	Very low	27.9	Very low	242 Å²	242	158.4 Å²	158.4	95%	0.949	81%	0.808	S	S	*	*				-151.3	85.8	125.7	-99.1	-79	0	0	0	107.5
486	E	23.1	Very low	27.9	Very low	195 Å²	195	159.6 Å²	159.6	91%	0.911	81%	0.813	S	S	*	*			trans	-124	107	171.8	-121.2	-173	177.7	0	0	107.2
487	S	26.4	Very low	28.1	Very low	93 Å²	93	165.7 Å²	165.7	65%	0.65	82%	0.819	S	S	*	*			trans	161.3	120.9	167.8	57.3	0	0	0	0	105.1
488	D	28.8	Very low	28	Very low	141 Å²	141	165.7 Å²	165.7	75%	0.754	82%	0.819	S	S	*	*			cis	-157.3	115.9	32.5	-69.9	-57.2	0	0	0	108
489	I	30.1	Very low	27.9	Very low	166 Å²	166	168.7 Å²	168.7	85%	0.851	83%	0.825	S	S	*	*			trans	-112.4	95.9	159.2	-63.9	179.9	0	0	0	105.9	K491	I489-K491 PolarHBondContact O-N 3.32Å; I489-K491 VanDerWaalsContact O-N 3.13Å
490	V	30.6	Very low	28.1	Very low	113 Å²	113	165.6 Å²	165.6	69%	0.685	82%	0.822	S	S	*	*			trans	-58.1	110.4	173.2	175.5	0	0	0	0	108	D492	V490-D492 PolarHBondContact O-N 3.46Å
491	K	27.4	Very low	28	Very low	184 Å²	184	166.3 Å²	166.3	80%	0.8	83%	0.825	S	S	*	*			trans	-75	104.1	166.2	-71.2	177.5	176.7	176.4	0	107.2	I489 D493	I489-K491 PolarHBondContact O-N 3.32Å; I489-K491 VanDerWaalsContact O-N 3.13Å; K491-D493 PolarHBondContact O-N 2.85Å
492	D	31.2	Very low	27.9	Very low	145 Å²	145	165 Å²	165	78%	0.775	83%	0.827	S	S	*	*			trans	-75.2	106.6	165.1	-86.2	-28.4	0	0	0	108.5	V490 F494	V490-D492 PolarHBondContact O-N 3.46Å; D492-F494 PolarHBondContact O-N 3.26Å
493	D	31.5	Very low	27.9	Very low	138 Å²	138	165.9 Å²	165.9	74%	0.738	83%	0.826	S	S	*	*			trans	-58.6	118.3	176	-79.9	-36.9	0	0	0	111.1	K491 Q495	K491-D493 PolarHBondContact O-N 2.85Å; D493-Q495 VanDerWaalsContact C-N 3.26Å; D493-Q495 PolarHBondContact O-N 2.94Å
494	F	28.7	Very low	28	Very low	211 Å²	211	166.4 Å²	166.4	93%	0.925	83%	0.828	S	S	*	*			trans	-64	84.8	163.1	-93.1	-99.4	0	0	0	109.5	D492 H496	D492-F494 PolarHBondContact O-N 3.26Å; F494-H496 PolarHBondContact O-N 2.87Å
495	Q	28.1	Very low	28.2	Very low	171 Å²	171	163.8 Å²	163.8	80%	0.799	83%	0.827	S	S	*	*			trans	-80.5	115.2	167.1	-78.1	-162.2	-13.3	0	0	110.9	D493 K497	D493-Q495 VanDerWaalsContact C-N 3.26Å; D493-Q495 PolarHBondContact O-N 2.94Å; Q495-K497 PolarHBondContact O-N 3.4Å
496	H	26.6	Very low	28.2	Very low	193 Å²	193	161.8 Å²	161.8	89%	0.894	82%	0.823	S	S	*	*			trans	-38.2	113.3	162.3	-76.5	-84.3	0	0	0	112	F494	F494-H496 PolarHBondContact O-N 2.87Å
497	K	29.3	Very low	28.5	Very low	201 Å²	201	158.3 Å²	158.3	87%	0.874	82%	0.82	S	S	*	*			trans	-108.9	121.1	163	-82.7	-174.1	178	176.3	0	110	Q495	Q495-K497 PolarHBondContact O-N 3.4Å
498	T	27.6	Very low	28.8	Very low	138 Å²	138	158.4 Å²	158.4	85%	0.847	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-56.3	147.1	-176.5	-2.1	0	0	0	0	113.7
499	E	25.4	Very low	28.9	Very low	183 Å²	183	159 Å²	159	86%	0.855	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-49.7	131.4	175.1	-67.4	173.8	140.6	0	0	112.9
500	P	30.3	Very low	28.8	Very low	128 Å²	128	159.4 Å²	159.4	83%	0.831	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-80.8	121	169	14.1	-1	0	0	0	110.2
501	Q	26.7	Very low	28.7	Very low	185 Å²	185	162.6 Å²	162.6	86%	0.864	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-54.8	135.6	172.8	-76.7	175.9	-27.9	0	0	112.4	Q503	Q501-Q503 PolarHBondContact O-N 2.91Å
502	S	25.7	Very low	28.8	Very low	115 Å²	115	158.3 Å²	158.3	80%	0.804	84%	0.838	S	S	*	*			trans	-39.8	119.9	164.8	50.5	0	0	0	0	113.7
503	Q	27	Very low	28.6	Very low	190 Å²	190	159 Å²	159	89%	0.888	84%	0.84	S	S	*	*			trans	-115.7	119.4	157.1	-77	-171.3	-16.6	0	0	109.1	Q501	Q501-Q503 PolarHBondContact O-N 2.91Å
504	E	27.7	Very low	28.5	Very low	182 Å²	182	158.1 Å²	158.1	85%	0.85	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-59	133.7	179.6	-68.8	174.7	138.9	0	0	112.1	K506	E504-K506 PolarHBondContact O-N 2.89Å
505	P	31.4	Very low	28.6	Very low	126 Å²	126	157.9 Å²	157.9	82%	0.818	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-78.7	116.6	174.6	30.5	-30.2	0	0	0	109.9	S507	P505-S507 PolarHBondContact O-N 3Å
506	K	29.5	Very low	28.6	Very low	200 Å²	200	158.6 Å²	158.6	87%	0.87	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-62	131.6	171.9	-71	178.9	177.7	176.6	0	110.7	E504 A508	E504-K506 PolarHBondContact O-N 2.89Å; K506-A508 PolarHBondContact O-N 3.18Å
507	S	28.6	Very low	28.7	Very low	122 Å²	122	155.4 Å²	155.4	85%	0.853	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-47.9	118.2	170.4	53	0	0	0	0	112.3	P505	P505-S507 PolarHBondContact O-N 3Å
508	A	31.9	Very low	28.6	Very low	94 Å²	94	150.8 Å²	150.8	78%	0.777	83%	0.833	S	S	*	*			trans	-113.5	128.5	167.7	0	0	0	0	0	109.2	K506	K506-A508 PolarHBondContact O-N 3.18Å
509	D	31	Very low	28.7	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	83%	0.833	S	S	*	*			trans	-52.6	131.7	-169.1	-71.3	-54.8	0	0	0	115	Q511	D509-Q511 PolarHBondContact O-N 3.27Å
510	I	27.8	Very low	28.8	Very low	173 Å²	173	148.2 Å²	148.2	89%	0.887	83%	0.832	S	S	*	*			trans	-69.4	95.8	169.6	-62.3	171.4	0	0	0	107.6
511	Q	29.5	Very low	28.7	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-79.6	127.7	168.3	-73.5	-169.1	-2.3	0	0	110.7	D509	D509-Q511 PolarHBondContact O-N 3.27Å
512	A	29.9	Very low	28.8	Very low	93 Å²	93	145.1 Å²	145.1	77%	0.769	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-60	132.9	-171.9	0	0	0	0	0	113.8
513	I	27.2	Very low	28.8	Very low	161 Å²	161	144 Å²	144	83%	0.826	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-65.5	125.9	172.8	-62.7	168.5	0	0	0	109
514	P	29.6	Very low	28.8	Very low	118 Å²	118	142.8 Å²	142.8	77%	0.766	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70.3	134.6	-177.8	-11.9	26.1	0	0	0	111.6
515	K	30.9	Very low	28.7	Very low	207 Å²	207	139 Å²	139	90%	0.9	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-58.1	136.2	177.5	-73	176.9	175.4	176.4	0	111.7
516	Q	26.3	Very low	28.5	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-57.3	141.2	175.2	-72.9	-161.3	-33.9	0	0	112.4
517	P	29.8	Very low	28.2	Very low	125 Å²	125	136.1 Å²	136.1	81%	0.812	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-76.3	132.7	176.9	16	-5.4	0	0	0	111.2
518	S	27.9	Very low	28.2	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-62	151.3	173.2	45.7	0	0	0	0	112.7	T520	S518-T520 PolarHBondContact O-N 3.09Å
519	P	28.7	Very low	28	Very low	130 Å²	130	140 Å²	140	84%	0.844	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-76.8	123	-162.7	31	-33.6	0	0	0	112.1
520	T	27.3	Very low	27.6	Very low	137 Å²	137	137.3 Å²	137.3	84%	0.84	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-70.4	128.5	176.5	-2.4	0	0	0	0	110.9	S518	S518-T520 PolarHBondContact O-N 3.09Å
521	S	27.6	Very low	27.7	Very low	108 Å²	108	136.1 Å²	136.1	76%	0.755	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-54.2	127.8	177.9	52.4	0	0	0	0	112.9	A523	S521-A523 PolarHBondContact O-N 3.48Å
522	V	29.1	Very low	27.5	Very low	140 Å²	140	135.5 Å²	135.5	85%	0.848	81%	0.807	S	S	*	*			trans	-67.9	107.6	171.6	-178.9	0	0	0	0	108.5
523	A	27.1	Very low	27.2	Very low	90 Å²	90	136.4 Å²	136.4	74%	0.744	81%	0.808	S	S	*	*			trans	-78.8	131.1	174.1	0	0	0	0	0	110.3	S521 A525	S521-A523 PolarHBondContact O-N 3.48Å; A523-A525 PolarHBondContact O-N 2.9Å
524	N	25.5	Very low	27.2	Very low	166 Å²	166	137.6 Å²	137.6	89%	0.888	81%	0.81	S	S	*	*			trans	-56.5	111.1	176.6	-68.9	-36.8	0	0	0	111.4
525	A	27	Very low	26.9	Very low	103 Å²	103	137.2 Å²	137.2	85%	0.851	81%	0.81	S	S	*	*			trans	-89.8	107	165.3	0	0	0	0	0	108.7	A523	A523-A525 PolarHBondContact O-N 2.9Å
526	S	25.9	Very low	26.9	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	80%	0.8	S	S	*	*			trans	-60.6	143	177.9	47.5	0	0	0	0	113.3	I528	S526-I528 PolarHBondContact O-N 3.01Å
527	L	23.6	Very low	27	Very low	159 Å²	159	133 Å²	133	83%	0.832	80%	0.801	S	S	*	*			trans	-31.7	118.1	167.4	-102.8	72.8	0	0	0	113.4
528	I	28	Very low	27	Very low	168 Å²	168	135.4 Å²	135.4	86%	0.862	80%	0.799	S	S	*	*			trans	-93.2	118	157.1	-64.8	177	0	0	0	107.3	S526	S526-I528 PolarHBondContact O-N 3.01Å
529	N	27.6	Very low	27.1	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	80%	0.798	S	S	*	*			trans	-58.9	131.8	-177.5	-77.4	-39.4	0	0	0	113.3
530	S	24.4	Very low	27.1	Very low	98 Å²	98	139.8 Å²	139.8	69%	0.685	80%	0.804	S	S	*	*				32.3	91.4	129.3	179.6	0	0	0	0	117.1
531	V	28.6	Very low	27.5	Very low	148 Å²	148	137.9 Å²	137.9	90%	0.897	80%	0.796	S	S	*	*			trans	-97.5	116.1	149.8	177.4	0	0	0	0	107.3
532	Q	26.4	Very low	28.1	Very low	167 Å²	167	137.3 Å²	137.3	78%	0.78	80%	0.798	S	S	*	*			trans	-65.4	138.4	-177.4	-75.7	173.9	-32.8	0	0	111.8
533	S	23	Very low	29.1	Very low	113 Å²	113	134.9 Å²	134.9	79%	0.79	79%	0.787	S	S	*	*			trans	-35.4	121.8	163.2	48.6	0	0	0	0	115.8
534	E	26.5	Very low	30.7	Very low	185 Å²	185	137.6 Å²	137.6	86%	0.864	78%	0.784	S	S	*	*			trans	-101.2	111.8	146.4	-83.9	-174.7	164.5	0	0	108.7	V536	E534-V536 PolarHBondContact O-N 2.9Å; E534-V536 VanDerWaalsContact O-N 3.16Å
535	S	24.7	Very low	32.4	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	75%	0.752	S	S	*	*			trans	-68.9	98.1	179	48.9	0	0	0	0	111.1	E537	S535-E537 PolarHBondContact O-N 3.31Å
536	V	29.1	Very low	34.1	Very low	113 Å²	113	129.3 Å²	129.3	69%	0.685	73%	0.726	S	S	*	*			trans	-90.9	90.7	161.6	-179.3	0	0	0	0	107.9	E534 K538	E534-V536 PolarHBondContact O-N 2.9Å; E534-V536 VanDerWaalsContact O-N 3.16Å; V536-K538 HydrophobicContact CG1-CB 4.39Å; V536-K538 HydrophobicContact CG1-CD 4.12Å; V536-K538 HydrophobicContact CG1-CG 4.01Å; V536-K538 PolarHBondContact O-N 2.91Å
537	E	29.4	Very low	35.8	Very low	191 Å²	191	130.4 Å²	130.4	89%	0.893	72%	0.723	S	S	*	*			trans	-62.6	97.2	163.4	-74.7	-172.7	147.4	0	0	109.3	S535	S535-E537 PolarHBondContact O-N 3.31Å
538	K	29.7	Very low	37.6	Very low	176 Å²	176	130 Å²	130	77%	0.765	72%	0.722	S	S	*	*			trans	-132.4	104.4	164.4	-81.6	-174.8	178.1	174.3	0	110.9	V536	V536-K538 HydrophobicContact CG1-CB 4.39Å; V536-K538 HydrophobicContact CG1-CD 4.12Å; V536-K538 HydrophobicContact CG1-CG 4.01Å; V536-K538 PolarHBondContact O-N 2.91Å
539	S	30.2	Very low	39.4	Very low	102 Å²	102	122.1 Å²	122.1	71%	0.713	68%	0.681	S	S	*	*			trans	48.7	102.5	152.5	57.5	0	0	0	0	117.4	S541	S539-S541 PolarHBondContact O-N 2.83Å
540	K	29.2	Very low	41.3	Very low	224 Å²	224	122.5 Å²	122.5	97%	0.974	68%	0.679	S	S	*	*			trans	-57.8	79.2	157.3	-67.7	173.6	176.7	173.9	0	110.9
541	S	35.5	Very low	43.5	Very low	98 Å²	98	122.6 Å²	122.6	69%	0.685	67%	0.667	S	S	*	*			trans	-104.9	102.7	145.3	52.8	0	0	0	0	105.5	S539 S543	S539-S541 PolarHBondContact O-N 2.83Å; S541-S543 PolarHBondContact O-N 3.14Å
542	A	40.4	Very low	45.7	Very low	96 Å²	96	115.6 Å²	115.6	79%	0.793	62%	0.624	S	S	*	*			trans	-52.1	111.1	173.6	0	0	0	0	0	107.8	Q544	A542-Q544 PolarHBondContact O-N 3.22Å
543	S	49.6	Very low	47.7	Very low	88 Å²	88	113.3 Å²	113.3	62%	0.615	61%	0.609	S	S	*	*			trans	-60.1	115.6	177.9	45.7	0	0	0	0	107.6	S541 Y545	S541-S543 PolarHBondContact O-N 3.14Å; S543-Y545 PolarHBondContact O-N 3.07Å
544	Q	60.3	Low	50	Low	147 Å²	147	111.9 Å²	111.9	69%	0.687	59%	0.59	S	S	*	*	S	Bend	trans	-63.3	-1.2	172.9	-70.2	177.3	-21.2	0	0	112.4	A542 Y877	A542-Q544 PolarHBondContact O-N 3.22Å; Q544-Y877 HydrophobicContact CB-CD2 4.1Å; Q544-Y877 WeakPolarHBondContact O-CB 3.05Å
545	Y	61.8	Low	52.2	Low	52 Å²	52	106.7 Å²	106.7	20%	0.204	56%	0.564	C	S	.	*			trans	-92.5	121.1	-178	-58.7	-59.2	0	0	0	111.2	S543 C552 K555 L556 Y877	S543-Y545 PolarHBondContact O-N 3.07Å; Y545-C552 HydrophobicContact CD1-CB 4.26Å; Y545-K555 HydrophobicContact CE1-CD 3.86Å; Y545-K555 HydrophobicContact CE1-CG 4.48Å; Y545-K555 WeakPolarHBondContact OH-CE 3.47Å; Y545-K555 PolarHBondContact OH-NZ 3Å; Y545-L556 HydrophobicContact CD2-CD1 3.91Å; Y545-L556 HydrophobicContact CG-CD1 4.19Å; Y545-Y877 HydrophobicContact CD1-CD1 4.46Å; Y545-Y877 HydrophobicContact CD1-CE1 4.43Å; Y545-Y877 HydrophobicContact CE1-CD1 4.4Å; Y545-Y877 AromaticContact CE1-CE1 3.93Å; Y545-Y877 HydrophobicContact CE1-CE1 3.93Å
546	S	62.9	Low	54.5	Low	43 Å²	43	103.3 Å²	103.3	30%	0.301	54%	0.538	S	S	.	.			trans	-86.3	128	173.6	179.1	0	0	0	0	110.6	N548 C549 C552 C875	S546-N548 PolarHBondContact O-N 3.29Å; S546-N548 PolarHBondContact OG-N 3.45Å; S546-C549 PolarHBondContact O-N 3.06Å; S546-C549 VanDerWaalsContact O-N 3.13Å; S546-C552 PolarHBondContact N-SG 3.03Å; S546-C552 VanDerWaalsContact N-SG 3.44Å; S546-C552 WeakPolarHBondContact O-CB 3.36Å; S546-C875 VanDerWaalsContact CB-CB 3.42Å
547	L	61.4	Low	56.3	Low	129 Å²	129	100.8 Å²	100.8	68%	0.675	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.3	174.4	-73.3	164.2	0	0	0	113.2	C549 Y553 L556	L547-C549 VanDerWaalsContact C-N 3.33Å; L547-Y553 HydrophobicContact CD2-CD2 4.34Å; L547-L556 HydrophobicContact CD2-CD2 4.48Å
548	N	60.8	Low	58	Low	152 Å²	152	98.9 Å²	98.9	81%	0.813	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-6.6	177.4	-64.8	-12.3	0	0	0	112.7	S546	S546-N548 PolarHBondContact O-N 3.29Å; S546-N548 PolarHBondContact OG-N 3.45Å
549	C	66.6	Low	59.8	Low	2 Å²	2	94.5 Å²	94.5	1%	0.014	49%	0.487	C	S	.	.			trans	-99.5	116.2	177.2	178.5	0	0	0	0	109.9	S546 L547 K551 C552 Y553 C875 H878	S546-C549 PolarHBondContact O-N 3.06Å; S546-C549 VanDerWaalsContact O-N 3.13Å; L547-C549 VanDerWaalsContact C-N 3.33Å; C549-K551 VanDerWaalsContact C-N 3.31Å; C549-K551 PolarHBondContact O-N 2.9Å; C549-C552 HydrophobicContact CB-CB 3.96Å; C549-C552 WeakPolarHBondContact O-CB 3.33Å; C549-C552 PolarHBondContact O-N 2.87Å; C549-Y553 PolarHBondContact O-N 3.21Å; C549-C875 HydrophobicContact CB-CB 3.79Å; C549-H878 PolarHBondContact SG-ND1 2.99Å; C549-H878 VanDerWaalsContact SG-ND1 3.38Å
550	H	66.9	Low	61.3	Low	138 Å²	138	94.6 Å²	94.6	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-56	-41.7	-178.2	-174.7	71.4	0	0	0	113	C552 Y553 E554	H550-C552 VanDerWaalsContact C-N 3.35Å; H550-C552 PolarHBondContact O-N 2.56Å; H550-Y553 PolarHBondContact O-N 3.22Å; H550-E554 IonicContact NE2-OE1 3.82Å; H550-E554 PolarHBondContact O-N 3.34Å
551	K	70.6	Confident	62.5	Low	100 Å²	100	89.9 Å²	89.9	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-62.2	-38.7	175.8	-68	-177.5	-178.1	172.7	0	112.2	C549 K555 L874 H878 E882	C549-K551 VanDerWaalsContact C-N 3.31Å; C549-K551 PolarHBondContact O-N 2.9Å; K551-K555 PolarHBondContact O-N 3.07Å; K551-L874 HydrophobicContact CD-CD2 3.96Å; K551-H878 VanDerWaalsContact C-CE1 3.48Å; K551-H878 WeakPolarHBondContact CB-CE1 3.2Å; K551-H878 WeakPolarHBondContact CB-NE2 3.45Å; K551-E882 IonicContact NZ-OE1 3.97Å; K551-E882 PolarHBondContact NZ-OE1 3.16Å
552	C	75.3	Confident	63.2	Low	0 Å²	0	94.7 Å²	94.7	0%	0	46%	0.46	C	S	.	.	H	α-helix	trans	-67.4	-44.2	174.7	-76.1	0	0	0	0	111.1	Y545 S546 C549 H550 K555 L556 C875 H878	Y545-C552 HydrophobicContact CD1-CB 4.26Å; S546-C552 PolarHBondContact N-SG 3.03Å; S546-C552 VanDerWaalsContact N-SG 3.44Å; S546-C552 WeakPolarHBondContact O-CB 3.36Å; C549-C552 HydrophobicContact CB-CB 3.96Å; C549-C552 WeakPolarHBondContact O-CB 3.33Å; C549-C552 PolarHBondContact O-N 2.87Å; H550-C552 VanDerWaalsContact C-N 3.35Å; H550-C552 PolarHBondContact O-N 2.56Å; C552-K555 PolarHBondContact O-N 3.3Å; C552-L556 WeakPolarHBondContact O-CB 3.43Å; C552-L556 PolarHBondContact O-N 2.98Å; C552-C875 PolarHBondContact SG-SG 2.99Å; C552-H878 PolarHBondContact N-CE1 3.22Å; C552-H878 VanDerWaalsContact N-CE1 3.27Å; C552-H878 PolarHBondContact SG-CE1 2.86Å; C552-H878 PolarHBondContact SG-ND1 3.26Å
553	Y	66.9	Low	63.6	Low	119 Å²	119	97 Å²	97	47%	0.467	46%	0.458	S	S	.	.	H	α-helix	trans	-62.6	-44.2	179.9	-172.9	-107.4	0	0	0	111.8	L547 C549 H550 K555 L556 I557	L547-Y553 HydrophobicContact CD2-CD2 4.34Å; C549-Y553 PolarHBondContact O-N 3.21Å; H550-Y553 PolarHBondContact O-N 3.22Å; Y553-K555 VanDerWaalsContact C-N 3.34Å; Y553-K555 PolarHBondContact O-N 3.37Å; Y553-L556 PolarHBondContact O-N 3.02Å; Y553-I557 HydrophobicContact CD1-CD1 3.59Å; Y553-I557 HydrophobicContact CD1-CG1 4.44Å; Y553-I557 HydrophobicContact CE1-CD1 3.21Å; Y553-I557 HydrophobicContact CE1-CG1 4.19Å; Y553-I557 HydrophobicContact CE2-CD1 4.45Å; Y553-I557 HydrophobicContact CG-CD1 4.36Å; Y553-I557 WeakPolarHBondContact O-CG1 3.32Å; Y553-I557 PolarHBondContact O-N 2.87Å
554	E	71.6	Confident	62.9	Low	83 Å²	83	99.6 Å²	99.6	39%	0.388	46%	0.464	S	S	.	.	H	α-helix	trans	-57.1	-46.1	172.4	-86.6	-141	166.3	0	0	112.4	H550 I557 R558	H550-E554 IonicContact NE2-OE1 3.82Å; H550-E554 PolarHBondContact O-N 3.34Å; E554-I557 PolarHBondContact O-N 2.99Å; E554-R558 WeakPolarHBondContact O-CG 3.19Å; E554-R558 PolarHBondContact O-N 3.12Å; E554-R558 IonicContact OE2-CZ 2.72Å; E554-R558 IonicContact OE2-NE 3.85Å; E554-R558 IonicContact OE2-NH2 2.61Å; E554-R558 PolarHBondContact OE2-NH2 3.34Å
555	K	72.6	Confident	61.3	Low	76 Å²	76	96.7 Å²	96.7	33%	0.33	46%	0.46	S	S	.	.	H	α-helix	trans	-66.1	-40.8	-179.5	-165.7	169.9	178.3	-172.7	0	111.3	Y545 K551 C552 Y553 R558 E559 Y877	Y545-K555 HydrophobicContact CE1-CD 3.86Å; Y545-K555 HydrophobicContact CE1-CG 4.48Å; Y545-K555 WeakPolarHBondContact OH-CE 3.47Å; Y545-K555 PolarHBondContact OH-NZ 3Å; K551-K555 PolarHBondContact O-N 3.07Å; C552-K555 PolarHBondContact O-N 3.3Å; Y553-K555 VanDerWaalsContact C-N 3.34Å; Y553-K555 PolarHBondContact O-N 3.37Å; K555-R558 PolarHBondContact O-N 3.01Å; K555-E559 PolarHBondContact O-N 3.47Å; K555-Y877 PolarHBondContact NZ-OH 3.4Å
556	L	73.3	Confident	59.8	Low	41 Å²	41	99.8 Å²	99.8	22%	0.215	49%	0.486	C	S	.	.	H	α-helix	trans	-60.8	-44	174.4	-149.3	97.1	0	0	0	110.9	Y545 L547 C552 Y553 E559 H560	Y545-L556 HydrophobicContact CD2-CD1 3.91Å; Y545-L556 HydrophobicContact CG-CD1 4.19Å; L547-L556 HydrophobicContact CD2-CD2 4.48Å; C552-L556 WeakPolarHBondContact O-CB 3.43Å; C552-L556 PolarHBondContact O-N 2.98Å; Y553-L556 PolarHBondContact O-N 3.02Å; L556-E559 PolarHBondContact O-N 3.43Å; L556-H560 WeakPolarHBondContact O-CB 3.47Å; L556-H560 PolarHBondContact O-CD2 3.22Å; L556-H560 PolarHBondContact O-N 3.16Å
557	I	67.8	Low	58.3	Low	60 Å²	60	104.6 Å²	104.6	31%	0.308	51%	0.507	S	S	.	.	H	α-helix	trans	-60.1	-46.8	174.7	-72	169.6	0	0	0	110.7	Y553 E554 E559 H560 Q561	Y553-I557 HydrophobicContact CD1-CD1 3.59Å; Y553-I557 HydrophobicContact CD1-CG1 4.44Å; Y553-I557 HydrophobicContact CE1-CD1 3.21Å; Y553-I557 HydrophobicContact CE1-CG1 4.19Å; Y553-I557 HydrophobicContact CE2-CD1 4.45Å; Y553-I557 HydrophobicContact CG-CD1 4.36Å; Y553-I557 WeakPolarHBondContact O-CG1 3.32Å; Y553-I557 PolarHBondContact O-N 2.87Å; E554-I557 PolarHBondContact O-N 2.99Å; I557-E559 VanDerWaalsContact C-N 3.33Å; I557-E559 PolarHBondContact O-N 3.31Å; I557-H560 PolarHBondContact O-N 2.88Å; I557-Q561 HydrophobicContact CG2-CG 4.14Å; I557-Q561 WeakPolarHBondContact O-CB 3.27Å; I557-Q561 VanDerWaalsContact O-CG 3.27Å; I557-Q561 WeakPolarHBondContact O-CG 3.34Å; I557-Q561 PolarHBondContact O-N 3.14Å
558	R	64.6	Low	56.7	Low	151 Å²	151	108.9 Å²	108.9	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-63.5	-38.4	179.4	-69.8	-177.5	-156.2	-158.9	7.8	112.1	E554 K555 R562	E554-R558 WeakPolarHBondContact O-CG 3.19Å; E554-R558 PolarHBondContact O-N 3.12Å; E554-R558 IonicContact OE2-CZ 2.72Å; E554-R558 IonicContact OE2-NE 3.85Å; E554-R558 IonicContact OE2-NH2 2.61Å; E554-R558 PolarHBondContact OE2-NH2 3.34Å; K555-R558 PolarHBondContact O-N 3.01Å; R558-R562 WeakPolarHBondContact O-CG 3.45Å; R558-R562 PolarHBondContact O-N 3.05Å
559	E	68.4	Low	55.1	Low	84 Å²	84	110.2 Å²	110.2	39%	0.393	52%	0.518	S	S	.	.	H	α-helix	trans	-68	-43.1	174.8	-74.5	-171.7	-178.2	0	0	111.9	K555 L556 I557 Q561 R562 L563	K555-E559 PolarHBondContact O-N 3.47Å; L556-E559 PolarHBondContact O-N 3.43Å; I557-E559 VanDerWaalsContact C-N 3.33Å; I557-E559 PolarHBondContact O-N 3.31Å; E559-Q561 PolarHBondContact O-N 3.04Å; E559-R562 WeakPolarHBondContact O-CB 3.48Å; E559-R562 PolarHBondContact O-N 3.29Å; E559-L563 WeakPolarHBondContact O-CG 3.12Å; E559-L563 PolarHBondContact O-N 2.79Å; E559-L563 VanDerWaalsContact O-N 3.08Å
560	H	61.5	Low	53.3	Low	103 Å²	103	120.1 Å²	120.1	48%	0.477	55%	0.554	S	S	.	*	H	α-helix	trans	-64.5	-38.3	174.2	-82.8	-67.6	0	0	0	112.8	L556 I557 R562 L563 L564	L556-H560 WeakPolarHBondContact O-CB 3.47Å; L556-H560 PolarHBondContact O-CD2 3.22Å; L556-H560 PolarHBondContact O-N 3.16Å; I557-H560 PolarHBondContact O-N 2.88Å; H560-R562 VanDerWaalsContact C-N 3.33Å; H560-R562 PolarHBondContact O-N 2.87Å; H560-L563 PolarHBondContact O-N 3.36Å; H560-L564 PolarHBondContact O-N 3.03Å
561	Q	54.2	Low	51.4	Low	125 Å²	125	123.5 Å²	123.5	58%	0.584	57%	0.568	S	S	*	*	H	α-helix	trans	-65.6	-35.2	174.6	-77.3	178	-12.4	0	0	112	I557 E559 L563 L564 C565	I557-Q561 HydrophobicContact CG2-CG 4.14Å; I557-Q561 WeakPolarHBondContact O-CB 3.27Å; I557-Q561 VanDerWaalsContact O-CG 3.27Å; I557-Q561 WeakPolarHBondContact O-CG 3.34Å; I557-Q561 PolarHBondContact O-N 3.14Å; E559-Q561 PolarHBondContact O-N 3.04Å; Q561-L563 VanDerWaalsContact C-N 3.31Å; Q561-L564 PolarHBondContact O-N 3.41Å; Q561-C565 PolarHBondContact O-N 3.15Å
562	R	49.4	Very low	49.4	Very low	199 Å²	199	126.5 Å²	126.5	75%	0.751	59%	0.587	S	S	*	*	H	α-helix	trans	-65.6	-34.8	171.9	-77	176	178.9	-179.5	-0.5	112.2	R558 E559 H560	R558-R562 WeakPolarHBondContact O-CG 3.45Å; R558-R562 PolarHBondContact O-N 3.05Å; E559-R562 WeakPolarHBondContact O-CB 3.48Å; E559-R562 PolarHBondContact O-N 3.29Å; H560-R562 VanDerWaalsContact C-N 3.33Å; H560-R562 PolarHBondContact O-N 2.87Å
563	L	49.2	Very low	47.2	Very low	144 Å²	144	132 Å²	132	75%	0.754	63%	0.625	S	S	*	*	H	α-helix	trans	-76.2	-25	176.8	-68.9	169.6	0	0	0	113.4	E559 H560 Q561	E559-L563 WeakPolarHBondContact O-CG 3.12Å; E559-L563 PolarHBondContact O-N 2.79Å; E559-L563 VanDerWaalsContact O-N 3.08Å; H560-L563 PolarHBondContact O-N 3.36Å; Q561-L563 VanDerWaalsContact C-N 3.31Å
564	L	34.7	Very low	45.3	Very low	143 Å²	143	132.2 Å²	132.2	75%	0.749	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-1	178.7	-77.6	165.6	0	0	0	114.3	H560 Q561 P566	H560-L564 PolarHBondContact O-N 3.03Å; Q561-L564 PolarHBondContact O-N 3.41Å; L564-P566 WeakPolarHBondContact O-CD 3.37Å
565	C	27.2	Very low	43.1	Very low	87 Å²	87	131.4 Å²	131.4	59%	0.588	66%	0.658	S	S	*	*	S	Bend	trans	-78.7	115.2	172.1	-153	0	0	0	0	108.4	Q561 I567	Q561-C565 PolarHBondContact O-N 3.15Å; C565-I567 PolarHBondContact O-N 3.3Å
566	P	30	Very low	41	Very low	117 Å²	117	139 Å²	139	76%	0.76	69%	0.686	S	S	*	*			trans	-65.8	100.7	-175.4	26.4	-32.6	0	0	0	108.8	L564 R568	L564-P566 WeakPolarHBondContact O-CD 3.37Å; P566-R568 PolarHBondContact O-N 2.9Å
567	I	31.8	Very low	39	Very low	143 Å²	143	144.7 Å²	144.7	73%	0.733	72%	0.717	S	S	*	*			trans	-63.2	101.1	176.8	-63.9	175.3	0	0	0	106.9	C565 M569	C565-I567 PolarHBondContact O-N 3.3Å; I567-M569 VanDerWaalsContact C-N 3.32Å; I567-M569 PolarHBondContact O-N 3.43Å
568	R	28.1	Very low	37.2	Very low	220 Å²	220	147.6 Å²	147.6	83%	0.83	74%	0.743	S	S	*	*			trans	-59.3	97.2	167.7	-150.8	175.9	-170.5	173.1	2.9	106.5	P566 R570	P566-R568 PolarHBondContact O-N 2.9Å; R568-R570 VanDerWaalsContact C-N 3.26Å; R568-R570 PolarHBondContact O-N 3.23Å
569	M	26.5	Very low	35.6	Very low	180 Å²	180	149.9 Å²	149.9	89%	0.887	76%	0.757	S	S	*	*			trans	-58	86.5	174.7	-75.6	-107.8	-88.1	0	0	109.7	I567 K571	I567-M569 VanDerWaalsContact C-N 3.32Å; I567-M569 PolarHBondContact O-N 3.43Å; M569-K571 PolarHBondContact O-N 3.01Å
570	R	28.2	Very low	33.6	Very low	209 Å²	209	152.5 Å²	152.5	79%	0.789	78%	0.779	S	S	*	*			trans	-79.1	107.2	159.9	-84.9	-174	-177.4	165.8	1.2	106.7	R568 L572	R568-R570 VanDerWaalsContact C-N 3.26Å; R568-R570 PolarHBondContact O-N 3.23Å; R570-L572 PolarHBondContact O-N 3.17Å
571	K	27.6	Very low	31.8	Very low	210 Å²	210	159.1 Å²	159.1	91%	0.913	80%	0.8	S	S	*	*			trans	-48.4	106.8	164.1	-72.5	178.4	175.5	179.5	0	108.5	M569	M569-K571 PolarHBondContact O-N 3.01Å
572	L	29.7	Very low	30.5	Very low	163 Å²	163	161 Å²	161	85%	0.853	81%	0.809	S	S	*	*			trans	-112.9	115.5	160.5	-81.2	165	0	0	0	106.6	R570	R570-L572 PolarHBondContact O-N 3.17Å
573	S	28.6	Very low	29.4	Very low	114 Å²	114	157.8 Å²	157.8	80%	0.797	81%	0.811	S	S	*	*			trans	-56.6	144.7	-175	42.8	0	0	0	0	112.8
574	S	25.4	Very low	28.2	Very low	125 Å²	125	159.8 Å²	159.8	87%	0.874	81%	0.814	S	S	*	*			trans	-48.8	139.5	171.5	58.1	0	0	0	0	114.2
575	G	26.6	Very low	27.7	Very low	65 Å²	65	161.9 Å²	161.9	67%	0.67	82%	0.817	S	S	*	*			trans	146.1	100	157.5	0	0	0	0	0	110.9
576	Y	29.3	Very low	27.6	Very low	235 Å²	235	167.7 Å²	167.7	92%	0.922	83%	0.832	S	S	*	*				177.5	116.6	119.3	-108	-92.3	0	0	0	110
577	N	29.7	Very low	27.2	Very low	162 Å²	162	170.5 Å²	170.5	87%	0.866	84%	0.835	S	S	*	*			trans	-63.4	130.3	170.6	-79.6	-43.1	0	0	0	110.5
578	S	30.7	Very low	26.8	Very low	120 Å²	120	174 Å²	174	84%	0.839	84%	0.839	S	S	*	*			trans	-135.4	115.3	156.1	56.3	0	0	0	0	110.1
579	K	30.3	Very low	26.5	Very low	199 Å²	199	175.4 Å²	175.4	87%	0.865	84%	0.844	S	S	*	*			trans	-74.3	132.7	-176.3	-73.1	175.1	173.8	176.7	0	110.4	R581	K579-R581 PolarHBondContact O-N 2.99Å
580	T	26.8	Very low	26.4	Very low	140 Å²	140	176.1 Å²	176.1	86%	0.859	84%	0.838	S	S	*	*			trans	-56.9	117.6	170.2	21.6	0	0	0	0	111.9	Q582	T580-Q582 PolarHBondContact O-N 3.47Å
581	R	24.8	Very low	26.3	Very low	242 Å²	242	171.9 Å²	171.9	91%	0.913	84%	0.841	S	S	*	*			trans	-78.7	109.8	168.5	-95.6	-177.7	171.8	-171.3	-1.5	109.7	K579	K579-R581 PolarHBondContact O-N 2.99Å
582	Q	25.8	Very low	26.1	Very low	164 Å²	164	172.2 Å²	172.2	77%	0.766	84%	0.842	S	S	*	*			trans	-75.1	122.1	166.5	-76.1	176.8	-17.7	0	0	109.9	T580	T580-Q582 PolarHBondContact O-N 3.47Å
583	V	26	Very low	25.8	Very low	132 Å²	132	173.1 Å²	173.1	80%	0.8	84%	0.842	S	S	*	*			trans	-96.9	107.3	173.9	-179.5	0	0	0	0	108.6	K585	V583-K585 PolarHBondContact O-N 3.35Å
584	F	25.2	Very low	25.8	Very low	186 Å²	186	174.1 Å²	174.1	82%	0.816	84%	0.844	S	S	*	*			trans	-75.3	114.2	176.7	-88.5	-95.7	0	0	0	111.2
585	K	23.9	Very low	25.9	Very low	186 Å²	186	173.6 Å²	173.6	81%	0.809	84%	0.84	S	S	*	*			trans	-86.3	101.9	170.2	-81.3	-175.9	175	-179.6	0	110.8	V583 H587	V583-K585 PolarHBondContact O-N 3.35Å; K585-H587 PolarHBondContact O-N 2.95Å
586	K	24.8	Very low	25.8	Very low	210 Å²	210	180.5 Å²	180.5	91%	0.913	85%	0.852	S	S	*	*			trans	-69.6	114.9	169.3	-100.9	179.1	174.8	174.8	0	110.5
587	H	22.4	Very low	25.6	Very low	176 Å²	176	178.6 Å²	178.6	82%	0.815	85%	0.849	S	S	*	*			trans	-81.1	119.9	169.3	-80.5	44.2	0	0	0	110.1	K585	K585-H587 PolarHBondContact O-N 2.95Å
588	R	22.3	Very low	25.3	Very low	217 Å²	217	176.8 Å²	176.8	82%	0.819	85%	0.846	S	S	*	*			trans	-106	120.3	164.6	-98.1	-177.8	170.1	168.9	-4	108.6
589	R	22.2	Very low	25	Very low	248 Å²	248	178 Å²	178	94%	0.936	85%	0.848	S	S	*	*			trans	-83.2	130.2	174.2	-70.3	177.3	177.4	161.9	-1.7	108.9
590	Y	23.5	Very low	24.6	Very low	196 Å²	196	177.2 Å²	177.2	77%	0.769	85%	0.85	S	S	*	*			trans	-111.1	130.1	167.9	-77.1	-82.2	0	0	0	108.9
591	S	25.7	Very low	24.5	Very low	120 Å²	120	179.5 Å²	179.5	84%	0.839	85%	0.848	S	S	*	*			trans	-88.7	135.4	177.6	43.6	0	0	0	0	110.7
592	F	24	Very low	24.5	Very low	217 Å²	217	174 Å²	174	95%	0.952	84%	0.841	S	S	*	*			trans	-81.3	127.2	177.7	-87.1	-101.8	0	0	0	111.1
593	E	23.7	Very low	24.3	Very low	181 Å²	181	175.7 Å²	175.7	85%	0.846	85%	0.846	S	S	*	*			trans	-123.9	120	164.5	-83	-174.1	167	0	0	111.2
594	T	29.3	Very low	24.2	Very low	136 Å²	136	177.5 Å²	177.5	83%	0.834	85%	0.846	S	S	*	*			trans	46.6	98.2	149.2	58	0	0	0	0	120.3
595	S	26.4	Very low	24.1	Very low	114 Å²	114	174.5 Å²	174.5	80%	0.797	85%	0.845	S	S	*	*			trans	-73.7	129.9	166.7	51.1	0	0	0	0	113.7
596	F	24.3	Very low	24.1	Very low	209 Å²	209	173.4 Å²	173.4	92%	0.917	85%	0.846	S	S	*	*			trans	-61.2	133	171.3	-118.1	-107.7	0	0	0	112.3
597	K	26.7	Very low	24.1	Very low	196 Å²	196	172.9 Å²	172.9	85%	0.852	84%	0.844	S	S	*	*			trans	-107.1	120.9	171.8	-79.5	-175.8	175.5	-178.6	0	110.3
598	P	23.4	Very low	24.3	Very low	124 Å²	124	169.8 Å²	169.8	81%	0.805	84%	0.842	S	S	*	*			trans	-90.3	124.3	176.1	32.2	-27.9	0	0	0	111.6
599	T	24.2	Very low	24.4	Very low	144 Å²	144	167.2 Å²	167.2	88%	0.883	85%	0.845	S	S	*	*			trans	-80.2	113.4	175.1	17.9	0	0	0	0	111.7
600	M	22.1	Very low	24.5	Very low	183 Å²	183	161.4 Å²	161.4	90%	0.901	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-73.7	122.6	167.7	-82.8	179.9	62.8	0	0	111
601	K	23.2	Very low	24.6	Very low	188 Å²	188	161.3 Å²	161.3	82%	0.817	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-94.5	120.8	165.4	-79.5	-176.7	176.5	178.5	0	109.6
602	T	24.7	Very low	24.7	Very low	126 Å²	126	165 Å²	165	77%	0.773	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-65.2	127.2	173.9	33.9	0	0	0	0	111.7
603	F	21.8	Very low	24.8	Very low	201 Å²	201	163.5 Å²	163.5	88%	0.882	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-84.9	125.5	177.9	-78.5	-97.5	0	0	0	110.9
604	H	24.8	Very low	24.9	Very low	169 Å²	169	160.7 Å²	160.7	78%	0.782	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-97.5	139.5	165	-81	-64.2	0	0	0	110.2
605	P	23	Very low	24.9	Very low	123 Å²	123	164 Å²	164	80%	0.799	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-81.8	121.8	-170.1	28.2	-23.2	0	0	0	110.9
606	I	23.8	Very low	25	Very low	164 Å²	164	165.3 Å²	165.3	84%	0.841	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-91.4	124.3	178.6	-61.8	175.6	0	0	0	109.2
607	K	24.2	Very low	25.3	Very low	199 Å²	199	162 Å²	162	87%	0.865	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-65.1	122.3	173.6	-69.4	174.9	175.1	178.1	0	109.9
608	S	26.3	Very low	25.6	Very low	110 Å²	110	156 Å²	156	77%	0.769	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-87.1	120.1	175.4	46.9	0	0	0	0	111	C610	S608-C610 PolarHBondContact O-N 3.47Å
609	D	25.5	Very low	26	Very low	164 Å²	164	156.2 Å²	156.2	88%	0.877	82%	0.821	S	S	*	*			trans	-69.7	113.9	174.3	-92.3	-41.6	0	0	0	111.2	K611	D609-K611 PolarHBondContact O-N 2.8Å
610	C	24.3	Very low	26.5	Very low	126 Å²	126	153.6 Å²	153.6	85%	0.851	81%	0.805	S	S	*	*			trans	-72.6	90.4	172.8	-64.1	0	0	0	0	111.2	S608	S608-C610 PolarHBondContact O-N 3.47Å
611	K	25.2	Very low	27.2	Very low	194 Å²	194	150.6 Å²	150.6	84%	0.843	79%	0.793	S	S	*	*			trans	-136.6	129.7	161.3	-78	-176	174.5	167.9	0	111.2	D609	D609-K611 PolarHBondContact O-N 2.8Å
612	K	27.3	Very low	27.6	Very low	196 Å²	196	148.7 Å²	148.7	85%	0.852	79%	0.789	S	S	*	*			trans	90	66.4	173	-57.1	-178.4	178.7	178.2	0	117
613	L	26.2	Very low	27.9	Very low	187 Å²	187	148.1 Å²	148.1	98%	0.979	78%	0.78	S	S	*	*			trans	-120.6	85.7	144.4	-86.5	159.2	0	0	0	107.3
614	T	26.5	Very low	28.5	Very low	122 Å²	122	146.9 Å²	146.9	75%	0.748	77%	0.774	S	S	*	*			trans	-104.6	133.6	175.5	43.1	0	0	0	0	109.9
615	K	28.7	Very low	29.1	Very low	205 Å²	205	147.8 Å²	147.8	89%	0.891	78%	0.776	S	S	*	*			trans	82.4	75.3	166.5	-60	-178.7	176.8	179.8	0	116.8
616	T	29.2	Very low	29.6	Very low	141 Å²	141	151.3 Å²	151.3	87%	0.865	78%	0.779	S	S	*	*			trans	-123	130.9	140.3	48.3	0	0	0	0	108.3	S618	T616-S618 PolarHBondContact O-N 3.35Å
617	T	29.8	Very low	29.7	Very low	141 Å²	141	151 Å²	151	87%	0.865	78%	0.778	S	S	*	*			trans	-50.8	128.8	-172.7	37.1	0	0	0	0	112.6	L619	T617-L619 PolarHBondContact O-N 3.47Å
618	S	33.7	Very low	29.9	Very low	69 Å²	69	148.4 Å²	148.4	48%	0.483	77%	0.772	S	S	.	*			trans	-54.8	125	-174.8	-171.7	0	0	0	0	112.8	T616 T620 D621	T616-S618 PolarHBondContact O-N 3.35Å; S618-T620 PolarHBondContact O-N 3.16Å; S618-T620 PolarHBondContact OG-OG1 3Å; S618-D621 PolarHBondContact O-N 2.93Å
619	L	31.7	Very low	29.9	Very low	128 Å²	128	151.4 Å²	151.4	67%	0.67	77%	0.771	S	S	*	*	H	α-helix	trans	-54.2	-21.8	178.3	-139.3	93.7	0	0	0	113.5	T617 D621 M622 L623	T617-L619 PolarHBondContact O-N 3.47Å; L619-D621 VanDerWaalsContact C-N 3.28Å; L619-D621 PolarHBondContact O-N 3.42Å; L619-M622 PolarHBondContact O-N 3.45Å; L619-L623 PolarHBondContact O-N 3.4Å
620	T	34.6	Very low	29.9	Very low	90 Å²	90	151.6 Å²	151.6	55%	0.552	77%	0.772	S	S	*	*	H	α-helix	trans	-64.9	-25.9	176.2	31.5	0	0	0	0	114.1	S618	S618-T620 PolarHBondContact O-N 3.16Å; S618-T620 PolarHBondContact OG-OG1 3Å
621	D	35.9	Very low	30.1	Very low	120 Å²	120	152.9 Å²	152.9	64%	0.642	77%	0.771	S	S	*	*	H	α-helix	trans	-78.9	-25.9	175.2	-75.6	-23	0	0	0	112.3	S618 L619	S618-D621 PolarHBondContact O-N 2.93Å; L619-D621 VanDerWaalsContact C-N 3.28Å; L619-D621 PolarHBondContact O-N 3.42Å
622	M	32	Very low	30.2	Very low	148 Å²	148	148.9 Å²	148.9	73%	0.729	77%	0.767	S	S	*	*	H	α-helix	trans	-74.7	-34.5	174.3	-73.2	-170.3	65.9	0	0	112.3	L619 K625	L619-M622 PolarHBondContact O-N 3.45Å; M622-K625 PolarHBondContact O-N 2.89Å
623	L	31.2	Very low	30.2	Very low	113 Å²	113	149.1 Å²	149.1	59%	0.592	77%	0.768	S	S	*	*	H	α-helix	trans	-76.3	-24.8	-178.2	-72.9	169.6	0	0	0	113.6	L619 K625	L619-L623 PolarHBondContact O-N 3.4Å; L623-K625 VanDerWaalsContact C-N 3.29Å; L623-K625 PolarHBondContact O-N 3.37Å
624	K	35.1	Very low	30.1	Very low	176 Å²	176	147.8 Å²	147.8	77%	0.765	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-16	175	-80.1	-174.9	178	177.5	0	114.4
625	K	36.1	Very low	30	Very low	188 Å²	188	151.9 Å²	151.9	82%	0.817	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-4.9	-179.9	-85	-172.8	176.6	179.2	0	115.7	M622 L623	M622-K625 PolarHBondContact O-N 2.89Å; L623-K625 VanDerWaalsContact C-N 3.29Å; L623-K625 PolarHBondContact O-N 3.37Å
626	K	33.5	Very low	29.8	Very low	196 Å²	196	147.5 Å²	147.5	85%	0.852	77%	0.765	S	S	*	*	S	Bend	trans	-113.9	2.8	178.8	-87	-168.4	174	-175.3	0	116.2	I628	K626-I628 PolarHBondContact O-N 3.24Å
627	L	26.2	Very low	29.5	Very low	157 Å²	157	147.1 Å²	147.1	82%	0.822	76%	0.762	S	S	*	*			trans	-93	70	171.1	-82.2	157.2	0	0	0	110.8
628	I	28	Very low	29.2	Very low	145 Å²	145	145 Å²	145	74%	0.744	75%	0.753	S	S	*	*			trans	-126.2	104.1	161.8	-61.5	-179.8	0	0	0	107.9	K626	K626-I628 PolarHBondContact O-N 3.24Å
629	K	26.4	Very low	28.6	Very low	173 Å²	173	147.7 Å²	147.7	75%	0.752	77%	0.771	S	S	*	*			trans	41.9	112.9	151.3	-66.7	-179.3	173.7	-177.3	0	118.3
630	N	27.1	Very low	28.2	Very low	168 Å²	168	148.6 Å²	148.6	90%	0.898	78%	0.776	S	S	*	*			trans	-142.2	97.9	138	-96.9	-18.4	0	0	0	109
631	D	27.1	Very low	27.7	Very low	154 Å²	154	150.9 Å²	150.9	82%	0.824	79%	0.79	S	S	*	*			trans	-78	118.3	165.6	-72.6	-49.2	0	0	0	109
632	S	27.1	Very low	27.1	Very low	110 Å²	110	153.2 Å²	153.2	77%	0.769	80%	0.802	S	S	*	*			trans	-161.2	90.7	157.7	44.4	0	0	0	0	113.3
633	K	27.8	Very low	27.3	Very low	200 Å²	200	150.9 Å²	150.9	87%	0.87	80%	0.798	S	S	*	*			trans	42.2	101.8	139.3	-68.6	-178.3	176.9	178.4	0	119.9
634	N	24.6	Very low	27.1	Very low	160 Å²	160	152.5 Å²	152.5	86%	0.856	81%	0.807	S	S	*	*			trans	-15.9	125	141.4	-59.4	-20.9	0	0	0	116.6
635	F	24.6	Very low	26.5	Very low	207 Å²	207	151.9 Å²	151.9	91%	0.908	81%	0.812	S	S	*	*			trans	-127.2	103.7	150.9	-104	-88.3	0	0	0	108.2
636	S	24	Very low	25.9	Very low	114 Å²	114	152.1 Å²	152.1	80%	0.797	81%	0.813	S	S	*	*			trans	-94.3	119.4	171.5	53.6	0	0	0	0	108.9
637	V	23.2	Very low	25.3	Very low	132 Å²	132	150.5 Å²	150.5	80%	0.8	81%	0.814	S	S	*	*			trans	-103.9	111.2	170.8	179.1	0	0	0	0	107.6
638	S	23	Very low	25.3	Very low	96 Å²	96	150.8 Å²	150.8	67%	0.671	82%	0.815	S	S	*	*			trans	-82.6	124.5	178.9	55	0	0	0	0	111	N640	S638-N640 PolarHBondContact O-N 3.1Å
639	C	21.2	Very low	25.1	Very low	126 Å²	126	147.5 Å²	147.5	85%	0.851	82%	0.818	S	S	*	*			trans	-73.4	114.8	172	-67.1	0	0	0	0	110.6	T641	C639-T641 PolarHBondContact O-N 2.92Å
640	N	24	Very low	24.9	Very low	148 Å²	148	144.4 Å²	144.4	79%	0.791	82%	0.824	S	S	*	*			trans	-82.7	111.3	171.7	-76.7	-25.5	0	0	0	110.1	S638	S638-N640 PolarHBondContact O-N 3.1Å
641	T	23.1	Very low	24.8	Very low	138 Å²	138	145.6 Å²	145.6	85%	0.847	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-70.9	122.4	166	44.4	0	0	0	0	110.1	C639	C639-T641 PolarHBondContact O-N 2.92Å
642	L	24	Very low	24.6	Very low	168 Å²	168	147.3 Å²	147.3	88%	0.88	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-102.6	130.2	168.2	-94.3	152.5	0	0	0	109.5
643	P	35.3	Very low	24.5	Very low	99 Å²	99	150.5 Å²	150.5	64%	0.643	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-89.6	158.6	179.5	37	-31.6	0	0	0	110.4
644	N	27.1	Very low	24.3	Very low	148 Å²	148	149.6 Å²	149.6	79%	0.791	83%	0.834	S	S	*	*			trans	-171.7	103.3	139.7	-89.4	-23.1	0	0	0	110.5
645	N	22.3	Very low	24.1	Very low	163 Å²	163	153.9 Å²	153.9	87%	0.872	84%	0.838	S	S	*	*			trans	-66.7	129	160.3	-75	-24.3	0	0	0	108.9
646	F	24.1	Very low	24	Very low	192 Å²	192	152.9 Å²	152.9	84%	0.842	83%	0.834	S	S	*	*			trans	-123.8	109.4	157	-99.6	-86.1	0	0	0	108.4
647	D	22.3	Very low	24	Very low	162 Å²	162	153.2 Å²	153.2	87%	0.866	83%	0.833	S	S	*	*			trans	-87.1	119.7	178.6	-145.8	-4.6	0	0	0	107.2
648	L	24.8	Very low	24	Very low	163 Å²	163	154.4 Å²	154.4	85%	0.853	83%	0.833	S	S	*	*			trans	-119.6	121.1	174.1	-84.3	168.5	0	0	0	109.1
649	G	24.7	Very low	24	Very low	77 Å²	77	155.6 Å²	155.6	79%	0.794	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-66.9	148.3	-166.1	0	0	0	0	0	115
650	A	22.2	Very low	24.1	Very low	107 Å²	107	157.1 Å²	157.1	88%	0.884	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-76.4	117	175.7	0	0	0	0	0	111.2
651	E	24.3	Very low	23.9	Very low	194 Å²	194	159 Å²	159	91%	0.907	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-103.9	132.5	159.9	-84.8	-164.3	155.5	0	0	111.4
652	Q	24	Very low	23.8	Very low	190 Å²	190	155.9 Å²	155.9	89%	0.888	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-68.5	120.7	-176.7	-67.3	170.5	-12.4	0	0	111.2
653	L	23.4	Very low	23.7	Very low	176 Å²	176	157.1 Å²	157.1	92%	0.921	83%	0.831	S	S	*	*			trans	-113.7	122.4	162.7	-78.4	169.2	0	0	0	110.9
654	Q	23.6	Very low	23.1	Very low	182 Å²	182	160.5 Å²	160.5	85%	0.85	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-63.3	139.5	-172.3	-75.9	172.3	-28.5	0	0	112.9
655	R	21.5	Very low	22.9	Very low	249 Å²	249	159 Å²	159	94%	0.94	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-67.1	120.7	178.8	-66.6	175.6	176.5	-179.5	-0.7	111.7
656	F	22.2	Very low	22.9	Very low	186 Å²	186	157.4 Å²	157.4	82%	0.816	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-97.4	139.6	155.4	-78.4	-82.7	0	0	0	110.1	I658	F656-I658 PolarHBondContact O-N 2.95Å
657	P	24	Very low	22.8	Very low	121 Å²	121	158.7 Å²	158.7	79%	0.786	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-81.3	118.9	-169.9	32.1	-32.1	0	0	0	111.1
658	I	24	Very low	22.8	Very low	157 Å²	157	159.9 Å²	159.9	81%	0.805	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-90.6	121.3	174.8	-61.7	173.1	0	0	0	109	F656 N660	F656-I658 PolarHBondContact O-N 2.95Å; I658-N660 PolarHBondContact O-N 3.36Å
659	V	21.7	Very low	22.7	Very low	121 Å²	121	160.8 Å²	160.8	73%	0.733	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-71.9	116.9	176.7	176.9	0	0	0	0	109.3	F661	V659-F661 PolarHBondContact O-N 3.44Å
660	N	22.7	Very low	22.5	Very low	158 Å²	158	168 Å²	168	85%	0.845	83%	0.827	S	S	*	*			trans	-70.1	111.1	178.3	-82.1	-33.4	0	0	0	111.4	I658 G662	I658-N660 PolarHBondContact O-N 3.36Å; N660-G662 PolarHBondContact O-N 2.94Å
661	F	21.1	Very low	22.5	Very low	189 Å²	189	169.6 Å²	169.6	83%	0.829	82%	0.819	S	S	*	*			trans	-81.8	96.3	159.5	-89	-86.4	0	0	0	109.2	V659 F663	V659-F661 PolarHBondContact O-N 3.44Å; F661-F663 PolarHBondContact O-N 2.72Å
662	G	21.4	Very low	22.4	Very low	72 Å²	72	165.1 Å²	165.1	74%	0.742	81%	0.806	S	S	*	*			trans	-77	113.2	172.6	0	0	0	0	0	111.1	N660 E664	N660-G662 PolarHBondContact O-N 2.94Å; G662-E664 PolarHBondContact O-N 3.47Å
663	F	21.8	Very low	22.4	Very low	194 Å²	194	163.1 Å²	163.1	85%	0.851	80%	0.801	S	S	*	*			trans	-80.6	100.6	164.2	-85.6	-90.9	0	0	0	109	F661 T665	F661-F663 PolarHBondContact O-N 2.72Å; F663-T665 PolarHBondContact O-N 2.69Å
664	E	22.1	Very low	22.5	Very low	170 Å²	170	161.4 Å²	161.4	79%	0.794	79%	0.793	S	S	*	*			trans	-77.8	106.1	165.8	-79	-172.4	158.9	0	0	109.8	G662 N666	G662-E664 PolarHBondContact O-N 3.47Å; E664-N666 PolarHBondContact O-N 3.42Å; E664-N666 VanDerWaalsContact O-N 3.11Å
665	T	22.6	Very low	22.5	Very low	116 Å²	116	164.3 Å²	164.3	71%	0.712	80%	0.796	S	S	*	*			trans	-76.6	91.6	171.3	46.1	0	0	0	0	110	F663 Y667	F663-T665 PolarHBondContact O-N 2.69Å; T665-Y667 VanDerWaalsContact C-N 3.31Å; T665-Y667 PolarHBondContact O-N 3.29Å
666	N	22.3	Very low	22.7	Very low	129 Å²	129	158.2 Å²	158.2	69%	0.69	79%	0.791	S	S	*	*			trans	-71.1	79.6	173.4	-85.1	-58.3	0	0	0	111.8	E664 K668	E664-N666 PolarHBondContact O-N 3.42Å; E664-N666 VanDerWaalsContact O-N 3.11Å; N666-K668 VanDerWaalsContact C-N 3.32Å; N666-K668 PolarHBondContact O-N 3.19Å
667	Y	21.6	Very low	23	Very low	219 Å²	219	153.2 Å²	153.2	86%	0.859	78%	0.78	S	S	*	*			trans	-72.8	84.6	164.5	-94.6	-90.3	0	0	0	110	T665 H669	T665-Y667 VanDerWaalsContact C-N 3.31Å; T665-Y667 PolarHBondContact O-N 3.29Å; Y667-H669 PolarHBondContact O-N 2.91Å
668	K	23.5	Very low	23.3	Very low	188 Å²	188	154.1 Å²	154.1	82%	0.817	78%	0.778	S	S	*	*			trans	-77.7	102.3	166.1	-83.6	-176.3	177.8	175.4	0	109.4	N666 R670	N666-K668 VanDerWaalsContact C-N 3.32Å; N666-K668 PolarHBondContact O-N 3.19Å; K668-R670 PolarHBondContact O-N 3.23Å
669	H	22.3	Very low	23.8	Very low	182 Å²	182	153.4 Å²	153.4	84%	0.843	77%	0.774	S	S	*	*			trans	-55.9	105	168.3	-124.7	17.7	0	0	0	109.8	Y667 I671	Y667-H669 PolarHBondContact O-N 2.91Å; H669-I671 PolarHBondContact O-N 2.88Å; H669-I671 VanDerWaalsContact O-N 3.13Å
670	R	20.8	Very low	24.4	Very low	228 Å²	228	154.6 Å²	154.6	86%	0.86	77%	0.772	S	S	*	*			trans	-78.7	91.7	175.9	-155.8	179.2	-164.6	-178.9	3.8	107.4	K668 T672	K668-R670 PolarHBondContact O-N 3.23Å; R670-T672 PolarHBondContact O-N 3.43Å
671	I	21.7	Very low	24.7	Very low	140 Å²	140	152.7 Å²	152.7	72%	0.718	76%	0.761	S	S	*	*			trans	-67.9	97.5	170.4	-61.6	173	0	0	0	107.2	H669 N673	H669-I671 PolarHBondContact O-N 2.88Å; H669-I671 VanDerWaalsContact O-N 3.13Å; I671-N673 PolarHBondContact O-N 2.91Å
672	T	22.5	Very low	25.1	Very low	101 Å²	101	149 Å²	149	62%	0.62	75%	0.75	S	S	*	*			trans	-82.9	103.1	169.7	47.8	0	0	0	0	108.6	R670 N674	R670-T672 PolarHBondContact O-N 3.43Å; T672-N674 VanDerWaalsContact C-N 3.31Å; T672-N674 PolarHBondContact O-N 3.21Å
673	N	23	Very low	25.8	Very low	147 Å²	147	151.8 Å²	151.8	79%	0.786	74%	0.744	S	S	*	*			trans	-68.4	82.6	171.6	-78.7	-26.8	0	0	0	110.6	I671 R675	I671-N673 PolarHBondContact O-N 2.91Å; N673-R675 PolarHBondContact O-N 2.65Å
674	N	25.6	Very low	26.2	Very low	141 Å²	141	146.4 Å²	146.4	75%	0.754	73%	0.727	S	S	*	*			trans	-93.6	77.6	168.5	-83.1	-8.7	0	0	0	109.9	T672 S676	T672-N674 VanDerWaalsContact C-N 3.31Å; T672-N674 PolarHBondContact O-N 3.21Å; N674-S676 VanDerWaalsContact C-N 3.34Å; N674-S676 PolarHBondContact O-N 3.32Å
675	R	24.8	Very low	26.6	Very low	242 Å²	242	142.8 Å²	142.8	91%	0.913	71%	0.713	S	S	*	*			trans	-79.9	84.4	159.7	-83.1	-175	176.6	179.9	-1.3	107.9	N673	N673-R675 PolarHBondContact O-N 2.65Å
676	S	26.1	Very low	27.1	Very low	121 Å²	121	144 Å²	144	85%	0.846	71%	0.71	S	S	*	*			trans	-179.3	71.7	161	-75.8	0	0	0	0	110.6	N674	N674-S676 VanDerWaalsContact C-N 3.34Å; N674-S676 PolarHBondContact O-N 3.32Å
677	S	28.5	Very low	27.6	Very low	81 Å²	81	142.9 Å²	142.9	57%	0.566	70%	0.703	S	S	*	*			trans	-150.4	2.2	171.8	57.6	0	0	0	0	116.5	I679	S677-I679 VanDerWaalsContact C-N 3.33Å; S677-I679 PolarHBondContact O-N 2.66Å
678	N	29.8	Very low	27.9	Very low	141 Å²	141	137 Å²	137	75%	0.754	69%	0.687	S	S	*	*	H	α-helix	trans	-78.5	-9.5	177.3	-85.1	-17.6	0	0	0	114.7
679	I	35.1	Very low	28.2	Very low	141 Å²	141	133.4 Å²	133.4	72%	0.723	68%	0.676	S	S	*	*	H	α-helix	trans	-84.4	-26.2	178.2	-64.2	174.9	0	0	0	111.6	S677	S677-I679 VanDerWaalsContact C-N 3.33Å; S677-I679 PolarHBondContact O-N 2.66Å
680	Q	33.6	Very low	28.8	Very low	146 Å²	146	131.4 Å²	131.4	68%	0.682	67%	0.668	S	S	*	*	H	α-helix	trans	-80.1	-32.3	-174.4	-131.5	170.5	-4.5	0	0	113	N682 Q683 T684	Q680-N682 PolarHBondContact O-N 3.41Å; Q680-Q683 PolarHBondContact O-N 3.12Å; Q680-T684 PolarHBondContact O-N 3.19Å; Q680-T684 PolarHBondContact O-OG1 2.86Å; Q680-T684 VanDerWaalsContact O-OG1 3.05Å
681	L	29.3	Very low	29.4	Very low	118 Å²	118	125 Å²	125	62%	0.618	65%	0.65	S	S	*	*	H	α-helix	trans	-68.1	-36.1	-177.4	-155.1	84.6	0	0	0	113.1	T684 L685	L681-T684 PolarHBondContact O-N 3.33Å; L681-L685 PolarHBondContact O-N 2.82Å
682	N	29.2	Very low	29.9	Very low	113 Å²	113	122.9 Å²	122.9	60%	0.604	65%	0.648	S	S	*	*	H	α-helix	trans	-72.9	-32.2	-179.6	-74.5	-9.1	0	0	0	112.4	Q680 L685 E686	Q680-N682 PolarHBondContact O-N 3.41Å; N682-L685 PolarHBondContact O-N 2.67Å; N682-E686 PolarHBondContact O-N 3.12Å
683	Q	35	Very low	30.2	Very low	129 Å²	129	124.7 Å²	124.7	60%	0.603	65%	0.654	S	S	*	*	H	α-helix	trans	-69.8	-35.1	175.8	-71.5	-177.3	-9	0	0	112	Q680 L687	Q680-Q683 PolarHBondContact O-N 3.12Å; Q683-L687 PolarHBondContact O-N 3.05Å
684	T	30.6	Very low	30.6	Very low	81 Å²	81	125 Å²	125	50%	0.497	65%	0.65	S	S	.	*	H	α-helix	trans	-69.5	-35	177	-43	0	0	0	0	112.2	Q680 L681 N688	Q680-T684 PolarHBondContact O-N 3.19Å; Q680-T684 PolarHBondContact O-OG1 2.86Å; Q680-T684 VanDerWaalsContact O-OG1 3.05Å; L681-T684 PolarHBondContact O-N 3.33Å; T684-N688 PolarHBondContact O-N 3.11Å; T684-N688 VanDerWaalsContact O-N 3.16Å
685	L	30.1	Very low	30.8	Very low	95 Å²	95	127.2 Å²	127.2	50%	0.497	65%	0.649	S	S	.	*	H	α-helix	trans	-71.1	-38.6	176.9	-91.8	154.7	0	0	0	113.1	L681 N682 N689	L681-L685 PolarHBondContact O-N 2.82Å; N682-L685 PolarHBondContact O-N 2.67Å; L685-N689 PolarHBondContact O-N 3.03Å
686	E	33.9	Very low	30.9	Very low	141 Å²	141	127.7 Å²	127.7	66%	0.659	65%	0.651	S	S	*	*	H	α-helix	trans	-65.8	-38.1	174.2	-106.6	-179.4	164	0	0	112.2	N682 N689 Q690	N682-E686 PolarHBondContact O-N 3.12Å; E686-N689 PolarHBondContact O-N 3.43Å; E686-Q690 WeakPolarHBondContact O-CG 3.23Å; E686-Q690 PolarHBondContact O-N 3.03Å; E686-Q690 VanDerWaalsContact O-N 3.15Å
687	L	31.9	Very low	30.8	Very low	105 Å²	105	125.1 Å²	125.1	55%	0.55	64%	0.644	S	S	.	*	H	α-helix	trans	-67	-41.3	178.5	-145.5	94.2	0	0	0	111.9	Q683 N689 Q690 L691	Q683-L687 PolarHBondContact O-N 3.05Å; L687-N689 PolarHBondContact O-N 3.31Å; L687-Q690 PolarHBondContact O-N 3.39Å; L687-L691 HydrophobicContact CD2-CD1 4.21Å; L687-L691 HydrophobicContact CG-CD1 4.49Å; L687-L691 WeakPolarHBondContact O-CG 3.22Å; L687-L691 PolarHBondContact O-N 2.98Å; L687-L691 VanDerWaalsContact O-N 3.07Å
688	N	29.3	Very low	30.7	Very low	96 Å²	96	129.4 Å²	129.4	51%	0.513	66%	0.66	S	S	.	*	H	α-helix	trans	-66.8	-36.5	179.1	-81.9	-11.8	0	0	0	112.6	T684 Q690 L691 S692	T684-N688 PolarHBondContact O-N 3.11Å; T684-N688 VanDerWaalsContact O-N 3.16Å; N688-Q690 VanDerWaalsContact C-N 3.34Å; N688-L691 PolarHBondContact O-N 3.25Å; N688-S692 PolarHBondContact O-N 3.02Å; N688-S692 VanDerWaalsContact O-N 3.12Å
689	N	30	Very low	30.5	Very low	112 Å²	112	129.7 Å²	129.7	60%	0.599	66%	0.661	S	S	*	*	H	α-helix	trans	-71.8	-28	175.4	-77.2	-21.9	0	0	0	112.9	L685 E686 L687	L685-N689 PolarHBondContact O-N 3.03Å; E686-N689 PolarHBondContact O-N 3.43Å; L687-N689 PolarHBondContact O-N 3.31Å
690	Q	35	Very low	30	Very low	140 Å²	140	130.9 Å²	130.9	65%	0.654	67%	0.667	S	S	*	*	H	α-helix	trans	-73.1	-34.4	172.5	-74	-173.3	-0.2	0	0	112.6	E686 L687 N688	E686-Q690 WeakPolarHBondContact O-CG 3.23Å; E686-Q690 PolarHBondContact O-N 3.03Å; E686-Q690 VanDerWaalsContact O-N 3.15Å; L687-Q690 PolarHBondContact O-N 3.39Å; N688-Q690 VanDerWaalsContact C-N 3.34Å
691	L	31.9	Very low	29.6	Very low	94 Å²	94	128.4 Å²	128.4	49%	0.492	67%	0.672	S	S	.	*	H	α-helix	trans	-78.1	-30.5	-178.9	-70.2	167.7	0	0	0	113.3	L687 N688 N693	L687-L691 HydrophobicContact CD2-CD1 4.21Å; L687-L691 HydrophobicContact CG-CD1 4.49Å; L687-L691 WeakPolarHBondContact O-CG 3.22Å; L687-L691 PolarHBondContact O-N 2.98Å; L687-L691 VanDerWaalsContact O-N 3.07Å; N688-L691 PolarHBondContact O-N 3.25Å; L691-N693 VanDerWaalsContact C-N 3.27Å; L691-N693 PolarHBondContact O-N 3.49Å
692	S	31.9	Very low	29.3	Very low	96 Å²	96	132.6 Å²	132.6	67%	0.671	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-18	-178.3	-173	0	0	0	0	114.7	N688	N688-S692 PolarHBondContact O-N 3.02Å; N688-S692 VanDerWaalsContact O-N 3.12Å
693	N	30	Very low	29.1	Very low	139 Å²	139	135.4 Å²	135.4	74%	0.743	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-11.1	-175.1	-81.5	-32	0	0	0	114.9	L691	L691-N693 VanDerWaalsContact C-N 3.27Å; L691-N693 PolarHBondContact O-N 3.49Å
694	Q	30.3	Very low	28.7	Very low	153 Å²	153	135.8 Å²	135.8	72%	0.715	70%	0.701	S	S	*	*	S	Bend	trans	-92	-2	-171.8	-83.9	-165.9	-18.6	0	0	116.7
695	Y	29.7	Very low	28.4	Very low	188 Å²	188	135.3 Å²	135.3	74%	0.737	71%	0.712	S	S	*	*			trans	-122.6	22.6	-172.8	-62.3	-73.8	0	0	0	115.9	G697	Y695-G697 PolarHBondContact O-N 3.39Å
696	R	26.8	Very low	28.2	Very low	251 Å²	251	139.5 Å²	139.5	95%	0.947	73%	0.726	S	S	*	*			trans	-87.8	26.2	173.6	-133	-177.4	-174.1	-177.4	2.1	114.7
697	G	24.9	Very low	27.6	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	73%	0.731	S	S	*	*			trans	-138.6	65.4	-175.8	0	0	0	0	0	113.1	Y695	Y695-G697 PolarHBondContact O-N 3.39Å
698	L	26.7	Very low	27.3	Very low	170 Å²	170	143.3 Å²	143.3	89%	0.89	74%	0.739	S	S	*	*			trans	-145.5	47.6	164	-96.2	165.8	0	0	0	109.8
699	D	25.8	Very low	27	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	75%	0.746	S	S	*	*			trans	-89.3	143.1	153.8	-69.1	-36.3	0	0	0	107.5
700	I	25.2	Very low	26.8	Very low	165 Å²	165	146.9 Å²	146.9	85%	0.846	75%	0.753	S	S	*	*			trans	93.9	85.4	173.9	-43.6	160.7	0	0	0	115.5
701	A	23.7	Very low	26.3	Very low	95 Å²	95	147 Å²	147	79%	0.785	76%	0.757	S	S	*	*			trans	-144	69.5	137.3	0	0	0	0	0	109.1	L703	A701-L703 PolarHBondContact O-N 2.97Å; A701-L703 VanDerWaalsContact O-N 3.07Å
702	Y	22.7	Very low	25.9	Very low	206 Å²	206	149.9 Å²	149.9	81%	0.808	77%	0.771	S	S	*	*			trans	-61.8	101.6	158.6	-101.4	-98.4	0	0	0	107.9	N704	Y702-N704 VanDerWaalsContact C-N 3.32Å; Y702-N704 PolarHBondContact O-N 3.43Å
703	L	26.3	Very low	25.5	Very low	171 Å²	171	150.4 Å²	150.4	90%	0.895	77%	0.77	S	S	*	*			trans	-82.7	89.4	156.3	-81.1	166.3	0	0	0	107	A701 G705	A701-L703 PolarHBondContact O-N 2.97Å; A701-L703 VanDerWaalsContact O-N 3.07Å; L703-G705 PolarHBondContact O-N 3Å
704	N	26	Very low	25.1	Very low	138 Å²	138	150 Å²	150	74%	0.738	77%	0.773	S	S	*	*			trans	-54.5	124.1	169.1	-87.6	-23	0	0	0	110.6	Y702	Y702-N704 VanDerWaalsContact C-N 3.32Å; Y702-N704 PolarHBondContact O-N 3.43Å
705	G	24.2	Very low	24.8	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	78%	0.776	S	S	*	*			trans	42.5	101.1	142.9	0	0	0	0	0	118.5	L703	L703-G705 PolarHBondContact O-N 3Å
706	K	25.2	Very low	24.5	Very low	183 Å²	183	145.9 Å²	145.9	80%	0.796	78%	0.778	S	S	*	*			trans	-151.8	107	132.1	-104.1	177.8	-170.8	-174.6	0	108.8	F708	K706-F708 HydrophobicContact CB-CE2 4.34Å; K706-F708 PolarHBondContact O-N 3.32Å
707	Q	22.6	Very low	24.3	Very low	162 Å²	162	140.2 Å²	140.2	76%	0.757	77%	0.772	S	S	*	*			trans	-53.5	111.9	166.6	-172.9	175.8	-4.2	0	0	108.5
708	F	25.5	Very low	24.3	Very low	164 Å²	164	143.1 Å²	143.1	72%	0.719	78%	0.776	S	S	*	*			trans	-102.1	95.8	166.9	-85.7	-83.4	0	0	0	107.2	K706 H710	K706-F708 HydrophobicContact CB-CE2 4.34Å; K706-F708 PolarHBondContact O-N 3.32Å; F708-H710 VanDerWaalsContact C-N 3.35Å; F708-H710 PolarHBondContact O-N 3.3Å
709	D	23.2	Very low	24.2	Very low	123 Å²	123	142.5 Å²	142.5	66%	0.658	77%	0.773	S	S	*	*			trans	-68.7	93.1	166.7	-71.1	-33.5	0	0	0	108.3	I711	D709-I711 VanDerWaalsContact C-N 3.3Å; D709-I711 PolarHBondContact O-N 2.87Å; D709-I711 VanDerWaalsContact O-N 3.12Å
710	H	26	Very low	24.2	Very low	161 Å²	161	141.2 Å²	141.2	75%	0.745	77%	0.77	S	S	*	*			trans	-79.5	86.3	164.4	-83.1	-63.2	0	0	0	108.8	F708 I712	F708-H710 VanDerWaalsContact C-N 3.35Å; F708-H710 PolarHBondContact O-N 3.3Å; H710-I712 PolarHBondContact O-N 3.33Å; H710-I712 VanDerWaalsContact O-N 3.12Å
711	I	24.5	Very low	24.1	Very low	143 Å²	143	139.6 Å²	139.6	73%	0.733	77%	0.769	S	S	*	*			trans	-62.4	108.3	156.6	-64.7	174.5	0	0	0	106.2	D709 T713	D709-I711 VanDerWaalsContact C-N 3.3Å; D709-I711 PolarHBondContact O-N 2.87Å; D709-I711 VanDerWaalsContact O-N 3.12Å; I711-T713 VanDerWaalsContact C-N 3.29Å; I711-T713 PolarHBondContact O-N 3.42Å
712	I	23.7	Very low	24.3	Very low	153 Å²	153	141.3 Å²	141.3	79%	0.785	77%	0.77	S	S	*	*			trans	-69.5	90	173.5	-61.8	170.9	0	0	0	106.7	H710 T714	H710-I712 PolarHBondContact O-N 3.33Å; H710-I712 VanDerWaalsContact O-N 3.12Å; I712-T714 PolarHBondContact O-N 2.97Å
713	T	23.3	Very low	24.5	Very low	107 Å²	107	140.2 Å²	140.2	66%	0.656	77%	0.771	S	S	*	*			trans	-78.3	104.5	167.7	-46.1	0	0	0	0	107.6	I711 T715	I711-T713 VanDerWaalsContact C-N 3.29Å; I711-T713 PolarHBondContact O-N 3.42Å; T713-T715 PolarHBondContact O-N 2.88Å; T713-T715 PolarHBondContact O-OG1 2.72Å
714	T	21.1	Very low	24.4	Very low	130 Å²	130	137.3 Å²	137.3	80%	0.798	77%	0.765	S	S	*	*			trans	-58	97.3	167.7	20.3	0	0	0	0	109.9	I712	I712-T714 PolarHBondContact O-N 2.97Å
715	T	23.4	Very low	24.5	Very low	127 Å²	127	140.8 Å²	140.8	78%	0.779	77%	0.774	S	S	*	*			trans	-87.8	114.1	171.1	-20.5	0	0	0	0	109.5	T713 T717	T713-T715 PolarHBondContact O-N 2.88Å; T713-T715 PolarHBondContact O-OG1 2.72Å; T715-T717 PolarHBondContact O-N 3.42Å
716	T	23.5	Very low	24.6	Very low	128 Å²	128	149.2 Å²	149.2	79%	0.785	78%	0.784	S	S	*	*			trans	-54.5	125	177.2	-6.6	0	0	0	0	111.4	T718	T716-T718 PolarHBondContact O-N 2.59Å
717	T	23.6	Very low	24.5	Very low	133 Å²	133	150 Å²	150	82%	0.816	79%	0.788	S	S	*	*			trans	-58.8	113.2	175.3	38.9	0	0	0	0	111.7	T715	T715-T717 PolarHBondContact O-N 3.42Å
718	T	24.4	Very low	24.7	Very low	128 Å²	128	147.9 Å²	147.9	79%	0.785	79%	0.788	S	S	*	*			trans	-90.8	122.2	166.7	39.8	0	0	0	0	110.2	T716 V720	T716-T718 PolarHBondContact O-N 2.59Å; T718-V720 PolarHBondContact O-N 3.44Å
719	N	23.7	Very low	24.8	Very low	158 Å²	158	149.1 Å²	149.1	85%	0.845	80%	0.795	S	S	*	*			trans	-59	116.5	176.8	-70.7	-33.2	0	0	0	111.1
720	V	26.1	Very low	25	Very low	120 Å²	120	152.1 Å²	152.1	73%	0.727	81%	0.805	S	S	*	*			trans	-109.7	106.9	166.2	-178.1	0	0	0	0	108.9	T718 T722	T718-V720 PolarHBondContact O-N 3.44Å; V720-T722 PolarHBondContact O-N 3.2Å
721	T	22.8	Very low	25	Very low	132 Å²	132	153 Å²	153	81%	0.81	81%	0.809	S	S	*	*			trans	-65.8	112.2	170.5	12.7	0	0	0	0	110.4
722	T	27.9	Very low	25.1	Very low	131 Å²	131	153.5 Å²	153.5	80%	0.804	81%	0.814	S	S	*	*			trans	-102.7	115.1	171.1	53.8	0	0	0	0	111.1	V720	V720-T722 PolarHBondContact O-N 3.2Å
723	H	26.8	Very low	25.2	Very low	182 Å²	182	155.9 Å²	155.9	84%	0.843	82%	0.818	S	S	*	*			trans	-57.6	142.1	177.7	-87.1	-81.4	0	0	0	114.4	K725	H723-K725 PolarHBondContact O-N 3.28Å
724	S	25.4	Very low	25.3	Very low	110 Å²	110	160.8 Å²	160.8	77%	0.769	83%	0.831	S	S	*	*			trans	-43.1	123.6	170.9	59.7	0	0	0	0	114.6
725	K	28.2	Very low	25.5	Very low	211 Å²	211	159.2 Å²	159.2	92%	0.917	83%	0.825	S	S	*	*			trans	-117.4	131.9	157.7	-78.9	-174.7	179.1	176.1	0	110.3	H723	H723-K725 PolarHBondContact O-N 3.28Å
726	R	25.6	Very low	25.6	Very low	247 Å²	247	159 Å²	159	93%	0.932	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-64	140.4	-166.5	-71.3	172	168.8	167.4	-4.9	113.2
727	K	24.3	Very low	25.7	Very low	201 Å²	201	160.8 Å²	160.8	87%	0.874	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-62.9	132.7	171.6	-70.9	178.1	174.6	178.7	0	111.5
728	P	26.8	Very low	25.9	Very low	117 Å²	117	165.1 Å²	165.1	76%	0.76	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83.4	142.3	167.8	24.9	-15.7	0	0	0	111.3	H730	P728-H730 PolarHBondContact O-N 3.22Å
729	H	26.6	Very low	26.2	Very low	189 Å²	189	165.2 Å²	165.2	88%	0.875	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-56	118.1	-179.1	-84.2	-91.5	0	0	0	113.3	Q731	H729-Q731 PolarHBondContact O-N 2.76Å
730	H	27.2	Very low	26.6	Very low	186 Å²	186	164.3 Å²	164.3	86%	0.861	82%	0.821	S	S	*	*			trans	-76.2	111.4	164.4	-94.5	-78.1	0	0	0	110	P728	P728-H730 PolarHBondContact O-N 3.22Å
731	Q	27.2	Very low	27.1	Very low	179 Å²	179	163.5 Å²	163.5	84%	0.836	81%	0.812	S	S	*	*			trans	-88.6	131.9	162.9	-84.7	-177.1	-13	0	0	110.1	H729 F733	H729-Q731 PolarHBondContact O-N 2.76Å; Q731-F733 PolarHBondContact O-N 2.88Å
732	N	25	Very low	27.8	Very low	155 Å²	155	162.8 Å²	162.8	83%	0.829	80%	0.803	S	S	*	*			trans	-64.3	113.8	-171.6	-69.7	-45.6	0	0	0	113.4
733	F	26.2	Very low	28.1	Very low	202 Å²	202	163 Å²	163	89%	0.886	80%	0.799	S	S	*	*			trans	-101.2	100.7	155.2	-86.8	-83.7	0	0	0	109.3	Q731 S735	Q731-F733 PolarHBondContact O-N 2.88Å; F733-S735 PolarHBondContact O-N 3.09Å; F733-S735 VanDerWaalsContact O-N 3.11Å
734	K	25.4	Very low	28.4	Very low	210 Å²	210	160.6 Å²	160.6	91%	0.913	79%	0.786	S	S	*	*			trans	-61	103.6	167.8	-75.7	177.8	174.2	178.6	0	108.6
735	S	25.7	Very low	29	Very low	97 Å²	97	164.4 Å²	164.4	68%	0.678	78%	0.784	S	S	*	*			trans	-109.1	128.2	161.9	69.5	0	0	0	0	108.6	F733 L737	F733-S735 PolarHBondContact O-N 3.09Å; F733-S735 VanDerWaalsContact O-N 3.11Å; S735-L737 PolarHBondContact O-N 3.27Å
736	C	24.6	Very low	29.3	Very low	124 Å²	124	161.9 Å²	161.9	84%	0.838	77%	0.773	S	S	*	*			trans	-62.2	95.1	-172.9	-59.8	0	0	0	0	111.2	Y738	C736-Y738 PolarHBondContact O-N 3.46Å
737	L	27.3	Very low	29.6	Very low	164 Å²	164	159.3 Å²	159.3	86%	0.859	76%	0.763	S	S	*	*			trans	-77.3	119.6	167.8	-78.9	162.4	0	0	0	108.9	S735 N739	S735-L737 PolarHBondContact O-N 3.27Å; L737-N739 PolarHBondContact O-N 2.75Å
738	Y	27	Very low	30.1	Very low	224 Å²	224	155 Å²	155	88%	0.878	75%	0.75	S	S	*	*			trans	-54.5	128.6	177.6	-89.3	-108.8	0	0	0	111.4	C736 E740	C736-Y738 PolarHBondContact O-N 3.46Å; Y738-E740 PolarHBondContact O-N 2.94Å; Y738-E740 VanDerWaalsContact O-N 3.09Å
739	N	30.9	Very low	30.6	Very low	130 Å²	130	155.1 Å²	155.1	70%	0.695	74%	0.744	S	S	*	*			trans	-55	105.5	177.5	-101.5	-24.5	0	0	0	112.4	L737 D741	L737-N739 PolarHBondContact O-N 2.75Å; N739-D741 PolarHBondContact O-N 3.14Å
740	E	31.4	Very low	30.9	Very low	140 Å²	140	152.2 Å²	152.2	65%	0.654	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-20	173.8	-77.8	-162.8	147.1	0	0	113.9	Y738 N742 L743 K744	Y738-E740 PolarHBondContact O-N 2.94Å; Y738-E740 VanDerWaalsContact O-N 3.09Å; E740-N742 VanDerWaalsContact C-N 3.26Å; E740-N742 PolarHBondContact O-N 2.95Å; E740-L743 PolarHBondContact O-N 2.98Å; E740-K744 PolarHBondContact O-N 2.98Å
741	D	37.5	Very low	31.1	Very low	103 Å²	103	149.2 Å²	149.2	55%	0.551	72%	0.723	S	S	*	*	H	α-helix	trans	-64.5	-28.2	-175.5	-72.1	-28.9	0	0	0	113.6	N739 L743 R745	N739-D741 PolarHBondContact O-N 3.14Å; D741-L743 VanDerWaalsContact C-N 3.35Å; D741-R745 PolarHBondContact O-N 2.9Å
742	N	36.8	Very low	31.3	Very low	116 Å²	116	144.4 Å²	144.4	62%	0.62	71%	0.709	S	S	*	*	H	α-helix	trans	-73.3	-26.9	176.1	-88.6	-26.1	0	0	0	112.8	E740 K746	E740-N742 VanDerWaalsContact C-N 3.26Å; E740-N742 PolarHBondContact O-N 2.95Å; N742-K746 PolarHBondContact O-N 3.11Å
743	L	34.6	Very low	31.6	Very low	135 Å²	135	141 Å²	141	71%	0.707	70%	0.697	S	S	*	*	H	α-helix	trans	-77	-35.9	175	-84.5	160.1	0	0	0	111.4	E740 D741 K746 R747	E740-L743 PolarHBondContact O-N 2.98Å; D741-L743 VanDerWaalsContact C-N 3.35Å; L743-K746 PolarHBondContact O-N 2.79Å; L743-R747 PolarHBondContact O-N 3.28Å; L743-R747 VanDerWaalsContact O-N 3.17Å
744	K	33.8	Very low	31.7	Very low	133 Å²	133	139.5 Å²	139.5	58%	0.578	69%	0.693	S	S	*	*	H	α-helix	trans	-65.3	-39.7	175	-78.8	-178.3	-176.7	171.4	0	112.8	E740 R747 N748	E740-K744 PolarHBondContact O-N 2.98Å; K744-R747 PolarHBondContact O-N 2.94Å; K744-N748 PolarHBondContact O-N 3.01Å
745	R	37.4	Very low	31.8	Very low	189 Å²	189	136.9 Å²	136.9	71%	0.713	69%	0.688	S	S	*	*	H	α-helix	trans	-67.3	-38	176.6	-77.5	-173.3	-170.4	165.1	4.4	113.6	D741 N749	D741-R745 PolarHBondContact O-N 2.9Å; R745-N749 PolarHBondContact O-N 2.92Å
746	K	34.8	Very low	31.8	Very low	159 Å²	159	141.3 Å²	141.3	69%	0.691	70%	0.695	S	S	*	*	H	α-helix	trans	-69	-33.7	177.1	-101	-176.7	176	180	0	112.8	N742 L743	N742-K746 PolarHBondContact O-N 3.11Å; L743-K746 PolarHBondContact O-N 2.79Å
747	R	30.9	Very low	31.8	Very low	192 Å²	192	142.6 Å²	142.6	73%	0.725	69%	0.689	S	S	*	*	H	α-helix	trans	-71.6	-37.7	179	-138.1	172.3	-178.2	161.1	-1	112.3	L743 K744 L751	L743-R747 PolarHBondContact O-N 3.28Å; L743-R747 VanDerWaalsContact O-N 3.17Å; K744-R747 PolarHBondContact O-N 2.94Å; R747-L751 PolarHBondContact O-N 3.18Å
748	N	36	Very low	31.7	Very low	111 Å²	111	140.4 Å²	140.4	59%	0.594	69%	0.687	S	S	*	*	H	α-helix	trans	-76.5	-23.2	-178.4	-73.2	-5.6	0	0	0	114.5	K744 S752	K744-N748 PolarHBondContact O-N 3.01Å; N748-S752 PolarHBondContact O-OG 2.87Å
749	N	36.9	Very low	31.6	Very low	119 Å²	119	139.1 Å²	139.1	64%	0.636	68%	0.682	S	S	*	*	H	α-helix	trans	-82	-20.9	176.4	-77.1	-3.7	0	0	0	113.8	R745	R745-N749 PolarHBondContact O-N 2.92Å
750	I	33.4	Very low	31.4	Very low	129 Å²	129	136.8 Å²	136.8	66%	0.662	68%	0.676	S	S	*	*	H	α-helix	trans	-84.3	-28.3	176.9	-63.3	173.8	0	0	0	110.8
751	L	29.5	Very low	31.2	Very low	122 Å²	122	134.3 Å²	134.3	64%	0.639	68%	0.679	S	S	*	*	H	α-helix	trans	-86.9	-13.7	-179.4	-93.3	136.4	0	0	0	115.2	R747	R747-L751 PolarHBondContact O-N 3.18Å
752	S	32.3	Very low	30.8	Very low	78 Å²	78	137.6 Å²	137.6	55%	0.545	69%	0.691	S	S	.	*	S	Bend	trans	-97.1	-11.5	-176.8	65.8	0	0	0	0	115.6	N748	N748-S752 PolarHBondContact O-OG 2.87Å
753	S	31.4	Very low	30.3	Very low	83 Å²	83	139 Å²	139	58%	0.58	70%	0.699	S	S	*	*	S	Bend	trans	-96.7	-12	-175.6	53.6	0	0	0	0	115.3
754	H	29.2	Very low	29.9	Very low	171 Å²	171	139.6 Å²	139.6	79%	0.792	70%	0.702	S	S	*	*	S	Bend	trans	-110.9	7.5	-175.8	-85.4	-70.9	0	0	0	116.3
755	L	27	Very low	29.5	Very low	155 Å²	155	140.2 Å²	140.2	81%	0.812	71%	0.71	S	S	*	*	S	Bend	trans	-129.1	33.4	179.6	-81.3	164.9	0	0	0	114.3
756	K	24.9	Very low	28.9	Very low	190 Å²	190	139.8 Å²	139.8	83%	0.826	72%	0.716	S	S	*	*			trans	-123.6	64.6	166.2	-77.6	-171.4	177	-176.1	0	111.2
757	Q	25.6	Very low	28.5	Very low	151 Å²	151	139.7 Å²	139.7	71%	0.706	72%	0.722	S	S	*	*			trans	-116.5	83.2	147.6	-78.2	-174.8	-3.3	0	0	106.5	Y759	Q757-Y759 HydrophobicContact CB-CD2 4.46Å; Q757-Y759 HydrophobicContact CB-CE2 3.95Å; Q757-Y759 WeakPolarHBondContact O-CD2 3.09Å; Q757-Y759 PolarHBondContact O-N 3.1Å; Q757-Y759 VanDerWaalsContact O-N 3.09Å; Q757-Y759 PolarHBondContact OE1-OH 2.78Å
758	S	24.7	Very low	28.3	Very low	118 Å²	118	137 Å²	137	83%	0.825	72%	0.722	S	S	*	*			trans	-62.5	100.6	164.1	47.9	0	0	0	0	107.8	S760	S758-S760 PolarHBondContact O-N 3.06Å
759	Y	25.3	Very low	28	Very low	197 Å²	197	139.3 Å²	139.3	77%	0.773	73%	0.734	S	S	*	*			trans	-74.2	107.3	162.4	-70.9	-87.9	0	0	0	106.2	Q757	Q757-Y759 HydrophobicContact CB-CD2 4.46Å; Q757-Y759 HydrophobicContact CB-CE2 3.95Å; Q757-Y759 WeakPolarHBondContact O-CD2 3.09Å; Q757-Y759 PolarHBondContact O-N 3.1Å; Q757-Y759 VanDerWaalsContact O-N 3.09Å; Q757-Y759 PolarHBondContact OE1-OH 2.78Å
760	S	25.2	Very low	27.5	Very low	81 Å²	81	141 Å²	141	57%	0.566	74%	0.743	S	S	*	*			trans	-66.9	143.6	174.2	69	0	0	0	0	109.4	S758 E762	S758-S760 PolarHBondContact O-N 3.06Å; S760-E762 PolarHBondContact O-N 2.71Å
761	A	28.6	Very low	27.1	Very low	88 Å²	88	140.3 Å²	140.3	73%	0.727	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-72.6	17.5	-172.8	0	0	0	0	0	114.8
762	E	28.7	Very low	26.8	Very low	172 Å²	172	142.8 Å²	142.8	80%	0.804	76%	0.756	S	S	*	*	G	3₁₀ helix	trans	-97.9	1.9	-174.2	-75.5	177.3	158.2	0	0	114.4	S760	S760-E762 PolarHBondContact O-N 2.71Å
763	N	25.3	Very low	26.4	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-100	20.9	172.3	-72.6	-23.3	0	0	0	113.6	I765	N763-I765 PolarHBondContact O-N 3.07Å
764	I	26.4	Very low	26.1	Very low	149 Å²	149	148.7 Å²	148.7	76%	0.764	78%	0.778	S	S	*	*	S	Bend	trans	-72.9	87.9	160.7	-59.3	179.8	0	0	0	106.3	Q766	I764-Q766 PolarHBondContact O-N 3.14Å
765	I	26.4	Very low	25.9	Very low	146 Å²	146	145.6 Å²	145.6	75%	0.749	78%	0.775	S	S	*	*			trans	-37.4	118.4	171.6	-68.9	162.2	0	0	0	108.9	N763 L767	N763-I765 PolarHBondContact O-N 3.07Å; I765-L767 PolarHBondContact O-N 3.38Å
766	Q	25.4	Very low	25.9	Very low	179 Å²	179	142.8 Å²	142.8	84%	0.836	77%	0.769	S	S	*	*			trans	-43.1	109.7	161.4	-83	169.9	-58.7	0	0	108	I764 D768	I764-Q766 PolarHBondContact O-N 3.14Å; Q766-D768 VanDerWaalsContact C-N 3.3Å; Q766-D768 PolarHBondContact O-N 3.48Å
767	L	25.8	Very low	26	Very low	158 Å²	158	142.6 Å²	142.6	83%	0.827	77%	0.77	S	S	*	*			trans	-65.1	98.2	165.4	-83.7	154.2	0	0	0	106.5	I765 N769	I765-L767 PolarHBondContact O-N 3.38Å; L767-N769 PolarHBondContact O-N 3.07Å; L767-N769 VanDerWaalsContact O-N 3.14Å
768	D	26.4	Very low	26.2	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	77%	0.774	S	S	*	*			trans	-53.1	115.2	163.4	-99.8	-26.2	0	0	0	108	Q766 D770	Q766-D768 VanDerWaalsContact C-N 3.3Å; Q766-D768 PolarHBondContact O-N 3.48Å; D768-D770 PolarHBondContact O-N 3.3Å
769	N	28.7	Very low	26.4	Very low	159 Å²	159	141.1 Å²	141.1	85%	0.85	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	14.1	-177.4	-87.3	-26.2	0	0	0	114.2	L767	L767-N769 PolarHBondContact O-N 3.07Å; L767-N769 VanDerWaalsContact O-N 3.14Å
770	D	27.1	Very low	26.7	Very low	154 Å²	154	136.5 Å²	136.5	82%	0.824	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	8.1	-175.9	-75.9	-22.3	0	0	0	115.1	D768 M772	D768-D770 PolarHBondContact O-N 3.3Å; D770-M772 PolarHBondContact O-N 3.13Å
771	T	24.3	Very low	27	Very low	115 Å²	115	143.3 Å²	143.3	71%	0.706	78%	0.775	S	S	*	*			trans	-89.6	83.6	165.5	8.6	0	0	0	0	110.6	I773	T771-I773 VanDerWaalsContact C-N 3.25Å; T771-I773 PolarHBondContact O-N 3.25Å
772	M	24.2	Very low	27.1	Very low	174 Å²	174	146 Å²	146	86%	0.857	78%	0.777	S	S	*	*			trans	-52.3	92.9	155.1	-81.9	-84.9	154	0	0	108.5	D770 T774	D770-M772 PolarHBondContact O-N 3.13Å; M772-T774 PolarHBondContact O-N 3.46Å
773	I	23.7	Very low	27.4	Very low	159 Å²	159	142.6 Å²	142.6	82%	0.815	76%	0.764	S	S	*	*			trans	-68.7	89.5	170.5	-62.2	176.8	0	0	0	106.2	T771 S775	T771-I773 VanDerWaalsContact C-N 3.25Å; T771-I773 PolarHBondContact O-N 3.25Å; I773-S775 PolarHBondContact O-N 2.91Å
774	T	25.5	Very low	27.8	Very low	126 Å²	126	142.1 Å²	142.1	77%	0.773	76%	0.757	S	S	*	*			trans	-58.8	123.4	162.7	42.9	0	0	0	0	107.6	M772	M772-T774 PolarHBondContact O-N 3.46Å
775	S	24.6	Very low	28.2	Very low	106 Å²	106	138.7 Å²	138.7	74%	0.741	75%	0.751	S	S	*	*			trans	-60.2	157.5	175.3	51.6	0	0	0	0	111.1	I773	I773-S775 PolarHBondContact O-N 2.91Å
776	S	26.9	Very low	28.6	Very low	97 Å²	97	139 Å²	139	68%	0.678	75%	0.747	S	S	*	*			trans	82.4	106	172.1	79.8	0	0	0	0	116.1
777	H	27.7	Very low	29.1	Very low	186 Å²	186	133.5 Å²	133.5	86%	0.861	73%	0.732	S	S	*	*			trans	172.5	71.4	139.6	-82.5	-46	0	0	0	109.2
778	S	29.7	Very low	29.6	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	73%	0.731	S	S	*	*	S	Bend	trans	-159.2	44.5	173.9	177.6	0	0	0	0	113.7
779	T	28.3	Very low	29.9	Very low	125 Å²	125	139.3 Å²	139.3	77%	0.767	74%	0.738	S	S	*	*	S	Bend	trans	-151.1	9.1	168.7	28.6	0	0	0	0	115.8
780	D	32	Very low	30.1	Very low	101 Å²	101	136.3 Å²	136.3	54%	0.54	73%	0.729	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.3	18.9	-171.7	-86.3	-29.6	0	0	0	117
781	Y	31.1	Very low	30.1	Very low	223 Å²	223	133.9 Å²	133.9	88%	0.875	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-25.7	171.5	-100.9	-83.8	0	0	0	114
782	L	31.7	Very low	30.3	Very low	146 Å²	146	133.8 Å²	133.8	76%	0.764	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-20.1	-178.1	-111.5	125.7	0	0	0	114.1
783	N	34.3	Very low	30.5	Very low	99 Å²	99	132.6 Å²	132.6	53%	0.529	72%	0.724	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.3	-25.8	-179.8	-71.8	-26.4	0	0	0	114	A785 K786 A787	N783-A785 VanDerWaalsContact C-N 3.26Å; N783-A785 PolarHBondContact O-N 2.78Å; N783-K786 PolarHBondContact O-N 3.33Å; N783-K786 VanDerWaalsContact O-N 3.13Å; N783-A787 PolarHBondContact O-N 3.14Å
784	Q	34.4	Very low	30.6	Very low	135 Å²	135	130.6 Å²	130.6	63%	0.631	72%	0.723	S	S	*	*	H	α-helix	trans	-68.5	-23.6	175	-73.1	-170.8	17.2	0	0	113.5
785	A	34.5	Very low	30.6	Very low	77 Å²	77	133 Å²	133	64%	0.636	73%	0.731	S	S	*	*	H	α-helix	trans	-74.4	-25.5	173	0	0	0	0	0	112.9	N783	N783-A785 VanDerWaalsContact C-N 3.26Å; N783-A785 PolarHBondContact O-N 2.78Å
786	K	33.6	Very low	30.8	Very low	154 Å²	154	131.9 Å²	131.9	67%	0.67	74%	0.736	S	S	*	*	H	α-helix	trans	-88.6	-33.3	177.4	-76	-176.9	176.3	177.8	0	112.9	N783 K788 R789 S790	N783-K786 PolarHBondContact O-N 3.33Å; N783-K786 VanDerWaalsContact O-N 3.13Å; K786-K788 PolarHBondContact O-N 3.46Å; K786-R789 PolarHBondContact O-N 3.24Å; K786-S790 PolarHBondContact O-OG 3.14Å
787	A	37.1	Very low	30.7	Very low	63 Å²	63	135.6 Å²	135.6	52%	0.521	75%	0.747	S	S	.	*	H	α-helix	trans	-71.6	-26.1	-179.9	0	0	0	0	0	114.3	N783 R789 S790	N783-A787 PolarHBondContact O-N 3.14Å; A787-R789 PolarHBondContact O-N 3.29Å; A787-S790 PolarHBondContact O-N 2.74Å
788	K	36	Very low	30.5	Very low	184 Å²	184	135.1 Å²	135.1	80%	0.8	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-5.8	176.3	-81.8	-175.7	179.1	173.5	0	114.9	K786	K786-K788 PolarHBondContact O-N 3.46Å
789	R	31.7	Very low	30.2	Very low	230 Å²	230	135.3 Å²	135.3	87%	0.868	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	1.1	173.2	-90.6	-175.2	174.5	179.8	-0.4	114.6	K786 A787	K786-R789 PolarHBondContact O-N 3.24Å; A787-R789 PolarHBondContact O-N 3.29Å
790	S	33.4	Very low	30.1	Very low	96 Å²	96	136 Å²	136	67%	0.671	74%	0.741	S	S	*	*	S	Bend	trans	-119.9	4.3	-171.9	-40.6	0	0	0	0	116	K786 A787	K786-S790 PolarHBondContact O-OG 3.14Å; A787-S790 PolarHBondContact O-N 2.74Å
791	S	27.1	Very low	29.7	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	76%	0.756	S	S	*	*	S	Bend	trans	-122	29.1	-177.3	61.8	0	0	0	0	115.6
792	S	29.3	Very low	29.5	Very low	113 Å²	113	132.4 Å²	132.4	79%	0.79	75%	0.749	S	S	*	*	S	Bend	trans	-104.1	8	169.4	60	0	0	0	0	114.6
793	I	28.4	Very low	29.3	Very low	148 Å²	148	131.6 Å²	131.6	76%	0.759	75%	0.75	S	S	*	*	S	Bend	trans	-136.3	97.7	176.6	-53.8	175.5	0	0	0	107.2
794	C	24.4	Very low	28.8	Very low	118 Å²	118	135 Å²	135	80%	0.797	77%	0.766	S	S	*	*			trans	152.2	80.8	158.9	-84.7	0	0	0	0	108.4
795	N	26	Very low	28.4	Very low	177 Å²	177	134 Å²	134	95%	0.947	77%	0.772	S	S	*	*			trans	-161	111.6	155.5	-94.1	-21.9	0	0	0	107.9
796	G	29.9	Very low	28	Very low	81 Å²	81	137.6 Å²	137.6	84%	0.835	78%	0.781	S	S	*	*			trans	139.6	42.5	176.3	0	0	0	0	0	115
797	L	23.1	Very low	27.7	Very low	176 Å²	176	135.9 Å²	135.9	92%	0.921	79%	0.785	S	S	*	*			trans	-94.2	94.1	162.2	-90.2	158.5	0	0	0	107.4
798	Q	24.8	Very low	27.2	Very low	176 Å²	176	141.8 Å²	141.8	82%	0.822	80%	0.804	S	S	*	*			trans	-157.8	119.6	156.8	-107.8	172.6	21.3	0	0	111
799	T	23.5	Very low	26.9	Very low	116 Å²	116	142.6 Å²	142.6	71%	0.712	81%	0.808	S	S	*	*			trans	73.7	120.4	146.8	62.9	0	0	0	0	121.2
800	N	25.4	Very low	26.7	Very low	140 Å²	140	141.5 Å²	141.5	75%	0.749	81%	0.81	S	S	*	*			trans	98.7	104.3	139	-59.6	-7.9	0	0	0	119.1
801	D	24.1	Very low	26.9	Very low	160 Å²	160	141.9 Å²	141.9	86%	0.856	80%	0.804	S	S	*	*				47.8	136.4	129.8	-73.4	-25.6	0	0	0	121.9
802	A	26	Very low	27.1	Very low	87 Å²	87	144 Å²	144	72%	0.719	80%	0.803	S	S	*	*			trans	90.6	108.7	156.7	0	0	0	0	0	118.4
803	T	28.2	Very low	27.6	Very low	129 Å²	129	146.1 Å²	146.1	79%	0.791	80%	0.797	S	S	*	*			trans	60.1	94.7	144	37.7	0	0	0	0	118	P805	T803-P805 WeakPolarHBondContact O-CD 3.36Å
804	I	23.1	Very low	28.1	Very low	170 Å²	170	143.6 Å²	143.6	87%	0.872	79%	0.789	S	S	*	*			trans	-60.4	113.5	163.7	-59.4	166.3	0	0	0	109.4
805	P	27	Very low	28.2	Very low	114 Å²	114	146.8 Å²	146.8	74%	0.74	78%	0.784	S	S	*	*			trans	-87.3	138.5	168.3	4.9	15.8	0	0	0	109.9	T803	T803-P805 WeakPolarHBondContact O-CD 3.36Å
806	N	26.7	Very low	28.5	Very low	154 Å²	154	144.7 Å²	144.7	82%	0.824	77%	0.769	S	S	*	*			trans	-37.8	132.3	177.7	-110.4	-31.2	0	0	0	114.4	M808	N806-M808 PolarHBondContact O-N 2.76Å
807	P	27.2	Very low	28.8	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-66.6	122.2	178.9	26.1	-31	0	0	0	110.9
808	M	26.8	Very low	29.2	Very low	186 Å²	186	144.8 Å²	144.8	92%	0.916	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-55.1	134.2	-178.3	-78.4	173.9	110.9	0	0	113	N806	N806-M808 PolarHBondContact O-N 2.76Å
809	K	29	Very low	29.6	Very low	202 Å²	202	141 Å²	141	88%	0.878	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-51.5	131.8	170.4	-74.1	173.4	171.8	175.5	0	112.1	D811	K809-D811 PolarHBondContact O-N 2.96Å
810	F	28.1	Very low	30	Very low	207 Å²	207	144.1 Å²	144.1	91%	0.908	74%	0.742	S	S	*	*			trans	-70.8	106.2	178.4	-152.8	-101.4	0	0	0	110.6	Q812	F810-Q812 PolarHBondContact O-N 2.7Å
811	D	35.8	Very low	30.2	Very low	104 Å²	104	148.4 Å²	148.4	56%	0.556	75%	0.748	S	S	*	*			trans	-80.3	100.2	-179.8	-176.4	6.3	0	0	0	111.9	K809 K813 T814	K809-D811 PolarHBondContact O-N 2.96Å; D811-K813 PolarHBondContact O-N 3.23Å; D811-K813 VanDerWaalsContact O-N 3.09Å; D811-K813 WeakPolarHBondContact OD1-CB 3.36Å; D811-K813 PolarHBondContact OD1-N 2.98Å; D811-K813 VanDerWaalsContact OD1-N 3.16Å; D811-T814 PolarHBondContact O-N 2.91Å; D811-T814 PolarHBondContact O-OG1 3.47Å
812	Q	32.7	Very low	30.3	Very low	149 Å²	149	150.4 Å²	150.4	70%	0.696	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.2	-14.2	-177.8	-155.7	167.7	12.5	0	0	114.1	F810 T814	F810-Q812 PolarHBondContact O-N 2.7Å; Q812-T814 VanDerWaalsContact C-N 3.32Å; Q812-T814 PolarHBondContact O-N 3.45Å
813	K	39.2	Very low	30.3	Very low	157 Å²	157	152.1 Å²	152.1	68%	0.683	75%	0.75	S	S	*	*	H	α-helix	trans	-71	-25	177.6	-74	-178.8	175.2	176.2	0	113.7	D811 S817	D811-K813 PolarHBondContact O-N 3.23Å; D811-K813 VanDerWaalsContact O-N 3.09Å; D811-K813 WeakPolarHBondContact OD1-CB 3.36Å; D811-K813 PolarHBondContact OD1-N 2.98Å; D811-K813 VanDerWaalsContact OD1-N 3.16Å; K813-S817 PolarHBondContact O-OG 3Å
814	T	39.4	Very low	30.2	Very low	94 Å²	94	155 Å²	155	58%	0.577	75%	0.752	S	S	*	*	H	α-helix	trans	-74.2	-29.5	-177.9	-36	0	0	0	0	112.1	D811 Q812	D811-T814 PolarHBondContact O-N 2.91Å; D811-T814 PolarHBondContact O-OG1 3.47Å; Q812-T814 VanDerWaalsContact C-N 3.32Å; Q812-T814 PolarHBondContact O-N 3.45Å
815	W	26.4	Very low	30.5	Very low	186 Å²	186	156.4 Å²	156.4	71%	0.705	75%	0.754	S	S	*	*	H	α-helix	trans	-77.3	-40.2	179.2	-165.4	80.4	0	0	0	112.2	S817 K818	W815-S817 PolarHBondContact O-N 2.84Å; W815-K818 PolarHBondContact O-N 3.49Å; W815-K818 VanDerWaalsContact O-N 3.13Å
816	Q	31.2	Very low	30.4	Very low	132 Å²	132	155 Å²	155	62%	0.617	76%	0.761	S	S	*	*	H	α-helix	trans	-65.9	-23.8	179	-68.3	-170.7	-11.3	0	0	113.5
817	S	36.1	Very low	30.1	Very low	84 Å²	84	153.5 Å²	153.5	59%	0.587	76%	0.761	S	S	*	*	H	α-helix	trans	-77.7	-23.1	176.1	-61.8	0	0	0	0	113.5	K813 W815	K813-S817 PolarHBondContact O-OG 3Å; W815-S817 PolarHBondContact O-N 2.84Å
818	K	32.4	Very low	30.1	Very low	175 Å²	175	153.4 Å²	153.4	76%	0.761	76%	0.76	S	S	*	*	H	α-helix	trans	-80.5	-24	177.2	-86	-177.3	174.9	176.8	0	113.4	W815	W815-K818 PolarHBondContact O-N 3.49Å; W815-K818 VanDerWaalsContact O-N 3.13Å
819	V	33.8	Very low	29.8	Very low	98 Å²	98	156.2 Å²	156.2	59%	0.594	76%	0.76	S	S	*	*	H	α-helix	trans	-82.8	-21.9	179.8	-177.3	0	0	0	0	112.7	R821	V819-R821 PolarHBondContact O-N 2.88Å
820	K	32.2	Very low	29.6	Very low	180 Å²	180	155.4 Å²	155.4	78%	0.783	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	4.9	179.2	-85.8	-175.3	176.4	178.1	0	116.4
821	R	28.2	Very low	29.2	Very low	231 Å²	231	152.8 Å²	152.8	87%	0.872	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	13.7	-179.9	-85.7	-171.1	179.8	159.2	1.5	116.4	V819	V819-R821 PolarHBondContact O-N 2.88Å
822	K	26.9	Very low	28.5	Very low	201 Å²	201	158.4 Å²	158.4	87%	0.874	77%	0.767	S	S	*	*	S	Bend	trans	-117	13.8	175.2	-76.8	-168	175	-176	0	116.2
823	T	26.4	Very low	28	Very low	123 Å²	123	159.4 Å²	159.4	76%	0.755	77%	0.771	S	S	*	*	S	Bend	trans	-115.9	64.8	172.6	42.2	0	0	0	0	111.2
824	K	26.3	Very low	27.1	Very low	191 Å²	191	159.4 Å²	159.4	83%	0.83	78%	0.779	S	S	*	*			trans	-159.7	56.3	169.9	-123.5	-178	-171.4	-174.1	0	113.9
825	H	29.4	Very low	26.4	Very low	198 Å²	198	163 Å²	163	92%	0.917	79%	0.789	S	S	*	*			trans	-137	89.8	157.5	-77.3	-64.8	0	0	0	109.2
826	G	23.5	Very low	26.1	Very low	85 Å²	85	162.3 Å²	162.3	88%	0.876	80%	0.798	S	S	*	*			trans	-71.1	130.3	165.2	0	0	0	0	0	109.3
827	C	21	Very low	25.8	Very low	123 Å²	123	163 Å²	163	83%	0.831	81%	0.805	S	S	*	*			trans	-120.8	131.3	167.1	-158.9	0	0	0	0	107.5
828	P	27.4	Very low	25.2	Very low	115 Å²	115	166.3 Å²	166.3	75%	0.747	82%	0.816	S	S	*	*			trans	-83.5	136.6	-155.1	32	-32.2	0	0	0	112.7	K830	P828-K830 PolarHBondContact O-N 3.43Å
829	R	20.1	Very low	24.8	Very low	245 Å²	245	167.3 Å²	167.3	93%	0.925	82%	0.823	S	S	*	*			trans	-73.5	96.2	177.5	-159.3	178.1	-166.9	172	1.8	109.1
830	K	24.4	Very low	24.3	Very low	185 Å²	185	171.3 Å²	171.3	80%	0.804	84%	0.835	S	S	*	*			trans	-103.1	108.9	164.3	-80.9	-169.8	175.9	-176.2	0	109.5	P828	P828-K830 PolarHBondContact O-N 3.43Å
831	L	20.1	Very low	24	Very low	153 Å²	153	168.2 Å²	168.2	80%	0.801	84%	0.836	S	S	*	*			trans	-57.6	128.4	164.8	-75	144.3	0	0	0	109.1
832	Y	21.9	Very low	23.9	Very low	221 Å²	221	165.2 Å²	165.2	87%	0.867	84%	0.836	S	S	*	*			trans	-126.5	113	156.4	-100.5	-86.2	0	0	0	107.6
833	E	21.7	Very low	23.7	Very low	170 Å²	170	163.4 Å²	163.4	79%	0.794	84%	0.837	S	S	*	*			trans	-69	142	176.7	-75.1	170	132.4	0	0	111.7	Q835	E833-Q835 PolarHBondContact O-N 3.19Å
834	N	21.2	Very low	23.6	Very low	157 Å²	157	167.4 Å²	167.4	84%	0.84	84%	0.843	S	S	*	*			trans	-6	106.9	152.8	-62.1	-27.1	0	0	0	116.4
835	Q	23.6	Very low	23.6	Very low	171 Å²	171	161.5 Å²	161.5	80%	0.799	84%	0.837	S	S	*	*			trans	-119.9	100.7	149.8	-72.4	-172.5	-7.5	0	0	108.6	E833 I837	E833-Q835 PolarHBondContact O-N 3.19Å; Q835-I837 PolarHBondContact O-N 2.87Å
836	L	21.6	Very low	23.3	Very low	171 Å²	171	162.9 Å²	162.9	90%	0.895	84%	0.836	S	S	*	*			trans	-53.9	111.9	159.6	-78.8	135.3	0	0	0	108.6
837	I	23.5	Very low	23.4	Very low	146 Å²	146	167.4 Å²	167.4	75%	0.749	83%	0.833	S	S	*	*			trans	-128	123.2	163.8	-60.1	-178.1	0	0	0	108.6	Q835	Q835-I837 PolarHBondContact O-N 2.87Å
838	N	24.5	Very low	23.8	Very low	154 Å²	154	171 Å²	171	82%	0.824	84%	0.835	S	S	*	*			trans	-43.3	130.4	-170.8	-71.1	-35.6	0	0	0	116.2	E840	N838-E840 PolarHBondContact O-N 2.79Å
839	H	23.6	Very low	23.6	Very low	195 Å²	195	170.6 Å²	170.6	90%	0.903	84%	0.835	S	S	*	*			trans	-64.7	97.2	158.9	-95.2	-100	0	0	0	109.9
840	E	23.4	Very low	23.9	Very low	182 Å²	182	166.2 Å²	166.2	85%	0.85	83%	0.83	S	S	*	*			trans	-173.5	84.3	155.9	-110.5	171.7	-158.2	0	0	109.2	N838	N838-E840 PolarHBondContact O-N 2.79Å
841	S	25.6	Very low	24.1	Very low	115 Å²	115	161.5 Å²	161.5	80%	0.804	82%	0.82	S	S	*	*			trans	166.2	52.9	155.7	45.5	0	0	0	0	113.5
842	L	25.6	Very low	24.4	Very low	168 Å²	168	163.7 Å²	163.7	88%	0.88	82%	0.824	S	S	*	*			trans	-134.9	50.8	163.7	-82.4	171.6	0	0	0	111.3
843	N	24	Very low	24.8	Very low	164 Å²	164	159.8 Å²	159.8	88%	0.877	82%	0.818	S	S	*	*			trans	-100.8	88.5	156.7	-99.2	-16.5	0	0	0	107.7
844	K	24.3	Very low	25.2	Very low	206 Å²	206	162.7 Å²	162.7	90%	0.896	82%	0.821	S	S	*	*	S	Bend	trans	-173.7	113	156.4	-102.9	159.6	-168.8	-174.1	0	110.1
845	G	25.5	Very low	25.8	Very low	67 Å²	67	164.1 Å²	164.1	69%	0.691	83%	0.825	S	S	*	*			trans	83	51.9	147.6	0	0	0	0	0	118.2	H847	G845-H847 PolarHBondContact O-N 2.97Å
846	Y	23.6	Very low	26.6	Very low	228 Å²	228	162.1 Å²	162.1	89%	0.894	82%	0.819	S	S	*	*			trans	-82.6	98.4	157.1	-90.6	-85.5	0	0	0	109.6	K848	Y846-K848 PolarHBondContact O-N 3Å; Y846-K848 VanDerWaalsContact O-N 3.14Å
847	H	25.3	Very low	27.4	Very low	180 Å²	180	158.1 Å²	158.1	83%	0.833	81%	0.81	S	S	*	*			trans	-46.5	114.9	160.9	-80.9	-91.7	0	0	0	109	G845 S849	G845-H847 PolarHBondContact O-N 2.97Å; H847-S849 VanDerWaalsContact C-N 3.33Å; H847-S849 PolarHBondContact O-N 3.18Å
848	K	28.2	Very low	28.2	Very low	198 Å²	198	153.6 Å²	153.6	86%	0.861	79%	0.789	S	S	*	*			trans	-56.6	99.8	166.8	-83.3	177.7	173.5	177.5	0	107.5	Y846 N850	Y846-K848 PolarHBondContact O-N 3Å; Y846-K848 VanDerWaalsContact O-N 3.14Å; K848-N850 PolarHBondContact O-N 3.02Å; K848-N850 VanDerWaalsContact O-N 3.1Å
849	S	24.9	Very low	29.7	Very low	106 Å²	106	147.8 Å²	147.8	74%	0.741	77%	0.766	S	S	*	*			trans	-58.3	113.3	163.7	54.2	0	0	0	0	107	H847 S851	H847-S849 VanDerWaalsContact C-N 3.33Å; H847-S849 PolarHBondContact O-N 3.18Å; S849-S851 PolarHBondContact O-N 3.43Å
850	N	25.3	Very low	31.6	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	76%	0.757	S	S	*	*			trans	-59.7	83.2	170	-76.5	-26.5	0	0	0	108.9	K848 F852	K848-N850 PolarHBondContact O-N 3.02Å; K848-N850 VanDerWaalsContact O-N 3.1Å; N850-F852 PolarHBondContact O-N 2.83Å; N850-F852 VanDerWaalsContact O-N 3.11Å
851	S	28.2	Very low	33.2	Very low	86 Å²	86	140.2 Å²	140.2	60%	0.601	75%	0.748	S	S	*	*			trans	-70.5	104.5	159.3	64	0	0	0	0	105.7	S849 N853	S849-S851 PolarHBondContact O-N 3.43Å; S851-N853 PolarHBondContact O-N 3.28Å
852	F	27.7	Very low	34.5	Very low	200 Å²	200	135.8 Å²	135.8	88%	0.877	72%	0.72	S	S	*	*			trans	-60.5	72.1	172.4	-135.4	-95.7	0	0	0	108.6	N850 R854	N850-F852 PolarHBondContact O-N 2.83Å; N850-F852 VanDerWaalsContact O-N 3.11Å; F852-R854 VanDerWaalsContact C-N 3.3Å; F852-R854 PolarHBondContact O-N 2.91Å
853	N	30.4	Very low	36.1	Very low	139 Å²	139	132.2 Å²	132.2	74%	0.743	70%	0.702	S	S	*	*			trans	-71	98.7	168.4	-88.6	-15.5	0	0	0	105.5	S851 M855	S851-N853 PolarHBondContact O-N 3.28Å; N853-M855 PolarHBondContact O-N 3.44Å
854	R	29.1	Very low	37.4	Very low	231 Å²	231	129 Å²	129	87%	0.872	68%	0.684	S	S	*	*			trans	-53.2	91.2	169.4	-157.8	177.2	-165.1	-176.1	2.9	107.1	F852 I856	F852-R854 VanDerWaalsContact C-N 3.3Å; F852-R854 PolarHBondContact O-N 2.91Å; R854-I856 PolarHBondContact O-N 3.19Å
855	M	33.9	Very low	39.1	Very low	186 Å²	186	123.1 Å²	123.1	92%	0.916	67%	0.674	S	S	*	*			trans	-67.5	99.8	178.8	-138.8	168.7	173.1	0	0	105.6	N853 A857	N853-M855 PolarHBondContact O-N 3.44Å; M855-A857 PolarHBondContact O-N 3.01Å; M855-A857 VanDerWaalsContact O-N 3.14Å
856	I	39.7	Very low	40.1	Very low	130 Å²	130	125.5 Å²	125.5	67%	0.667	67%	0.671	S	S	*	*			trans	-63.1	114.6	173	-62.2	177.8	0	0	0	105.2	R854 T858	R854-I856 PolarHBondContact O-N 3.19Å; I856-T858 VanDerWaalsContact C-N 3.33Å; I856-T858 PolarHBondContact O-N 2.99Å
857	A	39.1	Very low	41.1	Very low	86 Å²	86	118.3 Å²	118.3	71%	0.711	65%	0.647	S	S	*	*			trans	-65.4	94.7	177.7	0	0	0	0	0	108.6	M855	M855-A857 PolarHBondContact O-N 3.01Å; M855-A857 VanDerWaalsContact O-N 3.14Å
858	T	41	Very low	42	Very low	51 Å²	51	113.8 Å²	113.8	31%	0.313	63%	0.629	S	S	.	*			trans	-68.8	131.8	166.9	36.6	0	0	0	0	108.2	I856 D863	I856-T858 VanDerWaalsContact C-N 3.33Å; I856-T858 PolarHBondContact O-N 2.99Å; T858-D863 PolarHBondContact OG1-OD1 2.82Å
859	G	54.5	Low	42.8	Very low	33 Å²	33	113.7 Å²	113.7	34%	0.34	62%	0.624	S	S	.	*			trans	-59.8	173.2	172.1	0	0	0	0	0	111.4	A861 G862 D863	G859-A861 PolarHBondContact O-N 3.39Å; G859-G862 CarbonylContact O-C 3.59Å; G859-G862 WeakPolarHBondContact O-CA 3.31Å; G859-G862 PolarHBondContact O-N 3.14Å; G859-D863 PolarHBondContact O-N 3.27Å
860	I	64.2	Low	43.5	Very low	139 Å²	139	110.7 Å²	110.7	71%	0.713	61%	0.61	S	S	*	*	H	α-helix	trans	-48	-38.3	-175.4	-63.4	170.3	0	0	0	112.9	D863 L864	I860-D863 PolarHBondContact O-N 3.14Å; I860-L864 HydrophobicContact CG2-CD1 3.95Å; I860-L864 HydrophobicContact CG2-CG 4.44Å; I860-L864 VanDerWaalsContact O-CB 3.31Å; I860-L864 WeakPolarHBondContact O-CB 3.39Å; I860-L864 VanDerWaalsContact O-CG 3.26Å; I860-L864 WeakPolarHBondContact O-CG 3.06Å; I860-L864 PolarHBondContact O-N 3.37Å
861	A	57.6	Low	44.6	Very low	79 Å²	79	106.2 Å²	106.2	65%	0.653	60%	0.595	S	S	*	*	H	α-helix	trans	-67.4	-38.8	176.9	0	0	0	0	0	113.3	G859 L864 A865	G859-A861 PolarHBondContact O-N 3.39Å; A861-L864 PolarHBondContact O-N 3.27Å; A861-A865 WeakPolarHBondContact O-CB 3.37Å; A861-A865 PolarHBondContact O-N 3.13Å
862	G	52.7	Low	45.7	Very low	22 Å²	22	110.4 Å²	110.4	23%	0.227	60%	0.602	C	S	.	*	H	α-helix	trans	-76.3	-31.3	175.7	0	0	0	0	0	112.4	G859 A865 N866	G859-G862 CarbonylContact O-C 3.59Å; G859-G862 WeakPolarHBondContact O-CA 3.31Å; G859-G862 PolarHBondContact O-N 3.14Å; G862-A865 PolarHBondContact O-N 2.99Å; G862-N866 VanDerWaalsContact O-CB 3.27Å; G862-N866 WeakPolarHBondContact O-CB 3.21Å; G862-N866 PolarHBondContact O-N 3.44Å; G862-N866 PolarHBondContact O-ND2 3.27Å
863	D	58.7	Low	46.9	Very low	92 Å²	92	107.3 Å²	107.3	49%	0.492	60%	0.595	S	S	.	*	H	α-helix	trans	-64.8	-43	168.4	-79.7	0.7	0	0	0	110.8	T858 G859 I860 N866 I867	T858-D863 PolarHBondContact OG1-OD1 2.82Å; G859-D863 PolarHBondContact O-N 3.27Å; I860-D863 PolarHBondContact O-N 3.14Å; D863-N866 CarbonylContact O-C 3.38Å; D863-N866 PolarHBondContact O-N 2.96Å; D863-I867 WeakPolarHBondContact O-CG1 3.42Å; D863-I867 PolarHBondContact O-N 2.92Å
864	L	52.1	Low	48.3	Very low	98 Å²	98	102.2 Å²	102.2	51%	0.513	57%	0.567	S	S	.	*	H	α-helix	trans	-62.8	-41.4	173.4	-79.3	166.7	0	0	0	112.3	I860 A861 N866 I867	I860-L864 HydrophobicContact CG2-CD1 3.95Å; I860-L864 HydrophobicContact CG2-CG 4.44Å; I860-L864 VanDerWaalsContact O-CB 3.31Å; I860-L864 WeakPolarHBondContact O-CB 3.39Å; I860-L864 VanDerWaalsContact O-CG 3.26Å; I860-L864 WeakPolarHBondContact O-CG 3.06Å; I860-L864 PolarHBondContact O-N 3.37Å; A861-L864 PolarHBondContact O-N 3.27Å; L864-N866 VanDerWaalsContact C-N 3.27Å; L864-N866 PolarHBondContact O-N 3.38Å; L864-I867 HydrophobicContact CD2-CD1 3.78Å; L864-I867 WeakPolarHBondContact O-CB 3.4Å; L864-I867 PolarHBondContact O-N 3.01Å
865	A	59.4	Low	50.5	Low	82 Å²	82	92 Å²	92	68%	0.678	53%	0.531	S	S	*	.	H	α-helix	trans	-67.2	-30.2	175.5	0	0	0	0	0	112.4	A861 G862 I867	A861-A865 WeakPolarHBondContact O-CB 3.37Å; A861-A865 PolarHBondContact O-N 3.13Å; G862-A865 PolarHBondContact O-N 2.99Å; A865-I867 VanDerWaalsContact C-N 3.34Å
866	N	46.4	Very low	52.3	Low	116 Å²	116	90.6 Å²	90.6	62%	0.62	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	4.8	174.6	-75.8	-29.9	0	0	0	113.6	G862 D863 L864 D868	G862-N866 VanDerWaalsContact O-CB 3.27Å; G862-N866 WeakPolarHBondContact O-CB 3.21Å; G862-N866 PolarHBondContact O-N 3.44Å; G862-N866 PolarHBondContact O-ND2 3.27Å; D863-N866 CarbonylContact O-C 3.38Å; D863-N866 PolarHBondContact O-N 2.96Å; L864-N866 VanDerWaalsContact C-N 3.27Å; L864-N866 PolarHBondContact O-N 3.38Å; N866-D868 PolarHBondContact O-N 3.26Å
867	I	45.4	Very low	53.9	Low	77 Å²	77	87 Å²	87	40%	0.395	51%	0.505	S	S	.	.			trans	-66.4	90.1	164.9	-64.6	-175.5	0	0	0	106.6	D863 L864 A865 Y869	D863-I867 WeakPolarHBondContact O-CG1 3.42Å; D863-I867 PolarHBondContact O-N 2.92Å; L864-I867 HydrophobicContact CD2-CD1 3.78Å; L864-I867 WeakPolarHBondContact O-CB 3.4Å; L864-I867 PolarHBondContact O-N 3.01Å; A865-I867 VanDerWaalsContact C-N 3.34Å; I867-Y869 HydrophobicContact CB-CE2 4.39Å; I867-Y869 HydrophobicContact CG2-CD1 4.13Å; I867-Y869 HydrophobicContact CG2-CD2 4.22Å; I867-Y869 HydrophobicContact CG2-CE1 3.97Å; I867-Y869 HydrophobicContact CG2-CE2 4.06Å; I867-Y869 HydrophobicContact CG2-CG 4.26Å; I867-Y869 VanDerWaalsContact O-CD2 3.25Å; I867-Y869 WeakPolarHBondContact O-CD2 3.38Å; I867-Y869 PolarHBondContact O-N 3.43Å
868	D	43.9	Very low	55.6	Low	85 Å²	85	83.9 Å²	83.9	46%	0.455	48%	0.475	S	S	.	.			trans	-61.2	101.2	164.9	-171.5	-11.1	0	0	0	105.8	N866 G870 A871 K872	N866-D868 PolarHBondContact O-N 3.26Å; D868-G870 PolarHBondContact O-N 3.27Å; D868-G870 PolarHBondContact OD1-N 3.27Å; D868-A871 PolarHBondContact OD1-N 2.91Å; D868-K872 IonicContact OD2-NZ 3.55Å
869	Y	44.9	Very low	57	Low	196 Å²	196	84.3 Å²	84.3	77%	0.769	48%	0.478	S	S	*	.			trans	-68.9	41.1	175.8	-74.2	-80.1	0	0	0	112	I867 A871	I867-Y869 HydrophobicContact CB-CE2 4.39Å; I867-Y869 HydrophobicContact CG2-CD1 4.13Å; I867-Y869 HydrophobicContact CG2-CD2 4.22Å; I867-Y869 HydrophobicContact CG2-CE1 3.97Å; I867-Y869 HydrophobicContact CG2-CE2 4.06Å; I867-Y869 HydrophobicContact CG2-CG 4.26Å; I867-Y869 VanDerWaalsContact O-CD2 3.25Å; I867-Y869 WeakPolarHBondContact O-CD2 3.38Å; I867-Y869 PolarHBondContact O-N 3.43Å; Y869-A871 VanDerWaalsContact C-N 3.28Å; Y869-A871 PolarHBondContact O-N 3.44Å
870	G	38.6	Very low	57.8	Low	43 Å²	43	87.9 Å²	87.9	44%	0.443	49%	0.486	S	S	.	.	S	Bend	trans	68.6	21.8	171.1	0	0	0	0	0	114.3	D868 K872 N873	D868-G870 PolarHBondContact O-N 3.27Å; D868-G870 PolarHBondContact OD1-N 3.27Å; G870-K872 PolarHBondContact O-N 2.76Å; G870-K872 VanDerWaalsContact O-N 3.14Å; G870-N873 PolarHBondContact O-N 3.45Å; G870-N873 VanDerWaalsContact O-N 3.14Å
871	A	48.3	Very low	58.1	Low	59 Å²	59	84.5 Å²	84.5	49%	0.488	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-61.4	-23.8	179.3	0	0	0	0	0	111.9	D868 Y869 N873 L874	D868-A871 PolarHBondContact OD1-N 2.91Å; Y869-A871 VanDerWaalsContact C-N 3.28Å; Y869-A871 PolarHBondContact O-N 3.44Å; A871-N873 PolarHBondContact O-N 2.99Å; A871-L874 HydrophobicContact CB-CD1 4.4Å; A871-L874 PolarHBondContact O-N 3.37Å
872	K	51.7	Low	58.7	Low	174 Å²	174	84 Å²	84	76%	0.757	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-65.6	-6.2	176	-74.4	-178.7	-178.2	163.6	0	115.6	D868 G870	D868-K872 IonicContact OD2-NZ 3.55Å; G870-K872 PolarHBondContact O-N 2.76Å; G870-K872 VanDerWaalsContact O-N 3.14Å
873	N	54.5	Low	59.6	Low	135 Å²	135	86.8 Å²	86.8	72%	0.722	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-131.4	22.7	176.1	-75.8	-34.1	0	0	0	114.2	G870 A871	G870-N873 PolarHBondContact O-N 3.45Å; G870-N873 VanDerWaalsContact O-N 3.14Å; A871-N873 PolarHBondContact O-N 2.99Å
874	L	58.2	Low	60.4	Low	32 Å²	32	87.5 Å²	87.5	17%	0.168	46%	0.462	C	S	.	.			trans	-74.8	135.5	170.9	-66	169.2	0	0	0	109.8	K551 A871 H878 E882	K551-L874 HydrophobicContact CD-CD2 3.96Å; A871-L874 HydrophobicContact CB-CD1 4.4Å; A871-L874 PolarHBondContact O-N 3.37Å; L874-H878 HydrophobicContact CB-CB 4.31Å; L874-H878 HydrophobicContact CD2-CB 3.92Å; L874-E882 VanDerWaalsContact CD1-OE1 3.25Å; L874-E882 WeakPolarHBondContact CD1-OE1 3.45Å; L874-E882 WeakPolarHBondContact CD1-OE2 3.22Å
875	C	75.1	Confident	61.4	Low	18 Å²	18	86 Å²	86	12%	0.122	46%	0.46	C	S	.	.			trans	-70.9	165.2	171.4	65.9	0	0	0	0	110.6	S546 C549 C552 Y877 H878 T879	S546-C875 VanDerWaalsContact CB-CB 3.42Å; C549-C875 HydrophobicContact CB-CB 3.79Å; C552-C875 PolarHBondContact SG-SG 2.99Å; C875-Y877 PolarHBondContact O-N 3.25Å; C875-Y877 VanDerWaalsContact O-N 3.13Å; C875-H878 PolarHBondContact O-N 2.82Å; C875-H878 PolarHBondContact SG-N 3.17Å; C875-H878 PolarHBondContact SG-ND1 3.46Å; C875-T879 PolarHBondContact O-N 3.19Å; C875-T879 PolarHBondContact O-OG1 3.26Å
876	L	72.5	Confident	62.2	Low	155 Å²	155	85.6 Å²	85.6	81%	0.812	45%	0.447	S	S	*	.	H	α-helix	trans	-47.4	-42.8	174.5	-98.3	127	0	0	0	112.8	T879 Q880	L876-T879 PolarHBondContact O-N 3.2Å; L876-Q880 PolarHBondContact O-N 2.89Å
877	Y	73	Confident	63.7	Low	55 Å²	55	86 Å²	86	22%	0.216	45%	0.445	C	S	.	.	H	α-helix	trans	-61.5	-46.4	178.9	175.7	-100.1	0	0	0	113.4	Q544 Y545 K555 C875 L881	Q544-Y877 HydrophobicContact CB-CD2 4.1Å; Q544-Y877 WeakPolarHBondContact O-CB 3.05Å; Y545-Y877 HydrophobicContact CD1-CD1 4.46Å; Y545-Y877 HydrophobicContact CD1-CE1 4.43Å; Y545-Y877 HydrophobicContact CE1-CD1 4.4Å; Y545-Y877 AromaticContact CE1-CE1 3.93Å; Y545-Y877 HydrophobicContact CE1-CE1 3.93Å; K555-Y877 PolarHBondContact NZ-OH 3.4Å; C875-Y877 PolarHBondContact O-N 3.25Å; C875-Y877 VanDerWaalsContact O-N 3.13Å; Y877-L881 HydrophobicContact CD1-CD1 4.11Å; Y877-L881 HydrophobicContact CE1-CD1 3.54Å; Y877-L881 HydrophobicContact CE2-CD1 4.48Å; Y877-L881 PolarHBondContact O-N 2.83Å
878	H	75.8	Confident	65.3	Low	20 Å²	20	86.1 Å²	86.1	9%	0.093	44%	0.44	C	S	.	.	H	α-helix	trans	-77.4	-26.7	178.9	-75.6	107	0	0	0	113.2	C549 K551 C552 L874 C875 Q880 L881 E882	C549-H878 PolarHBondContact SG-ND1 2.99Å; C549-H878 VanDerWaalsContact SG-ND1 3.38Å; K551-H878 VanDerWaalsContact C-CE1 3.48Å; K551-H878 WeakPolarHBondContact CB-CE1 3.2Å; K551-H878 WeakPolarHBondContact CB-NE2 3.45Å; C552-H878 PolarHBondContact N-CE1 3.22Å; C552-H878 VanDerWaalsContact N-CE1 3.27Å; C552-H878 PolarHBondContact SG-CE1 2.86Å; C552-H878 PolarHBondContact SG-ND1 3.26Å; L874-H878 HydrophobicContact CB-CB 4.31Å; L874-H878 HydrophobicContact CD2-CB 3.92Å; C875-H878 PolarHBondContact O-N 2.82Å; C875-H878 PolarHBondContact SG-N 3.17Å; C875-H878 PolarHBondContact SG-ND1 3.46Å; H878-Q880 VanDerWaalsContact C-N 3.33Å; H878-L881 PolarHBondContact O-N 3.46Å; H878-E882 PolarHBondContact O-N 3.46Å
879	T	70.3	Confident	67	Low	60 Å²	60	86 Å²	86	37%	0.368	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-43.8	172.1	-51.7	0	0	0	0	110.1	C875 L876 L881 E882 I883	C875-T879 PolarHBondContact O-N 3.19Å; C875-T879 PolarHBondContact O-OG1 3.26Å; L876-T879 PolarHBondContact O-N 3.2Å; T879-L881 PolarHBondContact O-N 3.43Å; T879-E882 PolarHBondContact O-N 3.26Å; T879-I883 HydrophobicContact CG2-CD1 4.24Å; T879-I883 WeakPolarHBondContact O-CG1 3.41Å; T879-I883 PolarHBondContact O-N 3.46Å
880	Q	71	Confident	68.4	Low	108 Å²	108	82 Å²	82	51%	0.505	42%	0.423	S	S	.	.	H	α-helix	trans	-59.9	-45.8	175.6	-159.7	86.1	33.7	0	0	111.8	L876 H878 E882 I883 E884	L876-Q880 PolarHBondContact O-N 2.89Å; H878-Q880 VanDerWaalsContact C-N 3.33Å; Q880-E882 VanDerWaalsContact C-N 3.33Å; Q880-E882 PolarHBondContact O-N 3.34Å; Q880-I883 PolarHBondContact O-N 3.26Å; Q880-E884 WeakPolarHBondContact O-CG 3.32Å; Q880-E884 PolarHBondContact O-N 3.36Å
881	L	70	Confident	70.3	Confident	69 Å²	69	80.9 Å²	80.9	36%	0.361	41%	0.409	S	S	.	.	H	α-helix	trans	-64.7	-34.4	178.8	-71.3	172.7	0	0	0	113.1	Y877 H878 T879 S885	Y877-L881 HydrophobicContact CD1-CD1 4.11Å; Y877-L881 HydrophobicContact CE1-CD1 3.54Å; Y877-L881 HydrophobicContact CE2-CD1 4.48Å; Y877-L881 PolarHBondContact O-N 2.83Å; H878-L881 PolarHBondContact O-N 3.46Å; T879-L881 PolarHBondContact O-N 3.43Å; L881-S885 VanDerWaalsContact O-CB 3.31Å; L881-S885 WeakPolarHBondContact O-CB 3.25Å; L881-S885 PolarHBondContact O-N 2.89Å
882	E	70.5	Confident	71.9	Confident	67 Å²	67	82.9 Å²	82.9	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-70.6	-39	174.3	-90.3	178.7	-163.4	0	0	112	K551 L874 H878 T879 Q880 S885 N886	K551-E882 IonicContact NZ-OE1 3.97Å; K551-E882 PolarHBondContact NZ-OE1 3.16Å; L874-E882 VanDerWaalsContact CD1-OE1 3.25Å; L874-E882 WeakPolarHBondContact CD1-OE1 3.45Å; L874-E882 WeakPolarHBondContact CD1-OE2 3.22Å; H878-E882 PolarHBondContact O-N 3.46Å; T879-E882 PolarHBondContact O-N 3.26Å; Q880-E882 VanDerWaalsContact C-N 3.33Å; Q880-E882 PolarHBondContact O-N 3.34Å; E882-S885 PolarHBondContact O-N 3.43Å; E882-N886 WeakPolarHBondContact O-CB 3.27Å; E882-N886 PolarHBondContact O-N 3.32Å; E882-N886 PolarHBondContact O-ND2 3.25Å
883	I	71.1	Confident	73.1	Confident	81 Å²	81	81 Å²	81	42%	0.415	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-49.8	173.4	-67	165.5	0	0	0	110	T879 Q880 S885 N886 E887	T879-I883 HydrophobicContact CG2-CD1 4.24Å; T879-I883 WeakPolarHBondContact O-CG1 3.41Å; T879-I883 PolarHBondContact O-N 3.46Å; Q880-I883 PolarHBondContact O-N 3.26Å; I883-S885 VanDerWaalsContact C-N 3.31Å; I883-S885 PolarHBondContact O-N 3.44Å; I883-N886 PolarHBondContact O-N 3.01Å; I883-E887 HydrophobicContact CG2-CG 4.46Å; I883-E887 WeakPolarHBondContact O-CB 3.14Å; I883-E887 WeakPolarHBondContact O-CG 3.25Å; I883-E887 PolarHBondContact O-N 2.86Å
884	E	74.9	Confident	74.4	Confident	107 Å²	107	82 Å²	82	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-60.6	-39.1	177.5	-71.6	174.6	-175.7	0	0	112.2	Q880 R888	Q880-E884 WeakPolarHBondContact O-CG 3.32Å; Q880-E884 PolarHBondContact O-N 3.36Å; E884-R888 WeakPolarHBondContact O-CB 3.46Å; E884-R888 PolarHBondContact O-N 2.88Å
885	S	74	Confident	75.3	Confident	67 Å²	67	82.7 Å²	82.7	47%	0.469	41%	0.406	S	S	.	.	H	α-helix	trans	-67.8	-40.3	177	-172.9	0	0	0	0	112.3	L881 E882 I883 M889	L881-S885 VanDerWaalsContact O-CB 3.31Å; L881-S885 WeakPolarHBondContact O-CB 3.25Å; L881-S885 PolarHBondContact O-N 2.89Å; E882-S885 PolarHBondContact O-N 3.43Å; I883-S885 VanDerWaalsContact C-N 3.31Å; I883-S885 PolarHBondContact O-N 3.44Å; S885-M889 PolarHBondContact O-N 2.95Å
886	N	75.6	Confident	75.6	Confident	73 Å²	73	87.6 Å²	87.6	39%	0.39	43%	0.427	S	S	.	.	H	α-helix	trans	-69.8	-42.8	178.3	-71.4	-20	0	0	0	110.8	E882 I883 R888 M889 Y890	E882-N886 WeakPolarHBondContact O-CB 3.27Å; E882-N886 PolarHBondContact O-N 3.32Å; E882-N886 PolarHBondContact O-ND2 3.25Å; I883-N886 PolarHBondContact O-N 3.01Å; N886-R888 VanDerWaalsContact C-N 3.32Å; N886-R888 PolarHBondContact O-N 3.23Å; N886-M889 WeakPolarHBondContact O-CB 3.33Å; N886-M889 PolarHBondContact O-N 2.91Å; N886-M889 VanDerWaalsContact O-N 3.12Å; N886-Y890 HydrophobicContact CB-CD2 4.45Å; N886-Y890 HydrophobicContact CB-CE2 4.06Å; N886-Y890 WeakPolarHBondContact O-CD2 3.41Å; N886-Y890 PolarHBondContact O-N 3.49Å
887	E	77.5	Confident	76.2	Confident	124 Å²	124	82 Å²	82	58%	0.579	40%	0.398	S	S	*	.	H	α-helix	trans	-59.7	-42.6	174.3	-75.9	-177.3	170	0	0	111.9	I883 M889 Y890 A891	I883-E887 HydrophobicContact CG2-CG 4.46Å; I883-E887 WeakPolarHBondContact O-CB 3.14Å; I883-E887 WeakPolarHBondContact O-CG 3.25Å; I883-E887 PolarHBondContact O-N 2.86Å; E887-M889 VanDerWaalsContact C-N 3.33Å; E887-M889 PolarHBondContact O-N 3.15Å; E887-Y890 PolarHBondContact O-N 3.12Å; E887-A891 WeakPolarHBondContact O-CB 3.38Å; E887-A891 PolarHBondContact O-N 3.48Å
888	R	80.2	Confident	76.6	Confident	80 Å²	80	82.6 Å²	82.6	30%	0.302	41%	0.405	S	S	.	.	H	α-helix	trans	-62	-39.4	173.6	-179.6	173.4	165.3	-87.4	-2.7	112.2	E884 N886 A891 W892 D903	E884-R888 WeakPolarHBondContact O-CB 3.46Å; E884-R888 PolarHBondContact O-N 2.88Å; N886-R888 VanDerWaalsContact C-N 3.32Å; N886-R888 PolarHBondContact O-N 3.23Å; R888-A891 PolarHBondContact O-N 3.29Å; R888-W892 PolarHBondContact O-N 3.2Å; R888-W892 VanDerWaalsContact O-N 3.16Å; R888-D903 IonicContact CZ-OD1 3.06Å; R888-D903 IonicContact NE-OD1 3.13Å; R888-D903 PolarHBondContact NE-OD1 3.25Å; R888-D903 IonicContact NE-OD2 2.66Å; R888-D903 IonicContact NH2-OD1 3.66Å; R888-D903 PolarHBondContact NH2-OD1 2.94Å
889	M	78.5	Confident	76.9	Confident	83 Å²	83	89.1 Å²	89.1	41%	0.409	43%	0.429	S	S	.	.	H	α-helix	trans	-64.2	-46.8	175	-176.6	-175.3	79.5	0	0	111.5	S885 N886 E887 A891 W892 E893	S885-M889 PolarHBondContact O-N 2.95Å; N886-M889 WeakPolarHBondContact O-CB 3.33Å; N886-M889 PolarHBondContact O-N 2.91Å; N886-M889 VanDerWaalsContact O-N 3.12Å; E887-M889 VanDerWaalsContact C-N 3.33Å; E887-M889 PolarHBondContact O-N 3.15Å; M889-A891 VanDerWaalsContact C-N 3.28Å; M889-A891 PolarHBondContact O-N 3.09Å; M889-W892 WeakPolarHBondContact O-CA 3.41Å; M889-W892 WeakPolarHBondContact O-CB 3.26Å; M889-W892 PolarHBondContact O-N 3.29Å; M889-E893 PolarHBondContact O-N 3.2Å
890	Y	75.6	Confident	77.2	Confident	113 Å²	113	92.3 Å²	92.3	44%	0.443	45%	0.449	S	S	.	.	H	α-helix	trans	-64.5	-32.7	177	-66	-55.1	0	0	0	112.5	N886 E887 W892 E893 R894	N886-Y890 HydrophobicContact CB-CD2 4.45Å; N886-Y890 HydrophobicContact CB-CE2 4.06Å; N886-Y890 WeakPolarHBondContact O-CD2 3.41Å; N886-Y890 PolarHBondContact O-N 3.49Å; E887-Y890 PolarHBondContact O-N 3.12Å; Y890-W892 VanDerWaalsContact C-N 3.31Å; Y890-E893 WeakPolarHBondContact CD1-OE2 3.31Å; Y890-E893 PolarHBondContact O-N 2.97Å; Y890-R894 WeakPolarHBondContact O-CG 3.12Å; Y890-R894 PolarHBondContact O-N 3.43Å; Y890-R894 VanDerWaalsContact O-N 3.08Å
891	A	77.4	Confident	77.9	Confident	18 Å²	18	88.6 Å²	88.6	15%	0.149	44%	0.44	C	S	.	.	H	α-helix	trans	-63.2	-38.5	172.1	0	0	0	0	0	111.5	E887 R888 M889 R894 G895 E896	E887-A891 WeakPolarHBondContact O-CB 3.38Å; E887-A891 PolarHBondContact O-N 3.48Å; R888-A891 PolarHBondContact O-N 3.29Å; M889-A891 VanDerWaalsContact C-N 3.28Å; M889-A891 PolarHBondContact O-N 3.09Å; A891-R894 PolarHBondContact O-N 3.13Å; A891-G895 PolarHBondContact O-N 2.89Å; A891-E896 HydrophobicContact CB-CB 4.36Å; A891-E896 CarbonylContact O-C 3.48Å; A891-E896 WeakPolarHBondContact O-CA 3.39Å; A891-E896 PolarHBondContact O-N 2.81Å
892	W	83	Confident	78.2	Confident	101 Å²	101	90.3 Å²	90.3	38%	0.383	45%	0.448	S	S	.	.	H	α-helix	trans	-64.3	-44.2	173.1	-78.6	41	0	0	0	112.3	R888 M889 Y890 R894 G895 I897 D903 I908	R888-W892 PolarHBondContact O-N 3.2Å; R888-W892 VanDerWaalsContact O-N 3.16Å; M889-W892 WeakPolarHBondContact O-CA 3.41Å; M889-W892 WeakPolarHBondContact O-CB 3.26Å; M889-W892 PolarHBondContact O-N 3.29Å; Y890-W892 VanDerWaalsContact C-N 3.31Å; W892-R894 PolarHBondContact O-N 3.26Å; W892-G895 PolarHBondContact O-N 3.3Å; W892-I897 HydrophobicContact CB-CG1 4.33Å; W892-I897 HydrophobicContact CD2-CD1 4.49Å; W892-I897 HydrophobicContact CD2-CG1 4.35Å; W892-I897 HydrophobicContact CG-CD1 4.47Å; W892-I897 HydrophobicContact CG-CG1 3.97Å; W892-D903 HydrophobicContact CZ2-CB 4.04Å; W892-D903 PolarHBondContact NE1-OD2 3.01Å; W892-I908 HydrophobicContact CH2-CD1 3.74Å; W892-I908 HydrophobicContact CH2-CG1 4.4Å; W892-I908 HydrophobicContact CZ2-CD1 3.84Å; W892-I908 HydrophobicContact CZ2-CG1 4.49Å
893	E	75.9	Confident	78.9	Confident	134 Å²	134	87.3 Å²	87.3	63%	0.626	43%	0.434	S	S	*	.	H	α-helix	trans	-63.1	-31.3	179.4	-69.7	176.9	171.6	0	0	112.6	M889 Y890	M889-E893 PolarHBondContact O-N 3.2Å; Y890-E893 WeakPolarHBondContact CD1-OE2 3.31Å; Y890-E893 PolarHBondContact O-N 2.97Å
894	R	81.9	Confident	79.6	Confident	157 Å²	157	88.5 Å²	88.5	59%	0.592	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.1	174.9	-64.4	-169.8	-55.6	-93.4	-2.9	114.4	Y890 A891 W892 E896	Y890-R894 WeakPolarHBondContact O-CG 3.12Å; Y890-R894 PolarHBondContact O-N 3.43Å; Y890-R894 VanDerWaalsContact O-N 3.08Å; A891-R894 PolarHBondContact O-N 3.13Å; W892-R894 PolarHBondContact O-N 3.26Å; R894-E896 VanDerWaalsContact C-N 3.31Å; R894-E896 HydrophobicContact CB-CG 4.29Å; R894-E896 IonicContact CZ-OE2 2.91Å; R894-E896 IonicContact NE-OE2 3.89Å; R894-E896 PolarHBondContact NE-OE2 2.96Å; R894-E896 IonicContact NH2-OE2 3.99Å; R894-E896 PolarHBondContact NH2-OE2 3.38Å
895	G	76.6	Confident	79.9	Confident	47 Å²	47	90.9 Å²	90.9	49%	0.485	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	11.6	-175.8	0	0	0	0	0	115.1	A891 W892 I897	A891-G895 PolarHBondContact O-N 2.89Å; W892-G895 PolarHBondContact O-N 3.3Å; G895-I897 PolarHBondContact O-N 3.16Å
896	E	82.9	Confident	80.4	Confident	120 Å²	120	90 Å²	90	56%	0.561	43%	0.432	S	S	*	.			trans	-88.1	48	177.2	-61.5	177.3	145.1	0	0	111.3	A891 R894	A891-E896 HydrophobicContact CB-CB 4.36Å; A891-E896 CarbonylContact O-C 3.48Å; A891-E896 WeakPolarHBondContact O-CA 3.39Å; A891-E896 PolarHBondContact O-N 2.81Å; R894-E896 VanDerWaalsContact C-N 3.31Å; R894-E896 HydrophobicContact CB-CG 4.29Å; R894-E896 IonicContact CZ-OE2 2.91Å; R894-E896 IonicContact NE-OE2 3.89Å; R894-E896 PolarHBondContact NE-OE2 2.96Å; R894-E896 IonicContact NH2-OE2 3.99Å; R894-E896 PolarHBondContact NH2-OE2 3.38Å
897	I	83.8	Confident	80.9	Confident	38 Å²	38	88.8 Å²	88.8	20%	0.195	43%	0.425	C	S	.	.			trans	-73.5	132.3	-174.3	-60.6	166	0	0	0	110	W892 G895 Y899 D903	W892-I897 HydrophobicContact CB-CG1 4.33Å; W892-I897 HydrophobicContact CD2-CD1 4.49Å; W892-I897 HydrophobicContact CD2-CG1 4.35Å; W892-I897 HydrophobicContact CG-CD1 4.47Å; W892-I897 HydrophobicContact CG-CG1 3.97Å; G895-I897 PolarHBondContact O-N 3.16Å; I897-Y899 VanDerWaalsContact C-N 3.26Å; I897-Y899 HydrophobicContact CB-CD1 4.41Å; I897-Y899 HydrophobicContact CB-CD2 4.27Å; I897-Y899 HydrophobicContact CB-CE1 3.96Å; I897-Y899 HydrophobicContact CB-CE2 3.81Å; I897-Y899 HydrophobicContact CD1-CE1 4.32Å; I897-Y899 HydrophobicContact CG2-CD1 3.95Å; I897-Y899 HydrophobicContact CG2-CE1 3.8Å; I897-Y899 HydrophobicContact CG2-CE2 4.39Å; I897-Y899 HydrophobicContact CG2-CG 4.32Å; I897-Y899 WeakPolarHBondContact O-CD2 3.35Å; I897-Y899 PolarHBondContact O-N 3.17Å; I897-D903 HydrophobicContact CG2-CB 3.51Å
898	D	83	Confident	81.2	Confident	67 Å²	67	85.2 Å²	85.2	36%	0.358	41%	0.41	S	S	.	.			trans	-77.5	74.4	175.2	174.9	23.7	0	0	0	111.6	T900 G901 I902 D903 R904	D898-T900 PolarHBondContact O-N 3.17Å; D898-T900 PolarHBondContact OD1-N 3.31Å; D898-T900 PolarHBondContact OD1-OG1 3.32Å; D898-G901 VanDerWaalsContact CG-N 3.35Å; D898-G901 PolarHBondContact O-N 3.49Å; D898-G901 PolarHBondContact OD1-N 3.35Å; D898-G901 WeakPolarHBondContact OD2-CA 3.28Å; D898-G901 PolarHBondContact OD2-N 2.86Å; D898-I902 PolarHBondContact OD2-N 3.08Å; D898-D903 CarbonylContact O-C 3.59Å; D898-D903 WeakPolarHBondContact O-CA 3.45Å; D898-D903 VanDerWaalsContact O-CB 3.29Å; D898-D903 WeakPolarHBondContact O-CB 3.47Å; D898-D903 PolarHBondContact O-N 3.44Å; D898-D903 VanDerWaalsContact O-N 3.15Å; D898-R904 PolarHBondContact O-N 2.79Å
899	Y	80.9	Confident	81.4	Confident	157 Å²	157	82.6 Å²	82.6	62%	0.616	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.6	-179.3	-62.1	-73.7	0	0	0	114.3	I897 R904	I897-Y899 VanDerWaalsContact C-N 3.26Å; I897-Y899 HydrophobicContact CB-CD1 4.41Å; I897-Y899 HydrophobicContact CB-CD2 4.27Å; I897-Y899 HydrophobicContact CB-CE1 3.96Å; I897-Y899 HydrophobicContact CB-CE2 3.81Å; I897-Y899 HydrophobicContact CD1-CE1 4.32Å; I897-Y899 HydrophobicContact CG2-CD1 3.95Å; I897-Y899 HydrophobicContact CG2-CE1 3.8Å; I897-Y899 HydrophobicContact CG2-CE2 4.39Å; I897-Y899 HydrophobicContact CG2-CG 4.32Å; I897-Y899 WeakPolarHBondContact O-CD2 3.35Å; I897-Y899 PolarHBondContact O-N 3.17Å; Y899-R904 VanDerWaalsContact O-CA 3.26Å; Y899-R904 WeakPolarHBondContact O-CA 3.35Å; Y899-R904 WeakPolarHBondContact O-CB 3.44Å
900	T	77.6	Confident	81.7	Confident	128 Å²	128	82.3 Å²	82.3	79%	0.785	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-25.5	-177.1	63.3	0	0	0	0	114	D898	D898-T900 PolarHBondContact O-N 3.17Å; D898-T900 PolarHBondContact OD1-N 3.31Å; D898-T900 PolarHBondContact OD1-OG1 3.32Å
901	G	84.6	Confident	82.1	Confident	29 Å²	29	82.8 Å²	82.8	30%	0.299	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	-109.6	-177.4	0	0	0	0	0	112.6	D898 D903 R904 N907	D898-G901 VanDerWaalsContact CG-N 3.35Å; D898-G901 PolarHBondContact O-N 3.49Å; D898-G901 PolarHBondContact OD1-N 3.35Å; D898-G901 WeakPolarHBondContact OD2-CA 3.28Å; D898-G901 PolarHBondContact OD2-N 2.86Å; G901-D903 VanDerWaalsContact C-N 3.31Å; G901-D903 PolarHBondContact O-N 3.04Å; G901-R904 WeakPolarHBondContact O-CD 3.44Å; G901-R904 WeakPolarHBondContact O-CG 3.49Å; G901-R904 PolarHBondContact O-N 2.9Å; G901-N907 PolarHBondContact O-ND2 2.97Å
902	I	77.6	Confident	82.4	Confident	105 Å²	105	86.2 Å²	86.2	54%	0.538	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-34	-169.9	-65.7	176.3	0	0	0	111	D898 N907	D898-I902 PolarHBondContact OD2-N 3.08Å; I902-N907 WeakPolarHBondContact O-CB 3.31Å; I902-N907 PolarHBondContact O-ND2 3.24Å
903	D	84.2	Confident	82.4	Confident	5 Å²	5	82.3 Å²	82.3	3%	0.027	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	13.6	-176	-56.1	-36.8	0	0	0	113.7	R888 W892 I897 D898 G901 F905 I908	R888-D903 IonicContact CZ-OD1 3.06Å; R888-D903 IonicContact NE-OD1 3.13Å; R888-D903 PolarHBondContact NE-OD1 3.25Å; R888-D903 IonicContact NE-OD2 2.66Å; R888-D903 IonicContact NH2-OD1 3.66Å; R888-D903 PolarHBondContact NH2-OD1 2.94Å; W892-D903 HydrophobicContact CZ2-CB 4.04Å; W892-D903 PolarHBondContact NE1-OD2 3.01Å; I897-D903 HydrophobicContact CG2-CB 3.51Å; D898-D903 CarbonylContact O-C 3.59Å; D898-D903 WeakPolarHBondContact O-CA 3.45Å; D898-D903 VanDerWaalsContact O-CB 3.29Å; D898-D903 WeakPolarHBondContact O-CB 3.47Å; D898-D903 PolarHBondContact O-N 3.44Å; D898-D903 VanDerWaalsContact O-N 3.15Å; G901-D903 VanDerWaalsContact C-N 3.31Å; G901-D903 PolarHBondContact O-N 3.04Å; D903-F905 PolarHBondContact O-N 3.49Å; D903-I908 HydrophobicContact CB-CD1 4.45Å; D903-I908 WeakPolarHBondContact O-CD1 3.38Å
904	R	85.2	Confident	82.8	Confident	106 Å²	106	80.6 Å²	80.6	40%	0.4	40%	0.404	S	S	.	.			trans	-53.6	139.9	168.8	70.3	-176.9	-163.7	150.8	14.2	110.4	D898 Y899 G901 I906 N907 I908	D898-R904 PolarHBondContact O-N 2.79Å; Y899-R904 VanDerWaalsContact O-CA 3.26Å; Y899-R904 WeakPolarHBondContact O-CA 3.35Å; Y899-R904 WeakPolarHBondContact O-CB 3.44Å; G901-R904 WeakPolarHBondContact O-CD 3.44Å; G901-R904 WeakPolarHBondContact O-CG 3.49Å; G901-R904 PolarHBondContact O-N 2.9Å; R904-I906 HydrophobicContact CB-CG2 4.4Å; R904-I906 HydrophobicContact CG-CG2 3.6Å; R904-I906 PolarHBondContact O-N 2.72Å; R904-I906 VanDerWaalsContact O-N 3.09Å; R904-N907 HydrophobicContact CG-CB 3.85Å; R904-N907 VanDerWaalsContact CG-CG 3.46Å; R904-N907 WeakPolarHBondContact CG-ND2 3.2Å; R904-N907 VanDerWaalsContact CZ-OD1 3.31Å; R904-N907 PolarHBondContact NE-ND2 3.39Å; R904-N907 PolarHBondContact NE-OD1 3.32Å; R904-N907 PolarHBondContact NH2-OD1 3.49Å; R904-N907 WeakPolarHBondContact O-CB 3.27Å; R904-N907 PolarHBondContact O-N 2.78Å; R904-I908 PolarHBondContact O-N 3.22Å
905	F	81.7	Confident	82.9	Confident	157 Å²	157	76.7 Å²	76.7	69%	0.689	40%	0.397	S	S	*	.	H	α-helix	trans	-49.5	-43.8	-176.1	-179.6	-101.5	0	0	0	112.9	D903 N907 I908 L909	D903-F905 PolarHBondContact O-N 3.49Å; F905-N907 VanDerWaalsContact C-N 3.29Å; F905-N907 PolarHBondContact O-N 3.23Å; F905-I908 PolarHBondContact O-N 2.83Å; F905-L909 HydrophobicContact CE1-CD2 4.07Å; F905-L909 WeakPolarHBondContact O-CB 3.49Å; F905-L909 PolarHBondContact O-N 3.28Å
906	I	84.3	Confident	83.2	Confident	47 Å²	47	77.1 Å²	77.1	24%	0.241	39%	0.388	C	S	.	.	H	α-helix	trans	-62	-31.9	179.7	-173.1	61.4	0	0	0	113.4	R904 N910 M932	R904-I906 HydrophobicContact CB-CG2 4.4Å; R904-I906 HydrophobicContact CG-CG2 3.6Å; R904-I906 PolarHBondContact O-N 2.72Å; R904-I906 VanDerWaalsContact O-N 3.09Å; I906-N910 VanDerWaalsContact O-CB 3.31Å; I906-N910 WeakPolarHBondContact O-CB 3.34Å; I906-N910 PolarHBondContact O-N 3.3Å; I906-N910 PolarHBondContact O-ND2 3.17Å; I906-M932 HydrophobicContact CD1-CE 3.42Å; I906-M932 VanDerWaalsContact CD1-CE 3.42Å
907	N	86.1	Confident	83.3	Confident	48 Å²	48	77.9 Å²	77.9	26%	0.257	39%	0.386	S	S	.	.	H	α-helix	trans	-74.1	-41	176	-75.4	-7.8	0	0	0	111.5	G901 I902 R904 F905 N910 K911	G901-N907 PolarHBondContact O-ND2 2.97Å; I902-N907 WeakPolarHBondContact O-CB 3.31Å; I902-N907 PolarHBondContact O-ND2 3.24Å; R904-N907 HydrophobicContact CG-CB 3.85Å; R904-N907 VanDerWaalsContact CG-CG 3.46Å; R904-N907 WeakPolarHBondContact CG-ND2 3.2Å; R904-N907 VanDerWaalsContact CZ-OD1 3.31Å; R904-N907 PolarHBondContact NE-ND2 3.39Å; R904-N907 PolarHBondContact NE-OD1 3.32Å; R904-N907 PolarHBondContact NH2-OD1 3.49Å; R904-N907 WeakPolarHBondContact O-CB 3.27Å; R904-N907 PolarHBondContact O-N 2.78Å; F905-N907 VanDerWaalsContact C-N 3.29Å; F905-N907 PolarHBondContact O-N 3.23Å; N907-N910 PolarHBondContact O-N 3.29Å; N907-K911 PolarHBondContact O-N 3.19Å
908	I	84.3	Confident	83.2	Confident	49 Å²	49	82.3 Å²	82.3	25%	0.251	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-47.8	176.6	-61.8	171.5	0	0	0	109.2	W892 D903 R904 F905 N910 K911 L912	W892-I908 HydrophobicContact CH2-CD1 3.74Å; W892-I908 HydrophobicContact CH2-CG1 4.4Å; W892-I908 HydrophobicContact CZ2-CD1 3.84Å; W892-I908 HydrophobicContact CZ2-CG1 4.49Å; D903-I908 HydrophobicContact CB-CD1 4.45Å; D903-I908 WeakPolarHBondContact O-CD1 3.38Å; R904-I908 PolarHBondContact O-N 3.22Å; F905-I908 PolarHBondContact O-N 2.83Å; I908-N910 PolarHBondContact O-N 3.35Å; I908-K911 PolarHBondContact O-N 3.44Å; I908-L912 HydrophobicContact CG2-CD1 4.09Å; I908-L912 WeakPolarHBondContact O-CG 3.36Å; I908-L912 PolarHBondContact O-N 3Å
909	L	84.3	Confident	83.1	Confident	26 Å²	26	85.4 Å²	85.4	14%	0.136	43%	0.425	C	S	.	.	H	α-helix	trans	-58	-47.4	176.3	-174.1	62.3	0	0	0	111.3	F905 K911 L912 C913 T929	F905-L909 HydrophobicContact CE1-CD2 4.07Å; F905-L909 WeakPolarHBondContact O-CB 3.49Å; F905-L909 PolarHBondContact O-N 3.28Å; L909-K911 VanDerWaalsContact C-N 3.34Å; L909-K911 PolarHBondContact O-N 3.47Å; L909-L912 PolarHBondContact O-N 3.34Å; L909-L912 VanDerWaalsContact O-N 3.17Å; L909-C913 WeakPolarHBondContact O-CB 3.16Å; L909-C913 PolarHBondContact O-N 3.45Å; L909-C913 PolarHBondContact O-SG 2.9Å; L909-T929 HydrophobicContact CD1-CG2 4.27Å
910	N	84.8	Confident	83	Confident	77 Å²	77	79.5 Å²	79.5	41%	0.412	41%	0.412	S	S	.	.	H	α-helix	trans	-59.8	-41.4	177.3	-76	-18.4	0	0	0	112.6	I906 N907 I908 C913 I914	I906-N910 VanDerWaalsContact O-CB 3.31Å; I906-N910 WeakPolarHBondContact O-CB 3.34Å; I906-N910 PolarHBondContact O-N 3.3Å; I906-N910 PolarHBondContact O-ND2 3.17Å; N907-N910 PolarHBondContact O-N 3.29Å; I908-N910 PolarHBondContact O-N 3.35Å; N910-C913 PolarHBondContact O-N 3.4Å; N910-I914 VanDerWaalsContact O-CG1 3.28Å; N910-I914 WeakPolarHBondContact O-CG1 3.4Å; N910-I914 PolarHBondContact O-N 3.22Å
911	K	83.5	Confident	83.2	Confident	123 Å²	123	74.9 Å²	74.9	54%	0.535	39%	0.39	S	S	.	.	H	α-helix	trans	-64.4	-42	174.9	-81.6	-177.5	177.5	177.1	0	112.1	N907 I908 L909 I914 T915	N907-K911 PolarHBondContact O-N 3.19Å; I908-K911 PolarHBondContact O-N 3.44Å; L909-K911 VanDerWaalsContact C-N 3.34Å; L909-K911 PolarHBondContact O-N 3.47Å; K911-I914 PolarHBondContact O-N 3.41Å; K911-T915 WeakPolarHBondContact O-CB 3.43Å; K911-T915 PolarHBondContact O-N 3.42Å; K911-T915 PolarHBondContact O-OG1 3.07Å
912	L	84	Confident	82.9	Confident	90 Å²	90	78.5 Å²	78.5	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-47.7	175.7	-72.7	171	0	0	0	110.7	I908 L909 I914 T915 L916	I908-L912 HydrophobicContact CG2-CD1 4.09Å; I908-L912 WeakPolarHBondContact O-CG 3.36Å; I908-L912 PolarHBondContact O-N 3Å; L909-L912 PolarHBondContact O-N 3.34Å; L909-L912 VanDerWaalsContact O-N 3.17Å; L912-I914 PolarHBondContact O-N 3.18Å; L912-T915 PolarHBondContact O-N 3.37Å; L912-T915 VanDerWaalsContact O-N 3.12Å; L912-L916 WeakPolarHBondContact O-CB 3.45Å; L912-L916 VanDerWaalsContact O-CG 3.27Å; L912-L916 WeakPolarHBondContact O-CG 3.39Å; L912-L916 PolarHBondContact O-N 3.2Å
913	C	84.6	Confident	83	Confident	19 Å²	19	79.5 Å²	79.5	13%	0.128	41%	0.413	C	S	.	.	H	α-helix	trans	-58.9	-43.7	177.3	-68.9	0	0	0	0	112.4	L909 N910 T915 R917 L925	L909-C913 WeakPolarHBondContact O-CB 3.16Å; L909-C913 PolarHBondContact O-N 3.45Å; L909-C913 PolarHBondContact O-SG 2.9Å; N910-C913 PolarHBondContact O-N 3.4Å; C913-T915 VanDerWaalsContact C-N 3.34Å; C913-T915 PolarHBondContact O-N 3.42Å; C913-R917 WeakPolarHBondContact O-CB 3.41Å; C913-R917 PolarHBondContact O-N 3.46Å; C913-L925 HydrophobicContact CB-CD2 3.6Å
914	I	83.1	Confident	82.8	Confident	98 Å²	98	82.7 Å²	82.7	50%	0.503	43%	0.431	S	S	.	.	H	α-helix	trans	-61.3	-44.8	175.1	-69.8	164.6	0	0	0	110.7	N910 K911 L912 R917 N918	N910-I914 VanDerWaalsContact O-CG1 3.28Å; N910-I914 WeakPolarHBondContact O-CG1 3.4Å; N910-I914 PolarHBondContact O-N 3.22Å; K911-I914 PolarHBondContact O-N 3.41Å; L912-I914 PolarHBondContact O-N 3.18Å; I914-R917 PolarHBondContact O-N 2.86Å; I914-N918 WeakPolarHBondContact O-CB 3.27Å; I914-N918 PolarHBondContact O-N 2.76Å; I914-N918 PolarHBondContact O-ND2 3.13Å
915	T	83.9	Confident	82.5	Confident	75 Å²	75	79.5 Å²	79.5	46%	0.46	42%	0.421	S	S	.	.	H	α-helix	trans	-65.1	-45.6	-178.6	-54.4	0	0	0	0	111.1	K911 L912 C913 N918 I919	K911-T915 WeakPolarHBondContact O-CB 3.43Å; K911-T915 PolarHBondContact O-N 3.42Å; K911-T915 PolarHBondContact O-OG1 3.07Å; L912-T915 PolarHBondContact O-N 3.37Å; L912-T915 VanDerWaalsContact O-N 3.12Å; C913-T915 VanDerWaalsContact C-N 3.34Å; C913-T915 PolarHBondContact O-N 3.42Å; T915-N918 PolarHBondContact O-N 3.26Å; T915-I919 HydrophobicContact CG2-CD1 4.05Å; T915-I919 WeakPolarHBondContact O-CG1 3.44Å; T915-I919 PolarHBondContact O-N 3.26Å; T915-I919 VanDerWaalsContact O-N 3.13Å
916	L	83.7	Confident	82	Confident	56 Å²	56	74.4 Å²	74.4	29%	0.293	40%	0.404	S	S	.	.	H	α-helix	trans	-64.9	-42.1	178.3	-70.5	167.3	0	0	0	111.8	L912 N918 I919 G920 N924 P926	L912-L916 WeakPolarHBondContact O-CB 3.45Å; L912-L916 VanDerWaalsContact O-CG 3.27Å; L912-L916 WeakPolarHBondContact O-CG 3.39Å; L912-L916 PolarHBondContact O-N 3.2Å; L916-N918 VanDerWaalsContact C-N 3.31Å; L916-N918 PolarHBondContact O-N 3.24Å; L916-I919 PolarHBondContact O-N 3.09Å; L916-G920 PolarHBondContact O-N 3.48Å; L916-N924 HydrophobicContact CB-CB 4.21Å; L916-N924 WeakPolarHBondContact CD1-O 3.33Å; L916-P926 HydrophobicContact CD1-CG 4.04Å
917	R	83.7	Confident	81.4	Confident	136 Å²	136	80.8 Å²	80.8	51%	0.513	44%	0.437	S	S	.	.	H	α-helix	trans	-63.4	-35.9	175	-173.3	179.8	-90	164.8	-7.1	112.1	C913 I914 G921 D922	C913-R917 WeakPolarHBondContact O-CB 3.41Å; C913-R917 PolarHBondContact O-N 3.46Å; I914-R917 PolarHBondContact O-N 2.86Å; R917-G921 VanDerWaalsContact O-CA 3.26Å; R917-G921 WeakPolarHBondContact O-CA 3.48Å; R917-G921 PolarHBondContact O-N 3.18Å; R917-D922 IonicContact CZ-OD1 3.16Å; R917-D922 IonicContact NE-OD1 3.94Å; R917-D922 PolarHBondContact NE-OD1 3.3Å; R917-D922 IonicContact NH2-OD1 2.78Å; R917-D922 PolarHBondContact NH2-OD1 3.49Å
918	N	82.9	Confident	80.5	Confident	131 Å²	131	79.8 Å²	79.8	70%	0.701	44%	0.438	S	S	*	.	H	α-helix	trans	-70.2	-30.8	175.7	-71.5	-19.8	0	0	0	113.1	I914 T915 L916	I914-N918 WeakPolarHBondContact O-CB 3.27Å; I914-N918 PolarHBondContact O-N 2.76Å; I914-N918 PolarHBondContact O-ND2 3.13Å; T915-N918 PolarHBondContact O-N 3.26Å; L916-N918 VanDerWaalsContact C-N 3.31Å; L916-N918 PolarHBondContact O-N 3.24Å
919	I	80.6	Confident	79.5	Confident	131 Å²	131	78.9 Å²	78.9	67%	0.672	44%	0.435	S	S	*	.	H	α-helix	trans	-83.4	-37	-178.2	-66.4	167.3	0	0	0	111.8	T915 L916	T915-I919 HydrophobicContact CG2-CD1 4.05Å; T915-I919 WeakPolarHBondContact O-CG1 3.44Å; T915-I919 PolarHBondContact O-N 3.26Å; T915-I919 VanDerWaalsContact O-N 3.13Å; L916-I919 PolarHBondContact O-N 3.09Å
920	G	78.9	Confident	78.4	Confident	34 Å²	34	83.4 Å²	83.4	35%	0.351	46%	0.459	S	S	.	.	H	α-helix	trans	-148.7	16	-174.1	0	0	0	0	0	116.6	L916 T923 N924	L916-G920 PolarHBondContact O-N 3.48Å; G920-T923 PolarHBondContact O-OG1 2.96Å; G920-N924 WeakPolarHBondContact CA-ND2 3.35Å
921	G	80.8	Confident	76.9	Confident	30 Å²	30	85.5 Å²	85.5	31%	0.309	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	72.6	-163.5	-179.1	0	0	0	0	0	113.5	R917 T923 N924	R917-G921 VanDerWaalsContact O-CA 3.26Å; R917-G921 WeakPolarHBondContact O-CA 3.48Å; R917-G921 PolarHBondContact O-N 3.18Å; G921-T923 PolarHBondContact O-N 3.49Å; G921-N924 PolarHBondContact O-N 3.11Å
922	D	78.7	Confident	75.4	Confident	105 Å²	105	84.9 Å²	84.9	56%	0.561	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-66.5	-20.1	-172.9	-69	-40.7	0	0	0	114	R917 N924 L925	R917-D922 IonicContact CZ-OD1 3.16Å; R917-D922 IonicContact NE-OD1 3.94Å; R917-D922 PolarHBondContact NE-OD1 3.3Å; R917-D922 IonicContact NH2-OD1 2.78Å; R917-D922 PolarHBondContact NH2-OD1 3.49Å; D922-N924 PolarHBondContact O-N 3.42Å; D922-L925 HydrophobicContact CB-CD1 4.28Å; D922-L925 PolarHBondContact O-N 3.19Å
923	T	79.8	Confident	73.6	Confident	126 Å²	126	88 Å²	88	77%	0.773	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-70.3	-18.2	179.1	54.3	0	0	0	0	113.6	G920 G921	G920-T923 PolarHBondContact O-OG1 2.96Å; G921-T923 PolarHBondContact O-N 3.49Å
924	N	80.1	Confident	71.2	Confident	73 Å²	73	98.7 Å²	98.7	39%	0.39	54%	0.535	S	S	.	.	G	3₁₀ helix	trans	-92.3	1.5	178.5	-79.3	5.7	0	0	0	113.2	L916 G920 G921 D922	L916-N924 HydrophobicContact CB-CB 4.21Å; L916-N924 WeakPolarHBondContact CD1-O 3.33Å; G920-N924 WeakPolarHBondContact CA-ND2 3.35Å; G921-N924 PolarHBondContact O-N 3.11Å; D922-N924 PolarHBondContact O-N 3.42Å
925	L	78	Confident	70.6	Confident	38 Å²	38	98.8 Å²	98.8	20%	0.199	54%	0.536	C	S	.	.	S	Bend	trans	-70.4	143	179	-69.7	169.8	0	0	0	110.7	C913 D922	C913-L925 HydrophobicContact CB-CD2 3.6Å; D922-L925 HydrophobicContact CB-CD1 4.28Å; D922-L925 PolarHBondContact O-N 3.19Å
926	P	72.3	Confident	69.9	Low	50 Å²	50	100 Å²	100	33%	0.325	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-58	139.2	174.2	-18.9	28.9	0	0	0	111.4	L916 G928 T929	L916-P926 HydrophobicContact CD1-CG 4.04Å; P926-G928 PolarHBondContact O-N 2.88Å; P926-T929 HydrophobicContact CB-CG2 4.05Å; P926-T929 HydrophobicContact CG-CG2 4.18Å; P926-T929 WeakPolarHBondContact O-CG2 3.43Å; P926-T929 PolarHBondContact O-N 3.36Å; P926-T929 PolarHBondContact O-OG1 3.04Å
927	I	71.2	Confident	69.1	Low	181 Å²	181	102.4 Å²	102.4	93%	0.928	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	126.7	176.5	-60.4	170.3	0	0	0	109.1
928	G	66.7	Low	68.3	Low	28 Å²	28	100.5 Å²	100.5	29%	0.289	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	97.6	-0.4	179.5	0	0	0	0	0	115.4	P926 D930 I931	P926-G928 PolarHBondContact O-N 2.88Å; G928-D930 VanDerWaalsContact C-OD1 3.24Å; G928-D930 WeakPolarHBondContact CA-OD1 3.26Å; G928-D930 PolarHBondContact N-OD1 3.25Å; G928-D930 VanDerWaalsContact N-OD1 3.16Å; G928-D930 PolarHBondContact O-N 3.35Å; G928-I931 WeakPolarHBondContact O-CB 3.34Å; G928-I931 PolarHBondContact O-N 3.48Å
929	T	63.6	Low	67.4	Low	29 Å²	29	98.6 Å²	98.6	18%	0.178	55%	0.547	C	S	.	.	G	3₁₀ helix	trans	-71.6	-16	174	49.1	0	0	0	0	113.7	L909 P926 I931 M932	L909-T929 HydrophobicContact CD1-CG2 4.27Å; P926-T929 HydrophobicContact CB-CG2 4.05Å; P926-T929 HydrophobicContact CG-CG2 4.18Å; P926-T929 WeakPolarHBondContact O-CG2 3.43Å; P926-T929 PolarHBondContact O-N 3.36Å; P926-T929 PolarHBondContact O-OG1 3.04Å; T929-I931 VanDerWaalsContact C-N 3.26Å; T929-I931 PolarHBondContact O-N 3.37Å; T929-M932 PolarHBondContact O-N 3.41Å
930	D	60.9	Low	66.5	Low	121 Å²	121	96.4 Å²	96.4	65%	0.647	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-63.5	-26.2	169.6	39.2	-39.4	0	0	0	113.2	G928 M932	G928-D930 VanDerWaalsContact C-OD1 3.24Å; G928-D930 WeakPolarHBondContact CA-OD1 3.26Å; G928-D930 PolarHBondContact N-OD1 3.25Å; G928-D930 VanDerWaalsContact N-OD1 3.16Å; G928-D930 PolarHBondContact O-N 3.35Å; D930-M932 VanDerWaalsContact C-N 3.32Å; D930-M932 PolarHBondContact O-N 3.44Å
931	I	54.2	Low	65.6	Low	122 Å²	122	100.9 Å²	100.9	63%	0.626	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-75.6	-21.1	-179.5	-57.1	165.3	0	0	0	111.9	G928 T929 N933	G928-I931 WeakPolarHBondContact O-CB 3.34Å; G928-I931 PolarHBondContact O-N 3.48Å; T929-I931 VanDerWaalsContact C-N 3.26Å; T929-I931 PolarHBondContact O-N 3.37Å; I931-N933 VanDerWaalsContact C-N 3.3Å; I931-N933 PolarHBondContact O-N 3.36Å
932	M	51	Low	64.4	Low	109 Å²	109	106.3 Å²	106.3	54%	0.537	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-84.9	2.1	-173	-62	-67.9	-76.7	0	0	114.2	I906 T929 D930	I906-M932 HydrophobicContact CD1-CE 3.42Å; I906-M932 VanDerWaalsContact CD1-CE 3.42Å; T929-M932 PolarHBondContact O-N 3.41Å; D930-M932 VanDerWaalsContact C-N 3.32Å; D930-M932 PolarHBondContact O-N 3.44Å
933	N	46	Very low	63.2	Low	156 Å²	156	106.4 Å²	106.4	83%	0.834	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-101.9	1.4	178.3	-78.6	-27	0	0	0	114.1	I931	I931-N933 VanDerWaalsContact C-N 3.3Å; I931-N933 PolarHBondContact O-N 3.36Å
934	E	34.8	Very low	61.7	Low	244 Å²	244	104.6 Å²	104.6	100%	1.14	55%	0.554	S	S	*	*			trans	-87.1	0	160.9	-71.4	-171.2	167.6	0	0	110.4

Retrieved 934 of 934 residues in 893.5 ms (Link to these results)

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