A0A5K4F352_SCHMA Loading...

Piezo_RRas_bdg domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F352, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,078 aa.

						>A0A5K4F352_SCHMA|A0A5K4F352
MLPNEFLVRLYIFCTASFISFYVGDQFLILLCFHYSLCKVFSRLSSNSLLLVITLGTILMAEIMALRTLLPFLWSAPVNLLYILLINCFLCHYLVWSVLEFSLAGIEHEVLEIPTFSSLPTICCLLITMLGFGHWKKHLTSLTCFLGVPTLWLCSRYKPKKHLEVLWNSFMEACIAVLLNLFPVLNYAICYFFDESGGSLFKFMVEILFLVTTTNLISSHLRVQSLLTAKGTLNKQISRMVLPLFTGIILLNINTEFFNTLYNVLSYLPIFTVHFLVFVIMVSVTLLRYYHQTTRTQLLLKFMSTMLFVMIIGLYWNNFSNVFRISRQPFWKKRYINHLFWSGIVCLIFSVLTLFAYEYGNQEIFDIIFGVSLCILHYSEWCLYMTTNISESWLYNSCIITVVSVLLAAAYTNRRLLMNNSVLNRSSLVKIFSWHVFAPCCLVPAVLKLLLLCINEYVDNSTHHNTLNHRVHYNKDFVLGLYLLLLGLFCSERICQFKKQVVNRLLDFYPFLSPSRIAIESIVIGGYFHVAITLVWPQVMLLSNMDTDLFLNSNIYILIQFSISCLVTSLALILPSVLNLNLISREMSGYSRNFAKIGLLLLTITFNSIQLHLSLSGAVVYVVTIPTCVLCIIWMICLFIYLFSYATLDLYPISVFVYTLQNVIYPGLFILSVAFISMISINVLPPDLTVFLLFSIFISCMVCLVIWDINDSLITDQIRCTLTNCESDMMMTIFEKDDNSSSLKSSEKFSSVSLNNPRRSHVVVCNSFCELLIRLILLTCSLVSLLVLLIYLIHRSEVSMTDNICQLYTIFSLEIFCIAQISVGYPQRWLCDKVRCRSIQLIDNNSNGVLVFILISMVNVCIILSVILRYQFCPSFSTEIEIFFLPWIIFTFHGKQLHRYRHVLALTCFTILLVYMVFIHSPIVKGYAPSLPTFDRQFFGRTNSPLYYWSEFLLTIALCPLHVLFLADQSNITTQALVDILFFNQLSQSHTHKQHSTTSLSSIVCFKCIKFQIAYTLSYIFSCILYTAYGLLPFCISYWFVASSLASAIFGLYSFIICSYLLIRVDIVTDYYSYYSYT
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.3	Very low	42.1	Very low	204 Å²	204	110.7 Å²	110.7	100%	1.005	56%	0.555	S	S	*	*				0	110.2	0	-81	-174.3	165.6	0	0	107.3
2	L	32.9	Very low	43	Very low	121 Å²	121	103 Å²	103	63%	0.634	52%	0.516	S	S	*	.			trans	-68.5	139.8	175.6	-81.3	132.3	0	0	0	108.5	N4 E5	L2-N4 PolarHBondContact O-N 3Å; L2-E5 PolarHBondContact O-N 3.38Å
3	P	34.8	Very low	44	Very low	99 Å²	99	107.4 Å²	107.4	64%	0.643	53%	0.53	S	S	*	.	H	α-helix	trans	-54.1	-22	179.5	18.2	-29.8	0	0	0	113.7
4	N	41.3	Very low	44.6	Very low	117 Å²	117	103.7 Å²	103.7	63%	0.626	52%	0.52	S	S	*	.	H	α-helix	trans	-69.4	-32	175.2	-68	-8.9	0	0	0	114.1	L2 V8	L2-N4 PolarHBondContact O-N 3Å; N4-V8 VanDerWaalsContact O-CG2 3.26Å; N4-V8 WeakPolarHBondContact O-CG2 3.46Å; N4-V8 PolarHBondContact O-N 3.13Å
5	E	43.2	Very low	45	Very low	97 Å²	97	98.7 Å²	98.7	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-72.7	-34.3	-178.5	-69.3	179.1	141.1	0	0	112.3	L2 R9	L2-E5 PolarHBondContact O-N 3.38Å; E5-R9 WeakPolarHBondContact O-CG 3.46Å; E5-R9 PolarHBondContact O-N 3.43Å
6	F	43.2	Very low	45.5	Very low	147 Å²	147	93.2 Å²	93.2	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-69.9	-44.3	178.8	-178.9	-100.3	0	0	0	111.8	V8 R9 L10	F6-V8 PolarHBondContact O-N 3.18Å; F6-R9 PolarHBondContact O-N 2.69Å; F6-L10 HydrophobicContact CE1-CD1 4.35Å; F6-L10 HydrophobicContact CZ-CD1 4.23Å; F6-L10 WeakPolarHBondContact O-CB 3.33Å; F6-L10 PolarHBondContact O-N 3.33Å
7	L	43.8	Very low	46.1	Very low	112 Å²	112	89.7 Å²	89.7	59%	0.586	46%	0.457	S	S	*	.	H	α-helix	trans	-61.9	-41.2	177.9	-104.5	147.3	0	0	0	112.5	L10 Y11	L7-L10 PolarHBondContact O-N 3Å; L7-Y11 WeakPolarHBondContact O-CB 3.42Å; L7-Y11 PolarHBondContact O-N 3.48Å
8	V	45.2	Very low	46.6	Very low	67 Å²	67	92.7 Å²	92.7	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-66.9	-42.6	176.9	172.7	0	0	0	0	111.4	N4 F6 Y11 I12	N4-V8 VanDerWaalsContact O-CG2 3.26Å; N4-V8 WeakPolarHBondContact O-CG2 3.46Å; N4-V8 PolarHBondContact O-N 3.13Å; F6-V8 PolarHBondContact O-N 3.18Å; V8-Y11 WeakPolarHBondContact O-CB 3.24Å; V8-Y11 PolarHBondContact O-N 3.12Å; V8-I12 HydrophobicContact CG1-CD1 3.8Å; V8-I12 VanDerWaalsContact O-CG1 3.27Å; V8-I12 WeakPolarHBondContact O-CG1 3.17Å; V8-I12 PolarHBondContact O-N 2.82Å
9	R	49	Very low	46.9	Very low	110 Å²	110	88.8 Å²	88.8	42%	0.415	45%	0.448	S	S	.	.	H	α-helix	trans	-65.6	-38.7	176.3	-77.1	179.6	176.5	168.3	2.4	112.7	E5 F6 I12 F13 E100	E5-R9 WeakPolarHBondContact O-CG 3.46Å; E5-R9 PolarHBondContact O-N 3.43Å; F6-R9 PolarHBondContact O-N 2.69Å; R9-I12 PolarHBondContact O-N 3.42Å; R9-F13 WeakPolarHBondContact O-CB 3.26Å; R9-F13 PolarHBondContact O-N 3.26Å; R9-E100 IonicContact CZ-OE1 3.97Å; R9-E100 IonicContact NE-OE1 3.13Å; R9-E100 IonicContact NH2-OE1 2.63Å; R9-E100 PolarHBondContact NH2-OE1 3.01Å
10	L	50.6	Low	47.4	Very low	94 Å²	94	85 Å²	85	49%	0.492	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-44.3	174.5	-159.8	99.4	0	0	0	111.1	F6 L7 F13 C14	F6-L10 HydrophobicContact CE1-CD1 4.35Å; F6-L10 HydrophobicContact CZ-CD1 4.23Å; F6-L10 WeakPolarHBondContact O-CB 3.33Å; F6-L10 PolarHBondContact O-N 3.33Å; L7-L10 PolarHBondContact O-N 3Å; L10-F13 PolarHBondContact O-N 2.84Å; L10-C14 VanDerWaalsContact O-CB 3.31Å; L10-C14 WeakPolarHBondContact O-CB 3.24Å; L10-C14 PolarHBondContact O-N 3.44Å; L10-C14 PolarHBondContact O-SG 3.12Å; L10-C14 VanDerWaalsContact O-SG 3.37Å
11	Y	46.7	Very low	47.8	Very low	50 Å²	50	89.1 Å²	89.1	20%	0.196	45%	0.445	C	S	.	.	H	α-helix	trans	-57.5	-49.8	175.4	172.1	-101.5	0	0	0	111.7	L7 V8 T15 H92 P1033	L7-Y11 WeakPolarHBondContact O-CB 3.42Å; L7-Y11 PolarHBondContact O-N 3.48Å; V8-Y11 WeakPolarHBondContact O-CB 3.24Å; V8-Y11 PolarHBondContact O-N 3.12Å; Y11-T15 HydrophobicContact CD2-CG2 3.99Å; Y11-T15 HydrophobicContact CE1-CG2 4.45Å; Y11-T15 HydrophobicContact CE2-CG2 3.69Å; Y11-T15 HydrophobicContact CG-CG2 4.5Å; Y11-T15 VanDerWaalsContact O-CB 3.31Å; Y11-T15 WeakPolarHBondContact O-CB 3.24Å; Y11-T15 WeakPolarHBondContact O-CG2 3.46Å; Y11-T15 PolarHBondContact O-N 2.83Å; Y11-T15 PolarHBondContact O-OG1 3.46Å; Y11-H92 HydrophobicContact CE1-CB 4.47Å; Y11-P1033 HydrophobicContact CD2-CG 4.24Å; Y11-P1033 HydrophobicContact CE2-CG 4.38Å
12	I	53	Low	48.8	Very low	18 Å²	18	84 Å²	84	9%	0.092	42%	0.415	C	S	.	.	H	α-helix	trans	-66.7	-42.2	-177.8	-66.6	169	0	0	0	111.1	V8 R9 T15 A16 W96	V8-I12 HydrophobicContact CG1-CD1 3.8Å; V8-I12 VanDerWaalsContact O-CG1 3.27Å; V8-I12 WeakPolarHBondContact O-CG1 3.17Å; V8-I12 PolarHBondContact O-N 2.82Å; R9-I12 PolarHBondContact O-N 3.42Å; I12-T15 WeakPolarHBondContact CA-OG1 3.31Å; I12-T15 PolarHBondContact O-OG1 3.31Å; I12-A16 WeakPolarHBondContact O-CB 3.44Å; I12-A16 PolarHBondContact O-N 2.76Å; I12-W96 HydrophobicContact CD1-CB 3.92Å; I12-W96 VanDerWaalsContact CD1-CD1 3.49Å; I12-W96 HydrophobicContact CD1-CD2 3.19Å; I12-W96 HydrophobicContact CD1-CE3 3.78Å; I12-W96 HydrophobicContact CD1-CG 3.26Å; I12-W96 HydrophobicContact CD1-CH2 4.35Å; I12-W96 HydrophobicContact CD1-CZ2 3.86Å; I12-W96 HydrophobicContact CD1-CZ3 4.33Å; I12-W96 HydrophobicContact CG2-CH2 4.39Å; I12-W96 HydrophobicContact CG2-CZ3 4.32Å
13	F	55.6	Low	49.8	Very low	160 Å²	160	78.8 Å²	78.8	70%	0.702	39%	0.388	S	S	*	.	H	α-helix	trans	-66.6	-45.2	179.1	-168.9	-94.2	0	0	0	111.8	R9 L10 S17	R9-F13 WeakPolarHBondContact O-CB 3.26Å; R9-F13 PolarHBondContact O-N 3.26Å; L10-F13 PolarHBondContact O-N 2.84Å; F13-S17 WeakPolarHBondContact O-CB 3.44Å; F13-S17 PolarHBondContact O-N 3.06Å; F13-S17 PolarHBondContact O-OG 2.86Å
14	C	52.7	Low	51.1	Low	56 Å²	56	75.5 Å²	75.5	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-46.1	176.3	-71.5	0	0	0	0	111.5	L10 S17 F18	L10-C14 VanDerWaalsContact O-CB 3.31Å; L10-C14 WeakPolarHBondContact O-CB 3.24Å; L10-C14 PolarHBondContact O-N 3.44Å; L10-C14 PolarHBondContact O-SG 3.12Å; L10-C14 VanDerWaalsContact O-SG 3.37Å; C14-S17 WeakPolarHBondContact CA-OG 3.13Å; C14-S17 PolarHBondContact O-N 2.76Å; C14-S17 PolarHBondContact O-OG 3.38Å; C14-F18 WeakPolarHBondContact O-CB 3.41Å; C14-F18 WeakPolarHBondContact O-CD2 3.48Å; C14-F18 PolarHBondContact O-N 2.93Å
15	T	50.5	Low	51.9	Low	28 Å²	28	75.9 Å²	75.9	17%	0.172	37%	0.374	C	S	.	.	H	α-helix	trans	-67.7	-39.8	179.1	48.8	0	0	0	0	112.6	Y11 I12 F18 I19 F89	Y11-T15 HydrophobicContact CD2-CG2 3.99Å; Y11-T15 HydrophobicContact CE1-CG2 4.45Å; Y11-T15 HydrophobicContact CE2-CG2 3.69Å; Y11-T15 HydrophobicContact CG-CG2 4.5Å; Y11-T15 VanDerWaalsContact O-CB 3.31Å; Y11-T15 WeakPolarHBondContact O-CB 3.24Å; Y11-T15 WeakPolarHBondContact O-CG2 3.46Å; Y11-T15 PolarHBondContact O-N 2.83Å; Y11-T15 PolarHBondContact O-OG1 3.46Å; I12-T15 WeakPolarHBondContact CA-OG1 3.31Å; I12-T15 PolarHBondContact O-OG1 3.31Å; T15-F18 PolarHBondContact O-N 3.04Å; T15-I19 WeakPolarHBondContact O-CB 3.46Å; T15-I19 WeakPolarHBondContact O-CD1 3.3Å; T15-I19 WeakPolarHBondContact O-CG1 3.42Å; T15-I19 PolarHBondContact O-N 2.99Å; T15-F89 WeakPolarHBondContact OG1-CD2 3.42Å; T15-F89 WeakPolarHBondContact OG1-CE2 3.39Å
16	A	53	Low	52.6	Low	11 Å²	11	77.2 Å²	77.2	9%	0.091	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-41.3	175.3	0	0	0	0	0	112.2	I12 S20 L28 F89	I12-A16 WeakPolarHBondContact O-CB 3.44Å; I12-A16 PolarHBondContact O-N 2.76Å; A16-S20 WeakPolarHBondContact O-CB 3.33Å; A16-S20 PolarHBondContact O-N 3.5Å; A16-S20 PolarHBondContact O-OG 3.41Å; A16-L28 HydrophobicContact CB-CD1 4.09Å; A16-F89 HydrophobicContact CB-CE2 4.29Å; A16-F89 HydrophobicContact CB-CZ 3.85Å
17	S	56	Low	53.6	Low	34 Å²	34	70.3 Å²	70.3	24%	0.238	35%	0.35	C	S	.	.	H	α-helix	trans	-69.1	-38.3	175.6	50.1	0	0	0	0	112.6	F13 C14 S20 F21	F13-S17 WeakPolarHBondContact O-CB 3.44Å; F13-S17 PolarHBondContact O-N 3.06Å; F13-S17 PolarHBondContact O-OG 2.86Å; C14-S17 WeakPolarHBondContact CA-OG 3.13Å; C14-S17 PolarHBondContact O-N 2.76Å; C14-S17 PolarHBondContact O-OG 3.38Å; S17-S20 WeakPolarHBondContact CA-OG 3.43Å; S17-S20 PolarHBondContact O-N 3.44Å; S17-S20 PolarHBondContact O-OG 3.06Å; S17-F21 WeakPolarHBondContact O-CD2 3.37Å; S17-F21 PolarHBondContact O-N 3.37Å
18	F	54.5	Low	54.5	Low	143 Å²	143	67.8 Å²	67.8	63%	0.627	34%	0.337	S	S	*	.	H	α-helix	trans	-67.7	-38.2	174.2	-92.1	-74.3	0	0	0	113	C14 T15	C14-F18 WeakPolarHBondContact O-CB 3.41Å; C14-F18 WeakPolarHBondContact O-CD2 3.48Å; C14-F18 PolarHBondContact O-N 2.93Å; T15-F18 PolarHBondContact O-N 3.04Å
19	I	53.9	Low	55.5	Low	20 Å²	20	70 Å²	70	10%	0.103	35%	0.345	C	S	.	.	H	α-helix	trans	-73.1	-34.4	176.9	-66.4	164.7	0	0	0	110.8	T15 F21 Y22 V23 F27 I86 F89	T15-I19 WeakPolarHBondContact O-CB 3.46Å; T15-I19 WeakPolarHBondContact O-CD1 3.3Å; T15-I19 WeakPolarHBondContact O-CG1 3.42Å; T15-I19 PolarHBondContact O-N 2.99Å; I19-F21 VanDerWaalsContact C-N 3.27Å; I19-F21 PolarHBondContact O-N 3.03Å; I19-Y22 PolarHBondContact O-N 3.19Å; I19-V23 HydrophobicContact CG2-CG2 3.77Å; I19-V23 PolarHBondContact O-N 3.39Å; I19-F27 HydrophobicContact CB-CD1 4.45Å; I19-F27 HydrophobicContact CB-CE1 3.97Å; I19-F27 HydrophobicContact CG2-CD1 3.76Å; I19-F27 HydrophobicContact CG2-CE1 3.3Å; I19-F27 HydrophobicContact CG2-CE2 4.38Å; I19-F27 HydrophobicContact CG2-CG 4.48Å; I19-F27 HydrophobicContact CG2-CZ 3.66Å; I19-I86 HydrophobicContact CG2-CG1 4.03Å; I19-F89 HydrophobicContact CD1-CB 3.44Å; I19-F89 VanDerWaalsContact CD1-CB 3.44Å; I19-F89 HydrophobicContact CD1-CD1 3.48Å; I19-F89 VanDerWaalsContact CD1-CD1 3.48Å; I19-F89 HydrophobicContact CD1-CD2 3.61Å; I19-F89 HydrophobicContact CD1-CE1 4.11Å; I19-F89 HydrophobicContact CD1-CE2 4.22Å; I19-F89 HydrophobicContact CD1-CG 3.19Å; I19-F89 HydrophobicContact CD1-CZ 4.44Å
20	S	56.2	Low	56.4	Low	11 Å²	11	66.6 Å²	66.6	8%	0.077	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-28.5	175.8	67.2	0	0	0	0	113.3	A16 S17 Y22 G24	A16-S20 WeakPolarHBondContact O-CB 3.33Å; A16-S20 PolarHBondContact O-N 3.5Å; A16-S20 PolarHBondContact O-OG 3.41Å; S17-S20 WeakPolarHBondContact CA-OG 3.43Å; S17-S20 PolarHBondContact O-N 3.44Å; S17-S20 PolarHBondContact O-OG 3.06Å; S20-Y22 PolarHBondContact O-N 2.87Å; S20-G24 CarbonylContact O-C 3.59Å; S20-G24 VanDerWaalsContact O-C 3.3Å; S20-G24 WeakPolarHBondContact O-CA 3.34Å; S20-G24 PolarHBondContact O-N 2.79Å
21	F	56.6	Low	57.1	Low	172 Å²	172	62.5 Å²	62.5	75%	0.754	31%	0.314	S	S	*	.	H	α-helix	trans	-62.7	-23.5	170.4	-92.4	-73.2	0	0	0	113.3	S17 I19	S17-F21 WeakPolarHBondContact O-CD2 3.37Å; S17-F21 PolarHBondContact O-N 3.37Å; I19-F21 VanDerWaalsContact C-N 3.27Å; I19-F21 PolarHBondContact O-N 3.03Å
22	Y	51.6	Low	58.1	Low	96 Å²	96	63.7 Å²	63.7	38%	0.376	33%	0.328	S	S	.	.	H	α-helix	trans	-105	-36.7	-174.6	-138.8	-92.9	0	0	0	113.5	I19 S20 L69 Y82	I19-Y22 PolarHBondContact O-N 3.19Å; S20-Y22 PolarHBondContact O-N 2.87Å; Y22-L69 HydrophobicContact CD1-CD2 4.31Å; Y22-L69 HydrophobicContact CE1-CD2 4.15Å; Y22-Y82 HydrophobicContact CD1-CG 4.45Å; Y22-Y82 HydrophobicContact CE1-CD1 4.19Å; Y22-Y82 AromaticContact CE1-CD2 3.74Å; Y22-Y82 HydrophobicContact CE1-CD2 3.74Å; Y22-Y82 HydrophobicContact CE1-CE1 4.33Å; Y22-Y82 AromaticContact CE1-CE2 3.96Å; Y22-Y82 HydrophobicContact CE1-CE2 3.96Å; Y22-Y82 AromaticContact CE1-CG 3.92Å; Y22-Y82 HydrophobicContact CE1-CG 3.92Å; Y22-Y82 HydrophobicContact CE2-CE1 4.29Å; Y22-Y82 AromaticContact CZ-CD2 3.99Å; Y22-Y82 AromaticContact CZ-CE2 3.7Å; Y22-Y82 AromaticContact CZ-CZ 3.69Å; Y22-Y82 WeakPolarHBondContact OH-CE2 3.29Å; Y22-Y82 PolarHBondContact OH-OH 3.39Å
23	V	55.2	Low	58.9	Low	13 Å²	13	68.7 Å²	68.7	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-93.7	-17.8	-179.7	-174.6	0	0	0	0	111.6	I19 F27 T68 I86	I19-V23 HydrophobicContact CG2-CG2 3.77Å; I19-V23 PolarHBondContact O-N 3.39Å; V23-F27 HydrophobicContact CB-CB 4Å; V23-F27 HydrophobicContact CB-CD2 4.34Å; V23-F27 HydrophobicContact CB-CG 4.16Å; V23-F27 HydrophobicContact CG1-CB 3.79Å; V23-F27 HydrophobicContact CG1-CD2 3.84Å; V23-F27 HydrophobicContact CG1-CG 4.02Å; V23-T68 HydrophobicContact CG1-CG2 4.49Å; V23-I86 HydrophobicContact CG2-CD1 3.58Å; V23-I86 HydrophobicContact CG2-CG1 4.38Å
24	G	60.4	Low	59.9	Low	30 Å²	30	61 Å²	61	31%	0.309	32%	0.316	S	S	.	.			trans	98.3	161	-177.7	0	0	0	0	0	113.7	S20 Q26 F27	S20-G24 CarbonylContact O-C 3.59Å; S20-G24 VanDerWaalsContact O-C 3.3Å; S20-G24 WeakPolarHBondContact O-CA 3.34Å; S20-G24 PolarHBondContact O-N 2.79Å; G24-Q26 PolarHBondContact O-N 3.26Å; G24-F27 WeakPolarHBondContact O-CB 3.49Å; G24-F27 PolarHBondContact O-N 2.85Å
25	D	59	Low	60.8	Low	124 Å²	124	61.2 Å²	61.2	66%	0.663	31%	0.309	S	S	*	.	H	α-helix	trans	-55.1	-27.9	-173.5	-57.3	-21.9	0	0	0	113.8	F27 L28 I29	D25-F27 VanDerWaalsContact C-N 3.26Å; D25-F27 PolarHBondContact O-N 3.28Å; D25-L28 PolarHBondContact O-N 2.83Å; D25-I29 VanDerWaalsContact O-CG1 3.32Å; D25-I29 WeakPolarHBondContact O-CG1 3.47Å; D25-I29 PolarHBondContact O-N 3.49Å
26	Q	58.9	Low	61.6	Low	126 Å²	126	62.4 Å²	62.4	59%	0.589	32%	0.319	S	S	*	.	H	α-helix	trans	-62.2	-32.2	179.5	-60.8	-176.5	-13.2	0	0	112.8	G24 L30 M64	G24-Q26 PolarHBondContact O-N 3.26Å; Q26-L30 WeakPolarHBondContact O-CB 3.21Å; Q26-L30 PolarHBondContact O-N 2.86Å; Q26-M64 HydrophobicContact CB-CE 3.48Å; Q26-M64 VanDerWaalsContact CB-CE 3.48Å; Q26-M64 HydrophobicContact CB-SD 4.27Å; Q26-M64 HydrophobicContact CG-CE 4.29Å
27	F	63.2	Low	62.2	Low	1 Å²	1	64 Å²	64	0%	0.004	33%	0.326	C	S	.	.	H	α-helix	trans	-66.3	-42.3	176.1	-177.1	-93.9	0	0	0	111.6	I19 V23 G24 D25 L31 A61 I86 F89 L90	I19-F27 HydrophobicContact CB-CD1 4.45Å; I19-F27 HydrophobicContact CB-CE1 3.97Å; I19-F27 HydrophobicContact CG2-CD1 3.76Å; I19-F27 HydrophobicContact CG2-CE1 3.3Å; I19-F27 HydrophobicContact CG2-CE2 4.38Å; I19-F27 HydrophobicContact CG2-CG 4.48Å; I19-F27 HydrophobicContact CG2-CZ 3.66Å; V23-F27 HydrophobicContact CB-CB 4Å; V23-F27 HydrophobicContact CB-CD2 4.34Å; V23-F27 HydrophobicContact CB-CG 4.16Å; V23-F27 HydrophobicContact CG1-CB 3.79Å; V23-F27 HydrophobicContact CG1-CD2 3.84Å; V23-F27 HydrophobicContact CG1-CG 4.02Å; G24-F27 WeakPolarHBondContact O-CB 3.49Å; G24-F27 PolarHBondContact O-N 2.85Å; D25-F27 VanDerWaalsContact C-N 3.26Å; D25-F27 PolarHBondContact O-N 3.28Å; F27-L31 HydrophobicContact CD1-CD1 3.75Å; F27-L31 HydrophobicContact CE1-CD1 3.33Å; F27-L31 HydrophobicContact CZ-CD1 3.82Å; F27-L31 PolarHBondContact O-N 3.12Å; F27-A61 HydrophobicContact CD2-CB 4.21Å; F27-A61 HydrophobicContact CE2-CB 3.75Å; F27-I86 HydrophobicContact CE2-CG2 4.29Å; F27-I86 HydrophobicContact CZ-CG2 4.42Å; F27-F89 HydrophobicContact CE1-CD1 4.31Å; F27-F89 AromaticContact CE1-CE1 3.82Å; F27-F89 HydrophobicContact CE1-CE1 3.82Å; F27-F89 HydrophobicContact CZ-CD1 4.02Å; F27-F89 AromaticContact CZ-CE1 3.85Å; F27-F89 HydrophobicContact CZ-CE1 3.85Å; F27-L90 HydrophobicContact CE2-CD2 4.39Å; F27-L90 HydrophobicContact CZ-CD2 4.22Å
28	L	63.4	Low	62.7	Low	60 Å²	60	62.4 Å²	62.4	31%	0.314	31%	0.314	S	S	.	.	H	α-helix	trans	-66.7	-44.7	177	-163.2	84.8	0	0	0	111.2	A16 D25 L30 L31 C32	A16-L28 HydrophobicContact CB-CD1 4.09Å; D25-L28 PolarHBondContact O-N 2.83Å; L28-L30 VanDerWaalsContact C-N 3.3Å; L28-L30 PolarHBondContact O-N 3.37Å; L28-L31 PolarHBondContact O-N 2.86Å; L28-C32 WeakPolarHBondContact O-CB 3.35Å; L28-C32 PolarHBondContact O-N 3.11Å; L28-C32 PolarHBondContact O-SG 3.22Å; L28-C32 VanDerWaalsContact O-SG 3.37Å
29	I	65.3	Low	63.3	Low	113 Å²	113	61.7 Å²	61.7	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-60	-42.3	179.5	-68	165.9	0	0	0	110.5	D25 C32 F33	D25-I29 VanDerWaalsContact O-CG1 3.32Å; D25-I29 WeakPolarHBondContact O-CG1 3.47Å; D25-I29 PolarHBondContact O-N 3.49Å; I29-C32 PolarHBondContact O-N 3.11Å; I29-F33 WeakPolarHBondContact O-CB 3.35Å; I29-F33 PolarHBondContact O-N 3.2Å
30	L	67.4	Low	63.9	Low	38 Å²	38	65.3 Å²	65.3	20%	0.199	33%	0.334	C	S	.	.	H	α-helix	trans	-61.3	-46.6	178	-169.5	87	0	0	0	112.2	Q26 L28 F33 H34 T57 M60 A61	Q26-L30 WeakPolarHBondContact O-CB 3.21Å; Q26-L30 PolarHBondContact O-N 2.86Å; L28-L30 VanDerWaalsContact C-N 3.3Å; L28-L30 PolarHBondContact O-N 3.37Å; L30-F33 PolarHBondContact O-N 3.48Å; L30-H34 WeakPolarHBondContact O-CB 3.48Å; L30-H34 PolarHBondContact O-N 2.82Å; L30-T57 WeakPolarHBondContact CD2-O 3.41Å; L30-M60 HydrophobicContact CD1-CB 4.11Å; L30-M60 HydrophobicContact CD2-CB 3.71Å; L30-A61 HydrophobicContact CD2-CB 3.86Å
31	L	66.4	Low	64.2	Low	8 Å²	8	67.6 Å²	67.6	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-70.1	-36.6	179.6	-69.4	164.9	0	0	0	112.5	F27 L28 Y35 F89 Y93	F27-L31 HydrophobicContact CD1-CD1 3.75Å; F27-L31 HydrophobicContact CE1-CD1 3.33Å; F27-L31 HydrophobicContact CZ-CD1 3.82Å; F27-L31 PolarHBondContact O-N 3.12Å; L28-L31 PolarHBondContact O-N 2.86Å; L31-Y35 WeakPolarHBondContact O-CB 3.36Å; L31-Y35 PolarHBondContact O-N 3.17Å; L31-F89 HydrophobicContact CD1-CE1 3.71Å; L31-F89 HydrophobicContact CD1-CZ 4.05Å; L31-Y93 HydrophobicContact CB-CE2 4.43Å; L31-Y93 HydrophobicContact CD2-CD1 3.74Å; L31-Y93 HydrophobicContact CD2-CD2 4.03Å; L31-Y93 HydrophobicContact CD2-CE1 3.45Å; L31-Y93 VanDerWaalsContact CD2-CE1 3.45Å; L31-Y93 HydrophobicContact CD2-CE2 3.75Å; L31-Y93 HydrophobicContact CD2-CG 4.01Å; L31-Y93 VanDerWaalsContact CD2-CZ 3.43Å; L31-Y93 PolarHBondContact O-OH 3.45Å
32	C	67.9	Low	64.2	Low	75 Å²	75	62.4 Å²	62.4	51%	0.507	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-42.5	173.1	-75.6	0	0	0	0	111.5	L28 I29 Y35 S36	L28-C32 WeakPolarHBondContact O-CB 3.35Å; L28-C32 PolarHBondContact O-N 3.11Å; L28-C32 PolarHBondContact O-SG 3.22Å; L28-C32 VanDerWaalsContact O-SG 3.37Å; I29-C32 PolarHBondContact O-N 3.11Å; C32-Y35 PolarHBondContact O-N 3.45Å; C32-S36 WeakPolarHBondContact O-CB 3.34Å; C32-S36 PolarHBondContact O-N 3.21Å; C32-S36 PolarHBondContact O-OG 3.31Å
33	F	68.9	Low	64.5	Low	123 Å²	123	68.8 Å²	68.8	54%	0.539	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.3	-176.3	-110.2	0	0	0	111.2	I29 L30 Y35 S36 L37	I29-F33 WeakPolarHBondContact O-CB 3.35Å; I29-F33 PolarHBondContact O-N 3.2Å; L30-F33 PolarHBondContact O-N 3.48Å; F33-Y35 PolarHBondContact O-N 3.49Å; F33-S36 WeakPolarHBondContact CA-OG 3.39Å; F33-S36 PolarHBondContact O-N 3.34Å; F33-S36 PolarHBondContact O-OG 2.84Å; F33-L37 HydrophobicContact CD1-CD1 3.56Å; F33-L37 HydrophobicContact CD1-CG 4.43Å; F33-L37 HydrophobicContact CE1-CD1 3.23Å; F33-L37 HydrophobicContact CE1-CG 4.14Å; F33-L37 HydrophobicContact CE2-CD1 4.44Å; F33-L37 HydrophobicContact CG-CD1 4.31Å; F33-L37 HydrophobicContact CZ-CD1 3.73Å; F33-L37 HydrophobicContact CZ-CG 4.19Å; F33-L37 WeakPolarHBondContact O-CB 3.18Å; F33-L37 PolarHBondContact O-N 3.42Å
34	H	77.9	Confident	64.4	Low	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-53.7	-53.2	171.5	171.5	-97.8	0	0	0	112.3	L30 S36 L37 C38 T54 T57 Y93	L30-H34 WeakPolarHBondContact O-CB 3.48Å; L30-H34 PolarHBondContact O-N 2.82Å; H34-S36 VanDerWaalsContact C-N 3.27Å; H34-S36 PolarHBondContact O-N 3.47Å; H34-L37 WeakPolarHBondContact O-CB 3.47Å; H34-L37 PolarHBondContact O-N 3.14Å; H34-L37 VanDerWaalsContact O-N 3.12Å; H34-C38 VanDerWaalsContact CE1-SG 3.58Å; H34-C38 PolarHBondContact NE2-SG 3.44Å; H34-C38 PolarHBondContact O-N 2.95Å; H34-T54 WeakPolarHBondContact NE2-CA 3.31Å; H34-T54 WeakPolarHBondContact NE2-CG2 3.12Å; H34-T57 HydrophobicContact CB-CG2 3.69Å; H34-T57 PolarHBondContact CD2-OG1 3.45Å; H34-T57 VanDerWaalsContact CG-OG1 3.3Å; H34-T57 PolarHBondContact NE2-OG1 2.86Å; H34-Y93 AromaticContact CE1-CE1 3.85Å; H34-Y93 AromaticContact ND1-CE1 3.49Å; H34-Y93 WeakPolarHBondContact ND1-CE1 3.46Å; H34-Y93 AromaticContact ND1-CZ 3.47Å; H34-Y93 PolarHBondContact ND1-OH 3.11Å
35	Y	69.8	Low	63.9	Low	60 Å²	60	77.5 Å²	77.5	24%	0.235	40%	0.399	C	S	.	.	H	α-helix	trans	-59.8	-40.5	-178.8	-173.7	-99.8	0	0	0	111.6	L31 C32 F33 K39 W96 E100 F101	L31-Y35 WeakPolarHBondContact O-CB 3.36Å; L31-Y35 PolarHBondContact O-N 3.17Å; C32-Y35 PolarHBondContact O-N 3.45Å; F33-Y35 PolarHBondContact O-N 3.49Å; Y35-K39 HydrophobicContact CE1-CD 4.44Å; Y35-K39 VanDerWaalsContact O-CB 3.31Å; Y35-K39 WeakPolarHBondContact O-CB 3.22Å; Y35-K39 PolarHBondContact O-N 3.44Å; Y35-W96 AromaticContact CD2-CH2 3.44Å; Y35-W96 HydrophobicContact CD2-CH2 3.44Å; Y35-W96 VanDerWaalsContact CD2-CH2 3.44Å; Y35-W96 HydrophobicContact CD2-CZ2 4.45Å; Y35-W96 AromaticContact CD2-CZ3 3.68Å; Y35-W96 HydrophobicContact CD2-CZ3 3.68Å; Y35-W96 AromaticContact CE2-CH2 3.24Å; Y35-W96 HydrophobicContact CE2-CH2 3.24Å; Y35-W96 AromaticContact CE2-CZ2 3.85Å; Y35-W96 HydrophobicContact CE2-CZ2 3.85Å; Y35-W96 AromaticContact CE2-CZ3 3.9Å; Y35-W96 HydrophobicContact CE2-CZ3 3.9Å; Y35-W96 HydrophobicContact CG-CH2 4.48Å; Y35-E100 WeakPolarHBondContact CE2-OE2 3.23Å; Y35-E100 PolarHBondContact OH-OE1 3.45Å; Y35-F101 HydrophobicContact CD2-CZ 4.13Å; Y35-F101 HydrophobicContact CE2-CZ 4.15Å
36	S	68.6	Low	63.8	Low	53 Å²	53	73.4 Å²	73.4	37%	0.371	38%	0.381	S	S	.	.	H	α-helix	trans	-64.9	-40.9	175.4	72.3	0	0	0	0	112.8	C32 F33 H34 K39 V40	C32-S36 WeakPolarHBondContact O-CB 3.34Å; C32-S36 PolarHBondContact O-N 3.21Å; C32-S36 PolarHBondContact O-OG 3.31Å; F33-S36 WeakPolarHBondContact CA-OG 3.39Å; F33-S36 PolarHBondContact O-N 3.34Å; F33-S36 PolarHBondContact O-OG 2.84Å; H34-S36 VanDerWaalsContact C-N 3.27Å; H34-S36 PolarHBondContact O-N 3.47Å; S36-K39 PolarHBondContact O-N 3.37Å; S36-V40 VanDerWaalsContact O-CG2 3.31Å; S36-V40 WeakPolarHBondContact O-CG2 3.42Å; S36-V40 PolarHBondContact O-N 3.37Å; S36-V40 VanDerWaalsContact O-N 3.11Å
37	L	66	Low	63.7	Low	45 Å²	45	71 Å²	71	24%	0.236	37%	0.371	C	S	.	.	H	α-helix	trans	-62.9	-51.6	174.8	-84.1	166.2	0	0	0	111.4	F33 H34 K39 V40 F41 I53	F33-L37 HydrophobicContact CD1-CD1 3.56Å; F33-L37 HydrophobicContact CD1-CG 4.43Å; F33-L37 HydrophobicContact CE1-CD1 3.23Å; F33-L37 HydrophobicContact CE1-CG 4.14Å; F33-L37 HydrophobicContact CE2-CD1 4.44Å; F33-L37 HydrophobicContact CG-CD1 4.31Å; F33-L37 HydrophobicContact CZ-CD1 3.73Å; F33-L37 HydrophobicContact CZ-CG 4.19Å; F33-L37 WeakPolarHBondContact O-CB 3.18Å; F33-L37 PolarHBondContact O-N 3.42Å; H34-L37 WeakPolarHBondContact O-CB 3.47Å; H34-L37 PolarHBondContact O-N 3.14Å; H34-L37 VanDerWaalsContact O-N 3.12Å; L37-K39 PolarHBondContact O-N 3.36Å; L37-V40 PolarHBondContact O-N 3.44Å; L37-F41 HydrophobicContact CB-CD2 4.47Å; L37-F41 HydrophobicContact CD2-CD2 4.16Å; L37-F41 HydrophobicContact CD2-CE2 3.67Å; L37-F41 VanDerWaalsContact O-CD2 3.24Å; L37-F41 WeakPolarHBondContact O-CD2 3.38Å; L37-F41 PolarHBondContact O-N 2.61Å; L37-I53 HydrophobicContact CB-CG2 4.42Å
38	C	65.3	Low	63.2	Low	0 Å²	0	74.9 Å²	74.9	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-62	-33.1	179.6	-73.8	0	0	0	0	112.3	H34 F41 S42 L50 F101	H34-C38 VanDerWaalsContact CE1-SG 3.58Å; H34-C38 PolarHBondContact NE2-SG 3.44Å; H34-C38 PolarHBondContact O-N 2.95Å; C38-F41 PolarHBondContact O-N 3.45Å; C38-S42 WeakPolarHBondContact O-CB 3.25Å; C38-S42 PolarHBondContact O-N 3.46Å; C38-S42 PolarHBondContact O-OG 2.9Å; C38-L50 HydrophobicContact CB-CD2 4.16Å; C38-L50 HydrophobicContact CB-CG 4.31Å; C38-F101 HydrophobicContact CB-CD1 4.12Å; C38-F101 HydrophobicContact CB-CD2 3.85Å; C38-F101 HydrophobicContact CB-CE1 3.59Å; C38-F101 HydrophobicContact CB-CE2 3.31Å; C38-F101 HydrophobicContact CB-CG 4.26Å; C38-F101 HydrophobicContact CB-CZ 3.18Å
39	K	67.2	Low	62.8	Low	128 Å²	128	75.6 Å²	75.6	56%	0.557	40%	0.403	S	S	*	.	H	α-helix	trans	-70	-28.5	173.8	-167.6	173.7	-176.4	175.1	0	113.9	Y35 S36 L37 S42	Y35-K39 HydrophobicContact CE1-CD 4.44Å; Y35-K39 VanDerWaalsContact O-CB 3.31Å; Y35-K39 WeakPolarHBondContact O-CB 3.22Å; Y35-K39 PolarHBondContact O-N 3.44Å; S36-K39 PolarHBondContact O-N 3.37Å; L37-K39 PolarHBondContact O-N 3.36Å; K39-S42 PolarHBondContact O-OG 3.38Å
40	V	65.9	Low	62.5	Low	95 Å²	95	70.4 Å²	70.4	58%	0.576	38%	0.376	S	S	*	.	H	α-helix	trans	-77.1	-44.3	173	171.3	0	0	0	0	110.4	S36 L37	S36-V40 VanDerWaalsContact O-CG2 3.31Å; S36-V40 WeakPolarHBondContact O-CG2 3.42Å; S36-V40 PolarHBondContact O-N 3.37Å; S36-V40 VanDerWaalsContact O-N 3.11Å; L37-V40 PolarHBondContact O-N 3.44Å
41	F	62.5	Low	62	Low	59 Å²	59	70.3 Å²	70.3	26%	0.259	38%	0.376	S	S	.	.	H	α-helix	trans	-79.9	-17.2	-178	-76.8	-73.3	0	0	0	114.2	L37 C38 R43 L44 L49 L50 I53	L37-F41 HydrophobicContact CB-CD2 4.47Å; L37-F41 HydrophobicContact CD2-CD2 4.16Å; L37-F41 HydrophobicContact CD2-CE2 3.67Å; L37-F41 VanDerWaalsContact O-CD2 3.24Å; L37-F41 WeakPolarHBondContact O-CD2 3.38Å; L37-F41 PolarHBondContact O-N 2.61Å; C38-F41 PolarHBondContact O-N 3.45Å; F41-R43 PolarHBondContact O-N 3.05Å; F41-R43 VanDerWaalsContact O-N 3.08Å; F41-L44 HydrophobicContact CD1-CD1 3.74Å; F41-L44 HydrophobicContact CE1-CD1 4.14Å; F41-L44 WeakPolarHBondContact O-CA 3.46Å; F41-L44 WeakPolarHBondContact O-CB 3.27Å; F41-L44 PolarHBondContact O-N 3.33Å; F41-L44 VanDerWaalsContact O-O 3.05Å; F41-L49 HydrophobicContact CD1-CD2 3.54Å; F41-L49 HydrophobicContact CE1-CD2 3.74Å; F41-L49 HydrophobicContact CG-CD2 4.06Å; F41-L49 HydrophobicContact CZ-CD2 4.41Å; F41-L50 VanDerWaalsContact C-CD1 3.44Å; F41-L50 HydrophobicContact CB-CD1 3.5Å; F41-I53 HydrophobicContact CD2-CD1 3.89Å; F41-I53 HydrophobicContact CE2-CD1 4.22Å; F41-I53 HydrophobicContact CG-CD1 4.29Å
42	S	56.5	Low	61.4	Low	63 Å²	63	74.8 Å²	74.8	44%	0.441	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-11.8	174.2	69.1	0	0	0	0	113.1	C38 K39	C38-S42 WeakPolarHBondContact O-CB 3.25Å; C38-S42 PolarHBondContact O-N 3.46Å; C38-S42 PolarHBondContact O-OG 2.9Å; K39-S42 PolarHBondContact O-OG 3.38Å
43	R	58.3	Low	61	Low	231 Å²	231	72.9 Å²	72.9	87%	0.872	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-15.4	170.6	-67.4	-175.8	175.1	-178.2	-1.7	113.4	F41	F41-R43 PolarHBondContact O-N 3.05Å; F41-R43 VanDerWaalsContact O-N 3.08Å
44	L	53.5	Low	60.6	Low	99 Å²	99	67.1 Å²	67.1	52%	0.518	36%	0.362	S	S	.	.	S	Bend	trans	-98.9	132.7	176.1	-78	138.2	0	0	0	108.4	F41 S46	F41-L44 HydrophobicContact CD1-CD1 3.74Å; F41-L44 HydrophobicContact CE1-CD1 4.14Å; F41-L44 WeakPolarHBondContact O-CA 3.46Å; F41-L44 WeakPolarHBondContact O-CB 3.27Å; F41-L44 PolarHBondContact O-N 3.33Å; F41-L44 VanDerWaalsContact O-O 3.05Å; L44-S46 PolarHBondContact O-N 2.91Å
45	S	49.7	Very low	59.5	Low	126 Å²	126	70.8 Å²	70.8	88%	0.881	38%	0.381	S	S	*	.	S	Bend	trans	-66.8	10.8	-170.4	53.3	0	0	0	0	116.2	N47	S45-N47 PolarHBondContact O-N 3.44Å
46	S	57.8	Low	58.6	Low	39 Å²	39	69.6 Å²	69.6	27%	0.273	39%	0.388	S	S	.	.			trans	-97.1	80	-174.5	57.6	0	0	0	0	112.7	L44 S48 L49 L50	L44-S46 PolarHBondContact O-N 2.91Å; S46-S48 PolarHBondContact O-N 2.87Å; S46-S48 VanDerWaalsContact O-N 3.09Å; S46-L49 WeakPolarHBondContact O-CB 3.49Å; S46-L49 PolarHBondContact O-N 3.47Å; S46-L49 WeakPolarHBondContact OG-CB 3.34Å; S46-L50 PolarHBondContact O-N 3.25Å
47	N	56.3	Low	58.2	Low	74 Å²	74	67.9 Å²	67.9	40%	0.396	38%	0.375	S	S	.	.	H	α-helix	trans	-51.7	-31.8	172.5	-71.7	-7.3	0	0	0	113.3	S45 L51 L103	S45-N47 PolarHBondContact O-N 3.44Å; N47-L51 PolarHBondContact O-N 2.9Å; N47-L51 VanDerWaalsContact O-N 3.1Å; N47-L103 HydrophobicContact CB-CD2 3.93Å; N47-L103 WeakPolarHBondContact O-CD2 3.2Å
48	S	52.4	Low	57.8	Low	84 Å²	84	66.3 Å²	66.3	59%	0.587	37%	0.367	S	S	*	.	H	α-helix	trans	-66.6	-37	175.5	52.7	0	0	0	0	113.4	S46 L51 V52	S46-S48 PolarHBondContact O-N 2.87Å; S46-S48 VanDerWaalsContact O-N 3.09Å; S48-L51 PolarHBondContact O-N 3.22Å; S48-V52 VanDerWaalsContact O-CG2 3.28Å; S48-V52 WeakPolarHBondContact O-CG2 3.36Å; S48-V52 PolarHBondContact O-N 2.76Å; S48-V52 VanDerWaalsContact O-N 3.08Å
49	L	54.9	Low	57.1	Low	74 Å²	74	69.1 Å²	69.1	39%	0.387	38%	0.381	S	S	.	.	H	α-helix	trans	-70.5	-40.9	179.4	-164.5	109.1	0	0	0	110.5	F41 S46 L51 V52 I53	F41-L49 HydrophobicContact CD1-CD2 3.54Å; F41-L49 HydrophobicContact CE1-CD2 3.74Å; F41-L49 HydrophobicContact CG-CD2 4.06Å; F41-L49 HydrophobicContact CZ-CD2 4.41Å; S46-L49 WeakPolarHBondContact O-CB 3.49Å; S46-L49 PolarHBondContact O-N 3.47Å; S46-L49 WeakPolarHBondContact OG-CB 3.34Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L49-L51 PolarHBondContact O-N 2.9Å; L49-V52 PolarHBondContact O-N 3.44Å; L49-I53 HydrophobicContact CD2-CD1 3.74Å; L49-I53 HydrophobicContact CG-CD1 4.14Å; L49-I53 WeakPolarHBondContact O-CD1 3.29Å; L49-I53 VanDerWaalsContact O-CG1 3.24Å; L49-I53 WeakPolarHBondContact O-CG1 3.38Å; L49-I53 PolarHBondContact O-N 2.83Å
50	L	59	Low	56.4	Low	4 Å²	4	67.9 Å²	67.9	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-63.3	-38.9	175.1	-126.2	98.4	0	0	0	112.3	C38 F41 S46 I53 T54 F101 L103	C38-L50 HydrophobicContact CB-CD2 4.16Å; C38-L50 HydrophobicContact CB-CG 4.31Å; F41-L50 VanDerWaalsContact C-CD1 3.44Å; F41-L50 HydrophobicContact CB-CD1 3.5Å; S46-L50 PolarHBondContact O-N 3.25Å; L50-I53 PolarHBondContact O-N 3.46Å; L50-T54 WeakPolarHBondContact O-CB 3.49Å; L50-T54 WeakPolarHBondContact O-CG2 3.3Å; L50-T54 PolarHBondContact O-N 3.39Å; L50-T54 PolarHBondContact O-OG1 2.93Å; L50-F101 HydrophobicContact CD2-CB 3.24Å; L50-F101 HydrophobicContact CD2-CD1 3.88Å; L50-F101 HydrophobicContact CD2-CD2 3.89Å; L50-F101 HydrophobicContact CD2-CG 3.39Å; L50-L103 HydrophobicContact CB-CD2 4.2Å
51	L	56.9	Low	56	Low	37 Å²	37	63.4 Å²	63.4	19%	0.194	35%	0.352	C	S	.	.	H	α-helix	trans	-64.3	-39.6	174.8	-166.7	82.6	0	0	0	111.9	N47 S48 L49 T54 L55 L103 I106	N47-L51 PolarHBondContact O-N 2.9Å; N47-L51 VanDerWaalsContact O-N 3.1Å; S48-L51 PolarHBondContact O-N 3.22Å; L49-L51 VanDerWaalsContact C-N 3.33Å; L49-L51 PolarHBondContact O-N 2.9Å; L51-T54 VanDerWaalsContact C-OG1 3.25Å; L51-T54 WeakPolarHBondContact CA-OG1 3.27Å; L51-T54 PolarHBondContact O-OG1 2.88Å; L51-L55 HydrophobicContact CD2-CD1 4.34Å; L51-L55 HydrophobicContact CG-CD1 4.07Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 WeakPolarHBondContact O-CD1 3.27Å; L51-L55 WeakPolarHBondContact O-CG 3.23Å; L51-L55 PolarHBondContact O-N 2.82Å; L51-L103 HydrophobicContact CB-CD2 4.47Å; L51-L103 HydrophobicContact CD1-CD1 4.47Å; L51-I106 HydrophobicContact CD1-CD1 3.89Å; L51-I106 HydrophobicContact CD2-CD1 4.09Å; L51-I106 HydrophobicContact CG-CD1 4.43Å
52	V	54.1	Low	55.6	Low	102 Å²	102	62.4 Å²	62.4	62%	0.618	35%	0.348	S	S	*	.	H	α-helix	trans	-68.7	-39.1	177.4	170.6	0	0	0	0	111.3	S48 L49 G56	S48-V52 VanDerWaalsContact O-CG2 3.28Å; S48-V52 WeakPolarHBondContact O-CG2 3.36Å; S48-V52 PolarHBondContact O-N 2.76Å; S48-V52 VanDerWaalsContact O-N 3.08Å; L49-V52 PolarHBondContact O-N 3.44Å; V52-G56 PolarHBondContact O-N 3.35Å
53	I	60.2	Low	55.4	Low	35 Å²	35	62 Å²	62	18%	0.179	34%	0.34	C	S	.	.	H	α-helix	trans	-67.1	-42.1	176.9	-68.5	164.9	0	0	0	111.2	L37 F41 L49 L50 T57	L37-I53 HydrophobicContact CB-CG2 4.42Å; F41-I53 HydrophobicContact CD2-CD1 3.89Å; F41-I53 HydrophobicContact CE2-CD1 4.22Å; F41-I53 HydrophobicContact CG-CD1 4.29Å; L49-I53 HydrophobicContact CD2-CD1 3.74Å; L49-I53 HydrophobicContact CG-CD1 4.14Å; L49-I53 WeakPolarHBondContact O-CD1 3.29Å; L49-I53 VanDerWaalsContact O-CG1 3.24Å; L49-I53 WeakPolarHBondContact O-CG1 3.38Å; L49-I53 PolarHBondContact O-N 2.83Å; L50-I53 PolarHBondContact O-N 3.46Å; I53-T57 VanDerWaalsContact O-CG2 3.28Å; I53-T57 WeakPolarHBondContact O-CG2 3.21Å; I53-T57 PolarHBondContact O-N 3.2Å; I53-T57 VanDerWaalsContact O-N 3.11Å; I53-T57 PolarHBondContact O-OG1 3.33Å
54	T	60.7	Low	55.3	Low	1 Å²	1	53.1 Å²	53.1	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-63.8	-48.6	174.9	44.9	0	0	0	0	112.1	H34 L50 L51 G56 T57 I58 S97	H34-T54 WeakPolarHBondContact NE2-CA 3.31Å; H34-T54 WeakPolarHBondContact NE2-CG2 3.12Å; L50-T54 WeakPolarHBondContact O-CB 3.49Å; L50-T54 WeakPolarHBondContact O-CG2 3.3Å; L50-T54 PolarHBondContact O-N 3.39Å; L50-T54 PolarHBondContact O-OG1 2.93Å; L51-T54 VanDerWaalsContact C-OG1 3.25Å; L51-T54 WeakPolarHBondContact CA-OG1 3.27Å; L51-T54 PolarHBondContact O-OG1 2.88Å; T54-G56 PolarHBondContact O-N 3.27Å; T54-T57 PolarHBondContact O-N 2.86Å; T54-T57 PolarHBondContact O-OG1 3.46Å; T54-I58 WeakPolarHBondContact O-CD1 3.28Å; T54-I58 WeakPolarHBondContact O-CG1 3.14Å; T54-I58 PolarHBondContact O-N 3.04Å; T54-S97 WeakPolarHBondContact CG2-OG 3.45Å
55	L	54.3	Low	55.4	Low	77 Å²	77	48.6 Å²	48.6	40%	0.403	29%	0.286	S	S	.	.	H	α-helix	trans	-61.2	-44.6	175.6	-76.6	164.7	0	0	0	112.2	L51 T57 I58 L59 L94	L51-L55 HydrophobicContact CD2-CD1 4.34Å; L51-L55 HydrophobicContact CG-CD1 4.07Å; L51-L55 WeakPolarHBondContact O-CB 3.49Å; L51-L55 WeakPolarHBondContact O-CD1 3.27Å; L51-L55 WeakPolarHBondContact O-CG 3.23Å; L51-L55 PolarHBondContact O-N 2.82Å; L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 3.41Å; L55-I58 PolarHBondContact O-N 2.83Å; L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 PolarHBondContact O-N 3.07Å; L55-L94 HydrophobicContact CD2-CD1 4.05Å
56	G	51.4	Low	55.6	Low	36 Å²	36	44.2 Å²	44.2	37%	0.371	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-32.8	-178.6	0	0	0	0	0	114	V52 T54 M60	V52-G56 PolarHBondContact O-N 3.35Å; T54-G56 PolarHBondContact O-N 3.27Å; G56-M60 PolarHBondContact O-N 3.42Å
57	T	60.2	Low	55.3	Low	16 Å²	16	51.7 Å²	51.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-79.3	-35.1	179.8	51.3	0	0	0	0	112.7	L30 H34 I53 T54 L55 L59 M60 A61	L30-T57 WeakPolarHBondContact CD2-O 3.41Å; H34-T57 HydrophobicContact CB-CG2 3.69Å; H34-T57 PolarHBondContact CD2-OG1 3.45Å; H34-T57 VanDerWaalsContact CG-OG1 3.3Å; H34-T57 PolarHBondContact NE2-OG1 2.86Å; I53-T57 VanDerWaalsContact O-CG2 3.28Å; I53-T57 WeakPolarHBondContact O-CG2 3.21Å; I53-T57 PolarHBondContact O-N 3.2Å; I53-T57 VanDerWaalsContact O-N 3.11Å; I53-T57 PolarHBondContact O-OG1 3.33Å; T54-T57 PolarHBondContact O-N 2.86Å; T54-T57 PolarHBondContact O-OG1 3.46Å; L55-T57 VanDerWaalsContact C-N 3.31Å; L55-T57 PolarHBondContact O-N 3.41Å; T57-L59 VanDerWaalsContact C-N 3.33Å; T57-M60 PolarHBondContact O-N 2.7Å; T57-A61 WeakPolarHBondContact O-CB 3.18Å; T57-A61 PolarHBondContact O-N 2.93Å
58	I	57.9	Low	55.3	Low	12 Å²	12	50.5 Å²	50.5	6%	0.062	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-43.2	170	-71	158.9	0	0	0	110.6	T54 L55 M60 A61 E62 L90 Y93 L94	T54-I58 WeakPolarHBondContact O-CD1 3.28Å; T54-I58 WeakPolarHBondContact O-CG1 3.14Å; T54-I58 PolarHBondContact O-N 3.04Å; L55-I58 PolarHBondContact O-N 2.83Å; I58-M60 VanDerWaalsContact C-N 3.34Å; I58-M60 PolarHBondContact O-N 3.41Å; I58-A61 WeakPolarHBondContact O-CB 3.28Å; I58-A61 PolarHBondContact O-N 3.19Å; I58-A61 VanDerWaalsContact O-N 3.12Å; I58-E62 WeakPolarHBondContact O-CG 3.45Å; I58-E62 PolarHBondContact O-N 3.41Å; I58-L90 HydrophobicContact CG2-CB 4.24Å; I58-Y93 HydrophobicContact CG1-CD1 4.21Å; I58-L94 HydrophobicContact CD1-CB 3.42Å; I58-L94 VanDerWaalsContact CD1-CB 3.42Å; I58-L94 HydrophobicContact CD1-CD1 3.37Å; I58-L94 HydrophobicContact CD1-CG 3.71Å
59	L	49.7	Very low	55.4	Low	59 Å²	59	46.7 Å²	46.7	31%	0.309	24%	0.243	S	C	.	.	H	α-helix	trans	-62.6	-41.2	178	-141.4	147.4	0	0	0	111.6	L55 T57 E62 I63 V177 L181	L55-L59 WeakPolarHBondContact O-CB 3.36Å; L55-L59 PolarHBondContact O-N 3.07Å; T57-L59 VanDerWaalsContact C-N 3.33Å; L59-E62 PolarHBondContact O-N 3.43Å; L59-I63 HydrophobicContact CD2-CD1 4.02Å; L59-I63 WeakPolarHBondContact O-CD1 3.26Å; L59-I63 VanDerWaalsContact O-CG1 3.24Å; L59-I63 WeakPolarHBondContact O-CG1 3.3Å; L59-I63 PolarHBondContact O-N 3.3Å; L59-I63 VanDerWaalsContact O-N 3.08Å; L59-V177 HydrophobicContact CD1-CG2 3.92Å; L59-L181 HydrophobicContact CD2-CD1 3.58Å
60	M	53	Low	55.1	Low	103 Å²	103	45.4 Å²	45.4	51%	0.507	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-37.9	172.2	-85.1	-62.3	-159.8	0	0	112.9	L30 G56 T57 I58 I63 M64	L30-M60 HydrophobicContact CD1-CB 4.11Å; L30-M60 HydrophobicContact CD2-CB 3.71Å; G56-M60 PolarHBondContact O-N 3.42Å; T57-M60 PolarHBondContact O-N 2.7Å; I58-M60 VanDerWaalsContact C-N 3.34Å; I58-M60 PolarHBondContact O-N 3.41Å; M60-I63 PolarHBondContact O-N 2.94Å; M60-I63 HydrophobicContact SD-CD1 4.22Å; M60-M64 WeakPolarHBondContact O-CG 3.46Å; M60-M64 PolarHBondContact O-N 2.85Å
61	A	56.9	Low	54.5	Low	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-38.5	177.4	0	0	0	0	0	112.1	F27 L30 T57 I58 M64 A65 L90	F27-A61 HydrophobicContact CD2-CB 4.21Å; F27-A61 HydrophobicContact CE2-CB 3.75Å; L30-A61 HydrophobicContact CD2-CB 3.86Å; T57-A61 WeakPolarHBondContact O-CB 3.18Å; T57-A61 PolarHBondContact O-N 2.93Å; I58-A61 WeakPolarHBondContact O-CB 3.28Å; I58-A61 PolarHBondContact O-N 3.19Å; I58-A61 VanDerWaalsContact O-N 3.12Å; A61-M64 PolarHBondContact O-N 2.78Å; A61-A65 WeakPolarHBondContact O-CB 3.29Å; A61-A65 PolarHBondContact O-N 2.8Å; A61-L90 HydrophobicContact CB-CD1 4.09Å; A61-L90 HydrophobicContact CB-CD2 3.47Å; A61-L90 VanDerWaalsContact CB-CD2 3.47Å; A61-L90 HydrophobicContact CB-CG 4.44Å
62	E	54	Low	54	Low	39 Å²	39	53.7 Å²	53.7	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-43.2	171.6	-72.1	-175.3	172.4	0	0	111.6	I58 L59 M64 A65 L66 N87 L90	I58-E62 WeakPolarHBondContact O-CG 3.45Å; I58-E62 PolarHBondContact O-N 3.41Å; L59-E62 PolarHBondContact O-N 3.43Å; E62-M64 VanDerWaalsContact C-N 3.35Å; E62-M64 PolarHBondContact O-N 3.33Å; E62-A65 PolarHBondContact O-N 2.93Å; E62-L66 WeakPolarHBondContact O-CB 3.4Å; E62-L66 PolarHBondContact O-N 2.84Å; E62-N87 PolarHBondContact OE1-OD1 2.83Å; E62-L90 HydrophobicContact CB-CD1 4.44Å; E62-L90 HydrophobicContact CG-CD1 3.54Å
63	I	51.3	Low	53.7	Low	54 Å²	54	50.1 Å²	50.1	28%	0.277	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-44.3	176.3	-69.5	165	0	0	0	111.1	L59 M60 L66 R67 L181	L59-I63 HydrophobicContact CD2-CD1 4.02Å; L59-I63 WeakPolarHBondContact O-CD1 3.26Å; L59-I63 VanDerWaalsContact O-CG1 3.24Å; L59-I63 WeakPolarHBondContact O-CG1 3.3Å; L59-I63 PolarHBondContact O-N 3.3Å; L59-I63 VanDerWaalsContact O-N 3.08Å; M60-I63 PolarHBondContact O-N 2.94Å; M60-I63 HydrophobicContact SD-CD1 4.22Å; I63-L66 PolarHBondContact O-N 3.47Å; I63-R67 WeakPolarHBondContact O-CB 3.34Å; I63-R67 PolarHBondContact O-N 3.46Å; I63-L181 HydrophobicContact CB-CD2 4.39Å; I63-L181 HydrophobicContact CD1-CD1 3.9Å; I63-L181 HydrophobicContact CD1-CG 4.1Å; I63-L181 HydrophobicContact CG1-CD1 3.65Å; I63-L181 HydrophobicContact CG1-CD2 3.47Å; I63-L181 VanDerWaalsContact CG1-CD2 3.47Å; I63-L181 HydrophobicContact CG1-CG 3.53Å
64	M	56.7	Low	53.1	Low	44 Å²	44	57.9 Å²	57.9	22%	0.217	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-40.3	179.5	-70.4	-169.6	113.7	0	0	112.3	Q26 M60 A61 E62 R67 T68	Q26-M64 HydrophobicContact CB-CE 3.48Å; Q26-M64 VanDerWaalsContact CB-CE 3.48Å; Q26-M64 HydrophobicContact CB-SD 4.27Å; Q26-M64 HydrophobicContact CG-CE 4.29Å; M60-M64 WeakPolarHBondContact O-CG 3.46Å; M60-M64 PolarHBondContact O-N 2.85Å; A61-M64 PolarHBondContact O-N 2.78Å; E62-M64 VanDerWaalsContact C-N 3.35Å; E62-M64 PolarHBondContact O-N 3.33Å; M64-R67 PolarHBondContact O-N 3.36Å; M64-T68 PolarHBondContact O-N 2.93Å; M64-T68 VanDerWaalsContact O-N 3.14Å; M64-T68 PolarHBondContact O-OG1 3.4Å
65	A	56.6	Low	52.3	Low	5 Å²	5	62.1 Å²	62.1	4%	0.041	32%	0.315	C	S	.	.	H	α-helix	trans	-65	-42.6	174.7	0	0	0	0	0	112.3	A61 E62 T68 L69 I86	A61-A65 WeakPolarHBondContact O-CB 3.29Å; A61-A65 PolarHBondContact O-N 2.8Å; E62-A65 PolarHBondContact O-N 2.93Å; A65-T68 PolarHBondContact O-N 3.24Å; A65-T68 PolarHBondContact O-OG1 3.49Å; A65-T68 VanDerWaalsContact O-OG1 3.07Å; A65-L69 WeakPolarHBondContact O-CB 3.27Å; A65-L69 PolarHBondContact O-N 2.92Å; A65-I86 HydrophobicContact CB-CD1 3.95Å; A65-I86 HydrophobicContact CB-CG2 3.66Å
66	L	53.5	Low	51.9	Low	33 Å²	33	59.9 Å²	59.9	17%	0.173	31%	0.307	C	S	.	.	H	α-helix	trans	-63	-47.6	175.1	-121.1	83.6	0	0	0	110.8	E62 I63 T68 L69 L70 I83 L181 L185	E62-L66 WeakPolarHBondContact O-CB 3.4Å; E62-L66 PolarHBondContact O-N 2.84Å; I63-L66 PolarHBondContact O-N 3.47Å; L66-T68 VanDerWaalsContact C-N 3.25Å; L66-T68 PolarHBondContact O-N 3.46Å; L66-L69 PolarHBondContact O-N 3.42Å; L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 3.46Å; L66-I83 HydrophobicContact CD1-CD1 4.45Å; L66-L181 HydrophobicContact CD2-CD2 4.48Å; L66-L185 HydrophobicContact CB-CD1 4.26Å; L66-L185 HydrophobicContact CD2-CD1 3.32Å; L66-L185 HydrophobicContact CD2-CD2 3.62Å; L66-L185 HydrophobicContact CD2-CG 4.08Å; L66-L185 HydrophobicContact CG-CD1 4.39Å; L66-L185 HydrophobicContact CG-CD2 4.44Å
67	R	52.4	Low	51.8	Low	196 Å²	196	61.9 Å²	61.9	74%	0.74	31%	0.313	S	S	*	.	H	α-helix	trans	-58.5	-36.6	-178.8	-176.7	-179.6	177.3	-173.4	-0.3	112.9	I63 M64	I63-R67 WeakPolarHBondContact O-CB 3.34Å; I63-R67 PolarHBondContact O-N 3.46Å; M64-R67 PolarHBondContact O-N 3.36Å
68	T	55.8	Low	51.1	Low	50 Å²	50	62.4 Å²	62.4	31%	0.307	32%	0.317	S	S	.	.	H	α-helix	trans	-83.2	-37.1	-177.7	43.1	0	0	0	0	112.8	V23 M64 A65 L66 P71 F72	V23-T68 HydrophobicContact CG1-CG2 4.49Å; M64-T68 PolarHBondContact O-N 2.93Å; M64-T68 VanDerWaalsContact O-N 3.14Å; M64-T68 PolarHBondContact O-OG1 3.4Å; A65-T68 PolarHBondContact O-N 3.24Å; A65-T68 PolarHBondContact O-OG1 3.49Å; A65-T68 VanDerWaalsContact O-OG1 3.07Å; L66-T68 VanDerWaalsContact C-N 3.25Å; L66-T68 PolarHBondContact O-N 3.46Å; T68-P71 WeakPolarHBondContact O-CD 3.43Å; T68-F72 WeakPolarHBondContact O-CD2 3.15Å; T68-F72 WeakPolarHBondContact O-CE2 3.43Å
69	L	53.6	Low	50.7	Low	4 Å²	4	62.7 Å²	62.7	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-87	-24.1	-177.3	-74.3	158.4	0	0	0	113.8	Y22 A65 L66 P71 F72 L73 I83 I86	Y22-L69 HydrophobicContact CD1-CD2 4.31Å; Y22-L69 HydrophobicContact CE1-CD2 4.15Å; A65-L69 WeakPolarHBondContact O-CB 3.27Å; A65-L69 PolarHBondContact O-N 2.92Å; L66-L69 PolarHBondContact O-N 3.42Å; L69-P71 VanDerWaalsContact C-CD 3.46Å; L69-F72 CarbonylContact O-C 3.58Å; L69-F72 PolarHBondContact O-N 3.33Å; L69-L73 HydrophobicContact CB-CD1 3.9Å; L69-L73 VanDerWaalsContact O-CD1 3.3Å; L69-L73 WeakPolarHBondContact O-CD1 3.44Å; L69-L73 PolarHBondContact O-N 3.47Å; L69-I83 HydrophobicContact CB-CG1 4.24Å; L69-I83 HydrophobicContact CD1-CG1 3.85Å; L69-I86 HydrophobicContact CD1-CD1 3.35Å
70	L	49.3	Very low	50.7	Low	47 Å²	47	61.7 Å²	61.7	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-53.4	-42.9	-177.5	-160.9	83.4	0	0	0	114.2	L66 F72 L73 L185 I189	L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 3.46Å; L70-F72 VanDerWaalsContact C-N 3.31Å; L70-F72 PolarHBondContact O-N 3.21Å; L70-L73 PolarHBondContact O-N 2.73Å; L70-L185 HydrophobicContact CD1-CD2 3.8Å; L70-L185 HydrophobicContact CD2-CD2 3.7Å; L70-L185 HydrophobicContact CG-CD2 4.32Å; L70-I189 HydrophobicContact CD2-CD1 3.8Å; L70-I189 HydrophobicContact CD2-CG1 3.63Å
71	P	45.4	Very low	50.3	Low	89 Å²	89	58.7 Å²	58.7	58%	0.578	30%	0.299	S	S	*	.	H	α-helix	trans	-68	-30.4	177.4	-17.9	32.6	0	0	0	113	T68 L69	T68-P71 WeakPolarHBondContact O-CD 3.43Å; L69-P71 VanDerWaalsContact C-CD 3.46Å
72	F	47.9	Very low	50.1	Low	125 Å²	125	59.9 Å²	59.9	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-86.5	-21.2	-178.8	-62.2	-84.4	0	0	0	112.8	T68 L69 L70 W74 S75 A76 N79	T68-F72 WeakPolarHBondContact O-CD2 3.15Å; T68-F72 WeakPolarHBondContact O-CE2 3.43Å; L69-F72 CarbonylContact O-C 3.58Å; L69-F72 PolarHBondContact O-N 3.33Å; L70-F72 VanDerWaalsContact C-N 3.31Å; L70-F72 PolarHBondContact O-N 3.21Å; F72-W74 PolarHBondContact O-N 2.94Å; F72-S75 PolarHBondContact O-N 3.12Å; F72-S75 PolarHBondContact O-OG 2.91Å; F72-A76 PolarHBondContact O-N 3.14Å; F72-N79 WeakPolarHBondContact CB-ND2 3.38Å; F72-N79 PolarHBondContact O-ND2 3.37Å
73	L	47.7	Very low	50.1	Low	28 Å²	28	58.9 Å²	58.9	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-27	175.4	-92.9	143.3	0	0	0	113.8	L69 L70 N79 L80 I83	L69-L73 HydrophobicContact CB-CD1 3.9Å; L69-L73 VanDerWaalsContact O-CD1 3.3Å; L69-L73 WeakPolarHBondContact O-CD1 3.44Å; L69-L73 PolarHBondContact O-N 3.47Å; L70-L73 PolarHBondContact O-N 2.73Å; L73-N79 HydrophobicContact CG-CB 4.12Å; L73-L80 HydrophobicContact CD2-CB 4.25Å; L73-L80 HydrophobicContact CD2-CD2 3.57Å; L73-L80 HydrophobicContact CD2-CG 3.49Å; L73-L80 VanDerWaalsContact CD2-CG 3.49Å; L73-I83 HydrophobicContact CD1-CD1 3.17Å; L73-I83 HydrophobicContact CD1-CG1 3.99Å; L73-I83 HydrophobicContact CD2-CD1 4.29Å; L73-I83 HydrophobicContact CG-CD1 4.31Å
74	W	46	Very low	50	Low	197 Å²	197	58.5 Å²	58.5	75%	0.746	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-22.2	179.5	-147.3	-87.4	0	0	0	112.8	F72 M129	F72-W74 PolarHBondContact O-N 2.94Å; W74-M129 HydrophobicContact CE3-CE 4.19Å; W74-M129 HydrophobicContact CZ3-CE 3.91Å
75	S	45.1	Very low	49.7	Very low	91 Å²	91	57.7 Å²	57.7	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-28.9	-179.2	59.7	0	0	0	0	114.1	F72	F72-S75 PolarHBondContact O-N 3.12Å; F72-S75 PolarHBondContact O-OG 2.91Å
76	A	46.3	Very low	49.8	Very low	30 Å²	30	57.7 Å²	57.7	25%	0.248	29%	0.293	C	S	.	.			trans	-142.9	123.6	179.4	0	0	0	0	0	112.7	F72 V78 N79	F72-A76 PolarHBondContact O-N 3.14Å; A76-V78 PolarHBondContact O-N 3.38Å; A76-N79 PolarHBondContact O-N 3.37Å
77	P	47.6	Very low	49.8	Very low	77 Å²	77	56.8 Å²	56.8	50%	0.5	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-14.8	176.1	27.3	-34.5	0	0	0	112.5	N79 L80	P77-N79 PolarHBondContact O-N 2.9Å; P77-L80 HydrophobicContact CB-CD1 4.45Å; P77-L80 VanDerWaalsContact O-CB 3.31Å; P77-L80 WeakPolarHBondContact O-CB 3.39Å; P77-L80 PolarHBondContact O-N 3.39Å
78	V	46.9	Very low	49.7	Very low	28 Å²	28	49 Å²	49	17%	0.17	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-13.6	175	-174.6	0	0	0	0	111.9	A76 L81 T933 F934	A76-V78 PolarHBondContact O-N 3.38Å; V78-L81 WeakPolarHBondContact O-CB 3.44Å; V78-L81 PolarHBondContact O-N 3.04Å; V78-T933 VanDerWaalsContact CG2-O 3.32Å; V78-T933 WeakPolarHBondContact CG2-O 3.31Å; V78-F934 HydrophobicContact CG1-CD1 3.42Å; V78-F934 VanDerWaalsContact CG1-CD1 3.42Å; V78-F934 HydrophobicContact CG1-CE1 3.02Å; V78-F934 HydrophobicContact CG1-CE2 4.39Å; V78-F934 HydrophobicContact CG1-CG 4.27Å; V78-F934 HydrophobicContact CG1-CZ 3.57Å
79	N	49.2	Very low	49.8	Very low	17 Å²	17	47 Å²	47	9%	0.091	25%	0.251	C	S	.	.	H	α-helix	trans	-81.4	-15	174.2	-67.1	-38.1	0	0	0	114.5	F72 L73 A76 P77 L81 Y82 I83	F72-N79 WeakPolarHBondContact CB-ND2 3.38Å; F72-N79 PolarHBondContact O-ND2 3.37Å; L73-N79 HydrophobicContact CG-CB 4.12Å; A76-N79 PolarHBondContact O-N 3.37Å; P77-N79 PolarHBondContact O-N 2.9Å; N79-L81 PolarHBondContact O-N 3.49Å; N79-Y82 HydrophobicContact CB-CD2 4.34Å; N79-Y82 PolarHBondContact O-N 3.24Å; N79-Y82 VanDerWaalsContact OD1-CD2 3.23Å; N79-Y82 WeakPolarHBondContact OD1-CD2 3.2Å; N79-Y82 VanDerWaalsContact OD1-CE2 3.28Å; N79-Y82 WeakPolarHBondContact OD1-CE2 3.38Å; N79-I83 PolarHBondContact O-N 3.13Å
80	L	48.9	Very low	50.1	Low	38 Å²	38	46.9 Å²	46.9	20%	0.199	25%	0.25	C	S	.	.	H	α-helix	trans	-60.5	-29.3	167.2	-76.9	156.5	0	0	0	112.3	L73 P77 I83 L84 L126	L73-L80 HydrophobicContact CD2-CB 4.25Å; L73-L80 HydrophobicContact CD2-CD2 3.57Å; L73-L80 HydrophobicContact CD2-CG 3.49Å; L73-L80 VanDerWaalsContact CD2-CG 3.49Å; P77-L80 HydrophobicContact CB-CD1 4.45Å; P77-L80 VanDerWaalsContact O-CB 3.31Å; P77-L80 WeakPolarHBondContact O-CB 3.39Å; P77-L80 PolarHBondContact O-N 3.39Å; L80-I83 PolarHBondContact O-N 3.34Å; L80-L84 PolarHBondContact O-N 3.14Å; L80-L126 HydrophobicContact CD1-CD2 3.74Å; L80-L126 HydrophobicContact CD2-CD1 4.17Å; L80-L126 HydrophobicContact CD2-CD2 3.55Å; L80-L126 HydrophobicContact CD2-CG 3.59Å; L80-L126 HydrophobicContact CG-CD2 4.14Å
81	L	45.9	Very low	50.3	Low	40 Å²	40	45.2 Å²	45.2	21%	0.209	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-39.2	-177.7	-146.3	118.7	0	0	0	111.2	V78 N79 L84 L85 F934 W1039	V78-L81 WeakPolarHBondContact O-CB 3.44Å; V78-L81 PolarHBondContact O-N 3.04Å; N79-L81 PolarHBondContact O-N 3.49Å; L81-L84 WeakPolarHBondContact O-CB 3.38Å; L81-L84 PolarHBondContact O-N 3.03Å; L81-L85 PolarHBondContact O-N 3.24Å; L81-L85 VanDerWaalsContact O-N 3.14Å; L81-F934 HydrophobicContact CD2-CE1 4.39Å; L81-F934 HydrophobicContact CD2-CZ 4.18Å; L81-W1039 HydrophobicContact CB-CH2 4.19Å; L81-W1039 HydrophobicContact CB-CZ2 4.3Å; L81-W1039 HydrophobicContact CD1-CH2 4.16Å; L81-W1039 HydrophobicContact CD1-CZ2 3.42Å; L81-W1039 VanDerWaalsContact CD1-CZ2 3.42Å; L81-W1039 HydrophobicContact CD2-CD2 3.4Å; L81-W1039 HydrophobicContact CD2-CE3 3.63Å; L81-W1039 HydrophobicContact CD2-CG 4.25Å; L81-W1039 HydrophobicContact CD2-CH2 3.35Å; L81-W1039 HydrophobicContact CD2-CZ2 3.11Å; L81-W1039 HydrophobicContact CD2-CZ3 3.57Å; L81-W1039 HydrophobicContact CG-CD2 4.26Å; L81-W1039 VanDerWaalsContact CG-CE2 3.48Å; L81-W1039 HydrophobicContact CG-CE3 4.45Å; L81-W1039 HydrophobicContact CG-CH2 3.22Å; L81-W1039 HydrophobicContact CG-CZ2 2.97Å; L81-W1039 HydrophobicContact CG-CZ3 3.96Å
82	Y	51.3	Low	50.8	Low	25 Å²	25	44.8 Å²	44.8	10%	0.098	23%	0.232	C	C	.	.	H	α-helix	trans	-69.9	-36.4	174.2	-64	-62.3	0	0	0	112.6	Y22 N79 L84 L85 I86 F934 F1040	Y22-Y82 HydrophobicContact CD1-CG 4.45Å; Y22-Y82 HydrophobicContact CE1-CD1 4.19Å; Y22-Y82 AromaticContact CE1-CD2 3.74Å; Y22-Y82 HydrophobicContact CE1-CD2 3.74Å; Y22-Y82 HydrophobicContact CE1-CE1 4.33Å; Y22-Y82 AromaticContact CE1-CE2 3.96Å; Y22-Y82 HydrophobicContact CE1-CE2 3.96Å; Y22-Y82 AromaticContact CE1-CG 3.92Å; Y22-Y82 HydrophobicContact CE1-CG 3.92Å; Y22-Y82 HydrophobicContact CE2-CE1 4.29Å; Y22-Y82 AromaticContact CZ-CD2 3.99Å; Y22-Y82 AromaticContact CZ-CE2 3.7Å; Y22-Y82 AromaticContact CZ-CZ 3.69Å; Y22-Y82 WeakPolarHBondContact OH-CE2 3.29Å; Y22-Y82 PolarHBondContact OH-OH 3.39Å; N79-Y82 HydrophobicContact CB-CD2 4.34Å; N79-Y82 PolarHBondContact O-N 3.24Å; N79-Y82 VanDerWaalsContact OD1-CD2 3.23Å; N79-Y82 WeakPolarHBondContact OD1-CD2 3.2Å; N79-Y82 VanDerWaalsContact OD1-CE2 3.28Å; N79-Y82 WeakPolarHBondContact OD1-CE2 3.38Å; Y82-L84 VanDerWaalsContact C-N 3.33Å; Y82-L84 PolarHBondContact O-N 2.85Å; Y82-L85 WeakPolarHBondContact O-CB 3.48Å; Y82-L85 PolarHBondContact O-N 3.43Å; Y82-I86 VanDerWaalsContact O-CG1 3.29Å; Y82-I86 WeakPolarHBondContact O-CG1 3.36Å; Y82-I86 PolarHBondContact O-N 3.5Å; Y82-F934 WeakPolarHBondContact OH-CD1 3.45Å; Y82-F934 WeakPolarHBondContact OH-CE1 3.11Å; Y82-F1040 HydrophobicContact CE1-CE1 4Å; Y82-F1040 HydrophobicContact CE1-CZ 4.42Å
83	I	54.6	Low	51.5	Low	19 Å²	19	39.2 Å²	39.2	10%	0.097	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-44.4	172	-74	-168.9	0	0	0	110.8	L66 L69 L73 N79 L80 L85 I86 N87 I122	L66-I83 HydrophobicContact CD1-CD1 4.45Å; L69-I83 HydrophobicContact CB-CG1 4.24Å; L69-I83 HydrophobicContact CD1-CG1 3.85Å; L73-I83 HydrophobicContact CD1-CD1 3.17Å; L73-I83 HydrophobicContact CD1-CG1 3.99Å; L73-I83 HydrophobicContact CD2-CD1 4.29Å; L73-I83 HydrophobicContact CG-CD1 4.31Å; N79-I83 PolarHBondContact O-N 3.13Å; L80-I83 PolarHBondContact O-N 3.34Å; I83-L85 VanDerWaalsContact C-N 3.31Å; I83-L85 PolarHBondContact O-N 3.13Å; I83-I86 PolarHBondContact O-N 3.46Å; I83-N87 WeakPolarHBondContact CG2-ND2 3.29Å; I83-N87 WeakPolarHBondContact O-CB 3.35Å; I83-N87 PolarHBondContact O-N 3.38Å; I83-N87 PolarHBondContact O-ND2 3.06Å; I83-I122 HydrophobicContact CG2-CG2 4.25Å
84	L	48.9	Very low	52	Low	45 Å²	45	38.3 Å²	38.3	24%	0.236	20%	0.203	C	C	.	.	H	α-helix	trans	-60.5	-43.9	177.6	-166	87.2	0	0	0	111.1	L80 L81 Y82 N87 C88 W1039 L1052	L80-L84 PolarHBondContact O-N 3.14Å; L81-L84 WeakPolarHBondContact O-CB 3.38Å; L81-L84 PolarHBondContact O-N 3.03Å; Y82-L84 VanDerWaalsContact C-N 3.33Å; Y82-L84 PolarHBondContact O-N 2.85Å; L84-N87 PolarHBondContact O-N 3.48Å; L84-C88 WeakPolarHBondContact O-CB 2.85Å; L84-C88 PolarHBondContact O-N 2.95Å; L84-C88 PolarHBondContact O-SG 2.79Å; L84-C88 VanDerWaalsContact O-SG 3.37Å; L84-W1039 HydrophobicContact CD2-CH2 4.24Å; L84-L1052 HydrophobicContact CD2-CD1 4.37Å
85	L	50.5	Low	52.5	Low	27 Å²	27	31.1 Å²	31.1	14%	0.141	18%	0.181	C	C	.	.	H	α-helix	trans	-63.2	-45.1	179.8	-122.5	163.6	0	0	0	112.8	L81 Y82 I83 N87 C88 F89 I1036 W1039 F1040	L81-L85 PolarHBondContact O-N 3.24Å; L81-L85 VanDerWaalsContact O-N 3.14Å; Y82-L85 WeakPolarHBondContact O-CB 3.48Å; Y82-L85 PolarHBondContact O-N 3.43Å; I83-L85 VanDerWaalsContact C-N 3.31Å; I83-L85 PolarHBondContact O-N 3.13Å; L85-N87 VanDerWaalsContact C-N 3.33Å; L85-C88 PolarHBondContact O-N 3.32Å; L85-F89 WeakPolarHBondContact O-CB 3.22Å; L85-F89 PolarHBondContact O-N 3.13Å; L85-I1036 HydrophobicContact CD2-CG2 3.97Å; L85-W1039 HydrophobicContact CB-CZ3 4.35Å; L85-W1039 HydrophobicContact CD1-CE3 3.48Å; L85-W1039 VanDerWaalsContact CD1-CE3 3.48Å; L85-W1039 HydrophobicContact CD1-CZ3 3.35Å; L85-W1039 HydrophobicContact CG-CE3 4.17Å; L85-W1039 HydrophobicContact CG-CZ3 3.68Å; L85-F1040 HydrophobicContact CD1-CE2 4.07Å; L85-F1040 HydrophobicContact CD1-CZ 4Å
86	I	58.5	Low	53.4	Low	6 Å²	6	28.4 Å²	28.4	3%	0.031	16%	0.157	C	C	.	.	H	α-helix	trans	-64.6	-40.7	177.7	-68.1	164.5	0	0	0	110.5	I19 V23 F27 A65 L69 Y82 I83 F89 L90	I19-I86 HydrophobicContact CG2-CG1 4.03Å; V23-I86 HydrophobicContact CG2-CD1 3.58Å; V23-I86 HydrophobicContact CG2-CG1 4.38Å; F27-I86 HydrophobicContact CE2-CG2 4.29Å; F27-I86 HydrophobicContact CZ-CG2 4.42Å; A65-I86 HydrophobicContact CB-CD1 3.95Å; A65-I86 HydrophobicContact CB-CG2 3.66Å; L69-I86 HydrophobicContact CD1-CD1 3.35Å; Y82-I86 VanDerWaalsContact O-CG1 3.29Å; Y82-I86 WeakPolarHBondContact O-CG1 3.36Å; Y82-I86 PolarHBondContact O-N 3.5Å; I83-I86 PolarHBondContact O-N 3.46Å; I86-F89 PolarHBondContact O-N 3.33Å; I86-L90 HydrophobicContact CG2-CD1 3.77Å; I86-L90 HydrophobicContact CG2-CG 4.3Å; I86-L90 WeakPolarHBondContact O-CB 3.21Å; I86-L90 VanDerWaalsContact O-CG 3.26Å; I86-L90 WeakPolarHBondContact O-CG 3.4Å; I86-L90 PolarHBondContact O-N 3.35Å
87	N	54.6	Low	54.2	Low	14 Å²	14	27 Å²	27	8%	0.075	15%	0.145	C	C	.	.	H	α-helix	trans	-68.7	-37.5	176.8	-75.5	-55.2	0	0	0	112.7	E62 I83 L84 L85 L90 C91 I122	E62-N87 PolarHBondContact OE1-OD1 2.83Å; I83-N87 WeakPolarHBondContact CG2-ND2 3.29Å; I83-N87 WeakPolarHBondContact O-CB 3.35Å; I83-N87 PolarHBondContact O-N 3.38Å; I83-N87 PolarHBondContact O-ND2 3.06Å; L84-N87 PolarHBondContact O-N 3.48Å; L85-N87 VanDerWaalsContact C-N 3.33Å; N87-L90 PolarHBondContact O-N 2.62Å; N87-C91 WeakPolarHBondContact O-CB 3.48Å; N87-C91 PolarHBondContact O-N 2.8Å; N87-C91 PolarHBondContact O-SG 3.45Å; N87-I122 HydrophobicContact CB-CD1 3.71Å; N87-I122 VanDerWaalsContact CG-CD1 3.4Å; N87-I122 WeakPolarHBondContact ND2-CD1 3.21Å
88	C	50.6	Low	54.8	Low	32 Å²	32	24.3 Å²	24.3	22%	0.216	13%	0.127	C	C	.	.	H	α-helix	trans	-62.9	-40.7	171.7	-76	0	0	0	0	112.3	L84 L85 H92	L84-C88 WeakPolarHBondContact O-CB 2.85Å; L84-C88 PolarHBondContact O-N 2.95Å; L84-C88 PolarHBondContact O-SG 2.79Å; L84-C88 VanDerWaalsContact O-SG 3.37Å; L85-C88 PolarHBondContact O-N 3.32Å; C88-H92 PolarHBondContact O-N 3.4Å; C88-H92 PolarHBondContact O-ND1 3.38Å
89	F	57.1	Low	55.4	Low	8 Å²	8	29 Å²	29	4%	0.035	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-45.6	174.5	168.6	-96.3	0	0	0	112	T15 A16 I19 F27 L31 L85 I86 C91 H92 Y93	T15-F89 WeakPolarHBondContact OG1-CD2 3.42Å; T15-F89 WeakPolarHBondContact OG1-CE2 3.39Å; A16-F89 HydrophobicContact CB-CE2 4.29Å; A16-F89 HydrophobicContact CB-CZ 3.85Å; I19-F89 HydrophobicContact CD1-CB 3.44Å; I19-F89 VanDerWaalsContact CD1-CB 3.44Å; I19-F89 HydrophobicContact CD1-CD1 3.48Å; I19-F89 VanDerWaalsContact CD1-CD1 3.48Å; I19-F89 HydrophobicContact CD1-CD2 3.61Å; I19-F89 HydrophobicContact CD1-CE1 4.11Å; I19-F89 HydrophobicContact CD1-CE2 4.22Å; I19-F89 HydrophobicContact CD1-CG 3.19Å; I19-F89 HydrophobicContact CD1-CZ 4.44Å; F27-F89 HydrophobicContact CE1-CD1 4.31Å; F27-F89 AromaticContact CE1-CE1 3.82Å; F27-F89 HydrophobicContact CE1-CE1 3.82Å; F27-F89 HydrophobicContact CZ-CD1 4.02Å; F27-F89 AromaticContact CZ-CE1 3.85Å; F27-F89 HydrophobicContact CZ-CE1 3.85Å; L31-F89 HydrophobicContact CD1-CE1 3.71Å; L31-F89 HydrophobicContact CD1-CZ 4.05Å; L85-F89 WeakPolarHBondContact O-CB 3.22Å; L85-F89 PolarHBondContact O-N 3.13Å; I86-F89 PolarHBondContact O-N 3.33Å; F89-C91 VanDerWaalsContact C-N 3.29Å; F89-C91 PolarHBondContact O-N 3.16Å; F89-H92 CarbonylContact O-C 3.3Å; F89-H92 PolarHBondContact O-N 3.43Å; F89-H92 VanDerWaalsContact O-N 3.09Å; F89-Y93 WeakPolarHBondContact O-CB 3.42Å; F89-Y93 PolarHBondContact O-N 2.86Å
90	L	59.5	Low	56.2	Low	1 Å²	1	30.9 Å²	30.9	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-35.3	177.8	-72.1	170.5	0	0	0	112.2	F27 I58 A61 E62 I86 N87 Y93 L94	F27-L90 HydrophobicContact CE2-CD2 4.39Å; F27-L90 HydrophobicContact CZ-CD2 4.22Å; I58-L90 HydrophobicContact CG2-CB 4.24Å; A61-L90 HydrophobicContact CB-CD1 4.09Å; A61-L90 HydrophobicContact CB-CD2 3.47Å; A61-L90 VanDerWaalsContact CB-CD2 3.47Å; A61-L90 HydrophobicContact CB-CG 4.44Å; E62-L90 HydrophobicContact CB-CD1 4.44Å; E62-L90 HydrophobicContact CG-CD1 3.54Å; I86-L90 HydrophobicContact CG2-CD1 3.77Å; I86-L90 HydrophobicContact CG2-CG 4.3Å; I86-L90 WeakPolarHBondContact O-CB 3.21Å; I86-L90 VanDerWaalsContact O-CG 3.26Å; I86-L90 WeakPolarHBondContact O-CG 3.4Å; I86-L90 PolarHBondContact O-N 3.35Å; N87-L90 PolarHBondContact O-N 2.62Å; L90-Y93 PolarHBondContact O-N 3.45Å; L90-L94 PolarHBondContact O-N 2.83Å
91	C	54.7	Low	57.1	Low	12 Å²	12	29.9 Å²	29.9	8%	0.081	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-45.4	169.5	-75	0	0	0	0	112.2	N87 F89 Y93 L94 V95 P114 T115	N87-C91 WeakPolarHBondContact O-CB 3.48Å; N87-C91 PolarHBondContact O-N 2.8Å; N87-C91 PolarHBondContact O-SG 3.45Å; F89-C91 VanDerWaalsContact C-N 3.29Å; F89-C91 PolarHBondContact O-N 3.16Å; C91-Y93 VanDerWaalsContact C-N 3.33Å; C91-Y93 PolarHBondContact O-N 2.69Å; C91-L94 WeakPolarHBondContact O-CB 3.46Å; C91-L94 PolarHBondContact O-N 3.44Å; C91-V95 VanDerWaalsContact O-CG2 3.27Å; C91-V95 WeakPolarHBondContact O-CG2 3.45Å; C91-V95 PolarHBondContact O-N 3.2Å; C91-P114 PolarHBondContact SG-O 2.8Å; C91-T115 HydrophobicContact CB-CG2 4.36Å
92	H	55.8	Low	57.6	Low	80 Å²	80	32.1 Å²	32.1	37%	0.37	17%	0.172	S	C	.	.	H	α-helix	trans	-64.9	-38.2	176.6	-81.4	63.9	0	0	0	112	Y11 C88 F89 V95 W96	Y11-H92 HydrophobicContact CE1-CB 4.47Å; C88-H92 PolarHBondContact O-N 3.4Å; C88-H92 PolarHBondContact O-ND1 3.38Å; F89-H92 CarbonylContact O-C 3.3Å; F89-H92 PolarHBondContact O-N 3.43Å; F89-H92 VanDerWaalsContact O-N 3.09Å; H92-V95 PolarHBondContact O-N 3.31Å; H92-W96 VanDerWaalsContact O-CB 3.28Å; H92-W96 WeakPolarHBondContact O-CB 3.43Å; H92-W96 PolarHBondContact O-N 3.31Å
93	Y	61.1	Low	57.8	Low	8 Å²	8	31 Å²	31	3%	0.031	17%	0.168	C	C	.	.	H	α-helix	trans	-63	-41.3	174.8	-174.2	-98.3	0	0	0	111.7	L31 H34 I58 F89 L90 C91 W96 S97	L31-Y93 HydrophobicContact CB-CE2 4.43Å; L31-Y93 HydrophobicContact CD2-CD1 3.74Å; L31-Y93 HydrophobicContact CD2-CD2 4.03Å; L31-Y93 HydrophobicContact CD2-CE1 3.45Å; L31-Y93 VanDerWaalsContact CD2-CE1 3.45Å; L31-Y93 HydrophobicContact CD2-CE2 3.75Å; L31-Y93 HydrophobicContact CD2-CG 4.01Å; L31-Y93 VanDerWaalsContact CD2-CZ 3.43Å; L31-Y93 PolarHBondContact O-OH 3.45Å; H34-Y93 AromaticContact CE1-CE1 3.85Å; H34-Y93 AromaticContact ND1-CE1 3.49Å; H34-Y93 WeakPolarHBondContact ND1-CE1 3.46Å; H34-Y93 AromaticContact ND1-CZ 3.47Å; H34-Y93 PolarHBondContact ND1-OH 3.11Å; I58-Y93 HydrophobicContact CG1-CD1 4.21Å; F89-Y93 WeakPolarHBondContact O-CB 3.42Å; F89-Y93 PolarHBondContact O-N 2.86Å; L90-Y93 PolarHBondContact O-N 3.45Å; C91-Y93 VanDerWaalsContact C-N 3.33Å; C91-Y93 PolarHBondContact O-N 2.69Å; Y93-W96 AromaticContact CD2-CE3 3.97Å; Y93-W96 HydrophobicContact CD2-CE3 3.97Å; Y93-W96 HydrophobicContact CD2-CZ3 4.13Å; Y93-W96 AromaticContact CE2-CE3 3.94Å; Y93-W96 HydrophobicContact CE2-CE3 3.94Å; Y93-W96 AromaticContact CE2-CZ3 3.66Å; Y93-W96 HydrophobicContact CE2-CZ3 3.66Å; Y93-W96 PolarHBondContact O-N 2.85Å; Y93-S97 WeakPolarHBondContact O-CB 3.44Å; Y93-S97 PolarHBondContact O-N 2.87Å; Y93-S97 PolarHBondContact O-OG 3.46Å
94	L	59.7	Low	57.2	Low	9 Å²	9	34.6 Å²	34.6	5%	0.047	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-53.8	173.4	-171.7	139.7	0	0	0	111	L55 I58 L90 C91 W96 S97 V98 P114	L55-L94 HydrophobicContact CD2-CD1 4.05Å; I58-L94 HydrophobicContact CD1-CB 3.42Å; I58-L94 VanDerWaalsContact CD1-CB 3.42Å; I58-L94 HydrophobicContact CD1-CD1 3.37Å; I58-L94 HydrophobicContact CD1-CG 3.71Å; L90-L94 PolarHBondContact O-N 2.83Å; C91-L94 WeakPolarHBondContact O-CB 3.46Å; C91-L94 PolarHBondContact O-N 3.44Å; L94-W96 PolarHBondContact O-N 2.81Å; L94-S97 PolarHBondContact O-N 3.28Å; L94-S97 VanDerWaalsContact O-N 3.09Å; L94-S97 PolarHBondContact O-OG 3.39Å; L94-V98 HydrophobicContact CD2-CG2 3.88Å; L94-V98 HydrophobicContact CG-CG2 4.46Å; L94-V98 WeakPolarHBondContact O-CG2 3.43Å; L94-V98 PolarHBondContact O-N 2.9Å; L94-P114 HydrophobicContact CB-CG 4.38Å; L94-P114 HydrophobicContact CD1-CB 3.92Å; L94-P114 HydrophobicContact CD1-CG 3.6Å; L94-P114 HydrophobicContact CD2-CB 4.41Å; L94-P114 HydrophobicContact CD2-CG 3.32Å; L94-P114 HydrophobicContact CG-CG 3.91Å
95	V	56.3	Low	56.9	Low	46 Å²	46	36 Å²	36	28%	0.279	23%	0.225	S	C	.	.	H	α-helix	trans	-55.1	-43.5	179.9	171.9	0	0	0	0	110.4	C91 H92 V98 L99 L111	C91-V95 VanDerWaalsContact O-CG2 3.27Å; C91-V95 WeakPolarHBondContact O-CG2 3.45Å; C91-V95 PolarHBondContact O-N 3.2Å; H92-V95 PolarHBondContact O-N 3.31Å; V95-V98 PolarHBondContact O-N 3.44Å; V95-L99 HydrophobicContact CG1-CD1 3.9Å; V95-L99 VanDerWaalsContact O-CG 3.29Å; V95-L99 WeakPolarHBondContact O-CG 3.35Å; V95-L99 PolarHBondContact O-N 3.34Å; V95-L111 HydrophobicContact CB-CD2 3.96Å; V95-L111 HydrophobicContact CG1-CD2 3.86Å; V95-L111 HydrophobicContact CG2-CD2 3.73Å
96	W	63.4	Low	56.7	Low	35 Å²	35	37.3 Å²	37.3	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-63.6	-45.3	176.5	177.2	66.5	0	0	0	113.2	I12 Y35 H92 Y93 L94 V98 L99 E100	I12-W96 HydrophobicContact CD1-CB 3.92Å; I12-W96 VanDerWaalsContact CD1-CD1 3.49Å; I12-W96 HydrophobicContact CD1-CD2 3.19Å; I12-W96 HydrophobicContact CD1-CE3 3.78Å; I12-W96 HydrophobicContact CD1-CG 3.26Å; I12-W96 HydrophobicContact CD1-CH2 4.35Å; I12-W96 HydrophobicContact CD1-CZ2 3.86Å; I12-W96 HydrophobicContact CD1-CZ3 4.33Å; I12-W96 HydrophobicContact CG2-CH2 4.39Å; I12-W96 HydrophobicContact CG2-CZ3 4.32Å; Y35-W96 AromaticContact CD2-CH2 3.44Å; Y35-W96 HydrophobicContact CD2-CH2 3.44Å; Y35-W96 VanDerWaalsContact CD2-CH2 3.44Å; Y35-W96 HydrophobicContact CD2-CZ2 4.45Å; Y35-W96 AromaticContact CD2-CZ3 3.68Å; Y35-W96 HydrophobicContact CD2-CZ3 3.68Å; Y35-W96 AromaticContact CE2-CH2 3.24Å; Y35-W96 HydrophobicContact CE2-CH2 3.24Å; Y35-W96 AromaticContact CE2-CZ2 3.85Å; Y35-W96 HydrophobicContact CE2-CZ2 3.85Å; Y35-W96 AromaticContact CE2-CZ3 3.9Å; Y35-W96 HydrophobicContact CE2-CZ3 3.9Å; Y35-W96 HydrophobicContact CG-CH2 4.48Å; H92-W96 VanDerWaalsContact O-CB 3.28Å; H92-W96 WeakPolarHBondContact O-CB 3.43Å; H92-W96 PolarHBondContact O-N 3.31Å; Y93-W96 AromaticContact CD2-CE3 3.97Å; Y93-W96 HydrophobicContact CD2-CE3 3.97Å; Y93-W96 HydrophobicContact CD2-CZ3 4.13Å; Y93-W96 AromaticContact CE2-CE3 3.94Å; Y93-W96 HydrophobicContact CE2-CE3 3.94Å; Y93-W96 AromaticContact CE2-CZ3 3.66Å; Y93-W96 HydrophobicContact CE2-CZ3 3.66Å; Y93-W96 PolarHBondContact O-N 2.85Å; L94-W96 PolarHBondContact O-N 2.81Å; W96-V98 VanDerWaalsContact C-N 3.3Å; W96-V98 PolarHBondContact O-N 2.85Å; W96-L99 PolarHBondContact O-N 3.41Å; W96-E100 WeakPolarHBondContact CH2-OE2 3.46Å; W96-E100 WeakPolarHBondContact CZ2-OE2 3.27Å; W96-E100 PolarHBondContact NE1-OE2 2.99Å; W96-E100 WeakPolarHBondContact O-CB 3.42Å; W96-E100 PolarHBondContact O-N 3.45Å
97	S	64.1	Low	55.9	Low	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-63.2	-36.6	177.3	69.5	0	0	0	0	112.4	T54 Y93 L94 F101	T54-S97 WeakPolarHBondContact CG2-OG 3.45Å; Y93-S97 WeakPolarHBondContact O-CB 3.44Å; Y93-S97 PolarHBondContact O-N 2.87Å; Y93-S97 PolarHBondContact O-OG 3.46Å; L94-S97 PolarHBondContact O-N 3.28Å; L94-S97 VanDerWaalsContact O-N 3.09Å; L94-S97 PolarHBondContact O-OG 3.39Å; S97-F101 WeakPolarHBondContact O-CB 3.11Å; S97-F101 WeakPolarHBondContact O-CD2 3.2Å; S97-F101 PolarHBondContact O-N 3.42Å
98	V	60	Low	55.2	Low	21 Å²	21	50.4 Å²	50.4	13%	0.127	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-40.2	175.4	176.6	0	0	0	0	111.4	L94 V95 W96 L103 L111	L94-V98 HydrophobicContact CD2-CG2 3.88Å; L94-V98 HydrophobicContact CG-CG2 4.46Å; L94-V98 WeakPolarHBondContact O-CG2 3.43Å; L94-V98 PolarHBondContact O-N 2.9Å; V95-V98 PolarHBondContact O-N 3.44Å; W96-V98 VanDerWaalsContact C-N 3.3Å; W96-V98 PolarHBondContact O-N 2.85Å; V98-L103 HydrophobicContact CB-CD1 4.49Å; V98-L103 HydrophobicContact CG1-CB 4.1Å; V98-L103 HydrophobicContact CG2-CD1 4.31Å; V98-L103 PolarHBondContact O-N 3.32Å; V98-L111 HydrophobicContact CB-CD1 4.43Å; V98-L111 HydrophobicContact CB-CD2 4.2Å; V98-L111 HydrophobicContact CB-CG 4.34Å; V98-L111 HydrophobicContact CG1-CD1 3.59Å; V98-L111 HydrophobicContact CG1-CD2 4.23Å; V98-L111 HydrophobicContact CG1-CG 3.88Å
99	L	58.7	Low	54.7	Low	125 Å²	125	50.7 Å²	50.7	65%	0.654	29%	0.29	S	S	*	.	H	α-helix	trans	-73.1	-47.6	178.6	-70.8	168.4	0	0	0	113	V95 W96 S102	V95-L99 HydrophobicContact CG1-CD1 3.9Å; V95-L99 VanDerWaalsContact O-CG 3.29Å; V95-L99 WeakPolarHBondContact O-CG 3.35Å; V95-L99 PolarHBondContact O-N 3.34Å; W96-L99 PolarHBondContact O-N 3.41Å; L99-S102 PolarHBondContact O-N 3.04Å
100	E	66.9	Low	53.8	Low	58 Å²	58	52.2 Å²	52.2	27%	0.271	30%	0.3	S	S	.	.	H	α-helix	trans	-71.4	-35.7	-174.3	-173.6	166.3	-163.5	0	0	112.8	R9 Y35 W96 S102	R9-E100 IonicContact CZ-OE1 3.97Å; R9-E100 IonicContact NE-OE1 3.13Å; R9-E100 IonicContact NH2-OE1 2.63Å; R9-E100 PolarHBondContact NH2-OE1 3.01Å; Y35-E100 WeakPolarHBondContact CE2-OE2 3.23Å; Y35-E100 PolarHBondContact OH-OE1 3.45Å; W96-E100 WeakPolarHBondContact CH2-OE2 3.46Å; W96-E100 WeakPolarHBondContact CZ2-OE2 3.27Å; W96-E100 PolarHBondContact NE1-OE2 2.99Å; W96-E100 WeakPolarHBondContact O-CB 3.42Å; W96-E100 PolarHBondContact O-N 3.45Å; E100-S102 PolarHBondContact O-N 3.38Å
101	F	66.6	Low	52.9	Low	17 Å²	17	54 Å²	54	8%	0.075	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	12.5	178.7	-62.4	-65.6	0	0	0	113.6	Y35 C38 L50 S97 L103	Y35-F101 HydrophobicContact CD2-CZ 4.13Å; Y35-F101 HydrophobicContact CE2-CZ 4.15Å; C38-F101 HydrophobicContact CB-CD1 4.12Å; C38-F101 HydrophobicContact CB-CD2 3.85Å; C38-F101 HydrophobicContact CB-CE1 3.59Å; C38-F101 HydrophobicContact CB-CE2 3.31Å; C38-F101 HydrophobicContact CB-CG 4.26Å; C38-F101 HydrophobicContact CB-CZ 3.18Å; L50-F101 HydrophobicContact CD2-CB 3.24Å; L50-F101 HydrophobicContact CD2-CD1 3.88Å; L50-F101 HydrophobicContact CD2-CD2 3.89Å; L50-F101 HydrophobicContact CD2-CG 3.39Å; S97-F101 WeakPolarHBondContact O-CB 3.11Å; S97-F101 WeakPolarHBondContact O-CD2 3.2Å; S97-F101 PolarHBondContact O-N 3.42Å; F101-L103 HydrophobicContact CB-CD1 4.45Å; F101-L103 PolarHBondContact O-N 3.21Å
102	S	57.1	Low	52.2	Low	86 Å²	86	56.2 Å²	56.2	60%	0.601	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	47.6	176.5	59.4	0	0	0	0	112.4	L99 E100 A104	L99-S102 PolarHBondContact O-N 3.04Å; E100-S102 PolarHBondContact O-N 3.38Å; S102-A104 PolarHBondContact O-N 3.05Å
103	L	55.6	Low	51.3	Low	3 Å²	3	54 Å²	54	2%	0.016	31%	0.309	C	S	.	.			trans	-69.1	26.2	175.6	-78.4	158	0	0	0	112.1	N47 L50 L51 V98 F101 G105 I106	N47-L103 HydrophobicContact CB-CD2 3.93Å; N47-L103 WeakPolarHBondContact O-CD2 3.2Å; L50-L103 HydrophobicContact CB-CD2 4.2Å; L51-L103 HydrophobicContact CB-CD2 4.47Å; L51-L103 HydrophobicContact CD1-CD1 4.47Å; V98-L103 HydrophobicContact CB-CD1 4.49Å; V98-L103 HydrophobicContact CG1-CB 4.1Å; V98-L103 HydrophobicContact CG2-CD1 4.31Å; V98-L103 PolarHBondContact O-N 3.32Å; F101-L103 HydrophobicContact CB-CD1 4.45Å; F101-L103 PolarHBondContact O-N 3.21Å; L103-G105 PolarHBondContact O-N 3.42Å; L103-I106 HydrophobicContact CB-CD1 4.45Å; L103-I106 HydrophobicContact CD2-CD1 4.31Å; L103-I106 WeakPolarHBondContact O-CG1 3.35Å; L103-I106 PolarHBondContact O-N 3.48Å
104	A	41.1	Very low	50.2	Low	94 Å²	94	54.4 Å²	54.4	78%	0.777	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	11.1	-163.5	0	0	0	0	0	116.2	S102	S102-A104 PolarHBondContact O-N 3.05Å
105	G	43.6	Very low	49.2	Very low	73 Å²	73	57 Å²	57	75%	0.753	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-4.3	166.7	0	0	0	0	0	113.3	L103	L103-G105 PolarHBondContact O-N 3.42Å
106	I	45.3	Very low	48.3	Very low	56 Å²	56	58 Å²	58	29%	0.287	33%	0.329	S	S	.	.	S	Bend	trans	-102.6	120.4	-174.3	-54.9	175.5	0	0	0	107.5	L51 L103 V110	L51-I106 HydrophobicContact CD1-CD1 3.89Å; L51-I106 HydrophobicContact CD2-CD1 4.09Å; L51-I106 HydrophobicContact CG-CD1 4.43Å; L103-I106 HydrophobicContact CB-CD1 4.45Å; L103-I106 HydrophobicContact CD2-CD1 4.31Å; L103-I106 WeakPolarHBondContact O-CG1 3.35Å; L103-I106 PolarHBondContact O-N 3.48Å; I106-V110 HydrophobicContact CG2-CB 3.4Å; I106-V110 HydrophobicContact CG2-CG1 3.79Å; I106-V110 HydrophobicContact CG2-CG2 3.32Å
107	E	41.8	Very low	47.1	Very low	130 Å²	130	57.4 Å²	57.4	61%	0.607	33%	0.33	S	S	*	.			trans	-46.5	142.3	-179.4	-66.7	175.4	151.7	0	0	111.1	E109 V110	E107-E109 HydrophobicContact CB-CB 4.24Å; E107-E109 HydrophobicContact CB-CG 4.13Å; E107-E109 PolarHBondContact O-N 2.98Å; E107-V110 PolarHBondContact O-N 3.16Å
108	H	40.1	Very low	46	Very low	165 Å²	165	57.8 Å²	57.8	76%	0.764	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.4	-20.4	173.2	-85.7	-75.5	0	0	0	113.6	V110 L111	H108-V110 PolarHBondContact O-N 3.41Å; H108-L111 PolarHBondContact O-N 3.46Å
109	E	39.2	Very low	45.1	Very low	37 Å²	37	59.9 Å²	59.9	17%	0.173	34%	0.344	C	S	.	.	H	α-helix	trans	-62.3	-28.5	175.4	-51.4	-165.1	164	0	0	114.2	E107 L163 L166	E107-E109 HydrophobicContact CB-CB 4.24Å; E107-E109 HydrophobicContact CB-CG 4.13Å; E107-E109 PolarHBondContact O-N 2.98Å; E109-L163 HydrophobicContact CB-CD1 4.43Å; E109-L163 HydrophobicContact CG-CD1 4.01Å; E109-L166 HydrophobicContact CB-CD1 3.99Å; E109-L166 HydrophobicContact CB-CD2 3.82Å; E109-L166 HydrophobicContact CB-CG 4.45Å; E109-L166 WeakPolarHBondContact O-CD2 3.17Å
110	V	38.7	Very low	44.2	Very low	41 Å²	41	56.2 Å²	56.2	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-84.6	-15.3	-179.6	179.1	0	0	0	0	113.4	I106 E107 H108 I113	I106-V110 HydrophobicContact CG2-CB 3.4Å; I106-V110 HydrophobicContact CG2-CG1 3.79Å; I106-V110 HydrophobicContact CG2-CG2 3.32Å; E107-V110 PolarHBondContact O-N 3.16Å; H108-V110 PolarHBondContact O-N 3.41Å; V110-I113 HydrophobicContact CB-CD1 4.32Å; V110-I113 HydrophobicContact CG1-CD1 4.18Å; V110-I113 HydrophobicContact CG2-CD1 4.35Å; V110-I113 WeakPolarHBondContact O-CB 3.28Å
111	L	40.7	Very low	42.9	Very low	39 Å²	39	55 Å²	55	20%	0.204	32%	0.323	C	S	.	.	H	α-helix	trans	-80	-23.3	171.2	-97.7	142	0	0	0	112.4	V95 V98 H108	V95-L111 HydrophobicContact CB-CD2 3.96Å; V95-L111 HydrophobicContact CG1-CD2 3.86Å; V95-L111 HydrophobicContact CG2-CD2 3.73Å; V98-L111 HydrophobicContact CB-CD1 4.43Å; V98-L111 HydrophobicContact CB-CD2 4.2Å; V98-L111 HydrophobicContact CB-CG 4.34Å; V98-L111 HydrophobicContact CG1-CD1 3.59Å; V98-L111 HydrophobicContact CG1-CD2 4.23Å; V98-L111 HydrophobicContact CG1-CG 3.88Å; H108-L111 PolarHBondContact O-N 3.46Å
112	E	40	Very low	41.7	Very low	58 Å²	58	55.1 Å²	55.1	27%	0.271	33%	0.325	S	S	.	.	H	α-helix	trans	-71.2	-40.4	177	-70	-171.8	170.8	0	0	110.8	T115 F116 L163	E112-T115 PolarHBondContact O-N 3.21Å; E112-T115 VanDerWaalsContact O-N 3.15Å; E112-T115 PolarHBondContact O-OG1 3.01Å; E112-F116 HydrophobicContact CB-CD2 3.81Å; E112-F116 HydrophobicContact CB-CE2 3.92Å; E112-F116 HydrophobicContact CG-CE2 4.25Å; E112-F116 WeakPolarHBondContact O-CD2 3.4Å; E112-F116 PolarHBondContact O-N 3.23Å; E112-F116 VanDerWaalsContact O-N 3.16Å; E112-L163 WeakPolarHBondContact OE2-CD1 3.26Å
113	I	37.9	Very low	41	Very low	34 Å²	34	51.5 Å²	51.5	17%	0.174	30%	0.299	C	S	.	.	H	α-helix	trans	-30.2	-77.3	174.6	-75.3	-177.3	0	0	0	112.4	V110 T115 F116 S117 L166 F170	V110-I113 HydrophobicContact CB-CD1 4.32Å; V110-I113 HydrophobicContact CG1-CD1 4.18Å; V110-I113 HydrophobicContact CG2-CD1 4.35Å; V110-I113 WeakPolarHBondContact O-CB 3.28Å; I113-T115 VanDerWaalsContact C-N 3.26Å; I113-T115 PolarHBondContact O-N 3.2Å; I113-F116 WeakPolarHBondContact O-CA 3.42Å; I113-F116 PolarHBondContact O-N 2.88Å; I113-S117 PolarHBondContact O-N 3.39Å; I113-S117 VanDerWaalsContact O-N 3.11Å; I113-L166 HydrophobicContact CD1-CD2 3.57Å; I113-L166 HydrophobicContact CD1-CG 4.39Å; I113-L166 HydrophobicContact CG1-CD2 3.74Å; I113-F170 VanDerWaalsContact C-CE1 3.46Å; I113-F170 HydrophobicContact CB-CD2 3.58Å; I113-F170 HydrophobicContact CB-CE1 4.37Å; I113-F170 HydrophobicContact CB-CE2 3.49Å; I113-F170 VanDerWaalsContact CB-CE2 3.49Å; I113-F170 HydrophobicContact CB-CG 4.14Å; I113-F170 HydrophobicContact CB-CZ 3.82Å; I113-F170 HydrophobicContact CD1-CD2 3.94Å; I113-F170 HydrophobicContact CD1-CG 4.46Å; I113-F170 HydrophobicContact CG1-CB 4.21Å; I113-F170 HydrophobicContact CG1-CD1 4.44Å; I113-F170 HydrophobicContact CG1-CD2 3.49Å; I113-F170 VanDerWaalsContact CG1-CD2 3.49Å; I113-F170 HydrophobicContact CG1-CE2 3.98Å; I113-F170 HydrophobicContact CG1-CG 3.77Å; I113-F170 HydrophobicContact CG1-CZ 4.49Å; I113-F170 HydrophobicContact CG2-CD2 3.24Å; I113-F170 HydrophobicContact CG2-CE2 2.88Å; I113-F170 HydrophobicContact CG2-CG 4.27Å; I113-F170 HydrophobicContact CG2-CZ 3.59Å; I113-F170 WeakPolarHBondContact O-CE1 3.29Å; I113-F170 WeakPolarHBondContact O-CZ 3.44Å
114	P	36.8	Very low	40.2	Very low	15 Å²	15	55.1 Å²	55.1	10%	0.097	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-26.6	-169.9	22	-27.1	0	0	0	115	C91 L94 F116 S117 S118	C91-P114 PolarHBondContact SG-O 2.8Å; L94-P114 HydrophobicContact CB-CG 4.38Å; L94-P114 HydrophobicContact CD1-CB 3.92Å; L94-P114 HydrophobicContact CD1-CG 3.6Å; L94-P114 HydrophobicContact CD2-CB 4.41Å; L94-P114 HydrophobicContact CD2-CG 3.32Å; L94-P114 HydrophobicContact CG-CG 3.91Å; P114-F116 VanDerWaalsContact C-N 3.29Å; P114-F116 PolarHBondContact O-N 3.08Å; P114-S117 PolarHBondContact O-OG 3.14Å; P114-S118 PolarHBondContact O-OG 3.03Å
115	T	39	Very low	40.3	Very low	63 Å²	63	53 Å²	53	39%	0.387	30%	0.3	S	S	.	.	H	α-helix	trans	-71.5	-22.9	173.8	59.7	0	0	0	0	113.3	C91 E112 I113	C91-T115 HydrophobicContact CB-CG2 4.36Å; E112-T115 PolarHBondContact O-N 3.21Å; E112-T115 VanDerWaalsContact O-N 3.15Å; E112-T115 PolarHBondContact O-OG1 3.01Å; I113-T115 VanDerWaalsContact C-N 3.26Å; I113-T115 PolarHBondContact O-N 3.2Å
116	F	38.3	Very low	40.2	Very low	68 Å²	68	50.2 Å²	50.2	30%	0.298	27%	0.267	S	S	.	.	H	α-helix	trans	-103	-12.5	-179.2	-76.6	-75.2	0	0	0	114.3	E112 I113 P114 P120 W167 F170	E112-F116 HydrophobicContact CB-CD2 3.81Å; E112-F116 HydrophobicContact CB-CE2 3.92Å; E112-F116 HydrophobicContact CG-CE2 4.25Å; E112-F116 WeakPolarHBondContact O-CD2 3.4Å; E112-F116 PolarHBondContact O-N 3.23Å; E112-F116 VanDerWaalsContact O-N 3.16Å; I113-F116 WeakPolarHBondContact O-CA 3.42Å; I113-F116 PolarHBondContact O-N 2.88Å; P114-F116 VanDerWaalsContact C-N 3.29Å; P114-F116 PolarHBondContact O-N 3.08Å; F116-P120 WeakPolarHBondContact O-CD 3.44Å; F116-P120 WeakPolarHBondContact O-CG 3.41Å; F116-W167 HydrophobicContact CB-CH2 4.38Å; F116-W167 HydrophobicContact CB-CZ3 3.8Å; F116-W167 HydrophobicContact CD1-CH2 4.27Å; F116-W167 AromaticContact CD1-CZ3 3.92Å; F116-W167 HydrophobicContact CD1-CZ3 3.92Å; F116-W167 AromaticContact CG-CZ3 3.94Å; F116-W167 HydrophobicContact CG-CZ3 3.94Å; F116-F170 HydrophobicContact CB-CE1 4.18Å
117	S	37.8	Very low	40.1	Very low	22 Å²	22	51.7 Å²	51.7	15%	0.154	28%	0.275	C	S	.	.	H	α-helix	trans	-86.6	-48.7	179.6	41.8	0	0	0	0	112	I113 P114 P120 T121 F170 C174	I113-S117 PolarHBondContact O-N 3.39Å; I113-S117 VanDerWaalsContact O-N 3.11Å; P114-S117 PolarHBondContact O-OG 3.14Å; S117-P120 WeakPolarHBondContact O-CD 3.42Å; S117-T121 WeakPolarHBondContact O-CB 3.29Å; S117-T121 VanDerWaalsContact O-CG2 3.28Å; S117-T121 WeakPolarHBondContact O-CG2 3.3Å; S117-T121 PolarHBondContact O-N 2.98Å; S117-T121 PolarHBondContact O-OG1 3Å; S117-F170 VanDerWaalsContact CA-CE1 3.46Å; S117-F170 VanDerWaalsContact CB-CE1 3.4Å; S117-F170 VanDerWaalsContact OG-CZ 3.23Å; S117-F170 WeakPolarHBondContact OG-CZ 3.36Å; S117-C174 VanDerWaalsContact CA-SG 3.53Å; S117-C174 WeakPolarHBondContact CB-SG 3.24Å
118	S	41.7	Very low	40.1	Very low	9 Å²	9	48.7 Å²	48.7	6%	0.063	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-44.6	-163.7	51.5	0	0	0	0	109.2	P114 T121 I122	P114-S118 PolarHBondContact O-OG 3.03Å; S118-T121 WeakPolarHBondContact CA-OG1 3.42Å; S118-T121 PolarHBondContact O-N 3.46Å; S118-T121 PolarHBondContact O-OG1 2.61Å; S118-I122 WeakPolarHBondContact O-CB 3.36Å; S118-I122 WeakPolarHBondContact O-CD1 3.46Å; S118-I122 WeakPolarHBondContact O-CG1 3.45Å; S118-I122 PolarHBondContact O-N 2.94Å
119	L	40.4	Very low	40.1	Very low	65 Å²	65	44 Å²	44	34%	0.34	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-46.3	-174	-141.5	127.5	0	0	0	114.3	C123 T150	L119-C123 VanDerWaalsContact O-CB 3.29Å; L119-C123 WeakPolarHBondContact O-CB 3.36Å; L119-C123 PolarHBondContact O-N 3.11Å; L119-C123 PolarHBondContact O-SG 3.34Å; L119-T150 HydrophobicContact CD2-CG2 3.86Å
120	P	40.1	Very low	40.2	Very low	48 Å²	48	43.8 Å²	43.8	31%	0.312	25%	0.245	S	C	.	.	H	α-helix	trans	-71.5	-34.6	175.7	-19.1	33.6	0	0	0	113.4	F116 S117 C123 C124	F116-P120 WeakPolarHBondContact O-CD 3.44Å; F116-P120 WeakPolarHBondContact O-CG 3.41Å; S117-P120 WeakPolarHBondContact O-CD 3.42Å; P120-C123 PolarHBondContact O-N 2.91Å; P120-C124 WeakPolarHBondContact O-CB 3.36Å; P120-C124 PolarHBondContact O-N 2.88Å; P120-C124 PolarHBondContact O-SG 3.27Å
121	T	39.1	Very low	40.3	Very low	31 Å²	31	44.4 Å²	44.4	19%	0.19	26%	0.259	C	S	.	.	H	α-helix	trans	-70.8	-39.2	177.7	51.5	0	0	0	0	111.7	S117 S118 C124 L125 C174 L178	S117-T121 WeakPolarHBondContact O-CB 3.29Å; S117-T121 VanDerWaalsContact O-CG2 3.28Å; S117-T121 WeakPolarHBondContact O-CG2 3.3Å; S117-T121 PolarHBondContact O-N 2.98Å; S117-T121 PolarHBondContact O-OG1 3Å; S118-T121 WeakPolarHBondContact CA-OG1 3.42Å; S118-T121 PolarHBondContact O-N 3.46Å; S118-T121 PolarHBondContact O-OG1 2.61Å; T121-C124 PolarHBondContact O-N 3.19Å; T121-L125 WeakPolarHBondContact O-CB 3.47Å; T121-L125 PolarHBondContact O-N 3.49Å; T121-C174 HydrophobicContact CG2-CB 4.03Å; T121-L178 HydrophobicContact CG2-CD1 3.45Å; T121-L178 VanDerWaalsContact CG2-CD1 3.45Å; T121-L178 HydrophobicContact CG2-CG 4.39Å
122	I	41.8	Very low	40.4	Very low	20 Å²	20	48 Å²	48	10%	0.103	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-40.1	170.8	-66	159.1	0	0	0	110.8	I83 N87 S118 L125 L126	I83-I122 HydrophobicContact CG2-CG2 4.25Å; N87-I122 HydrophobicContact CB-CD1 3.71Å; N87-I122 VanDerWaalsContact CG-CD1 3.4Å; N87-I122 WeakPolarHBondContact ND2-CD1 3.21Å; S118-I122 WeakPolarHBondContact O-CB 3.36Å; S118-I122 WeakPolarHBondContact O-CD1 3.46Å; S118-I122 WeakPolarHBondContact O-CG1 3.45Å; S118-I122 PolarHBondContact O-N 2.94Å; I122-L125 CarbonylContact O-C 3.44Å; I122-L125 WeakPolarHBondContact O-CB 3.41Å; I122-L125 PolarHBondContact O-N 3.28Å; I122-L126 HydrophobicContact CG2-CD1 3.95Å; I122-L126 VanDerWaalsContact O-CB 3.26Å; I122-L126 WeakPolarHBondContact O-CB 3.42Å; I122-L126 PolarHBondContact O-N 2.88Å
123	C	41.1	Very low	40.5	Very low	10 Å²	10	46.7 Å²	46.7	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-37.5	174.6	-73.4	0	0	0	0	112.7	L119 P120 L126 I127	L119-C123 VanDerWaalsContact O-CB 3.29Å; L119-C123 WeakPolarHBondContact O-CB 3.36Å; L119-C123 PolarHBondContact O-N 3.11Å; L119-C123 PolarHBondContact O-SG 3.34Å; P120-C123 PolarHBondContact O-N 2.91Å; C123-L126 VanDerWaalsContact O-CB 3.3Å; C123-L126 WeakPolarHBondContact O-CB 3.49Å; C123-L126 PolarHBondContact O-N 3Å; C123-I127 WeakPolarHBondContact O-CB 3.07Å; C123-I127 WeakPolarHBondContact O-CD1 3.43Å; C123-I127 WeakPolarHBondContact O-CG1 3.27Å; C123-I127 PolarHBondContact O-N 2.85Å
124	C	40.7	Very low	40.5	Very low	79 Å²	79	54.3 Å²	54.3	53%	0.534	31%	0.31	S	S	.	.	H	α-helix	trans	-70	-39.3	173	-80	0	0	0	0	112.2	P120 T121 L126 I127 T128	P120-C124 WeakPolarHBondContact O-CB 3.36Å; P120-C124 PolarHBondContact O-N 2.88Å; P120-C124 PolarHBondContact O-SG 3.27Å; T121-C124 PolarHBondContact O-N 3.19Å; C124-L126 VanDerWaalsContact C-N 3.29Å; C124-I127 PolarHBondContact O-N 3.37Å; C124-T128 WeakPolarHBondContact O-CB 3.33Å; C124-T128 WeakPolarHBondContact O-CG2 3.33Å; C124-T128 PolarHBondContact O-N 3.26Å; C124-T128 PolarHBondContact O-OG1 3.49Å
125	L	41.8	Very low	40.9	Very low	51 Å²	51	59.8 Å²	59.8	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-60.5	-38.8	168.9	-103.8	152.1	0	0	0	111.3	T121 I122 T128 M129 F182	T121-L125 WeakPolarHBondContact O-CB 3.47Å; T121-L125 PolarHBondContact O-N 3.49Å; I122-L125 CarbonylContact O-C 3.44Å; I122-L125 WeakPolarHBondContact O-CB 3.41Å; I122-L125 PolarHBondContact O-N 3.28Å; L125-T128 VanDerWaalsContact CA-OG1 3.3Å; L125-T128 WeakPolarHBondContact CA-OG1 3.45Å; L125-T128 PolarHBondContact O-OG1 3.5Å; L125-M129 HydrophobicContact CD2-CG 4.49Å; L125-M129 WeakPolarHBondContact O-CB 3.41Å; L125-M129 WeakPolarHBondContact O-CG 3.39Å; L125-M129 PolarHBondContact O-N 3.15Å; L125-F182 HydrophobicContact CD1-CE2 4.21Å; L125-F182 HydrophobicContact CD2-CE2 3.6Å; L125-F182 HydrophobicContact CD2-CZ 4.01Å; L125-F182 HydrophobicContact CG-CE2 3.87Å
126	L	41.6	Very low	40.9	Very low	14 Å²	14	65.9 Å²	65.9	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-64.8	-50.1	173.7	-106.1	143.4	0	0	0	112	L80 I122 C123 C124 T128 M129 L130 L146	L80-L126 HydrophobicContact CD1-CD2 3.74Å; L80-L126 HydrophobicContact CD2-CD1 4.17Å; L80-L126 HydrophobicContact CD2-CD2 3.55Å; L80-L126 HydrophobicContact CD2-CG 3.59Å; L80-L126 HydrophobicContact CG-CD2 4.14Å; I122-L126 HydrophobicContact CG2-CD1 3.95Å; I122-L126 VanDerWaalsContact O-CB 3.26Å; I122-L126 WeakPolarHBondContact O-CB 3.42Å; I122-L126 PolarHBondContact O-N 2.88Å; C123-L126 VanDerWaalsContact O-CB 3.3Å; C123-L126 WeakPolarHBondContact O-CB 3.49Å; C123-L126 PolarHBondContact O-N 3Å; C124-L126 VanDerWaalsContact C-N 3.29Å; L126-T128 VanDerWaalsContact C-N 3.27Å; L126-T128 PolarHBondContact O-N 3.16Å; L126-M129 PolarHBondContact O-N 3.29Å; L126-L130 HydrophobicContact CB-CD1 4.42Å; L126-L130 HydrophobicContact CD2-CD1 3.53Å; L126-L130 HydrophobicContact CD2-CG 4.2Å; L126-L130 WeakPolarHBondContact O-CB 3.3Å; L126-L130 WeakPolarHBondContact O-CD1 3.43Å; L126-L130 WeakPolarHBondContact O-CG 3.26Å; L126-L130 PolarHBondContact O-N 3.48Å; L126-L146 HydrophobicContact CD1-CD1 4.43Å; L126-L146 HydrophobicContact CD2-CD1 4.03Å
127	I	42.8	Very low	40.9	Very low	87 Å²	87	71.6 Å²	71.6	45%	0.446	37%	0.374	S	S	.	.	H	α-helix	trans	-63.3	-37.4	-179.8	-69.9	161.1	0	0	0	110.6	C123 C124 G131	C123-I127 WeakPolarHBondContact O-CB 3.07Å; C123-I127 WeakPolarHBondContact O-CD1 3.43Å; C123-I127 WeakPolarHBondContact O-CG1 3.27Å; C123-I127 PolarHBondContact O-N 2.85Å; C124-I127 PolarHBondContact O-N 3.37Å; I127-G131 PolarHBondContact O-N 2.86Å
128	T	41.8	Very low	41.1	Very low	66 Å²	66	75.4 Å²	75.4	41%	0.405	39%	0.389	S	S	.	.	H	α-helix	trans	-71.6	-50.7	175.4	43.8	0	0	0	0	111.4	C124 L125 L126 L130 G131 F132	C124-T128 WeakPolarHBondContact O-CB 3.33Å; C124-T128 WeakPolarHBondContact O-CG2 3.33Å; C124-T128 PolarHBondContact O-N 3.26Å; C124-T128 PolarHBondContact O-OG1 3.49Å; L125-T128 VanDerWaalsContact CA-OG1 3.3Å; L125-T128 WeakPolarHBondContact CA-OG1 3.45Å; L125-T128 PolarHBondContact O-OG1 3.5Å; L126-T128 VanDerWaalsContact C-N 3.27Å; L126-T128 PolarHBondContact O-N 3.16Å; T128-L130 PolarHBondContact O-N 3.06Å; T128-G131 PolarHBondContact O-N 3.46Å; T128-G131 VanDerWaalsContact O-N 3.17Å; T128-F132 WeakPolarHBondContact O-CD2 3.46Å; T128-F132 PolarHBondContact O-N 2.85Å
129	M	41.4	Very low	40.8	Very low	66 Å²	66	78.2 Å²	78.2	33%	0.325	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-36.6	178.7	-67	-71.7	-77	0	0	113.2	W74 L125 L126	W74-M129 HydrophobicContact CE3-CE 4.19Å; W74-M129 HydrophobicContact CZ3-CE 3.91Å; L125-M129 HydrophobicContact CD2-CG 4.49Å; L125-M129 WeakPolarHBondContact O-CB 3.41Å; L125-M129 WeakPolarHBondContact O-CG 3.39Å; L125-M129 PolarHBondContact O-N 3.15Å; L126-M129 PolarHBondContact O-N 3.29Å
130	L	40.9	Very low	40.5	Very low	34 Å²	34	80 Å²	80	18%	0.178	42%	0.417	C	S	.	.	H	α-helix	trans	-74.5	-26.7	175.6	-68.8	167.5	0	0	0	112.8	L126 T128 L142	L126-L130 HydrophobicContact CB-CD1 4.42Å; L126-L130 HydrophobicContact CD2-CD1 3.53Å; L126-L130 HydrophobicContact CD2-CG 4.2Å; L126-L130 WeakPolarHBondContact O-CB 3.3Å; L126-L130 WeakPolarHBondContact O-CD1 3.43Å; L126-L130 WeakPolarHBondContact O-CG 3.26Å; L126-L130 PolarHBondContact O-N 3.48Å; T128-L130 PolarHBondContact O-N 3.06Å; L130-L142 HydrophobicContact CD1-CB 4.35Å; L130-L142 HydrophobicContact CD1-CD2 3.51Å; L130-L142 HydrophobicContact CD2-CD2 4.35Å
131	G	40.9	Very low	40.3	Very low	53 Å²	53	78.8 Å²	78.8	55%	0.546	41%	0.41	S	S	.	.	H	α-helix	trans	-75.1	-22.9	174.2	0	0	0	0	0	114.2	I127 T128	I127-G131 PolarHBondContact O-N 2.86Å; T128-G131 PolarHBondContact O-N 3.46Å; T128-G131 VanDerWaalsContact O-N 3.17Å
132	F	43.4	Very low	40.3	Very low	115 Å²	115	80.1 Å²	80.1	50%	0.504	42%	0.416	S	S	.	.	H	α-helix	trans	-95.1	-11	-179.5	-78.5	-70.8	0	0	0	114.6	T128 L200	T128-F132 WeakPolarHBondContact O-CD2 3.46Å; T128-F132 PolarHBondContact O-N 2.85Å; F132-L200 HydrophobicContact CE1-CD2 4.18Å
133	G	41.1	Very low	40	Very low	30 Å²	30	82 Å²	82	31%	0.309	43%	0.428	S	S	.	.	S	Bend	trans	-93.2	168.7	-178.8	0	0	0	0	0	115.6	W135	G133-W135 PolarHBondContact O-N 3.39Å
134	H	39.1	Very low	39.7	Very low	195 Å²	195	85 Å²	85	90%	0.903	45%	0.448	S	S	*	.	S	Bend	trans	-60.1	8.8	177.6	-110.9	-69.8	0	0	0	115.7	K136	H134-K136 PolarHBondContact O-N 3Å
135	W	45.1	Very low	39.7	Very low	130 Å²	130	85 Å²	85	49%	0.492	44%	0.439	S	S	.	.			trans	-100.2	37	-159.1	-57.1	100.6	0	0	0	114.2	G133 K137 H138	G133-W135 PolarHBondContact O-N 3.39Å; W135-K137 PolarHBondContact O-N 3.16Å; W135-H138 PolarHBondContact O-N 3.38Å; W135-H138 VanDerWaalsContact O-N 3.15Å
136	K	37.7	Very low	39.6	Very low	190 Å²	190	85.4 Å²	85.4	83%	0.826	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	-29.1	177.7	-97.3	-178.1	177	177.2	0	114.4	H134	H134-K136 PolarHBondContact O-N 3Å
137	K	38.7	Very low	39.4	Very low	189 Å²	189	85.4 Å²	85.4	82%	0.822	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-23	-176.5	-72.7	-173.7	177	-176.9	0	114.8	W135	W135-K137 PolarHBondContact O-N 3.16Å
138	H	41.4	Very low	39	Very low	102 Å²	102	83 Å²	83	47%	0.472	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	2.4	-177.8	-58.2	-66.6	0	0	0	113	W135 S141 L142	W135-H138 PolarHBondContact O-N 3.38Å; W135-H138 VanDerWaalsContact O-N 3.15Å; H138-S141 PolarHBondContact O-OG 3.29Å; H138-L142 HydrophobicContact CB-CD1 4.38Å; H138-L142 PolarHBondContact O-N 3.35Å
139	L	36.4	Very low	38.7	Very low	68 Å²	68	82.5 Å²	82.5	36%	0.356	43%	0.432	S	S	.	.	H	α-helix	trans	-64.3	-42.9	-174.4	-167.1	78.6	0	0	0	112.2	T143	L139-T143 VanDerWaalsContact O-CB 3.27Å; L139-T143 WeakPolarHBondContact O-CB 3.47Å; L139-T143 WeakPolarHBondContact O-CG2 3.19Å; L139-T143 PolarHBondContact O-N 3.46Å; L139-T143 VanDerWaalsContact O-N 3.07Å; L139-T143 PolarHBondContact O-OG1 3.29Å
140	T	33.1	Very low	38.6	Very low	101 Å²	101	80.5 Å²	80.5	62%	0.62	42%	0.423	S	S	*	.	H	α-helix	trans	-72.8	-39.2	-178.7	46.4	0	0	0	0	112.1	T143 C144	T140-T143 WeakPolarHBondContact CA-OG1 3.38Å; T140-T143 PolarHBondContact O-OG1 3.38Å; T140-C144 VanDerWaalsContact O-CB 3.28Å; T140-C144 WeakPolarHBondContact O-CB 3.43Å; T140-C144 PolarHBondContact O-N 2.83Å; T140-C144 PolarHBondContact O-SG 2.84Å; T140-C144 VanDerWaalsContact O-SG 3.33Å
141	S	36.5	Very low	38.3	Very low	24 Å²	24	84.8 Å²	84.8	17%	0.168	45%	0.446	C	S	.	.	H	α-helix	trans	-70.7	-43.9	179.1	59.6	0	0	0	0	111.8	H138 C144 F145	H138-S141 PolarHBondContact O-OG 3.29Å; S141-C144 PolarHBondContact O-N 3.37Å; S141-F145 VanDerWaalsContact O-CB 3.28Å; S141-F145 WeakPolarHBondContact O-CB 3.21Å; S141-F145 PolarHBondContact O-N 2.98Å
142	L	39.3	Very low	38.2	Very low	59 Å²	59	85 Å²	85	31%	0.309	43%	0.43	S	S	.	.	H	α-helix	trans	-70.8	-37	177.2	-105.5	100.5	0	0	0	113.4	L130 H138 F145 L146	L130-L142 HydrophobicContact CD1-CB 4.35Å; L130-L142 HydrophobicContact CD1-CD2 3.51Å; L130-L142 HydrophobicContact CD2-CD2 4.35Å; H138-L142 HydrophobicContact CB-CD1 4.38Å; H138-L142 PolarHBondContact O-N 3.35Å; L142-F145 PolarHBondContact O-N 3.13Å; L142-L146 HydrophobicContact CD2-CD1 3.9Å; L142-L146 HydrophobicContact CG-CD1 4.49Å; L142-L146 WeakPolarHBondContact O-CB 3.41Å; L142-L146 PolarHBondContact O-N 3.09Å
143	T	36	Very low	37.9	Very low	58 Å²	58	84 Å²	84	36%	0.356	43%	0.43	S	S	.	.	H	α-helix	trans	-67.9	-35.8	175.8	51.2	0	0	0	0	111.9	L139 T140 G147	L139-T143 VanDerWaalsContact O-CB 3.27Å; L139-T143 WeakPolarHBondContact O-CB 3.47Å; L139-T143 WeakPolarHBondContact O-CG2 3.19Å; L139-T143 PolarHBondContact O-N 3.46Å; L139-T143 VanDerWaalsContact O-N 3.07Å; L139-T143 PolarHBondContact O-OG1 3.29Å; T140-T143 WeakPolarHBondContact CA-OG1 3.38Å; T140-T143 PolarHBondContact O-OG1 3.38Å; T143-G147 VanDerWaalsContact O-CA 3.25Å; T143-G147 WeakPolarHBondContact O-CA 3.39Å; T143-G147 PolarHBondContact O-N 3.46Å
144	C	34.3	Very low	37.6	Very low	74 Å²	74	86.2 Å²	86.2	50%	0.5	44%	0.439	S	S	.	.	H	α-helix	trans	-69.7	-39.8	169.9	-74.9	0	0	0	0	112.5	T140 S141 V148	T140-C144 VanDerWaalsContact O-CB 3.28Å; T140-C144 WeakPolarHBondContact O-CB 3.43Å; T140-C144 PolarHBondContact O-N 2.83Å; T140-C144 PolarHBondContact O-SG 2.84Å; T140-C144 VanDerWaalsContact O-SG 3.33Å; S141-C144 PolarHBondContact O-N 3.37Å; C144-V148 VanDerWaalsContact O-CB 3.24Å; C144-V148 WeakPolarHBondContact O-CB 3.48Å; C144-V148 VanDerWaalsContact O-CG2 3.23Å; C144-V148 WeakPolarHBondContact O-CG2 3.46Å; C144-V148 PolarHBondContact O-N 3.11Å
145	F	40.9	Very low	37.4	Very low	78 Å²	78	81.1 Å²	81.1	34%	0.342	43%	0.426	S	S	.	.	H	α-helix	trans	-72.2	-36.8	-178	-109.3	-89.5	0	0	0	114.2	S141 L142 P149 F884 I1049	S141-F145 VanDerWaalsContact O-CB 3.28Å; S141-F145 WeakPolarHBondContact O-CB 3.21Å; S141-F145 PolarHBondContact O-N 2.98Å; L142-F145 PolarHBondContact O-N 3.13Å; F145-P149 WeakPolarHBondContact O-CD 3.41Å; F145-P149 WeakPolarHBondContact O-CG 3.46Å; F145-F884 HydrophobicContact CZ-CB 4.28Å; F145-F884 HydrophobicContact CZ-CD1 4.5Å; F145-F884 HydrophobicContact CZ-CD2 4.14Å; F145-F884 HydrophobicContact CZ-CG 4.06Å; F145-I1049 HydrophobicContact CE1-CG2 4.32Å
146	L	39.8	Very low	36.8	Very low	61 Å²	61	77.2 Å²	77.2	32%	0.319	41%	0.411	S	S	.	.	H	α-helix	trans	-98.3	-38.2	-178.2	-74.2	161.2	0	0	0	112.2	L126 L142 T150	L126-L146 HydrophobicContact CD1-CD1 4.43Å; L126-L146 HydrophobicContact CD2-CD1 4.03Å; L142-L146 HydrophobicContact CD2-CD1 3.9Å; L142-L146 HydrophobicContact CG-CD1 4.49Å; L142-L146 WeakPolarHBondContact O-CB 3.41Å; L142-L146 PolarHBondContact O-N 3.09Å; L146-T150 WeakPolarHBondContact O-CB 3.39Å; L146-T150 WeakPolarHBondContact O-CG2 3.18Å; L146-T150 PolarHBondContact O-N 3.49Å; L146-T150 PolarHBondContact O-OG1 3.5Å
147	G	36.4	Very low	36.7	Very low	14 Å²	14	74.6 Å²	74.6	14%	0.144	40%	0.397	C	S	.	.	H	α-helix	trans	-71.6	-35.3	-177.2	0	0	0	0	0	113.4	T143 T150 L151	T143-G147 VanDerWaalsContact O-CA 3.25Å; T143-G147 WeakPolarHBondContact O-CA 3.39Å; T143-G147 PolarHBondContact O-N 3.46Å; G147-T150 WeakPolarHBondContact CA-OG1 3.47Å; G147-T150 PolarHBondContact O-OG1 3.41Å; G147-T150 VanDerWaalsContact O-OG1 3.05Å; G147-L151 WeakPolarHBondContact O-CB 3.38Å; G147-L151 VanDerWaalsContact O-CD1 3.31Å; G147-L151 WeakPolarHBondContact O-CD1 3.18Å; G147-L151 WeakPolarHBondContact O-CG 3.31Å; G147-L151 PolarHBondContact O-N 2.89Å
148	V	35.5	Very low	36.5	Very low	36 Å²	36	75.1 Å²	75.1	22%	0.218	40%	0.399	C	S	.	.	H	α-helix	trans	-75.5	-45.6	-177.1	178.1	0	0	0	0	112.3	C144 T150 L151 W152 F892	C144-V148 VanDerWaalsContact O-CB 3.24Å; C144-V148 WeakPolarHBondContact O-CB 3.48Å; C144-V148 VanDerWaalsContact O-CG2 3.23Å; C144-V148 WeakPolarHBondContact O-CG2 3.46Å; C144-V148 PolarHBondContact O-N 3.11Å; V148-T150 PolarHBondContact O-N 2.79Å; V148-L151 PolarHBondContact O-N 3.04Å; V148-W152 WeakPolarHBondContact O-CB 3.46Å; V148-W152 PolarHBondContact O-N 3.06Å; V148-F892 HydrophobicContact CB-CZ 4.37Å; V148-F892 HydrophobicContact CG1-CE1 3.89Å; V148-F892 HydrophobicContact CG1-CE2 3.9Å; V148-F892 HydrophobicContact CG1-CZ 3.34Å; V148-F892 HydrophobicContact CG2-CZ 4.07Å
149	P	35.5	Very low	36.3	Very low	56 Å²	56	73 Å²	73	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-66.7	-34.6	175.7	-23.5	36.5	0	0	0	113.2	F145 W152 L153	F145-P149 WeakPolarHBondContact O-CD 3.41Å; F145-P149 WeakPolarHBondContact O-CG 3.46Å; P149-W152 PolarHBondContact O-N 3.09Å; P149-L153 WeakPolarHBondContact O-CB 3.19Å; P149-L153 WeakPolarHBondContact O-CG 3.27Å; P149-L153 PolarHBondContact O-N 3.4Å
150	T	38.8	Very low	36.4	Very low	23 Å²	23	78.3 Å²	78.3	14%	0.141	42%	0.415	C	S	.	.	H	α-helix	trans	-69.7	-46.8	174.3	47.4	0	0	0	0	111.8	L119 L146 G147 V148 W152 L153 C154	L119-T150 HydrophobicContact CD2-CG2 3.86Å; L146-T150 WeakPolarHBondContact O-CB 3.39Å; L146-T150 WeakPolarHBondContact O-CG2 3.18Å; L146-T150 PolarHBondContact O-N 3.49Å; L146-T150 PolarHBondContact O-OG1 3.5Å; G147-T150 WeakPolarHBondContact CA-OG1 3.47Å; G147-T150 PolarHBondContact O-OG1 3.41Å; G147-T150 VanDerWaalsContact O-OG1 3.05Å; V148-T150 PolarHBondContact O-N 2.79Å; T150-W152 PolarHBondContact O-N 3.19Å; T150-L153 PolarHBondContact O-N 2.79Å; T150-C154 VanDerWaalsContact O-CB 3.32Å; T150-C154 WeakPolarHBondContact O-CB 3.37Å; T150-C154 PolarHBondContact O-N 2.85Å; T150-C154 PolarHBondContact O-SG 3.06Å
151	L	35.5	Very low	36.5	Very low	125 Å²	125	82.3 Å²	82.3	65%	0.654	42%	0.424	S	S	*	.	H	α-helix	trans	-61	-33.6	171.4	-75.6	166	0	0	0	111.7	G147 V148 S155	G147-L151 WeakPolarHBondContact O-CB 3.38Å; G147-L151 VanDerWaalsContact O-CD1 3.31Å; G147-L151 WeakPolarHBondContact O-CD1 3.18Å; G147-L151 WeakPolarHBondContact O-CG 3.31Å; G147-L151 PolarHBondContact O-N 2.89Å; V148-L151 PolarHBondContact O-N 3.04Å; L151-S155 WeakPolarHBondContact O-CB 3.41Å; L151-S155 PolarHBondContact O-N 3.43Å; L151-S155 PolarHBondContact O-OG 3.18Å
152	W	38.4	Very low	36.4	Very low	56 Å²	56	87.9 Å²	87.9	21%	0.212	45%	0.447	C	S	.	.	H	α-helix	trans	-69.4	-46.3	176.5	-177.4	91.4	0	0	0	112.1	V148 P149 T150 S155 R156 T891	V148-W152 WeakPolarHBondContact O-CB 3.46Å; V148-W152 PolarHBondContact O-N 3.06Å; P149-W152 PolarHBondContact O-N 3.09Å; T150-W152 PolarHBondContact O-N 3.19Å; W152-S155 PolarHBondContact O-N 2.85Å; W152-S155 PolarHBondContact O-OG 3.21Å; W152-R156 VanDerWaalsContact CE2-NE 3.26Å; W152-R156 VanDerWaalsContact CZ2-NE 3.33Å; W152-R156 VanDerWaalsContact CZ2-NH1 3.32Å; W152-R156 WeakPolarHBondContact O-CB 3.21Å; W152-R156 PolarHBondContact O-N 2.91Å; W152-T891 PolarHBondContact NE1-O 3.33Å
153	L	37	Very low	36.1	Very low	96 Å²	96	86.2 Å²	86.2	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-58.3	-47.9	171.6	-85.6	156.4	0	0	0	110.7	P149 T150 S155 R156	P149-L153 WeakPolarHBondContact O-CB 3.19Å; P149-L153 WeakPolarHBondContact O-CG 3.27Å; P149-L153 PolarHBondContact O-N 3.4Å; T150-L153 PolarHBondContact O-N 2.79Å; L153-S155 VanDerWaalsContact C-N 3.3Å; L153-S155 PolarHBondContact O-N 3.48Å; L153-R156 PolarHBondContact O-N 3.43Å
154	C	35.1	Very low	36.2	Very low	75 Å²	75	88.1 Å²	88.1	51%	0.507	44%	0.443	S	S	.	.	H	α-helix	trans	-66	-27.5	176.6	-66.1	0	0	0	0	113.5	T150	T150-C154 VanDerWaalsContact O-CB 3.32Å; T150-C154 WeakPolarHBondContact O-CB 3.37Å; T150-C154 PolarHBondContact O-N 2.85Å; T150-C154 PolarHBondContact O-SG 3.06Å
155	S	33.6	Very low	36.3	Very low	89 Å²	89	89.6 Å²	89.6	62%	0.622	45%	0.45	S	S	*	.	H	α-helix	trans	-84.7	-23.3	179.5	76.3	0	0	0	0	113.9	L151 W152 L153	L151-S155 WeakPolarHBondContact O-CB 3.41Å; L151-S155 PolarHBondContact O-N 3.43Å; L151-S155 PolarHBondContact O-OG 3.18Å; W152-S155 PolarHBondContact O-N 2.85Å; W152-S155 PolarHBondContact O-OG 3.21Å; L153-S155 VanDerWaalsContact C-N 3.3Å; L153-S155 PolarHBondContact O-N 3.48Å
156	R	34	Very low	36	Very low	47 Å²	47	87.5 Å²	87.5	18%	0.177	44%	0.442	C	S	.	.	H	α-helix	trans	-88.3	-20.1	-172.7	-84.3	-161.3	172.5	-164.2	4.1	114.2	W152 L153 G894	W152-R156 VanDerWaalsContact CE2-NE 3.26Å; W152-R156 VanDerWaalsContact CZ2-NE 3.33Å; W152-R156 VanDerWaalsContact CZ2-NH1 3.32Å; W152-R156 WeakPolarHBondContact O-CB 3.21Å; W152-R156 PolarHBondContact O-N 2.91Å; L153-R156 PolarHBondContact O-N 3.43Å; R156-G894 PolarHBondContact NH2-O 3.47Å
157	Y	35	Very low	36	Very low	136 Å²	136	88.7 Å²	88.7	53%	0.533	44%	0.442	S	S	.	.			trans	-91.8	118.9	177.9	-113.8	-101.5	0	0	0	111.7	P159	Y157-P159 WeakPolarHBondContact O-CD 3.47Å
158	K	34.7	Very low	36.2	Very low	199 Å²	199	89.7 Å²	89.7	87%	0.865	44%	0.444	S	S	*	.			trans	-90.4	108.7	163.7	-98.9	-174.7	174.2	-177.6	0	106.8	K160	K158-K160 PolarHBondContact O-N 2.92Å
159	P	36.3	Very low	36.3	Very low	59 Å²	59	90.6 Å²	90.6	38%	0.383	45%	0.452	S	S	.	.			trans	-59.8	134.8	171.3	21.6	-28.7	0	0	0	109.7	Y157 L163	Y157-P159 WeakPolarHBondContact O-CD 3.47Å; P159-L163 HydrophobicContact CB-CB 3.67Å; P159-L163 HydrophobicContact CB-CD2 3.9Å; P159-L163 HydrophobicContact CB-CG 4.44Å
160	K	38	Very low	36.3	Very low	179 Å²	179	88.6 Å²	88.6	78%	0.778	44%	0.438	S	S	*	.			trans	-60.7	149.2	161.3	-78.1	178.5	177.3	172.9	0	107.5	K158 H162 L163	K158-K160 PolarHBondContact O-N 2.92Å; K160-H162 PolarHBondContact O-N 3.19Å; K160-L163 WeakPolarHBondContact O-CB 3.37Å; K160-L163 PolarHBondContact O-N 2.99Å
161	K	35.4	Very low	36.4	Very low	184 Å²	184	91.8 Å²	91.8	80%	0.8	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-23.6	-172.2	-80.4	179.5	173.1	178.6	0	116.2
162	H	34.9	Very low	36.6	Very low	141 Å²	141	88.3 Å²	88.3	65%	0.653	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-35.2	177.3	-66.5	-74.2	0	0	0	113.2	K160 E164 V165 L166	K160-H162 PolarHBondContact O-N 3.19Å; H162-E164 PolarHBondContact O-N 3.44Å; H162-V165 PolarHBondContact O-N 3.01Å; H162-L166 PolarHBondContact O-N 2.88Å
163	L	33.9	Very low	36.5	Very low	25 Å²	25	87.5 Å²	87.5	13%	0.131	44%	0.438	C	S	.	.	H	α-helix	trans	-66.8	-19.7	176.9	-136.6	107.3	0	0	0	113.1	E109 E112 P159 K160 V165 L166 W167	E109-L163 HydrophobicContact CB-CD1 4.43Å; E109-L163 HydrophobicContact CG-CD1 4.01Å; E112-L163 WeakPolarHBondContact OE2-CD1 3.26Å; P159-L163 HydrophobicContact CB-CB 3.67Å; P159-L163 HydrophobicContact CB-CD2 3.9Å; P159-L163 HydrophobicContact CB-CG 4.44Å; K160-L163 WeakPolarHBondContact O-CB 3.37Å; K160-L163 PolarHBondContact O-N 2.99Å; L163-V165 VanDerWaalsContact C-N 3.31Å; L163-L166 PolarHBondContact O-N 3.49Å; L163-W167 WeakPolarHBondContact O-CA 3.03Å; L163-W167 WeakPolarHBondContact O-CB 3.45Å; L163-W167 PolarHBondContact O-N 2.96Å
164	E	36.9	Very low	36.6	Very low	98 Å²	98	83.5 Å²	83.5	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-70.3	-29.1	176.7	-152.1	173.7	-146.5	0	0	111.6	H162 N168 Y289	H162-E164 PolarHBondContact O-N 3.44Å; E164-N168 WeakPolarHBondContact O-CB 3.38Å; E164-N168 VanDerWaalsContact O-CG 3.24Å; E164-N168 PolarHBondContact O-N 3.47Å; E164-N168 PolarHBondContact O-ND2 3.32Å; E164-Y289 HydrophobicContact CG-CE1 4.32Å
165	V	36.1	Very low	36.7	Very low	105 Å²	105	81.5 Å²	81.5	64%	0.636	40%	0.401	S	S	*	.	H	α-helix	trans	-78.2	-43.2	174.1	-179.4	0	0	0	0	110	H162 L163 N168 S169	H162-V165 PolarHBondContact O-N 3.01Å; L163-V165 VanDerWaalsContact C-N 3.31Å; V165-N168 PolarHBondContact O-N 2.94Å; V165-S169 PolarHBondContact O-N 3.48Å; V165-S169 PolarHBondContact O-OG 2.95Å
166	L	34.9	Very low	36.9	Very low	33 Å²	33	78.5 Å²	78.5	17%	0.173	38%	0.382	C	S	.	.	H	α-helix	trans	-68.7	-40.5	-179.6	-144.4	118.6	0	0	0	111.9	E109 I113 H162 L163 N168 S169 F170	E109-L166 HydrophobicContact CB-CD1 3.99Å; E109-L166 HydrophobicContact CB-CD2 3.82Å; E109-L166 HydrophobicContact CB-CG 4.45Å; E109-L166 WeakPolarHBondContact O-CD2 3.17Å; I113-L166 HydrophobicContact CD1-CD2 3.57Å; I113-L166 HydrophobicContact CD1-CG 4.39Å; I113-L166 HydrophobicContact CG1-CD2 3.74Å; H162-L166 PolarHBondContact O-N 2.88Å; L163-L166 PolarHBondContact O-N 3.49Å; L166-N168 VanDerWaalsContact C-N 3.29Å; L166-N168 PolarHBondContact O-N 3.35Å; L166-S169 VanDerWaalsContact CA-OG 3.25Å; L166-S169 WeakPolarHBondContact CA-OG 3.47Å; L166-S169 PolarHBondContact O-N 3.3Å; L166-S169 PolarHBondContact O-OG 3.23Å; L166-F170 WeakPolarHBondContact O-CB 3.48Å; L166-F170 PolarHBondContact O-N 3.46Å
167	W	40.3	Very low	37	Very low	86 Å²	86	78.4 Å²	78.4	33%	0.326	39%	0.387	S	S	.	.	H	α-helix	trans	-60.4	-35.2	171.1	-175.5	-97	0	0	0	112.6	F116 L163 F170 M171	F116-W167 HydrophobicContact CB-CH2 4.38Å; F116-W167 HydrophobicContact CB-CZ3 3.8Å; F116-W167 HydrophobicContact CD1-CH2 4.27Å; F116-W167 AromaticContact CD1-CZ3 3.92Å; F116-W167 HydrophobicContact CD1-CZ3 3.92Å; F116-W167 AromaticContact CG-CZ3 3.94Å; F116-W167 HydrophobicContact CG-CZ3 3.94Å; L163-W167 WeakPolarHBondContact O-CA 3.03Å; L163-W167 WeakPolarHBondContact O-CB 3.45Å; L163-W167 PolarHBondContact O-N 2.96Å; W167-F170 PolarHBondContact O-N 3.48Å; W167-M171 WeakPolarHBondContact O-CB 3.47Å; W167-M171 VanDerWaalsContact O-CG 3.25Å; W167-M171 WeakPolarHBondContact O-CG 3.3Å; W167-M171 PolarHBondContact O-N 3.45Å
168	N	39.8	Very low	37.1	Very low	35 Å²	35	74 Å²	74	19%	0.187	37%	0.372	C	S	.	.	H	α-helix	trans	-72.7	-46.4	174.5	-79.5	-39.8	0	0	0	112.1	E164 V165 L166 F170 M171 E172 Y289	E164-N168 WeakPolarHBondContact O-CB 3.38Å; E164-N168 VanDerWaalsContact O-CG 3.24Å; E164-N168 PolarHBondContact O-N 3.47Å; E164-N168 PolarHBondContact O-ND2 3.32Å; V165-N168 PolarHBondContact O-N 2.94Å; L166-N168 VanDerWaalsContact C-N 3.29Å; L166-N168 PolarHBondContact O-N 3.35Å; N168-F170 PolarHBondContact O-N 2.9Å; N168-M171 PolarHBondContact O-N 3.23Å; N168-E172 WeakPolarHBondContact O-CB 3.28Å; N168-E172 WeakPolarHBondContact O-CG 3.42Å; N168-E172 PolarHBondContact O-N 3.17Å; N168-Y289 WeakPolarHBondContact ND2-CE1 3.44Å; N168-Y289 PolarHBondContact ND2-OH 3.2Å; N168-Y289 VanDerWaalsContact ND2-OH 3.15Å; N168-Y289 VanDerWaalsContact OD1-CZ 3.26Å; N168-Y289 PolarHBondContact OD1-OH 3.35Å
169	S	37.8	Very low	37.2	Very low	55 Å²	55	65.3 Å²	65.3	39%	0.385	34%	0.335	S	S	.	.	H	α-helix	trans	-61.8	-25.9	172.7	50.4	0	0	0	0	112.5	V165 L166 E172 A173	V165-S169 PolarHBondContact O-N 3.48Å; V165-S169 PolarHBondContact O-OG 2.95Å; L166-S169 VanDerWaalsContact CA-OG 3.25Å; L166-S169 WeakPolarHBondContact CA-OG 3.47Å; L166-S169 PolarHBondContact O-N 3.3Å; L166-S169 PolarHBondContact O-OG 3.23Å; S169-E172 WeakPolarHBondContact O-CB 2.9Å; S169-A173 WeakPolarHBondContact O-CB 3.26Å; S169-A173 PolarHBondContact O-N 2.94Å
170	F	36.9	Very low	37	Very low	15 Å²	15	68 Å²	68	7%	0.066	35%	0.346	C	S	.	.	H	α-helix	trans	-84.9	-40.5	-178.9	-169.8	-115.2	0	0	0	113.4	I113 F116 S117 L166 W167 N168 E172 A173 C174	I113-F170 VanDerWaalsContact C-CE1 3.46Å; I113-F170 HydrophobicContact CB-CD2 3.58Å; I113-F170 HydrophobicContact CB-CE1 4.37Å; I113-F170 HydrophobicContact CB-CE2 3.49Å; I113-F170 VanDerWaalsContact CB-CE2 3.49Å; I113-F170 HydrophobicContact CB-CG 4.14Å; I113-F170 HydrophobicContact CB-CZ 3.82Å; I113-F170 HydrophobicContact CD1-CD2 3.94Å; I113-F170 HydrophobicContact CD1-CG 4.46Å; I113-F170 HydrophobicContact CG1-CB 4.21Å; I113-F170 HydrophobicContact CG1-CD1 4.44Å; I113-F170 HydrophobicContact CG1-CD2 3.49Å; I113-F170 VanDerWaalsContact CG1-CD2 3.49Å; I113-F170 HydrophobicContact CG1-CE2 3.98Å; I113-F170 HydrophobicContact CG1-CG 3.77Å; I113-F170 HydrophobicContact CG1-CZ 4.49Å; I113-F170 HydrophobicContact CG2-CD2 3.24Å; I113-F170 HydrophobicContact CG2-CE2 2.88Å; I113-F170 HydrophobicContact CG2-CG 4.27Å; I113-F170 HydrophobicContact CG2-CZ 3.59Å; I113-F170 WeakPolarHBondContact O-CE1 3.29Å; I113-F170 WeakPolarHBondContact O-CZ 3.44Å; F116-F170 HydrophobicContact CB-CE1 4.18Å; S117-F170 VanDerWaalsContact CA-CE1 3.46Å; S117-F170 VanDerWaalsContact CB-CE1 3.4Å; S117-F170 VanDerWaalsContact OG-CZ 3.23Å; S117-F170 WeakPolarHBondContact OG-CZ 3.36Å; L166-F170 WeakPolarHBondContact O-CB 3.48Å; L166-F170 PolarHBondContact O-N 3.46Å; W167-F170 PolarHBondContact O-N 3.48Å; N168-F170 PolarHBondContact O-N 2.9Å; F170-E172 PolarHBondContact O-N 3.29Å; F170-A173 HydrophobicContact CD2-CB 4.34Å; F170-A173 CarbonylContact O-C 3.5Å; F170-A173 PolarHBondContact O-N 3.12Å; F170-A173 VanDerWaalsContact O-N 3.1Å; F170-C174 PolarHBondContact O-N 3.45Å; F170-C174 PolarHBondContact O-SG 2.93Å
171	M	40.7	Very low	37.1	Very low	90 Å²	90	60.4 Å²	60.4	44%	0.443	31%	0.314	S	S	.	.	H	α-helix	trans	-58.4	-37	164.5	-75.2	-69.4	-69.3	0	0	110.9	W167 N168 I175	W167-M171 WeakPolarHBondContact O-CB 3.47Å; W167-M171 VanDerWaalsContact O-CG 3.25Å; W167-M171 WeakPolarHBondContact O-CG 3.3Å; W167-M171 PolarHBondContact O-N 3.45Å; N168-M171 PolarHBondContact O-N 3.23Å; M171-I175 WeakPolarHBondContact O-CB 3.19Å; M171-I175 VanDerWaalsContact O-CD1 3.27Å; M171-I175 WeakPolarHBondContact O-CD1 3.49Å; M171-I175 WeakPolarHBondContact O-CG1 3.17Å; M171-I175 PolarHBondContact O-N 2.88Å
172	E	39.1	Very low	37.4	Very low	51 Å²	51	53.6 Å²	53.6	24%	0.238	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-36.9	172.5	-72.9	162.5	-167	0	0	112.8	N168 S169 F170 I175 A176 S219	N168-E172 WeakPolarHBondContact O-CB 3.28Å; N168-E172 WeakPolarHBondContact O-CG 3.42Å; N168-E172 PolarHBondContact O-N 3.17Å; S169-E172 WeakPolarHBondContact O-CB 2.9Å; F170-E172 PolarHBondContact O-N 3.29Å; E172-I175 WeakPolarHBondContact O-CB 3.31Å; E172-A176 WeakPolarHBondContact O-CB 3.36Å; E172-A176 PolarHBondContact O-N 3.14Å; E172-S219 WeakPolarHBondContact OE1-CB 3.09Å; E172-S219 WeakPolarHBondContact OE2-CB 3.42Å; E172-S219 PolarHBondContact OE2-OG 2.97Å
173	A	36.9	Very low	37.4	Very low	40 Å²	40	49.2 Å²	49.2	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-72.1	-41.6	173.5	0	0	0	0	0	112.5	S169 F170 I175 A176 V177	S169-A173 WeakPolarHBondContact O-CB 3.26Å; S169-A173 PolarHBondContact O-N 2.94Å; F170-A173 HydrophobicContact CD2-CB 4.34Å; F170-A173 CarbonylContact O-C 3.5Å; F170-A173 PolarHBondContact O-N 3.12Å; F170-A173 VanDerWaalsContact O-N 3.1Å; A173-I175 VanDerWaalsContact C-N 3.25Å; A173-I175 PolarHBondContact O-N 3.24Å; A173-A176 CarbonylContact O-C 3.55Å; A173-A176 WeakPolarHBondContact O-CA 3.25Å; A173-A176 WeakPolarHBondContact O-CB 3.4Å; A173-A176 PolarHBondContact O-N 2.92Å; A173-V177 WeakPolarHBondContact O-CG2 3.26Å; A173-V177 PolarHBondContact O-N 3.08Å
174	C	38.3	Very low	37.7	Very low	11 Å²	11	52.7 Å²	52.7	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-56.7	-44.3	170	-65.5	0	0	0	0	110.9	S117 T121 F170 A176 V177 L178	S117-C174 VanDerWaalsContact CA-SG 3.53Å; S117-C174 WeakPolarHBondContact CB-SG 3.24Å; T121-C174 HydrophobicContact CG2-CB 4.03Å; F170-C174 PolarHBondContact O-N 3.45Å; F170-C174 PolarHBondContact O-SG 2.93Å; C174-A176 VanDerWaalsContact C-N 3.34Å; C174-V177 PolarHBondContact O-N 3.29Å; C174-L178 VanDerWaalsContact O-CB 3.23Å; C174-L178 WeakPolarHBondContact O-CB 3.35Å; C174-L178 WeakPolarHBondContact O-CD1 3.37Å; C174-L178 PolarHBondContact O-N 3.35Å
175	I	38.1	Very low	38	Very low	33 Å²	33	49.4 Å²	49.4	17%	0.169	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-41	174.2	-77.7	166.5	0	0	0	110.4	M171 E172 A173 L178 L179 T212	M171-I175 WeakPolarHBondContact O-CB 3.19Å; M171-I175 VanDerWaalsContact O-CD1 3.27Å; M171-I175 WeakPolarHBondContact O-CD1 3.49Å; M171-I175 WeakPolarHBondContact O-CG1 3.17Å; M171-I175 PolarHBondContact O-N 2.88Å; E172-I175 WeakPolarHBondContact O-CB 3.31Å; A173-I175 VanDerWaalsContact C-N 3.25Å; A173-I175 PolarHBondContact O-N 3.24Å; I175-L178 CarbonylContact O-C 3.6Å; I175-L179 HydrophobicContact CG2-CD1 3.81Å; I175-L179 HydrophobicContact CG2-CG 4.5Å; I175-L179 WeakPolarHBondContact O-CB 3.05Å; I175-L179 WeakPolarHBondContact O-CD1 3.18Å; I175-L179 WeakPolarHBondContact O-CG 3.44Å; I175-L179 PolarHBondContact O-N 3.48Å; I175-T212 HydrophobicContact CB-CG2 4.39Å; I175-T212 HydrophobicContact CG1-CG2 4.42Å; I175-T212 VanDerWaalsContact CG2-CB 3.43Å; I175-T212 HydrophobicContact CG2-CG2 3.48Å; I175-T212 VanDerWaalsContact CG2-CG2 3.48Å
176	A	36	Very low	38	Very low	26 Å²	26	45 Å²	45	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-68.1	-34.3	176.6	0	0	0	0	0	113.9	E172 A173 C174 L179 N180 L216	E172-A176 WeakPolarHBondContact O-CB 3.36Å; E172-A176 PolarHBondContact O-N 3.14Å; A173-A176 CarbonylContact O-C 3.55Å; A173-A176 WeakPolarHBondContact O-CA 3.25Å; A173-A176 WeakPolarHBondContact O-CB 3.4Å; A173-A176 PolarHBondContact O-N 2.92Å; C174-A176 VanDerWaalsContact C-N 3.34Å; A176-L179 VanDerWaalsContact O-CB 3.31Å; A176-L179 WeakPolarHBondContact O-CB 3.42Å; A176-L179 PolarHBondContact O-N 3.17Å; A176-N180 PolarHBondContact O-N 3.23Å; A176-N180 VanDerWaalsContact O-N 3.17Å; A176-N180 PolarHBondContact O-ND2 3.34Å; A176-L216 HydrophobicContact CB-CD1 4.2Å
177	V	36.2	Very low	38.3	Very low	45 Å²	45	52 Å²	52	27%	0.273	27%	0.274	S	S	.	.	H	α-helix	trans	-76.7	-42.6	175.3	177.2	0	0	0	0	110.7	L59 A173 C174 L179 N180 L181	L59-V177 HydrophobicContact CD1-CG2 3.92Å; A173-V177 WeakPolarHBondContact O-CG2 3.26Å; A173-V177 PolarHBondContact O-N 3.08Å; C174-V177 PolarHBondContact O-N 3.29Å; V177-L179 PolarHBondContact O-N 3.35Å; V177-N180 PolarHBondContact O-N 3.15Å; V177-L181 HydrophobicContact CG1-CD1 3.92Å; V177-L181 PolarHBondContact O-N 3.3Å
178	L	37.9	Very low	38.2	Very low	44 Å²	44	50.1 Å²	50.1	23%	0.23	28%	0.277	C	S	.	.	H	α-helix	trans	-59	-29	166.1	-90.7	150.1	0	0	0	112.2	T121 C174 I175 F182 L208	T121-L178 HydrophobicContact CG2-CD1 3.45Å; T121-L178 VanDerWaalsContact CG2-CD1 3.45Å; T121-L178 HydrophobicContact CG2-CG 4.39Å; C174-L178 VanDerWaalsContact O-CB 3.23Å; C174-L178 WeakPolarHBondContact O-CB 3.35Å; C174-L178 WeakPolarHBondContact O-CD1 3.37Å; C174-L178 PolarHBondContact O-N 3.35Å; I175-L178 CarbonylContact O-C 3.6Å; L178-F182 HydrophobicContact CD2-CD2 3.94Å; L178-F182 HydrophobicContact CD2-CE2 4.16Å; L178-F182 WeakPolarHBondContact O-CB 3.48Å; L178-L208 HydrophobicContact CD2-CD2 4.46Å
179	L	35.8	Very low	38.3	Very low	17 Å²	17	51.2 Å²	51.2	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-76	-30.4	178.2	-97.8	161.3	0	0	0	113.6	I175 A176 V177 P183 F209 T212 T213 L216	I175-L179 HydrophobicContact CG2-CD1 3.81Å; I175-L179 HydrophobicContact CG2-CG 4.5Å; I175-L179 WeakPolarHBondContact O-CB 3.05Å; I175-L179 WeakPolarHBondContact O-CD1 3.18Å; I175-L179 WeakPolarHBondContact O-CG 3.44Å; I175-L179 PolarHBondContact O-N 3.48Å; A176-L179 VanDerWaalsContact O-CB 3.31Å; A176-L179 WeakPolarHBondContact O-CB 3.42Å; A176-L179 PolarHBondContact O-N 3.17Å; V177-L179 PolarHBondContact O-N 3.35Å; L179-P183 WeakPolarHBondContact O-CD 3.1Å; L179-P183 WeakPolarHBondContact O-CG 3.31Å; L179-F209 HydrophobicContact CD2-CD2 3.62Å; L179-F209 HydrophobicContact CD2-CE2 4Å; L179-F209 HydrophobicContact CD2-CG 4.43Å; L179-T212 WeakPolarHBondContact CD2-OG1 3.46Å; L179-T212 VanDerWaalsContact CG-CB 3.46Å; L179-T212 HydrophobicContact CG-CG2 4.25Å; L179-T212 WeakPolarHBondContact CG-OG1 3.36Å; L179-T213 HydrophobicContact CD2-CG2 4.38Å; L179-L216 HydrophobicContact CD1-CD1 3.7Å
180	N	34	Very low	38.3	Very low	116 Å²	116	51.7 Å²	51.7	62%	0.62	29%	0.285	S	S	*	.	H	α-helix	trans	-102.1	-34.3	-172.7	-74	-27.9	0	0	0	113.2	A176 V177 V184	A176-N180 PolarHBondContact O-N 3.23Å; A176-N180 VanDerWaalsContact O-N 3.17Å; A176-N180 PolarHBondContact O-ND2 3.34Å; V177-N180 PolarHBondContact O-N 3.15Å; N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.03Å
181	L	39.5	Very low	38.4	Very low	19 Å²	19	60 Å²	60	10%	0.099	32%	0.317	C	S	.	.	H	α-helix	trans	-79.8	-38	178.4	-103.7	98.4	0	0	0	113	L59 I63 L66 V177 V184 L185	L59-L181 HydrophobicContact CD2-CD1 3.58Å; I63-L181 HydrophobicContact CB-CD2 4.39Å; I63-L181 HydrophobicContact CD1-CD1 3.9Å; I63-L181 HydrophobicContact CD1-CG 4.1Å; I63-L181 HydrophobicContact CG1-CD1 3.65Å; I63-L181 HydrophobicContact CG1-CD2 3.47Å; I63-L181 VanDerWaalsContact CG1-CD2 3.47Å; I63-L181 HydrophobicContact CG1-CG 3.53Å; L66-L181 HydrophobicContact CD2-CD2 4.48Å; V177-L181 HydrophobicContact CG1-CD1 3.92Å; V177-L181 PolarHBondContact O-N 3.3Å; L181-V184 PolarHBondContact O-N 2.78Å; L181-L185 HydrophobicContact CB-CD1 4.47Å; L181-L185 HydrophobicContact CD2-CD1 3.99Å; L181-L185 WeakPolarHBondContact O-CB 3.13Å; L181-L185 PolarHBondContact O-N 3.2Å
182	F	41.1	Very low	38.2	Very low	41 Å²	41	63.5 Å²	63.5	18%	0.18	33%	0.33	C	S	.	.	H	α-helix	trans	-69.9	-39.2	-170.1	-135	-84.7	0	0	0	113.1	L125 L178 V184 N186 F201 V205	L125-F182 HydrophobicContact CD1-CE2 4.21Å; L125-F182 HydrophobicContact CD2-CE2 3.6Å; L125-F182 HydrophobicContact CD2-CZ 4.01Å; L125-F182 HydrophobicContact CG-CE2 3.87Å; L178-F182 HydrophobicContact CD2-CD2 3.94Å; L178-F182 HydrophobicContact CD2-CE2 4.16Å; L178-F182 WeakPolarHBondContact O-CB 3.48Å; F182-V184 VanDerWaalsContact C-N 3.34Å; F182-V184 PolarHBondContact O-N 2.86Å; F182-N186 WeakPolarHBondContact O-CB 3.36Å; F182-N186 PolarHBondContact O-N 2.79Å; F182-F201 HydrophobicContact CE1-CZ 4.28Å; F182-V205 HydrophobicContact CD1-CG2 3.66Å; F182-V205 HydrophobicContact CE1-CG2 3.84Å
183	P	36	Very low	38.2	Very low	48 Å²	48	68 Å²	68	31%	0.312	35%	0.349	S	S	.	.	H	α-helix	trans	-66	-34.8	172	-20.6	33.4	0	0	0	112.7	L179 N186 Y187	L179-P183 WeakPolarHBondContact O-CD 3.1Å; L179-P183 WeakPolarHBondContact O-CG 3.31Å; P183-N186 PolarHBondContact O-N 2.83Å; P183-Y187 WeakPolarHBondContact O-CB 3.44Å; P183-Y187 PolarHBondContact O-N 3.24Å
184	V	40.4	Very low	38	Very low	99 Å²	99	74.6 Å²	74.6	60%	0.6	38%	0.379	S	S	*	.	H	α-helix	trans	-72.1	-42.6	179.3	175.6	0	0	0	0	111.4	N180 L181 F182 Y187 A188	N180-V184 VanDerWaalsContact O-CG2 3.31Å; N180-V184 WeakPolarHBondContact O-CG2 3.03Å; L181-V184 PolarHBondContact O-N 2.78Å; F182-V184 VanDerWaalsContact C-N 3.34Å; F182-V184 PolarHBondContact O-N 2.86Å; V184-Y187 PolarHBondContact O-N 3.11Å; V184-A188 PolarHBondContact O-N 3.23Å; V184-A188 VanDerWaalsContact O-N 3.07Å
185	L	41.2	Very low	38.1	Very low	28 Å²	28	81.2 Å²	81.2	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-65.6	-39.2	171.8	-105.8	115	0	0	0	112.1	L66 L70 L181 A188 I189	L66-L185 HydrophobicContact CB-CD1 4.26Å; L66-L185 HydrophobicContact CD2-CD1 3.32Å; L66-L185 HydrophobicContact CD2-CD2 3.62Å; L66-L185 HydrophobicContact CD2-CG 4.08Å; L66-L185 HydrophobicContact CG-CD1 4.39Å; L66-L185 HydrophobicContact CG-CD2 4.44Å; L70-L185 HydrophobicContact CD1-CD2 3.8Å; L70-L185 HydrophobicContact CD2-CD2 3.7Å; L70-L185 HydrophobicContact CG-CD2 4.32Å; L181-L185 HydrophobicContact CB-CD1 4.47Å; L181-L185 HydrophobicContact CD2-CD1 3.99Å; L181-L185 WeakPolarHBondContact O-CB 3.13Å; L181-L185 PolarHBondContact O-N 3.2Å; L185-A188 PolarHBondContact O-N 3.43Å; L185-I189 HydrophobicContact CD2-CD1 4.43Å; L185-I189 WeakPolarHBondContact O-CB 3.48Å; L185-I189 VanDerWaalsContact O-CD1 3.31Å; L185-I189 WeakPolarHBondContact O-CD1 3.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.3Å; L185-I189 PolarHBondContact O-N 3.49Å
186	N	37.7	Very low	38.1	Very low	12 Å²	12	86 Å²	86	6%	0.064	45%	0.446	C	S	.	.	H	α-helix	trans	-68.1	-38.1	178.4	-165.4	13	0	0	0	111.8	F182 P183 A188 I189 C190 F201 V205	F182-N186 WeakPolarHBondContact O-CB 3.36Å; F182-N186 PolarHBondContact O-N 2.79Å; P183-N186 PolarHBondContact O-N 2.83Å; N186-A188 VanDerWaalsContact C-N 3.32Å; N186-A188 PolarHBondContact O-N 2.92Å; N186-I189 PolarHBondContact O-N 3.49Å; N186-C190 VanDerWaalsContact O-CB 3.3Å; N186-C190 WeakPolarHBondContact O-CB 3.17Å; N186-C190 PolarHBondContact O-N 3.49Å; N186-C190 PolarHBondContact O-SG 3.39Å; N186-C190 PolarHBondContact OD1-SG 2.77Å; N186-F201 HydrophobicContact CB-CE1 4.24Å; N186-F201 WeakPolarHBondContact OD1-CD1 3.32Å; N186-F201 WeakPolarHBondContact OD1-CE1 3.43Å; N186-V205 WeakPolarHBondContact ND2-CB 3.48Å; N186-V205 VanDerWaalsContact ND2-CG2 3.34Å; N186-V205 WeakPolarHBondContact ND2-CG2 3.33Å
187	Y	39.9	Very low	38.3	Very low	180 Å²	180	87.6 Å²	87.6	71%	0.706	46%	0.464	S	S	*	.	H	α-helix	trans	-64.7	-37.2	172.3	-141.3	-87.8	0	0	0	111.6	P183 V184 Y191	P183-Y187 WeakPolarHBondContact O-CB 3.44Å; P183-Y187 PolarHBondContact O-N 3.24Å; V184-Y187 PolarHBondContact O-N 3.11Å; Y187-Y191 WeakPolarHBondContact O-CB 3.34Å; Y187-Y191 PolarHBondContact O-N 3.32Å
188	A	39.9	Very low	38.4	Very low	48 Å²	48	87 Å²	87	40%	0.397	47%	0.467	S	S	.	.	H	α-helix	trans	-68.2	-42.5	174	0	0	0	0	0	112.3	V184 L185 N186 Y191 F192	V184-A188 PolarHBondContact O-N 3.23Å; V184-A188 VanDerWaalsContact O-N 3.07Å; L185-A188 PolarHBondContact O-N 3.43Å; N186-A188 VanDerWaalsContact C-N 3.32Å; N186-A188 PolarHBondContact O-N 2.92Å; A188-Y191 PolarHBondContact O-N 3.05Å; A188-F192 VanDerWaalsContact O-CD2 3.3Å; A188-F192 WeakPolarHBondContact O-CD2 3.41Å; A188-F192 PolarHBondContact O-N 2.83Å; A188-F192 VanDerWaalsContact O-N 3.16Å
189	I	40	Very low	38.5	Very low	57 Å²	57	87.8 Å²	87.8	29%	0.292	48%	0.476	S	S	.	.	H	α-helix	trans	-66.3	-42.8	178	-65.1	158.8	0	0	0	111	L70 L185 N186 Y191 F192 F193 F201	L70-I189 HydrophobicContact CD2-CD1 3.8Å; L70-I189 HydrophobicContact CD2-CG1 3.63Å; L185-I189 HydrophobicContact CD2-CD1 4.43Å; L185-I189 WeakPolarHBondContact O-CB 3.48Å; L185-I189 VanDerWaalsContact O-CD1 3.31Å; L185-I189 WeakPolarHBondContact O-CD1 3.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.3Å; L185-I189 PolarHBondContact O-N 3.49Å; N186-I189 PolarHBondContact O-N 3.49Å; I189-Y191 VanDerWaalsContact C-N 3.34Å; I189-Y191 PolarHBondContact O-N 2.79Å; I189-F192 PolarHBondContact O-N 2.78Å; I189-F193 PolarHBondContact O-N 3.26Å; I189-F201 HydrophobicContact CD1-CE1 4.36Å
190	C	39.7	Very low	38.6	Very low	65 Å²	65	89 Å²	89	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-70.9	-24.8	176.7	-66.5	0	0	0	0	113.5	N186	N186-C190 VanDerWaalsContact O-CB 3.3Å; N186-C190 WeakPolarHBondContact O-CB 3.17Å; N186-C190 PolarHBondContact O-N 3.49Å; N186-C190 PolarHBondContact O-SG 3.39Å; N186-C190 PolarHBondContact OD1-SG 2.77Å
191	Y	38.8	Very low	38.9	Very low	189 Å²	189	86 Å²	86	74%	0.741	46%	0.464	S	S	*	.	H	α-helix	trans	-82.1	-24.3	177.1	-164.3	-91	0	0	0	112.7	Y187 A188 I189	Y187-Y191 WeakPolarHBondContact O-CB 3.34Å; Y187-Y191 PolarHBondContact O-N 3.32Å; A188-Y191 PolarHBondContact O-N 3.05Å; I189-Y191 VanDerWaalsContact C-N 3.34Å; I189-Y191 PolarHBondContact O-N 2.79Å
192	F	36.8	Very low	39	Very low	164 Å²	164	90.1 Å²	90.1	72%	0.719	48%	0.481	S	S	*	.	H	α-helix	trans	-97.1	-19.3	-178.8	-87.7	-76.4	0	0	0	114.7	A188 I189	A188-F192 VanDerWaalsContact O-CD2 3.3Å; A188-F192 WeakPolarHBondContact O-CD2 3.41Å; A188-F192 PolarHBondContact O-N 2.83Å; A188-F192 VanDerWaalsContact O-N 3.16Å; I189-F192 PolarHBondContact O-N 2.78Å
193	F	38	Very low	38.9	Very low	145 Å²	145	89.4 Å²	89.4	64%	0.636	48%	0.478	S	S	*	.			trans	-128	104.4	-176.8	-79.7	-86.4	0	0	0	112.4	I189 E195	I189-F193 PolarHBondContact O-N 3.26Å; F193-E195 PolarHBondContact O-N 3.46Å
194	D	33.5	Very low	39.2	Very low	179 Å²	179	90 Å²	90	96%	0.957	48%	0.477	S	S	*	.			trans	-78.7	46.8	178.8	-141.3	9.1	0	0	0	111.5
195	E	40	Very low	39.2	Very low	151 Å²	151	86 Å²	86	71%	0.706	45%	0.454	S	S	*	.			trans	-109.1	125.6	-178.5	-76.8	-165.9	166	0	0	112.3	F193 G197 G198	F193-E195 PolarHBondContact O-N 3.46Å; E195-G197 PolarHBondContact O-N 3.46Å; E195-G198 PolarHBondContact O-N 2.61Å
196	S	38.1	Very low	39.3	Very low	134 Å²	134	87.2 Å²	87.2	94%	0.937	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-0.9	178.5	58.4	0	0	0	0	118.6
197	G	40.1	Very low	39.5	Very low	58 Å²	58	88.9 Å²	88.9	60%	0.598	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-3	174.7	0	0	0	0	0	115.9	E195 S199	E195-G197 PolarHBondContact O-N 3.46Å; G197-S199 VanDerWaalsContact C-N 3.31Å; G197-S199 PolarHBondContact O-N 2.81Å
198	G	38.6	Very low	39.6	Very low	33 Å²	33	83.9 Å²	83.9	34%	0.34	45%	0.452	S	S	.	.	H	α-helix	trans	-66.8	-14.1	-171.1	0	0	0	0	0	117.5	E195 L200 K202	E195-G198 PolarHBondContact O-N 2.61Å; G198-L200 PolarHBondContact O-N 3.5Å; G198-K202 WeakPolarHBondContact O-CB 3.44Å; G198-K202 PolarHBondContact O-N 2.75Å
199	S	40.1	Very low	39.7	Very low	60 Å²	60	86.8 Å²	86.8	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-70.3	-34.4	-174.8	59.8	0	0	0	0	113.9	G197 F203	G197-S199 VanDerWaalsContact C-N 3.31Å; G197-S199 PolarHBondContact O-N 2.81Å; S199-F203 VanDerWaalsContact O-CB 3.25Å; S199-F203 WeakPolarHBondContact O-CB 3.49Å; S199-F203 PolarHBondContact O-N 2.81Å; S199-F203 VanDerWaalsContact O-N 3.16Å
200	L	37.1	Very low	39.8	Very low	43 Å²	43	85.4 Å²	85.4	23%	0.225	45%	0.449	C	S	.	.	H	α-helix	trans	-80.5	-30.8	-174.5	-151.5	144.7	0	0	0	112.4	F132 G198 M204 Y267	F132-L200 HydrophobicContact CE1-CD2 4.18Å; G198-L200 PolarHBondContact O-N 3.5Å; L200-M204 PolarHBondContact O-N 3.38Å; L200-Y267 HydrophobicContact CD1-CD1 3.53Å; L200-Y267 HydrophobicContact CD1-CD2 3.32Å; L200-Y267 HydrophobicContact CD1-CE1 3.87Å; L200-Y267 HydrophobicContact CD1-CE2 3.65Å; L200-Y267 HydrophobicContact CD1-CG 3.27Å
201	F	39.7	Very low	39.8	Very low	54 Å²	54	84 Å²	84	24%	0.237	44%	0.438	C	S	.	.	H	α-helix	trans	-76.3	-41.5	176.7	-166.7	-104.1	0	0	0	111.4	F182 N186 I189 F203 M204 V205	F182-F201 HydrophobicContact CE1-CZ 4.28Å; N186-F201 HydrophobicContact CB-CE1 4.24Å; N186-F201 WeakPolarHBondContact OD1-CD1 3.32Å; N186-F201 WeakPolarHBondContact OD1-CE1 3.43Å; I189-F201 HydrophobicContact CD1-CE1 4.36Å; F201-F203 VanDerWaalsContact C-N 3.26Å; F201-F203 PolarHBondContact O-N 3.16Å; F201-M204 PolarHBondContact O-N 2.82Å; F201-V205 WeakPolarHBondContact O-CG2 3.33Å; F201-V205 PolarHBondContact O-N 3.41Å; F201-V205 VanDerWaalsContact O-N 3.15Å
202	K	42	Very low	39.9	Very low	104 Å²	104	75.5 Å²	75.5	45%	0.452	41%	0.406	S	S	.	.	H	α-helix	trans	-56.9	-42.1	169.4	-160.6	-178.5	178.6	-163.5	0	111.5	G198 V205 E206	G198-K202 WeakPolarHBondContact O-CB 3.44Å; G198-K202 PolarHBondContact O-N 2.75Å; K202-V205 PolarHBondContact O-N 2.87Å; K202-E206 WeakPolarHBondContact O-CG 3.48Å; K202-E206 PolarHBondContact O-N 2.8Å
203	F	39.9	Very low	40	Very low	27 Å²	27	69.4 Å²	69.4	12%	0.118	38%	0.382	C	S	.	.	H	α-helix	trans	-68.2	-42.4	179.7	-176	-107	0	0	0	114.7	S199 F201 V205 E206 I207 I253 F257 F271	S199-F203 VanDerWaalsContact O-CB 3.25Å; S199-F203 WeakPolarHBondContact O-CB 3.49Å; S199-F203 PolarHBondContact O-N 2.81Å; S199-F203 VanDerWaalsContact O-N 3.16Å; F201-F203 VanDerWaalsContact C-N 3.26Å; F201-F203 PolarHBondContact O-N 3.16Å; F203-V205 VanDerWaalsContact C-N 3.27Å; F203-V205 PolarHBondContact O-N 2.94Å; F203-E206 PolarHBondContact O-N 2.91Å; F203-I207 HydrophobicContact CD1-CD1 4.07Å; F203-I207 HydrophobicContact CE1-CD1 3.32Å; F203-I207 HydrophobicContact CE1-CG1 4.32Å; F203-I207 HydrophobicContact CE2-CD1 4.17Å; F203-I207 HydrophobicContact CE2-CG1 4.42Å; F203-I207 HydrophobicContact CZ-CD1 3.33Å; F203-I207 HydrophobicContact CZ-CG1 4.04Å; F203-I207 PolarHBondContact O-N 2.95Å; F203-I253 HydrophobicContact CE2-CG2 4.47Å; F203-F257 AromaticContact CD2-CD2 4Å; F203-F257 HydrophobicContact CD2-CD2 4Å; F203-F257 AromaticContact CE1-CD2 3.82Å; F203-F257 HydrophobicContact CE1-CD2 3.82Å; F203-F257 AromaticContact CE1-CE2 3.6Å; F203-F257 HydrophobicContact CE1-CE2 3.6Å; F203-F257 HydrophobicContact CE2-CB 3.94Å; F203-F257 AromaticContact CE2-CD2 3.05Å; F203-F257 HydrophobicContact CE2-CD2 3.05Å; F203-F257 AromaticContact CE2-CE2 3.66Å; F203-F257 HydrophobicContact CE2-CE2 3.66Å; F203-F257 AromaticContact CE2-CG 3.78Å; F203-F257 HydrophobicContact CE2-CG 3.78Å; F203-F257 AromaticContact CZ-CD2 2.95Å; F203-F257 HydrophobicContact CZ-CD2 2.95Å; F203-F257 AromaticContact CZ-CE2 2.97Å; F203-F257 HydrophobicContact CZ-CE2 2.97Å; F203-F257 AromaticContact CZ-CG 3.98Å; F203-F257 HydrophobicContact CZ-CG 3.98Å; F203-F257 HydrophobicContact CZ-CZ 4.04Å; F203-F271 AromaticContact CE1-CD2 3.87Å; F203-F271 HydrophobicContact CE1-CD2 3.87Å; F203-F271 AromaticContact CE1-CE2 3.58Å; F203-F271 HydrophobicContact CE1-CE2 3.58Å; F203-F271 AromaticContact CZ-CE2 3.89Å; F203-F271 HydrophobicContact CZ-CE2 3.89Å; F203-F271 HydrophobicContact CZ-CZ 4.44Å
204	M	42.3	Very low	40.2	Very low	59 Å²	59	64.7 Å²	64.7	29%	0.291	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-34.7	173.4	-82.5	-74.1	-171.5	0	0	111.8	L200 F201 L208	L200-M204 PolarHBondContact O-N 3.38Å; F201-M204 PolarHBondContact O-N 2.82Å; M204-L208 WeakPolarHBondContact O-CB 3.49Å; M204-L208 PolarHBondContact O-N 2.9Å
205	V	41.2	Very low	40.5	Very low	17 Å²	17	59.7 Å²	59.7	10%	0.103	34%	0.338	C	S	.	.	H	α-helix	trans	-71.5	-35.2	176.5	171.7	0	0	0	0	112	F182 N186 F201 K202 F203 L208 F209	F182-V205 HydrophobicContact CD1-CG2 3.66Å; F182-V205 HydrophobicContact CE1-CG2 3.84Å; N186-V205 WeakPolarHBondContact ND2-CB 3.48Å; N186-V205 VanDerWaalsContact ND2-CG2 3.34Å; N186-V205 WeakPolarHBondContact ND2-CG2 3.33Å; F201-V205 WeakPolarHBondContact O-CG2 3.33Å; F201-V205 PolarHBondContact O-N 3.41Å; F201-V205 VanDerWaalsContact O-N 3.15Å; K202-V205 PolarHBondContact O-N 2.87Å; F203-V205 VanDerWaalsContact C-N 3.27Å; F203-V205 PolarHBondContact O-N 2.94Å; V205-L208 PolarHBondContact O-N 3.12Å; V205-F209 VanDerWaalsContact O-CB 3.23Å; V205-F209 WeakPolarHBondContact O-CB 3.48Å; V205-F209 PolarHBondContact O-N 3.22Å
206	E	41.8	Very low	40.4	Very low	52 Å²	52	55.4 Å²	55.4	24%	0.243	32%	0.32	C	S	.	.	H	α-helix	trans	-69	-38.3	173.6	-76.6	171.2	-172.1	0	0	113	K202 F203 F209 L210	K202-E206 WeakPolarHBondContact O-CG 3.48Å; K202-E206 PolarHBondContact O-N 2.8Å; F203-E206 PolarHBondContact O-N 2.91Å; E206-F209 PolarHBondContact O-N 3.19Å; E206-L210 WeakPolarHBondContact O-CB 3.32Å; E206-L210 PolarHBondContact O-N 2.81Å
207	I	42.6	Very low	40.5	Very low	48 Å²	48	52.5 Å²	52.5	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-66.6	-43.7	172.1	-71.2	174.6	0	0	0	110.8	F203 F209 L210 V211 F271	F203-I207 HydrophobicContact CD1-CD1 4.07Å; F203-I207 HydrophobicContact CE1-CD1 3.32Å; F203-I207 HydrophobicContact CE1-CG1 4.32Å; F203-I207 HydrophobicContact CE2-CD1 4.17Å; F203-I207 HydrophobicContact CE2-CG1 4.42Å; F203-I207 HydrophobicContact CZ-CD1 3.33Å; F203-I207 HydrophobicContact CZ-CG1 4.04Å; F203-I207 PolarHBondContact O-N 2.95Å; I207-F209 VanDerWaalsContact C-N 3.3Å; I207-F209 PolarHBondContact O-N 3.24Å; I207-L210 PolarHBondContact O-N 3.44Å; I207-V211 HydrophobicContact CG2-CG2 4.36Å; I207-V211 VanDerWaalsContact O-CG2 3.28Å; I207-V211 WeakPolarHBondContact O-CG2 3.27Å; I207-V211 PolarHBondContact O-N 2.9Å; I207-F271 HydrophobicContact CD1-CE2 3.63Å; I207-F271 HydrophobicContact CD1-CZ 4.41Å
208	L	41.9	Very low	40.5	Very low	75 Å²	75	52 Å²	52	39%	0.393	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-46.3	175.8	-143.9	83.9	0	0	0	109.5	L178 M204 V205 L210 V211 T212	L178-L208 HydrophobicContact CD2-CD2 4.46Å; M204-L208 WeakPolarHBondContact O-CB 3.49Å; M204-L208 PolarHBondContact O-N 2.9Å; V205-L208 PolarHBondContact O-N 3.12Å; L208-L210 PolarHBondContact O-N 2.91Å; L208-V211 PolarHBondContact O-N 2.84Å; L208-T212 WeakPolarHBondContact O-CB 3.4Å; L208-T212 WeakPolarHBondContact O-CG2 3.44Å; L208-T212 PolarHBondContact O-N 2.7Å; L208-T212 PolarHBondContact O-OG1 3.32Å
209	F	42.3	Very low	40.5	Very low	109 Å²	109	50.8 Å²	50.8	48%	0.478	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-40.3	175.7	-174.9	-97.4	0	0	0	112.9	L179 V205 E206 I207 T212 T213	L179-F209 HydrophobicContact CD2-CD2 3.62Å; L179-F209 HydrophobicContact CD2-CE2 4Å; L179-F209 HydrophobicContact CD2-CG 4.43Å; V205-F209 VanDerWaalsContact O-CB 3.23Å; V205-F209 WeakPolarHBondContact O-CB 3.48Å; V205-F209 PolarHBondContact O-N 3.22Å; E206-F209 PolarHBondContact O-N 3.19Å; I207-F209 VanDerWaalsContact C-N 3.3Å; I207-F209 PolarHBondContact O-N 3.24Å; F209-T212 VanDerWaalsContact CA-OG1 3.3Å; F209-T212 WeakPolarHBondContact CA-OG1 3.43Å; F209-T212 PolarHBondContact O-OG1 3.43Å; F209-T212 VanDerWaalsContact O-OG1 3.06Å; F209-T213 HydrophobicContact CD1-CG2 4.24Å; F209-T213 HydrophobicContact CE1-CG2 3.9Å; F209-T213 HydrophobicContact CE2-CG2 4.2Å; F209-T213 HydrophobicContact CZ-CG2 3.87Å; F209-T213 VanDerWaalsContact O-CB 3.31Å; F209-T213 WeakPolarHBondContact O-CB 3.09Å; F209-T213 WeakPolarHBondContact O-CG2 3.41Å; F209-T213 PolarHBondContact O-N 2.86Å; F209-T213 PolarHBondContact O-OG1 3.25Å
210	L	41.4	Very low	40.4	Very low	28 Å²	28	53.3 Å²	53.3	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-67.8	-42.6	177.3	-166.3	82.9	0	0	0	112.3	E206 I207 L208 T212 T213 T214 I249 L250 I253	E206-L210 WeakPolarHBondContact O-CB 3.32Å; E206-L210 PolarHBondContact O-N 2.81Å; I207-L210 PolarHBondContact O-N 3.44Å; L208-L210 PolarHBondContact O-N 2.91Å; L210-T212 VanDerWaalsContact C-N 3.33Å; L210-T213 WeakPolarHBondContact CA-OG1 3.38Å; L210-T213 PolarHBondContact O-OG1 2.96Å; L210-T214 WeakPolarHBondContact O-CB 3.22Å; L210-T214 WeakPolarHBondContact O-CG2 3.49Å; L210-T214 PolarHBondContact O-N 3.34Å; L210-T214 PolarHBondContact O-OG1 3.36Å; L210-I249 HydrophobicContact CD1-CB 4.33Å; L210-I249 HydrophobicContact CD1-CG2 3.45Å; L210-I249 VanDerWaalsContact CD1-CG2 3.45Å; L210-L250 HydrophobicContact CD2-CD1 3.85Å; L210-L250 HydrophobicContact CD2-CG 4.33Å; L210-I253 HydrophobicContact CD1-CD1 3.98Å
211	V	40.7	Very low	40.4	Very low	35 Å²	35	53.6 Å²	53.6	21%	0.212	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-36.2	178.8	170.9	0	0	0	0	111.2	I207 L208 T214 N215 F278	I207-V211 HydrophobicContact CG2-CG2 4.36Å; I207-V211 VanDerWaalsContact O-CG2 3.28Å; I207-V211 WeakPolarHBondContact O-CG2 3.27Å; I207-V211 PolarHBondContact O-N 2.9Å; L208-V211 PolarHBondContact O-N 2.84Å; V211-T214 WeakPolarHBondContact CA-OG1 3.43Å; V211-T214 PolarHBondContact O-OG1 3.29Å; V211-T214 VanDerWaalsContact O-OG1 3.05Å; V211-N215 WeakPolarHBondContact O-CB 3.32Å; V211-N215 VanDerWaalsContact O-CG 3.32Å; V211-N215 PolarHBondContact O-N 3.3Å; V211-N215 VanDerWaalsContact O-N 3.16Å; V211-N215 PolarHBondContact O-ND2 3.31Å; V211-N215 VanDerWaalsContact O-ND2 3.11Å; V211-F278 HydrophobicContact CG1-CE2 3.98Å; V211-F278 HydrophobicContact CG1-CZ 4.15Å; V211-F278 HydrophobicContact CG2-CE1 4.48Å; V211-F278 HydrophobicContact CG2-CE2 3.82Å; V211-F278 HydrophobicContact CG2-CZ 3.5Å
212	T	39.8	Very low	40.1	Very low	10 Å²	10	57.9 Å²	57.9	6%	0.061	29%	0.288	C	S	.	.	H	α-helix	trans	-82.4	-37.1	-178.2	53.9	0	0	0	0	112	I175 L179 L208 F209 L210 N215 L216	I175-T212 HydrophobicContact CB-CG2 4.39Å; I175-T212 HydrophobicContact CG1-CG2 4.42Å; I175-T212 VanDerWaalsContact CG2-CB 3.43Å; I175-T212 HydrophobicContact CG2-CG2 3.48Å; I175-T212 VanDerWaalsContact CG2-CG2 3.48Å; L179-T212 WeakPolarHBondContact CD2-OG1 3.46Å; L179-T212 VanDerWaalsContact CG-CB 3.46Å; L179-T212 HydrophobicContact CG-CG2 4.25Å; L179-T212 WeakPolarHBondContact CG-OG1 3.36Å; L208-T212 WeakPolarHBondContact O-CB 3.4Å; L208-T212 WeakPolarHBondContact O-CG2 3.44Å; L208-T212 PolarHBondContact O-N 2.7Å; L208-T212 PolarHBondContact O-OG1 3.32Å; F209-T212 VanDerWaalsContact CA-OG1 3.3Å; F209-T212 WeakPolarHBondContact CA-OG1 3.43Å; F209-T212 PolarHBondContact O-OG1 3.43Å; F209-T212 VanDerWaalsContact O-OG1 3.06Å; L210-T212 VanDerWaalsContact C-N 3.33Å; T212-N215 PolarHBondContact O-N 2.95Å; T212-L216 WeakPolarHBondContact O-CB 3.43Å; T212-L216 PolarHBondContact O-N 2.82Å
213	T	39.7	Very low	39.8	Very low	36 Å²	36	58.3 Å²	58.3	22%	0.221	30%	0.299	C	S	.	.	H	α-helix	trans	-65.4	-39.2	170.3	45.4	0	0	0	0	112.3	L179 F209 L210 L216 I217	L179-T213 HydrophobicContact CD2-CG2 4.38Å; F209-T213 HydrophobicContact CD1-CG2 4.24Å; F209-T213 HydrophobicContact CE1-CG2 3.9Å; F209-T213 HydrophobicContact CE2-CG2 4.2Å; F209-T213 HydrophobicContact CZ-CG2 3.87Å; F209-T213 VanDerWaalsContact O-CB 3.31Å; F209-T213 WeakPolarHBondContact O-CB 3.09Å; F209-T213 WeakPolarHBondContact O-CG2 3.41Å; F209-T213 PolarHBondContact O-N 2.86Å; F209-T213 PolarHBondContact O-OG1 3.25Å; L210-T213 WeakPolarHBondContact CA-OG1 3.38Å; L210-T213 PolarHBondContact O-OG1 2.96Å; T213-L216 PolarHBondContact O-N 3.44Å; T213-I217 WeakPolarHBondContact O-CB 3.48Å; T213-I217 WeakPolarHBondContact O-CD1 3.25Å; T213-I217 WeakPolarHBondContact O-CG1 3.38Å; T213-I217 PolarHBondContact O-N 2.98Å
214	T	40.6	Very low	39.5	Very low	47 Å²	47	62.5 Å²	62.5	29%	0.288	32%	0.319	S	S	.	.	H	α-helix	trans	-65.9	-38.8	174.8	42.8	0	0	0	0	112.7	L210 V211 S218 T246	L210-T214 WeakPolarHBondContact O-CB 3.22Å; L210-T214 WeakPolarHBondContact O-CG2 3.49Å; L210-T214 PolarHBondContact O-N 3.34Å; L210-T214 PolarHBondContact O-OG1 3.36Å; V211-T214 WeakPolarHBondContact CA-OG1 3.43Å; V211-T214 PolarHBondContact O-OG1 3.29Å; V211-T214 VanDerWaalsContact O-OG1 3.05Å; T214-S218 WeakPolarHBondContact O-CB 3.46Å; T214-S218 PolarHBondContact O-N 2.84Å; T214-T246 HydrophobicContact CG2-CG2 3.47Å; T214-T246 VanDerWaalsContact CG2-CG2 3.47Å
215	N	40	Very low	39.2	Very low	73 Å²	73	63.2 Å²	63.2	39%	0.39	33%	0.33	S	S	.	.	H	α-helix	trans	-70	-37.6	173.7	-77.7	-30.7	0	0	0	112.8	V211 T212 S218 S219	V211-N215 WeakPolarHBondContact O-CB 3.32Å; V211-N215 VanDerWaalsContact O-CG 3.32Å; V211-N215 PolarHBondContact O-N 3.3Å; V211-N215 VanDerWaalsContact O-N 3.16Å; V211-N215 PolarHBondContact O-ND2 3.31Å; V211-N215 VanDerWaalsContact O-ND2 3.11Å; T212-N215 PolarHBondContact O-N 2.95Å; N215-S218 WeakPolarHBondContact O-CB 3.37Å; N215-S218 PolarHBondContact O-N 3.36Å; N215-S219 WeakPolarHBondContact O-CB 3.26Å; N215-S219 PolarHBondContact O-N 3.38Å; N215-S219 PolarHBondContact O-OG 2.95Å
216	L	39.5	Very low	38.7	Very low	61 Å²	61	66.7 Å²	66.7	32%	0.319	35%	0.347	S	S	.	.	H	α-helix	trans	-70.5	-39.1	178.2	-165.9	139.7	0	0	0	111.8	A176 L179 T212 T213 S219 H220	A176-L216 HydrophobicContact CB-CD1 4.2Å; L179-L216 HydrophobicContact CD1-CD1 3.7Å; T212-L216 WeakPolarHBondContact O-CB 3.43Å; T212-L216 PolarHBondContact O-N 2.82Å; T213-L216 PolarHBondContact O-N 3.44Å; L216-S219 PolarHBondContact O-N 3.39Å; L216-S219 PolarHBondContact O-OG 3.43Å; L216-S219 VanDerWaalsContact O-OG 3.04Å; L216-H220 WeakPolarHBondContact O-CB 3.37Å; L216-H220 PolarHBondContact O-N 3.28Å
217	I	40	Very low	38.3	Very low	73 Å²	73	67.2 Å²	67.2	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-67.3	-41.3	172.5	-64.2	161.6	0	0	0	110.3	T213 S219 L221 L242	T213-I217 WeakPolarHBondContact O-CB 3.48Å; T213-I217 WeakPolarHBondContact O-CD1 3.25Å; T213-I217 WeakPolarHBondContact O-CG1 3.38Å; T213-I217 PolarHBondContact O-N 2.98Å; I217-S219 VanDerWaalsContact C-N 3.31Å; I217-S219 PolarHBondContact O-N 3.48Å; I217-L221 HydrophobicContact CG2-CD1 3.67Å; I217-L221 HydrophobicContact CG2-CG 4.28Å; I217-L221 VanDerWaalsContact O-CB 3.27Å; I217-L221 WeakPolarHBondContact O-CB 3.41Å; I217-L221 VanDerWaalsContact O-CD1 3.32Å; I217-L221 WeakPolarHBondContact O-CD1 3.36Å; I217-L221 WeakPolarHBondContact O-CG 3.49Å; I217-L221 PolarHBondContact O-N 2.98Å; I217-L242 HydrophobicContact CG2-CD1 3.47Å; I217-L242 VanDerWaalsContact CG2-CD1 3.47Å
218	S	39.5	Very low	37.9	Very low	49 Å²	49	69 Å²	69	34%	0.343	37%	0.365	S	S	.	.	H	α-helix	trans	-59	-40.1	174.6	164	0	0	0	0	112.3	T214 N215 R222	T214-S218 WeakPolarHBondContact O-CB 3.46Å; T214-S218 PolarHBondContact O-N 2.84Å; N215-S218 WeakPolarHBondContact O-CB 3.37Å; N215-S218 PolarHBondContact O-N 3.36Å; S218-R222 PolarHBondContact O-N 3.28Å
219	S	39	Very low	37.6	Very low	7 Å²	7	69.2 Å²	69.2	5%	0.049	38%	0.377	C	S	.	.	H	α-helix	trans	-78.7	-41.1	179.9	73.3	0	0	0	0	113.9	E172 N215 L216 I217 L221 R222 V223	E172-S219 WeakPolarHBondContact OE1-CB 3.09Å; E172-S219 WeakPolarHBondContact OE2-CB 3.42Å; E172-S219 PolarHBondContact OE2-OG 2.97Å; N215-S219 WeakPolarHBondContact O-CB 3.26Å; N215-S219 PolarHBondContact O-N 3.38Å; N215-S219 PolarHBondContact O-OG 2.95Å; L216-S219 PolarHBondContact O-N 3.39Å; L216-S219 PolarHBondContact O-OG 3.43Å; L216-S219 VanDerWaalsContact O-OG 3.04Å; I217-S219 VanDerWaalsContact C-N 3.31Å; I217-S219 PolarHBondContact O-N 3.48Å; S219-L221 VanDerWaalsContact C-N 3.31Å; S219-L221 PolarHBondContact O-N 3.04Å; S219-R222 WeakPolarHBondContact O-CA 3.26Å; S219-R222 VanDerWaalsContact O-CB 3.27Å; S219-R222 WeakPolarHBondContact O-CB 3.34Å; S219-R222 PolarHBondContact O-N 2.78Å; S219-V223 WeakPolarHBondContact O-CG2 3.27Å; S219-V223 PolarHBondContact O-N 3.17Å
220	H	37.1	Very low	37.3	Very low	112 Å²	112	73.4 Å²	73.4	52%	0.519	40%	0.396	S	S	.	.	H	α-helix	trans	-62.5	-39	175.8	-123.1	10.9	0	0	0	111.8	L216 R222 V223 Q224	L216-H220 WeakPolarHBondContact O-CB 3.37Å; L216-H220 PolarHBondContact O-N 3.28Å; H220-R222 PolarHBondContact O-N 3.48Å; H220-V223 PolarHBondContact O-N 3.23Å; H220-Q224 PolarHBondContact O-N 2.95Å; H220-Q224 VanDerWaalsContact O-N 3.08Å
221	L	36.8	Very low	36.9	Very low	50 Å²	50	73.9 Å²	73.9	26%	0.262	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-22	173	-73.9	168	0	0	0	113	I217 S219 L226 L227 L242	I217-L221 HydrophobicContact CG2-CD1 3.67Å; I217-L221 HydrophobicContact CG2-CG 4.28Å; I217-L221 VanDerWaalsContact O-CB 3.27Å; I217-L221 WeakPolarHBondContact O-CB 3.41Å; I217-L221 VanDerWaalsContact O-CD1 3.32Å; I217-L221 WeakPolarHBondContact O-CD1 3.36Å; I217-L221 WeakPolarHBondContact O-CG 3.49Å; I217-L221 PolarHBondContact O-N 2.98Å; S219-L221 VanDerWaalsContact C-N 3.31Å; S219-L221 PolarHBondContact O-N 3.04Å; L221-L226 HydrophobicContact CD2-CB 4.4Å; L221-L226 HydrophobicContact CD2-CD1 4.48Å; L221-L227 HydrophobicContact CB-CD1 3.64Å; L221-L227 HydrophobicContact CB-CG 4.09Å; L221-L227 WeakPolarHBondContact O-CG 3.24Å; L221-L227 PolarHBondContact O-N 3.32Å; L221-L242 HydrophobicContact CD1-CD1 4.46Å
222	R	34	Very low	36.7	Very low	143 Å²	143	77.7 Å²	77.7	54%	0.54	43%	0.43	S	S	.	.	H	α-helix	trans	-86.4	-41.7	179.6	-157.2	-179.4	-172.5	-175.9	1.8	111.4	S218 S219 H220 L227	S218-R222 PolarHBondContact O-N 3.28Å; S219-R222 WeakPolarHBondContact O-CA 3.26Å; S219-R222 VanDerWaalsContact O-CB 3.27Å; S219-R222 WeakPolarHBondContact O-CB 3.34Å; S219-R222 PolarHBondContact O-N 2.78Å; H220-R222 PolarHBondContact O-N 3.48Å; R222-L227 HydrophobicContact CB-CD1 4.13Å
223	V	35.1	Very low	36.4	Very low	114 Å²	114	83.9 Å²	83.9	69%	0.691	46%	0.462	S	S	*	.	H	α-helix	trans	-68.2	-37	177.3	174.9	0	0	0	0	111.6	S219 H220 S225	S219-V223 WeakPolarHBondContact O-CG2 3.27Å; S219-V223 PolarHBondContact O-N 3.17Å; H220-V223 PolarHBondContact O-N 3.23Å; V223-S225 PolarHBondContact O-N 2.79Å; V223-S225 VanDerWaalsContact O-N 3.16Å
224	Q	34.9	Very low	36.3	Very low	115 Å²	115	86.7 Å²	86.7	54%	0.537	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	11.8	179.6	-73.8	-170.3	-19	0	0	115.1	H220 L226	H220-Q224 PolarHBondContact O-N 2.95Å; H220-Q224 VanDerWaalsContact O-N 3.08Å; Q224-L226 HydrophobicContact CB-CD1 3.98Å; Q224-L226 PolarHBondContact O-N 3.29Å
225	S	35.1	Very low	36	Very low	73 Å²	73	87.9 Å²	87.9	51%	0.51	48%	0.477	S	S	.	.	S	Bend	trans	58.4	0.6	-177.2	76.8	0	0	0	0	116.5	V223 L227 T228	V223-S225 PolarHBondContact O-N 2.79Å; V223-S225 VanDerWaalsContact O-N 3.16Å; S225-L227 PolarHBondContact O-N 2.91Å; S225-L227 VanDerWaalsContact O-N 3.14Å; S225-T228 WeakPolarHBondContact O-CB 3.23Å; S225-T228 WeakPolarHBondContact O-CG2 3.22Å; S225-T228 PolarHBondContact O-N 3.17Å; S225-T228 PolarHBondContact O-OG1 2.96Å
226	L	31.9	Very low	35.8	Very low	90 Å²	90	91.3 Å²	91.3	47%	0.471	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.6	175	-90.6	148.8	0	0	0	113.1	L221 Q224	L221-L226 HydrophobicContact CD2-CB 4.4Å; L221-L226 HydrophobicContact CD2-CD1 4.48Å; Q224-L226 HydrophobicContact CB-CD1 3.98Å; Q224-L226 PolarHBondContact O-N 3.29Å
227	L	33.1	Very low	35.6	Very low	63 Å²	63	93.5 Å²	93.5	33%	0.33	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	1.3	175.3	-82	167.8	0	0	0	115.1	L221 R222 S225 R295	L221-L227 HydrophobicContact CB-CD1 3.64Å; L221-L227 HydrophobicContact CB-CG 4.09Å; L221-L227 WeakPolarHBondContact O-CG 3.24Å; L221-L227 PolarHBondContact O-N 3.32Å; R222-L227 HydrophobicContact CB-CD1 4.13Å; S225-L227 PolarHBondContact O-N 2.91Å; S225-L227 VanDerWaalsContact O-N 3.14Å; L227-R295 PolarHBondContact O-NH2 2.82Å
228	T	33.2	Very low	35.3	Very low	86 Å²	86	93 Å²	93	53%	0.528	51%	0.505	S	S	.	.	S	Bend	trans	-69.6	144.9	177	60.8	0	0	0	0	111.4	S225 K230	S225-T228 WeakPolarHBondContact O-CB 3.23Å; S225-T228 WeakPolarHBondContact O-CG2 3.22Å; S225-T228 PolarHBondContact O-N 3.17Å; S225-T228 PolarHBondContact O-OG1 2.96Å; T228-K230 PolarHBondContact O-N 3.28Å
229	A	37.1	Very low	35.1	Very low	79 Å²	79	98 Å²	98	65%	0.653	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-7.5	-162.4	0	0	0	0	0	116.4	K235	A229-K235 PolarHBondContact O-NZ 3.37Å
230	K	34.8	Very low	34.9	Very low	198 Å²	198	104.3 Å²	104.3	86%	0.861	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-17.1	-165.2	-74.6	-176.3	173.8	-178.9	0	116.5	T228	T228-K230 PolarHBondContact O-N 3.28Å
231	G	33	Very low	34.9	Very low	37 Å²	37	102.1 Å²	102.1	38%	0.381	54%	0.541	S	S	.	.			trans	-91.1	110	179.2	0	0	0	0	0	113	K235	G231-K235 WeakPolarHBondContact O-CD 3.31Å; G231-K235 WeakPolarHBondContact O-CG 3.35Å
232	T	37.7	Very low	35.1	Very low	116 Å²	116	103.1 Å²	103.1	71%	0.712	55%	0.546	S	S	*	.	S	Bend	trans	-78.6	-33.2	179.2	45.2	0	0	0	0	113.1
233	L	31.7	Very low	35.2	Very low	140 Å²	140	99.1 Å²	99.1	73%	0.733	54%	0.539	S	S	*	.	S	Bend	trans	-81.1	-37.8	-177.7	-117.7	89.9	0	0	0	114	K235 Q236	L233-K235 PolarHBondContact O-N 3.42Å; L233-Q236 PolarHBondContact O-N 3.38Å
234	N	38.1	Very low	35.3	Very low	94 Å²	94	98.4 Å²	98.4	50%	0.503	53%	0.53	S	S	.	.	H	α-helix	trans	-70.1	-14.4	178.6	-91.8	-7.2	0	0	0	114	S238	N234-S238 WeakPolarHBondContact O-CB 3.29Å; N234-S238 PolarHBondContact O-N 3.24Å; N234-S238 PolarHBondContact O-OG 3.21Å
235	K	35	Very low	35.5	Very low	73 Å²	73	99.1 Å²	99.1	32%	0.317	53%	0.532	S	S	.	.	H	α-helix	trans	-72.4	-27.9	178.3	-84.7	173.3	-175.9	164.8	0	113.2	A229 G231 L233 R239	A229-K235 PolarHBondContact O-NZ 3.37Å; G231-K235 WeakPolarHBondContact O-CD 3.31Å; G231-K235 WeakPolarHBondContact O-CG 3.35Å; L233-K235 PolarHBondContact O-N 3.42Å; K235-R239 VanDerWaalsContact O-CB 3.28Å; K235-R239 WeakPolarHBondContact O-CB 3.33Å; K235-R239 WeakPolarHBondContact O-CD 3.48Å; K235-R239 WeakPolarHBondContact O-CG 3.46Å; K235-R239 PolarHBondContact O-N 3.34Å
236	Q	35.8	Very low	35.7	Very low	144 Å²	144	96.5 Å²	96.5	67%	0.673	51%	0.513	S	S	*	.	H	α-helix	trans	-82	-42.3	179.5	-85	179.8	-26.5	0	0	112.1	L233 R239 M240	L233-Q236 PolarHBondContact O-N 3.38Å; Q236-R239 PolarHBondContact O-N 2.93Å; Q236-M240 PolarHBondContact O-N 3.34Å
237	I	33.9	Very low	35.9	Very low	108 Å²	108	93.6 Å²	93.6	55%	0.554	50%	0.504	S	S	*	.	H	α-helix	trans	-68.3	-44.2	-179.8	-60.3	172.8	0	0	0	110.5	R239 M240 V241	I237-R239 VanDerWaalsContact C-N 3.29Å; I237-R239 PolarHBondContact O-N 3.13Å; I237-M240 PolarHBondContact O-N 3.43Å; I237-V241 HydrophobicContact CG2-CG2 3.81Å; I237-V241 WeakPolarHBondContact O-CB 3.43Å; I237-V241 WeakPolarHBondContact O-CG2 3.22Å; I237-V241 PolarHBondContact O-N 2.95Å
238	S	35.1	Very low	36.1	Very low	63 Å²	63	94.6 Å²	94.6	44%	0.441	51%	0.509	S	S	.	.	H	α-helix	trans	-66.1	-27.3	175.4	59.4	0	0	0	0	114	N234	N234-S238 WeakPolarHBondContact O-CB 3.29Å; N234-S238 PolarHBondContact O-N 3.24Å; N234-S238 PolarHBondContact O-OG 3.21Å
239	R	35.3	Very low	36.3	Very low	153 Å²	153	94.1 Å²	94.1	58%	0.577	50%	0.503	S	S	*	.	H	α-helix	trans	-72.4	-25	175.4	-84.4	173.5	-172.2	-177.8	-1.9	113.7	K235 Q236 I237 P243	K235-R239 VanDerWaalsContact O-CB 3.28Å; K235-R239 WeakPolarHBondContact O-CB 3.33Å; K235-R239 WeakPolarHBondContact O-CD 3.48Å; K235-R239 WeakPolarHBondContact O-CG 3.46Å; K235-R239 PolarHBondContact O-N 3.34Å; Q236-R239 PolarHBondContact O-N 2.93Å; I237-R239 VanDerWaalsContact C-N 3.29Å; I237-R239 PolarHBondContact O-N 3.13Å; R239-P243 WeakPolarHBondContact O-CD 3.29Å; R239-P243 WeakPolarHBondContact O-CG 3.36Å
240	M	35	Very low	36.5	Very low	139 Å²	139	92.1 Å²	92.1	69%	0.685	48%	0.481	S	S	*	.	H	α-helix	trans	-98.8	-42.1	177.8	-90.2	-155.4	162.7	0	0	112.8	Q236 I237 P243 L244	Q236-M240 PolarHBondContact O-N 3.34Å; I237-M240 PolarHBondContact O-N 3.43Å; M240-P243 WeakPolarHBondContact O-CD 3.42Å; M240-L244 VanDerWaalsContact O-CB 3.3Å; M240-L244 WeakPolarHBondContact O-CB 3.45Å; M240-L244 PolarHBondContact O-N 3.45Å; M240-L244 VanDerWaalsContact O-N 3.12Å
241	V	35.8	Very low	36.6	Very low	67 Å²	67	88.6 Å²	88.6	41%	0.406	47%	0.471	S	S	.	.	H	α-helix	trans	-70.1	-39.8	-170.8	174.9	0	0	0	0	112.1	I237 L244 F245	I237-V241 HydrophobicContact CG2-CG2 3.81Å; I237-V241 WeakPolarHBondContact O-CB 3.43Å; I237-V241 WeakPolarHBondContact O-CG2 3.22Å; I237-V241 PolarHBondContact O-N 2.95Å; V241-L244 PolarHBondContact O-N 3.44Å; V241-F245 HydrophobicContact CG1-CD2 3.75Å; V241-F245 HydrophobicContact CG1-CE2 4.03Å; V241-F245 PolarHBondContact O-N 3.01Å
242	L	40.7	Very low	36.8	Very low	71 Å²	71	92.4 Å²	92.4	37%	0.372	48%	0.483	S	S	.	.	H	α-helix	trans	-68.6	-46.8	-177.8	-157.4	78.3	0	0	0	112.3	I217 L221 L244 F245 T246	I217-L242 HydrophobicContact CG2-CD1 3.47Å; I217-L242 VanDerWaalsContact CG2-CD1 3.47Å; L221-L242 HydrophobicContact CD1-CD1 4.46Å; L242-L244 VanDerWaalsContact C-N 3.34Å; L242-L244 PolarHBondContact O-N 3.5Å; L242-F245 PolarHBondContact O-N 2.87Å; L242-T246 PolarHBondContact O-N 3.37Å; L242-T246 PolarHBondContact O-OG1 3.35Å
243	P	37.4	Very low	37	Very low	58 Å²	58	88.7 Å²	88.7	38%	0.377	46%	0.458	S	S	.	.	H	α-helix	trans	-63	-35.4	171.9	-23.6	35.9	0	0	0	113.7	R239 M240 T246 G247	R239-P243 WeakPolarHBondContact O-CD 3.29Å; R239-P243 WeakPolarHBondContact O-CG 3.36Å; M240-P243 WeakPolarHBondContact O-CD 3.42Å; P243-T246 VanDerWaalsContact CA-OG1 3.25Å; P243-T246 WeakPolarHBondContact CA-OG1 3.42Å; P243-T246 PolarHBondContact O-OG1 3.45Å; P243-G247 WeakPolarHBondContact O-CA 3.45Å; P243-G247 PolarHBondContact O-N 2.87Å
244	L	36.9	Very low	37.6	Very low	99 Å²	99	83.8 Å²	83.8	52%	0.518	43%	0.432	S	S	.	.	H	α-helix	trans	-65.9	-47	176.7	-111.6	142.3	0	0	0	111.8	M240 V241 L242 G247 I248	M240-L244 VanDerWaalsContact O-CB 3.3Å; M240-L244 WeakPolarHBondContact O-CB 3.45Å; M240-L244 PolarHBondContact O-N 3.45Å; M240-L244 VanDerWaalsContact O-N 3.12Å; V241-L244 PolarHBondContact O-N 3.44Å; L242-L244 VanDerWaalsContact C-N 3.34Å; L242-L244 PolarHBondContact O-N 3.5Å; L244-G247 PolarHBondContact O-N 2.93Å; L244-I248 HydrophobicContact CD2-CD1 3.91Å; L244-I248 HydrophobicContact CD2-CG1 4.49Å; L244-I248 WeakPolarHBondContact O-CB 3.4Å; L244-I248 WeakPolarHBondContact O-CD1 3.37Å; L244-I248 WeakPolarHBondContact O-CG1 3.22Å; L244-I248 PolarHBondContact O-N 3.08Å
245	F	39.8	Very low	37.7	Very low	131 Å²	131	83.8 Å²	83.8	58%	0.575	44%	0.436	S	S	*	.	H	α-helix	trans	-65.2	-43.7	177.3	-97.8	-87.1	0	0	0	111.8	V241 L242 G247 I248 I249	V241-F245 HydrophobicContact CG1-CD2 3.75Å; V241-F245 HydrophobicContact CG1-CE2 4.03Å; V241-F245 PolarHBondContact O-N 3.01Å; L242-F245 PolarHBondContact O-N 2.87Å; F245-G247 VanDerWaalsContact C-N 3.28Å; F245-G247 PolarHBondContact O-N 3.39Å; F245-I248 PolarHBondContact O-N 3.3Å; F245-I249 WeakPolarHBondContact O-CB 3.39Å; F245-I249 WeakPolarHBondContact O-CD1 3.47Å; F245-I249 WeakPolarHBondContact O-CG1 3.44Å; F245-I249 PolarHBondContact O-N 2.75Å
246	T	38.4	Very low	38	Very low	18 Å²	18	85.6 Å²	85.6	11%	0.11	45%	0.445	C	S	.	.	H	α-helix	trans	-63.8	-35.3	172.3	44.7	0	0	0	0	112.2	T214 L242 P243 L250	T214-T246 HydrophobicContact CG2-CG2 3.47Å; T214-T246 VanDerWaalsContact CG2-CG2 3.47Å; L242-T246 PolarHBondContact O-N 3.37Å; L242-T246 PolarHBondContact O-OG1 3.35Å; P243-T246 VanDerWaalsContact CA-OG1 3.25Å; P243-T246 WeakPolarHBondContact CA-OG1 3.42Å; P243-T246 PolarHBondContact O-OG1 3.45Å; T246-L250 VanDerWaalsContact O-CB 3.29Å; T246-L250 WeakPolarHBondContact O-CB 3.33Å; T246-L250 WeakPolarHBondContact O-CD1 3.16Å; T246-L250 PolarHBondContact O-N 3.43Å
247	G	35.7	Very low	38.2	Very low	28 Å²	28	80 Å²	80	29%	0.289	42%	0.419	S	S	.	.	H	α-helix	trans	-69.2	-40.1	177.6	0	0	0	0	0	113.1	P243 L244 F245 L250 L251	P243-G247 WeakPolarHBondContact O-CA 3.45Å; P243-G247 PolarHBondContact O-N 2.87Å; L244-G247 PolarHBondContact O-N 2.93Å; F245-G247 VanDerWaalsContact C-N 3.28Å; F245-G247 PolarHBondContact O-N 3.39Å; G247-L250 PolarHBondContact O-N 2.93Å; G247-L251 WeakPolarHBondContact O-CB 3.48Å; G247-L251 PolarHBondContact O-N 2.92Å
248	I	38	Very low	38.6	Very low	85 Å²	85	77.8 Å²	77.8	44%	0.436	41%	0.406	S	S	.	.	H	α-helix	trans	-68.7	-40.9	175.7	-68.1	162.3	0	0	0	110.6	L244 F245 L251 N252	L244-I248 HydrophobicContact CD2-CD1 3.91Å; L244-I248 HydrophobicContact CD2-CG1 4.49Å; L244-I248 WeakPolarHBondContact O-CB 3.4Å; L244-I248 WeakPolarHBondContact O-CD1 3.37Å; L244-I248 WeakPolarHBondContact O-CG1 3.22Å; L244-I248 PolarHBondContact O-N 3.08Å; F245-I248 PolarHBondContact O-N 3.3Å; I248-L251 PolarHBondContact O-N 3.35Å; I248-N252 PolarHBondContact O-N 3.47Å
249	I	37.7	Very low	39	Very low	76 Å²	76	79.9 Å²	79.9	39%	0.39	41%	0.412	S	S	.	.	H	α-helix	trans	-66.8	-41.7	174.9	-65	165.9	0	0	0	110.3	L210 F245 L251 N252 I253	L210-I249 HydrophobicContact CD1-CB 4.33Å; L210-I249 HydrophobicContact CD1-CG2 3.45Å; L210-I249 VanDerWaalsContact CD1-CG2 3.45Å; F245-I249 WeakPolarHBondContact O-CB 3.39Å; F245-I249 WeakPolarHBondContact O-CD1 3.47Å; F245-I249 WeakPolarHBondContact O-CG1 3.44Å; F245-I249 PolarHBondContact O-N 2.75Å; I249-L251 VanDerWaalsContact C-N 3.35Å; I249-L251 PolarHBondContact O-N 3.24Å; I249-N252 PolarHBondContact O-N 3.45Å; I249-I253 HydrophobicContact CG2-CD1 3.7Å; I249-I253 HydrophobicContact CG2-CG1 4.43Å; I249-I253 WeakPolarHBondContact O-CB 3.41Å; I249-I253 VanDerWaalsContact O-CG1 3.22Å; I249-I253 WeakPolarHBondContact O-CG1 3.19Å; I249-I253 PolarHBondContact O-N 2.87Å
250	L	40.1	Very low	39.4	Very low	37 Å²	37	75 Å²	75	19%	0.194	40%	0.399	C	S	.	.	H	α-helix	trans	-62.7	-37.7	171.9	-104.8	110.9	0	0	0	112.7	L210 T246 G247 N254 M306	L210-L250 HydrophobicContact CD2-CD1 3.85Å; L210-L250 HydrophobicContact CD2-CG 4.33Å; T246-L250 VanDerWaalsContact O-CB 3.29Å; T246-L250 WeakPolarHBondContact O-CB 3.33Å; T246-L250 WeakPolarHBondContact O-CD1 3.16Å; T246-L250 PolarHBondContact O-N 3.43Å; G247-L250 PolarHBondContact O-N 2.93Å; L250-N254 WeakPolarHBondContact O-CB 3.17Å; L250-N254 PolarHBondContact O-N 3.01Å; L250-N254 PolarHBondContact O-ND2 3.46Å; L250-N254 VanDerWaalsContact O-ND2 3.16Å; L250-M306 HydrophobicContact CD1-CE 4.01Å; L250-M306 HydrophobicContact CD1-SD 4.45Å; L250-M306 HydrophobicContact CD2-CE 4.12Å; L250-M306 HydrophobicContact CD2-SD 4.12Å
251	L	37.6	Very low	39.6	Very low	123 Å²	123	69.2 Å²	69.2	64%	0.644	37%	0.371	S	S	*	.	H	α-helix	trans	-67.6	-36.8	177.5	-110.1	132.9	0	0	0	112.1	G247 I248 I249	G247-L251 WeakPolarHBondContact O-CB 3.48Å; G247-L251 PolarHBondContact O-N 2.92Å; I248-L251 PolarHBondContact O-N 3.35Å; I249-L251 VanDerWaalsContact C-N 3.35Å; I249-L251 PolarHBondContact O-N 3.24Å
252	N	37.4	Very low	39.8	Very low	118 Å²	118	70.8 Å²	70.8	63%	0.631	37%	0.37	S	S	*	.	H	α-helix	trans	-75.5	-34	175.7	-85.6	-12.6	0	0	0	113	I248 I249 N254 T255	I248-N252 PolarHBondContact O-N 3.47Å; I249-N252 PolarHBondContact O-N 3.45Å; N252-N254 VanDerWaalsContact C-N 3.34Å; N252-T255 PolarHBondContact O-OG1 3.41Å
253	I	41.8	Very low	39.8	Very low	37 Å²	37	73.2 Å²	73.2	19%	0.19	38%	0.383	C	S	.	.	H	α-helix	trans	-72.2	-32.6	172.6	-65.7	166.9	0	0	0	110.1	F203 L210 I249 T255 E256 F257	F203-I253 HydrophobicContact CE2-CG2 4.47Å; L210-I253 HydrophobicContact CD1-CD1 3.98Å; I249-I253 HydrophobicContact CG2-CD1 3.7Å; I249-I253 HydrophobicContact CG2-CG1 4.43Å; I249-I253 WeakPolarHBondContact O-CB 3.41Å; I249-I253 VanDerWaalsContact O-CG1 3.22Å; I249-I253 WeakPolarHBondContact O-CG1 3.19Å; I249-I253 PolarHBondContact O-N 2.87Å; I253-T255 VanDerWaalsContact C-N 3.3Å; I253-T255 PolarHBondContact O-N 3.4Å; I253-E256 PolarHBondContact O-N 2.79Å; I253-F257 WeakPolarHBondContact O-CB 3.26Å; I253-F257 PolarHBondContact O-N 3.23Å
254	N	43.3	Very low	40.1	Very low	37 Å²	37	72.9 Å²	72.9	20%	0.198	38%	0.38	C	S	.	.	H	α-helix	trans	-60	-32.3	-179.5	-91.9	-27.3	0	0	0	113.6	L250 N252 F258	L250-N254 WeakPolarHBondContact O-CB 3.17Å; L250-N254 PolarHBondContact O-N 3.01Å; L250-N254 PolarHBondContact O-ND2 3.46Å; L250-N254 VanDerWaalsContact O-ND2 3.16Å; N252-N254 VanDerWaalsContact C-N 3.34Å; N254-F258 HydrophobicContact CB-CD2 4.14Å; N254-F258 HydrophobicContact CB-CE2 4.21Å; N254-F258 VanDerWaalsContact O-CB 3.29Å; N254-F258 WeakPolarHBondContact O-CB 3.2Å; N254-F258 WeakPolarHBondContact O-CD2 3.39Å; N254-F258 PolarHBondContact O-N 3.06Å
255	T	40.2	Very low	40.4	Very low	94 Å²	94	71.4 Å²	71.4	58%	0.577	37%	0.372	S	S	*	.	H	α-helix	trans	-72.4	-40.8	-178.1	44.8	0	0	0	0	112.9	N252 I253 N259	N252-T255 PolarHBondContact O-OG1 3.41Å; I253-T255 VanDerWaalsContact C-N 3.3Å; I253-T255 PolarHBondContact O-N 3.4Å; T255-N259 PolarHBondContact O-N 3.4Å
256	E	42	Very low	40.4	Very low	111 Å²	111	68.5 Å²	68.5	52%	0.519	37%	0.368	S	S	.	.	H	α-helix	trans	-74.3	-36.1	171.7	-84.7	-171.9	139.1	0	0	112.2	I253 N259 T260	I253-E256 PolarHBondContact O-N 2.79Å; E256-N259 PolarHBondContact O-N 2.95Å; E256-T260 PolarHBondContact O-N 2.96Å; E256-T260 PolarHBondContact O-OG1 3.45Å
257	F	39.9	Very low	40.7	Very low	27 Å²	27	72.9 Å²	72.9	12%	0.118	38%	0.384	C	S	.	.	H	α-helix	trans	-61.8	-46.6	174.9	174.2	-123.3	0	0	0	112.8	F203 I253 N259 T260 L261 F271	F203-F257 AromaticContact CD2-CD2 4Å; F203-F257 HydrophobicContact CD2-CD2 4Å; F203-F257 AromaticContact CE1-CD2 3.82Å; F203-F257 HydrophobicContact CE1-CD2 3.82Å; F203-F257 AromaticContact CE1-CE2 3.6Å; F203-F257 HydrophobicContact CE1-CE2 3.6Å; F203-F257 HydrophobicContact CE2-CB 3.94Å; F203-F257 AromaticContact CE2-CD2 3.05Å; F203-F257 HydrophobicContact CE2-CD2 3.05Å; F203-F257 AromaticContact CE2-CE2 3.66Å; F203-F257 HydrophobicContact CE2-CE2 3.66Å; F203-F257 AromaticContact CE2-CG 3.78Å; F203-F257 HydrophobicContact CE2-CG 3.78Å; F203-F257 AromaticContact CZ-CD2 2.95Å; F203-F257 HydrophobicContact CZ-CD2 2.95Å; F203-F257 AromaticContact CZ-CE2 2.97Å; F203-F257 HydrophobicContact CZ-CE2 2.97Å; F203-F257 AromaticContact CZ-CG 3.98Å; F203-F257 HydrophobicContact CZ-CG 3.98Å; F203-F257 HydrophobicContact CZ-CZ 4.04Å; I253-F257 WeakPolarHBondContact O-CB 3.26Å; I253-F257 PolarHBondContact O-N 3.23Å; F257-N259 VanDerWaalsContact C-N 3.31Å; F257-N259 PolarHBondContact O-N 3.06Å; F257-T260 WeakPolarHBondContact CA-OG1 2.95Å; F257-T260 PolarHBondContact O-N 2.88Å; F257-T260 PolarHBondContact O-OG1 2.76Å; F257-L261 HydrophobicContact CD1-CD1 3.93Å; F257-L261 HydrophobicContact CD2-CD1 3.65Å; F257-L261 HydrophobicContact CD2-CG 4.08Å; F257-L261 HydrophobicContact CE1-CD1 3.51Å; F257-L261 HydrophobicContact CE2-CD1 3.22Å; F257-L261 HydrophobicContact CE2-CG 3.86Å; F257-L261 HydrophobicContact CG-CD1 4.04Å; F257-L261 HydrophobicContact CZ-CD1 3.18Å; F257-L261 HydrophobicContact CZ-CG 4.29Å; F257-L261 VanDerWaalsContact O-CB 3.25Å; F257-L261 WeakPolarHBondContact O-CB 3.46Å; F257-L261 WeakPolarHBondContact O-CG 3.16Å; F257-L261 PolarHBondContact O-N 3.01Å; F257-F271 HydrophobicContact CE2-CE1 4.23Å; F257-F271 HydrophobicContact CE2-CE2 4.07Å; F257-F271 AromaticContact CE2-CZ 3.87Å; F257-F271 HydrophobicContact CE2-CZ 3.87Å; F257-F271 HydrophobicContact CZ-CD1 4.37Å; F257-F271 AromaticContact CZ-CE1 3.65Å; F257-F271 HydrophobicContact CZ-CE1 3.65Å; F257-F271 HydrophobicContact CZ-CE2 4.23Å; F257-F271 AromaticContact CZ-CZ 3.56Å; F257-F271 HydrophobicContact CZ-CZ 3.56Å
258	F	42.9	Very low	40.9	Very low	62 Å²	62	72.7 Å²	72.7	27%	0.272	38%	0.376	S	S	.	.	H	α-helix	trans	-64.9	-37.3	176.4	-86.2	-65.6	0	0	0	110.9	N254 Y262 W316	N254-F258 HydrophobicContact CB-CD2 4.14Å; N254-F258 HydrophobicContact CB-CE2 4.21Å; N254-F258 VanDerWaalsContact O-CB 3.29Å; N254-F258 WeakPolarHBondContact O-CB 3.2Å; N254-F258 WeakPolarHBondContact O-CD2 3.39Å; N254-F258 PolarHBondContact O-N 3.06Å; F258-Y262 WeakPolarHBondContact O-CB 3.28Å; F258-Y262 PolarHBondContact O-N 2.91Å; F258-W316 HydrophobicContact CE1-CB 4.48Å; F258-W316 AromaticContact CE1-CD1 3.86Å; F258-W316 HydrophobicContact CE1-CG 4.48Å
259	N	42.8	Very low	41	Very low	107 Å²	107	69.6 Å²	69.6	57%	0.572	36%	0.361	S	S	*	.	H	α-helix	trans	-67.1	-38.8	176.6	-95.5	-12.6	0	0	0	113.6	T255 E256 F257 Y262 N263	T255-N259 PolarHBondContact O-N 3.4Å; E256-N259 PolarHBondContact O-N 2.95Å; F257-N259 VanDerWaalsContact C-N 3.31Å; F257-N259 PolarHBondContact O-N 3.06Å; N259-Y262 WeakPolarHBondContact O-CB 3.11Å; N259-Y262 PolarHBondContact O-N 3Å; N259-N263 PolarHBondContact O-ND2 3.15Å
260	T	43.3	Very low	41.1	Very low	49 Å²	49	70.1 Å²	70.1	30%	0.301	36%	0.364	S	S	.	.	H	α-helix	trans	-75.5	-38.5	177.7	36.1	0	0	0	0	112.2	E256 F257 Y262 N263	E256-T260 PolarHBondContact O-N 2.96Å; E256-T260 PolarHBondContact O-OG1 3.45Å; F257-T260 WeakPolarHBondContact CA-OG1 2.95Å; F257-T260 PolarHBondContact O-N 2.88Å; F257-T260 PolarHBondContact O-OG1 2.76Å; T260-Y262 VanDerWaalsContact C-N 3.29Å; T260-Y262 PolarHBondContact O-N 3.4Å; T260-N263 PolarHBondContact O-N 2.9Å
261	L	40.5	Very low	41.3	Very low	18 Å²	18	70 Å²	70	9%	0.094	36%	0.362	C	S	.	.	H	α-helix	trans	-66.2	-27.6	169.3	-84	172.7	0	0	0	113.6	F257 N263 L268 N317	F257-L261 HydrophobicContact CD1-CD1 3.93Å; F257-L261 HydrophobicContact CD2-CD1 3.65Å; F257-L261 HydrophobicContact CD2-CG 4.08Å; F257-L261 HydrophobicContact CE1-CD1 3.51Å; F257-L261 HydrophobicContact CE2-CD1 3.22Å; F257-L261 HydrophobicContact CE2-CG 3.86Å; F257-L261 HydrophobicContact CG-CD1 4.04Å; F257-L261 HydrophobicContact CZ-CD1 3.18Å; F257-L261 HydrophobicContact CZ-CG 4.29Å; F257-L261 VanDerWaalsContact O-CB 3.25Å; F257-L261 WeakPolarHBondContact O-CB 3.46Å; F257-L261 WeakPolarHBondContact O-CG 3.16Å; F257-L261 PolarHBondContact O-N 3.01Å; L261-N263 VanDerWaalsContact C-N 3.27Å; L261-N263 PolarHBondContact O-N 3.5Å; L261-L268 HydrophobicContact CD2-CB 4.26Å; L261-L268 HydrophobicContact CD2-CD1 3.65Å; L261-N317 PolarHBondContact O-ND2 3.38Å
262	Y	39.1	Very low	41.6	Very low	101 Å²	101	65.5 Å²	65.5	40%	0.396	34%	0.339	S	S	.	.	H	α-helix	trans	-66.1	-30.9	177.1	-147.9	-98.5	0	0	0	112.8	F258 N259 T260 S320	F258-Y262 WeakPolarHBondContact O-CB 3.28Å; F258-Y262 PolarHBondContact O-N 2.91Å; N259-Y262 WeakPolarHBondContact O-CB 3.11Å; N259-Y262 PolarHBondContact O-N 3Å; T260-Y262 VanDerWaalsContact C-N 3.29Å; T260-Y262 PolarHBondContact O-N 3.4Å; Y262-S320 WeakPolarHBondContact CE2-OG 3.46Å; Y262-S320 PolarHBondContact OH-OG 3.3Å
263	N	40.5	Very low	41.7	Very low	122 Å²	122	61.1 Å²	61.1	65%	0.652	32%	0.317	S	S	*	.	H	α-helix	trans	-96.7	-20.3	-168.3	-76.1	-20.6	0	0	0	113.7	N259 T260 L261	N259-N263 PolarHBondContact O-ND2 3.15Å; T260-N263 PolarHBondContact O-N 2.9Å; L261-N263 VanDerWaalsContact C-N 3.27Å; L261-N263 PolarHBondContact O-N 3.5Å
264	V	45.2	Very low	41.8	Very low	51 Å²	51	64.6 Å²	64.6	31%	0.309	33%	0.332	S	S	.	.			trans	-138.5	91.5	-175.7	-163.1	0	0	0	0	113.2	S266 Y267	V264-S266 VanDerWaalsContact CG1-OG 3.3Å; V264-S266 WeakPolarHBondContact CG1-OG 3.49Å; V264-S266 PolarHBondContact O-N 3.21Å; V264-S266 VanDerWaalsContact O-N 3.13Å; V264-Y267 HydrophobicContact CB-CD2 3.58Å; V264-Y267 HydrophobicContact CB-CE2 3.82Å; V264-Y267 HydrophobicContact CG1-CD2 3.26Å; V264-Y267 HydrophobicContact CG1-CE2 3.18Å; V264-Y267 HydrophobicContact CG1-CG 4.28Å; V264-Y267 HydrophobicContact CG2-CD2 4.41Å; V264-Y267 HydrophobicContact CG2-CE2 4.29Å; V264-Y267 PolarHBondContact O-N 3.01Å
265	L	41.7	Very low	41.8	Very low	67 Å²	67	64.5 Å²	64.5	35%	0.351	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.8	-179	-115.1	86	0	0	0	114.4	Y267 N388	L265-Y267 VanDerWaalsContact C-N 3.26Å; L265-Y267 PolarHBondContact O-N 3.22Å; L265-N388 HydrophobicContact CD2-CB 4.22Å
266	S	41.3	Very low	42	Very low	70 Å²	70	62.8 Å²	62.8	49%	0.49	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.2	-173.6	54.4	0	0	0	0	114.3	V264	V264-S266 VanDerWaalsContact CG1-OG 3.3Å; V264-S266 WeakPolarHBondContact CG1-OG 3.49Å; V264-S266 PolarHBondContact O-N 3.21Å; V264-S266 VanDerWaalsContact O-N 3.13Å
267	Y	42.9	Very low	41.9	Very low	111 Å²	111	60.5 Å²	60.5	44%	0.435	31%	0.311	S	S	.	.	S	Bend	trans	-102.7	-17.6	-171.8	-59.9	-51.9	0	0	0	115	L200 V264 L265 I270 F271	L200-Y267 HydrophobicContact CD1-CD1 3.53Å; L200-Y267 HydrophobicContact CD1-CD2 3.32Å; L200-Y267 HydrophobicContact CD1-CE1 3.87Å; L200-Y267 HydrophobicContact CD1-CE2 3.65Å; L200-Y267 HydrophobicContact CD1-CG 3.27Å; V264-Y267 HydrophobicContact CB-CD2 3.58Å; V264-Y267 HydrophobicContact CB-CE2 3.82Å; V264-Y267 HydrophobicContact CG1-CD2 3.26Å; V264-Y267 HydrophobicContact CG1-CE2 3.18Å; V264-Y267 HydrophobicContact CG1-CG 4.28Å; V264-Y267 HydrophobicContact CG2-CD2 4.41Å; V264-Y267 HydrophobicContact CG2-CE2 4.29Å; V264-Y267 PolarHBondContact O-N 3.01Å; L265-Y267 VanDerWaalsContact C-N 3.26Å; L265-Y267 PolarHBondContact O-N 3.22Å; Y267-I270 HydrophobicContact CD1-CD1 4.4Å; Y267-I270 PolarHBondContact O-N 3.41Å; Y267-F271 PolarHBondContact O-N 3.02Å; Y267-F271 VanDerWaalsContact O-N 3.13Å
268	L	41.4	Very low	42	Very low	23 Å²	23	62.8 Å²	62.8	12%	0.12	32%	0.321	C	S	.	.	H	α-helix	trans	-55.7	-43.8	174	-174.6	83.3	0	0	0	112.7	L261 I270 F271 T272 L314	L261-L268 HydrophobicContact CD2-CB 4.26Å; L261-L268 HydrophobicContact CD2-CD1 3.65Å; L268-I270 PolarHBondContact O-N 2.93Å; L268-F271 PolarHBondContact O-N 3.26Å; L268-T272 WeakPolarHBondContact O-CG2 3.29Å; L268-T272 PolarHBondContact O-N 3.44Å; L268-T272 VanDerWaalsContact O-N 3.09Å; L268-T272 PolarHBondContact O-OG1 3.26Å; L268-L314 HydrophobicContact CD1-CD2 3.95Å; L268-L314 HydrophobicContact CD2-CD2 4Å; L268-L314 HydrophobicContact CG-CD2 3.93Å
269	P	38.7	Very low	42.1	Very low	21 Å²	21	61 Å²	61	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-44.9	-52.2	166.5	-43	45.3	0	0	0	117.2	F271 T272 V273 W393	P269-F271 VanDerWaalsContact C-N 3.34Å; P269-T272 PolarHBondContact O-N 2.96Å; P269-T272 PolarHBondContact O-OG1 2.84Å; P269-V273 PolarHBondContact O-N 3.42Å; P269-W393 HydrophobicContact CB-CG 4.12Å; P269-W393 HydrophobicContact CG-CG 4.3Å
270	I	41.4	Very low	42.1	Very low	86 Å²	86	58.1 Å²	58.1	44%	0.441	30%	0.299	S	S	.	.	H	α-helix	trans	-73	-37.2	-172	-63.8	170.1	0	0	0	108.9	Y267 L268 H274	Y267-I270 HydrophobicContact CD1-CD1 4.4Å; Y267-I270 PolarHBondContact O-N 3.41Å; L268-I270 PolarHBondContact O-N 2.93Å; I270-H274 WeakPolarHBondContact O-CB 3.05Å; I270-H274 PolarHBondContact O-N 3.01Å; I270-H274 PolarHBondContact O-ND1 3.18Å
271	F	43.3	Very low	41.9	Very low	35 Å²	35	61.8 Å²	61.8	15%	0.154	31%	0.314	C	S	.	.	H	α-helix	trans	-60.5	-47.1	173.8	-175.2	-102.3	0	0	0	112.4	F203 I207 F257 Y267 L268 P269 V273 H274 F275	F203-F271 AromaticContact CE1-CD2 3.87Å; F203-F271 HydrophobicContact CE1-CD2 3.87Å; F203-F271 AromaticContact CE1-CE2 3.58Å; F203-F271 HydrophobicContact CE1-CE2 3.58Å; F203-F271 AromaticContact CZ-CE2 3.89Å; F203-F271 HydrophobicContact CZ-CE2 3.89Å; F203-F271 HydrophobicContact CZ-CZ 4.44Å; I207-F271 HydrophobicContact CD1-CE2 3.63Å; I207-F271 HydrophobicContact CD1-CZ 4.41Å; F257-F271 HydrophobicContact CE2-CE1 4.23Å; F257-F271 HydrophobicContact CE2-CE2 4.07Å; F257-F271 AromaticContact CE2-CZ 3.87Å; F257-F271 HydrophobicContact CE2-CZ 3.87Å; F257-F271 HydrophobicContact CZ-CD1 4.37Å; F257-F271 AromaticContact CZ-CE1 3.65Å; F257-F271 HydrophobicContact CZ-CE1 3.65Å; F257-F271 HydrophobicContact CZ-CE2 4.23Å; F257-F271 AromaticContact CZ-CZ 3.56Å; F257-F271 HydrophobicContact CZ-CZ 3.56Å; Y267-F271 PolarHBondContact O-N 3.02Å; Y267-F271 VanDerWaalsContact O-N 3.13Å; L268-F271 PolarHBondContact O-N 3.26Å; P269-F271 VanDerWaalsContact C-N 3.34Å; F271-V273 PolarHBondContact O-N 2.86Å; F271-H274 PolarHBondContact O-N 3.43Å; F271-F275 HydrophobicContact CZ-CD2 4.4Å; F271-F275 WeakPolarHBondContact O-CB 3.34Å; F271-F275 PolarHBondContact O-N 2.95Å
272	T	44.1	Very low	41.9	Very low	28 Å²	28	62.6 Å²	62.6	17%	0.172	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-40.2	179.7	53.7	0	0	0	0	113.8	L268 P269 L276 L314	L268-T272 WeakPolarHBondContact O-CG2 3.29Å; L268-T272 PolarHBondContact O-N 3.44Å; L268-T272 VanDerWaalsContact O-N 3.09Å; L268-T272 PolarHBondContact O-OG1 3.26Å; P269-T272 PolarHBondContact O-N 2.96Å; P269-T272 PolarHBondContact O-OG1 2.84Å; T272-L276 WeakPolarHBondContact O-CB 3.18Å; T272-L276 PolarHBondContact O-N 3.36Å; T272-L314 HydrophobicContact CG2-CD1 3.73Å; T272-L314 HydrophobicContact CG2-CD2 3.42Å; T272-L314 VanDerWaalsContact CG2-CD2 3.42Å; T272-L314 HydrophobicContact CG2-CG 4.04Å
273	V	39.9	Very low	42.1	Very low	26 Å²	26	59.2 Å²	59.2	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-67.2	-49	177.8	158.8	0	0	0	0	111.7	P269 F271 F275 L276 V277 I400	P269-V273 PolarHBondContact O-N 3.42Å; F271-V273 PolarHBondContact O-N 2.86Å; V273-F275 VanDerWaalsContact C-N 3.29Å; V273-F275 PolarHBondContact O-N 3.37Å; V273-L276 PolarHBondContact O-N 2.89Å; V273-V277 WeakPolarHBondContact O-CG2 3.32Å; V273-V277 PolarHBondContact O-N 3.32Å; V273-I400 HydrophobicContact CB-CD1 4.01Å; V273-I400 HydrophobicContact CG1-CD1 3.21Å; V273-I400 HydrophobicContact CG1-CG1 4.5Å; V273-I400 HydrophobicContact CG2-CD1 3.66Å
274	H	42.5	Very low	42	Very low	110 Å²	110	55.3 Å²	55.3	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-67.3	-34.5	179.9	-73.9	76.8	0	0	0	111.3	I270 F271 F278	I270-H274 WeakPolarHBondContact O-CB 3.05Å; I270-H274 PolarHBondContact O-N 3.01Å; I270-H274 PolarHBondContact O-ND1 3.18Å; F271-H274 PolarHBondContact O-N 3.43Å; H274-F278 WeakPolarHBondContact O-CB 3.42Å; H274-F278 PolarHBondContact O-N 3.19Å
275	F	45	Very low	41.6	Very low	35 Å²	35	56.2 Å²	56.2	15%	0.154	30%	0.297	C	S	.	.	H	α-helix	trans	-71.2	-36.4	174.8	-166.4	-88.8	0	0	0	112.5	F271 V273 F278 V279 M310	F271-F275 HydrophobicContact CZ-CD2 4.4Å; F271-F275 WeakPolarHBondContact O-CB 3.34Å; F271-F275 PolarHBondContact O-N 2.95Å; V273-F275 VanDerWaalsContact C-N 3.29Å; V273-F275 PolarHBondContact O-N 3.37Å; F275-F278 HydrophobicContact CD2-CD1 4.4Å; F275-F278 HydrophobicContact CE2-CD1 4.43Å; F275-F278 WeakPolarHBondContact O-CB 3.14Å; F275-F278 PolarHBondContact O-N 2.71Å; F275-V279 HydrophobicContact CD1-CG2 3.7Å; F275-V279 HydrophobicContact CE1-CG2 3.5Å; F275-V279 VanDerWaalsContact CE1-CG2 3.5Å; F275-V279 HydrophobicContact CZ-CG2 4.21Å; F275-V279 WeakPolarHBondContact O-CB 3.41Å; F275-V279 VanDerWaalsContact O-CG2 3.23Å; F275-V279 WeakPolarHBondContact O-CG2 3.15Å; F275-V279 PolarHBondContact O-N 3.26Å; F275-M310 HydrophobicContact CB-SD 4.14Å; F275-M310 HydrophobicContact CD1-CE 3.57Å; F275-M310 HydrophobicContact CD1-SD 3.04Å; F275-M310 WeakPolarHBondContact CD1-SD 3.4Å; F275-M310 HydrophobicContact CD2-SD 4.45Å; F275-M310 HydrophobicContact CE1-CB 4.5Å; F275-M310 HydrophobicContact CE1-CE 3.72Å; F275-M310 HydrophobicContact CE1-CG 4.49Å; F275-M310 HydrophobicContact CE1-SD 3.35Å; F275-M310 WeakPolarHBondContact CE1-SD 3.39Å; F275-M310 HydrophobicContact CG-SD 3.64Å; F275-M310 HydrophobicContact CZ-SD 4.19Å
276	L	43.3	Very low	41.3	Very low	58 Å²	58	55.3 Å²	55.3	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-66.3	-43.9	174.1	-163.8	88	0	0	0	111.3	T272 V273 F278 V279 I280 I400	T272-L276 WeakPolarHBondContact O-CB 3.18Å; T272-L276 PolarHBondContact O-N 3.36Å; V273-L276 PolarHBondContact O-N 2.89Å; L276-F278 VanDerWaalsContact C-N 3.3Å; L276-F278 PolarHBondContact O-N 2.83Å; L276-V279 PolarHBondContact O-N 3.19Å; L276-I280 HydrophobicContact CD2-CD1 4.28Å; L276-I280 HydrophobicContact CG-CD1 4.14Å; L276-I280 WeakPolarHBondContact O-CB 3.24Å; L276-I280 WeakPolarHBondContact O-CD1 3.39Å; L276-I280 WeakPolarHBondContact O-CG1 3.36Å; L276-I280 PolarHBondContact O-N 3.28Å; L276-I400 HydrophobicContact CD2-CG2 4.01Å
277	V	39.9	Very low	41.3	Very low	64 Å²	64	56.2 Å²	56.2	39%	0.388	29%	0.291	S	S	.	.	H	α-helix	trans	-62.7	-39.4	173.9	172.7	0	0	0	0	110.7	V273 I280 M281 I400	V273-V277 WeakPolarHBondContact O-CG2 3.32Å; V273-V277 PolarHBondContact O-N 3.32Å; V277-I280 PolarHBondContact O-N 2.97Å; V277-M281 HydrophobicContact CG1-CG 4.25Å; V277-M281 VanDerWaalsContact O-CB 3.28Å; V277-M281 WeakPolarHBondContact O-CB 3.29Å; V277-M281 WeakPolarHBondContact O-CG 3.42Å; V277-M281 PolarHBondContact O-N 3.07Å; V277-I400 HydrophobicContact CG2-CG2 4.45Å
278	F	42.8	Very low	40.9	Very low	75 Å²	75	60.6 Å²	60.6	33%	0.329	31%	0.307	S	S	.	.	H	α-helix	trans	-62.8	-48.6	173.6	172.8	-100.9	0	0	0	111.9	V211 H274 F275 L276 I280 M281 V282	V211-F278 HydrophobicContact CG1-CE2 3.98Å; V211-F278 HydrophobicContact CG1-CZ 4.15Å; V211-F278 HydrophobicContact CG2-CE1 4.48Å; V211-F278 HydrophobicContact CG2-CE2 3.82Å; V211-F278 HydrophobicContact CG2-CZ 3.5Å; H274-F278 WeakPolarHBondContact O-CB 3.42Å; H274-F278 PolarHBondContact O-N 3.19Å; F275-F278 HydrophobicContact CD2-CD1 4.4Å; F275-F278 HydrophobicContact CE2-CD1 4.43Å; F275-F278 WeakPolarHBondContact O-CB 3.14Å; F275-F278 PolarHBondContact O-N 2.71Å; L276-F278 VanDerWaalsContact C-N 3.3Å; L276-F278 PolarHBondContact O-N 2.83Å; F278-I280 VanDerWaalsContact C-N 3.29Å; F278-I280 PolarHBondContact O-N 3.39Å; F278-M281 PolarHBondContact O-N 3.21Å; F278-V282 HydrophobicContact CD1-CG2 4.39Å; F278-V282 HydrophobicContact CD2-CG2 3.95Å; F278-V282 HydrophobicContact CE1-CG2 4.1Å; F278-V282 HydrophobicContact CE2-CG2 3.62Å; F278-V282 HydrophobicContact CG-CG2 4.32Å; F278-V282 HydrophobicContact CZ-CG2 3.69Å; F278-V282 VanDerWaalsContact O-CB 3.24Å; F278-V282 WeakPolarHBondContact O-CB 3.38Å; F278-V282 WeakPolarHBondContact O-CG2 3.46Å; F278-V282 PolarHBondContact O-N 3.36Å
279	V	44.2	Very low	40.6	Very low	25 Å²	25	63.8 Å²	63.8	15%	0.152	32%	0.318	C	S	.	.	H	α-helix	trans	-59.3	-41.1	176.1	167.2	0	0	0	0	110.4	F275 L276 S283 M303	F275-V279 HydrophobicContact CD1-CG2 3.7Å; F275-V279 HydrophobicContact CE1-CG2 3.5Å; F275-V279 VanDerWaalsContact CE1-CG2 3.5Å; F275-V279 HydrophobicContact CZ-CG2 4.21Å; F275-V279 WeakPolarHBondContact O-CB 3.41Å; F275-V279 VanDerWaalsContact O-CG2 3.23Å; F275-V279 WeakPolarHBondContact O-CG2 3.15Å; F275-V279 PolarHBondContact O-N 3.26Å; L276-V279 PolarHBondContact O-N 3.19Å; V279-S283 WeakPolarHBondContact O-CB 3.31Å; V279-S283 PolarHBondContact O-N 3.37Å; V279-S283 PolarHBondContact O-OG 3.49Å; V279-M303 HydrophobicContact CB-CE 4.47Å; V279-M303 HydrophobicContact CG1-CE 3.98Å
280	I	43.1	Very low	40.7	Very low	45 Å²	45	66.9 Å²	66.9	23%	0.231	33%	0.327	C	S	.	.	H	α-helix	trans	-69.1	-44.7	177.3	-67.5	162.4	0	0	0	111.2	L276 V277 F278 S283 V284 S404 L407	L276-I280 HydrophobicContact CD2-CD1 4.28Å; L276-I280 HydrophobicContact CG-CD1 4.14Å; L276-I280 WeakPolarHBondContact O-CB 3.24Å; L276-I280 WeakPolarHBondContact O-CD1 3.39Å; L276-I280 WeakPolarHBondContact O-CG1 3.36Å; L276-I280 PolarHBondContact O-N 3.28Å; V277-I280 PolarHBondContact O-N 2.97Å; F278-I280 VanDerWaalsContact C-N 3.29Å; F278-I280 PolarHBondContact O-N 3.39Å; I280-S283 PolarHBondContact O-N 2.94Å; I280-V284 HydrophobicContact CG2-CG2 4.2Å; I280-V284 VanDerWaalsContact O-CB 3.31Å; I280-V284 WeakPolarHBondContact O-CB 3.3Å; I280-V284 WeakPolarHBondContact O-CG2 3.49Å; I280-V284 PolarHBondContact O-N 3.19Å; I280-S404 VanDerWaalsContact CD1-CB 3.5Å; I280-L407 HydrophobicContact CG2-CD2 4.17Å
281	M	39.3	Very low	40.6	Very low	127 Å²	127	71.6 Å²	71.6	63%	0.626	35%	0.347	S	S	*	.	H	α-helix	trans	-63.5	-43.6	178.5	-77.2	-96.3	-94.4	0	0	111.7	V277 F278 V284 T285	V277-M281 HydrophobicContact CG1-CG 4.25Å; V277-M281 VanDerWaalsContact O-CB 3.28Å; V277-M281 WeakPolarHBondContact O-CB 3.29Å; V277-M281 WeakPolarHBondContact O-CG 3.42Å; V277-M281 PolarHBondContact O-N 3.07Å; F278-M281 PolarHBondContact O-N 3.21Å; M281-V284 PolarHBondContact O-N 3.21Å; M281-T285 WeakPolarHBondContact O-CB 3.26Å; M281-T285 PolarHBondContact O-N 3.47Å; M281-T285 PolarHBondContact O-OG1 2.72Å
282	V	41.4	Very low	40.2	Very low	35 Å²	35	77.6 Å²	77.6	21%	0.212	38%	0.376	C	S	.	.	H	α-helix	trans	-65.6	-43.7	174.2	171.7	0	0	0	0	109.9	F278 V284 T285 L286 M303	F278-V282 HydrophobicContact CD1-CG2 4.39Å; F278-V282 HydrophobicContact CD2-CG2 3.95Å; F278-V282 HydrophobicContact CE1-CG2 4.1Å; F278-V282 HydrophobicContact CE2-CG2 3.62Å; F278-V282 HydrophobicContact CG-CG2 4.32Å; F278-V282 HydrophobicContact CZ-CG2 3.69Å; F278-V282 VanDerWaalsContact O-CB 3.24Å; F278-V282 WeakPolarHBondContact O-CB 3.38Å; F278-V282 WeakPolarHBondContact O-CG2 3.46Å; F278-V282 PolarHBondContact O-N 3.36Å; V282-V284 PolarHBondContact O-N 3.17Å; V282-T285 WeakPolarHBondContact CA-OG1 3.22Å; V282-T285 PolarHBondContact O-N 3.28Å; V282-T285 PolarHBondContact O-OG1 3.28Å; V282-T285 VanDerWaalsContact O-OG1 3.11Å; V282-L286 HydrophobicContact CG1-CD1 3.36Å; V282-L286 HydrophobicContact CG1-CG 4.27Å; V282-L286 WeakPolarHBondContact O-CB 3.34Å; V282-L286 VanDerWaalsContact O-CD1 3.25Å; V282-L286 WeakPolarHBondContact O-CD1 3.31Å; V282-L286 WeakPolarHBondContact O-CG 3.28Å; V282-L286 PolarHBondContact O-N 3.29Å; V282-M303 HydrophobicContact CB-CE 4.19Å; V282-M303 HydrophobicContact CG1-CE 3.77Å; V282-M303 HydrophobicContact CG1-SD 4.41Å
283	S	41.8	Very low	40.2	Very low	30 Å²	30	79.9 Å²	79.9	21%	0.21	39%	0.39	C	S	.	.	H	α-helix	trans	-60.8	-42.7	174.7	-61	0	0	0	0	112.5	V279 I280 L287	V279-S283 WeakPolarHBondContact O-CB 3.31Å; V279-S283 PolarHBondContact O-N 3.37Å; V279-S283 PolarHBondContact O-OG 3.49Å; I280-S283 PolarHBondContact O-N 2.94Å; S283-L287 VanDerWaalsContact O-CB 3.28Å; S283-L287 WeakPolarHBondContact O-CB 3.2Å; S283-L287 PolarHBondContact O-N 2.95Å
284	V	38.6	Very low	40.2	Very low	40 Å²	40	83.7 Å²	83.7	24%	0.242	41%	0.414	C	S	.	.	H	α-helix	trans	-71.9	-40.5	-178.8	169	0	0	0	0	111.5	I280 M281 V282 R288 Y411	I280-V284 HydrophobicContact CG2-CG2 4.2Å; I280-V284 VanDerWaalsContact O-CB 3.31Å; I280-V284 WeakPolarHBondContact O-CB 3.3Å; I280-V284 WeakPolarHBondContact O-CG2 3.49Å; I280-V284 PolarHBondContact O-N 3.19Å; M281-V284 PolarHBondContact O-N 3.21Å; V282-V284 PolarHBondContact O-N 3.17Å; V284-R288 WeakPolarHBondContact O-CB 3.37Å; V284-R288 PolarHBondContact O-N 3.41Å; V284-R288 VanDerWaalsContact O-N 3.11Å; V284-Y411 HydrophobicContact CG1-CE2 4.49Å
285	T	36.9	Very low	40	Very low	70 Å²	70	84.6 Å²	84.6	43%	0.429	41%	0.412	S	S	.	.	H	α-helix	trans	-68.8	-40	174.9	40.6	0	0	0	0	111.6	M281 V282 R288 Y289	M281-T285 WeakPolarHBondContact O-CB 3.26Å; M281-T285 PolarHBondContact O-N 3.47Å; M281-T285 PolarHBondContact O-OG1 2.72Å; V282-T285 WeakPolarHBondContact CA-OG1 3.22Å; V282-T285 PolarHBondContact O-N 3.28Å; V282-T285 PolarHBondContact O-OG1 3.28Å; V282-T285 VanDerWaalsContact O-OG1 3.11Å; T285-R288 WeakPolarHBondContact O-CB 3.45Å; T285-R288 PolarHBondContact O-N 2.98Å; T285-Y289 WeakPolarHBondContact O-CD2 3.22Å; T285-Y289 PolarHBondContact O-N 3.34Å
286	L	36.4	Very low	39.9	Very low	48 Å²	48	84.7 Å²	84.7	25%	0.251	42%	0.416	S	S	.	.	H	α-helix	trans	-70.9	-34.8	175.4	-69.1	164.4	0	0	0	112.9	V282 R288 Y289 Y290 L299	V282-L286 HydrophobicContact CG1-CD1 3.36Å; V282-L286 HydrophobicContact CG1-CG 4.27Å; V282-L286 WeakPolarHBondContact O-CB 3.34Å; V282-L286 VanDerWaalsContact O-CD1 3.25Å; V282-L286 WeakPolarHBondContact O-CD1 3.31Å; V282-L286 WeakPolarHBondContact O-CG 3.28Å; V282-L286 PolarHBondContact O-N 3.29Å; L286-R288 PolarHBondContact O-N 2.99Å; L286-Y289 PolarHBondContact O-N 3.4Å; L286-Y290 HydrophobicContact CD2-CD2 4.1Å; L286-Y290 HydrophobicContact CD2-CE2 4.04Å; L286-Y290 PolarHBondContact O-N 3.36Å; L286-Y290 VanDerWaalsContact O-N 3.07Å; L286-L299 HydrophobicContact CB-CD2 4.18Å; L286-L299 HydrophobicContact CD1-CD2 3.48Å; L286-L299 VanDerWaalsContact CD1-CD2 3.48Å; L286-L299 HydrophobicContact CD1-CG 4.25Å; L286-L299 HydrophobicContact CD2-CD2 3.67Å; L286-L299 HydrophobicContact CG-CD2 3.96Å
287	L	39.6	Very low	39.8	Very low	88 Å²	88	86.9 Å²	86.9	46%	0.461	42%	0.424	S	S	.	.	H	α-helix	trans	-65	-29.3	171.4	-124.5	92.6	0	0	0	112.1	S283	S283-L287 VanDerWaalsContact O-CB 3.28Å; S283-L287 WeakPolarHBondContact O-CB 3.2Å; S283-L287 PolarHBondContact O-N 2.95Å
288	R	34.9	Very low	39.8	Very low	203 Å²	203	88.5 Å²	88.5	77%	0.766	43%	0.431	S	S	*	.	H	α-helix	trans	-73.3	-35.1	176.3	-121.2	-179.9	179.3	-179	-2.1	112	V284 T285 L286	V284-R288 WeakPolarHBondContact O-CB 3.37Å; V284-R288 PolarHBondContact O-N 3.41Å; V284-R288 VanDerWaalsContact O-N 3.11Å; T285-R288 WeakPolarHBondContact O-CB 3.45Å; T285-R288 PolarHBondContact O-N 2.98Å; L286-R288 PolarHBondContact O-N 2.99Å
289	Y	35.3	Very low	39.7	Very low	91 Å²	91	88 Å²	88	36%	0.357	43%	0.431	S	S	.	.	H	α-helix	trans	-96.5	-28.7	-171.5	-88.5	-67.4	0	0	0	116	E164 N168 T285 L286	E164-Y289 HydrophobicContact CG-CE1 4.32Å; N168-Y289 WeakPolarHBondContact ND2-CE1 3.44Å; N168-Y289 PolarHBondContact ND2-OH 3.2Å; N168-Y289 VanDerWaalsContact ND2-OH 3.15Å; N168-Y289 VanDerWaalsContact OD1-CZ 3.26Å; N168-Y289 PolarHBondContact OD1-OH 3.35Å; T285-Y289 WeakPolarHBondContact O-CD2 3.22Å; T285-Y289 PolarHBondContact O-N 3.34Å; L286-Y289 PolarHBondContact O-N 3.4Å
290	Y	40.6	Very low	39.7	Very low	85 Å²	85	88.8 Å²	88.8	33%	0.333	43%	0.434	S	S	.	.			trans	-110.5	85.1	-171.5	-75.5	-82.7	0	0	0	113.1	L286 Q292	L286-Y290 HydrophobicContact CD2-CD2 4.1Å; L286-Y290 HydrophobicContact CD2-CE2 4.04Å; L286-Y290 PolarHBondContact O-N 3.36Å; L286-Y290 VanDerWaalsContact O-N 3.07Å; Y290-Q292 VanDerWaalsContact C-N 3.35Å; Y290-Q292 PolarHBondContact O-N 2.88Å
291	H	38.9	Very low	39.8	Very low	186 Å²	186	90.3 Å²	90.3	86%	0.861	44%	0.439	S	S	*	.			trans	-83.2	6.7	-179.6	-143.2	-49.5	0	0	0	115
292	Q	36.7	Very low	40	Very low	160 Å²	160	87.8 Å²	87.8	75%	0.748	43%	0.425	S	S	*	.	S	Bend	trans	-132.7	86.3	-171.8	-84.5	174.1	-24.6	0	0	114.8	Y290 T294	Y290-Q292 VanDerWaalsContact C-N 3.35Å; Y290-Q292 PolarHBondContact O-N 2.88Å; Q292-T294 PolarHBondContact O-N 3.38Å
293	T	43.3	Very low	40.2	Very low	76 Å²	76	87.9 Å²	87.9	47%	0.466	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	-13.9	133.2	55.7	0	0	0	0	124.4	L428	T293-L428 HydrophobicContact CG2-CD1 4.46Å
294	T	39.9	Very low	40.3	Very low	107 Å²	107	87.8 Å²	87.8	66%	0.656	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	-29.2	177.9	52.1	0	0	0	0	115.8	Q292	Q292-T294 PolarHBondContact O-N 3.38Å
295	R	38.6	Very low	40.6	Very low	129 Å²	129	88.6 Å²	88.6	49%	0.487	43%	0.428	S	S	.	.	H	α-helix	trans	-81.4	-20.8	175.3	-81.1	179.8	171.2	156.3	-3.4	113.5	L227 Q297 L298 L299	L227-R295 PolarHBondContact O-NH2 2.82Å; R295-Q297 VanDerWaalsContact C-N 3.28Å; R295-Q297 PolarHBondContact O-N 3.2Å; R295-L298 PolarHBondContact O-N 3.31Å; R295-L299 PolarHBondContact O-N 2.87Å
296	T	42	Very low	41	Very low	37 Å²	37	87.4 Å²	87.4	23%	0.227	42%	0.418	C	S	.	.	H	α-helix	trans	-64.1	-29.9	175.7	44.4	0	0	0	0	112.7	L300	T296-L300 WeakPolarHBondContact O-CB 3.29Å; T296-L300 PolarHBondContact O-N 3.42Å
297	Q	41.8	Very low	41.5	Very low	103 Å²	103	87.5 Å²	87.5	48%	0.481	42%	0.418	S	S	.	.	H	α-helix	trans	-70.1	-39.1	178	-75.5	-179.5	-25	0	0	113.4	R295 L300 K301 Y357	R295-Q297 VanDerWaalsContact C-N 3.28Å; R295-Q297 PolarHBondContact O-N 3.2Å; Q297-L300 PolarHBondContact O-N 2.78Å; Q297-K301 WeakPolarHBondContact O-CG 3.31Å; Q297-K301 PolarHBondContact O-N 3.28Å; Q297-Y357 WeakPolarHBondContact CA-OH 3.16Å
298	L	39.5	Very low	41.8	Very low	99 Å²	99	85.2 Å²	85.2	52%	0.518	41%	0.405	S	S	.	.	H	α-helix	trans	-71.5	-37.7	-179.9	-165.1	119.6	0	0	0	111.3	R295 K301 F302	R295-L298 PolarHBondContact O-N 3.31Å; L298-K301 PolarHBondContact O-N 3.13Å; L298-F302 WeakPolarHBondContact O-CB 3.24Å; L298-F302 PolarHBondContact O-N 2.87Å
299	L	40.4	Very low	42.4	Very low	64 Å²	64	78.7 Å²	78.7	34%	0.335	39%	0.387	S	S	.	.	H	α-helix	trans	-70.4	-34.9	175.7	-155.1	74.2	0	0	0	111.5	L286 R295 F302 M303	L286-L299 HydrophobicContact CB-CD2 4.18Å; L286-L299 HydrophobicContact CD1-CD2 3.48Å; L286-L299 VanDerWaalsContact CD1-CD2 3.48Å; L286-L299 HydrophobicContact CD1-CG 4.25Å; L286-L299 HydrophobicContact CD2-CD2 3.67Å; L286-L299 HydrophobicContact CG-CD2 3.96Å; R295-L299 PolarHBondContact O-N 2.87Å; L299-F302 WeakPolarHBondContact O-CB 3.28Å; L299-F302 PolarHBondContact O-N 3.48Å; L299-M303 WeakPolarHBondContact O-CG 3.24Å; L299-M303 PolarHBondContact O-N 3.12Å
300	L	45.3	Very low	43	Very low	41 Å²	41	75.8 Å²	75.8	22%	0.215	38%	0.377	C	S	.	.	H	α-helix	trans	-70.4	-37.7	172.7	-136	96.1	0	0	0	113	T296 Q297 F302 M303 S304 Y357 I431	T296-L300 WeakPolarHBondContact O-CB 3.29Å; T296-L300 PolarHBondContact O-N 3.42Å; Q297-L300 PolarHBondContact O-N 2.78Å; L300-F302 VanDerWaalsContact C-N 3.28Å; L300-M303 PolarHBondContact O-N 3.37Å; L300-S304 WeakPolarHBondContact O-CB 3.36Å; L300-S304 PolarHBondContact O-N 3.27Å; L300-S304 PolarHBondContact O-OG 3.45Å; L300-Y357 WeakPolarHBondContact CB-OH 3.14Å; L300-Y357 HydrophobicContact CD2-CD2 4.28Å; L300-Y357 HydrophobicContact CD2-CE2 3.44Å; L300-Y357 VanDerWaalsContact CD2-CE2 3.44Å; L300-I431 HydrophobicContact CD1-CD1 3.36Å; L300-I431 HydrophobicContact CD1-CG1 4.33Å; L300-I431 HydrophobicContact CD2-CB 4.44Å; L300-I431 HydrophobicContact CD2-CD1 3.29Å; L300-I431 HydrophobicContact CD2-CG1 3.43Å; L300-I431 VanDerWaalsContact CD2-CG1 3.43Å; L300-I431 HydrophobicContact CD2-CG2 4.13Å; L300-I431 HydrophobicContact CG-CD1 3.9Å; L300-I431 HydrophobicContact CG-CG1 4.47Å
301	K	44.5	Very low	43.3	Very low	77 Å²	77	72.2 Å²	72.2	34%	0.335	36%	0.364	S	S	.	.	H	α-helix	trans	-60	-40.8	169.2	-77.3	-173.7	-178.6	-167.4	0	110.8	Q297 L298 S304 T305 Y357 E358	Q297-K301 WeakPolarHBondContact O-CG 3.31Å; Q297-K301 PolarHBondContact O-N 3.28Å; L298-K301 PolarHBondContact O-N 3.13Å; K301-S304 WeakPolarHBondContact CA-OG 3.25Å; K301-S304 PolarHBondContact O-N 2.96Å; K301-S304 PolarHBondContact O-OG 3.08Å; K301-T305 WeakPolarHBondContact O-CB 3.26Å; K301-T305 WeakPolarHBondContact O-CG2 3.47Å; K301-T305 PolarHBondContact O-N 3.27Å; K301-T305 PolarHBondContact O-OG1 3.35Å; K301-Y357 HydrophobicContact CG-CD1 3.86Å; K301-Y357 HydrophobicContact CG-CE1 3.72Å; K301-E358 IonicContact NZ-OE1 2.95Å; K301-E358 PolarHBondContact NZ-OE1 3.39Å
302	F	44.7	Very low	43.8	Very low	74 Å²	74	65.8 Å²	65.8	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-45.6	175.7	-174.1	-99.1	0	0	0	111.9	L298 L299 L300 T305 M306	L298-F302 WeakPolarHBondContact O-CB 3.24Å; L298-F302 PolarHBondContact O-N 2.87Å; L299-F302 WeakPolarHBondContact O-CB 3.28Å; L299-F302 PolarHBondContact O-N 3.48Å; L300-F302 VanDerWaalsContact C-N 3.28Å; F302-T305 VanDerWaalsContact C-OG1 3.3Å; F302-T305 VanDerWaalsContact CA-OG1 3.23Å; F302-T305 WeakPolarHBondContact CA-OG1 3.44Å; F302-T305 PolarHBondContact O-N 2.8Å; F302-T305 PolarHBondContact O-OG1 3.46Å; F302-M306 HydrophobicContact CD1-CG 4.14Å; F302-M306 HydrophobicContact CE1-CE 4.39Å; F302-M306 HydrophobicContact CE1-CG 3.84Å; F302-M306 HydrophobicContact CZ-CE 4.24Å; F302-M306 HydrophobicContact CZ-CG 4.05Å; F302-M306 HydrophobicContact CZ-SD 4.26Å; F302-M306 WeakPolarHBondContact O-CB 3.49Å; F302-M306 VanDerWaalsContact O-CG 3.23Å; F302-M306 WeakPolarHBondContact O-CG 3.36Å; F302-M306 PolarHBondContact O-N 3.04Å
303	M	44.4	Very low	44.2	Very low	38 Å²	38	58.7 Å²	58.7	19%	0.187	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.8	-66.8	-68.6	-96.2	0	0	112.1	V279 V282 L299 L300 M306 L307	V279-M303 HydrophobicContact CB-CE 4.47Å; V279-M303 HydrophobicContact CG1-CE 3.98Å; V282-M303 HydrophobicContact CB-CE 4.19Å; V282-M303 HydrophobicContact CG1-CE 3.77Å; V282-M303 HydrophobicContact CG1-SD 4.41Å; L299-M303 WeakPolarHBondContact O-CG 3.24Å; L299-M303 PolarHBondContact O-N 3.12Å; L300-M303 PolarHBondContact O-N 3.37Å; M303-M306 PolarHBondContact O-N 3.28Å; M303-L307 VanDerWaalsContact O-CB 3.25Å; M303-L307 WeakPolarHBondContact O-CB 3.33Å; M303-L307 PolarHBondContact O-N 3.31Å
304	S	44.5	Very low	44.5	Very low	28 Å²	28	56.5 Å²	56.5	20%	0.196	29%	0.291	C	S	.	.	H	α-helix	trans	-71.1	-35.8	174.3	71.5	0	0	0	0	112	L300 K301 F308 L354	L300-S304 WeakPolarHBondContact O-CB 3.36Å; L300-S304 PolarHBondContact O-N 3.27Å; L300-S304 PolarHBondContact O-OG 3.45Å; K301-S304 WeakPolarHBondContact CA-OG 3.25Å; K301-S304 PolarHBondContact O-N 2.96Å; K301-S304 PolarHBondContact O-OG 3.08Å; S304-F308 WeakPolarHBondContact O-CB 3.38Å; S304-F308 PolarHBondContact O-N 3.17Å; S304-L354 WeakPolarHBondContact OG-CD2 3.3Å
305	T	45.4	Very low	45.1	Very low	57 Å²	57	51.9 Å²	51.9	35%	0.35	26%	0.261	S	S	.	.	H	α-helix	trans	-67.5	-36.6	171.7	47.2	0	0	0	0	112.6	K301 F302 F308 V309 L354	K301-T305 WeakPolarHBondContact O-CB 3.26Å; K301-T305 WeakPolarHBondContact O-CG2 3.47Å; K301-T305 PolarHBondContact O-N 3.27Å; K301-T305 PolarHBondContact O-OG1 3.35Å; F302-T305 VanDerWaalsContact C-OG1 3.3Å; F302-T305 VanDerWaalsContact CA-OG1 3.23Å; F302-T305 WeakPolarHBondContact CA-OG1 3.44Å; F302-T305 PolarHBondContact O-N 2.8Å; F302-T305 PolarHBondContact O-OG1 3.46Å; T305-F308 WeakPolarHBondContact O-CB 3.35Å; T305-F308 PolarHBondContact O-N 3.42Å; T305-V309 WeakPolarHBondContact O-CB 3.39Å; T305-V309 VanDerWaalsContact O-CG2 3.26Å; T305-V309 WeakPolarHBondContact O-CG2 3.39Å; T305-V309 PolarHBondContact O-N 2.7Å; T305-L354 HydrophobicContact CG2-CD2 3.61Å
306	M	45.5	Very low	45.6	Very low	45 Å²	45	53.4 Å²	53.4	22%	0.222	27%	0.267	C	S	.	.	H	α-helix	trans	-71.7	-40.3	176.7	-71.3	-68.3	-96.9	0	0	111.4	L250 F302 M303 F308 V309 M310	L250-M306 HydrophobicContact CD1-CE 4.01Å; L250-M306 HydrophobicContact CD1-SD 4.45Å; L250-M306 HydrophobicContact CD2-CE 4.12Å; L250-M306 HydrophobicContact CD2-SD 4.12Å; F302-M306 HydrophobicContact CD1-CG 4.14Å; F302-M306 HydrophobicContact CE1-CE 4.39Å; F302-M306 HydrophobicContact CE1-CG 3.84Å; F302-M306 HydrophobicContact CZ-CE 4.24Å; F302-M306 HydrophobicContact CZ-CG 4.05Å; F302-M306 HydrophobicContact CZ-SD 4.26Å; F302-M306 WeakPolarHBondContact O-CB 3.49Å; F302-M306 VanDerWaalsContact O-CG 3.23Å; F302-M306 WeakPolarHBondContact O-CG 3.36Å; F302-M306 PolarHBondContact O-N 3.04Å; M303-M306 PolarHBondContact O-N 3.28Å; M306-F308 VanDerWaalsContact C-N 3.29Å; M306-F308 PolarHBondContact O-N 3.2Å; M306-V309 PolarHBondContact O-N 3.2Å; M306-M310 VanDerWaalsContact O-CB 3.28Å; M306-M310 WeakPolarHBondContact O-CB 3.49Å; M306-M310 PolarHBondContact O-N 3.34Å
307	L	46.9	Very low	45.9	Very low	50 Å²	50	51.9 Å²	51.9	26%	0.262	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-39.1	171.4	-163	118.7	0	0	0	111	M303 M310 I311	M303-L307 VanDerWaalsContact O-CB 3.25Å; M303-L307 WeakPolarHBondContact O-CB 3.33Å; M303-L307 PolarHBondContact O-N 3.31Å; L307-M310 PolarHBondContact O-N 3.21Å; L307-I311 HydrophobicContact CD2-CD1 3.64Å; L307-I311 HydrophobicContact CG-CD1 4.23Å; L307-I311 WeakPolarHBondContact O-CB 3.23Å; L307-I311 WeakPolarHBondContact O-CD1 3.19Å; L307-I311 WeakPolarHBondContact O-CG1 3.25Å; L307-I311 PolarHBondContact O-N 3.16Å
308	F	45.6	Very low	46.2	Very low	40 Å²	40	47.5 Å²	47.5	18%	0.175	24%	0.238	C	C	.	.	H	α-helix	trans	-65.3	-48.9	175.2	176.4	-104.3	0	0	0	113.2	S304 T305 M306 M310 I311 I312 L347 S350 V351 L354	S304-F308 WeakPolarHBondContact O-CB 3.38Å; S304-F308 PolarHBondContact O-N 3.17Å; T305-F308 WeakPolarHBondContact O-CB 3.35Å; T305-F308 PolarHBondContact O-N 3.42Å; M306-F308 VanDerWaalsContact C-N 3.29Å; M306-F308 PolarHBondContact O-N 3.2Å; F308-M310 VanDerWaalsContact C-N 3.26Å; F308-M310 PolarHBondContact O-N 2.72Å; F308-I311 PolarHBondContact O-N 2.73Å; F308-I312 HydrophobicContact CD1-CD1 3.81Å; F308-I312 HydrophobicContact CD2-CD1 4.45Å; F308-I312 HydrophobicContact CE1-CD1 3.28Å; F308-I312 HydrophobicContact CE1-CG1 4.47Å; F308-I312 HydrophobicContact CE2-CD1 3.96Å; F308-I312 HydrophobicContact CE2-CG1 4.48Å; F308-I312 HydrophobicContact CG-CD1 4.36Å; F308-I312 HydrophobicContact CZ-CD1 3.35Å; F308-I312 HydrophobicContact CZ-CG1 4.3Å; F308-I312 WeakPolarHBondContact O-CG1 3.24Å; F308-I312 PolarHBondContact O-N 2.79Å; F308-L347 HydrophobicContact CE2-CD2 4.27Å; F308-L347 HydrophobicContact CZ-CD2 4.27Å; F308-S350 WeakPolarHBondContact CD2-OG 3.5Å; F308-S350 VanDerWaalsContact CE2-OG 3.23Å; F308-S350 WeakPolarHBondContact CE2-OG 3.33Å; F308-V351 HydrophobicContact CE2-CB 4.08Å; F308-V351 HydrophobicContact CE2-CG2 3.29Å; F308-V351 HydrophobicContact CZ-CB 4.4Å; F308-V351 HydrophobicContact CZ-CG2 3.33Å; F308-L354 HydrophobicContact CB-CD1 3.59Å; F308-L354 HydrophobicContact CD1-CD1 3.83Å; F308-L354 HydrophobicContact CD2-CD1 3.67Å; F308-L354 HydrophobicContact CE1-CD1 4.43Å; F308-L354 HydrophobicContact CE2-CD1 4.32Å; F308-L354 HydrophobicContact CG-CD1 3.41Å; F308-L354 VanDerWaalsContact CG-CD1 3.41Å
309	V	47	Very low	46.6	Very low	65 Å²	65	45.2 Å²	45.2	39%	0.394	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-37	175.7	170.2	0	0	0	0	110.9	T305 M306 I312 G313	T305-V309 WeakPolarHBondContact O-CB 3.39Å; T305-V309 VanDerWaalsContact O-CG2 3.26Å; T305-V309 WeakPolarHBondContact O-CG2 3.39Å; T305-V309 PolarHBondContact O-N 2.7Å; M306-V309 PolarHBondContact O-N 3.2Å; V309-I312 PolarHBondContact O-N 3.44Å; V309-G313 PolarHBondContact O-N 3.38Å
310	M	48.2	Very low	47.1	Very low	31 Å²	31	43 Å²	43	15%	0.153	21%	0.214	C	C	.	.	H	α-helix	trans	-71.7	-40.2	176.3	-173.5	-174.1	59.1	0	0	112.6	F275 M306 L307 F308 I312 G313 L314	F275-M310 HydrophobicContact CB-SD 4.14Å; F275-M310 HydrophobicContact CD1-CE 3.57Å; F275-M310 HydrophobicContact CD1-SD 3.04Å; F275-M310 WeakPolarHBondContact CD1-SD 3.4Å; F275-M310 HydrophobicContact CD2-SD 4.45Å; F275-M310 HydrophobicContact CE1-CB 4.5Å; F275-M310 HydrophobicContact CE1-CE 3.72Å; F275-M310 HydrophobicContact CE1-CG 4.49Å; F275-M310 HydrophobicContact CE1-SD 3.35Å; F275-M310 WeakPolarHBondContact CE1-SD 3.39Å; F275-M310 HydrophobicContact CG-SD 3.64Å; F275-M310 HydrophobicContact CZ-SD 4.19Å; M306-M310 VanDerWaalsContact O-CB 3.28Å; M306-M310 WeakPolarHBondContact O-CB 3.49Å; M306-M310 PolarHBondContact O-N 3.34Å; L307-M310 PolarHBondContact O-N 3.21Å; F308-M310 VanDerWaalsContact C-N 3.26Å; F308-M310 PolarHBondContact O-N 2.72Å; M310-I312 VanDerWaalsContact C-N 3.29Å; M310-I312 PolarHBondContact O-N 3.43Å; M310-G313 PolarHBondContact O-N 3.37Å; M310-L314 HydrophobicContact CG-CD1 4.03Å; M310-L314 WeakPolarHBondContact O-CB 3.28Å; M310-L314 PolarHBondContact O-N 2.87Å
311	I	47.3	Very low	47.2	Very low	9 Å²	9	41.6 Å²	41.6	5%	0.046	21%	0.206	C	C	.	.	H	α-helix	trans	-58.3	-45.6	171.6	-76	166.6	0	0	0	109.1	L307 F308 L314 Y315	L307-I311 HydrophobicContact CD2-CD1 3.64Å; L307-I311 HydrophobicContact CG-CD1 4.23Å; L307-I311 WeakPolarHBondContact O-CB 3.23Å; L307-I311 WeakPolarHBondContact O-CD1 3.19Å; L307-I311 WeakPolarHBondContact O-CG1 3.25Å; L307-I311 PolarHBondContact O-N 3.16Å; F308-I311 PolarHBondContact O-N 2.73Å; I311-L314 PolarHBondContact O-N 3.48Å; I311-Y315 HydrophobicContact CG2-CD2 3.62Å; I311-Y315 HydrophobicContact CG2-CE2 3.79Å; I311-Y315 WeakPolarHBondContact O-CB 3.13Å; I311-Y315 WeakPolarHBondContact O-CD2 3.41Å; I311-Y315 PolarHBondContact O-N 3.11Å
312	I	47.7	Very low	47.3	Very low	51 Å²	51	38.6 Å²	38.6	26%	0.262	19%	0.194	S	C	.	.	H	α-helix	trans	-60.3	-45.7	173.9	-69.5	170.3	0	0	0	111.4	F308 V309 M310 Y315 W316 L347	F308-I312 HydrophobicContact CD1-CD1 3.81Å; F308-I312 HydrophobicContact CD2-CD1 4.45Å; F308-I312 HydrophobicContact CE1-CD1 3.28Å; F308-I312 HydrophobicContact CE1-CG1 4.47Å; F308-I312 HydrophobicContact CE2-CD1 3.96Å; F308-I312 HydrophobicContact CE2-CG1 4.48Å; F308-I312 HydrophobicContact CG-CD1 4.36Å; F308-I312 HydrophobicContact CZ-CD1 3.35Å; F308-I312 HydrophobicContact CZ-CG1 4.3Å; F308-I312 WeakPolarHBondContact O-CG1 3.24Å; F308-I312 PolarHBondContact O-N 2.79Å; V309-I312 PolarHBondContact O-N 3.44Å; M310-I312 VanDerWaalsContact C-N 3.29Å; M310-I312 PolarHBondContact O-N 3.43Å; I312-Y315 PolarHBondContact O-N 3.18Å; I312-W316 WeakPolarHBondContact O-CB 3.21Å; I312-W316 PolarHBondContact O-N 3.44Å; I312-L347 HydrophobicContact CD1-CD2 3.91Å; I312-L347 HydrophobicContact CG1-CD1 4.21Å; I312-L347 HydrophobicContact CG1-CD2 3.66Å; I312-L347 HydrophobicContact CG1-CG 3.85Å
313	G	47	Very low	47.6	Very low	12 Å²	12	40.9 Å²	40.9	12%	0.124	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-42.1	179.1	0	0	0	0	0	113.3	V309 M310 N317	V309-G313 PolarHBondContact O-N 3.38Å; M310-G313 PolarHBondContact O-N 3.37Å; G313-N317 WeakPolarHBondContact O-CB 3.3Å; G313-N317 PolarHBondContact O-N 2.84Å
314	L	49.3	Very low	47.9	Very low	30 Å²	30	45.9 Å²	45.9	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-46.4	173.2	-86.2	158.1	0	0	0	111.7	L268 T272 M310 I311 N317 N318	L268-L314 HydrophobicContact CD1-CD2 3.95Å; L268-L314 HydrophobicContact CD2-CD2 4Å; L268-L314 HydrophobicContact CG-CD2 3.93Å; T272-L314 HydrophobicContact CG2-CD1 3.73Å; T272-L314 HydrophobicContact CG2-CD2 3.42Å; T272-L314 VanDerWaalsContact CG2-CD2 3.42Å; T272-L314 HydrophobicContact CG2-CG 4.04Å; M310-L314 HydrophobicContact CG-CD1 4.03Å; M310-L314 WeakPolarHBondContact O-CB 3.28Å; M310-L314 PolarHBondContact O-N 2.87Å; I311-L314 PolarHBondContact O-N 3.48Å; L314-N317 PolarHBondContact O-N 3.33Å; L314-N318 WeakPolarHBondContact O-CB 3.44Å; L314-N318 VanDerWaalsContact O-CG 3.24Å; L314-N318 PolarHBondContact O-N 3.27Å; L314-N318 PolarHBondContact O-ND2 3.13Å
315	Y	51	Low	48	Very low	10 Å²	10	45.9 Å²	45.9	4%	0.039	22%	0.218	C	C	.	.	H	α-helix	trans	-73.6	-33.5	179.9	-80.9	-65.6	0	0	0	113	I311 I312 N317 N318 F319 C346 S379	I311-Y315 HydrophobicContact CG2-CD2 3.62Å; I311-Y315 HydrophobicContact CG2-CE2 3.79Å; I311-Y315 WeakPolarHBondContact O-CB 3.13Å; I311-Y315 WeakPolarHBondContact O-CD2 3.41Å; I311-Y315 PolarHBondContact O-N 3.11Å; I312-Y315 PolarHBondContact O-N 3.18Å; Y315-N317 VanDerWaalsContact C-N 3.35Å; Y315-N318 CarbonylContact O-C 3.52Å; Y315-N318 WeakPolarHBondContact O-CB 3.32Å; Y315-N318 PolarHBondContact O-N 3.29Å; Y315-F319 WeakPolarHBondContact O-CB 3.4Å; Y315-F319 PolarHBondContact O-N 2.83Å; Y315-C346 HydrophobicContact CD2-CB 4.23Å; Y315-C346 HydrophobicContact CE1-CB 4.49Å; Y315-C346 HydrophobicContact CE2-CB 3.42Å; Y315-C346 VanDerWaalsContact CE2-CB 3.42Å; Y315-C346 WeakPolarHBondContact CE2-SG 3.4Å; Y315-C346 WeakPolarHBondContact OH-CB 3.15Å; Y315-S379 PolarHBondContact OH-OG 3.32Å; Y315-S379 VanDerWaalsContact OH-OG 3.07Å
316	W	49.3	Very low	48	Very low	160 Å²	160	46.6 Å²	46.6	61%	0.606	23%	0.226	S	C	*	.	H	α-helix	trans	-64.8	-40.2	173.5	-172.1	-99.3	0	0	0	111.1	F258 I312 F319 S320	F258-W316 HydrophobicContact CE1-CB 4.48Å; F258-W316 AromaticContact CE1-CD1 3.86Å; F258-W316 HydrophobicContact CE1-CG 4.48Å; I312-W316 WeakPolarHBondContact O-CB 3.21Å; I312-W316 PolarHBondContact O-N 3.44Å; W316-F319 WeakPolarHBondContact O-CB 3.31Å; W316-F319 PolarHBondContact O-N 3.32Å; W316-S320 WeakPolarHBondContact O-CB 3.45Å; W316-S320 PolarHBondContact O-N 3.14Å
317	N	48.4	Very low	48.1	Very low	6 Å²	6	55 Å²	55	3%	0.032	26%	0.255	C	S	.	.	H	α-helix	trans	-67.4	-40.4	173.7	-157.8	-1.8	0	0	0	111.4	L261 G313 L314 Y315 F319 S320 N321	L261-N317 PolarHBondContact O-ND2 3.38Å; G313-N317 WeakPolarHBondContact O-CB 3.3Å; G313-N317 PolarHBondContact O-N 2.84Å; L314-N317 PolarHBondContact O-N 3.33Å; Y315-N317 VanDerWaalsContact C-N 3.35Å; N317-F319 VanDerWaalsContact C-N 3.33Å; N317-F319 PolarHBondContact O-N 3.48Å; N317-S320 PolarHBondContact O-N 2.74Å; N317-N321 WeakPolarHBondContact O-CB 3.27Å; N317-N321 VanDerWaalsContact O-CG 3.25Å; N317-N321 PolarHBondContact O-N 3.45Å; N317-N321 PolarHBondContact O-ND2 3.4Å
318	N	48.4	Very low	48.1	Very low	11 Å²	11	57.8 Å²	57.8	6%	0.059	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-37.8	170.7	-71.6	-29.6	0	0	0	112.5	L314 Y315 N321 V322	L314-N318 WeakPolarHBondContact O-CB 3.44Å; L314-N318 VanDerWaalsContact O-CG 3.24Å; L314-N318 PolarHBondContact O-N 3.27Å; L314-N318 PolarHBondContact O-ND2 3.13Å; Y315-N318 CarbonylContact O-C 3.52Å; Y315-N318 WeakPolarHBondContact O-CB 3.32Å; Y315-N318 PolarHBondContact O-N 3.29Å; N318-N321 PolarHBondContact O-N 3.28Å; N318-V322 WeakPolarHBondContact O-CB 3.17Å; N318-V322 WeakPolarHBondContact O-CG2 3.39Å; N318-V322 PolarHBondContact O-N 3.26Å
319	F	48.5	Very low	48.1	Very low	51 Å²	51	61.8 Å²	61.8	22%	0.224	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-46.3	176.7	-131	-109.5	0	0	0	111.3	Y315 W316 N317 N321 V322 F323 F340 I344	Y315-F319 WeakPolarHBondContact O-CB 3.4Å; Y315-F319 PolarHBondContact O-N 2.83Å; W316-F319 WeakPolarHBondContact O-CB 3.31Å; W316-F319 PolarHBondContact O-N 3.32Å; N317-F319 VanDerWaalsContact C-N 3.33Å; N317-F319 PolarHBondContact O-N 3.48Å; F319-N321 VanDerWaalsContact C-N 3.3Å; F319-N321 PolarHBondContact O-N 3.04Å; F319-V322 WeakPolarHBondContact O-CB 3.32Å; F319-V322 PolarHBondContact O-N 3.26Å; F319-F323 AromaticContact CD1-CD2 3.92Å; F319-F323 HydrophobicContact CD1-CD2 3.92Å; F319-F323 AromaticContact CD1-CE2 3.51Å; F319-F323 HydrophobicContact CD1-CE2 3.51Å; F319-F323 HydrophobicContact CE1-CD2 4.5Å; F319-F323 AromaticContact CE1-CE2 3.66Å; F319-F323 HydrophobicContact CE1-CE2 3.66Å; F319-F323 VanDerWaalsContact O-CD2 3.26Å; F319-F323 WeakPolarHBondContact O-CD2 3.46Å; F319-F323 PolarHBondContact O-N 2.86Å; F319-F340 HydrophobicContact CD1-CE2 4.33Å; F319-F340 HydrophobicContact CD2-CD2 4.02Å; F319-F340 HydrophobicContact CD2-CE2 4.34Å; F319-F340 HydrophobicContact CE1-CD2 4.02Å; F319-F340 AromaticContact CE1-CE2 3.41Å; F319-F340 HydrophobicContact CE1-CE2 3.41Å; F319-F340 VanDerWaalsContact CE1-CE2 3.41Å; F319-F340 HydrophobicContact CE1-CZ 4.19Å; F319-F340 AromaticContact CE2-CD2 3.33Å; F319-F340 HydrophobicContact CE2-CD2 3.33Å; F319-F340 AromaticContact CE2-CE2 3.42Å; F319-F340 HydrophobicContact CE2-CE2 3.42Å; F319-F340 VanDerWaalsContact CE2-CE2 3.42Å; F319-F340 HydrophobicContact CE2-CG 4.02Å; F319-F340 HydrophobicContact CE2-CZ 4.11Å; F319-F340 AromaticContact CZ-CD2 3.37Å; F319-F340 HydrophobicContact CZ-CD2 3.37Å; F319-F340 HydrophobicContact CZ-CE1 4.36Å; F319-F340 AromaticContact CZ-CE2 2.88Å; F319-F340 HydrophobicContact CZ-CE2 2.88Å; F319-F340 HydrophobicContact CZ-CG 4.3Å; F319-F340 AromaticContact CZ-CZ 3.46Å; F319-F340 HydrophobicContact CZ-CZ 3.46Å; F319-F340 VanDerWaalsContact CZ-CZ 3.46Å; F319-I344 HydrophobicContact CE2-CD1 4.4Å; F319-I344 HydrophobicContact CE2-CG1 4.13Å; F319-I344 HydrophobicContact CZ-CD1 4.36Å; F319-I344 HydrophobicContact CZ-CG1 4.42Å
320	S	49.9	Very low	47.9	Very low	18 Å²	18	68 Å²	68	13%	0.126	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-40	175.6	-175.1	0	0	0	0	111.6	Y262 W316 N317 F323 R324	Y262-S320 WeakPolarHBondContact CE2-OG 3.46Å; Y262-S320 PolarHBondContact OH-OG 3.3Å; W316-S320 WeakPolarHBondContact O-CB 3.45Å; W316-S320 PolarHBondContact O-N 3.14Å; N317-S320 PolarHBondContact O-N 2.74Å; S320-F323 PolarHBondContact O-N 3.45Å; S320-R324 VanDerWaalsContact O-CB 3.32Å; S320-R324 WeakPolarHBondContact O-CB 3.23Å; S320-R324 PolarHBondContact O-N 2.93Å
321	N	47.8	Very low	47.9	Very low	11 Å²	11	70.5 Å²	70.5	6%	0.059	33%	0.326	C	S	.	.	H	α-helix	trans	-68.2	-39.8	175.4	-72.5	-27.7	0	0	0	111.7	N317 N318 F319 F323 R324 I325	N317-N321 WeakPolarHBondContact O-CB 3.27Å; N317-N321 VanDerWaalsContact O-CG 3.25Å; N317-N321 PolarHBondContact O-N 3.45Å; N317-N321 PolarHBondContact O-ND2 3.4Å; N318-N321 PolarHBondContact O-N 3.28Å; F319-N321 VanDerWaalsContact C-N 3.3Å; F319-N321 PolarHBondContact O-N 3.04Å; N321-F323 VanDerWaalsContact C-N 3.33Å; N321-F323 PolarHBondContact O-N 3.28Å; N321-R324 PolarHBondContact O-N 3.41Å; N321-I325 HydrophobicContact CB-CD1 4.24Å; N321-I325 WeakPolarHBondContact O-CB 3.25Å; N321-I325 WeakPolarHBondContact O-CD1 3.5Å; N321-I325 WeakPolarHBondContact O-CG1 3.42Å; N321-I325 PolarHBondContact O-N 3.3Å
322	V	46.9	Very low	48.1	Very low	14 Å²	14	76.2 Å²	76.2	9%	0.085	35%	0.351	C	S	.	.	H	α-helix	trans	-59.1	-42.4	171.3	160.6	0	0	0	0	111.4	N318 F319 S326 I336 L339 F340	N318-V322 WeakPolarHBondContact O-CB 3.17Å; N318-V322 WeakPolarHBondContact O-CG2 3.39Å; N318-V322 PolarHBondContact O-N 3.26Å; F319-V322 WeakPolarHBondContact O-CB 3.32Å; F319-V322 PolarHBondContact O-N 3.26Å; V322-S326 WeakPolarHBondContact O-CB 3.15Å; V322-S326 PolarHBondContact O-N 2.89Å; V322-S326 PolarHBondContact O-OG 3.32Å; V322-I336 HydrophobicContact CB-CG2 4.29Å; V322-I336 HydrophobicContact CG1-CG2 3.51Å; V322-I336 HydrophobicContact CG2-CG2 4.17Å; V322-L339 HydrophobicContact CG2-CB 4.47Å; V322-L339 HydrophobicContact CG2-CD2 3.64Å; V322-L339 HydrophobicContact CG2-CG 4.28Å; V322-F340 HydrophobicContact CG1-CD2 4.48Å
323	F	51.3	Low	48.4	Very low	122 Å²	122	82.1 Å²	82.1	54%	0.535	38%	0.375	S	S	.	.	H	α-helix	trans	-70.3	-30.4	176.1	-88	-70.8	0	0	0	114	F319 S320 N321 S326	F319-F323 AromaticContact CD1-CD2 3.92Å; F319-F323 HydrophobicContact CD1-CD2 3.92Å; F319-F323 AromaticContact CD1-CE2 3.51Å; F319-F323 HydrophobicContact CD1-CE2 3.51Å; F319-F323 HydrophobicContact CE1-CD2 4.5Å; F319-F323 AromaticContact CE1-CE2 3.66Å; F319-F323 HydrophobicContact CE1-CE2 3.66Å; F319-F323 VanDerWaalsContact O-CD2 3.26Å; F319-F323 WeakPolarHBondContact O-CD2 3.46Å; F319-F323 PolarHBondContact O-N 2.86Å; S320-F323 PolarHBondContact O-N 3.45Å; N321-F323 VanDerWaalsContact C-N 3.33Å; N321-F323 PolarHBondContact O-N 3.28Å; F323-S326 PolarHBondContact O-OG 3.47Å; F323-S326 VanDerWaalsContact O-OG 3.05Å
324	R	49.5	Very low	48.9	Very low	142 Å²	142	91 Å²	91	54%	0.536	41%	0.405	S	S	.	.	H	α-helix	trans	-80.2	-35.1	177.9	-163.1	174.2	169.7	-179.2	-3	111.8	S320 N321	S320-R324 VanDerWaalsContact O-CB 3.32Å; S320-R324 WeakPolarHBondContact O-CB 3.23Å; S320-R324 PolarHBondContact O-N 2.93Å; N321-R324 PolarHBondContact O-N 3.41Å
325	I	47.6	Very low	49.3	Very low	28 Å²	28	92.4 Å²	92.4	14%	0.144	41%	0.408	C	S	.	.	H	α-helix	trans	-84.4	-27.3	-179.7	-63	164.7	0	0	0	111.7	N321 R327 Q328 I336 N388	N321-I325 HydrophobicContact CB-CD1 4.24Å; N321-I325 WeakPolarHBondContact O-CB 3.25Å; N321-I325 WeakPolarHBondContact O-CD1 3.5Å; N321-I325 WeakPolarHBondContact O-CG1 3.42Å; N321-I325 PolarHBondContact O-N 3.3Å; I325-R327 PolarHBondContact O-N 2.92Å; I325-Q328 PolarHBondContact O-N 3.49Å; I325-I336 HydrophobicContact CG2-CD1 4.18Å; I325-N388 VanDerWaalsContact CD1-ND2 3.33Å; I325-N388 WeakPolarHBondContact CD1-ND2 3.41Å
326	S	44.7	Very low	49.5	Very low	72 Å²	72	93 Å²	93	50%	0.503	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.6	174.9	67.1	0	0	0	0	114.1	V322 F323	V322-S326 WeakPolarHBondContact O-CB 3.15Å; V322-S326 PolarHBondContact O-N 2.89Å; V322-S326 PolarHBondContact O-OG 3.32Å; F323-S326 PolarHBondContact O-OG 3.47Å; F323-S326 VanDerWaalsContact O-OG 3.05Å
327	R	47.4	Very low	50	Low	223 Å²	223	89.9 Å²	89.9	84%	0.842	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.4	172.6	-66.4	-176.4	177.3	178.8	-0.8	114.1	I325	I325-R327 PolarHBondContact O-N 2.92Å
328	Q	48.3	Very low	50.7	Low	108 Å²	108	93.4 Å²	93.4	51%	0.505	42%	0.423	S	S	.	.			trans	-93.9	131.6	-180	-67.3	-167.6	-9	0	0	112.4	I325 F330	I325-Q328 PolarHBondContact O-N 3.49Å; Q328-F330 VanDerWaalsContact C-N 3.31Å; Q328-F330 PolarHBondContact O-N 3.36Å
329	P	44.2	Very low	51.2	Low	123 Å²	123	93.3 Å²	93.3	80%	0.799	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-6.5	-169.7	24.8	-30.2	0	0	0	116
330	F	44.3	Very low	51.6	Low	195 Å²	195	93.7 Å²	93.7	86%	0.855	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	8	-165.6	-85.3	-79.6	0	0	0	116.8	Q328	Q328-F330 VanDerWaalsContact C-N 3.31Å; Q328-F330 PolarHBondContact O-N 3.36Å
331	W	47	Very low	52.3	Low	84 Å²	84	100.2 Å²	100.2	32%	0.318	45%	0.446	S	S	.	.	S	Bend	trans	-110.4	142.4	-166.6	-70.5	80.3	0	0	0	114.7	K333 I336 T386 T387	W331-K333 PolarHBondContact O-N 3.49Å; W331-I336 HydrophobicContact CB-CD1 4.35Å; W331-T386 VanDerWaalsContact CH2-O 3.3Å; W331-T386 WeakPolarHBondContact CH2-O 3.35Å; W331-T386 WeakPolarHBondContact CZ3-O 3.28Å; W331-T387 HydrophobicContact CH2-CG2 4.21Å; W331-T387 WeakPolarHBondContact CH2-OG1 3.26Å; W331-T387 HydrophobicContact CZ3-CG2 4.36Å
332	K	51.9	Low	52.9	Low	130 Å²	130	100.2 Å²	100.2	57%	0.565	45%	0.447	S	S	*	.			trans	-59.6	91.5	178	-72.2	-177.9	-177.5	178.8	0	110.6	R334 Y335 H472	K332-R334 PolarHBondContact O-N 3.48Å; K332-Y335 HydrophobicContact CB-CD2 4.04Å; K332-Y335 HydrophobicContact CD-CD2 4.33Å; K332-Y335 HydrophobicContact CD-CE2 4.16Å; K332-Y335 PolarHBondContact O-N 3.36Å; K332-H472 PolarHBondContact NZ-CD2 3.41Å; K332-H472 VanDerWaalsContact NZ-CD2 3.29Å; K332-H472 PolarHBondContact NZ-NE2 2.95Å
333	K	54.2	Low	53.3	Low	175 Å²	175	99.7 Å²	99.7	76%	0.761	44%	0.444	S	S	*	.	H	α-helix	trans	-42.6	-27.7	176.4	-72.7	-177.8	177.5	178.4	0	114.4	W331 N337	W331-K333 PolarHBondContact O-N 3.49Å; K333-N337 PolarHBondContact O-N 2.96Å
334	R	57.8	Low	53.7	Low	198 Å²	198	96.3 Å²	96.3	75%	0.747	43%	0.431	S	S	*	.	H	α-helix	trans	-58	-50.1	175.6	-81.4	-176.5	177.8	166.3	0.2	113.9	K332 I336 N337 H338	K332-R334 PolarHBondContact O-N 3.48Å; R334-I336 PolarHBondContact O-N 3.38Å; R334-N337 PolarHBondContact O-N 2.99Å; R334-H338 PolarHBondContact O-CD2 3.06Å; R334-H338 PolarHBondContact O-N 3.19Å
335	Y	56.2	Low	54.3	Low	59 Å²	59	92 Å²	92	23%	0.231	42%	0.42	C	S	.	.	H	α-helix	trans	-72	-32.8	-173.5	-74.7	-77.7	0	0	0	112.9	K332 H338 L339 M385 H472	K332-Y335 HydrophobicContact CB-CD2 4.04Å; K332-Y335 HydrophobicContact CD-CD2 4.33Å; K332-Y335 HydrophobicContact CD-CE2 4.16Å; K332-Y335 PolarHBondContact O-N 3.36Å; Y335-H338 PolarHBondContact O-N 2.7Å; Y335-L339 WeakPolarHBondContact O-CB 3.49Å; Y335-L339 PolarHBondContact O-N 3.5Å; Y335-M385 HydrophobicContact CD1-CB 4.33Å; Y335-M385 HydrophobicContact CE1-CB 4.27Å; Y335-M385 HydrophobicContact CE1-CG 4.47Å; Y335-H472 AromaticContact CE2-CE1 3.44Å; Y335-H472 VanDerWaalsContact CE2-CE1 3.44Å; Y335-H472 WeakPolarHBondContact CE2-CE1 3.32Å; Y335-H472 AromaticContact CZ-CE1 3.49Å; Y335-H472 VanDerWaalsContact CZ-CE1 3.49Å; Y335-H472 AromaticContact CZ-ND1 3.8Å; Y335-H472 PolarHBondContact OH-CE1 3.48Å; Y335-H472 PolarHBondContact OH-ND1 3.34Å
336	I	55.4	Low	54.8	Low	23 Å²	23	90.7 Å²	90.7	12%	0.118	41%	0.414	C	S	.	.	H	α-helix	trans	-64.6	-44.2	175.7	-62.4	177.3	0	0	0	110.3	V322 I325 W331 R334 L339 F340	V322-I336 HydrophobicContact CB-CG2 4.29Å; V322-I336 HydrophobicContact CG1-CG2 3.51Å; V322-I336 HydrophobicContact CG2-CG2 4.17Å; I325-I336 HydrophobicContact CG2-CD1 4.18Å; W331-I336 HydrophobicContact CB-CD1 4.35Å; R334-I336 PolarHBondContact O-N 3.38Å; I336-L339 PolarHBondContact O-N 2.91Å; I336-F340 WeakPolarHBondContact O-CB 3.36Å; I336-F340 PolarHBondContact O-N 2.95Å
337	N	60.5	Low	55.2	Low	95 Å²	95	90.1 Å²	90.1	51%	0.508	41%	0.405	S	S	.	.	H	α-helix	trans	-63.9	-42.4	174.1	-74.4	-4	0	0	0	111.9	K333 R334 L339 F340 W341	K333-N337 PolarHBondContact O-N 2.96Å; R334-N337 PolarHBondContact O-N 2.99Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 3.03Å; N337-F340 PolarHBondContact O-N 3.19Å; N337-W341 PolarHBondContact O-N 3Å
338	H	63.9	Low	56	Low	80 Å²	80	83.8 Å²	83.8	37%	0.37	39%	0.387	S	S	.	.	H	α-helix	trans	-63.7	-39.7	176.8	-73	-56.2	0	0	0	112.6	R334 Y335 S342 Y378	R334-H338 PolarHBondContact O-CD2 3.06Å; R334-H338 PolarHBondContact O-N 3.19Å; Y335-H338 PolarHBondContact O-N 2.7Å; H338-S342 WeakPolarHBondContact O-CB 3.18Å; H338-S342 PolarHBondContact O-N 3.4Å; H338-S342 PolarHBondContact O-OG 3.41Å; H338-Y378 HydrophobicContact CB-CE1 4.27Å
339	L	58.7	Low	56.4	Low	8 Å²	8	81.3 Å²	81.3	4%	0.042	38%	0.375	C	S	.	.	H	α-helix	trans	-64.2	-45.1	176.2	-171	68.1	0	0	0	111	V322 Y335 I336 N337 S342 G343 C382 L383	V322-L339 HydrophobicContact CG2-CB 4.47Å; V322-L339 HydrophobicContact CG2-CD2 3.64Å; V322-L339 HydrophobicContact CG2-CG 4.28Å; Y335-L339 WeakPolarHBondContact O-CB 3.49Å; Y335-L339 PolarHBondContact O-N 3.5Å; I336-L339 PolarHBondContact O-N 2.91Å; N337-L339 VanDerWaalsContact C-N 3.34Å; N337-L339 PolarHBondContact O-N 3.03Å; L339-S342 WeakPolarHBondContact CA-OG 3.22Å; L339-S342 PolarHBondContact O-N 3.46Å; L339-S342 PolarHBondContact O-OG 3.3Å; L339-G343 PolarHBondContact O-N 2.77Å; L339-C382 HydrophobicContact CD1-CB 4.05Å; L339-L383 HydrophobicContact CD1-CD2 4.21Å; L339-L383 HydrophobicContact CD1-CG 3.9Å; L339-L383 HydrophobicContact CD2-CD2 3.67Å; L339-L383 HydrophobicContact CD2-CG 4.27Å
340	F	56.8	Low	56.9	Low	59 Å²	59	75.6 Å²	75.6	26%	0.259	34%	0.337	S	S	.	.	H	α-helix	trans	-57.3	-52.8	175.6	-179.2	-89.8	0	0	0	112.5	F319 V322 I336 N337 G343 I344	F319-F340 HydrophobicContact CD1-CE2 4.33Å; F319-F340 HydrophobicContact CD2-CD2 4.02Å; F319-F340 HydrophobicContact CD2-CE2 4.34Å; F319-F340 HydrophobicContact CE1-CD2 4.02Å; F319-F340 AromaticContact CE1-CE2 3.41Å; F319-F340 HydrophobicContact CE1-CE2 3.41Å; F319-F340 VanDerWaalsContact CE1-CE2 3.41Å; F319-F340 HydrophobicContact CE1-CZ 4.19Å; F319-F340 AromaticContact CE2-CD2 3.33Å; F319-F340 HydrophobicContact CE2-CD2 3.33Å; F319-F340 AromaticContact CE2-CE2 3.42Å; F319-F340 HydrophobicContact CE2-CE2 3.42Å; F319-F340 VanDerWaalsContact CE2-CE2 3.42Å; F319-F340 HydrophobicContact CE2-CG 4.02Å; F319-F340 HydrophobicContact CE2-CZ 4.11Å; F319-F340 AromaticContact CZ-CD2 3.37Å; F319-F340 HydrophobicContact CZ-CD2 3.37Å; F319-F340 HydrophobicContact CZ-CE1 4.36Å; F319-F340 AromaticContact CZ-CE2 2.88Å; F319-F340 HydrophobicContact CZ-CE2 2.88Å; F319-F340 HydrophobicContact CZ-CG 4.3Å; F319-F340 AromaticContact CZ-CZ 3.46Å; F319-F340 HydrophobicContact CZ-CZ 3.46Å; F319-F340 VanDerWaalsContact CZ-CZ 3.46Å; V322-F340 HydrophobicContact CG1-CD2 4.48Å; I336-F340 WeakPolarHBondContact O-CB 3.36Å; I336-F340 PolarHBondContact O-N 2.95Å; N337-F340 PolarHBondContact O-N 3.19Å; F340-G343 PolarHBondContact O-N 3.06Å; F340-I344 HydrophobicContact CD1-CD1 3.75Å; F340-I344 HydrophobicContact CE1-CD1 3.31Å; F340-I344 HydrophobicContact CZ-CD1 3.81Å; F340-I344 PolarHBondContact O-N 3.35Å
341	W	64.2	Low	57.3	Low	156 Å²	156	68.6 Å²	68.6	59%	0.591	31%	0.31	S	S	*	.	H	α-helix	trans	-66.6	-40.1	179.2	-76.5	110.5	0	0	0	112.3	N337 G343 I344 V345	N337-W341 PolarHBondContact O-N 3Å; W341-G343 VanDerWaalsContact C-N 3.25Å; W341-G343 PolarHBondContact O-N 3.29Å; W341-I344 PolarHBondContact O-N 3.5Å; W341-V345 WeakPolarHBondContact O-CB 3.15Å; W341-V345 WeakPolarHBondContact O-CG2 3.33Å; W341-V345 PolarHBondContact O-N 3.37Å
342	S	60.9	Low	57.9	Low	11 Å²	11	68 Å²	68	8%	0.077	31%	0.313	C	S	.	.	H	α-helix	trans	-59.9	-38.3	175.7	72.8	0	0	0	0	111.7	H338 L339 V345 C346 I375	H338-S342 WeakPolarHBondContact O-CB 3.18Å; H338-S342 PolarHBondContact O-N 3.4Å; H338-S342 PolarHBondContact O-OG 3.41Å; L339-S342 WeakPolarHBondContact CA-OG 3.22Å; L339-S342 PolarHBondContact O-N 3.46Å; L339-S342 PolarHBondContact O-OG 3.3Å; S342-V345 PolarHBondContact O-N 2.99Å; S342-C346 VanDerWaalsContact O-CB 3.32Å; S342-C346 WeakPolarHBondContact O-CB 3.48Å; S342-C346 PolarHBondContact O-N 3.3Å; S342-I375 WeakPolarHBondContact O-CG2 3.39Å
343	G	54	Low	58.1	Low	2 Å²	2	62.4 Å²	62.4	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-66.4	-47.4	177.4	0	0	0	0	0	113.6	L339 F340 W341 V345 C346 L347	L339-G343 PolarHBondContact O-N 2.77Å; F340-G343 PolarHBondContact O-N 3.06Å; W341-G343 VanDerWaalsContact C-N 3.25Å; W341-G343 PolarHBondContact O-N 3.29Å; G343-V345 VanDerWaalsContact C-N 3.31Å; G343-V345 PolarHBondContact O-N 2.91Å; G343-C346 PolarHBondContact O-N 3.03Å; G343-L347 WeakPolarHBondContact O-CB 3.33Å; G343-L347 PolarHBondContact O-N 2.83Å
344	I	60.8	Low	57.9	Low	51 Å²	51	55.7 Å²	55.7	26%	0.262	26%	0.262	S	S	.	.	H	α-helix	trans	-58.6	-46.5	176.2	-66.6	169.7	0	0	0	110.7	F319 F340 W341 L347 I348	F319-I344 HydrophobicContact CE2-CD1 4.4Å; F319-I344 HydrophobicContact CE2-CG1 4.13Å; F319-I344 HydrophobicContact CZ-CD1 4.36Å; F319-I344 HydrophobicContact CZ-CG1 4.42Å; F340-I344 HydrophobicContact CD1-CD1 3.75Å; F340-I344 HydrophobicContact CE1-CD1 3.31Å; F340-I344 HydrophobicContact CZ-CD1 3.81Å; F340-I344 PolarHBondContact O-N 3.35Å; W341-I344 PolarHBondContact O-N 3.5Å; I344-L347 WeakPolarHBondContact O-CB 3.4Å; I344-L347 PolarHBondContact O-N 2.95Å; I344-I348 HydrophobicContact CG2-CD1 3.9Å; I344-I348 WeakPolarHBondContact O-CG1 3.37Å; I344-I348 PolarHBondContact O-N 2.95Å
345	V	61.9	Low	57.7	Low	51 Å²	51	51.4 Å²	51.4	31%	0.309	25%	0.249	S	C	.	.	H	α-helix	trans	-65.7	-43.1	-178.4	178.5	0	0	0	0	110.4	W341 S342 G343 L347 I348 F349 I375	W341-V345 WeakPolarHBondContact O-CB 3.15Å; W341-V345 WeakPolarHBondContact O-CG2 3.33Å; W341-V345 PolarHBondContact O-N 3.37Å; S342-V345 PolarHBondContact O-N 2.99Å; G343-V345 VanDerWaalsContact C-N 3.31Å; G343-V345 PolarHBondContact O-N 2.91Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.03Å; V345-I348 PolarHBondContact O-N 3.42Å; V345-F349 HydrophobicContact CG1-CD2 3.55Å; V345-F349 HydrophobicContact CG1-CE2 3.45Å; V345-F349 VanDerWaalsContact CG1-CE2 3.45Å; V345-F349 WeakPolarHBondContact O-CD2 3.39Å; V345-F349 PolarHBondContact O-N 2.79Å; V345-I375 HydrophobicContact CB-CD1 4.42Å; V345-I375 HydrophobicContact CG1-CD1 3.66Å
346	C	57.6	Low	57.6	Low	1 Å²	1	49 Å²	49	1%	0.007	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-38.6	174.8	-164.7	0	0	0	0	112.4	Y315 S342 G343 F349 S350 I375	Y315-C346 HydrophobicContact CD2-CB 4.23Å; Y315-C346 HydrophobicContact CE1-CB 4.49Å; Y315-C346 HydrophobicContact CE2-CB 3.42Å; Y315-C346 VanDerWaalsContact CE2-CB 3.42Å; Y315-C346 WeakPolarHBondContact CE2-SG 3.4Å; Y315-C346 WeakPolarHBondContact OH-CB 3.15Å; S342-C346 VanDerWaalsContact O-CB 3.32Å; S342-C346 WeakPolarHBondContact O-CB 3.48Å; S342-C346 PolarHBondContact O-N 3.3Å; G343-C346 PolarHBondContact O-N 3.03Å; C346-F349 PolarHBondContact O-N 3.27Å; C346-S350 VanDerWaalsContact O-CB 3.23Å; C346-S350 WeakPolarHBondContact O-CB 3.32Å; C346-S350 PolarHBondContact O-N 3.2Å; C346-S350 PolarHBondContact O-OG 3.43Å; C346-S350 VanDerWaalsContact O-OG 3.06Å; C346-I375 HydrophobicContact CB-CB 4.23Å; C346-I375 HydrophobicContact CB-CG2 3.66Å
347	L	53.9	Low	57.2	Low	60 Å²	60	49.1 Å²	49.1	31%	0.314	24%	0.24	S	C	.	.	H	α-helix	trans	-62.4	-49.2	177.1	-133.6	162.8	0	0	0	110.2	F308 I312 G343 I344 V345 F349 S350 V351	F308-L347 HydrophobicContact CE2-CD2 4.27Å; F308-L347 HydrophobicContact CZ-CD2 4.27Å; I312-L347 HydrophobicContact CD1-CD2 3.91Å; I312-L347 HydrophobicContact CG1-CD1 4.21Å; I312-L347 HydrophobicContact CG1-CD2 3.66Å; I312-L347 HydrophobicContact CG1-CG 3.85Å; G343-L347 WeakPolarHBondContact O-CB 3.33Å; G343-L347 PolarHBondContact O-N 2.83Å; I344-L347 WeakPolarHBondContact O-CB 3.4Å; I344-L347 PolarHBondContact O-N 2.95Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.03Å; L347-F349 PolarHBondContact O-N 3.37Å; L347-S350 WeakPolarHBondContact CA-OG 3.11Å; L347-S350 PolarHBondContact O-N 3.35Å; L347-S350 PolarHBondContact O-OG 3.36Å; L347-V351 HydrophobicContact CD2-CG2 4.41Å; L347-V351 WeakPolarHBondContact O-CG2 3.17Å; L347-V351 PolarHBondContact O-N 3.05Å
348	I	64.3	Low	56.4	Low	90 Å²	90	50.2 Å²	50.2	46%	0.462	24%	0.242	S	C	.	.	H	α-helix	trans	-57.8	-49.6	175.4	-66.4	165.2	0	0	0	111.1	I344 V345 S350 V351 L352	I344-I348 HydrophobicContact CG2-CD1 3.9Å; I344-I348 WeakPolarHBondContact O-CG1 3.37Å; I344-I348 PolarHBondContact O-N 2.95Å; V345-I348 PolarHBondContact O-N 3.42Å; I348-S350 PolarHBondContact O-N 3.33Å; I348-V351 WeakPolarHBondContact O-CB 3.25Å; I348-V351 PolarHBondContact O-N 3.4Å; I348-L352 HydrophobicContact CG2-CD1 3.81Å; I348-L352 HydrophobicContact CG2-CG 4.41Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CG 3.26Å; I348-L352 WeakPolarHBondContact O-CG 3.41Å; I348-L352 PolarHBondContact O-N 3.49Å
349	F	56.8	Low	55.7	Low	57 Å²	57	55.5 Å²	55.5	25%	0.25	26%	0.26	C	S	.	.	H	α-helix	trans	-66.2	-36.6	179.9	-79.9	-72.4	0	0	0	112.3	V345 C346 L347 L352 T353 I368 V371 I375	V345-F349 HydrophobicContact CG1-CD2 3.55Å; V345-F349 HydrophobicContact CG1-CE2 3.45Å; V345-F349 VanDerWaalsContact CG1-CE2 3.45Å; V345-F349 WeakPolarHBondContact O-CD2 3.39Å; V345-F349 PolarHBondContact O-N 2.79Å; C346-F349 PolarHBondContact O-N 3.27Å; L347-F349 PolarHBondContact O-N 3.37Å; F349-L352 HydrophobicContact CD1-CD1 4.32Å; F349-L352 CarbonylContact O-C 3.58Å; F349-L352 PolarHBondContact O-N 2.88Å; F349-T353 WeakPolarHBondContact O-CG2 3.41Å; F349-T353 PolarHBondContact O-N 3.01Å; F349-I368 HydrophobicContact CB-CG2 4.27Å; F349-I368 HydrophobicContact CD1-CG2 3.84Å; F349-I368 WeakPolarHBondContact O-CG2 3.39Å; F349-V371 HydrophobicContact CD1-CB 4.26Å; F349-V371 HydrophobicContact CD1-CG1 3.87Å; F349-V371 HydrophobicContact CD2-CG1 3.61Å; F349-V371 HydrophobicContact CE1-CB 4.44Å; F349-V371 HydrophobicContact CE1-CG1 3.92Å; F349-V371 HydrophobicContact CE2-CG1 3.64Å; F349-V371 HydrophobicContact CG-CB 4.43Å; F349-V371 HydrophobicContact CG-CG1 3.75Å; F349-V371 HydrophobicContact CZ-CG1 3.82Å; F349-I375 HydrophobicContact CD2-CD1 3.77Å; F349-I375 HydrophobicContact CE2-CD1 4.35Å
350	S	53.3	Low	55.1	Low	2 Å²	2	57.6 Å²	57.6	1%	0.014	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-37.4	175.5	69.1	0	0	0	0	112.5	F308 C346 L347 I348 T353 L354	F308-S350 WeakPolarHBondContact CD2-OG 3.5Å; F308-S350 VanDerWaalsContact CE2-OG 3.23Å; F308-S350 WeakPolarHBondContact CE2-OG 3.33Å; C346-S350 VanDerWaalsContact O-CB 3.23Å; C346-S350 WeakPolarHBondContact O-CB 3.32Å; C346-S350 PolarHBondContact O-N 3.2Å; C346-S350 PolarHBondContact O-OG 3.43Å; C346-S350 VanDerWaalsContact O-OG 3.06Å; L347-S350 WeakPolarHBondContact CA-OG 3.11Å; L347-S350 PolarHBondContact O-N 3.35Å; L347-S350 PolarHBondContact O-OG 3.36Å; I348-S350 PolarHBondContact O-N 3.33Å; S350-T353 WeakPolarHBondContact CA-OG1 3.29Å; S350-T353 PolarHBondContact O-N 3.16Å; S350-T353 PolarHBondContact O-OG1 2.95Å; S350-L354 PolarHBondContact O-N 3.32Å
351	V	54.2	Low	55	Low	48 Å²	48	58.1 Å²	58.1	29%	0.291	29%	0.29	S	S	.	.	H	α-helix	trans	-60.3	-47.9	168.6	173.5	0	0	0	0	110.1	F308 L347 I348 T353 L354 F355	F308-V351 HydrophobicContact CE2-CB 4.08Å; F308-V351 HydrophobicContact CE2-CG2 3.29Å; F308-V351 HydrophobicContact CZ-CB 4.4Å; F308-V351 HydrophobicContact CZ-CG2 3.33Å; L347-V351 HydrophobicContact CD2-CG2 4.41Å; L347-V351 WeakPolarHBondContact O-CG2 3.17Å; L347-V351 PolarHBondContact O-N 3.05Å; I348-V351 WeakPolarHBondContact O-CB 3.25Å; I348-V351 PolarHBondContact O-N 3.4Å; V351-T353 VanDerWaalsContact C-N 3.27Å; V351-T353 PolarHBondContact O-N 3.35Å; V351-L354 WeakPolarHBondContact O-CB 3.19Å; V351-L354 PolarHBondContact O-N 2.92Å; V351-F355 HydrophobicContact CG1-CD2 3.68Å; V351-F355 HydrophobicContact CG1-CE2 3.43Å; V351-F355 VanDerWaalsContact CG1-CE2 3.43Å; V351-F355 VanDerWaalsContact O-CD2 3.25Å; V351-F355 WeakPolarHBondContact O-CD2 3.15Å; V351-F355 PolarHBondContact O-N 3.21Å
352	L	59.4	Low	54.5	Low	72 Å²	72	53.8 Å²	53.8	38%	0.377	28%	0.276	S	S	.	.	H	α-helix	trans	-64.4	-30	-179.7	-70.6	169.5	0	0	0	112.4	I348 F349 L354 F355 A356 I368	I348-L352 HydrophobicContact CG2-CD1 3.81Å; I348-L352 HydrophobicContact CG2-CG 4.41Å; I348-L352 WeakPolarHBondContact O-CB 3.44Å; I348-L352 VanDerWaalsContact O-CG 3.26Å; I348-L352 WeakPolarHBondContact O-CG 3.41Å; I348-L352 PolarHBondContact O-N 3.49Å; F349-L352 HydrophobicContact CD1-CD1 4.32Å; F349-L352 CarbonylContact O-C 3.58Å; F349-L352 PolarHBondContact O-N 2.88Å; L352-L354 VanDerWaalsContact C-N 3.35Å; L352-F355 PolarHBondContact O-N 2.91Å; L352-A356 VanDerWaalsContact O-CB 3.29Å; L352-A356 WeakPolarHBondContact O-CB 3.36Å; L352-A356 PolarHBondContact O-N 3.31Å; L352-I368 HydrophobicContact CB-CD1 4.16Å; L352-I368 HydrophobicContact CB-CG2 3.69Å
353	T	55.1	Low	54.1	Low	12 Å²	12	60.2 Å²	60.2	7%	0.074	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-37.5	176.2	53.8	0	0	0	0	111.9	F349 S350 V351 Y357 I368 F369	F349-T353 WeakPolarHBondContact O-CG2 3.41Å; F349-T353 PolarHBondContact O-N 3.01Å; S350-T353 WeakPolarHBondContact CA-OG1 3.29Å; S350-T353 PolarHBondContact O-N 3.16Å; S350-T353 PolarHBondContact O-OG1 2.95Å; V351-T353 VanDerWaalsContact C-N 3.27Å; V351-T353 PolarHBondContact O-N 3.35Å; T353-Y357 WeakPolarHBondContact O-CB 3.43Å; T353-Y357 PolarHBondContact O-N 2.89Å; T353-Y357 VanDerWaalsContact O-N 3.1Å; T353-I368 VanDerWaalsContact CG2-C 3.47Å; T353-I368 HydrophobicContact CG2-CB 3.85Å; T353-I368 HydrophobicContact CG2-CG2 3.32Å; T353-F369 HydrophobicContact CG2-CB 3.92Å; T353-F369 HydrophobicContact CG2-CD2 4.47Å; T353-F369 VanDerWaalsContact CG2-N 3.35Å
354	L	51.3	Low	54.4	Low	34 Å²	34	63.8 Å²	63.8	18%	0.178	32%	0.323	C	S	.	.	H	α-helix	trans	-62.8	-44.5	174.3	-87.8	152	0	0	0	110.9	S304 T305 F308 S350 V351 L352	S304-L354 WeakPolarHBondContact OG-CD2 3.3Å; T305-L354 HydrophobicContact CG2-CD2 3.61Å; F308-L354 HydrophobicContact CB-CD1 3.59Å; F308-L354 HydrophobicContact CD1-CD1 3.83Å; F308-L354 HydrophobicContact CD2-CD1 3.67Å; F308-L354 HydrophobicContact CE1-CD1 4.43Å; F308-L354 HydrophobicContact CE2-CD1 4.32Å; F308-L354 HydrophobicContact CG-CD1 3.41Å; F308-L354 VanDerWaalsContact CG-CD1 3.41Å; S350-L354 PolarHBondContact O-N 3.32Å; V351-L354 WeakPolarHBondContact O-CB 3.19Å; V351-L354 PolarHBondContact O-N 2.92Å; L352-L354 VanDerWaalsContact C-N 3.35Å
355	F	52.6	Low	54.2	Low	109 Å²	109	62.2 Å²	62.2	48%	0.478	31%	0.314	S	S	.	.	H	α-helix	trans	-67.1	-45.9	175.8	-76.2	-66.6	0	0	0	112.5	V351 L352 Y357 E358 Y359	V351-F355 HydrophobicContact CG1-CD2 3.68Å; V351-F355 HydrophobicContact CG1-CE2 3.43Å; V351-F355 VanDerWaalsContact CG1-CE2 3.43Å; V351-F355 VanDerWaalsContact O-CD2 3.25Å; V351-F355 WeakPolarHBondContact O-CD2 3.15Å; V351-F355 PolarHBondContact O-N 3.21Å; L352-F355 PolarHBondContact O-N 2.91Å; F355-Y357 PolarHBondContact O-N 3.31Å; F355-E358 WeakPolarHBondContact O-CB 3.32Å; F355-E358 PolarHBondContact O-N 2.91Å; F355-Y359 VanDerWaalsContact O-CD2 3.32Å; F355-Y359 WeakPolarHBondContact O-CD2 3.39Å; F355-Y359 PolarHBondContact O-N 2.85Å
356	A	53.4	Low	54	Low	7 Å²	7	60.9 Å²	60.9	6%	0.058	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-31.4	-178.8	0	0	0	0	0	113.3	L352 E358 Y359 I364 F365 I368	L352-A356 VanDerWaalsContact O-CB 3.29Å; L352-A356 WeakPolarHBondContact O-CB 3.36Å; L352-A356 PolarHBondContact O-N 3.31Å; A356-E358 VanDerWaalsContact C-N 3.28Å; A356-E358 PolarHBondContact O-N 3.45Å; A356-Y359 PolarHBondContact O-N 3.32Å; A356-I364 HydrophobicContact CB-CG2 3.85Å; A356-F365 HydrophobicContact CB-CB 4.43Å; A356-I368 HydrophobicContact CB-CD1 3.83Å
357	Y	46.9	Very low	54.1	Low	26 Å²	26	66.1 Å²	66.1	10%	0.102	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-33	173.4	-175.1	-98.9	0	0	0	112.6	Q297 L300 K301 T353 F355 F365	Q297-Y357 WeakPolarHBondContact CA-OH 3.16Å; L300-Y357 WeakPolarHBondContact CB-OH 3.14Å; L300-Y357 HydrophobicContact CD2-CD2 4.28Å; L300-Y357 HydrophobicContact CD2-CE2 3.44Å; L300-Y357 VanDerWaalsContact CD2-CE2 3.44Å; K301-Y357 HydrophobicContact CG-CD1 3.86Å; K301-Y357 HydrophobicContact CG-CE1 3.72Å; T353-Y357 WeakPolarHBondContact O-CB 3.43Å; T353-Y357 PolarHBondContact O-N 2.89Å; T353-Y357 VanDerWaalsContact O-N 3.1Å; F355-Y357 PolarHBondContact O-N 3.31Å; Y357-F365 HydrophobicContact CD2-CD2 4.2Å; Y357-F365 AromaticContact CD2-CE2 3.98Å; Y357-F365 HydrophobicContact CD2-CE2 3.98Å; Y357-F365 HydrophobicContact CG-CE2 4.46Å
358	E	44.1	Very low	54.4	Low	119 Å²	119	64.3 Å²	64.3	56%	0.556	32%	0.322	S	S	*	.	H	α-helix	trans	-72.2	-29.4	176.9	-62.6	-159.4	134.6	0	0	113.2	K301 F355 A356 G360	K301-E358 IonicContact NZ-OE1 2.95Å; K301-E358 PolarHBondContact NZ-OE1 3.39Å; F355-E358 WeakPolarHBondContact O-CB 3.32Å; F355-E358 PolarHBondContact O-N 2.91Å; A356-E358 VanDerWaalsContact C-N 3.28Å; A356-E358 PolarHBondContact O-N 3.45Å; E358-G360 PolarHBondContact O-N 3.31Å
359	Y	50.2	Low	54.2	Low	190 Å²	190	61.8 Å²	61.8	75%	0.745	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.6	179.8	-78.5	-81	0	0	0	114	F355 A356 N361	F355-Y359 VanDerWaalsContact O-CD2 3.32Å; F355-Y359 WeakPolarHBondContact O-CD2 3.39Å; F355-Y359 PolarHBondContact O-N 2.85Å; A356-Y359 PolarHBondContact O-N 3.32Å; Y359-N361 PolarHBondContact O-N 2.88Å
360	G	45.5	Very low	54.3	Low	53 Å²	53	59.3 Å²	59.3	55%	0.546	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	8.7	176.8	0	0	0	0	0	114.7	E358 Q362	E358-G360 PolarHBondContact O-N 3.31Å; G360-Q362 PolarHBondContact O-N 2.92Å
361	N	54.4	Low	54.7	Low	70 Å²	70	61.6 Å²	61.6	37%	0.374	31%	0.312	S	S	.	.			trans	-92.8	96.7	-177	-159.4	-16.1	0	0	0	110.1	Y359 E363 I364 F365	Y359-N361 PolarHBondContact O-N 2.88Å; N361-E363 VanDerWaalsContact C-N 3.28Å; N361-E363 PolarHBondContact O-N 2.91Å; N361-I364 HydrophobicContact CB-CB 4.33Å; N361-I364 HydrophobicContact CB-CD1 4.09Å; N361-I364 HydrophobicContact CB-CG1 4.25Å; N361-I364 VanDerWaalsContact ND2-CD1 3.29Å; N361-I364 WeakPolarHBondContact ND2-CD1 3.18Å; N361-I364 PolarHBondContact O-N 2.98Å; N361-F365 PolarHBondContact O-N 2.75Å; N361-F365 VanDerWaalsContact O-N 3.11Å
362	Q	53.1	Low	54.9	Low	64 Å²	64	59.6 Å²	59.6	30%	0.299	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-35	-173.4	-178.5	171.9	-14.8	0	0	112.8	G360 F365 D366 V429	G360-Q362 PolarHBondContact O-N 2.92Å; Q362-F365 PolarHBondContact O-N 2.72Å; Q362-D366 VanDerWaalsContact O-CB 3.25Å; Q362-D366 WeakPolarHBondContact O-CB 3.47Å; Q362-D366 VanDerWaalsContact O-CG 3.26Å; Q362-D366 PolarHBondContact O-N 3.12Å; Q362-V429 HydrophobicContact CB-CG1 4.37Å; Q362-V429 HydrophobicContact CG-CG1 4.12Å
363	E	54	Low	54.9	Low	147 Å²	147	57.8 Å²	57.8	69%	0.687	29%	0.291	S	S	*	.	H	α-helix	trans	-66.7	-43.6	-179.7	-63.9	-175.9	170.6	0	0	111.9	N361 D366 I367	N361-E363 VanDerWaalsContact C-N 3.28Å; N361-E363 PolarHBondContact O-N 2.91Å; E363-D366 PolarHBondContact O-N 2.91Å; E363-I367 WeakPolarHBondContact O-CD1 3.26Å; E363-I367 WeakPolarHBondContact O-CG1 3.09Å; E363-I367 PolarHBondContact O-N 2.77Å
364	I	58.9	Low	55.4	Low	77 Å²	77	59.2 Å²	59.2	40%	0.395	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-43.2	178.2	-61.5	-179	0	0	0	109.9	A356 N361 I367 I368	A356-I364 HydrophobicContact CB-CG2 3.85Å; N361-I364 HydrophobicContact CB-CB 4.33Å; N361-I364 HydrophobicContact CB-CD1 4.09Å; N361-I364 HydrophobicContact CB-CG1 4.25Å; N361-I364 VanDerWaalsContact ND2-CD1 3.29Å; N361-I364 WeakPolarHBondContact ND2-CD1 3.18Å; N361-I364 PolarHBondContact O-N 2.98Å; I364-I367 PolarHBondContact O-N 2.88Å; I364-I368 HydrophobicContact CG2-CD1 3.44Å; I364-I368 VanDerWaalsContact CG2-CD1 3.44Å; I364-I368 HydrophobicContact CG2-CG1 4.28Å; I364-I368 WeakPolarHBondContact O-CB 3.32Å; I364-I368 WeakPolarHBondContact O-CD1 3.47Å; I364-I368 WeakPolarHBondContact O-CG1 3.41Å; I364-I368 PolarHBondContact O-N 2.79Å
365	F	57.1	Low	56	Low	17 Å²	17	58.7 Å²	58.7	8%	0.075	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-50.2	174.8	176.6	-93.7	0	0	0	111.9	A356 Y357 N361 Q362 I367 I368 F369 V429	A356-F365 HydrophobicContact CB-CB 4.43Å; Y357-F365 HydrophobicContact CD2-CD2 4.2Å; Y357-F365 AromaticContact CD2-CE2 3.98Å; Y357-F365 HydrophobicContact CD2-CE2 3.98Å; Y357-F365 HydrophobicContact CG-CE2 4.46Å; N361-F365 PolarHBondContact O-N 2.75Å; N361-F365 VanDerWaalsContact O-N 3.11Å; Q362-F365 PolarHBondContact O-N 2.72Å; F365-I367 VanDerWaalsContact C-N 3.33Å; F365-I367 PolarHBondContact O-N 3.37Å; F365-I368 PolarHBondContact O-N 3.37Å; F365-F369 WeakPolarHBondContact O-CB 3.34Å; F365-F369 PolarHBondContact O-N 2.83Å; F365-V429 HydrophobicContact CD1-CG1 4.45Å
366	D	57.7	Low	56.5	Low	24 Å²	24	55.7 Å²	55.7	13%	0.128	29%	0.287	C	S	.	.	H	α-helix	trans	-60.1	-40.3	-179.3	-82.1	3.6	0	0	0	111.7	Q362 E363 G370 S433 V436	Q362-D366 VanDerWaalsContact O-CB 3.25Å; Q362-D366 WeakPolarHBondContact O-CB 3.47Å; Q362-D366 VanDerWaalsContact O-CG 3.26Å; Q362-D366 PolarHBondContact O-N 3.12Å; E363-D366 PolarHBondContact O-N 2.91Å; D366-G370 PolarHBondContact O-N 3.31Å; D366-S433 PolarHBondContact OD2-OG 3.42Å; D366-V436 HydrophobicContact CB-CG2 3.46Å; D366-V436 VanDerWaalsContact CB-CG2 3.46Å; D366-V436 VanDerWaalsContact CG-CG2 3.47Å
367	I	60.7	Low	57.1	Low	111 Å²	111	55.8 Å²	55.8	57%	0.569	29%	0.286	S	S	*	.	H	α-helix	trans	-66.4	-52.5	177	-69.6	164.9	0	0	0	111.1	E363 I364 F365 F369 G370 V371	E363-I367 WeakPolarHBondContact O-CD1 3.26Å; E363-I367 WeakPolarHBondContact O-CG1 3.09Å; E363-I367 PolarHBondContact O-N 2.77Å; I364-I367 PolarHBondContact O-N 2.88Å; F365-I367 VanDerWaalsContact C-N 3.33Å; F365-I367 PolarHBondContact O-N 3.37Å; I367-F369 VanDerWaalsContact C-N 3.31Å; I367-F369 PolarHBondContact O-N 3.42Å; I367-G370 PolarHBondContact O-N 2.96Å; I367-V371 VanDerWaalsContact O-CG2 3.28Å; I367-V371 WeakPolarHBondContact O-CG2 3.24Å; I367-V371 PolarHBondContact O-N 2.73Å
368	I	59.8	Low	58.2	Low	22 Å²	22	59.4 Å²	59.4	11%	0.113	30%	0.3	C	S	.	.	H	α-helix	trans	-67.3	-36.6	-174.5	-61.8	169	0	0	0	110.3	F349 L352 T353 A356 I364 F365 V371 S372	F349-I368 HydrophobicContact CB-CG2 4.27Å; F349-I368 HydrophobicContact CD1-CG2 3.84Å; F349-I368 WeakPolarHBondContact O-CG2 3.39Å; L352-I368 HydrophobicContact CB-CD1 4.16Å; L352-I368 HydrophobicContact CB-CG2 3.69Å; T353-I368 VanDerWaalsContact CG2-C 3.47Å; T353-I368 HydrophobicContact CG2-CB 3.85Å; T353-I368 HydrophobicContact CG2-CG2 3.32Å; A356-I368 HydrophobicContact CB-CD1 3.83Å; I364-I368 HydrophobicContact CG2-CD1 3.44Å; I364-I368 VanDerWaalsContact CG2-CD1 3.44Å; I364-I368 HydrophobicContact CG2-CG1 4.28Å; I364-I368 WeakPolarHBondContact O-CB 3.32Å; I364-I368 WeakPolarHBondContact O-CD1 3.47Å; I364-I368 WeakPolarHBondContact O-CG1 3.41Å; I364-I368 PolarHBondContact O-N 2.79Å; F365-I368 PolarHBondContact O-N 3.37Å; I368-V371 PolarHBondContact O-N 3.43Å; I368-S372 PolarHBondContact O-N 3.38Å; I368-S372 VanDerWaalsContact O-N 3.11Å
369	F	59.5	Low	59.1	Low	37 Å²	37	53.9 Å²	53.9	16%	0.162	28%	0.275	C	S	.	.	H	α-helix	trans	-70.1	-40.3	174.8	-176.2	-106.3	0	0	0	112.4	T353 F365 I367 V371 S372 L373 V436 F437	T353-F369 HydrophobicContact CG2-CB 3.92Å; T353-F369 HydrophobicContact CG2-CD2 4.47Å; T353-F369 VanDerWaalsContact CG2-N 3.35Å; F365-F369 WeakPolarHBondContact O-CB 3.34Å; F365-F369 PolarHBondContact O-N 2.83Å; I367-F369 VanDerWaalsContact C-N 3.31Å; I367-F369 PolarHBondContact O-N 3.42Å; F369-V371 VanDerWaalsContact C-N 3.33Å; F369-V371 PolarHBondContact O-N 3.49Å; F369-S372 PolarHBondContact O-N 3.46Å; F369-S372 PolarHBondContact O-OG 3.16Å; F369-L373 HydrophobicContact CD1-CD1 3.73Å; F369-L373 HydrophobicContact CE1-CD1 3.32Å; F369-L373 HydrophobicContact CE1-CG 4.26Å; F369-L373 HydrophobicContact CE2-CD1 4.44Å; F369-L373 HydrophobicContact CG-CD1 4.45Å; F369-L373 HydrophobicContact CZ-CD1 3.72Å; F369-L373 HydrophobicContact CZ-CD2 4.46Å; F369-L373 HydrophobicContact CZ-CG 4.25Å; F369-L373 WeakPolarHBondContact O-CG 3.34Å; F369-L373 PolarHBondContact O-N 2.9Å; F369-L373 VanDerWaalsContact O-N 3.16Å; F369-V436 HydrophobicContact CD1-CG1 4.26Å; F369-F437 HydrophobicContact CE1-CE2 4.5Å; F369-F437 HydrophobicContact CE1-CZ 4.36Å
370	G	58.7	Low	59.7	Low	4 Å²	4	45.8 Å²	45.8	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-41	173.3	0	0	0	0	0	112.6	D366 I367 L373 C374 C440	D366-G370 PolarHBondContact O-N 3.31Å; I367-G370 PolarHBondContact O-N 2.96Å; G370-L373 PolarHBondContact O-N 2.85Å; G370-C374 PolarHBondContact O-N 3.05Å; G370-C374 PolarHBondContact O-SG 2.98Å; G370-C374 VanDerWaalsContact O-SG 3.35Å; G370-C440 WeakPolarHBondContact CA-SG 3.42Å
371	V	62.1	Low	60.9	Low	50 Å²	50	45.2 Å²	45.2	30%	0.303	23%	0.225	S	C	.	.	H	α-helix	trans	-64.5	-44.4	177.2	171.3	0	0	0	0	111.4	F349 I367 I368 F369 L373 C374 I375	F349-V371 HydrophobicContact CD1-CB 4.26Å; F349-V371 HydrophobicContact CD1-CG1 3.87Å; F349-V371 HydrophobicContact CD2-CG1 3.61Å; F349-V371 HydrophobicContact CE1-CB 4.44Å; F349-V371 HydrophobicContact CE1-CG1 3.92Å; F349-V371 HydrophobicContact CE2-CG1 3.64Å; F349-V371 HydrophobicContact CG-CB 4.43Å; F349-V371 HydrophobicContact CG-CG1 3.75Å; F349-V371 HydrophobicContact CZ-CG1 3.82Å; I367-V371 VanDerWaalsContact O-CG2 3.28Å; I367-V371 WeakPolarHBondContact O-CG2 3.24Å; I367-V371 PolarHBondContact O-N 2.73Å; I368-V371 PolarHBondContact O-N 3.43Å; F369-V371 VanDerWaalsContact C-N 3.33Å; F369-V371 PolarHBondContact O-N 3.49Å; V371-L373 VanDerWaalsContact C-N 3.34Å; V371-L373 PolarHBondContact O-N 3.47Å; V371-C374 PolarHBondContact O-N 2.93Å; V371-I375 HydrophobicContact CG1-CD1 3.61Å; V371-I375 HydrophobicContact CG1-CG1 4.36Å; V371-I375 WeakPolarHBondContact O-CD1 3.32Å; V371-I375 WeakPolarHBondContact O-CG1 3.31Å; V371-I375 PolarHBondContact O-N 2.91Å
372	S	57.9	Low	61.4	Low	7 Å²	7	41.9 Å²	41.9	5%	0.049	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-38.7	179	64.8	0	0	0	0	112.6	I368 F369 I375 L376	I368-S372 PolarHBondContact O-N 3.38Å; I368-S372 VanDerWaalsContact O-N 3.11Å; F369-S372 PolarHBondContact O-N 3.46Å; F369-S372 PolarHBondContact O-OG 3.16Å; S372-I375 PolarHBondContact O-N 3.39Å; S372-L376 PolarHBondContact O-N 3.04Å
373	L	60.6	Low	61.9	Low	34 Å²	34	39.5 Å²	39.5	18%	0.178	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-43.2	174.7	-72.6	169.3	0	0	0	112.9	F369 G370 V371 I375 L376 H377 C440	F369-L373 HydrophobicContact CD1-CD1 3.73Å; F369-L373 HydrophobicContact CE1-CD1 3.32Å; F369-L373 HydrophobicContact CE1-CG 4.26Å; F369-L373 HydrophobicContact CE2-CD1 4.44Å; F369-L373 HydrophobicContact CG-CD1 4.45Å; F369-L373 HydrophobicContact CZ-CD1 3.72Å; F369-L373 HydrophobicContact CZ-CD2 4.46Å; F369-L373 HydrophobicContact CZ-CG 4.25Å; F369-L373 WeakPolarHBondContact O-CG 3.34Å; F369-L373 PolarHBondContact O-N 2.9Å; F369-L373 VanDerWaalsContact O-N 3.16Å; G370-L373 PolarHBondContact O-N 2.85Å; V371-L373 VanDerWaalsContact C-N 3.34Å; V371-L373 PolarHBondContact O-N 3.47Å; L373-I375 VanDerWaalsContact C-N 3.31Å; L373-I375 PolarHBondContact O-N 3.25Å; L373-L376 WeakPolarHBondContact O-CB 3.44Å; L373-L376 PolarHBondContact O-N 2.72Å; L373-H377 PolarHBondContact O-N 3.25Å; L373-C440 HydrophobicContact CB-CB 4.36Å; L373-C440 HydrophobicContact CD1-CB 4.43Å
374	C	65	Low	62.5	Low	42 Å²	42	32.5 Å²	32.5	28%	0.284	16%	0.164	S	C	.	.	H	α-helix	trans	-62	-40	175.4	-72.5	0	0	0	0	111.9	G370 V371 L376 H377 Y378	G370-C374 PolarHBondContact O-N 3.05Å; G370-C374 PolarHBondContact O-SG 2.98Å; G370-C374 VanDerWaalsContact O-SG 3.35Å; V371-C374 PolarHBondContact O-N 2.93Å; C374-L376 VanDerWaalsContact C-N 3.34Å; C374-H377 PolarHBondContact O-N 3.49Å; C374-Y378 PolarHBondContact O-N 3.1Å
375	I	64.2	Low	62.8	Low	23 Å²	23	29.9 Å²	29.9	12%	0.118	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-37.8	177.2	-63.1	158.4	0	0	0	111	S342 V345 C346 F349 V371 S372 L373 Y378 S379	S342-I375 WeakPolarHBondContact O-CG2 3.39Å; V345-I375 HydrophobicContact CB-CD1 4.42Å; V345-I375 HydrophobicContact CG1-CD1 3.66Å; C346-I375 HydrophobicContact CB-CB 4.23Å; C346-I375 HydrophobicContact CB-CG2 3.66Å; F349-I375 HydrophobicContact CD2-CD1 3.77Å; F349-I375 HydrophobicContact CE2-CD1 4.35Å; V371-I375 HydrophobicContact CG1-CD1 3.61Å; V371-I375 HydrophobicContact CG1-CG1 4.36Å; V371-I375 WeakPolarHBondContact O-CD1 3.32Å; V371-I375 WeakPolarHBondContact O-CG1 3.31Å; V371-I375 PolarHBondContact O-N 2.91Å; S372-I375 PolarHBondContact O-N 3.39Å; L373-I375 VanDerWaalsContact C-N 3.31Å; L373-I375 PolarHBondContact O-N 3.25Å; I375-Y378 PolarHBondContact O-N 3.43Å; I375-S379 PolarHBondContact O-N 3.43Å; I375-S379 PolarHBondContact O-OG 3.32Å
376	L	62.4	Low	62.9	Low	46 Å²	46	29.7 Å²	29.7	24%	0.241	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-47.4	173.6	-173.8	134.5	0	0	0	111.2	S372 L373 C374 Y378 S379 E380	S372-L376 PolarHBondContact O-N 3.04Å; L373-L376 WeakPolarHBondContact O-CB 3.44Å; L373-L376 PolarHBondContact O-N 2.72Å; C374-L376 VanDerWaalsContact C-N 3.34Å; L376-Y378 VanDerWaalsContact C-N 3.28Å; L376-Y378 PolarHBondContact O-N 2.99Å; L376-S379 PolarHBondContact O-N 3.46Å; L376-S379 PolarHBondContact O-OG 2.85Å; L376-E380 HydrophobicContact CD2-CG 4.35Å; L376-E380 WeakPolarHBondContact O-CG 3.27Å; L376-E380 PolarHBondContact O-N 3.37Å
377	H	67	Low	62.8	Low	9 Å²	9	31.6 Å²	31.6	4%	0.042	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-36.9	174.8	-80.7	-50.2	0	0	0	113	L373 C374 E380 W381 C440 P444 K448	L373-H377 PolarHBondContact O-N 3.25Å; C374-H377 PolarHBondContact O-N 3.49Å; H377-E380 IonicContact CE1-OE2 2.93Å; H377-E380 IonicContact ND1-OE2 3.71Å; H377-E380 PolarHBondContact ND1-OE2 3.02Å; H377-E380 VanDerWaalsContact ND1-OE2 3.13Å; H377-W381 PolarHBondContact O-N 3.47Å; H377-W381 VanDerWaalsContact O-N 3.16Å; H377-C440 PolarHBondContact CD2-O 3.26Å; H377-P444 HydrophobicContact CB-CB 4.09Å; H377-K448 PolarHBondContact ND1-NZ 3.26Å; H377-K448 WeakPolarHBondContact O-CE 3.4Å; H377-K448 PolarHBondContact O-NZ 3.41Å
378	Y	68.6	Low	62.4	Low	101 Å²	101	28.4 Å²	28.4	40%	0.396	15%	0.147	S	C	.	.	H	α-helix	trans	-66.9	-40.2	174.5	-179	-104.5	0	0	0	112.8	H338 C374 I375 L376 W381 C382	H338-Y378 HydrophobicContact CB-CE1 4.27Å; C374-Y378 PolarHBondContact O-N 3.1Å; I375-Y378 PolarHBondContact O-N 3.43Å; L376-Y378 VanDerWaalsContact C-N 3.28Å; L376-Y378 PolarHBondContact O-N 2.99Å; Y378-W381 PolarHBondContact O-N 2.97Å; Y378-C382 VanDerWaalsContact CE1-SG 3.56Å; Y378-C382 PolarHBondContact O-N 2.92Å; Y378-C382 PolarHBondContact O-SG 3.39Å
379	S	62.8	Low	62.3	Low	4 Å²	4	28.3 Å²	28.3	3%	0.028	15%	0.147	C	C	.	.	H	α-helix	trans	-68.7	-39.7	178.3	66.9	0	0	0	0	112	Y315 I375 L376 W381 C382 L383	Y315-S379 PolarHBondContact OH-OG 3.32Å; Y315-S379 VanDerWaalsContact OH-OG 3.07Å; I375-S379 PolarHBondContact O-N 3.43Å; I375-S379 PolarHBondContact O-OG 3.32Å; L376-S379 PolarHBondContact O-N 3.46Å; L376-S379 PolarHBondContact O-OG 2.85Å; S379-W381 VanDerWaalsContact C-N 3.29Å; S379-W381 PolarHBondContact O-N 2.52Å; S379-C382 PolarHBondContact O-N 3.39Å; S379-L383 WeakPolarHBondContact O-CB 3.49Å; S379-L383 WeakPolarHBondContact O-CG 3.23Å; S379-L383 PolarHBondContact O-N 3.27Å
380	E	64.1	Low	62.3	Low	20 Å²	20	29.6 Å²	29.6	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-57.2	-41.7	170.3	-67.2	-175.6	136.7	0	0	111.7	L376 H377 L383 Y384 W393 S397 K448	L376-E380 HydrophobicContact CD2-CG 4.35Å; L376-E380 WeakPolarHBondContact O-CG 3.27Å; L376-E380 PolarHBondContact O-N 3.37Å; H377-E380 IonicContact CE1-OE2 2.93Å; H377-E380 IonicContact ND1-OE2 3.71Å; H377-E380 PolarHBondContact ND1-OE2 3.02Å; H377-E380 VanDerWaalsContact ND1-OE2 3.13Å; E380-L383 PolarHBondContact O-N 3.28Å; E380-Y384 PolarHBondContact O-N 3.16Å; E380-W393 HydrophobicContact CB-CH2 3.7Å; E380-W393 HydrophobicContact CB-CZ3 3.92Å; E380-W393 HydrophobicContact CG-CH2 3.56Å; E380-W393 HydrophobicContact CG-CZ2 4.35Å; E380-W393 HydrophobicContact CG-CZ3 4.25Å; E380-S397 PolarHBondContact OE1-OG 2.94Å; E380-K448 VanDerWaalsContact CB-NZ 3.32Å; E380-K448 IonicContact OE2-NZ 3.88Å; E380-K448 PolarHBondContact OE2-NZ 2.93Å
381	W	70.7	Confident	62.5	Low	40 Å²	40	32.8 Å²	32.8	15%	0.152	17%	0.174	C	C	.	.	H	α-helix	trans	-69.6	-37.4	176.9	-172.9	-96.1	0	0	0	112.3	H377 Y378 S379 Y384 M385 L394 K448 L451 Y473	H377-W381 PolarHBondContact O-N 3.47Å; H377-W381 VanDerWaalsContact O-N 3.16Å; Y378-W381 PolarHBondContact O-N 2.97Å; S379-W381 VanDerWaalsContact C-N 3.29Å; S379-W381 PolarHBondContact O-N 2.52Å; W381-Y384 HydrophobicContact CE3-CD1 4.41Å; W381-Y384 HydrophobicContact CH2-CD1 4.44Å; W381-Y384 HydrophobicContact CH2-CE1 4.35Å; W381-Y384 HydrophobicContact CZ3-CD1 4.37Å; W381-Y384 WeakPolarHBondContact O-CB 3.22Å; W381-Y384 PolarHBondContact O-N 2.99Å; W381-M385 WeakPolarHBondContact O-CG 3.49Å; W381-M385 PolarHBondContact O-N 3.47Å; W381-L394 HydrophobicContact CE3-CD2 4.29Å; W381-L394 HydrophobicContact CZ3-CD2 4.49Å; W381-K448 HydrophobicContact CE3-CG 4.07Å; W381-K448 HydrophobicContact CZ3-CG 4.43Å; W381-L451 HydrophobicContact CH2-CB 3.47Å; W381-L451 VanDerWaalsContact CH2-CB 3.47Å; W381-L451 HydrophobicContact CH2-CD1 3.91Å; W381-L451 HydrophobicContact CH2-CG 4.34Å; W381-L451 HydrophobicContact CZ2-CB 4.22Å; W381-L451 HydrophobicContact CZ2-CD1 4.01Å; W381-L451 HydrophobicContact CZ3-CB 4.08Å; W381-L451 HydrophobicContact CZ3-CD1 4.39Å; W381-Y473 HydrophobicContact CZ2-CD2 4.3Å; W381-Y473 HydrophobicContact CZ2-CE2 4.39Å
382	C	64.5	Low	62.2	Low	1 Å²	1	33.9 Å²	33.9	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-43	174.2	-69.6	0	0	0	0	111.2	L339 Y378 S379 Y384 M385 T386	L339-C382 HydrophobicContact CD1-CB 4.05Å; Y378-C382 VanDerWaalsContact CE1-SG 3.56Å; Y378-C382 PolarHBondContact O-N 2.92Å; Y378-C382 PolarHBondContact O-SG 3.39Å; S379-C382 PolarHBondContact O-N 3.39Å; C382-Y384 VanDerWaalsContact C-N 3.3Å; C382-Y384 PolarHBondContact O-N 3.43Å; C382-M385 PolarHBondContact O-N 2.96Å; C382-M385 VanDerWaalsContact O-N 3.16Å; C382-T386 WeakPolarHBondContact O-CG2 3.48Å; C382-T386 PolarHBondContact O-N 3.37Å; C382-T386 PolarHBondContact O-OG1 2.93Å
383	L	62.8	Low	62.3	Low	13 Å²	13	34.7 Å²	34.7	7%	0.068	19%	0.186	C	C	.	.	H	α-helix	trans	-63.5	-37.1	176.2	-73.5	166.3	0	0	0	112.5	L339 S379 E380 T386 N388 I389	L339-L383 HydrophobicContact CD1-CD2 4.21Å; L339-L383 HydrophobicContact CD1-CG 3.9Å; L339-L383 HydrophobicContact CD2-CD2 3.67Å; L339-L383 HydrophobicContact CD2-CG 4.27Å; S379-L383 WeakPolarHBondContact O-CB 3.49Å; S379-L383 WeakPolarHBondContact O-CG 3.23Å; S379-L383 PolarHBondContact O-N 3.27Å; E380-L383 PolarHBondContact O-N 3.28Å; L383-T386 WeakPolarHBondContact CA-OG1 3.47Å; L383-T386 PolarHBondContact O-N 2.97Å; L383-T386 PolarHBondContact O-OG1 3.17Å; L383-N388 PolarHBondContact O-N 3.31Å; L383-I389 HydrophobicContact CB-CD1 3.37Å; L383-I389 HydrophobicContact CB-CG1 3.94Å; L383-I389 HydrophobicContact CD1-CD1 3.87Å; L383-I389 HydrophobicContact CG-CD1 4.18Å
384	Y	66.8	Low	62.5	Low	1 Å²	1	33 Å²	33	0%	0.004	18%	0.177	C	C	.	.	H	α-helix	trans	-57.1	-61.5	166.8	175.9	-111.2	0	0	0	109.5	E380 W381 C382 T386 T387 E391 L394 L452 R470	E380-Y384 PolarHBondContact O-N 3.16Å; W381-Y384 HydrophobicContact CE3-CD1 4.41Å; W381-Y384 HydrophobicContact CH2-CD1 4.44Å; W381-Y384 HydrophobicContact CH2-CE1 4.35Å; W381-Y384 HydrophobicContact CZ3-CD1 4.37Å; W381-Y384 WeakPolarHBondContact O-CB 3.22Å; W381-Y384 PolarHBondContact O-N 2.99Å; C382-Y384 VanDerWaalsContact C-N 3.3Å; C382-Y384 PolarHBondContact O-N 3.43Å; Y384-T386 PolarHBondContact O-N 2.76Å; Y384-T387 PolarHBondContact O-N 2.63Å; Y384-E391 HydrophobicContact CE2-CG 3.58Å; Y384-E391 PolarHBondContact OH-OE1 3.47Å; Y384-L394 HydrophobicContact CD1-CD1 3.96Å; Y384-L394 HydrophobicContact CD2-CD1 3.38Å; Y384-L394 HydrophobicContact CE2-CD1 4.19Å; Y384-L394 HydrophobicContact CG-CD1 3.23Å; Y384-L452 HydrophobicContact CE1-CD2 4.35Å; Y384-L452 HydrophobicContact CE2-CD2 4.19Å; Y384-R470 HydrophobicContact CE1-CG 4.32Å; Y384-R470 PolarHBondContact O-NH1 3.46Å; Y384-R470 PolarHBondContact O-NH2 3.31Å; Y384-R470 PolarHBondContact OH-NE 3.28Å
385	M	65.2	Low	62.3	Low	22 Å²	22	33.5 Å²	33.5	11%	0.108	17%	0.173	C	C	.	.	H	α-helix	trans	-56.8	-26	-177.9	-64.4	-55.8	-78	0	0	114.5	Y335 W381 C382 T387 R470 H472	Y335-M385 HydrophobicContact CD1-CB 4.33Å; Y335-M385 HydrophobicContact CE1-CB 4.27Å; Y335-M385 HydrophobicContact CE1-CG 4.47Å; W381-M385 WeakPolarHBondContact O-CG 3.49Å; W381-M385 PolarHBondContact O-N 3.47Å; C382-M385 PolarHBondContact O-N 2.96Å; C382-M385 VanDerWaalsContact O-N 3.16Å; M385-T387 VanDerWaalsContact C-N 3.31Å; M385-T387 PolarHBondContact O-N 3.13Å; M385-R470 HydrophobicContact CE-CB 4.09Å; M385-R470 HydrophobicContact SD-CB 4.09Å; M385-H472 WeakPolarHBondContact CE-CE1 3.38Å; M385-H472 WeakPolarHBondContact CE-ND1 3.33Å
386	T	59.8	Low	61.8	Low	12 Å²	12	36.6 Å²	36.6	7%	0.074	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	20.1	174.8	64.9	0	0	0	0	114.9	W331 C382 L383 Y384 N388	W331-T386 VanDerWaalsContact CH2-O 3.3Å; W331-T386 WeakPolarHBondContact CH2-O 3.35Å; W331-T386 WeakPolarHBondContact CZ3-O 3.28Å; C382-T386 WeakPolarHBondContact O-CG2 3.48Å; C382-T386 PolarHBondContact O-N 3.37Å; C382-T386 PolarHBondContact O-OG1 2.93Å; L383-T386 WeakPolarHBondContact CA-OG1 3.47Å; L383-T386 PolarHBondContact O-N 2.97Å; L383-T386 PolarHBondContact O-OG1 3.17Å; Y384-T386 PolarHBondContact O-N 2.76Å; T386-N388 PolarHBondContact O-N 2.97Å; T386-N388 PolarHBondContact O-OD1 2.88Å
387	T	56.6	Low	61.6	Low	64 Å²	64	35 Å²	35	39%	0.393	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	18.1	178.8	91.4	0	0	0	0	117	W331 Y384 M385 I389 R470	W331-T387 HydrophobicContact CH2-CG2 4.21Å; W331-T387 WeakPolarHBondContact CH2-OG1 3.26Å; W331-T387 HydrophobicContact CZ3-CG2 4.36Å; Y384-T387 PolarHBondContact O-N 2.63Å; M385-T387 VanDerWaalsContact C-N 3.31Å; M385-T387 PolarHBondContact O-N 3.13Å; T387-I389 VanDerWaalsContact C-N 3.29Å; T387-R470 VanDerWaalsContact CG2-NH1 3.29Å; T387-R470 VanDerWaalsContact N-NH1 3.12Å
388	N	52.1	Low	61.4	Low	44 Å²	44	34.5 Å²	34.5	24%	0.235	18%	0.181	C	C	.	.	S	Bend	trans	-82.5	-12.8	176.5	-72.4	-21.4	0	0	0	112.2	L265 I325 L383 T386	L265-N388 HydrophobicContact CD2-CB 4.22Å; I325-N388 VanDerWaalsContact CD1-ND2 3.33Å; I325-N388 WeakPolarHBondContact CD1-ND2 3.41Å; L383-N388 PolarHBondContact O-N 3.31Å; T386-N388 PolarHBondContact O-N 2.97Å; T386-N388 PolarHBondContact O-OD1 2.88Å
389	I	56.5	Low	60.8	Low	21 Å²	21	33.9 Å²	33.9	11%	0.108	18%	0.183	C	C	.	.	S	Bend	trans	-135.5	142.9	-177.3	-49	-179.9	0	0	0	111.8	L383 T387 W393 R470	L383-I389 HydrophobicContact CB-CD1 3.37Å; L383-I389 HydrophobicContact CB-CG1 3.94Å; L383-I389 HydrophobicContact CD1-CD1 3.87Å; L383-I389 HydrophobicContact CG-CD1 4.18Å; T387-I389 VanDerWaalsContact C-N 3.29Å; I389-W393 HydrophobicContact CB-CE3 4.05Å; I389-W393 HydrophobicContact CB-CZ3 4.3Å; I389-W393 HydrophobicContact CD1-CD2 4.31Å; I389-W393 HydrophobicContact CD1-CE3 3.85Å; I389-W393 HydrophobicContact CD1-CH2 3.34Å; I389-W393 HydrophobicContact CD1-CZ2 3.96Å; I389-W393 HydrophobicContact CD1-CZ3 3.32Å; I389-W393 HydrophobicContact CG1-CE3 4.5Å; I389-W393 HydrophobicContact CG1-CZ3 4.37Å; I389-W393 HydrophobicContact CG2-CB 3.5Å; I389-W393 HydrophobicContact CG2-CD2 3.28Å; I389-W393 HydrophobicContact CG2-CE3 3.1Å; I389-W393 HydrophobicContact CG2-CG 3.51Å; I389-W393 HydrophobicContact CG2-CZ3 3.78Å; I389-R470 PolarHBondContact O-NH2 3.47Å
390	S	59.3	Low	60.4	Low	63 Å²	63	35.5 Å²	35.5	44%	0.441	19%	0.191	S	C	.	.			trans	-78.2	156.5	177.4	65.9	0	0	0	0	113	S392 W393	S390-S392 VanDerWaalsContact C-N 3.3Å; S390-S392 PolarHBondContact O-N 3.16Å; S390-S392 PolarHBondContact OG-OG 3.43Å; S390-W393 WeakPolarHBondContact O-CB 3.39Å; S390-W393 PolarHBondContact O-N 3.06Å
391	E	62.9	Low	59.8	Low	71 Å²	71	35.4 Å²	35.4	33%	0.332	19%	0.192	S	C	.	.	H	α-helix	trans	-59.6	-40.6	174.2	-70.7	171.5	-177.3	0	0	112.2	Y384 W393 L394 Y395 L452	Y384-E391 HydrophobicContact CE2-CG 3.58Å; Y384-E391 PolarHBondContact OH-OE1 3.47Å; E391-W393 PolarHBondContact O-N 3.25Å; E391-W393 VanDerWaalsContact O-N 3.16Å; E391-L394 WeakPolarHBondContact O-CB 3.42Å; E391-L394 PolarHBondContact O-N 3.44Å; E391-Y395 WeakPolarHBondContact O-CD2 3.47Å; E391-Y395 PolarHBondContact O-N 3.47Å; E391-L452 HydrophobicContact CG-CD2 4.47Å
392	S	56.8	Low	59	Low	73 Å²	73	35 Å²	35	51%	0.51	19%	0.194	S	C	.	.	H	α-helix	trans	-56.1	-32.9	177.6	66.4	0	0	0	0	113.2	S390 N396	S390-S392 VanDerWaalsContact C-N 3.3Å; S390-S392 PolarHBondContact O-N 3.16Å; S390-S392 PolarHBondContact OG-OG 3.43Å; S392-N396 VanDerWaalsContact O-CG 3.27Å; S392-N396 PolarHBondContact O-N 2.89Å; S392-N396 VanDerWaalsContact O-N 3.17Å; S392-N396 PolarHBondContact O-ND2 3.43Å
393	W	60.3	Low	58.3	Low	24 Å²	24	38.8 Å²	38.8	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-41.4	175.6	171.9	69.3	0	0	0	112.1	P269 E380 I389 S390 E391 N396 S397	P269-W393 HydrophobicContact CB-CG 4.12Å; P269-W393 HydrophobicContact CG-CG 4.3Å; E380-W393 HydrophobicContact CB-CH2 3.7Å; E380-W393 HydrophobicContact CB-CZ3 3.92Å; E380-W393 HydrophobicContact CG-CH2 3.56Å; E380-W393 HydrophobicContact CG-CZ2 4.35Å; E380-W393 HydrophobicContact CG-CZ3 4.25Å; I389-W393 HydrophobicContact CB-CE3 4.05Å; I389-W393 HydrophobicContact CB-CZ3 4.3Å; I389-W393 HydrophobicContact CD1-CD2 4.31Å; I389-W393 HydrophobicContact CD1-CE3 3.85Å; I389-W393 HydrophobicContact CD1-CH2 3.34Å; I389-W393 HydrophobicContact CD1-CZ2 3.96Å; I389-W393 HydrophobicContact CD1-CZ3 3.32Å; I389-W393 HydrophobicContact CG1-CE3 4.5Å; I389-W393 HydrophobicContact CG1-CZ3 4.37Å; I389-W393 HydrophobicContact CG2-CB 3.5Å; I389-W393 HydrophobicContact CG2-CD2 3.28Å; I389-W393 HydrophobicContact CG2-CE3 3.1Å; I389-W393 HydrophobicContact CG2-CG 3.51Å; I389-W393 HydrophobicContact CG2-CZ3 3.78Å; S390-W393 WeakPolarHBondContact O-CB 3.39Å; S390-W393 PolarHBondContact O-N 3.06Å; E391-W393 PolarHBondContact O-N 3.25Å; E391-W393 VanDerWaalsContact O-N 3.16Å; W393-N396 PolarHBondContact O-N 3.47Å; W393-S397 PolarHBondContact O-N 2.88Å
394	L	63.6	Low	57.7	Low	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.2	-39.4	-177.6	-126.9	153.4	0	0	0	110.5	W381 Y384 E391 C398 K448 L452	W381-L394 HydrophobicContact CE3-CD2 4.29Å; W381-L394 HydrophobicContact CZ3-CD2 4.49Å; Y384-L394 HydrophobicContact CD1-CD1 3.96Å; Y384-L394 HydrophobicContact CD2-CD1 3.38Å; Y384-L394 HydrophobicContact CE2-CD1 4.19Å; Y384-L394 HydrophobicContact CG-CD1 3.23Å; E391-L394 WeakPolarHBondContact O-CB 3.42Å; E391-L394 PolarHBondContact O-N 3.44Å; L394-C398 WeakPolarHBondContact O-CB 3.14Å; L394-C398 PolarHBondContact O-N 3.4Å; L394-C398 PolarHBondContact O-SG 3.26Å; L394-K448 HydrophobicContact CD2-CB 4.05Å; L394-K448 HydrophobicContact CD2-CD 3.88Å; L394-K448 HydrophobicContact CD2-CG 4.16Å; L394-L452 HydrophobicContact CB-CD1 3.75Å; L394-L452 HydrophobicContact CB-CD2 4.19Å; L394-L452 HydrophobicContact CD1-CD2 4.33Å; L394-L452 HydrophobicContact CD2-CD1 3.88Å; L394-L452 HydrophobicContact CD2-CG 4.46Å; L394-L452 HydrophobicContact CG-CD1 4.32Å
395	Y	61.6	Low	57.1	Low	51 Å²	51	39.3 Å²	39.3	20%	0.2	22%	0.222	C	C	.	.	H	α-helix	trans	-57.3	-49.8	168.3	-81.8	-68.3	0	0	0	112	E391 C398 I399 L449 L452 E456	E391-Y395 WeakPolarHBondContact O-CD2 3.47Å; E391-Y395 PolarHBondContact O-N 3.47Å; Y395-C398 PolarHBondContact O-N 2.93Å; Y395-I399 VanDerWaalsContact O-CG1 3.28Å; Y395-I399 WeakPolarHBondContact O-CG1 3.42Å; Y395-I399 PolarHBondContact O-N 3.29Å; Y395-L449 HydrophobicContact CD1-CD2 3.48Å; Y395-L449 VanDerWaalsContact CD1-CD2 3.48Å; Y395-L449 HydrophobicContact CE1-CD2 3.91Å; Y395-L452 HydrophobicContact CD1-CD1 4.35Å; Y395-L452 HydrophobicContact CD2-CD1 4.4Å; Y395-L452 HydrophobicContact CE1-CB 4.26Å; Y395-L452 HydrophobicContact CE1-CD1 4.42Å; Y395-L452 HydrophobicContact CE2-CB 4.33Å; Y395-L452 HydrophobicContact CG-CD1 4.32Å; Y395-E456 PolarHBondContact OH-OE2 3.2Å
396	N	53.6	Low	56.4	Low	89 Å²	89	43.2 Å²	43.2	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-45.9	179.6	-74.4	-21.4	0	0	0	112.4	S392 W393 C398 I399 I400	S392-N396 VanDerWaalsContact O-CG 3.27Å; S392-N396 PolarHBondContact O-N 2.89Å; S392-N396 VanDerWaalsContact O-N 3.17Å; S392-N396 PolarHBondContact O-ND2 3.43Å; W393-N396 PolarHBondContact O-N 3.47Å; N396-C398 VanDerWaalsContact C-N 3.3Å; N396-C398 PolarHBondContact O-N 3.39Å; N396-I399 PolarHBondContact O-N 3.19Å; N396-I400 WeakPolarHBondContact O-CB 3.34Å; N396-I400 VanDerWaalsContact O-CD1 3.28Å; N396-I400 WeakPolarHBondContact O-CD1 3.38Å; N396-I400 VanDerWaalsContact O-CG1 3.26Å; N396-I400 WeakPolarHBondContact O-CG1 3.41Å; N396-I400 PolarHBondContact O-N 3.4Å
397	S	57.6	Low	55.9	Low	11 Å²	11	46.2 Å²	46.2	8%	0.077	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-43.7	176.2	179.7	0	0	0	0	111.1	E380 W393 T401	E380-S397 PolarHBondContact OE1-OG 2.94Å; W393-S397 PolarHBondContact O-N 2.88Å; S397-T401 WeakPolarHBondContact O-CB 3.19Å; S397-T401 VanDerWaalsContact O-CG2 3.31Å; S397-T401 WeakPolarHBondContact O-CG2 3.14Å; S397-T401 PolarHBondContact O-N 3Å; S397-T401 PolarHBondContact O-OG1 3.01Å
398	C	62.3	Low	55.4	Low	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.1	-42.2	177.8	-62.8	0	0	0	0	113.1	L394 Y395 N396 I400 T401 V402 A445 K448 L449	L394-C398 WeakPolarHBondContact O-CB 3.14Å; L394-C398 PolarHBondContact O-N 3.4Å; L394-C398 PolarHBondContact O-SG 3.26Å; Y395-C398 PolarHBondContact O-N 2.93Å; N396-C398 VanDerWaalsContact C-N 3.3Å; N396-C398 PolarHBondContact O-N 3.39Å; C398-I400 PolarHBondContact O-N 3.49Å; C398-T401 VanDerWaalsContact CA-OG1 3.29Å; C398-T401 WeakPolarHBondContact CA-OG1 3.19Å; C398-T401 PolarHBondContact O-N 3.16Å; C398-T401 PolarHBondContact O-OG1 3.32Å; C398-V402 WeakPolarHBondContact O-CB 3.33Å; C398-V402 VanDerWaalsContact O-CG2 3.23Å; C398-V402 WeakPolarHBondContact O-CG2 3.49Å; C398-V402 PolarHBondContact O-N 2.88Å; C398-A445 HydrophobicContact CB-CB 4.32Å; C398-K448 WeakPolarHBondContact SG-CB 3.5Å; C398-L449 HydrophobicContact CB-CD1 3.67Å; C398-L449 HydrophobicContact CB-CD2 3.79Å; C398-L449 HydrophobicContact CB-CG 3.43Å; C398-L449 VanDerWaalsContact CB-CG 3.43Å
399	I	57.8	Low	55.2	Low	87 Å²	87	43.3 Å²	43.3	45%	0.446	25%	0.246	S	C	.	.	H	α-helix	trans	-63.5	-44.2	177.8	-69	165.5	0	0	0	110.4	Y395 N396 T401 V402 V403	Y395-I399 VanDerWaalsContact O-CG1 3.28Å; Y395-I399 WeakPolarHBondContact O-CG1 3.42Å; Y395-I399 PolarHBondContact O-N 3.29Å; N396-I399 PolarHBondContact O-N 3.19Å; I399-T401 PolarHBondContact O-N 2.91Å; I399-V402 PolarHBondContact O-N 2.87Å; I399-V403 HydrophobicContact CG2-CG2 4.22Å; I399-V403 WeakPolarHBondContact O-CB 3.44Å; I399-V403 VanDerWaalsContact O-CG2 3.25Å; I399-V403 WeakPolarHBondContact O-CG2 3.42Å; I399-V403 PolarHBondContact O-N 3Å
400	I	52.5	Low	54.6	Low	39 Å²	39	45.4 Å²	45.4	20%	0.2	27%	0.266	C	S	.	.	H	α-helix	trans	-66.5	-39.9	-179.7	-69.6	158.2	0	0	0	111.3	V273 L276 V277 N396 C398 V403 S404	V273-I400 HydrophobicContact CB-CD1 4.01Å; V273-I400 HydrophobicContact CG1-CD1 3.21Å; V273-I400 HydrophobicContact CG1-CG1 4.5Å; V273-I400 HydrophobicContact CG2-CD1 3.66Å; L276-I400 HydrophobicContact CD2-CG2 4.01Å; V277-I400 HydrophobicContact CG2-CG2 4.45Å; N396-I400 WeakPolarHBondContact O-CB 3.34Å; N396-I400 VanDerWaalsContact O-CD1 3.28Å; N396-I400 WeakPolarHBondContact O-CD1 3.38Å; N396-I400 VanDerWaalsContact O-CG1 3.26Å; N396-I400 WeakPolarHBondContact O-CG1 3.41Å; N396-I400 PolarHBondContact O-N 3.4Å; C398-I400 PolarHBondContact O-N 3.49Å; I400-V403 PolarHBondContact O-N 3.35Å; I400-S404 VanDerWaalsContact O-CB 3.25Å; I400-S404 WeakPolarHBondContact O-CB 3.48Å; I400-S404 PolarHBondContact O-N 3.29Å; I400-S404 PolarHBondContact O-OG 3.43Å
401	T	52.4	Low	53.8	Low	17 Å²	17	47 Å²	47	10%	0.104	26%	0.263	C	S	.	.	H	α-helix	trans	-66.1	-40.6	175	47.5	0	0	0	0	111.7	S397 C398 I399 S404 V405 A445	S397-T401 WeakPolarHBondContact O-CB 3.19Å; S397-T401 VanDerWaalsContact O-CG2 3.31Å; S397-T401 WeakPolarHBondContact O-CG2 3.14Å; S397-T401 PolarHBondContact O-N 3Å; S397-T401 PolarHBondContact O-OG1 3.01Å; C398-T401 VanDerWaalsContact CA-OG1 3.29Å; C398-T401 WeakPolarHBondContact CA-OG1 3.19Å; C398-T401 PolarHBondContact O-N 3.16Å; C398-T401 PolarHBondContact O-OG1 3.32Å; I399-T401 PolarHBondContact O-N 2.91Å; T401-S404 WeakPolarHBondContact CA-OG 3.29Å; T401-S404 PolarHBondContact O-OG 2.87Å; T401-V405 WeakPolarHBondContact O-CB 3.45Å; T401-V405 WeakPolarHBondContact O-CG2 3.28Å; T401-V405 PolarHBondContact O-N 3.41Å; T401-A445 WeakPolarHBondContact OG1-CB 3.33Å
402	V	54.3	Low	52.9	Low	32 Å²	32	46 Å²	46	19%	0.194	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-47.9	173.5	172.7	0	0	0	0	111.6	C398 I399 S404 V405 L406 L442 A445 V446	C398-V402 WeakPolarHBondContact O-CB 3.33Å; C398-V402 VanDerWaalsContact O-CG2 3.23Å; C398-V402 WeakPolarHBondContact O-CG2 3.49Å; C398-V402 PolarHBondContact O-N 2.88Å; I399-V402 PolarHBondContact O-N 2.87Å; V402-S404 PolarHBondContact O-N 3.11Å; V402-V405 PolarHBondContact O-N 2.9Å; V402-L406 HydrophobicContact CG1-CD1 3.95Å; V402-L406 HydrophobicContact CG1-CG 4.45Å; V402-L406 WeakPolarHBondContact O-CG 3.45Å; V402-L406 PolarHBondContact O-N 3.11Å; V402-L442 HydrophobicContact CG1-CD1 4.38Å; V402-L442 HydrophobicContact CG2-CD1 4.15Å; V402-A445 HydrophobicContact CG2-CB 4.17Å; V402-V446 HydrophobicContact CG2-CG2 4.48Å
403	V	50.1	Low	52	Low	81 Å²	81	47.5 Å²	47.5	49%	0.491	27%	0.265	S	S	.	.	H	α-helix	trans	-63.4	-41.7	179.7	170.6	0	0	0	0	111.1	I399 I400 L406 L407	I399-V403 HydrophobicContact CG2-CG2 4.22Å; I399-V403 WeakPolarHBondContact O-CB 3.44Å; I399-V403 VanDerWaalsContact O-CG2 3.25Å; I399-V403 WeakPolarHBondContact O-CG2 3.42Å; I399-V403 PolarHBondContact O-N 3Å; I400-V403 PolarHBondContact O-N 3.35Å; V403-L406 PolarHBondContact O-N 2.99Å; V403-L407 WeakPolarHBondContact O-CB 3.33Å; V403-L407 PolarHBondContact O-N 2.78Å
404	S	49.4	Very low	50.8	Low	24 Å²	24	54.8 Å²	54.8	17%	0.168	29%	0.292	C	S	.	.	H	α-helix	trans	-65.9	-38.9	177.1	57.3	0	0	0	0	112.7	I280 I400 T401 V402 L407 A408	I280-S404 VanDerWaalsContact CD1-CB 3.5Å; I400-S404 VanDerWaalsContact O-CB 3.25Å; I400-S404 WeakPolarHBondContact O-CB 3.48Å; I400-S404 PolarHBondContact O-N 3.29Å; I400-S404 PolarHBondContact O-OG 3.43Å; T401-S404 WeakPolarHBondContact CA-OG 3.29Å; T401-S404 PolarHBondContact O-OG 2.87Å; V402-S404 PolarHBondContact O-N 3.11Å; S404-L407 PolarHBondContact O-N 3.15Å; S404-A408 WeakPolarHBondContact O-CB 3.37Å; S404-A408 PolarHBondContact O-N 3.42Å
405	V	53.5	Low	49.3	Very low	1 Å²	1	62 Å²	62	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-44.1	173.2	170.2	0	0	0	0	111.2	T401 V402 A408 A409 W434 F437 C441 L442	T401-V405 WeakPolarHBondContact O-CB 3.45Å; T401-V405 WeakPolarHBondContact O-CG2 3.28Å; T401-V405 PolarHBondContact O-N 3.41Å; V402-V405 PolarHBondContact O-N 2.9Å; V405-A408 PolarHBondContact O-N 3.48Å; V405-A409 WeakPolarHBondContact O-CB 3.35Å; V405-A409 PolarHBondContact O-N 3.37Å; V405-W434 HydrophobicContact CG1-CE3 4.41Å; V405-W434 HydrophobicContact CG1-CH2 3.95Å; V405-W434 HydrophobicContact CG1-CZ3 3.46Å; V405-W434 VanDerWaalsContact CG1-CZ3 3.46Å; V405-F437 HydrophobicContact CG2-CB 4.49Å; V405-F437 HydrophobicContact CG2-CD1 4.03Å; V405-C441 HydrophobicContact CG2-CB 3.92Å; V405-L442 HydrophobicContact CG1-CB 4.3Å; V405-L442 HydrophobicContact CG1-CD1 4.24Å
406	L	51.8	Low	47.9	Very low	103 Å²	103	65.4 Å²	65.4	54%	0.539	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-40	176	-72.2	171.7	0	0	0	112	V402 V403 A409 A410	V402-L406 HydrophobicContact CG1-CD1 3.95Å; V402-L406 HydrophobicContact CG1-CG 4.45Å; V402-L406 WeakPolarHBondContact O-CG 3.45Å; V402-L406 PolarHBondContact O-N 3.11Å; V403-L406 PolarHBondContact O-N 2.99Å; L406-A409 PolarHBondContact O-N 3.29Å; L406-A410 WeakPolarHBondContact O-CB 3.19Å; L406-A410 PolarHBondContact O-N 3.35Å
407	L	48.5	Very low	46.6	Very low	76 Å²	76	68.4 Å²	68.4	40%	0.398	36%	0.355	S	S	.	.	H	α-helix	trans	-61.7	-49	174.4	-157.6	93.4	0	0	0	110	I280 V403 S404 A409 A410 Y411	I280-L407 HydrophobicContact CG2-CD2 4.17Å; V403-L407 WeakPolarHBondContact O-CB 3.33Å; V403-L407 PolarHBondContact O-N 2.78Å; S404-L407 PolarHBondContact O-N 3.15Å; L407-A409 VanDerWaalsContact C-N 3.32Å; L407-A409 PolarHBondContact O-N 3.33Å; L407-A410 PolarHBondContact O-N 3.44Å; L407-Y411 HydrophobicContact CD1-CE2 4.49Å; L407-Y411 HydrophobicContact CD2-CD2 4.37Å; L407-Y411 HydrophobicContact CD2-CE2 4.02Å; L407-Y411 HydrophobicContact CG-CD2 4.06Å; L407-Y411 HydrophobicContact CG-CE2 3.88Å; L407-Y411 WeakPolarHBondContact O-CD2 3.43Å; L407-Y411 PolarHBondContact O-N 3.38Å
408	A	45.9	Very low	45.4	Very low	30 Å²	30	75 Å²	75	25%	0.248	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-39.4	176.8	0	0	0	0	0	112.5	S404 V405 Y411 T412	S404-A408 WeakPolarHBondContact O-CB 3.37Å; S404-A408 PolarHBondContact O-N 3.42Å; V405-A408 PolarHBondContact O-N 3.48Å; A408-Y411 PolarHBondContact O-N 2.83Å; A408-T412 WeakPolarHBondContact O-CG2 3.29Å; A408-T412 PolarHBondContact O-N 2.85Å; A408-T412 PolarHBondContact O-OG1 2.88Å; A408-T412 VanDerWaalsContact O-OG1 3.09Å
409	A	47.7	Very low	44.1	Very low	17 Å²	17	80 Å²	80	14%	0.14	41%	0.414	C	S	.	.	H	α-helix	trans	-63.1	-45.2	174	0	0	0	0	0	112.5	V405 L406 L407 Y411 T412 N413 W434	V405-A409 WeakPolarHBondContact O-CB 3.35Å; V405-A409 PolarHBondContact O-N 3.37Å; L406-A409 PolarHBondContact O-N 3.29Å; L407-A409 VanDerWaalsContact C-N 3.32Å; L407-A409 PolarHBondContact O-N 3.33Å; A409-Y411 VanDerWaalsContact C-N 3.28Å; A409-Y411 PolarHBondContact O-N 3.21Å; A409-T412 WeakPolarHBondContact CA-OG1 3.33Å; A409-T412 PolarHBondContact O-N 3.49Å; A409-T412 PolarHBondContact O-OG1 2.93Å; A409-N413 PolarHBondContact O-N 3.46Å; A409-N413 VanDerWaalsContact O-N 3.12Å; A409-W434 HydrophobicContact CB-CE3 3.89Å; A409-W434 HydrophobicContact CB-CH2 4.2Å; A409-W434 HydrophobicContact CB-CZ3 3.5Å
410	A	44.6	Very low	42.8	Very low	64 Å²	64	83.2 Å²	83.2	53%	0.529	43%	0.432	S	S	.	.	H	α-helix	trans	-61.7	-37.4	177	0	0	0	0	0	111.9	L406 L407 R414	L406-A410 WeakPolarHBondContact O-CB 3.19Å; L406-A410 PolarHBondContact O-N 3.35Å; L407-A410 PolarHBondContact O-N 3.44Å; A410-R414 PolarHBondContact O-N 3.3Å
411	Y	42.9	Very low	41.7	Very low	96 Å²	96	86.3 Å²	86.3	38%	0.376	46%	0.457	S	S	.	.	H	α-helix	trans	-73.7	-37.5	177.1	-85.7	-77.1	0	0	0	113.5	V284 L407 A408 A409 R414	V284-Y411 HydrophobicContact CG1-CE2 4.49Å; L407-Y411 HydrophobicContact CD1-CE2 4.49Å; L407-Y411 HydrophobicContact CD2-CD2 4.37Å; L407-Y411 HydrophobicContact CD2-CE2 4.02Å; L407-Y411 HydrophobicContact CG-CD2 4.06Å; L407-Y411 HydrophobicContact CG-CE2 3.88Å; L407-Y411 WeakPolarHBondContact O-CD2 3.43Å; L407-Y411 PolarHBondContact O-N 3.38Å; A408-Y411 PolarHBondContact O-N 2.83Å; A409-Y411 VanDerWaalsContact C-N 3.28Å; A409-Y411 PolarHBondContact O-N 3.21Å; Y411-R414 PolarHBondContact O-N 3.24Å
412	T	44.8	Very low	40.7	Very low	51 Å²	51	90.2 Å²	90.2	31%	0.313	48%	0.48	S	S	.	.	H	α-helix	trans	-67.6	-39.3	177.6	49.6	0	0	0	0	112.5	A408 A409 R414 R415 L416	A408-T412 WeakPolarHBondContact O-CG2 3.29Å; A408-T412 PolarHBondContact O-N 2.85Å; A408-T412 PolarHBondContact O-OG1 2.88Å; A408-T412 VanDerWaalsContact O-OG1 3.09Å; A409-T412 WeakPolarHBondContact CA-OG1 3.33Å; A409-T412 PolarHBondContact O-N 3.49Å; A409-T412 PolarHBondContact O-OG1 2.93Å; T412-R414 VanDerWaalsContact C-N 3.28Å; T412-R414 PolarHBondContact O-N 3.37Å; T412-R415 PolarHBondContact O-N 2.91Å; T412-R415 VanDerWaalsContact O-N 3.15Å; T412-L416 PolarHBondContact O-N 3.3Å
413	N	37.3	Very low	39.3	Very low	105 Å²	105	96.8 Å²	96.8	56%	0.561	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-30.8	174.5	-87.3	-20.9	0	0	0	113.2	A409 R415 L416 L417	A409-N413 PolarHBondContact O-N 3.46Å; A409-N413 VanDerWaalsContact O-N 3.12Å; N413-R415 VanDerWaalsContact C-N 3.34Å; N413-R415 PolarHBondContact O-N 3.45Å; N413-L416 PolarHBondContact O-N 2.82Å; N413-L417 PolarHBondContact O-N 3.35Å
414	R	34.4	Very low	38.2	Very low	177 Å²	177	100.1 Å²	100.1	67%	0.668	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-32.2	173.9	-99.7	-176.8	173	173.6	0.2	113.4	A410 Y411 T412 M418	A410-R414 PolarHBondContact O-N 3.3Å; Y411-R414 PolarHBondContact O-N 3.24Å; T412-R414 VanDerWaalsContact C-N 3.28Å; T412-R414 PolarHBondContact O-N 3.37Å; R414-M418 PolarHBondContact O-N 2.98Å
415	R	32.6	Very low	37.2	Very low	152 Å²	152	110.7 Å²	110.7	57%	0.574	57%	0.565	S	S	*	*	H	α-helix	trans	-72.2	-34.3	177.5	-91.2	-176.2	173.5	176.7	-0.6	112.9	T412 N413 L417 M418 N419	T412-R415 PolarHBondContact O-N 2.91Å; T412-R415 VanDerWaalsContact O-N 3.15Å; N413-R415 VanDerWaalsContact C-N 3.34Å; N413-R415 PolarHBondContact O-N 3.45Å; R415-L417 VanDerWaalsContact C-N 3.33Å; R415-M418 PolarHBondContact O-N 2.97Å; R415-N419 VanDerWaalsContact O-CB 3.29Å; R415-N419 WeakPolarHBondContact O-CB 3.39Å; R415-N419 PolarHBondContact O-N 2.98Å
416	L	31.1	Very low	36.1	Very low	121 Å²	121	114.3 Å²	114.3	63%	0.634	59%	0.59	S	S	*	*	H	α-helix	trans	-67.3	-33	177.3	-94.1	149.9	0	0	0	112.7	T412 N413	T412-L416 PolarHBondContact O-N 3.3Å; N413-L416 PolarHBondContact O-N 2.82Å
417	L	28.3	Very low	35.2	Very low	152 Å²	152	115.4 Å²	115.4	80%	0.796	61%	0.607	S	S	*	*	H	α-helix	trans	-74.4	-27.1	174.7	-99	132.9	0	0	0	113.8	N413 R415	N413-L417 PolarHBondContact O-N 3.35Å; R415-L417 VanDerWaalsContact C-N 3.33Å
418	M	31.5	Very low	34.6	Very low	151 Å²	151	116.2 Å²	116.2	74%	0.744	61%	0.611	S	S	*	*	H	α-helix	trans	-93.5	-23.5	178.5	-76	-147.9	159	0	0	114.6	R414 R415 N420 S421	R414-M418 PolarHBondContact O-N 2.98Å; R415-M418 PolarHBondContact O-N 2.97Å; M418-N420 PolarHBondContact O-N 2.98Å; M418-S421 PolarHBondContact O-OG 3.19Å
419	N	35	Very low	34.2	Very low	105 Å²	105	116.2 Å²	116.2	56%	0.561	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-84.3	-2.7	-176.3	-83.3	2	0	0	0	115.2	R415 S421	R415-N419 VanDerWaalsContact O-CB 3.29Å; R415-N419 WeakPolarHBondContact O-CB 3.39Å; R415-N419 PolarHBondContact O-N 2.98Å; N419-S421 PolarHBondContact O-N 3.36Å
420	N	30	Very low	34.2	Very low	154 Å²	154	122.7 Å²	122.7	82%	0.824	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-70.5	-4	173.1	-79.2	-10.4	0	0	0	113.5	M418	M418-N420 PolarHBondContact O-N 2.98Å
421	S	30.9	Very low	34.3	Very low	103 Å²	103	121.7 Å²	121.7	72%	0.72	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-110.6	-2.9	178.9	61	0	0	0	0	115.7	M418 N419	M418-S421 PolarHBondContact O-OG 3.19Å; N419-S421 PolarHBondContact O-N 3.36Å
422	V	29.5	Very low	34.7	Very low	99 Å²	99	120.9 Å²	120.9	60%	0.6	62%	0.616	S	S	*	*			trans	-140.7	89.8	-179.2	-171.5	0	0	0	0	110.7	N424	V422-N424 PolarHBondContact O-N 3.1Å; V422-N424 VanDerWaalsContact O-N 3.14Å
423	L	25.4	Very low	35.1	Very low	171 Å²	171	119 Å²	119	90%	0.895	61%	0.605	S	S	*	*			trans	-59.9	107.1	156.5	-101.5	96.5	0	0	0	107.8
424	N	27.4	Very low	36.1	Very low	151 Å²	151	119.1 Å²	119.1	81%	0.807	60%	0.598	S	S	*	*			trans	-151	121.5	145.4	-113.6	-19.3	0	0	0	112.9	V422 S426	V422-N424 PolarHBondContact O-N 3.1Å; V422-N424 VanDerWaalsContact O-N 3.14Å; N424-S426 PolarHBondContact O-N 3.24Å
425	R	28.4	Very low	37.4	Very low	246 Å²	246	114.8 Å²	114.8	93%	0.928	59%	0.585	S	S	*	*			trans	-67.5	104.6	-179.7	-69	169.2	169.8	170.3	-4.9	109.9
426	S	30.7	Very low	38.7	Very low	77 Å²	77	108 Å²	108	54%	0.538	56%	0.561	S	S	.	*			trans	-148.1	123	150.9	56	0	0	0	0	109	N424 L428	N424-S426 PolarHBondContact O-N 3.24Å; S426-L428 PolarHBondContact O-N 3.34Å
427	S	33.2	Very low	40.2	Very low	126 Å²	126	103.8 Å²	103.8	88%	0.881	54%	0.537	S	S	*	.			trans	-68.8	83.2	-169.9	49.7	0	0	0	0	111.9
428	L	35.7	Very low	41.9	Very low	93 Å²	93	96.6 Å²	96.6	49%	0.487	50%	0.5	S	S	.	.			trans	-82.6	119.1	166	-88.1	150.6	0	0	0	108.9	T293 S426 K430	T293-L428 HydrophobicContact CG2-CD1 4.46Å; S426-L428 PolarHBondContact O-N 3.34Å; L428-K430 PolarHBondContact O-N 2.87Å; L428-K430 VanDerWaalsContact O-N 3.08Å
429	V	37.4	Very low	43.7	Very low	29 Å²	29	90.5 Å²	90.5	18%	0.176	47%	0.471	C	S	.	.			trans	-49.7	115.9	167.6	177.5	0	0	0	0	107.7	Q362 F365 I431	Q362-V429 HydrophobicContact CB-CG1 4.37Å; Q362-V429 HydrophobicContact CG-CG1 4.12Å; F365-V429 HydrophobicContact CD1-CG1 4.45Å; V429-I431 VanDerWaalsContact C-N 3.35Å; V429-I431 PolarHBondContact O-N 2.86Å
430	K	46.7	Very low	45.3	Very low	153 Å²	153	86.3 Å²	86.3	67%	0.665	45%	0.45	S	S	*	.			trans	-77.2	89.7	177.7	-73.3	-179.9	-178.9	173.7	0	108.6	L428 F432 S433	L428-K430 PolarHBondContact O-N 2.87Å; L428-K430 VanDerWaalsContact O-N 3.08Å; K430-F432 PolarHBondContact O-N 3.44Å; K430-S433 PolarHBondContact O-N 3.3Å
431	I	46.5	Very low	47	Very low	43 Å²	43	79.4 Å²	79.4	22%	0.221	41%	0.414	C	S	.	.	S	Bend	trans	-57.6	-16.7	-178.1	-58.7	138.6	0	0	0	113.3	L300 V429	L300-I431 HydrophobicContact CD1-CD1 3.36Å; L300-I431 HydrophobicContact CD1-CG1 4.33Å; L300-I431 HydrophobicContact CD2-CB 4.44Å; L300-I431 HydrophobicContact CD2-CD1 3.29Å; L300-I431 HydrophobicContact CD2-CG1 3.43Å; L300-I431 VanDerWaalsContact CD2-CG1 3.43Å; L300-I431 HydrophobicContact CD2-CG2 4.13Å; L300-I431 HydrophobicContact CG-CD1 3.9Å; L300-I431 HydrophobicContact CG-CG1 4.47Å; V429-I431 VanDerWaalsContact C-N 3.35Å; V429-I431 PolarHBondContact O-N 2.86Å
432	F	51.2	Low	48.8	Very low	80 Å²	80	75 Å²	75	35%	0.351	38%	0.382	S	S	.	.			trans	-127.7	63.9	-177.8	-58.9	-78.9	0	0	0	110.6	K430 F437	K430-F432 PolarHBondContact O-N 3.44Å; F432-F437 HydrophobicContact CB-CE2 4.37Å; F432-F437 HydrophobicContact CD1-CD2 4.4Å; F432-F437 AromaticContact CD1-CE2 3.45Å; F432-F437 HydrophobicContact CD1-CE2 3.45Å; F432-F437 VanDerWaalsContact CD1-CE2 3.45Å; F432-F437 AromaticContact CD1-CZ 3.59Å; F432-F437 HydrophobicContact CD1-CZ 3.59Å; F432-F437 HydrophobicContact CE1-CE2 4.15Å; F432-F437 AromaticContact CE1-CZ 3.88Å; F432-F437 HydrophobicContact CE1-CZ 3.88Å; F432-F437 HydrophobicContact CG-CE2 4.32Å
433	S	53	Low	50.9	Low	11 Å²	11	70.3 Å²	70.3	8%	0.077	35%	0.353	C	S	.	.			trans	-76.5	123.2	169.6	76.5	0	0	0	0	108.6	D366 K430 H435 V436 F437	D366-S433 PolarHBondContact OD2-OG 3.42Å; K430-S433 PolarHBondContact O-N 3.3Å; S433-H435 PolarHBondContact O-N 3.2Å; S433-V436 PolarHBondContact O-N 3.04Å; S433-V436 WeakPolarHBondContact OG-CG2 3.47Å; S433-F437 PolarHBondContact O-N 3.18Å
434	W	59.7	Low	53.2	Low	107 Å²	107	62.7 Å²	62.7	41%	0.405	32%	0.315	S	S	.	.	H	α-helix	trans	-49.1	-30.6	172.3	-179.9	-110.2	0	0	0	111.8	V405 A409 V436 A438 L442	V405-W434 HydrophobicContact CG1-CE3 4.41Å; V405-W434 HydrophobicContact CG1-CH2 3.95Å; V405-W434 HydrophobicContact CG1-CZ3 3.46Å; V405-W434 VanDerWaalsContact CG1-CZ3 3.46Å; A409-W434 HydrophobicContact CB-CE3 3.89Å; A409-W434 HydrophobicContact CB-CH2 4.2Å; A409-W434 HydrophobicContact CB-CZ3 3.5Å; W434-V436 VanDerWaalsContact C-N 3.33Å; W434-V436 PolarHBondContact O-N 3Å; W434-A438 VanDerWaalsContact O-CB 3.29Å; W434-A438 WeakPolarHBondContact O-CB 3.46Å; W434-A438 PolarHBondContact O-N 2.85Å; W434-L442 HydrophobicContact CH2-CD2 4.37Å
435	H	60.3	Low	55.3	Low	86 Å²	86	55.5 Å²	55.5	40%	0.398	28%	0.276	S	S	.	.	H	α-helix	trans	-56	-28.6	173.6	-65.1	-36.5	0	0	0	117.4	S433 P439 R493	S433-H435 PolarHBondContact O-N 3.2Å; H435-P439 VanDerWaalsContact O-CD 3.3Å; H435-P439 WeakPolarHBondContact O-CD 3.09Å; H435-P439 VanDerWaalsContact O-CG 3.26Å; H435-P439 WeakPolarHBondContact O-CG 3.45Å; H435-R493 VanDerWaalsContact CG-CZ 3.45Å; H435-R493 PolarHBondContact ND1-NE 2.92Å; H435-R493 VanDerWaalsContact ND1-NE 3.19Å
436	V	60.8	Low	57.5	Low	11 Å²	11	45.3 Å²	45.3	7%	0.067	24%	0.241	C	C	.	.	H	α-helix	trans	-101.1	-40.9	176.4	176.9	0	0	0	0	110.3	D366 F369 S433 W434 A438 P439 C440	D366-V436 HydrophobicContact CB-CG2 3.46Å; D366-V436 VanDerWaalsContact CB-CG2 3.46Å; D366-V436 VanDerWaalsContact CG-CG2 3.47Å; F369-V436 HydrophobicContact CD1-CG1 4.26Å; S433-V436 PolarHBondContact O-N 3.04Å; S433-V436 WeakPolarHBondContact OG-CG2 3.47Å; W434-V436 VanDerWaalsContact C-N 3.33Å; W434-V436 PolarHBondContact O-N 3Å; V436-A438 PolarHBondContact O-N 3.18Å; V436-P439 VanDerWaalsContact O-CD 3.31Å; V436-P439 WeakPolarHBondContact O-CD 3.3Å; V436-P439 WeakPolarHBondContact O-CG 3.22Å; V436-C440 WeakPolarHBondContact O-CB 3.49Å; V436-C440 PolarHBondContact O-N 3.31Å; V436-C440 PolarHBondContact O-SG 3.17Å
437	F	63.5	Low	59.8	Low	32 Å²	32	42.3 Å²	42.3	14%	0.14	22%	0.219	C	C	.	.	H	α-helix	trans	-66.5	-36.6	-178	-87.1	-87.1	0	0	0	113.8	F369 V405 F432 S433 C441 L442	F369-F437 HydrophobicContact CE1-CE2 4.5Å; F369-F437 HydrophobicContact CE1-CZ 4.36Å; V405-F437 HydrophobicContact CG2-CB 4.49Å; V405-F437 HydrophobicContact CG2-CD1 4.03Å; F432-F437 HydrophobicContact CB-CE2 4.37Å; F432-F437 HydrophobicContact CD1-CD2 4.4Å; F432-F437 AromaticContact CD1-CE2 3.45Å; F432-F437 HydrophobicContact CD1-CE2 3.45Å; F432-F437 VanDerWaalsContact CD1-CE2 3.45Å; F432-F437 AromaticContact CD1-CZ 3.59Å; F432-F437 HydrophobicContact CD1-CZ 3.59Å; F432-F437 HydrophobicContact CE1-CE2 4.15Å; F432-F437 AromaticContact CE1-CZ 3.88Å; F432-F437 HydrophobicContact CE1-CZ 3.88Å; F432-F437 HydrophobicContact CG-CE2 4.32Å; S433-F437 PolarHBondContact O-N 3.18Å; F437-C441 HydrophobicContact CD1-CB 4.28Å; F437-C441 WeakPolarHBondContact O-CA 3.44Å; F437-C441 WeakPolarHBondContact O-CB 3.44Å; F437-C441 PolarHBondContact O-N 3.02Å; F437-L442 PolarHBondContact O-N 3.41Å
438	A	62.6	Low	61.8	Low	1 Å²	1	36.8 Å²	36.8	1%	0.008	18%	0.179	C	C	.	.	I	π-helix	trans	-62.9	-56.2	177.5	0	0	0	0	0	112.5	W434 V436 L442 V443	W434-A438 VanDerWaalsContact O-CB 3.29Å; W434-A438 WeakPolarHBondContact O-CB 3.46Å; W434-A438 PolarHBondContact O-N 2.85Å; V436-A438 PolarHBondContact O-N 3.18Å; A438-L442 WeakPolarHBondContact O-CB 3.31Å; A438-L442 PolarHBondContact O-N 2.89Å; A438-V443 WeakPolarHBondContact O-CG2 3.48Å; A438-V443 PolarHBondContact O-N 3.47Å
439	P	69.3	Low	63.5	Low	23 Å²	23	34.2 Å²	34.2	15%	0.149	17%	0.166	C	C	.	.	I	π-helix	trans	-72.8	-29.5	-180	28.5	-35.5	0	0	0	114.2	H435 V436 P444 L486	H435-P439 VanDerWaalsContact O-CD 3.3Å; H435-P439 WeakPolarHBondContact O-CD 3.09Å; H435-P439 VanDerWaalsContact O-CG 3.26Å; H435-P439 WeakPolarHBondContact O-CG 3.45Å; V436-P439 VanDerWaalsContact O-CD 3.31Å; V436-P439 WeakPolarHBondContact O-CD 3.3Å; V436-P439 WeakPolarHBondContact O-CG 3.22Å; P439-P444 VanDerWaalsContact O-CD 3.31Å; P439-P444 WeakPolarHBondContact O-CD 3.33Å; P439-L486 HydrophobicContact CB-CD1 3.75Å
440	C	69.2	Low	65.2	Low	17 Å²	17	33.9 Å²	33.9	12%	0.115	16%	0.163	C	C	.	.	I	π-helix	trans	-99.2	-19.7	-171.4	-58.4	0	0	0	0	114.9	G370 L373 H377 V436	G370-C440 WeakPolarHBondContact CA-SG 3.42Å; L373-C440 HydrophobicContact CB-CB 4.36Å; L373-C440 HydrophobicContact CD1-CB 4.43Å; H377-C440 PolarHBondContact CD2-O 3.26Å; V436-C440 WeakPolarHBondContact O-CB 3.49Å; V436-C440 PolarHBondContact O-N 3.31Å; V436-C440 PolarHBondContact O-SG 3.17Å
441	C	65.1	Low	66.5	Low	9 Å²	9	26.9 Å²	26.9	6%	0.061	13%	0.132	C	C	.	.	I	π-helix	trans	-120.6	-51.6	177.7	-60.4	0	0	0	0	112.2	V405 F437 A445	V405-C441 HydrophobicContact CG2-CB 3.92Å; F437-C441 HydrophobicContact CD1-CB 4.28Å; F437-C441 WeakPolarHBondContact O-CA 3.44Å; F437-C441 WeakPolarHBondContact O-CB 3.44Å; F437-C441 PolarHBondContact O-N 3.02Å; C441-A445 WeakPolarHBondContact O-CB 3.08Å; C441-A445 PolarHBondContact O-N 3.2Å
442	L	69.4	Low	67.7	Low	10 Å²	10	25 Å²	25	5%	0.052	12%	0.123	C	C	.	.	I	π-helix	trans	-68.3	-51.1	-174.6	-171.8	70.8	0	0	0	111.8	V402 V405 W434 F437 A438 A445 V446 F489	V402-L442 HydrophobicContact CG1-CD1 4.38Å; V402-L442 HydrophobicContact CG2-CD1 4.15Å; V405-L442 HydrophobicContact CG1-CB 4.3Å; V405-L442 HydrophobicContact CG1-CD1 4.24Å; W434-L442 HydrophobicContact CH2-CD2 4.37Å; F437-L442 PolarHBondContact O-N 3.41Å; A438-L442 WeakPolarHBondContact O-CB 3.31Å; A438-L442 PolarHBondContact O-N 2.89Å; L442-A445 PolarHBondContact O-N 3.36Å; L442-V446 HydrophobicContact CD1-CG2 4.35Å; L442-V446 HydrophobicContact CG-CG2 4.42Å; L442-V446 WeakPolarHBondContact O-CB 3.2Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.37Å; L442-V446 PolarHBondContact O-N 2.75Å; L442-F489 HydrophobicContact CD2-CB 4.37Å; L442-F489 HydrophobicContact CD2-CD1 3.43Å; L442-F489 VanDerWaalsContact CD2-CD1 3.43Å; L442-F489 HydrophobicContact CD2-CD2 4.38Å; L442-F489 HydrophobicContact CD2-CE1 3.69Å; L442-F489 HydrophobicContact CD2-CG 3.82Å; L442-F489 HydrophobicContact CD2-CZ 4.26Å; L442-F489 HydrophobicContact CG-CD1 4.37Å; L442-F489 HydrophobicContact CG-CE1 4.34Å; L442-F489 HydrophobicContact CG-CZ 4.44Å
443	V	73	Confident	68.4	Low	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-60.1	-48.8	-179.8	171.9	0	0	0	0	111.2	A438 A445 V446 L447 Y482 L485 L486 F489	A438-V443 WeakPolarHBondContact O-CG2 3.48Å; A438-V443 PolarHBondContact O-N 3.47Å; V443-A445 PolarHBondContact O-N 2.98Å; V443-V446 PolarHBondContact O-N 3.43Å; V443-L447 VanDerWaalsContact O-CB 3.24Å; V443-L447 WeakPolarHBondContact O-CB 3.49Å; V443-L447 PolarHBondContact O-N 3.08Å; V443-Y482 HydrophobicContact CB-CE2 4.37Å; V443-Y482 HydrophobicContact CG1-CD2 3.54Å; V443-Y482 HydrophobicContact CG1-CE2 3.47Å; V443-Y482 VanDerWaalsContact CG1-CE2 3.47Å; V443-Y482 HydrophobicContact CG1-CG 4.3Å; V443-L485 HydrophobicContact CG1-CB 3.89Å; V443-L486 HydrophobicContact CG2-CD1 4.36Å; V443-F489 HydrophobicContact CG2-CB 4.09Å; V443-F489 HydrophobicContact CG2-CD2 3.85Å; V443-F489 HydrophobicContact CG2-CG 4.39Å
444	P	74.9	Confident	68.9	Low	12 Å²	12	24.6 Å²	24.6	8%	0.078	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-38.2	175.9	-26.3	37.2	0	0	0	114.1	H377 P439 L447 K448 Y482	H377-P444 HydrophobicContact CB-CB 4.09Å; P439-P444 VanDerWaalsContact O-CD 3.31Å; P439-P444 WeakPolarHBondContact O-CD 3.33Å; P444-L447 PolarHBondContact O-N 3.47Å; P444-K448 WeakPolarHBondContact O-CB 3.49Å; P444-K448 VanDerWaalsContact O-CG 3.22Å; P444-K448 WeakPolarHBondContact O-CG 3.38Å; P444-K448 PolarHBondContact O-N 3.02Å; P444-Y482 HydrophobicContact CG-CE2 4.44Å
445	A	70.1	Confident	69.1	Low	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.3	-44	177.7	0	0	0	0	0	112.1	C398 T401 V402 C441 L442 V443 K448 L449	C398-A445 HydrophobicContact CB-CB 4.32Å; T401-A445 WeakPolarHBondContact OG1-CB 3.33Å; V402-A445 HydrophobicContact CG2-CB 4.17Å; C441-A445 WeakPolarHBondContact O-CB 3.08Å; C441-A445 PolarHBondContact O-N 3.2Å; L442-A445 PolarHBondContact O-N 3.36Å; V443-A445 PolarHBondContact O-N 2.98Å; A445-K448 PolarHBondContact O-N 3.46Å; A445-L449 WeakPolarHBondContact O-CG 3.13Å; A445-L449 PolarHBondContact O-N 3.34Å
446	V	75.4	Confident	69	Low	31 Å²	31	19.7 Å²	19.7	19%	0.188	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-40.1	175.9	175.9	0	0	0	0	110.8	V402 L442 V443 K448 L449 L450 L485 F489	V402-V446 HydrophobicContact CG2-CG2 4.48Å; L442-V446 HydrophobicContact CD1-CG2 4.35Å; L442-V446 HydrophobicContact CG-CG2 4.42Å; L442-V446 WeakPolarHBondContact O-CB 3.2Å; L442-V446 VanDerWaalsContact O-CG2 3.27Å; L442-V446 WeakPolarHBondContact O-CG2 3.37Å; L442-V446 PolarHBondContact O-N 2.75Å; V443-V446 PolarHBondContact O-N 3.43Å; V446-K448 PolarHBondContact O-N 3.43Å; V446-L449 PolarHBondContact O-N 3.48Å; V446-L450 WeakPolarHBondContact O-CB 3.45Å; V446-L450 PolarHBondContact O-N 3.48Å; V446-L485 HydrophobicContact CG1-CD1 4.18Å; V446-L485 HydrophobicContact CG1-CD2 3.75Å; V446-F489 HydrophobicContact CB-CE2 4.22Å; V446-F489 HydrophobicContact CG1-CE2 4.16Å; V446-F489 HydrophobicContact CG1-CZ 4.45Å; V446-F489 HydrophobicContact CG2-CE2 4.03Å; V446-F489 HydrophobicContact CG2-CZ 4.01Å
447	L	78.9	Confident	68.5	Low	14 Å²	14	25 Å²	25	7%	0.073	13%	0.128	C	C	.	.	H	α-helix	trans	-60.2	-45.5	174.6	-179.6	63.2	0	0	0	111.5	V443 P444 L450 L451 V478 L481 Y482 L485	V443-L447 VanDerWaalsContact O-CB 3.24Å; V443-L447 WeakPolarHBondContact O-CB 3.49Å; V443-L447 PolarHBondContact O-N 3.08Å; P444-L447 PolarHBondContact O-N 3.47Å; L447-L450 PolarHBondContact O-N 2.84Å; L447-L451 HydrophobicContact CD1-CD1 4.28Å; L447-L451 HydrophobicContact CD1-CG 4.33Å; L447-L451 HydrophobicContact CG-CD1 4.09Å; L447-L451 VanDerWaalsContact O-CG 3.28Å; L447-L451 WeakPolarHBondContact O-CG 3.23Å; L447-L451 PolarHBondContact O-N 3.5Å; L447-V478 HydrophobicContact CD2-CG1 4.02Å; L447-L481 HydrophobicContact CD1-CB 3.57Å; L447-L481 HydrophobicContact CD1-CD1 4.21Å; L447-Y482 HydrophobicContact CD2-CD2 4.04Å; L447-L485 HydrophobicContact CB-CD1 3.73Å; L447-L485 HydrophobicContact CD1-CD1 4.05Å; L447-L485 HydrophobicContact CG-CD1 4.49Å
448	K	75.8	Confident	67.9	Low	10 Å²	10	25.6 Å²	25.6	4%	0.043	13%	0.134	C	C	.	.	H	α-helix	trans	-61.1	-47.1	176	-76.8	171.7	178.6	-141.7	0	112.1	H377 E380 W381 L394 C398 P444 A445 V446 L450 L451 L452	H377-K448 PolarHBondContact ND1-NZ 3.26Å; H377-K448 WeakPolarHBondContact O-CE 3.4Å; H377-K448 PolarHBondContact O-NZ 3.41Å; E380-K448 VanDerWaalsContact CB-NZ 3.32Å; E380-K448 IonicContact OE2-NZ 3.88Å; E380-K448 PolarHBondContact OE2-NZ 2.93Å; W381-K448 HydrophobicContact CE3-CG 4.07Å; W381-K448 HydrophobicContact CZ3-CG 4.43Å; L394-K448 HydrophobicContact CD2-CB 4.05Å; L394-K448 HydrophobicContact CD2-CD 3.88Å; L394-K448 HydrophobicContact CD2-CG 4.16Å; C398-K448 WeakPolarHBondContact SG-CB 3.5Å; P444-K448 WeakPolarHBondContact O-CB 3.49Å; P444-K448 VanDerWaalsContact O-CG 3.22Å; P444-K448 WeakPolarHBondContact O-CG 3.38Å; P444-K448 PolarHBondContact O-N 3.02Å; A445-K448 PolarHBondContact O-N 3.46Å; V446-K448 PolarHBondContact O-N 3.43Å; K448-L450 VanDerWaalsContact C-N 3.28Å; K448-L450 PolarHBondContact O-N 3.21Å; K448-L451 PolarHBondContact O-N 2.94Å; K448-L452 WeakPolarHBondContact O-CB 3.19Å; K448-L452 VanDerWaalsContact O-CG 3.25Å; K448-L452 WeakPolarHBondContact O-CG 3.38Å; K448-L452 PolarHBondContact O-N 3.49Å
449	L	71.4	Confident	67.3	Low	40 Å²	40	29.6 Å²	29.6	21%	0.209	16%	0.155	C	C	.	.	H	α-helix	trans	-56.8	-44.6	175.5	-78.2	164.5	0	0	0	111.1	Y395 C398 A445 V446 L452 C453	Y395-L449 HydrophobicContact CD1-CD2 3.48Å; Y395-L449 VanDerWaalsContact CD1-CD2 3.48Å; Y395-L449 HydrophobicContact CE1-CD2 3.91Å; C398-L449 HydrophobicContact CB-CD1 3.67Å; C398-L449 HydrophobicContact CB-CD2 3.79Å; C398-L449 HydrophobicContact CB-CG 3.43Å; C398-L449 VanDerWaalsContact CB-CG 3.43Å; A445-L449 WeakPolarHBondContact O-CG 3.13Å; A445-L449 PolarHBondContact O-N 3.34Å; V446-L449 PolarHBondContact O-N 3.48Å; L449-L452 PolarHBondContact O-N 3.37Å; L449-C453 PolarHBondContact O-N 2.85Å; L449-C453 PolarHBondContact O-SG 3.24Å
450	L	72.2	Confident	66.1	Low	22 Å²	22	34.9 Å²	34.9	12%	0.115	18%	0.182	C	C	.	.	H	α-helix	trans	-64.4	-43.2	179.1	-171.2	132.5	0	0	0	112.4	V446 L447 K448 C453 I454 L481 F561	V446-L450 WeakPolarHBondContact O-CB 3.45Å; V446-L450 PolarHBondContact O-N 3.48Å; L447-L450 PolarHBondContact O-N 2.84Å; K448-L450 VanDerWaalsContact C-N 3.28Å; K448-L450 PolarHBondContact O-N 3.21Å; L450-C453 PolarHBondContact O-N 3.31Å; L450-I454 HydrophobicContact CD2-CD1 3.65Å; L450-I454 HydrophobicContact CG-CD1 4.35Å; L450-I454 VanDerWaalsContact O-CG1 3.27Å; L450-I454 WeakPolarHBondContact O-CG1 3.37Å; L450-I454 PolarHBondContact O-N 3.35Å; L450-L481 HydrophobicContact CD2-CD1 3.54Å; L450-L481 HydrophobicContact CD2-CD2 3.92Å; L450-L481 HydrophobicContact CD2-CG 4.33Å; L450-F561 HydrophobicContact CD1-CD1 3.53Å; L450-F561 HydrophobicContact CD1-CD2 4.3Å; L450-F561 HydrophobicContact CD1-CE1 3.14Å; L450-F561 HydrophobicContact CD1-CE2 3.98Å; L450-F561 HydrophobicContact CD1-CG 4.1Å; L450-F561 HydrophobicContact CD1-CZ 3.39Å
451	L	75	Confident	64.7	Low	5 Å²	5	35.6 Å²	35.6	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-68.9	-32.2	176.3	-65.5	172.3	0	0	0	112.9	W381 L447 K448 N455 Y473 F477 V478 L481	W381-L451 HydrophobicContact CH2-CB 3.47Å; W381-L451 VanDerWaalsContact CH2-CB 3.47Å; W381-L451 HydrophobicContact CH2-CD1 3.91Å; W381-L451 HydrophobicContact CH2-CG 4.34Å; W381-L451 HydrophobicContact CZ2-CB 4.22Å; W381-L451 HydrophobicContact CZ2-CD1 4.01Å; W381-L451 HydrophobicContact CZ3-CB 4.08Å; W381-L451 HydrophobicContact CZ3-CD1 4.39Å; L447-L451 HydrophobicContact CD1-CD1 4.28Å; L447-L451 HydrophobicContact CD1-CG 4.33Å; L447-L451 HydrophobicContact CG-CD1 4.09Å; L447-L451 VanDerWaalsContact O-CG 3.28Å; L447-L451 WeakPolarHBondContact O-CG 3.23Å; L447-L451 PolarHBondContact O-N 3.5Å; K448-L451 PolarHBondContact O-N 2.94Å; L451-N455 PolarHBondContact O-N 3.28Å; L451-N455 VanDerWaalsContact O-N 3.14Å; L451-N455 PolarHBondContact O-ND2 3.35Å; L451-Y473 HydrophobicContact CB-CE2 4.12Å; L451-Y473 HydrophobicContact CD2-CD1 4Å; L451-Y473 HydrophobicContact CD2-CD2 3.84Å; L451-Y473 HydrophobicContact CD2-CE1 4.01Å; L451-Y473 HydrophobicContact CD2-CE2 3.88Å; L451-Y473 HydrophobicContact CD2-CG 3.91Å; L451-Y473 PolarHBondContact O-OH 3.24Å; L451-Y473 VanDerWaalsContact O-OH 3.06Å; L451-F477 HydrophobicContact CD2-CE1 4.02Å; L451-V478 HydrophobicContact CD1-CG1 4.43Å; L451-V478 HydrophobicContact CD1-CG2 4.37Å; L451-L481 HydrophobicContact CD2-CD1 4.05Å
452	L	70.9	Confident	63.5	Low	3 Å²	3	39.4 Å²	39.4	2%	0.016	21%	0.211	C	C	.	.	H	α-helix	trans	-67.1	-46.8	173	-73.4	165.6	0	0	0	111.1	Y384 E391 L394 Y395 K448 L449 I454 N455 E456	Y384-L452 HydrophobicContact CE1-CD2 4.35Å; Y384-L452 HydrophobicContact CE2-CD2 4.19Å; E391-L452 HydrophobicContact CG-CD2 4.47Å; L394-L452 HydrophobicContact CB-CD1 3.75Å; L394-L452 HydrophobicContact CB-CD2 4.19Å; L394-L452 HydrophobicContact CD1-CD2 4.33Å; L394-L452 HydrophobicContact CD2-CD1 3.88Å; L394-L452 HydrophobicContact CD2-CG 4.46Å; L394-L452 HydrophobicContact CG-CD1 4.32Å; Y395-L452 HydrophobicContact CD1-CD1 4.35Å; Y395-L452 HydrophobicContact CD2-CD1 4.4Å; Y395-L452 HydrophobicContact CE1-CB 4.26Å; Y395-L452 HydrophobicContact CE1-CD1 4.42Å; Y395-L452 HydrophobicContact CE2-CB 4.33Å; Y395-L452 HydrophobicContact CG-CD1 4.32Å; K448-L452 WeakPolarHBondContact O-CB 3.19Å; K448-L452 VanDerWaalsContact O-CG 3.25Å; K448-L452 WeakPolarHBondContact O-CG 3.38Å; K448-L452 PolarHBondContact O-N 3.49Å; L449-L452 PolarHBondContact O-N 3.37Å; L452-I454 VanDerWaalsContact C-N 3.31Å; L452-I454 PolarHBondContact O-N 3.01Å; L452-N455 WeakPolarHBondContact O-CB 3.23Å; L452-N455 PolarHBondContact O-N 3.39Å; L452-N455 VanDerWaalsContact O-N 3.13Å; L452-E456 PolarHBondContact O-N 3.38Å
453	C	65.6	Low	61.8	Low	51 Å²	51	46 Å²	46	35%	0.345	24%	0.241	S	C	.	.	H	α-helix	trans	-56.5	-47.6	174.9	-68.6	0	0	0	0	110.4	L449 L450 N455 E456 Y457	L449-C453 PolarHBondContact O-N 2.85Å; L449-C453 PolarHBondContact O-SG 3.24Å; L450-C453 PolarHBondContact O-N 3.31Å; C453-N455 VanDerWaalsContact C-N 3.29Å; C453-N455 PolarHBondContact O-N 3.47Å; C453-E456 PolarHBondContact O-N 3.46Å; C453-Y457 WeakPolarHBondContact O-CD2 3.16Å; C453-Y457 PolarHBondContact O-N 3.38Å
454	I	64.4	Low	59.9	Low	33 Å²	33	55.5 Å²	55.5	17%	0.169	29%	0.285	C	S	.	.	H	α-helix	trans	-60.3	-38.3	179	-62.7	162.4	0	0	0	111.6	L450 L452 V458 Y473 F477 L558	L450-I454 HydrophobicContact CD2-CD1 3.65Å; L450-I454 HydrophobicContact CG-CD1 4.35Å; L450-I454 VanDerWaalsContact O-CG1 3.27Å; L450-I454 WeakPolarHBondContact O-CG1 3.37Å; L450-I454 PolarHBondContact O-N 3.35Å; L452-I454 VanDerWaalsContact C-N 3.31Å; L452-I454 PolarHBondContact O-N 3.01Å; I454-V458 HydrophobicContact CG2-CG2 4.41Å; I454-V458 VanDerWaalsContact O-CG2 3.26Å; I454-V458 WeakPolarHBondContact O-CG2 3.43Å; I454-V458 PolarHBondContact O-N 3.4Å; I454-Y473 HydrophobicContact CB-CE1 4.44Å; I454-Y473 VanDerWaalsContact CB-OH 3.32Å; I454-Y473 WeakPolarHBondContact CB-OH 3.25Å; I454-Y473 HydrophobicContact CG2-CE1 3.92Å; I454-Y473 VanDerWaalsContact CG2-OH 3.26Å; I454-Y473 WeakPolarHBondContact CG2-OH 3.44Å; I454-F477 HydrophobicContact CD1-CE1 4.44Å; I454-F477 HydrophobicContact CD1-CZ 4.24Å; I454-L558 HydrophobicContact CD1-CD1 3.81Å
455	N	63.3	Low	57.7	Low	3 Å²	3	62.3 Å²	62.3	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-47.6	176.2	-76.8	-19.2	0	0	0	112.6	L451 L452 C453 Y457 V458 D459 V471 Y473	L451-N455 PolarHBondContact O-N 3.28Å; L451-N455 VanDerWaalsContact O-N 3.14Å; L451-N455 PolarHBondContact O-ND2 3.35Å; L452-N455 WeakPolarHBondContact O-CB 3.23Å; L452-N455 PolarHBondContact O-N 3.39Å; L452-N455 VanDerWaalsContact O-N 3.13Å; C453-N455 VanDerWaalsContact C-N 3.29Å; C453-N455 PolarHBondContact O-N 3.47Å; N455-Y457 PolarHBondContact O-N 3.07Å; N455-V458 PolarHBondContact O-N 3.25Å; N455-D459 PolarHBondContact O-N 2.9Å; N455-V471 WeakPolarHBondContact OD1-CB 3.35Å; N455-Y473 PolarHBondContact N-OH 3.48Å; N455-Y473 WeakPolarHBondContact OD1-CE2 3.19Å; N455-Y473 PolarHBondContact OD1-OH 2.84Å
456	E	58.1	Low	56	Low	86 Å²	86	66.4 Å²	66.4	40%	0.402	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-31.3	-176.1	-168.1	173.8	173.5	0	0	112.4	Y395 L452 C453 N460	Y395-E456 PolarHBondContact OH-OE2 3.2Å; L452-E456 PolarHBondContact O-N 3.38Å; C453-E456 PolarHBondContact O-N 3.46Å; E456-N460 PolarHBondContact O-ND2 3.48Å
457	Y	50.2	Low	54	Low	122 Å²	122	72.3 Å²	72.3	48%	0.478	38%	0.376	S	S	.	.	H	α-helix	trans	-87.3	-19.6	-179.8	-76	-76.2	0	0	0	114.5	C453 N455	C453-Y457 WeakPolarHBondContact O-CD2 3.16Å; C453-Y457 PolarHBondContact O-N 3.38Å; N455-Y457 PolarHBondContact O-N 3.07Å
458	V	51.3	Low	52.5	Low	46 Å²	46	77.1 Å²	77.1	28%	0.279	40%	0.401	S	S	.	.	H	α-helix	trans	-78.9	-34.8	175.2	171.6	0	0	0	0	111.6	I454 N455 N460 S461 V471	I454-V458 HydrophobicContact CG2-CG2 4.41Å; I454-V458 VanDerWaalsContact O-CG2 3.26Å; I454-V458 WeakPolarHBondContact O-CG2 3.43Å; I454-V458 PolarHBondContact O-N 3.4Å; N455-V458 PolarHBondContact O-N 3.25Å; V458-N460 VanDerWaalsContact C-N 3.32Å; V458-N460 PolarHBondContact O-N 3.5Å; V458-S461 PolarHBondContact O-OG 2.9Å; V458-V471 HydrophobicContact CB-CG2 4.39Å; V458-V471 HydrophobicContact CG1-CG2 4.03Å
459	D	49.4	Very low	51.2	Low	84 Å²	84	82.6 Å²	82.6	45%	0.449	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.9	-178.9	-82.6	-13.3	0	0	0	113.8	N455	N455-D459 PolarHBondContact O-N 2.9Å
460	N	45.1	Very low	50.6	Low	134 Å²	134	82.9 Å²	82.9	72%	0.717	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-12.9	-179.9	-89.8	-26	0	0	0	114.3	E456 V458	E456-N460 PolarHBondContact O-ND2 3.48Å; V458-N460 VanDerWaalsContact C-N 3.32Å; V458-N460 PolarHBondContact O-N 3.5Å
461	S	39.6	Very low	50	Low	32 Å²	32	84 Å²	84	22%	0.224	43%	0.433	C	S	.	.	S	Bend	trans	-94.3	112.8	170.9	50.4	0	0	0	0	109.9	V458	V458-S461 PolarHBondContact O-OG 2.9Å
462	T	39	Very low	49.4	Very low	90 Å²	90	87.5 Å²	87.5	55%	0.552	45%	0.449	S	S	*	.	S	Bend	trans	85.6	5.3	152.4	72.4	0	0	0	0	123.4	D548	T462-D548 WeakPolarHBondContact CG2-OD2 3.28Å
463	H	34.8	Very low	49.2	Very low	149 Å²	149	88.8 Å²	88.8	69%	0.69	45%	0.454	S	S	*	.			trans	-143.7	93.8	167	-74.9	-61.1	0	0	0	114.7	N465	H463-N465 PolarHBondContact O-N 3.5Å
464	H	32.2	Very low	49.5	Very low	198 Å²	198	90 Å²	90	92%	0.917	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	13.6	171.1	-88.3	-57.7	0	0	0	115.9
465	N	29.6	Very low	50	Low	155 Å²	155	96.7 Å²	96.7	83%	0.829	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-154.1	57	-174	-89.5	-27.9	0	0	0	112.9	H463	H463-N465 PolarHBondContact O-N 3.5Å
466	T	34.6	Very low	50.7	Low	87 Å²	87	100 Å²	100	53%	0.534	50%	0.502	S	S	.	.			trans	-147.9	110	160.8	47.2	0	0	0	0	111.6	N468	T466-N468 PolarHBondContact O-N 3.35Å
467	L	33.3	Very low	51.5	Low	154 Å²	154	95.9 Å²	95.9	81%	0.806	48%	0.483	S	S	*	.	S	Bend	trans	-45.2	129.2	156.7	-78.6	132.5	0	0	0	110.6
468	N	45.9	Very low	52.9	Low	115 Å²	115	92.2 Å²	92.2	62%	0.615	47%	0.473	S	S	*	.			trans	69.9	50.7	148.9	-55.9	-32.4	0	0	0	119.4	T466	T466-N468 PolarHBondContact O-N 3.35Å
469	H	49.4	Very low	54.3	Low	126 Å²	126	94.1 Å²	94.1	58%	0.583	48%	0.481	S	S	*	.			trans	-101.8	76.8	166.2	-80.2	-49.9	0	0	0	113.4	V471	H469-V471 PolarHBondContact O-N 3.35Å
470	R	58.8	Low	55.7	Low	45 Å²	45	90.1 Å²	90.1	17%	0.17	46%	0.46	C	S	.	.			trans	-65	117.4	167.4	-67	-174.6	176.1	137.6	-17.9	111.1	Y384 M385 T387 I389 H472	Y384-R470 HydrophobicContact CE1-CG 4.32Å; Y384-R470 PolarHBondContact O-NH1 3.46Å; Y384-R470 PolarHBondContact O-NH2 3.31Å; Y384-R470 PolarHBondContact OH-NE 3.28Å; M385-R470 HydrophobicContact CE-CB 4.09Å; M385-R470 HydrophobicContact SD-CB 4.09Å; T387-R470 VanDerWaalsContact CG2-NH1 3.29Å; T387-R470 VanDerWaalsContact N-NH1 3.12Å; I389-R470 PolarHBondContact O-NH2 3.47Å; R470-H472 PolarHBondContact O-N 3.49Å
471	V	58.9	Low	57.2	Low	45 Å²	45	83.8 Å²	83.8	27%	0.273	43%	0.426	S	S	.	.			trans	-62.6	127.2	-180	-174.5	0	0	0	0	110.3	N455 V458 H469	N455-V471 WeakPolarHBondContact OD1-CB 3.35Å; V458-V471 HydrophobicContact CB-CG2 4.39Å; V458-V471 HydrophobicContact CG1-CG2 4.03Å; H469-V471 PolarHBondContact O-N 3.35Å
472	H	62.5	Low	59.1	Low	79 Å²	79	85.3 Å²	85.3	37%	0.366	43%	0.428	S	S	.	.			trans	-85.6	111	171.8	-78.2	-71.4	0	0	0	109.9	K332 Y335 M385 R470	K332-H472 PolarHBondContact NZ-CD2 3.41Å; K332-H472 VanDerWaalsContact NZ-CD2 3.29Å; K332-H472 PolarHBondContact NZ-NE2 2.95Å; Y335-H472 AromaticContact CE2-CE1 3.44Å; Y335-H472 VanDerWaalsContact CE2-CE1 3.44Å; Y335-H472 WeakPolarHBondContact CE2-CE1 3.32Å; Y335-H472 AromaticContact CZ-CE1 3.49Å; Y335-H472 VanDerWaalsContact CZ-CE1 3.49Å; Y335-H472 AromaticContact CZ-ND1 3.8Å; Y335-H472 PolarHBondContact OH-CE1 3.48Å; Y335-H472 PolarHBondContact OH-ND1 3.34Å; M385-H472 WeakPolarHBondContact CE-CE1 3.38Å; M385-H472 WeakPolarHBondContact CE-ND1 3.33Å; R470-H472 PolarHBondContact O-N 3.49Å
473	Y	67.8	Low	61	Low	31 Å²	31	82.5 Å²	82.5	12%	0.122	41%	0.409	C	S	.	.			trans	-74.1	144.8	173.5	-61.4	-78.9	0	0	0	112	W381 L451 I454 N455 F477 V478	W381-Y473 HydrophobicContact CZ2-CD2 4.3Å; W381-Y473 HydrophobicContact CZ2-CE2 4.39Å; L451-Y473 HydrophobicContact CB-CE2 4.12Å; L451-Y473 HydrophobicContact CD2-CD1 4Å; L451-Y473 HydrophobicContact CD2-CD2 3.84Å; L451-Y473 HydrophobicContact CD2-CE1 4.01Å; L451-Y473 HydrophobicContact CD2-CE2 3.88Å; L451-Y473 HydrophobicContact CD2-CG 3.91Å; L451-Y473 PolarHBondContact O-OH 3.24Å; L451-Y473 VanDerWaalsContact O-OH 3.06Å; I454-Y473 HydrophobicContact CB-CE1 4.44Å; I454-Y473 VanDerWaalsContact CB-OH 3.32Å; I454-Y473 WeakPolarHBondContact CB-OH 3.25Å; I454-Y473 HydrophobicContact CG2-CE1 3.92Å; I454-Y473 VanDerWaalsContact CG2-OH 3.26Å; I454-Y473 WeakPolarHBondContact CG2-OH 3.44Å; N455-Y473 PolarHBondContact N-OH 3.48Å; N455-Y473 WeakPolarHBondContact OD1-CE2 3.19Å; N455-Y473 PolarHBondContact OD1-OH 2.84Å; Y473-F477 AromaticContact CD1-CD1 3.65Å; Y473-F477 HydrophobicContact CD1-CD1 3.65Å; Y473-F477 AromaticContact CD1-CE1 3.54Å; Y473-F477 HydrophobicContact CD1-CE1 3.54Å; Y473-F477 HydrophobicContact CE1-CD1 4.5Å; Y473-F477 AromaticContact CE1-CE1 3.94Å; Y473-F477 HydrophobicContact CE1-CE1 3.94Å; Y473-F477 HydrophobicContact CG-CD1 4.25Å; Y473-F477 HydrophobicContact CG-CE1 4.42Å; Y473-V478 HydrophobicContact CG-CG2 4.42Å
474	N	71.1	Confident	62.8	Low	77 Å²	77	75.5 Å²	75.5	41%	0.412	38%	0.377	S	S	.	.			trans	-65.1	143.3	169.2	-170.7	5.5	0	0	0	108.7	D476 F477 V478	N474-D476 PolarHBondContact ND2-OD2 2.92Å; N474-D476 VanDerWaalsContact ND2-OD2 3.09Å; N474-D476 PolarHBondContact O-N 3.5Å; N474-F477 HydrophobicContact CB-CB 4.4Å; N474-F477 WeakPolarHBondContact O-CB 3.49Å; N474-F477 PolarHBondContact O-N 2.84Å; N474-V478 PolarHBondContact O-N 3.36Å
475	K	75.8	Confident	64.8	Low	172 Å²	172	66.2 Å²	66.2	75%	0.748	33%	0.334	S	S	*	.	H	α-helix	trans	-57.3	-38.5	177.8	-67.8	-179.2	179.4	179	0	111.2	V478 L479	K475-V478 PolarHBondContact O-N 2.88Å; K475-L479 WeakPolarHBondContact O-CB 3.23Å; K475-L479 PolarHBondContact O-N 3.18Å
476	D	77.6	Confident	66.9	Low	72 Å²	72	60.4 Å²	60.4	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-62.3	-45	179.4	-55.1	-33.5	0	0	0	110.7	N474 V478 L479 G480 L534	N474-D476 PolarHBondContact ND2-OD2 2.92Å; N474-D476 VanDerWaalsContact ND2-OD2 3.09Å; N474-D476 PolarHBondContact O-N 3.5Å; D476-V478 PolarHBondContact O-N 2.84Å; D476-L479 WeakPolarHBondContact O-CB 3.48Å; D476-L479 PolarHBondContact O-N 3.47Å; D476-G480 PolarHBondContact O-N 3.31Å; D476-L534 CarbonylContact C-O 3.59Å; D476-L534 HydrophobicContact CB-CD2 3.85Å; D476-L534 WeakPolarHBondContact O-CB 3.03Å
477	F	75.8	Confident	68.4	Low	1 Å²	1	56.3 Å²	56.3	0%	0.004	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-46.3	178.5	176.6	-102.4	0	0	0	112.6	L451 I454 Y473 N474 L479 G480 L481 L534 V535 Q538 V539 L558	L451-F477 HydrophobicContact CD2-CE1 4.02Å; I454-F477 HydrophobicContact CD1-CE1 4.44Å; I454-F477 HydrophobicContact CD1-CZ 4.24Å; Y473-F477 AromaticContact CD1-CD1 3.65Å; Y473-F477 HydrophobicContact CD1-CD1 3.65Å; Y473-F477 AromaticContact CD1-CE1 3.54Å; Y473-F477 HydrophobicContact CD1-CE1 3.54Å; Y473-F477 HydrophobicContact CE1-CD1 4.5Å; Y473-F477 AromaticContact CE1-CE1 3.94Å; Y473-F477 HydrophobicContact CE1-CE1 3.94Å; Y473-F477 HydrophobicContact CG-CD1 4.25Å; Y473-F477 HydrophobicContact CG-CE1 4.42Å; N474-F477 HydrophobicContact CB-CB 4.4Å; N474-F477 WeakPolarHBondContact O-CB 3.49Å; N474-F477 PolarHBondContact O-N 2.84Å; F477-L479 VanDerWaalsContact C-N 3.3Å; F477-L479 PolarHBondContact O-N 3.41Å; F477-G480 PolarHBondContact O-N 2.92Å; F477-L481 HydrophobicContact CD1-CD1 3.89Å; F477-L481 HydrophobicContact CE1-CD1 3.32Å; F477-L481 HydrophobicContact CE1-CG 4.32Å; F477-L481 HydrophobicContact CE2-CD1 4.15Å; F477-L481 HydrophobicContact CE2-CG 4.4Å; F477-L481 HydrophobicContact CZ-CD1 3.48Å; F477-L481 VanDerWaalsContact CZ-CD1 3.48Å; F477-L481 HydrophobicContact CZ-CG 4.19Å; F477-L481 PolarHBondContact O-N 3.36Å; F477-L534 PolarHBondContact N-O 3.39Å; F477-V535 HydrophobicContact CD2-CB 4.49Å; F477-V535 HydrophobicContact CD2-CG1 4.05Å; F477-V535 HydrophobicContact CE2-CG1 3.92Å; F477-Q538 HydrophobicContact CB-CB 3.98Å; F477-Q538 HydrophobicContact CB-CG 4.35Å; F477-Q538 HydrophobicContact CD2-CB 3.74Å; F477-Q538 HydrophobicContact CD2-CG 4.14Å; F477-Q538 HydrophobicContact CE2-CB 4.48Å; F477-Q538 HydrophobicContact CG-CB 4.03Å; F477-Q538 HydrophobicContact CG-CG 4.17Å; F477-V539 HydrophobicContact CE2-CG2 4.37Å; F477-L558 HydrophobicContact CE2-CD2 4.03Å; F477-L558 HydrophobicContact CZ-CD2 3.95Å
478	V	78.3	Confident	69.9	Low	44 Å²	44	51 Å²	51	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-40.9	176.9	179.3	0	0	0	0	110.7	L447 L451 Y473 N474 K475 D476 Y482	L447-V478 HydrophobicContact CD2-CG1 4.02Å; L451-V478 HydrophobicContact CD1-CG1 4.43Å; L451-V478 HydrophobicContact CD1-CG2 4.37Å; Y473-V478 HydrophobicContact CG-CG2 4.42Å; N474-V478 PolarHBondContact O-N 3.36Å; K475-V478 PolarHBondContact O-N 2.88Å; D476-V478 PolarHBondContact O-N 2.84Å; V478-Y482 VanDerWaalsContact O-CB 3.31Å; V478-Y482 WeakPolarHBondContact O-CB 3.42Å; V478-Y482 PolarHBondContact O-N 3.12Å
479	L	81.4	Confident	70.8	Confident	86 Å²	86	48.5 Å²	48.5	45%	0.45	23%	0.233	S	C	.	.	H	α-helix	trans	-65.3	-43.3	176.5	-177.8	64.6	0	0	0	111.8	K475 D476 F477 Y482 L483 L534	K475-L479 WeakPolarHBondContact O-CB 3.23Å; K475-L479 PolarHBondContact O-N 3.18Å; D476-L479 WeakPolarHBondContact O-CB 3.48Å; D476-L479 PolarHBondContact O-N 3.47Å; F477-L479 VanDerWaalsContact C-N 3.3Å; F477-L479 PolarHBondContact O-N 3.41Å; L479-Y482 WeakPolarHBondContact O-CB 3.24Å; L479-Y482 PolarHBondContact O-N 3.32Å; L479-L483 HydrophobicContact CG-CD1 4.36Å; L479-L483 WeakPolarHBondContact O-CG 3.26Å; L479-L483 PolarHBondContact O-N 3.37Å; L479-L534 HydrophobicContact CB-CD1 4.49Å; L479-L534 HydrophobicContact CD2-CD1 3.89Å; L479-L534 HydrophobicContact CG-CD1 4.02Å
480	G	77.9	Confident	71.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.6	-45.5	177.8	0	0	0	0	0	112.4	D476 F477 L483 L484 V535	D476-G480 PolarHBondContact O-N 3.31Å; F477-G480 PolarHBondContact O-N 2.92Å; G480-L483 PolarHBondContact O-N 3.37Å; G480-L484 WeakPolarHBondContact O-CG 3.41Å; G480-L484 PolarHBondContact O-N 3.39Å; G480-V535 VanDerWaalsContact C-CG2 3.47Å
481	L	77.4	Confident	71.8	Confident	2 Å²	2	42 Å²	42	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-42.9	173.4	-75.9	173.6	0	0	0	112.1	L447 L450 L451 F477 L483 L484 L485 V535	L447-L481 HydrophobicContact CD1-CB 3.57Å; L447-L481 HydrophobicContact CD1-CD1 4.21Å; L450-L481 HydrophobicContact CD2-CD1 3.54Å; L450-L481 HydrophobicContact CD2-CD2 3.92Å; L450-L481 HydrophobicContact CD2-CG 4.33Å; L451-L481 HydrophobicContact CD2-CD1 4.05Å; F477-L481 HydrophobicContact CD1-CD1 3.89Å; F477-L481 HydrophobicContact CE1-CD1 3.32Å; F477-L481 HydrophobicContact CE1-CG 4.32Å; F477-L481 HydrophobicContact CE2-CD1 4.15Å; F477-L481 HydrophobicContact CE2-CG 4.4Å; F477-L481 HydrophobicContact CZ-CD1 3.48Å; F477-L481 VanDerWaalsContact CZ-CD1 3.48Å; F477-L481 HydrophobicContact CZ-CG 4.19Å; F477-L481 PolarHBondContact O-N 3.36Å; L481-L483 VanDerWaalsContact C-N 3.32Å; L481-L483 PolarHBondContact O-N 3.01Å; L481-L484 PolarHBondContact O-N 3.09Å; L481-L485 WeakPolarHBondContact O-CG 3.5Å; L481-L485 PolarHBondContact O-N 3.21Å; L481-V535 HydrophobicContact CG-CG2 4.37Å
482	Y	80.2	Confident	71.8	Confident	63 Å²	63	46 Å²	46	25%	0.247	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-44.3	175.3	179.7	-91.5	0	0	0	111.5	V443 P444 L447 V478 L479 L485 L486	V443-Y482 HydrophobicContact CB-CE2 4.37Å; V443-Y482 HydrophobicContact CG1-CD2 3.54Å; V443-Y482 HydrophobicContact CG1-CE2 3.47Å; V443-Y482 VanDerWaalsContact CG1-CE2 3.47Å; V443-Y482 HydrophobicContact CG1-CG 4.3Å; P444-Y482 HydrophobicContact CG-CE2 4.44Å; L447-Y482 HydrophobicContact CD2-CD2 4.04Å; V478-Y482 VanDerWaalsContact O-CB 3.31Å; V478-Y482 WeakPolarHBondContact O-CB 3.42Å; V478-Y482 PolarHBondContact O-N 3.12Å; L479-Y482 WeakPolarHBondContact O-CB 3.24Å; L479-Y482 PolarHBondContact O-N 3.32Å; Y482-L485 PolarHBondContact O-N 2.95Å; Y482-L486 HydrophobicContact CE1-CD2 4.31Å; Y482-L486 VanDerWaalsContact O-CB 3.24Å; Y482-L486 WeakPolarHBondContact O-CB 3.19Å; Y482-L486 PolarHBondContact O-N 2.9Å
483	L	78.9	Confident	71.8	Confident	31 Å²	31	47.7 Å²	47.7	16%	0.162	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-41.5	176.9	-71.8	171.8	0	0	0	111.9	L479 G480 L481 L486 G487 Y527 V530 A531 L534	L479-L483 HydrophobicContact CG-CD1 4.36Å; L479-L483 WeakPolarHBondContact O-CG 3.26Å; L479-L483 PolarHBondContact O-N 3.37Å; G480-L483 PolarHBondContact O-N 3.37Å; L481-L483 VanDerWaalsContact C-N 3.32Å; L481-L483 PolarHBondContact O-N 3.01Å; L483-L486 PolarHBondContact O-N 2.93Å; L483-G487 PolarHBondContact O-N 3.34Å; L483-Y527 HydrophobicContact CD2-CE2 3.91Å; L483-Y527 PolarHBondContact O-OH 2.71Å; L483-V530 HydrophobicContact CD1-CG1 4.47Å; L483-A531 HydrophobicContact CB-CB 3.73Å; L483-A531 HydrophobicContact CD1-CB 4.36Å; L483-L534 HydrophobicContact CD1-CD1 3.89Å
484	L	72	Confident	71.7	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-45.2	175.5	-73.3	170.9	0	0	0	112	G480 L481 G487 L488 F528 A531 V535 L566	G480-L484 WeakPolarHBondContact O-CG 3.41Å; G480-L484 PolarHBondContact O-N 3.39Å; L481-L484 PolarHBondContact O-N 3.09Å; L484-G487 PolarHBondContact O-N 3.47Å; L484-L488 PolarHBondContact O-N 3.14Å; L484-F528 HydrophobicContact CD2-CD1 4.29Å; L484-A531 HydrophobicContact CD2-CB 4.15Å; L484-A531 HydrophobicContact CG-CB 4.13Å; L484-V535 HydrophobicContact CD1-CG2 4.07Å; L484-L566 HydrophobicContact CD2-CD1 4.48Å
485	L	73.4	Confident	71.3	Confident	3 Å²	3	44 Å²	44	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-66.1	-38.6	177	-69.3	172.4	0	0	0	111.9	V443 V446 L447 L481 Y482 G487 L488 F489 F561	V443-L485 HydrophobicContact CG1-CB 3.89Å; V446-L485 HydrophobicContact CG1-CD1 4.18Å; V446-L485 HydrophobicContact CG1-CD2 3.75Å; L447-L485 HydrophobicContact CB-CD1 3.73Å; L447-L485 HydrophobicContact CD1-CD1 4.05Å; L447-L485 HydrophobicContact CG-CD1 4.49Å; L481-L485 WeakPolarHBondContact O-CG 3.5Å; L481-L485 PolarHBondContact O-N 3.21Å; Y482-L485 PolarHBondContact O-N 2.95Å; L485-G487 VanDerWaalsContact C-N 3.33Å; L485-L488 PolarHBondContact O-N 3.29Å; L485-F489 HydrophobicContact CB-CD2 4.46Å; L485-F489 HydrophobicContact CD2-CE2 4.12Å; L485-F489 VanDerWaalsContact O-CD2 3.23Å; L485-F489 WeakPolarHBondContact O-CD2 3.27Å; L485-F489 PolarHBondContact O-N 3Å; L485-F561 HydrophobicContact CD2-CE1 4.27Å; L485-F561 HydrophobicContact CD2-CZ 4.03Å
486	L	74.9	Confident	70.8	Confident	33 Å²	33	40.5 Å²	40.5	17%	0.173	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-41.5	173.5	-169.5	74.7	0	0	0	110.8	P439 V443 Y482 L483 L488 C490 I494	P439-L486 HydrophobicContact CB-CD1 3.75Å; V443-L486 HydrophobicContact CG2-CD1 4.36Å; Y482-L486 HydrophobicContact CE1-CD2 4.31Å; Y482-L486 VanDerWaalsContact O-CB 3.24Å; Y482-L486 WeakPolarHBondContact O-CB 3.19Å; Y482-L486 PolarHBondContact O-N 2.9Å; L483-L486 PolarHBondContact O-N 2.93Å; L486-L488 VanDerWaalsContact C-N 3.29Å; L486-L488 PolarHBondContact O-N 2.89Å; L486-C490 HydrophobicContact CD1-CB 4.2Å; L486-C490 HydrophobicContact CG-CB 4.41Å; L486-C490 WeakPolarHBondContact O-CA 3.13Å; L486-C490 VanDerWaalsContact O-CB 3.22Å; L486-C490 WeakPolarHBondContact O-CB 3.21Å; L486-C490 PolarHBondContact O-N 3.32Å; L486-I494 HydrophobicContact CG-CD1 4.49Å
487	G	65	Low	70.3	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-53.6	-44.2	170.6	0	0	0	0	0	112.9	L483 L484 L485 S491 Y527	L483-G487 PolarHBondContact O-N 3.34Å; L484-G487 PolarHBondContact O-N 3.47Å; L485-G487 VanDerWaalsContact C-N 3.33Å; G487-S491 WeakPolarHBondContact O-CA 3.48Å; G487-S491 WeakPolarHBondContact O-CB 3.47Å; G487-S491 PolarHBondContact O-N 3.15Å; G487-Y527 PolarHBondContact N-OH 2.81Å
488	L	65.1	Low	70	Confident	42 Å²	42	43.5 Å²	43.5	22%	0.22	21%	0.206	C	C	.	.	H	α-helix	trans	-71.9	-50.9	-178	-170.9	145.1	0	0	0	112.6	L484 L485 L486 C565 T568	L484-L488 PolarHBondContact O-N 3.14Å; L485-L488 PolarHBondContact O-N 3.29Å; L486-L488 VanDerWaalsContact C-N 3.29Å; L486-L488 PolarHBondContact O-N 2.89Å; L488-C565 HydrophobicContact CD1-CB 4.17Å; L488-T568 WeakPolarHBondContact CD1-OG1 3.38Å
489	F	65.5	Low	69.4	Low	63 Å²	63	44 Å²	44	28%	0.276	21%	0.205	S	C	.	.	H	α-helix	trans	-84.9	-23.8	-174.4	-66.8	-65.2	0	0	0	114.1	L442 V443 V446 L485	L442-F489 HydrophobicContact CD2-CB 4.37Å; L442-F489 HydrophobicContact CD2-CD1 3.43Å; L442-F489 VanDerWaalsContact CD2-CD1 3.43Å; L442-F489 HydrophobicContact CD2-CD2 4.38Å; L442-F489 HydrophobicContact CD2-CE1 3.69Å; L442-F489 HydrophobicContact CD2-CG 3.82Å; L442-F489 HydrophobicContact CD2-CZ 4.26Å; L442-F489 HydrophobicContact CG-CD1 4.37Å; L442-F489 HydrophobicContact CG-CE1 4.34Å; L442-F489 HydrophobicContact CG-CZ 4.44Å; V443-F489 HydrophobicContact CG2-CB 4.09Å; V443-F489 HydrophobicContact CG2-CD2 3.85Å; V443-F489 HydrophobicContact CG2-CG 4.39Å; V446-F489 HydrophobicContact CB-CE2 4.22Å; V446-F489 HydrophobicContact CG1-CE2 4.16Å; V446-F489 HydrophobicContact CG1-CZ 4.45Å; V446-F489 HydrophobicContact CG2-CE2 4.03Å; V446-F489 HydrophobicContact CG2-CZ 4.01Å; L485-F489 HydrophobicContact CB-CD2 4.46Å; L485-F489 HydrophobicContact CD2-CE2 4.12Å; L485-F489 VanDerWaalsContact O-CD2 3.23Å; L485-F489 WeakPolarHBondContact O-CD2 3.27Å; L485-F489 PolarHBondContact O-N 3Å
490	C	67.5	Low	69	Low	17 Å²	17	45.6 Å²	45.6	12%	0.115	21%	0.21	C	C	.	.	S	Bend	trans	-119.7	23.5	-175.6	-62.8	0	0	0	0	113.7	L486 E492 R493 I494	L486-C490 HydrophobicContact CD1-CB 4.2Å; L486-C490 HydrophobicContact CG-CB 4.41Å; L486-C490 WeakPolarHBondContact O-CA 3.13Å; L486-C490 VanDerWaalsContact O-CB 3.22Å; L486-C490 WeakPolarHBondContact O-CB 3.21Å; L486-C490 PolarHBondContact O-N 3.32Å; C490-E492 VanDerWaalsContact C-N 3.3Å; C490-E492 PolarHBondContact O-N 2.94Å; C490-R493 PolarHBondContact O-N 3.42Å; C490-I494 PolarHBondContact O-N 2.86Å
491	S	61.4	Low	68.9	Low	17 Å²	17	47.6 Å²	47.6	12%	0.119	22%	0.222	C	C	.	.	H	α-helix	trans	-48.2	-43.9	-178.6	53.6	0	0	0	0	114.4	G487 R493 I494 C495	G487-S491 WeakPolarHBondContact O-CA 3.48Å; G487-S491 WeakPolarHBondContact O-CB 3.47Å; G487-S491 PolarHBondContact O-N 3.15Å; S491-R493 VanDerWaalsContact C-N 3.35Å; S491-R493 PolarHBondContact O-N 3.5Å; S491-I494 PolarHBondContact O-N 3.3Å; S491-C495 PolarHBondContact O-N 3.49Å
492	E	58.5	Low	68.8	Low	130 Å²	130	47.5 Å²	47.5	61%	0.607	22%	0.222	S	C	*	.	H	α-helix	trans	-63	-39.8	179.8	-171.5	175.3	-168.1	0	0	112.3	C490 C495 Q496	C490-E492 VanDerWaalsContact C-N 3.3Å; C490-E492 PolarHBondContact O-N 2.94Å; E492-C495 PolarHBondContact O-N 3.02Å; E492-Q496 WeakPolarHBondContact O-CG 3.25Å; E492-Q496 PolarHBondContact O-N 2.89Å
493	R	62.3	Low	68.5	Low	115 Å²	115	47.6 Å²	47.6	43%	0.434	23%	0.227	S	C	.	.	H	α-helix	trans	-73.4	-38.2	177.6	-84.5	-160.8	164.7	-158	-10.3	112.5	H435 C490 S491 C495 Q496 F497	H435-R493 VanDerWaalsContact CG-CZ 3.45Å; H435-R493 PolarHBondContact ND1-NE 2.92Å; H435-R493 VanDerWaalsContact ND1-NE 3.19Å; C490-R493 PolarHBondContact O-N 3.42Å; S491-R493 VanDerWaalsContact C-N 3.35Å; S491-R493 PolarHBondContact O-N 3.5Å; R493-C495 PolarHBondContact O-N 3Å; R493-Q496 PolarHBondContact O-N 2.89Å; R493-Q496 VanDerWaalsContact O-N 3.17Å; R493-F497 WeakPolarHBondContact O-CB 3.48Å; R493-F497 PolarHBondContact O-N 2.81Å
494	I	66.1	Low	68.4	Low	26 Å²	26	54.6 Å²	54.6	13%	0.133	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-37.7	173.8	-66.2	164.7	0	0	0	109.4	L486 C490 S491 F497 K498 Y527	L486-I494 HydrophobicContact CG-CD1 4.49Å; C490-I494 PolarHBondContact O-N 2.86Å; S491-I494 PolarHBondContact O-N 3.3Å; I494-F497 PolarHBondContact O-N 2.79Å; I494-K498 WeakPolarHBondContact O-CB 3.49Å; I494-K498 PolarHBondContact O-N 3.16Å; I494-Y527 HydrophobicContact CD1-CE1 4.12Å
495	C	62.1	Low	68.6	Low	5 Å²	5	57.4 Å²	57.4	3%	0.034	27%	0.266	C	S	.	.	H	α-helix	trans	-68.5	-39.3	173.5	-171.4	0	0	0	0	113.4	S491 E492 R493 K498 K499 S576	S491-C495 PolarHBondContact O-N 3.49Å; E492-C495 PolarHBondContact O-N 3.02Å; R493-C495 PolarHBondContact O-N 3Å; C495-K498 WeakPolarHBondContact O-CB 3.42Å; C495-K498 PolarHBondContact O-N 2.97Å; C495-K499 WeakPolarHBondContact O-CG 3.23Å; C495-K499 PolarHBondContact O-N 3Å; C495-S576 PolarHBondContact SG-OG 3.29Å
496	Q	65	Low	68.7	Low	97 Å²	97	58.4 Å²	58.4	45%	0.453	27%	0.271	S	S	.	.	H	α-helix	trans	-65	-42.3	173.6	-72.9	177.4	0.1	0	0	112	E492 R493 K499 Q500	E492-Q496 WeakPolarHBondContact O-CG 3.25Å; E492-Q496 PolarHBondContact O-N 2.89Å; R493-Q496 PolarHBondContact O-N 2.89Å; R493-Q496 VanDerWaalsContact O-N 3.17Å; Q496-K499 WeakPolarHBondContact O-CB 3.45Å; Q496-K499 PolarHBondContact O-N 3.08Å; Q496-K499 VanDerWaalsContact O-N 3.16Å; Q496-Q500 WeakPolarHBondContact O-CG 3.39Å; Q496-Q500 PolarHBondContact O-N 3.43Å
497	F	67.2	Low	68.7	Low	133 Å²	133	63 Å²	63	58%	0.583	30%	0.296	S	S	*	.	H	α-helix	trans	-62.3	-44.6	175.6	-175.1	-101.8	0	0	0	111	R493 I494 K499 Q500 V501	R493-F497 WeakPolarHBondContact O-CB 3.48Å; R493-F497 PolarHBondContact O-N 2.81Å; I494-F497 PolarHBondContact O-N 2.79Å; F497-K499 VanDerWaalsContact C-N 3.32Å; F497-K499 PolarHBondContact O-N 2.93Å; F497-Q500 PolarHBondContact O-N 2.98Å; F497-Q500 VanDerWaalsContact O-N 3.13Å; F497-V501 HydrophobicContact CD1-CG2 3.93Å; F497-V501 HydrophobicContact CE1-CG2 3.57Å; F497-V501 HydrophobicContact CE2-CG2 4.24Å; F497-V501 HydrophobicContact CG-CG2 4.41Å; F497-V501 HydrophobicContact CZ-CG2 3.75Å; F497-V501 WeakPolarHBondContact O-CG2 3.4Å; F497-V501 PolarHBondContact O-N 3.47Å
498	K	69.4	Low	69.2	Low	3 Å²	3	70.9 Å²	70.9	1%	0.013	33%	0.33	C	S	.	.	H	α-helix	trans	-51.7	-50.9	169.4	176.2	-156.4	76	162.6	0	111.1	I494 C495 Q500 V501 V502 E520 V523 I524	I494-K498 WeakPolarHBondContact O-CB 3.49Å; I494-K498 PolarHBondContact O-N 3.16Å; C495-K498 WeakPolarHBondContact O-CB 3.42Å; C495-K498 PolarHBondContact O-N 2.97Å; K498-Q500 VanDerWaalsContact C-N 3.31Å; K498-Q500 PolarHBondContact O-N 3.24Å; K498-V501 PolarHBondContact O-N 3.02Å; K498-V502 HydrophobicContact CG-CG2 4.3Å; K498-V502 WeakPolarHBondContact O-CB 3.21Å; K498-V502 VanDerWaalsContact O-CG2 3.29Å; K498-V502 WeakPolarHBondContact O-CG2 3.28Å; K498-V502 PolarHBondContact O-N 3Å; K498-E520 HydrophobicContact CD-CB 3.79Å; K498-E520 HydrophobicContact CD-CG 3.97Å; K498-E520 WeakPolarHBondContact CD-O 3.42Å; K498-E520 VanDerWaalsContact CE-OE2 3.28Å; K498-E520 WeakPolarHBondContact CE-OE2 3.32Å; K498-E520 HydrophobicContact CG-CB 4.38Å; K498-E520 HydrophobicContact CG-CG 4.24Å; K498-E520 IonicContact NZ-OE2 2.65Å; K498-E520 PolarHBondContact NZ-OE2 3.26Å; K498-V523 HydrophobicContact CG-CB 4.41Å; K498-V523 HydrophobicContact CG-CG1 4.21Å; K498-I524 HydrophobicContact CD-CD1 3.37Å; K498-I524 HydrophobicContact CD-CG1 3.67Å; K498-I524 HydrophobicContact CG-CG1 4.38Å
499	K	66.1	Low	69.8	Low	56 Å²	56	74.8 Å²	74.8	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-59.6	-41	179.1	-73.4	-179	-179	-172.8	0	112	C495 Q496 F497 N503	C495-K499 WeakPolarHBondContact O-CG 3.23Å; C495-K499 PolarHBondContact O-N 3Å; Q496-K499 WeakPolarHBondContact O-CB 3.45Å; Q496-K499 PolarHBondContact O-N 3.08Å; Q496-K499 VanDerWaalsContact O-N 3.16Å; F497-K499 VanDerWaalsContact C-N 3.32Å; F497-K499 PolarHBondContact O-N 2.93Å; K499-N503 WeakPolarHBondContact O-CB 3.49Å; K499-N503 PolarHBondContact O-N 2.79Å; K499-N503 PolarHBondContact O-ND2 3.46Å; K499-N503 PolarHBondContact O-OD1 3.2Å
500	Q	73.4	Confident	70	Confident	118 Å²	118	75.9 Å²	75.9	55%	0.551	36%	0.356	S	S	*	.	H	α-helix	trans	-67	-43.5	177	-71.3	177.7	-6.9	0	0	112.6	Q496 F497 K498 N503 R504	Q496-Q500 WeakPolarHBondContact O-CG 3.39Å; Q496-Q500 PolarHBondContact O-N 3.43Å; F497-Q500 PolarHBondContact O-N 2.98Å; F497-Q500 VanDerWaalsContact O-N 3.13Å; K498-Q500 VanDerWaalsContact C-N 3.31Å; K498-Q500 PolarHBondContact O-N 3.24Å; Q500-N503 PolarHBondContact O-N 3.27Å; Q500-R504 WeakPolarHBondContact O-CG 3.25Å; Q500-R504 PolarHBondContact O-N 3.07Å
501	V	74.7	Confident	70.5	Confident	43 Å²	43	82.1 Å²	82.1	26%	0.261	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-45.1	177.5	171.6	0	0	0	0	110.7	F497 K498 R504 L505	F497-V501 HydrophobicContact CD1-CG2 3.93Å; F497-V501 HydrophobicContact CE1-CG2 3.57Å; F497-V501 HydrophobicContact CE2-CG2 4.24Å; F497-V501 HydrophobicContact CG-CG2 4.41Å; F497-V501 HydrophobicContact CZ-CG2 3.75Å; F497-V501 WeakPolarHBondContact O-CG2 3.4Å; F497-V501 PolarHBondContact O-N 3.47Å; K498-V501 PolarHBondContact O-N 3.02Å; V501-R504 PolarHBondContact O-N 3.48Å; V501-L505 HydrophobicContact CG1-CD1 3.95Å; V501-L505 WeakPolarHBondContact O-CB 3.26Å; V501-L505 WeakPolarHBondContact O-CG 3.25Å; V501-L505 PolarHBondContact O-N 2.66Å
502	V	75.6	Confident	70.8	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-66.9	-41.9	177.1	175.1	0	0	0	0	111.1	K498 R504 L505 L506 R516 I519 E520 V523	K498-V502 HydrophobicContact CG-CG2 4.3Å; K498-V502 WeakPolarHBondContact O-CB 3.21Å; K498-V502 VanDerWaalsContact O-CG2 3.29Å; K498-V502 WeakPolarHBondContact O-CG2 3.28Å; K498-V502 PolarHBondContact O-N 3Å; V502-R504 VanDerWaalsContact C-N 3.35Å; V502-R504 PolarHBondContact O-N 2.94Å; V502-L505 PolarHBondContact O-N 3.1Å; V502-L506 HydrophobicContact CG1-CD1 3.82Å; V502-L506 HydrophobicContact CG1-CG 4.15Å; V502-L506 WeakPolarHBondContact O-CB 3.42Å; V502-L506 WeakPolarHBondContact O-CG 3.21Å; V502-L506 PolarHBondContact O-N 3.19Å; V502-R516 HydrophobicContact CG1-CG 4.1Å; V502-I519 HydrophobicContact CG1-CG2 4.33Å; V502-I519 HydrophobicContact CG2-CG2 3.9Å; V502-E520 HydrophobicContact CB-CG 4.16Å; V502-E520 HydrophobicContact CG1-CG 4.02Å; V502-E520 HydrophobicContact CG2-CG 3.77Å; V502-V523 HydrophobicContact CG2-CG2 4.39Å
503	N	75.1	Confident	70.9	Confident	65 Å²	65	81 Å²	81	35%	0.348	38%	0.384	S	S	.	.	H	α-helix	trans	-59.9	-45.6	174.5	-73.2	-7.6	0	0	0	110.9	K499 Q500 L505 L506 D507 R516	K499-N503 WeakPolarHBondContact O-CB 3.49Å; K499-N503 PolarHBondContact O-N 2.79Å; K499-N503 PolarHBondContact O-ND2 3.46Å; K499-N503 PolarHBondContact O-OD1 3.2Å; Q500-N503 PolarHBondContact O-N 3.27Å; N503-L505 PolarHBondContact O-N 3.26Å; N503-L506 CarbonylContact O-C 3.55Å; N503-L506 WeakPolarHBondContact O-CB 3.35Å; N503-L506 PolarHBondContact O-N 2.95Å; N503-D507 PolarHBondContact O-N 2.78Å; N503-R516 PolarHBondContact OD1-NH2 2.88Å
504	R	76.9	Confident	70.7	Confident	177 Å²	177	81 Å²	81	67%	0.668	40%	0.399	S	S	*	.	H	α-helix	trans	-62.9	-40.8	174.9	-76	-173.5	-177.5	178.5	1.8	112.9	Q500 V501 V502 L506 D507 F508	Q500-R504 WeakPolarHBondContact O-CG 3.25Å; Q500-R504 PolarHBondContact O-N 3.07Å; V501-R504 PolarHBondContact O-N 3.48Å; V502-R504 VanDerWaalsContact C-N 3.35Å; V502-R504 PolarHBondContact O-N 2.94Å; R504-L506 VanDerWaalsContact C-N 3.3Å; R504-L506 PolarHBondContact O-N 3.24Å; R504-D507 WeakPolarHBondContact O-CB 3.47Å; R504-D507 PolarHBondContact O-N 3.06Å; R504-F508 WeakPolarHBondContact O-CD2 3.37Å; R504-F508 PolarHBondContact O-N 3.27Å; R504-F508 VanDerWaalsContact O-N 3.12Å
505	L	75.3	Confident	70.7	Confident	63 Å²	63	81.6 Å²	81.6	33%	0.33	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-39.4	174.7	-84.2	163.7	0	0	0	111.6	V501 V502 N503 D507 F508 Y509	V501-L505 HydrophobicContact CG1-CD1 3.95Å; V501-L505 WeakPolarHBondContact O-CB 3.26Å; V501-L505 WeakPolarHBondContact O-CG 3.25Å; V501-L505 PolarHBondContact O-N 2.66Å; V502-L505 PolarHBondContact O-N 3.1Å; N503-L505 PolarHBondContact O-N 3.26Å; L505-D507 VanDerWaalsContact C-N 3.34Å; L505-F508 PolarHBondContact O-N 3.41Å; L505-Y509 WeakPolarHBondContact O-CB 3.4Å; L505-Y509 PolarHBondContact O-N 2.84Å
506	L	74.7	Confident	70.8	Confident	24 Å²	24	85.4 Å²	85.4	13%	0.126	42%	0.419	C	S	.	.	H	α-helix	trans	-69.1	-32	175.1	-70.5	171.9	0	0	0	112.1	V502 N503 R504 F508 Y509 P510 L512 R516	V502-L506 HydrophobicContact CG1-CD1 3.82Å; V502-L506 HydrophobicContact CG1-CG 4.15Å; V502-L506 WeakPolarHBondContact O-CB 3.42Å; V502-L506 WeakPolarHBondContact O-CG 3.21Å; V502-L506 PolarHBondContact O-N 3.19Å; N503-L506 CarbonylContact O-C 3.55Å; N503-L506 WeakPolarHBondContact O-CB 3.35Å; N503-L506 PolarHBondContact O-N 2.95Å; R504-L506 VanDerWaalsContact C-N 3.3Å; R504-L506 PolarHBondContact O-N 3.24Å; L506-F508 VanDerWaalsContact C-N 3.34Å; L506-Y509 CarbonylContact O-C 3.55Å; L506-Y509 PolarHBondContact O-N 3.42Å; L506-P510 VanDerWaalsContact O-CA 3.24Å; L506-P510 WeakPolarHBondContact O-CA 3.43Å; L506-P510 VanDerWaalsContact O-N 3.13Å; L506-L512 VanDerWaalsContact CD2-C 3.44Å; L506-L512 HydrophobicContact CD2-CB 3.95Å; L506-R516 HydrophobicContact CD1-CB 4.44Å; L506-R516 HydrophobicContact CD1-CG 4.14Å
507	D	75.8	Confident	70.6	Confident	130 Å²	130	86.5 Å²	86.5	70%	0.695	43%	0.427	S	S	*	.	H	α-helix	trans	-65	-38.6	173.4	-62.4	-27.9	0	0	0	111.1	N503 R504 L505	N503-D507 PolarHBondContact O-N 2.78Å; R504-D507 WeakPolarHBondContact O-CB 3.47Å; R504-D507 PolarHBondContact O-N 3.06Å; L505-D507 VanDerWaalsContact C-N 3.34Å
508	F	76.4	Confident	70.4	Confident	164 Å²	164	82.5 Å²	82.5	72%	0.719	42%	0.419	S	S	*	.	H	α-helix	trans	-78	-35.8	175	-75	-71.2	0	0	0	113.3	R504 L505 L506	R504-F508 WeakPolarHBondContact O-CD2 3.37Å; R504-F508 PolarHBondContact O-N 3.27Å; R504-F508 VanDerWaalsContact O-N 3.12Å; L505-F508 PolarHBondContact O-N 3.41Å; L506-F508 VanDerWaalsContact C-N 3.34Å
509	Y	77.4	Confident	70.3	Confident	124 Å²	124	83.6 Å²	83.6	49%	0.486	42%	0.424	S	S	.	.			trans	-130.6	73.7	-174	-60.1	-70	0	0	0	111	L505 L506 F511 L512	L505-Y509 WeakPolarHBondContact O-CB 3.4Å; L505-Y509 PolarHBondContact O-N 2.84Å; L506-Y509 CarbonylContact O-C 3.55Å; L506-Y509 PolarHBondContact O-N 3.42Å; Y509-F511 AromaticContact CD1-CE1 3.64Å; Y509-F511 HydrophobicContact CD1-CE1 3.64Å; Y509-F511 AromaticContact CD1-CZ 3.98Å; Y509-F511 HydrophobicContact CD1-CZ 3.98Å; Y509-F511 HydrophobicContact CG-CE1 4.2Å; Y509-F511 HydrophobicContact CG-CZ 4.36Å; Y509-F511 PolarHBondContact O-N 2.82Å; Y509-F511 VanDerWaalsContact O-N 3.12Å; Y509-L512 HydrophobicContact CG-CD1 4.41Å; Y509-L512 WeakPolarHBondContact O-CB 3.5Å; Y509-L512 PolarHBondContact O-N 2.94Å
510	P	70	Confident	70.2	Confident	87 Å²	87	81.4 Å²	81.4	57%	0.565	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-62.8	-23	-174	19.7	-30.7	0	0	0	114.1	L506 L512 S513	L506-P510 VanDerWaalsContact O-CA 3.24Å; L506-P510 WeakPolarHBondContact O-CA 3.43Å; L506-P510 VanDerWaalsContact O-N 3.13Å; P510-L512 PolarHBondContact O-N 3.21Å; P510-S513 WeakPolarHBondContact O-CB 3.35Å; P510-S513 PolarHBondContact O-N 3.33Å; P510-S513 VanDerWaalsContact O-N 3.13Å; P510-S513 PolarHBondContact O-OG 3.2Å
511	F	76.5	Confident	69.6	Low	148 Å²	148	78.4 Å²	78.4	65%	0.649	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-64	-17.2	174.6	67.5	-99.3	0	0	0	113.5	Y509 S513 P514	Y509-F511 AromaticContact CD1-CE1 3.64Å; Y509-F511 HydrophobicContact CD1-CE1 3.64Å; Y509-F511 AromaticContact CD1-CZ 3.98Å; Y509-F511 HydrophobicContact CD1-CZ 3.98Å; Y509-F511 HydrophobicContact CG-CE1 4.2Å; Y509-F511 HydrophobicContact CG-CZ 4.36Å; Y509-F511 PolarHBondContact O-N 2.82Å; Y509-F511 VanDerWaalsContact O-N 3.12Å; F511-S513 VanDerWaalsContact C-N 3.28Å; F511-S513 PolarHBondContact O-N 3.33Å; F511-P514 WeakPolarHBondContact O-CD 3.15Å
512	L	68.4	Low	69.4	Low	48 Å²	48	82.1 Å²	82.1	25%	0.251	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-81.2	-2.2	176.2	-70	178.8	0	0	0	113.6	L506 Y509 P510 S515 R516 I519	L506-L512 VanDerWaalsContact CD2-C 3.44Å; L506-L512 HydrophobicContact CD2-CB 3.95Å; Y509-L512 HydrophobicContact CG-CD1 4.41Å; Y509-L512 WeakPolarHBondContact O-CB 3.5Å; Y509-L512 PolarHBondContact O-N 2.94Å; P510-L512 PolarHBondContact O-N 3.21Å; L512-S515 WeakPolarHBondContact CA-OG 3.25Å; L512-S515 CarbonylContact O-C 3.48Å; L512-S515 WeakPolarHBondContact O-CA 3.36Å; L512-S515 PolarHBondContact O-N 3Å; L512-S515 PolarHBondContact O-OG 3.02Å; L512-R516 PolarHBondContact O-N 3.36Å; L512-I519 HydrophobicContact CB-CD1 3.62Å; L512-I519 HydrophobicContact CD1-CD1 3.98Å; L512-I519 HydrophobicContact CD2-CD1 4.2Å; L512-I519 HydrophobicContact CG-CD1 4.14Å
513	S	60	Low	69.2	Low	74 Å²	74	84.3 Å²	84.3	52%	0.517	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-54.5	-37.6	179.4	59.1	0	0	0	0	115.5	P510 F511 S515 R516	P510-S513 WeakPolarHBondContact O-CB 3.35Å; P510-S513 PolarHBondContact O-N 3.33Å; P510-S513 VanDerWaalsContact O-N 3.13Å; P510-S513 PolarHBondContact O-OG 3.2Å; F511-S513 VanDerWaalsContact C-N 3.28Å; F511-S513 PolarHBondContact O-N 3.33Å; S513-S515 VanDerWaalsContact C-N 3.25Å; S513-S515 PolarHBondContact O-N 2.94Å; S513-R516 WeakPolarHBondContact O-CB 3.43Å; S513-R516 PolarHBondContact O-N 2.88Å
514	P	58.9	Low	68.9	Low	116 Å²	116	81.9 Å²	81.9	75%	0.753	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-67.4	-31.4	176.3	-13.4	28.8	0	0	0	111.6	F511 R516	F511-P514 WeakPolarHBondContact O-CD 3.15Å; P514-R516 VanDerWaalsContact C-N 3.29Å; P514-R516 PolarHBondContact O-N 3.47Å
515	S	66	Low	68.3	Low	39 Å²	39	75.3 Å²	75.3	27%	0.273	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-86.7	11.4	179.7	54.8	0	0	0	0	113.9	L512 S513 I517 A518 I519	L512-S515 WeakPolarHBondContact CA-OG 3.25Å; L512-S515 CarbonylContact O-C 3.48Å; L512-S515 WeakPolarHBondContact O-CA 3.36Å; L512-S515 PolarHBondContact O-N 3Å; L512-S515 PolarHBondContact O-OG 3.02Å; S513-S515 VanDerWaalsContact C-N 3.25Å; S513-S515 PolarHBondContact O-N 2.94Å; S515-I517 VanDerWaalsContact C-N 3.28Å; S515-I517 PolarHBondContact O-N 3.27Å; S515-A518 WeakPolarHBondContact O-CA 3.39Å; S515-A518 WeakPolarHBondContact O-CB 3.32Å; S515-A518 PolarHBondContact O-N 3.43Å; S515-I519 WeakPolarHBondContact O-CG1 3.35Å; S515-I519 PolarHBondContact O-N 2.79Å; S515-I519 WeakPolarHBondContact OG-CD1 3.1Å
516	R	64.1	Low	68.2	Low	85 Å²	85	74 Å²	74	32%	0.321	41%	0.414	S	S	.	.	H	α-helix	trans	-50.1	-46.6	-178.2	179.7	-179.4	-178.4	145.5	17.6	112.9	V502 N503 L506 L512 S513 P514 A518 I519 E520	V502-R516 HydrophobicContact CG1-CG 4.1Å; N503-R516 PolarHBondContact OD1-NH2 2.88Å; L506-R516 HydrophobicContact CD1-CB 4.44Å; L506-R516 HydrophobicContact CD1-CG 4.14Å; L512-R516 PolarHBondContact O-N 3.36Å; S513-R516 WeakPolarHBondContact O-CB 3.43Å; S513-R516 PolarHBondContact O-N 2.88Å; P514-R516 VanDerWaalsContact C-N 3.29Å; P514-R516 PolarHBondContact O-N 3.47Å; R516-A518 VanDerWaalsContact C-N 3.34Å; R516-A518 PolarHBondContact O-N 3.45Å; R516-I519 PolarHBondContact O-N 3.45Å; R516-E520 HydrophobicContact CG-CG 4.41Å; R516-E520 IonicContact CZ-OE1 2.55Å; R516-E520 IonicContact NE-OE1 3.85Å; R516-E520 PolarHBondContact NE-OE1 3.27Å; R516-E520 IonicContact NH2-OE1 3.88Å; R516-E520 WeakPolarHBondContact O-CB 3.5Å; R516-E520 VanDerWaalsContact O-CG 3.3Å; R516-E520 WeakPolarHBondContact O-CG 3.14Å; R516-E520 PolarHBondContact O-N 3.32Å
517	I	61.1	Low	68.2	Low	119 Å²	119	75.3 Å²	75.3	61%	0.61	42%	0.417	S	S	*	.	H	α-helix	trans	-65.3	-40	-179.4	-61	172.9	0	0	0	110.9	S515 S521	S515-I517 VanDerWaalsContact C-N 3.28Å; S515-I517 PolarHBondContact O-N 3.27Å; I517-S521 WeakPolarHBondContact O-CB 3.39Å; I517-S521 PolarHBondContact O-N 3.23Å; I517-S521 PolarHBondContact O-OG 3.05Å
518	A	62.9	Low	67.8	Low	50 Å²	50	69.5 Å²	69.5	41%	0.413	39%	0.386	S	S	.	.	H	α-helix	trans	-65.2	-46.4	176.6	0	0	0	0	0	111	S515 R516 S521 I522	S515-A518 WeakPolarHBondContact O-CA 3.39Å; S515-A518 WeakPolarHBondContact O-CB 3.32Å; S515-A518 PolarHBondContact O-N 3.43Å; R516-A518 VanDerWaalsContact C-N 3.34Å; R516-A518 PolarHBondContact O-N 3.45Å; A518-S521 PolarHBondContact O-N 3.4Å; A518-I522 WeakPolarHBondContact O-CB 3.48Å; A518-I522 WeakPolarHBondContact O-CD1 3.4Å; A518-I522 WeakPolarHBondContact O-CG1 3.26Å; A518-I522 PolarHBondContact O-N 3.31Å
519	I	67	Low	67.6	Low	25 Å²	25	67.5 Å²	67.5	13%	0.128	38%	0.378	C	S	.	.	H	α-helix	trans	-63.6	-44.5	178.5	-63.5	164.9	0	0	0	110.8	V502 L512 S515 R516 S521 I522 V523	V502-I519 HydrophobicContact CG1-CG2 4.33Å; V502-I519 HydrophobicContact CG2-CG2 3.9Å; L512-I519 HydrophobicContact CB-CD1 3.62Å; L512-I519 HydrophobicContact CD1-CD1 3.98Å; L512-I519 HydrophobicContact CD2-CD1 4.2Å; L512-I519 HydrophobicContact CG-CD1 4.14Å; S515-I519 WeakPolarHBondContact O-CG1 3.35Å; S515-I519 PolarHBondContact O-N 2.79Å; S515-I519 WeakPolarHBondContact OG-CD1 3.1Å; R516-I519 PolarHBondContact O-N 3.45Å; I519-S521 VanDerWaalsContact C-N 3.27Å; I519-S521 PolarHBondContact O-N 3.49Å; I519-I522 PolarHBondContact O-N 3.43Å; I519-V523 HydrophobicContact CG2-CG2 4.44Å; I519-V523 VanDerWaalsContact O-CG2 3.3Å; I519-V523 WeakPolarHBondContact O-CG2 3.15Å; I519-V523 PolarHBondContact O-N 3.22Å
520	E	64.4	Low	67.6	Low	10 Å²	10	65.1 Å²	65.1	5%	0.047	38%	0.377	C	S	.	.	H	α-helix	trans	-58.3	-40.3	175.2	-79.2	-173	-163.1	0	0	111.9	K498 V502 R516 I524	K498-E520 HydrophobicContact CD-CB 3.79Å; K498-E520 HydrophobicContact CD-CG 3.97Å; K498-E520 WeakPolarHBondContact CD-O 3.42Å; K498-E520 VanDerWaalsContact CE-OE2 3.28Å; K498-E520 WeakPolarHBondContact CE-OE2 3.32Å; K498-E520 HydrophobicContact CG-CB 4.38Å; K498-E520 HydrophobicContact CG-CG 4.24Å; K498-E520 IonicContact NZ-OE2 2.65Å; K498-E520 PolarHBondContact NZ-OE2 3.26Å; V502-E520 HydrophobicContact CB-CG 4.16Å; V502-E520 HydrophobicContact CG1-CG 4.02Å; V502-E520 HydrophobicContact CG2-CG 3.77Å; R516-E520 HydrophobicContact CG-CG 4.41Å; R516-E520 IonicContact CZ-OE1 2.55Å; R516-E520 IonicContact NE-OE1 3.85Å; R516-E520 PolarHBondContact NE-OE1 3.27Å; R516-E520 IonicContact NH2-OE1 3.88Å; R516-E520 WeakPolarHBondContact O-CB 3.5Å; R516-E520 VanDerWaalsContact O-CG 3.3Å; R516-E520 WeakPolarHBondContact O-CG 3.14Å; R516-E520 PolarHBondContact O-N 3.32Å; E520-I524 PolarHBondContact O-N 2.93Å
521	S	59.7	Low	67.9	Low	56 Å²	56	61 Å²	61	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-71.4	-39.5	178	-56	0	0	0	0	112.1	I517 A518 I519 I524 G525	I517-S521 WeakPolarHBondContact O-CB 3.39Å; I517-S521 PolarHBondContact O-N 3.23Å; I517-S521 PolarHBondContact O-OG 3.05Å; A518-S521 PolarHBondContact O-N 3.4Å; I519-S521 VanDerWaalsContact C-N 3.27Å; I519-S521 PolarHBondContact O-N 3.49Å; S521-I524 PolarHBondContact O-N 2.9Å; S521-G525 PolarHBondContact O-N 2.88Å
522	I	71.5	Confident	67.5	Low	120 Å²	120	57 Å²	57	62%	0.615	33%	0.334	S	S	*	.	H	α-helix	trans	-63.1	-41.9	175.9	-69.9	162.7	0	0	0	110.9	A518 I519 G525 G526	A518-I522 WeakPolarHBondContact O-CB 3.48Å; A518-I522 WeakPolarHBondContact O-CD1 3.4Å; A518-I522 WeakPolarHBondContact O-CG1 3.26Å; A518-I522 PolarHBondContact O-N 3.31Å; I519-I522 PolarHBondContact O-N 3.43Å; I522-G525 PolarHBondContact O-N 2.85Å; I522-G526 PolarHBondContact O-N 2.87Å
523	V	71.3	Confident	67.8	Low	47 Å²	47	57.8 Å²	57.8	29%	0.285	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-42.8	178.9	171.5	0	0	0	0	111.4	K498 V502 I519 Y527	K498-V523 HydrophobicContact CG-CB 4.41Å; K498-V523 HydrophobicContact CG-CG1 4.21Å; V502-V523 HydrophobicContact CG2-CG2 4.39Å; I519-V523 HydrophobicContact CG2-CG2 4.44Å; I519-V523 VanDerWaalsContact O-CG2 3.3Å; I519-V523 WeakPolarHBondContact O-CG2 3.15Å; I519-V523 PolarHBondContact O-N 3.22Å; V523-Y527 PolarHBondContact O-N 3.33Å; V523-Y527 VanDerWaalsContact O-N 3.07Å
524	I	68	Low	68.8	Low	13 Å²	13	55.9 Å²	55.9	7%	0.067	33%	0.326	C	S	.	.	H	α-helix	trans	-69.5	-45	176.2	-68.2	161.4	0	0	0	111.1	K498 E520 S521 G526 Y527 F528 I573 V577	K498-I524 HydrophobicContact CD-CD1 3.37Å; K498-I524 HydrophobicContact CD-CG1 3.67Å; K498-I524 HydrophobicContact CG-CG1 4.38Å; E520-I524 PolarHBondContact O-N 2.93Å; S521-I524 PolarHBondContact O-N 2.9Å; I524-G526 VanDerWaalsContact C-N 3.29Å; I524-G526 PolarHBondContact O-N 3.2Å; I524-Y527 WeakPolarHBondContact O-CB 3.31Å; I524-Y527 PolarHBondContact O-N 3.23Å; I524-F528 HydrophobicContact CG2-CD2 3.83Å; I524-F528 HydrophobicContact CG2-CE2 3.74Å; I524-F528 WeakPolarHBondContact O-CD2 3.32Å; I524-F528 PolarHBondContact O-N 2.92Å; I524-F528 VanDerWaalsContact O-N 3.15Å; I524-I573 HydrophobicContact CD1-CG2 3.4Å; I524-I573 HydrophobicContact CG1-CG2 4.18Å; I524-I573 HydrophobicContact CG2-CD1 4.35Å; I524-I573 HydrophobicContact CG2-CG2 4.07Å; I524-V577 HydrophobicContact CD1-CG2 3.33Å
525	G	65.5	Low	69.4	Low	40 Å²	40	50.6 Å²	50.6	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-43.3	176.7	0	0	0	0	0	111.3	S521 I522 F528 H529	S521-G525 PolarHBondContact O-N 2.88Å; I522-G525 PolarHBondContact O-N 2.85Å; G525-F528 PolarHBondContact O-N 2.66Å; G525-H529 WeakPolarHBondContact O-CB 3.45Å; G525-H529 PolarHBondContact O-N 3.07Å
526	G	72.2	Confident	69.5	Low	35 Å²	35	55 Å²	55	36%	0.361	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-42.1	174.6	0	0	0	0	0	113	I522 I524 F528 H529 V530	I522-G526 PolarHBondContact O-N 2.87Å; I524-G526 VanDerWaalsContact C-N 3.29Å; I524-G526 PolarHBondContact O-N 3.2Å; G526-F528 PolarHBondContact O-N 3.31Å; G526-H529 PolarHBondContact O-N 3.03Å; G526-V530 VanDerWaalsContact O-CG2 3.27Å; G526-V530 WeakPolarHBondContact O-CG2 3.49Å; G526-V530 PolarHBondContact O-N 3.3Å
527	Y	75.3	Confident	69.9	Low	51 Å²	51	54.5 Å²	54.5	20%	0.2	31%	0.309	C	S	.	.	H	α-helix	trans	-57.7	-50.6	175.9	175.6	-95.7	0	0	0	112.2	L483 G487 I494 V523 I524 V530 A531	L483-Y527 HydrophobicContact CD2-CE2 3.91Å; L483-Y527 PolarHBondContact O-OH 2.71Å; G487-Y527 PolarHBondContact N-OH 2.81Å; I494-Y527 HydrophobicContact CD1-CE1 4.12Å; V523-Y527 PolarHBondContact O-N 3.33Å; V523-Y527 VanDerWaalsContact O-N 3.07Å; I524-Y527 WeakPolarHBondContact O-CB 3.31Å; I524-Y527 PolarHBondContact O-N 3.23Å; Y527-V530 PolarHBondContact O-N 2.91Å; Y527-A531 PolarHBondContact O-N 3.07Å
528	F	68	Low	70.2	Confident	8 Å²	8	50.1 Å²	50.1	4%	0.035	29%	0.286	C	S	.	.	H	α-helix	trans	-72.1	-35.2	179.7	-74.5	-64.9	0	0	0	113	L484 I524 G525 G526 V530 A531 I532 L566 S569 I573	L484-F528 HydrophobicContact CD2-CD1 4.29Å; I524-F528 HydrophobicContact CG2-CD2 3.83Å; I524-F528 HydrophobicContact CG2-CE2 3.74Å; I524-F528 WeakPolarHBondContact O-CD2 3.32Å; I524-F528 PolarHBondContact O-N 2.92Å; I524-F528 VanDerWaalsContact O-N 3.15Å; G525-F528 PolarHBondContact O-N 2.66Å; G526-F528 PolarHBondContact O-N 3.31Å; F528-V530 VanDerWaalsContact C-N 3.34Å; F528-V530 PolarHBondContact O-N 3.38Å; F528-A531 PolarHBondContact O-N 3.45Å; F528-I532 WeakPolarHBondContact O-CB 3.33Å; F528-I532 VanDerWaalsContact O-CG1 3.29Å; F528-I532 WeakPolarHBondContact O-CG1 3.38Å; F528-I532 PolarHBondContact O-N 2.68Å; F528-L566 HydrophobicContact CB-CD1 3.75Å; F528-L566 HydrophobicContact CD1-CD1 3.64Å; F528-L566 HydrophobicContact CG-CD1 3.82Å; F528-S569 WeakPolarHBondContact CE1-OG 3.31Å; F528-S569 WeakPolarHBondContact CZ-OG 3.35Å; F528-I573 HydrophobicContact CE2-CD1 3.49Å; F528-I573 VanDerWaalsContact CE2-CD1 3.49Å; F528-I573 HydrophobicContact CZ-CD1 3.59Å
529	H	71.5	Confident	70.2	Confident	122 Å²	122	47.9 Å²	47.9	57%	0.565	27%	0.268	S	S	*	.	H	α-helix	trans	-58.2	-49	173.7	-175.6	-73.7	0	0	0	110.3	G525 G526 A531 I532 T533	G525-H529 WeakPolarHBondContact O-CB 3.45Å; G525-H529 PolarHBondContact O-N 3.07Å; G526-H529 PolarHBondContact O-N 3.03Å; H529-A531 PolarHBondContact O-N 3.16Å; H529-I532 PolarHBondContact O-N 2.83Å; H529-T533 VanDerWaalsContact CE1-CG2 3.43Å; H529-T533 WeakPolarHBondContact CE1-CG2 3.33Å; H529-T533 WeakPolarHBondContact O-CB 3.5Å; H529-T533 VanDerWaalsContact O-CG2 3.26Å; H529-T533 WeakPolarHBondContact O-CG2 3.38Å; H529-T533 PolarHBondContact O-N 2.91Å; H529-T533 PolarHBondContact O-OG1 3.29Å; H529-T533 VanDerWaalsContact O-OG1 3.04Å
530	V	77.7	Confident	70	Confident	74 Å²	74	50.2 Å²	50.2	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-48.5	175.5	172.6	0	0	0	0	110.7	L483 G526 Y527 F528 I532 T533 L534	L483-V530 HydrophobicContact CD1-CG1 4.47Å; G526-V530 VanDerWaalsContact O-CG2 3.27Å; G526-V530 WeakPolarHBondContact O-CG2 3.49Å; G526-V530 PolarHBondContact O-N 3.3Å; Y527-V530 PolarHBondContact O-N 2.91Å; F528-V530 VanDerWaalsContact C-N 3.34Å; F528-V530 PolarHBondContact O-N 3.38Å; V530-I532 PolarHBondContact O-N 3.28Å; V530-T533 WeakPolarHBondContact CA-OG1 3.48Å; V530-T533 PolarHBondContact O-N 2.98Å; V530-T533 PolarHBondContact O-OG1 2.9Å; V530-L534 HydrophobicContact CG1-CD1 3.93Å; V530-L534 HydrophobicContact CG1-CG 4.48Å; V530-L534 VanDerWaalsContact O-CG 3.27Å; V530-L534 WeakPolarHBondContact O-CG 3.31Å; V530-L534 PolarHBondContact O-N 3.25Å; V530-L534 VanDerWaalsContact O-N 3.11Å
531	A	75.2	Confident	69.9	Low	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-58	-45	179.2	0	0	0	0	0	112.6	L483 L484 Y527 F528 H529 L534 V535	L483-A531 HydrophobicContact CB-CB 3.73Å; L483-A531 HydrophobicContact CD1-CB 4.36Å; L484-A531 HydrophobicContact CD2-CB 4.15Å; L484-A531 HydrophobicContact CG-CB 4.13Å; Y527-A531 PolarHBondContact O-N 3.07Å; F528-A531 PolarHBondContact O-N 3.45Å; H529-A531 PolarHBondContact O-N 3.16Å; A531-L534 PolarHBondContact O-N 3.04Å; A531-V535 WeakPolarHBondContact O-CG2 3.47Å; A531-V535 PolarHBondContact O-N 2.96Å
532	I	68.7	Low	69.9	Low	64 Å²	64	54.4 Å²	54.4	33%	0.328	30%	0.296	S	S	.	.	H	α-helix	trans	-66.8	-46.2	177.8	-67.6	161.6	0	0	0	111.1	F528 H529 V530 L534 V535 W536 L566	F528-I532 WeakPolarHBondContact O-CB 3.33Å; F528-I532 VanDerWaalsContact O-CG1 3.29Å; F528-I532 WeakPolarHBondContact O-CG1 3.38Å; F528-I532 PolarHBondContact O-N 2.68Å; H529-I532 PolarHBondContact O-N 2.83Å; V530-I532 PolarHBondContact O-N 3.28Å; I532-L534 PolarHBondContact O-N 3.47Å; I532-L534 VanDerWaalsContact O-N 3.16Å; I532-V535 PolarHBondContact O-N 2.9Å; I532-W536 WeakPolarHBondContact O-CB 3.44Å; I532-W536 PolarHBondContact O-N 2.99Å; I532-L566 HydrophobicContact CD1-CD1 3.48Å; I532-L566 VanDerWaalsContact CD1-CD1 3.48Å; I532-L566 HydrophobicContact CD1-CD2 4.09Å; I532-L566 HydrophobicContact CD1-CG 4.4Å; I532-L566 HydrophobicContact CG1-CD1 4.13Å
533	T	76	Confident	69	Low	66 Å²	66	50.3 Å²	50.3	41%	0.405	28%	0.278	S	S	.	.	H	α-helix	trans	-61	-26.3	-179.4	53.5	0	0	0	0	113.2	H529 V530 P537	H529-T533 VanDerWaalsContact CE1-CG2 3.43Å; H529-T533 WeakPolarHBondContact CE1-CG2 3.33Å; H529-T533 WeakPolarHBondContact O-CB 3.5Å; H529-T533 VanDerWaalsContact O-CG2 3.26Å; H529-T533 WeakPolarHBondContact O-CG2 3.38Å; H529-T533 PolarHBondContact O-N 2.91Å; H529-T533 PolarHBondContact O-OG1 3.29Å; H529-T533 VanDerWaalsContact O-OG1 3.04Å; V530-T533 WeakPolarHBondContact CA-OG1 3.48Å; V530-T533 PolarHBondContact O-N 2.98Å; V530-T533 PolarHBondContact O-OG1 2.9Å; T533-P537 WeakPolarHBondContact O-CD 3.47Å; T533-P537 WeakPolarHBondContact O-CG 3.3Å
534	L	79.9	Confident	68.2	Low	34 Å²	34	53 Å²	53	18%	0.178	29%	0.292	C	S	.	.	H	α-helix	trans	-78.3	-31.6	175.3	-71.5	171.2	0	0	0	112.6	D476 F477 L479 L483 V530 A531 I532	D476-L534 CarbonylContact C-O 3.59Å; D476-L534 HydrophobicContact CB-CD2 3.85Å; D476-L534 WeakPolarHBondContact O-CB 3.03Å; F477-L534 PolarHBondContact N-O 3.39Å; L479-L534 HydrophobicContact CB-CD1 4.49Å; L479-L534 HydrophobicContact CD2-CD1 3.89Å; L479-L534 HydrophobicContact CG-CD1 4.02Å; L483-L534 HydrophobicContact CD1-CD1 3.89Å; V530-L534 HydrophobicContact CG1-CD1 3.93Å; V530-L534 HydrophobicContact CG1-CG 4.48Å; V530-L534 VanDerWaalsContact O-CG 3.27Å; V530-L534 WeakPolarHBondContact O-CG 3.31Å; V530-L534 PolarHBondContact O-N 3.25Å; V530-L534 VanDerWaalsContact O-N 3.11Å; A531-L534 PolarHBondContact O-N 3.04Å; I532-L534 PolarHBondContact O-N 3.47Å; I532-L534 VanDerWaalsContact O-N 3.16Å
535	V	71	Confident	67.4	Low	5 Å²	5	58.6 Å²	58.6	3%	0.03	32%	0.319	C	S	.	.	H	α-helix	trans	-81.3	-41	178.7	174.8	0	0	0	0	111.6	F477 G480 L481 L484 A531 I532 P537 Q538 V539	F477-V535 HydrophobicContact CD2-CB 4.49Å; F477-V535 HydrophobicContact CD2-CG1 4.05Å; F477-V535 HydrophobicContact CE2-CG1 3.92Å; G480-V535 VanDerWaalsContact C-CG2 3.47Å; L481-V535 HydrophobicContact CG-CG2 4.37Å; L484-V535 HydrophobicContact CD1-CG2 4.07Å; A531-V535 WeakPolarHBondContact O-CG2 3.47Å; A531-V535 PolarHBondContact O-N 2.96Å; I532-V535 PolarHBondContact O-N 2.9Å; V535-P537 VanDerWaalsContact C-CD 3.47Å; V535-Q538 PolarHBondContact O-N 3.34Å; V535-V539 HydrophobicContact CG1-CG2 3.69Å; V535-V539 PolarHBondContact O-N 3.39Å
536	W	69.2	Low	66.2	Low	130 Å²	130	63.3 Å²	63.3	49%	0.492	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-43	-168.9	-163.4	-102.6	0	0	0	115.4	I532 Q538 V539 M540	I532-W536 WeakPolarHBondContact O-CB 3.44Å; I532-W536 PolarHBondContact O-N 2.99Å; W536-Q538 VanDerWaalsContact C-N 3.29Å; W536-Q538 PolarHBondContact O-N 2.88Å; W536-V539 PolarHBondContact O-N 3.39Å; W536-M540 HydrophobicContact CD2-CG 4.49Å; W536-M540 HydrophobicContact CG-CG 4.29Å; W536-M540 HydrophobicContact CZ2-SD 3.99Å; W536-M540 WeakPolarHBondContact O-CG 3.34Å; W536-M540 PolarHBondContact O-N 3.17Å
537	P	71.1	Confident	64.9	Low	75 Å²	75	68 Å²	68	49%	0.487	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-37.8	-177.1	-24.7	34.5	0	0	0	113.1	T533 V535 L541	T533-P537 WeakPolarHBondContact O-CD 3.47Å; T533-P537 WeakPolarHBondContact O-CG 3.3Å; V535-P537 VanDerWaalsContact C-CD 3.47Å; P537-L541 WeakPolarHBondContact O-CB 3.45Å; P537-L541 PolarHBondContact O-N 3.23Å
538	Q	67.6	Low	63.6	Low	27 Å²	27	68.2 Å²	68.2	13%	0.126	36%	0.361	C	S	.	.	H	α-helix	trans	-79.4	-31.2	-179.9	-170.9	151.3	1.9	0	0	112	F477 V535 W536 L541 L542	F477-Q538 HydrophobicContact CB-CB 3.98Å; F477-Q538 HydrophobicContact CB-CG 4.35Å; F477-Q538 HydrophobicContact CD2-CB 3.74Å; F477-Q538 HydrophobicContact CD2-CG 4.14Å; F477-Q538 HydrophobicContact CE2-CB 4.48Å; F477-Q538 HydrophobicContact CG-CB 4.03Å; F477-Q538 HydrophobicContact CG-CG 4.17Å; V535-Q538 PolarHBondContact O-N 3.34Å; W536-Q538 VanDerWaalsContact C-N 3.29Å; W536-Q538 PolarHBondContact O-N 2.88Å; Q538-L541 PolarHBondContact O-N 2.94Å; Q538-L542 HydrophobicContact CG-CD1 4.45Å; Q538-L542 WeakPolarHBondContact O-CB 3.1Å; Q538-L542 WeakPolarHBondContact O-CD1 3.47Å; Q538-L542 VanDerWaalsContact O-CG 3.3Å; Q538-L542 WeakPolarHBondContact O-CG 3.35Å; Q538-L542 PolarHBondContact O-N 3.39Å
539	V	63.6	Low	62.5	Low	4 Å²	4	75.5 Å²	75.5	2%	0.024	40%	0.399	C	S	.	.	H	α-helix	trans	-63	-44.1	169.9	176.5	0	0	0	0	110.7	F477 V535 W536 L542 S543 I555 L558 I559	F477-V539 HydrophobicContact CE2-CG2 4.37Å; V535-V539 HydrophobicContact CG1-CG2 3.69Å; V535-V539 PolarHBondContact O-N 3.39Å; W536-V539 PolarHBondContact O-N 3.39Å; V539-L542 PolarHBondContact O-N 3.28Å; V539-S543 PolarHBondContact O-N 2.85Å; V539-I555 HydrophobicContact CG1-CG2 3.96Å; V539-L558 HydrophobicContact CG2-CD2 3.95Å; V539-I559 HydrophobicContact CG1-CD1 3.85Å; V539-I559 HydrophobicContact CG1-CG1 3.65Å
540	M	62.3	Low	61	Low	73 Å²	73	76.4 Å²	76.4	36%	0.36	40%	0.402	S	S	.	.	H	α-helix	trans	-64.7	-38	175	-70.9	-64.4	-60.2	0	0	112.3	W536 L542 S543 N544	W536-M540 HydrophobicContact CD2-CG 4.49Å; W536-M540 HydrophobicContact CG-CG 4.29Å; W536-M540 HydrophobicContact CZ2-SD 3.99Å; W536-M540 WeakPolarHBondContact O-CG 3.34Å; W536-M540 PolarHBondContact O-N 3.17Å; M540-L542 VanDerWaalsContact C-N 3.35Å; M540-S543 WeakPolarHBondContact CA-OG 3.16Å; M540-S543 PolarHBondContact O-N 2.84Å; M540-S543 PolarHBondContact O-OG 2.78Å; M540-N544 WeakPolarHBondContact O-CB 3.31Å; M540-N544 VanDerWaalsContact O-CG 3.23Å; M540-N544 PolarHBondContact O-N 3.45Å; M540-N544 PolarHBondContact O-OD1 2.86Å
541	L	63.2	Low	59.4	Low	114 Å²	114	74.2 Å²	74.2	60%	0.597	39%	0.388	S	S	*	.	H	α-helix	trans	-67.4	-38.8	176.9	-167.5	134.5	0	0	0	111.3	P537 Q538 M545	P537-L541 WeakPolarHBondContact O-CB 3.45Å; P537-L541 PolarHBondContact O-N 3.23Å; Q538-L541 PolarHBondContact O-N 2.94Å; L541-M545 WeakPolarHBondContact O-CG 3.45Å
542	L	58.4	Low	57.9	Low	40 Å²	40	78 Å²	78	21%	0.209	41%	0.408	C	S	.	.	H	α-helix	trans	-65.6	-37.9	172.1	-72	162.1	0	0	0	111.3	Q538 V539 M540 N544 M545 I555	Q538-L542 HydrophobicContact CG-CD1 4.45Å; Q538-L542 WeakPolarHBondContact O-CB 3.1Å; Q538-L542 WeakPolarHBondContact O-CD1 3.47Å; Q538-L542 VanDerWaalsContact O-CG 3.3Å; Q538-L542 WeakPolarHBondContact O-CG 3.35Å; Q538-L542 PolarHBondContact O-N 3.39Å; V539-L542 PolarHBondContact O-N 3.28Å; M540-L542 VanDerWaalsContact C-N 3.35Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 3.27Å; L542-M545 PolarHBondContact O-N 3.2Å; L542-I555 HydrophobicContact CB-CD1 3.88Å; L542-I555 HydrophobicContact CB-CG1 4Å; L542-I555 WeakPolarHBondContact O-CD1 3.23Å
543	S	52.9	Low	56.8	Low	34 Å²	34	77.4 Å²	77.4	24%	0.238	41%	0.41	C	S	.	.	H	α-helix	trans	-71.5	-27	179.7	75.2	0	0	0	0	114.2	V539 M540 I555	V539-S543 PolarHBondContact O-N 2.85Å; M540-S543 WeakPolarHBondContact CA-OG 3.16Å; M540-S543 PolarHBondContact O-N 2.84Å; M540-S543 PolarHBondContact O-OG 2.78Å; S543-I555 VanDerWaalsContact CA-CD1 3.5Å
544	N	54.9	Low	55.4	Low	105 Å²	105	76.8 Å²	76.8	56%	0.561	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-1.3	-179.4	-69.2	-0.7	0	0	0	113.1	M540 L542 D546	M540-N544 WeakPolarHBondContact O-CB 3.31Å; M540-N544 VanDerWaalsContact O-CG 3.23Å; M540-N544 PolarHBondContact O-N 3.45Å; M540-N544 PolarHBondContact O-OD1 2.86Å; L542-N544 VanDerWaalsContact C-N 3.34Å; L542-N544 PolarHBondContact O-N 3.27Å; N544-D546 PolarHBondContact O-N 3.48Å
545	M	52.1	Low	54	Low	130 Å²	130	75.8 Å²	75.8	64%	0.64	40%	0.398	S	S	*	.	S	Bend	trans	-79.9	76.4	169.9	-66.8	-73	-76	0	0	108.2	L541 L542 T547 L551	L541-M545 WeakPolarHBondContact O-CG 3.45Å; L542-M545 PolarHBondContact O-N 3.2Å; M545-T547 PolarHBondContact O-N 2.82Å; M545-L551 HydrophobicContact CB-CD2 4.34Å
546	D	39.4	Very low	53	Low	139 Å²	139	80 Å²	80	74%	0.743	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	113.8	175.4	-72.2	-41.1	0	0	0	111.2	N544	N544-D546 PolarHBondContact O-N 3.48Å
547	T	45.2	Very low	52.1	Low	134 Å²	134	78.2 Å²	78.2	82%	0.822	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	178.4	-20.4	133.5	42.8	0	0	0	0	114.7	M545	M545-T547 PolarHBondContact O-N 2.82Å
548	D	48	Very low	51.1	Low	54 Å²	54	75.5 Å²	75.5	29%	0.289	40%	0.395	S	S	.	.			trans	-111.4	120.2	-173.1	-69.4	-33.1	0	0	0	113.9	T462 F550 L551	T462-D548 WeakPolarHBondContact CG2-OD2 3.28Å; D548-F550 PolarHBondContact O-N 3.38Å; D548-L551 PolarHBondContact O-N 3.48Å
549	L	44.2	Very low	50.4	Low	161 Å²	161	75.8 Å²	75.8	84%	0.843	40%	0.397	S	S	*	.	H	α-helix	trans	-51.2	-26.7	174.1	-132.3	95.9	0	0	0	112.8
550	F	40.4	Very low	49.7	Very low	142 Å²	142	79.1 Å²	79.1	62%	0.623	41%	0.412	S	S	*	.	H	α-helix	trans	-77.1	-28.1	177.1	-91.7	-85.7	0	0	0	114.3	D548 S553 N554	D548-F550 PolarHBondContact O-N 3.38Å; F550-S553 PolarHBondContact O-OG 2.99Å; F550-N554 PolarHBondContact O-ND2 2.86Å
551	L	43.8	Very low	49.1	Very low	28 Å²	28	78.8 Å²	78.8	15%	0.147	41%	0.409	C	S	.	.	H	α-helix	trans	-74.6	-36.1	177.5	-147.6	87.6	0	0	0	110.5	M545 D548 S553 N554 I555	M545-L551 HydrophobicContact CB-CD2 4.34Å; D548-L551 PolarHBondContact O-N 3.48Å; L551-S553 PolarHBondContact O-N 2.81Å; L551-N554 PolarHBondContact O-N 3.47Å; L551-I555 HydrophobicContact CD2-CD1 4.33Å; L551-I555 HydrophobicContact CG-CD1 4.46Å; L551-I555 WeakPolarHBondContact O-CD1 3.4Å; L551-I555 WeakPolarHBondContact O-CG1 3.44Å; L551-I555 PolarHBondContact O-N 3.42Å; L551-I555 VanDerWaalsContact O-N 3.12Å
552	N	43.5	Very low	48.6	Very low	79 Å²	79	74.3 Å²	74.3	42%	0.422	39%	0.387	S	S	.	.	H	α-helix	trans	-59.4	-46.8	176.8	-85	-16.8	0	0	0	112.2	N554 I555 Y556	N552-N554 PolarHBondContact O-N 3.32Å; N552-I555 PolarHBondContact O-N 2.84Å; N552-Y556 HydrophobicContact CB-CE2 4.33Å; N552-Y556 WeakPolarHBondContact O-CD2 3.24Å; N552-Y556 PolarHBondContact O-N 3.43Å; N552-Y556 VanDerWaalsContact O-N 3.11Å
553	S	45.3	Very low	48.3	Very low	52 Å²	52	75.1 Å²	75.1	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-34.7	177.3	54.6	0	0	0	0	112.9	F550 L551 Y556 I557	F550-S553 PolarHBondContact O-OG 2.99Å; L551-S553 PolarHBondContact O-N 2.81Å; S553-Y556 WeakPolarHBondContact O-CB 3.14Å; S553-Y556 PolarHBondContact O-N 3.31Å; S553-I557 WeakPolarHBondContact O-CG1 3.46Å; S553-I557 PolarHBondContact O-N 3.3Å
554	N	48.4	Very low	48	Very low	52 Å²	52	75.4 Å²	75.4	28%	0.278	39%	0.393	S	S	.	.	H	α-helix	trans	-78.3	-32.5	-175.7	-65.6	-15.2	0	0	0	112.5	F550 L551 N552 Y556 I557 L558	F550-N554 PolarHBondContact O-ND2 2.86Å; L551-N554 PolarHBondContact O-N 3.47Å; N552-N554 PolarHBondContact O-N 3.32Å; N554-Y556 VanDerWaalsContact C-N 3.33Å; N554-I557 WeakPolarHBondContact O-CB 3.13Å; N554-I557 PolarHBondContact O-N 2.97Å; N554-L558 PolarHBondContact O-N 3.41Å
555	I	50.7	Low	47.7	Very low	13 Å²	13	70.5 Å²	70.5	7%	0.067	37%	0.367	C	S	.	.	H	α-helix	trans	-67.8	-38.7	171.4	-64.8	160.8	0	0	0	110	V539 L542 S543 L551 N552 I557 L558 I559	V539-I555 HydrophobicContact CG1-CG2 3.96Å; L542-I555 HydrophobicContact CB-CD1 3.88Å; L542-I555 HydrophobicContact CB-CG1 4Å; L542-I555 WeakPolarHBondContact O-CD1 3.23Å; S543-I555 VanDerWaalsContact CA-CD1 3.5Å; L551-I555 HydrophobicContact CD2-CD1 4.33Å; L551-I555 HydrophobicContact CG-CD1 4.46Å; L551-I555 WeakPolarHBondContact O-CD1 3.4Å; L551-I555 WeakPolarHBondContact O-CG1 3.44Å; L551-I555 PolarHBondContact O-N 3.42Å; L551-I555 VanDerWaalsContact O-N 3.12Å; N552-I555 PolarHBondContact O-N 2.84Å; I555-I557 VanDerWaalsContact C-N 3.31Å; I555-I557 PolarHBondContact O-N 2.94Å; I555-L558 PolarHBondContact O-N 2.94Å; I555-I559 HydrophobicContact CG2-CD1 3.83Å; I555-I559 HydrophobicContact CG2-CG1 4.41Å; I555-I559 WeakPolarHBondContact O-CB 3.04Å; I555-I559 VanDerWaalsContact O-CG1 3.24Å; I555-I559 WeakPolarHBondContact O-CG1 3.35Å; I555-I559 PolarHBondContact O-N 3.45Å
556	Y	49.2	Very low	47.6	Very low	95 Å²	95	66 Å²	66	37%	0.373	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-36.7	171.1	-71	-62.6	0	0	0	112.5	N552 S553 N554 I559 Q560 L613	N552-Y556 HydrophobicContact CB-CE2 4.33Å; N552-Y556 WeakPolarHBondContact O-CD2 3.24Å; N552-Y556 PolarHBondContact O-N 3.43Å; N552-Y556 VanDerWaalsContact O-N 3.11Å; S553-Y556 WeakPolarHBondContact O-CB 3.14Å; S553-Y556 PolarHBondContact O-N 3.31Å; N554-Y556 VanDerWaalsContact C-N 3.33Å; Y556-I559 PolarHBondContact O-N 3.35Å; Y556-Q560 WeakPolarHBondContact O-CB 3.2Å; Y556-Q560 PolarHBondContact O-N 3.17Å; Y556-L613 HydrophobicContact CE1-CD1 4.08Å
557	I	50.3	Low	48.1	Very low	92 Å²	92	59.9 Å²	59.9	47%	0.472	31%	0.313	S	S	.	.	H	α-helix	trans	-65.6	-42.1	174.2	-68.3	164.4	0	0	0	111.3	S553 N554 I555 Q560 F561	S553-I557 WeakPolarHBondContact O-CG1 3.46Å; S553-I557 PolarHBondContact O-N 3.3Å; N554-I557 WeakPolarHBondContact O-CB 3.13Å; N554-I557 PolarHBondContact O-N 2.97Å; I555-I557 VanDerWaalsContact C-N 3.31Å; I555-I557 PolarHBondContact O-N 2.94Å; I557-Q560 CarbonylContact O-C 3.55Å; I557-Q560 WeakPolarHBondContact O-CB 3.2Å; I557-Q560 PolarHBondContact O-N 3.5Å; I557-F561 WeakPolarHBondContact O-CB 3.3Å; I557-F561 PolarHBondContact O-N 2.74Å
558	L	50.5	Low	48.1	Very low	18 Å²	18	56.1 Å²	56.1	9%	0.094	29%	0.29	C	S	.	.	H	α-helix	trans	-68.1	-39.4	177.4	-172.2	68.8	0	0	0	112	I454 F477 V539 N554 I555 Q560 F561 S562	I454-L558 HydrophobicContact CD1-CD1 3.81Å; F477-L558 HydrophobicContact CE2-CD2 4.03Å; F477-L558 HydrophobicContact CZ-CD2 3.95Å; V539-L558 HydrophobicContact CG2-CD2 3.95Å; N554-L558 PolarHBondContact O-N 3.41Å; I555-L558 PolarHBondContact O-N 2.94Å; L558-Q560 VanDerWaalsContact C-N 3.33Å; L558-F561 PolarHBondContact O-N 3.35Å; L558-S562 WeakPolarHBondContact O-CB 3.28Å; L558-S562 PolarHBondContact O-N 2.84Å; L558-S562 PolarHBondContact O-OG 2.9Å
559	I	52.6	Low	48	Very low	33 Å²	33	53.6 Å²	53.6	17%	0.169	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-43.1	171	-68.9	168.2	0	0	0	109.7	V539 I555 Y556 F561 S562 I563	V539-I559 HydrophobicContact CG1-CD1 3.85Å; V539-I559 HydrophobicContact CG1-CG1 3.65Å; I555-I559 HydrophobicContact CG2-CD1 3.83Å; I555-I559 HydrophobicContact CG2-CG1 4.41Å; I555-I559 WeakPolarHBondContact O-CB 3.04Å; I555-I559 VanDerWaalsContact O-CG1 3.24Å; I555-I559 WeakPolarHBondContact O-CG1 3.35Å; I555-I559 PolarHBondContact O-N 3.45Å; Y556-I559 PolarHBondContact O-N 3.35Å; I559-F561 PolarHBondContact O-N 2.89Å; I559-S562 WeakPolarHBondContact CA-OG 3.14Å; I559-S562 PolarHBondContact O-N 3.43Å; I559-S562 PolarHBondContact O-OG 2.85Å; I559-I563 HydrophobicContact CG2-CD1 3.55Å; I559-I563 HydrophobicContact CG2-CG1 4.23Å; I559-I563 WeakPolarHBondContact O-CB 3.23Å; I559-I563 WeakPolarHBondContact O-CG1 3.45Å; I559-I563 PolarHBondContact O-N 3.38Å
560	Q	48.4	Very low	48.2	Very low	73 Å²	73	49.2 Å²	49.2	34%	0.341	25%	0.253	S	S	.	.	H	α-helix	trans	-66.1	-38.3	177	-168.9	179.9	12.3	0	0	112.2	Y556 I557 L558 S564 N607	Y556-Q560 WeakPolarHBondContact O-CB 3.2Å; Y556-Q560 PolarHBondContact O-N 3.17Å; I557-Q560 CarbonylContact O-C 3.55Å; I557-Q560 WeakPolarHBondContact O-CB 3.2Å; I557-Q560 PolarHBondContact O-N 3.5Å; L558-Q560 VanDerWaalsContact C-N 3.33Å; Q560-S564 WeakPolarHBondContact O-CB 3.45Å; Q560-S564 PolarHBondContact O-N 3.01Å; Q560-S564 PolarHBondContact O-OG 2.73Å; Q560-N607 PolarHBondContact NE2-OD1 3.42Å
561	F	50.8	Low	48.5	Very low	67 Å²	67	43.2 Å²	43.2	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-65	-46.3	174.2	-176.7	-93.7	0	0	0	110.9	L450 L485 I557 L558 I559 S564 C565	L450-F561 HydrophobicContact CD1-CD1 3.53Å; L450-F561 HydrophobicContact CD1-CD2 4.3Å; L450-F561 HydrophobicContact CD1-CE1 3.14Å; L450-F561 HydrophobicContact CD1-CE2 3.98Å; L450-F561 HydrophobicContact CD1-CG 4.1Å; L450-F561 HydrophobicContact CD1-CZ 3.39Å; L485-F561 HydrophobicContact CD2-CE1 4.27Å; L485-F561 HydrophobicContact CD2-CZ 4.03Å; I557-F561 WeakPolarHBondContact O-CB 3.3Å; I557-F561 PolarHBondContact O-N 2.74Å; L558-F561 PolarHBondContact O-N 3.35Å; I559-F561 PolarHBondContact O-N 2.89Å; F561-S564 WeakPolarHBondContact CA-OG 3.45Å; F561-S564 PolarHBondContact O-N 3.23Å; F561-S564 PolarHBondContact O-OG 3.26Å; F561-C565 WeakPolarHBondContact CE1-SG 3.26Å; F561-C565 VanDerWaalsContact CZ-SG 3.5Å; F561-C565 VanDerWaalsContact O-CB 3.31Å; F561-C565 WeakPolarHBondContact O-CB 3.4Å; F561-C565 PolarHBondContact O-N 3.5Å; F561-C565 PolarHBondContact O-SG 3.44Å
562	S	50.9	Low	48.5	Very low	20 Å²	20	45.9 Å²	45.9	14%	0.14	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-40.6	177.8	55.3	0	0	0	0	112.7	L558 I559 C565 L566	L558-S562 WeakPolarHBondContact O-CB 3.28Å; L558-S562 PolarHBondContact O-N 2.84Å; L558-S562 PolarHBondContact O-OG 2.9Å; I559-S562 WeakPolarHBondContact CA-OG 3.14Å; I559-S562 PolarHBondContact O-N 3.43Å; I559-S562 PolarHBondContact O-OG 2.85Å; S562-C565 PolarHBondContact O-N 3.48Å; S562-L566 VanDerWaalsContact O-CB 3.3Å; S562-L566 WeakPolarHBondContact O-CB 2.96Å; S562-L566 PolarHBondContact O-N 3.18Å
563	I	52.3	Low	48.8	Very low	56 Å²	56	42.3 Å²	42.3	29%	0.287	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-45.6	172.8	-68.2	170.3	0	0	0	110.4	I559 C565 L566 V567	I559-I563 HydrophobicContact CG2-CD1 3.55Å; I559-I563 HydrophobicContact CG2-CG1 4.23Å; I559-I563 WeakPolarHBondContact O-CB 3.23Å; I559-I563 WeakPolarHBondContact O-CG1 3.45Å; I559-I563 PolarHBondContact O-N 3.38Å; I563-C565 VanDerWaalsContact C-N 3.35Å; I563-C565 PolarHBondContact O-N 2.73Å; I563-L566 CarbonylContact O-C 3.56Å; I563-L566 WeakPolarHBondContact O-CB 3.43Å; I563-L566 PolarHBondContact O-N 2.65Å; I563-L566 VanDerWaalsContact O-N 3.16Å; I563-V567 HydrophobicContact CG2-CG2 3.93Å; I563-V567 VanDerWaalsContact O-CB 3.3Å; I563-V567 WeakPolarHBondContact O-CB 3.44Å; I563-V567 WeakPolarHBondContact O-CG2 2.76Å; I563-V567 PolarHBondContact O-N 2.81Å
564	S	47.2	Very low	48.8	Very low	40 Å²	40	43.6 Å²	43.6	28%	0.28	23%	0.227	S	C	.	.	H	α-helix	trans	-65.2	-38.6	178.3	62	0	0	0	0	111.6	Q560 F561 V567 T568	Q560-S564 WeakPolarHBondContact O-CB 3.45Å; Q560-S564 PolarHBondContact O-N 3.01Å; Q560-S564 PolarHBondContact O-OG 2.73Å; F561-S564 WeakPolarHBondContact CA-OG 3.45Å; F561-S564 PolarHBondContact O-N 3.23Å; F561-S564 PolarHBondContact O-OG 3.26Å; S564-V567 PolarHBondContact O-N 2.9Å; S564-T568 VanDerWaalsContact O-CB 3.25Å; S564-T568 WeakPolarHBondContact O-CB 3.23Å; S564-T568 VanDerWaalsContact O-CG2 3.26Å; S564-T568 WeakPolarHBondContact O-CG2 3.38Å; S564-T568 PolarHBondContact O-N 3.44Å; S564-T568 PolarHBondContact O-OG1 2.86Å
565	C	48.2	Very low	48.6	Very low	2 Å²	2	41.9 Å²	41.9	1%	0.014	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-42	170.3	-75.2	0	0	0	0	112.1	L488 F561 S562 I563 T568 S569	L488-C565 HydrophobicContact CD1-CB 4.17Å; F561-C565 WeakPolarHBondContact CE1-SG 3.26Å; F561-C565 VanDerWaalsContact CZ-SG 3.5Å; F561-C565 VanDerWaalsContact O-CB 3.31Å; F561-C565 WeakPolarHBondContact O-CB 3.4Å; F561-C565 PolarHBondContact O-N 3.5Å; F561-C565 PolarHBondContact O-SG 3.44Å; S562-C565 PolarHBondContact O-N 3.48Å; I563-C565 VanDerWaalsContact C-N 3.35Å; I563-C565 PolarHBondContact O-N 2.73Å; C565-T568 WeakPolarHBondContact CA-OG1 3.27Å; C565-T568 PolarHBondContact O-OG1 2.9Å; C565-S569 WeakPolarHBondContact O-CB 3.35Å; C565-S569 PolarHBondContact O-N 3.28Å; C565-S569 PolarHBondContact O-OG 2.91Å
566	L	50.1	Low	48.3	Very low	36 Å²	36	42.8 Å²	42.8	19%	0.188	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-49.3	176.1	-170.5	85.2	0	0	0	111.3	L484 F528 I532 S562 I563 S569 L570	L484-L566 HydrophobicContact CD2-CD1 4.48Å; F528-L566 HydrophobicContact CB-CD1 3.75Å; F528-L566 HydrophobicContact CD1-CD1 3.64Å; F528-L566 HydrophobicContact CG-CD1 3.82Å; I532-L566 HydrophobicContact CD1-CD1 3.48Å; I532-L566 VanDerWaalsContact CD1-CD1 3.48Å; I532-L566 HydrophobicContact CD1-CD2 4.09Å; I532-L566 HydrophobicContact CD1-CG 4.4Å; I532-L566 HydrophobicContact CG1-CD1 4.13Å; S562-L566 VanDerWaalsContact O-CB 3.3Å; S562-L566 WeakPolarHBondContact O-CB 2.96Å; S562-L566 PolarHBondContact O-N 3.18Å; I563-L566 CarbonylContact O-C 3.56Å; I563-L566 WeakPolarHBondContact O-CB 3.43Å; I563-L566 PolarHBondContact O-N 2.65Å; I563-L566 VanDerWaalsContact O-N 3.16Å; L566-S569 WeakPolarHBondContact CA-OG 3.48Å; L566-S569 PolarHBondContact O-N 3.42Å; L566-S569 PolarHBondContact O-OG 3.31Å; L566-L570 HydrophobicContact CD2-CD1 4.26Å; L566-L570 HydrophobicContact CG-CD1 4.01Å; L566-L570 VanDerWaalsContact O-CB 3.26Å; L566-L570 WeakPolarHBondContact O-CB 3.48Å; L566-L570 VanDerWaalsContact O-CG 3.28Å; L566-L570 WeakPolarHBondContact O-CG 3.28Å; L566-L570 PolarHBondContact O-N 3.44Å
567	V	49.3	Very low	48.1	Very low	10 Å²	10	39.1 Å²	39.1	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-43.4	-178.5	173.7	0	0	0	0	110.1	I563 S564 A571 L599 L602 T603	I563-V567 HydrophobicContact CG2-CG2 3.93Å; I563-V567 VanDerWaalsContact O-CB 3.3Å; I563-V567 WeakPolarHBondContact O-CB 3.44Å; I563-V567 WeakPolarHBondContact O-CG2 2.76Å; I563-V567 PolarHBondContact O-N 2.81Å; S564-V567 PolarHBondContact O-N 2.9Å; V567-A571 VanDerWaalsContact O-CB 3.31Å; V567-A571 WeakPolarHBondContact O-CB 3.38Å; V567-A571 PolarHBondContact O-N 3.05Å; V567-L599 HydrophobicContact CB-CD2 4.46Å; V567-L599 HydrophobicContact CG1-CD2 3.42Å; V567-L599 VanDerWaalsContact CG1-CD2 3.42Å; V567-L599 WeakPolarHBondContact O-CD2 3.16Å; V567-L602 HydrophobicContact CG1-CD2 4.28Å; V567-L602 HydrophobicContact CG2-CD2 4.43Å; V567-T603 HydrophobicContact CG1-CG2 4.07Å
568	T	46.5	Very low	47.7	Very low	56 Å²	56	38.9 Å²	38.9	34%	0.344	21%	0.213	S	C	.	.	H	α-helix	trans	-68.4	-38.6	175.8	50.6	0	0	0	0	112.8	L488 S564 C565 A571 L572	L488-T568 WeakPolarHBondContact CD1-OG1 3.38Å; S564-T568 VanDerWaalsContact O-CB 3.25Å; S564-T568 WeakPolarHBondContact O-CB 3.23Å; S564-T568 VanDerWaalsContact O-CG2 3.26Å; S564-T568 WeakPolarHBondContact O-CG2 3.38Å; S564-T568 PolarHBondContact O-N 3.44Å; S564-T568 PolarHBondContact O-OG1 2.86Å; C565-T568 WeakPolarHBondContact CA-OG1 3.27Å; C565-T568 PolarHBondContact O-OG1 2.9Å; T568-A571 WeakPolarHBondContact O-CB 3.2Å; T568-A571 PolarHBondContact O-N 3.17Å; T568-L572 VanDerWaalsContact O-CG 3.26Å; T568-L572 WeakPolarHBondContact O-CG 3.49Å; T568-L572 PolarHBondContact O-N 3.45Å
569	S	44.9	Very low	47.2	Very low	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-69.4	-40.6	175.9	61.2	0	0	0	0	111.7	F528 C565 L566 A571 L572 I573	F528-S569 WeakPolarHBondContact CE1-OG 3.31Å; F528-S569 WeakPolarHBondContact CZ-OG 3.35Å; C565-S569 WeakPolarHBondContact O-CB 3.35Å; C565-S569 PolarHBondContact O-N 3.28Å; C565-S569 PolarHBondContact O-OG 2.91Å; L566-S569 WeakPolarHBondContact CA-OG 3.48Å; L566-S569 PolarHBondContact O-N 3.42Å; L566-S569 PolarHBondContact O-OG 3.31Å; S569-A571 VanDerWaalsContact C-N 3.3Å; S569-A571 PolarHBondContact O-N 3.41Å; S569-L572 PolarHBondContact O-N 3.13Å; S569-I573 WeakPolarHBondContact O-CB 3.31Å; S569-I573 WeakPolarHBondContact O-CD1 3.16Å; S569-I573 WeakPolarHBondContact O-CG1 3.41Å; S569-I573 PolarHBondContact O-N 3.03Å
570	L	49.3	Very low	46.5	Very low	70 Å²	70	42.2 Å²	42.2	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-58.3	-41.3	167.1	-77.7	165.3	0	0	0	111.1	L566 L572 I573 L574	L566-L570 HydrophobicContact CD2-CD1 4.26Å; L566-L570 HydrophobicContact CG-CD1 4.01Å; L566-L570 VanDerWaalsContact O-CB 3.26Å; L566-L570 WeakPolarHBondContact O-CB 3.48Å; L566-L570 VanDerWaalsContact O-CG 3.28Å; L566-L570 WeakPolarHBondContact O-CG 3.28Å; L566-L570 PolarHBondContact O-N 3.44Å; L570-L572 VanDerWaalsContact C-N 3.31Å; L570-L572 PolarHBondContact O-N 3.11Å; L570-I573 PolarHBondContact O-N 2.97Å; L570-L574 VanDerWaalsContact O-CB 3.29Å; L570-L574 WeakPolarHBondContact O-CB 3.44Å; L570-L574 PolarHBondContact O-N 3.46Å
571	A	46.3	Very low	45.8	Very low	16 Å²	16	45.1 Å²	45.1	13%	0.132	25%	0.249	C	C	.	.	H	α-helix	trans	-62.9	-35.1	176.8	0	0	0	0	0	114.1	V567 T568 S569 P575 L599	V567-A571 VanDerWaalsContact O-CB 3.31Å; V567-A571 WeakPolarHBondContact O-CB 3.38Å; V567-A571 PolarHBondContact O-N 3.05Å; T568-A571 WeakPolarHBondContact O-CB 3.2Å; T568-A571 PolarHBondContact O-N 3.17Å; S569-A571 VanDerWaalsContact C-N 3.3Å; S569-A571 PolarHBondContact O-N 3.41Å; A571-P575 WeakPolarHBondContact O-CD 3.17Å; A571-P575 WeakPolarHBondContact O-CG 3.42Å; A571-L599 HydrophobicContact CB-CB 3.97Å; A571-L599 HydrophobicContact CB-CD1 3.4Å; A571-L599 HydrophobicContact CB-CD2 3.61Å; A571-L599 HydrophobicContact CB-CG 3.78Å
572	L	44.7	Very low	45.2	Very low	84 Å²	84	49.5 Å²	49.5	44%	0.44	28%	0.275	S	S	.	.	H	α-helix	trans	-77.4	-31.7	177.1	-69.5	165.7	0	0	0	111.4	T568 S569 L570	T568-L572 VanDerWaalsContact O-CG 3.26Å; T568-L572 WeakPolarHBondContact O-CG 3.49Å; T568-L572 PolarHBondContact O-N 3.45Å; S569-L572 PolarHBondContact O-N 3.13Å; L570-L572 VanDerWaalsContact C-N 3.31Å; L570-L572 PolarHBondContact O-N 3.11Å
573	I	48.1	Very low	44.3	Very low	3 Å²	3	52.5 Å²	52.5	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-85.8	-40.2	-176.2	-67.2	164.8	0	0	0	112	I524 F528 S569 L570 P575 S576 V577	I524-I573 HydrophobicContact CD1-CG2 3.4Å; I524-I573 HydrophobicContact CG1-CG2 4.18Å; I524-I573 HydrophobicContact CG2-CD1 4.35Å; I524-I573 HydrophobicContact CG2-CG2 4.07Å; F528-I573 HydrophobicContact CE2-CD1 3.49Å; F528-I573 VanDerWaalsContact CE2-CD1 3.49Å; F528-I573 HydrophobicContact CZ-CD1 3.59Å; S569-I573 WeakPolarHBondContact O-CB 3.31Å; S569-I573 WeakPolarHBondContact O-CD1 3.16Å; S569-I573 WeakPolarHBondContact O-CG1 3.41Å; S569-I573 PolarHBondContact O-N 3.03Å; L570-I573 PolarHBondContact O-N 2.97Å; I573-P575 VanDerWaalsContact C-CD 3.5Å; I573-S576 CarbonylContact O-C 3.33Å; I573-S576 WeakPolarHBondContact O-CA 3.49Å; I573-S576 WeakPolarHBondContact O-CB 3.44Å; I573-S576 PolarHBondContact O-N 3.4Å; I573-S576 PolarHBondContact O-OG 3.41Å; I573-V577 HydrophobicContact CG2-CG2 3.57Å; I573-V577 WeakPolarHBondContact O-CG2 3.27Å; I573-V577 PolarHBondContact O-N 3.28Å
574	L	46.4	Very low	43.6	Very low	79 Å²	79	53.3 Å²	53.3	41%	0.414	30%	0.299	S	S	.	.	H	α-helix	trans	-55	-43.3	-174.7	-159.2	74.7	0	0	0	113.8	L570 S576 V577 L578	L570-L574 VanDerWaalsContact O-CB 3.29Å; L570-L574 WeakPolarHBondContact O-CB 3.44Å; L570-L574 PolarHBondContact O-N 3.46Å; L574-S576 PolarHBondContact O-N 3.47Å; L574-V577 PolarHBondContact O-N 3.29Å; L574-V577 VanDerWaalsContact O-N 3.14Å; L574-L578 HydrophobicContact CG-CD1 4.19Å; L574-L578 PolarHBondContact O-N 3.29Å; L574-L578 VanDerWaalsContact O-N 3.08Å
575	P	43.7	Very low	42.9	Very low	16 Å²	16	63 Å²	63	10%	0.104	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-25.4	175.9	-19.4	31.6	0	0	0	113.6	A571 I573 R592 A595	A571-P575 WeakPolarHBondContact O-CD 3.17Å; A571-P575 WeakPolarHBondContact O-CG 3.42Å; I573-P575 VanDerWaalsContact C-CD 3.5Å; P575-R592 HydrophobicContact CB-CB 4.43Å; P575-R592 HydrophobicContact CB-CG 3.49Å; P575-R592 VanDerWaalsContact CB-CG 3.49Å; P575-R592 HydrophobicContact CG-CG 4.11Å; P575-A595 HydrophobicContact CG-CB 4.06Å
576	S	45.5	Very low	42.2	Very low	32 Å²	32	69.3 Å²	69.3	22%	0.224	36%	0.359	C	S	.	.	H	α-helix	trans	-86.6	-19.8	177.3	72.3	0	0	0	0	113.5	C495 I573 L574	C495-S576 PolarHBondContact SG-OG 3.29Å; I573-S576 CarbonylContact O-C 3.33Å; I573-S576 WeakPolarHBondContact O-CA 3.49Å; I573-S576 WeakPolarHBondContact O-CB 3.44Å; I573-S576 PolarHBondContact O-N 3.4Å; I573-S576 PolarHBondContact O-OG 3.41Å; L574-S576 PolarHBondContact O-N 3.47Å
577	V	43.2	Very low	41.5	Very low	19 Å²	19	70.4 Å²	70.4	12%	0.115	36%	0.364	C	S	.	.	H	α-helix	trans	-81.6	-37.7	174.2	176.2	0	0	0	0	111.3	I524 I573 L574 N579	I524-V577 HydrophobicContact CD1-CG2 3.33Å; I573-V577 HydrophobicContact CG2-CG2 3.57Å; I573-V577 WeakPolarHBondContact O-CG2 3.27Å; I573-V577 PolarHBondContact O-N 3.28Å; L574-V577 PolarHBondContact O-N 3.29Å; L574-V577 VanDerWaalsContact O-N 3.14Å; V577-N579 PolarHBondContact O-N 3.24Å
578	L	42.1	Very low	40.9	Very low	87 Å²	87	72 Å²	72	46%	0.455	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	13.6	-178.4	-75.8	164.1	0	0	0	115.1	L574 L580	L574-L578 HydrophobicContact CG-CD1 4.19Å; L574-L578 PolarHBondContact O-N 3.29Å; L574-L578 VanDerWaalsContact O-N 3.08Å; L578-L580 HydrophobicContact CB-CD1 3.88Å; L578-L580 PolarHBondContact O-N 3.06Å
579	N	41.3	Very low	40.4	Very low	85 Å²	85	70.7 Å²	70.7	46%	0.455	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	42.4	39.8	168.8	-147.9	20.7	0	0	0	115.9	V577 N581	V577-N579 PolarHBondContact O-N 3.24Å; N579-N581 PolarHBondContact O-N 2.94Å
580	L	37.1	Very low	40.1	Very low	36 Å²	36	72.9 Å²	72.9	19%	0.188	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-73.3	9.6	179.6	-85.7	127.3	0	0	0	114.5	L578 L582 I583 S591	L578-L580 HydrophobicContact CB-CD1 3.88Å; L578-L580 PolarHBondContact O-N 3.06Å; L580-L582 PolarHBondContact O-N 2.97Å; L580-L582 VanDerWaalsContact O-N 3.16Å; L580-I583 HydrophobicContact CD2-CD1 4.08Å; L580-I583 PolarHBondContact O-N 2.84Å; L580-S591 VanDerWaalsContact CD1-OG 3.23Å; L580-S591 WeakPolarHBondContact CD1-OG 3.36Å
581	N	34.3	Very low	39.7	Very low	134 Å²	134	70.8 Å²	70.8	72%	0.717	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-70	-4.8	178.5	-79.7	-3.1	0	0	0	114.1	N579	N579-N581 PolarHBondContact O-N 2.94Å
582	L	37.3	Very low	39.4	Very low	159 Å²	159	76.5 Å²	76.5	83%	0.832	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-91.7	-5.3	173.7	-92.5	151.5	0	0	0	113.8	L580	L580-L582 PolarHBondContact O-N 2.97Å; L580-L582 VanDerWaalsContact O-N 3.16Å
583	I	33.1	Very low	39.3	Very low	83 Å²	83	73.6 Å²	73.6	43%	0.426	38%	0.375	S	S	.	.	S	Bend	trans	-117.6	134.7	-177.2	-50.3	171.1	0	0	0	107.8	L580 M587	L580-I583 HydrophobicContact CD2-CD1 4.08Å; L580-I583 PolarHBondContact O-N 2.84Å; I583-M587 HydrophobicContact CB-CB 4.22Å; I583-M587 HydrophobicContact CG2-CB 3.47Å; I583-M587 VanDerWaalsContact CG2-CB 3.47Å; I583-M587 HydrophobicContact CG2-CG 3.7Å
584	S	36.1	Very low	39.2	Very low	73 Å²	73	76.9 Å²	76.9	51%	0.51	39%	0.39	S	S	.	.			trans	-33.6	147.2	-170.3	62.8	0	0	0	0	115.5	E586 M587 S588	S584-E586 CarbonylContact O-C 3.58Å; S584-E586 PolarHBondContact O-N 3.13Å; S584-M587 WeakPolarHBondContact O-CA 2.71Å; S584-M587 WeakPolarHBondContact O-CB 3.41Å; S584-M587 PolarHBondContact O-N 3.34Å; S584-M587 WeakPolarHBondContact OG-CG 3.27Å; S584-S588 PolarHBondContact O-N 2.86Å
585	R	32.9	Very low	39.1	Very low	242 Å²	242	73.5 Å²	73.5	91%	0.913	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.3	-30	-178.3	-123.5	175.3	-177.2	173.3	0.7	114.3	S588	R585-S588 PolarHBondContact O-OG 3.4Å
586	E	35	Very low	39.2	Very low	136 Å²	136	75.4 Å²	75.4	64%	0.636	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-46.2	175.4	-65.3	-174.2	161.5	0	0	111.9	S584 S588 G589 Y590	S584-E586 CarbonylContact O-C 3.58Å; S584-E586 PolarHBondContact O-N 3.13Å; E586-S588 VanDerWaalsContact C-N 3.32Å; E586-S588 PolarHBondContact O-N 3.42Å; E586-G589 PolarHBondContact O-N 3.45Å; E586-G589 VanDerWaalsContact O-N 3.15Å; E586-Y590 HydrophobicContact CB-CE2 4.42Å; E586-Y590 WeakPolarHBondContact O-CD2 3.47Å; E586-Y590 WeakPolarHBondContact O-CE2 3.33Å
587	M	35.1	Very low	39.3	Very low	59 Å²	59	76.4 Å²	76.4	29%	0.291	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-27.9	-179.4	-67.1	-65.8	-112	0	0	114.2	I583 S584 G589 Y590 Y645	I583-M587 HydrophobicContact CB-CB 4.22Å; I583-M587 HydrophobicContact CG2-CB 3.47Å; I583-M587 VanDerWaalsContact CG2-CB 3.47Å; I583-M587 HydrophobicContact CG2-CG 3.7Å; S584-M587 WeakPolarHBondContact O-CA 2.71Å; S584-M587 WeakPolarHBondContact O-CB 3.41Å; S584-M587 PolarHBondContact O-N 3.34Å; S584-M587 WeakPolarHBondContact OG-CG 3.27Å; M587-G589 PolarHBondContact O-N 3.12Å; M587-Y590 PolarHBondContact O-N 3.32Å; M587-Y590 HydrophobicContact SD-CD2 4.12Å; M587-Y590 HydrophobicContact SD-CE2 4.29Å; M587-Y645 HydrophobicContact CE-CE1 3.67Å
588	S	35.6	Very low	39.5	Very low	43 Å²	43	75.7 Å²	75.7	30%	0.301	38%	0.379	S	S	.	.	H	α-helix	trans	-62.7	-22.3	174	76.5	0	0	0	0	114.1	S584 R585 E586	S584-S588 PolarHBondContact O-N 2.86Å; R585-S588 PolarHBondContact O-OG 3.4Å; E586-S588 VanDerWaalsContact C-N 3.32Å; E586-S588 PolarHBondContact O-N 3.42Å
589	G	37.6	Very low	39.8	Very low	28 Å²	28	72.6 Å²	72.6	29%	0.289	36%	0.363	S	S	.	.	H	α-helix	trans	-77.8	-36.9	174.4	0	0	0	0	0	113	E586 M587 N593	E586-G589 PolarHBondContact O-N 3.45Å; E586-G589 VanDerWaalsContact O-N 3.15Å; M587-G589 PolarHBondContact O-N 3.12Å; G589-N593 PolarHBondContact O-N 3.33Å; G589-N593 VanDerWaalsContact O-N 3.14Å; G589-N593 PolarHBondContact O-ND2 3.05Å
590	Y	37.3	Very low	40.1	Very low	46 Å²	46	70.9 Å²	70.9	18%	0.18	35%	0.353	C	S	.	.	H	α-helix	trans	-67	-49.5	-174.3	-66.2	-105.1	0	0	0	111.4	E586 M587 R592 N593 F594 S654	E586-Y590 HydrophobicContact CB-CE2 4.42Å; E586-Y590 WeakPolarHBondContact O-CD2 3.47Å; E586-Y590 WeakPolarHBondContact O-CE2 3.33Å; M587-Y590 PolarHBondContact O-N 3.32Å; M587-Y590 HydrophobicContact SD-CD2 4.12Å; M587-Y590 HydrophobicContact SD-CE2 4.29Å; Y590-R592 PolarHBondContact O-N 2.78Å; Y590-N593 PolarHBondContact O-N 3.26Å; Y590-F594 WeakPolarHBondContact O-CB 3.28Å; Y590-F594 PolarHBondContact O-N 2.82Å; Y590-S654 WeakPolarHBondContact CE1-OG 3.41Å; Y590-S654 VanDerWaalsContact CZ-CB 3.45Å; Y590-S654 PolarHBondContact OH-OG 3.34Å
591	S	40.3	Very low	40.7	Very low	26 Å²	26	71.4 Å²	71.4	18%	0.182	36%	0.356	C	S	.	.	H	α-helix	trans	-65.2	-38	178.4	56.7	0	0	0	0	113	L580 N593 F594 A595	L580-S591 VanDerWaalsContact CD1-OG 3.23Å; L580-S591 WeakPolarHBondContact CD1-OG 3.36Å; S591-N593 VanDerWaalsContact C-N 3.29Å; S591-N593 PolarHBondContact O-N 2.97Å; S591-F594 PolarHBondContact O-N 2.88Å; S591-A595 WeakPolarHBondContact O-CB 3.44Å; S591-A595 PolarHBondContact O-N 2.79Å
592	R	41.7	Very low	41.4	Very low	136 Å²	136	68.1 Å²	68.1	51%	0.513	34%	0.338	S	S	.	.	H	α-helix	trans	-59.4	-40.1	174	-105.5	-179.3	170.4	178	-2	112.2	P575 Y590 K596	P575-R592 HydrophobicContact CB-CB 4.43Å; P575-R592 HydrophobicContact CB-CG 3.49Å; P575-R592 VanDerWaalsContact CB-CG 3.49Å; P575-R592 HydrophobicContact CG-CG 4.11Å; Y590-R592 PolarHBondContact O-N 2.78Å; R592-K596 VanDerWaalsContact O-CG 3.28Å; R592-K596 WeakPolarHBondContact O-CG 3.28Å; R592-K596 PolarHBondContact O-N 3.42Å
593	N	42.5	Very low	41.9	Very low	23 Å²	23	62.5 Å²	62.5	12%	0.123	31%	0.31	C	S	.	.	H	α-helix	trans	-83.9	-32.4	-177	-61.6	-16.5	0	0	0	112.2	G589 Y590 S591 K596 I597 V657 Q661	G589-N593 PolarHBondContact O-N 3.33Å; G589-N593 VanDerWaalsContact O-N 3.14Å; G589-N593 PolarHBondContact O-ND2 3.05Å; Y590-N593 PolarHBondContact O-N 3.26Å; S591-N593 VanDerWaalsContact C-N 3.29Å; S591-N593 PolarHBondContact O-N 2.97Å; N593-K596 WeakPolarHBondContact O-CB 3.24Å; N593-K596 PolarHBondContact O-N 3.43Å; N593-I597 WeakPolarHBondContact O-CG1 3.07Å; N593-I597 PolarHBondContact O-N 3.29Å; N593-I597 VanDerWaalsContact O-N 3.08Å; N593-V657 HydrophobicContact CB-CG1 3.19Å; N593-Q661 PolarHBondContact ND2-OE1 3.39Å; N593-Q661 PolarHBondContact OD1-OE1 3.05Å
594	F	44.9	Very low	42.6	Very low	73 Å²	73	61.8 Å²	61.8	32%	0.32	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-44	173	-153.5	-93.4	0	0	0	111.6	Y590 S591 K596 I597 G598 W634 L638	Y590-F594 WeakPolarHBondContact O-CB 3.28Å; Y590-F594 PolarHBondContact O-N 2.82Å; S591-F594 PolarHBondContact O-N 2.88Å; F594-K596 VanDerWaalsContact C-N 3.33Å; F594-K596 PolarHBondContact O-N 2.89Å; F594-I597 PolarHBondContact O-N 3.47Å; F594-G598 PolarHBondContact O-N 3.11Å; F594-W634 AromaticContact CD1-CZ2 3.69Å; F594-W634 HydrophobicContact CD1-CZ2 3.69Å; F594-W634 AromaticContact CE1-CE2 3.75Å; F594-W634 AromaticContact CE1-CZ2 3.73Å; F594-W634 HydrophobicContact CE1-CZ2 3.73Å; F594-W634 AromaticContact CE1-NE1 3.49Å; F594-W634 AromaticContact CZ-NE1 3.8Å; F594-W634 WeakPolarHBondContact O-CZ2 3.34Å; F594-L638 HydrophobicContact CD1-CD1 4.21Å; F594-L638 HydrophobicContact CE1-CD1 4.23Å
595	A	44.9	Very low	43.1	Very low	8 Å²	8	58.8 Å²	58.8	7%	0.066	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-40	174.1	0	0	0	0	0	112.5	P575 S591 I597 G598 L599	P575-A595 HydrophobicContact CG-CB 4.06Å; S591-A595 WeakPolarHBondContact O-CB 3.44Å; S591-A595 PolarHBondContact O-N 2.79Å; A595-I597 VanDerWaalsContact C-N 3.33Å; A595-I597 PolarHBondContact O-N 3.42Å; A595-G598 PolarHBondContact O-N 3.24Å; A595-L599 WeakPolarHBondContact O-CB 3.23Å; A595-L599 WeakPolarHBondContact O-CD1 3.47Å; A595-L599 PolarHBondContact O-N 3.07Å
596	K	45.4	Very low	43.8	Very low	55 Å²	55	51.7 Å²	51.7	24%	0.239	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-38.2	175.4	-77.6	171.9	-175.9	171.1	0	113	R592 N593 F594 L599 L600	R592-K596 VanDerWaalsContact O-CG 3.28Å; R592-K596 WeakPolarHBondContact O-CG 3.28Å; R592-K596 PolarHBondContact O-N 3.42Å; N593-K596 WeakPolarHBondContact O-CB 3.24Å; N593-K596 PolarHBondContact O-N 3.43Å; F594-K596 VanDerWaalsContact C-N 3.33Å; F594-K596 PolarHBondContact O-N 2.89Å; K596-L599 PolarHBondContact O-N 3.32Å; K596-L600 PolarHBondContact O-N 3.04Å
597	I	47.7	Very low	44.2	Very low	54 Å²	54	48.5 Å²	48.5	28%	0.277	25%	0.248	S	C	.	.	H	α-helix	trans	-68.3	-45	176.6	-68.7	166.1	0	0	0	110.8	N593 F594 A595 L599 L600 L601 V657	N593-I597 WeakPolarHBondContact O-CG1 3.07Å; N593-I597 PolarHBondContact O-N 3.29Å; N593-I597 VanDerWaalsContact O-N 3.08Å; F594-I597 PolarHBondContact O-N 3.47Å; A595-I597 VanDerWaalsContact C-N 3.33Å; A595-I597 PolarHBondContact O-N 3.42Å; I597-L599 PolarHBondContact O-N 3.44Å; I597-L600 WeakPolarHBondContact O-CB 3.25Å; I597-L600 PolarHBondContact O-N 3.47Å; I597-L600 VanDerWaalsContact O-N 3.12Å; I597-L601 HydrophobicContact CG2-CD1 4.2Å; I597-L601 PolarHBondContact O-N 2.8Å; I597-V657 HydrophobicContact CD1-CB 4.47Å; I597-V657 HydrophobicContact CD1-CG1 3.9Å; I597-V657 HydrophobicContact CD1-CG2 3.84Å
598	G	47.5	Very low	44.6	Very low	4 Å²	4	46.3 Å²	46.3	4%	0.041	24%	0.239	C	C	.	.	H	α-helix	trans	-58	-38.6	174.3	0	0	0	0	0	113.2	F594 A595 L601 L602	F594-G598 PolarHBondContact O-N 3.11Å; A595-G598 PolarHBondContact O-N 3.24Å; G598-L601 PolarHBondContact O-N 2.84Å; G598-L602 WeakPolarHBondContact O-CB 3.13Å; G598-L602 PolarHBondContact O-N 3.29Å
599	L	48.1	Very low	45	Very low	22 Å²	22	47.8 Å²	47.8	12%	0.115	24%	0.243	C	C	.	.	H	α-helix	trans	-73.2	-31.6	175.6	-89.6	129.1	0	0	0	113.8	V567 A571 A595 K596 I597 L602 T603	V567-L599 HydrophobicContact CB-CD2 4.46Å; V567-L599 HydrophobicContact CG1-CD2 3.42Å; V567-L599 VanDerWaalsContact CG1-CD2 3.42Å; V567-L599 WeakPolarHBondContact O-CD2 3.16Å; A571-L599 HydrophobicContact CB-CB 3.97Å; A571-L599 HydrophobicContact CB-CD1 3.4Å; A571-L599 HydrophobicContact CB-CD2 3.61Å; A571-L599 HydrophobicContact CB-CG 3.78Å; A595-L599 WeakPolarHBondContact O-CB 3.23Å; A595-L599 WeakPolarHBondContact O-CD1 3.47Å; A595-L599 PolarHBondContact O-N 3.07Å; K596-L599 PolarHBondContact O-N 3.32Å; I597-L599 PolarHBondContact O-N 3.44Å; L599-L602 WeakPolarHBondContact O-CB 3.31Å; L599-L602 PolarHBondContact O-N 2.91Å; L599-T603 PolarHBondContact O-N 3.35Å; L599-T603 PolarHBondContact O-OG1 2.85Å
600	L	48.1	Very low	45.3	Very low	48 Å²	48	48.9 Å²	48.9	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-63	-44.8	169.4	-168	100	0	0	0	110.8	K596 I597 L602 T603 I604 L668	K596-L600 PolarHBondContact O-N 3.04Å; I597-L600 WeakPolarHBondContact O-CB 3.25Å; I597-L600 PolarHBondContact O-N 3.47Å; I597-L600 VanDerWaalsContact O-N 3.12Å; L600-L602 VanDerWaalsContact C-N 3.27Å; L600-L602 PolarHBondContact O-N 2.78Å; L600-T603 WeakPolarHBondContact CA-OG1 3.27Å; L600-T603 PolarHBondContact O-N 3.43Å; L600-T603 PolarHBondContact O-OG1 3.29Å; L600-I604 HydrophobicContact CD2-CD1 3.98Å; L600-I604 HydrophobicContact CG-CD1 4.1Å; L600-I604 WeakPolarHBondContact O-CB 3.13Å; L600-I604 WeakPolarHBondContact O-CD1 3.35Å; L600-I604 WeakPolarHBondContact O-CG1 3.14Å; L600-I604 PolarHBondContact O-N 3.36Å; L600-L668 HydrophobicContact CD1-CD1 3.94Å
601	L	49.2	Very low	45.5	Very low	48 Å²	48	49 Å²	49	25%	0.251	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-36.4	173.7	-77	160.7	0	0	0	111.3	I597 G598 I604 T605 W634	I597-L601 HydrophobicContact CG2-CD1 4.2Å; I597-L601 PolarHBondContact O-N 2.8Å; G598-L601 PolarHBondContact O-N 2.84Å; L601-I604 PolarHBondContact O-N 2.98Å; L601-T605 WeakPolarHBondContact O-CB 3.49Å; L601-T605 WeakPolarHBondContact O-CG2 3.18Å; L601-T605 PolarHBondContact O-N 3.33Å; L601-T605 PolarHBondContact O-OG1 2.56Å; L601-W634 HydrophobicContact CD1-CG 4.46Å
602	L	49.5	Very low	45.5	Very low	65 Å²	65	52.4 Å²	52.4	34%	0.34	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-44.1	173.7	-152.7	91.5	0	0	0	111.8	V567 G598 L599 L600 I604 T605 F606	V567-L602 HydrophobicContact CG1-CD2 4.28Å; V567-L602 HydrophobicContact CG2-CD2 4.43Å; G598-L602 WeakPolarHBondContact O-CB 3.13Å; G598-L602 PolarHBondContact O-N 3.29Å; L599-L602 WeakPolarHBondContact O-CB 3.31Å; L599-L602 PolarHBondContact O-N 2.91Å; L600-L602 VanDerWaalsContact C-N 3.27Å; L600-L602 PolarHBondContact O-N 2.78Å; L602-I604 VanDerWaalsContact C-N 3.33Å; L602-I604 PolarHBondContact O-N 3.39Å; L602-T605 VanDerWaalsContact C-OG1 3.32Å; L602-T605 WeakPolarHBondContact CA-OG1 3.28Å; L602-T605 PolarHBondContact O-N 2.82Å; L602-T605 PolarHBondContact O-OG1 2.81Å; L602-F606 HydrophobicContact CD2-CD2 4.16Å; L602-F606 HydrophobicContact CD2-CE2 3.87Å; L602-F606 HydrophobicContact CG-CD2 3.94Å; L602-F606 HydrophobicContact CG-CE2 3.9Å; L602-F606 WeakPolarHBondContact O-CB 3.34Å; L602-F606 VanDerWaalsContact O-CD2 3.27Å; L602-F606 WeakPolarHBondContact O-CD2 3.43Å; L602-F606 PolarHBondContact O-N 2.87Å
603	T	46.7	Very low	45.5	Very low	40 Å²	40	51.6 Å²	51.6	25%	0.245	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-37.8	174.9	13.7	0	0	0	0	111.8	V567 L599 L600 N607	V567-T603 HydrophobicContact CG1-CG2 4.07Å; L599-T603 PolarHBondContact O-N 3.35Å; L599-T603 PolarHBondContact O-OG1 2.85Å; L600-T603 WeakPolarHBondContact CA-OG1 3.27Å; L600-T603 PolarHBondContact O-N 3.43Å; L600-T603 PolarHBondContact O-OG1 3.29Å; T603-N607 VanDerWaalsContact O-CB 3.27Å; T603-N607 WeakPolarHBondContact O-CB 3.39Å; T603-N607 PolarHBondContact O-N 3.44Å; T603-N607 PolarHBondContact O-ND2 2.89Å
604	I	47.8	Very low	45.6	Very low	69 Å²	69	55 Å²	55	35%	0.354	29%	0.287	S	S	.	.	H	α-helix	trans	-66.5	-44.6	176.3	-67.9	164.1	0	0	0	110.6	L600 L601 L602 N607 S608	L600-I604 HydrophobicContact CD2-CD1 3.98Å; L600-I604 HydrophobicContact CG-CD1 4.1Å; L600-I604 WeakPolarHBondContact O-CB 3.13Å; L600-I604 WeakPolarHBondContact O-CD1 3.35Å; L600-I604 WeakPolarHBondContact O-CG1 3.14Å; L600-I604 PolarHBondContact O-N 3.36Å; L601-I604 PolarHBondContact O-N 2.98Å; L602-I604 VanDerWaalsContact C-N 3.33Å; L602-I604 PolarHBondContact O-N 3.39Å; I604-N607 PolarHBondContact O-N 2.9Å; I604-S608 WeakPolarHBondContact O-CB 3.25Å; I604-S608 PolarHBondContact O-N 3.13Å; I604-S608 PolarHBondContact O-OG 3.09Å
605	T	46.5	Very low	45.3	Very low	9 Å²	9	52.8 Å²	52.8	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-47.2	175.7	42.6	0	0	0	0	111.2	L601 L602 N607 S608 I609 T627	L601-T605 WeakPolarHBondContact O-CB 3.49Å; L601-T605 WeakPolarHBondContact O-CG2 3.18Å; L601-T605 PolarHBondContact O-N 3.33Å; L601-T605 PolarHBondContact O-OG1 2.56Å; L602-T605 VanDerWaalsContact C-OG1 3.32Å; L602-T605 WeakPolarHBondContact CA-OG1 3.28Å; L602-T605 PolarHBondContact O-N 2.82Å; L602-T605 PolarHBondContact O-OG1 2.81Å; T605-N607 PolarHBondContact O-N 3.48Å; T605-S608 WeakPolarHBondContact CA-OG 3.17Å; T605-S608 PolarHBondContact O-N 3.31Å; T605-S608 VanDerWaalsContact O-N 3.11Å; T605-S608 PolarHBondContact O-OG 3.41Å; T605-I609 VanDerWaalsContact O-CG1 3.28Å; T605-I609 WeakPolarHBondContact O-CG1 3.49Å; T605-I609 PolarHBondContact O-N 3.45Å; T605-T627 WeakPolarHBondContact CG2-O 3Å
606	F	48	Very low	45.4	Very low	93 Å²	93	56.7 Å²	56.7	41%	0.408	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-43.7	175.3	-89	-72.3	0	0	0	112.5	L602 S608 I609 Q610	L602-F606 HydrophobicContact CD2-CD2 4.16Å; L602-F606 HydrophobicContact CD2-CE2 3.87Å; L602-F606 HydrophobicContact CG-CD2 3.94Å; L602-F606 HydrophobicContact CG-CE2 3.9Å; L602-F606 WeakPolarHBondContact O-CB 3.34Å; L602-F606 VanDerWaalsContact O-CD2 3.27Å; L602-F606 WeakPolarHBondContact O-CD2 3.43Å; L602-F606 PolarHBondContact O-N 2.87Å; F606-S608 VanDerWaalsContact C-N 3.29Å; F606-S608 PolarHBondContact O-N 3.39Å; F606-I609 PolarHBondContact O-N 2.99Å; F606-Q610 WeakPolarHBondContact O-CB 3.48Å; F606-Q610 PolarHBondContact O-N 3.32Å
607	N	44.5	Very low	45	Very low	70 Å²	70	56.3 Å²	56.3	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-63.4	-34	174.8	-74.7	-25.7	0	0	0	112.1	Q560 T603 I604 T605 Q610 L611	Q560-N607 PolarHBondContact NE2-OD1 3.42Å; T603-N607 VanDerWaalsContact O-CB 3.27Å; T603-N607 WeakPolarHBondContact O-CB 3.39Å; T603-N607 PolarHBondContact O-N 3.44Å; T603-N607 PolarHBondContact O-ND2 2.89Å; I604-N607 PolarHBondContact O-N 2.9Å; T605-N607 PolarHBondContact O-N 3.48Å; N607-Q610 PolarHBondContact O-N 3.18Å; N607-L611 PolarHBondContact O-N 2.88Å
608	S	43.2	Very low	44.7	Very low	13 Å²	13	57.3 Å²	57.3	9%	0.091	33%	0.333	C	S	.	.	H	α-helix	trans	-73.3	-35.6	176.2	74.9	0	0	0	0	113.3	I604 T605 F606 Q610 L611	I604-S608 WeakPolarHBondContact O-CB 3.25Å; I604-S608 PolarHBondContact O-N 3.13Å; I604-S608 PolarHBondContact O-OG 3.09Å; T605-S608 WeakPolarHBondContact CA-OG 3.17Å; T605-S608 PolarHBondContact O-N 3.31Å; T605-S608 VanDerWaalsContact O-N 3.11Å; T605-S608 PolarHBondContact O-OG 3.41Å; F606-S608 VanDerWaalsContact C-N 3.29Å; F606-S608 PolarHBondContact O-N 3.39Å; S608-Q610 PolarHBondContact O-N 3.43Å; S608-L611 WeakPolarHBondContact O-CB 3.1Å; S608-L611 PolarHBondContact O-N 3.36Å
609	I	44.5	Very low	44.5	Very low	74 Å²	74	60.1 Å²	60.1	38%	0.379	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-23.7	172.4	-65.1	163.2	0	0	0	110.1	T605 F606 H612 T624	T605-I609 VanDerWaalsContact O-CG1 3.28Å; T605-I609 WeakPolarHBondContact O-CG1 3.49Å; T605-I609 PolarHBondContact O-N 3.45Å; F606-I609 PolarHBondContact O-N 2.99Å; I609-H612 WeakPolarHBondContact O-CB 3.25Å; I609-H612 PolarHBondContact O-N 3.13Å; I609-T624 HydrophobicContact CG1-CG2 4.26Å
610	Q	42.1	Very low	44.1	Very low	51 Å²	51	59.5 Å²	59.5	24%	0.238	35%	0.347	C	S	.	.	H	α-helix	trans	-81.3	-24.1	178.4	-153.2	167.9	-6.5	0	0	113	F606 N607 S608 H612 L613	F606-Q610 WeakPolarHBondContact O-CB 3.48Å; F606-Q610 PolarHBondContact O-N 3.32Å; N607-Q610 PolarHBondContact O-N 3.18Å; S608-Q610 PolarHBondContact O-N 3.43Å; Q610-H612 PolarHBondContact O-N 2.9Å; Q610-H612 VanDerWaalsContact O-N 3.16Å; Q610-L613 PolarHBondContact O-N 2.95Å
611	L	43.2	Very low	43.8	Very low	47 Å²	47	64.5 Å²	64.5	25%	0.246	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-61.2	-17.2	167.1	-116.5	116.1	0	0	0	113.1	N607 S608 L613 S614 L615 V690	N607-L611 PolarHBondContact O-N 2.88Å; S608-L611 WeakPolarHBondContact O-CB 3.1Å; S608-L611 PolarHBondContact O-N 3.36Å; L611-L613 PolarHBondContact O-N 3.4Å; L611-S614 PolarHBondContact O-N 3.43Å; L611-L615 HydrophobicContact CD2-CD1 3.49Å; L611-L615 VanDerWaalsContact CD2-CD1 3.49Å; L611-L615 HydrophobicContact CD2-CD2 4.02Å; L611-L615 HydrophobicContact CD2-CG 4.24Å; L611-L615 HydrophobicContact CG-CD1 4.22Å; L611-L615 PolarHBondContact O-N 3.49Å; L611-V690 HydrophobicContact CD2-CG2 3.34Å
612	H	38.9	Very low	43.8	Very low	99 Å²	99	66.6 Å²	66.6	46%	0.458	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-65.3	-13.3	-179.6	-156.1	-44.1	0	0	0	114.3	I609 Q610 V620	I609-H612 WeakPolarHBondContact O-CB 3.25Å; I609-H612 PolarHBondContact O-N 3.13Å; Q610-H612 PolarHBondContact O-N 2.9Å; Q610-H612 VanDerWaalsContact O-N 3.16Å; H612-V620 HydrophobicContact CB-CG1 4.02Å; H612-V620 WeakPolarHBondContact CD2-CG1 3.21Å
613	L	43.4	Very low	43.6	Very low	118 Å²	118	65.9 Å²	65.9	62%	0.618	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-101.4	-9.6	-177.4	-84	141.4	0	0	0	114.4	Y556 Q610 L611	Y556-L613 HydrophobicContact CE1-CD1 4.08Å; Q610-L613 PolarHBondContact O-N 2.95Å; L611-L613 PolarHBondContact O-N 3.4Å
614	S	43.7	Very low	43.5	Very low	94 Å²	94	64.8 Å²	64.8	66%	0.657	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.9	-11.4	-179.4	57.3	0	0	0	0	114.8	L611	L611-S614 PolarHBondContact O-N 3.43Å
615	L	38.4	Very low	43.6	Very low	28 Å²	28	65.8 Å²	65.8	15%	0.147	38%	0.375	C	S	.	.	S	Bend	trans	-113.2	142.5	178.5	-85.8	87.5	0	0	0	113.2	L611 G617 V619 V690	L611-L615 HydrophobicContact CD2-CD1 3.49Å; L611-L615 VanDerWaalsContact CD2-CD1 3.49Å; L611-L615 HydrophobicContact CD2-CD2 4.02Å; L611-L615 HydrophobicContact CD2-CG 4.24Å; L611-L615 HydrophobicContact CG-CD1 4.22Å; L611-L615 PolarHBondContact O-N 3.49Å; L615-G617 PolarHBondContact O-N 2.85Å; L615-V619 HydrophobicContact CD2-CG1 4.49Å; L615-V690 HydrophobicContact CD2-CG2 4.04Å
616	S	46.4	Very low	43.6	Very low	90 Å²	90	67.8 Å²	67.8	63%	0.629	39%	0.388	S	S	*	.			trans	-48.3	134.2	172.5	69.7	0	0	0	0	111.7	A618 V619	S616-A618 PolarHBondContact O-N 2.76Å; S616-V619 PolarHBondContact O-N 3.45Å
617	G	37	Very low	43.5	Very low	46 Å²	46	64 Å²	64	47%	0.474	37%	0.372	S	S	.	.	H	α-helix	trans	-60.1	-5.5	-163.4	0	0	0	0	0	117.6	L615 Y621	L615-G617 PolarHBondContact O-N 2.85Å; G617-Y621 WeakPolarHBondContact O-CD2 3.21Å
618	A	42.6	Very low	43.6	Very low	75 Å²	75	63.2 Å²	63.2	62%	0.62	37%	0.371	S	S	*	.	H	α-helix	trans	-82.1	-38	-179.9	0	0	0	0	0	113.6	S616 V620	S616-A618 PolarHBondContact O-N 2.76Å; A618-V620 VanDerWaalsContact C-N 3.3Å; A618-V620 PolarHBondContact O-N 2.89Å
619	V	43.7	Very low	43.8	Very low	63 Å²	63	65.9 Å²	65.9	38%	0.382	39%	0.387	S	S	.	.	H	α-helix	trans	-74.1	-28.6	-177.8	-177.7	0	0	0	0	111.2	L615 S616 Y621 V622	L615-V619 HydrophobicContact CD2-CG1 4.49Å; S616-V619 PolarHBondContact O-N 3.45Å; V619-Y621 PolarHBondContact O-N 3.5Å; V619-V622 PolarHBondContact O-N 3.09Å
620	V	38.7	Very low	44	Very low	10 Å²	10	65 Å²	65	6%	0.061	38%	0.383	C	S	.	.	H	α-helix	trans	-59.8	-43	177.6	178.1	0	0	0	0	111.7	H612 A618 V622 V623 T624	H612-V620 HydrophobicContact CB-CG1 4.02Å; H612-V620 WeakPolarHBondContact CD2-CG1 3.21Å; A618-V620 VanDerWaalsContact C-N 3.3Å; A618-V620 PolarHBondContact O-N 2.89Å; V620-V622 VanDerWaalsContact C-N 3.27Å; V620-V622 PolarHBondContact O-N 3.47Å; V620-V623 PolarHBondContact O-N 2.9Å; V620-T624 HydrophobicContact CG1-CG2 3.91Å; V620-T624 WeakPolarHBondContact O-CB 3.32Å; V620-T624 WeakPolarHBondContact O-CG2 3.37Å; V620-T624 PolarHBondContact O-N 2.92Å; V620-T624 PolarHBondContact O-OG1 3.37Å
621	Y	42.6	Very low	44.2	Very low	152 Å²	152	63.6 Å²	63.6	60%	0.596	38%	0.378	S	S	*	.	H	α-helix	trans	-64.3	-31.5	178.9	-79.6	-67.8	0	0	0	113.1	G617 V619 V623 I625	G617-Y621 WeakPolarHBondContact O-CD2 3.21Å; V619-Y621 PolarHBondContact O-N 3.5Å; Y621-V623 VanDerWaalsContact C-N 3.34Å; Y621-V623 PolarHBondContact O-N 3.48Å; Y621-I625 HydrophobicContact CD1-CD1 3.63Å; Y621-I625 HydrophobicContact CD1-CG1 4.14Å; Y621-I625 HydrophobicContact CG-CD1 4.37Å; Y621-I625 WeakPolarHBondContact O-CB 3.06Å; Y621-I625 WeakPolarHBondContact O-CG1 3.44Å; Y621-I625 PolarHBondContact O-N 2.98Å
622	V	49.1	Very low	44.4	Very low	93 Å²	93	66.2 Å²	66.2	56%	0.564	39%	0.392	S	S	*	.	H	α-helix	trans	-71.8	-28.7	-177.3	-177.2	0	0	0	0	112	V619 V620 P626	V619-V622 PolarHBondContact O-N 3.09Å; V620-V622 VanDerWaalsContact C-N 3.27Å; V620-V622 PolarHBondContact O-N 3.47Å; V622-P626 VanDerWaalsContact O-CD 3.22Å; V622-P626 WeakPolarHBondContact O-CD 3.38Å; V622-P626 VanDerWaalsContact O-CG 3.25Å; V622-P626 WeakPolarHBondContact O-CG 3.25Å
623	V	45.2	Very low	44.8	Very low	50 Å²	50	65.7 Å²	65.7	30%	0.303	39%	0.391	S	S	.	.	H	α-helix	trans	-102.5	-37.7	-178.4	-174.8	0	0	0	0	112.4	V620 Y621 T627	V620-V623 PolarHBondContact O-N 2.9Å; Y621-V623 VanDerWaalsContact C-N 3.34Å; Y621-V623 PolarHBondContact O-N 3.48Å; V623-T627 WeakPolarHBondContact O-CB 3.09Å; V623-T627 WeakPolarHBondContact O-CG2 3.28Å; V623-T627 PolarHBondContact O-N 3.36Å; V623-T627 PolarHBondContact O-OG1 2.88Å
624	T	45	Very low	45.2	Very low	16 Å²	16	62.3 Å²	62.3	10%	0.098	37%	0.37	C	S	.	.	H	α-helix	trans	-73.9	-40.4	-177.1	55.5	0	0	0	0	112.8	I609 V620 T627 C628	I609-T624 HydrophobicContact CG1-CG2 4.26Å; V620-T624 HydrophobicContact CG1-CG2 3.91Å; V620-T624 WeakPolarHBondContact O-CB 3.32Å; V620-T624 WeakPolarHBondContact O-CG2 3.37Å; V620-T624 PolarHBondContact O-N 2.92Å; V620-T624 PolarHBondContact O-OG1 3.37Å; T624-T627 WeakPolarHBondContact CA-OG1 3.29Å; T624-T627 PolarHBondContact O-N 3.27Å; T624-T627 PolarHBondContact O-OG1 2.55Å; T624-T627 VanDerWaalsContact O-OG1 3.05Å; T624-C628 VanDerWaalsContact O-CB 3.29Å; T624-C628 WeakPolarHBondContact O-CB 3.06Å; T624-C628 PolarHBondContact O-N 2.99Å; T624-C628 PolarHBondContact O-SG 3.02Å; T624-C628 VanDerWaalsContact O-SG 3.33Å
625	I	49.3	Very low	45.3	Very low	91 Å²	91	63.5 Å²	63.5	47%	0.467	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-51.8	-179.2	-65.5	173.4	0	0	0	111.4	Y621 T627 C628 V629	Y621-I625 HydrophobicContact CD1-CD1 3.63Å; Y621-I625 HydrophobicContact CD1-CG1 4.14Å; Y621-I625 HydrophobicContact CG-CD1 4.37Å; Y621-I625 WeakPolarHBondContact O-CB 3.06Å; Y621-I625 WeakPolarHBondContact O-CG1 3.44Å; Y621-I625 PolarHBondContact O-N 2.98Å; I625-T627 VanDerWaalsContact C-N 3.31Å; I625-T627 PolarHBondContact O-N 2.72Å; I625-C628 PolarHBondContact O-N 3.37Å; I625-V629 HydrophobicContact CG2-CG2 4.22Å; I625-V629 WeakPolarHBondContact O-CB 3.31Å; I625-V629 VanDerWaalsContact O-CG2 3.24Å; I625-V629 WeakPolarHBondContact O-CG2 3.5Å; I625-V629 PolarHBondContact O-N 2.89Å
626	P	46.4	Very low	45.8	Very low	51 Å²	51	66.4 Å²	66.4	33%	0.331	38%	0.382	S	S	.	.	H	α-helix	trans	-64.1	-36.6	-178.6	-22.7	34.7	0	0	0	112.7	V622 V629 L630	V622-P626 VanDerWaalsContact O-CD 3.22Å; V622-P626 WeakPolarHBondContact O-CD 3.38Å; V622-P626 VanDerWaalsContact O-CG 3.25Å; V622-P626 WeakPolarHBondContact O-CG 3.25Å; P626-V629 PolarHBondContact O-N 2.97Å; P626-L630 WeakPolarHBondContact O-CB 3.42Å; P626-L630 PolarHBondContact O-N 2.88Å
627	T	46.7	Very low	45.8	Very low	14 Å²	14	64.8 Å²	64.8	9%	0.086	37%	0.37	C	S	.	.	H	α-helix	trans	-72.4	-38.1	-179.6	56.9	0	0	0	0	111.9	T605 V623 T624 I625 L630 C631	T605-T627 WeakPolarHBondContact CG2-O 3Å; V623-T627 WeakPolarHBondContact O-CB 3.09Å; V623-T627 WeakPolarHBondContact O-CG2 3.28Å; V623-T627 PolarHBondContact O-N 3.36Å; V623-T627 PolarHBondContact O-OG1 2.88Å; T624-T627 WeakPolarHBondContact CA-OG1 3.29Å; T624-T627 PolarHBondContact O-N 3.27Å; T624-T627 PolarHBondContact O-OG1 2.55Å; T624-T627 VanDerWaalsContact O-OG1 3.05Å; I625-T627 VanDerWaalsContact C-N 3.31Å; I625-T627 PolarHBondContact O-N 2.72Å; T627-L630 PolarHBondContact O-N 3.27Å; T627-C631 PolarHBondContact O-N 3.06Å
628	C	45.9	Very low	46.2	Very low	52 Å²	52	65 Å²	65	35%	0.351	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-44.1	170	-75	0	0	0	0	112.1	T624 I625 L630 C631 I632	T624-C628 VanDerWaalsContact O-CB 3.29Å; T624-C628 WeakPolarHBondContact O-CB 3.06Å; T624-C628 PolarHBondContact O-N 2.99Å; T624-C628 PolarHBondContact O-SG 3.02Å; T624-C628 VanDerWaalsContact O-SG 3.33Å; I625-C628 PolarHBondContact O-N 3.37Å; C628-L630 VanDerWaalsContact C-N 3.33Å; C628-L630 PolarHBondContact O-N 2.82Å; C628-C631 PolarHBondContact O-N 3.45Å; C628-I632 VanDerWaalsContact O-CG1 3.31Å; C628-I632 WeakPolarHBondContact O-CG1 3.29Å; C628-I632 PolarHBondContact O-N 3.24Å
629	V	48	Very low	46.4	Very low	69 Å²	69	68.4 Å²	68.4	42%	0.418	36%	0.361	S	S	.	.	H	α-helix	trans	-60.4	-43.9	175.4	170.1	0	0	0	0	110.5	I625 P626 I632 I633	I625-V629 HydrophobicContact CG2-CG2 4.22Å; I625-V629 WeakPolarHBondContact O-CB 3.31Å; I625-V629 VanDerWaalsContact O-CG2 3.24Å; I625-V629 WeakPolarHBondContact O-CG2 3.5Å; I625-V629 PolarHBondContact O-N 2.89Å; P626-V629 PolarHBondContact O-N 2.97Å; V629-I632 PolarHBondContact O-N 3.26Å; V629-I633 HydrophobicContact CG1-CD1 3.67Å; V629-I633 HydrophobicContact CG1-CG1 4.32Å; V629-I633 WeakPolarHBondContact O-CB 3.34Å; V629-I633 VanDerWaalsContact O-CG1 3.26Å; V629-I633 WeakPolarHBondContact O-CG1 3.38Å; V629-I633 PolarHBondContact O-N 3.09Å
630	L	47.2	Very low	46.4	Very low	56 Å²	56	69.9 Å²	69.9	29%	0.293	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-38.9	174.7	-101.4	140.3	0	0	0	112.8	P626 T627 C628 I633 W634 M701	P626-L630 WeakPolarHBondContact O-CB 3.42Å; P626-L630 PolarHBondContact O-N 2.88Å; T627-L630 PolarHBondContact O-N 3.27Å; C628-L630 VanDerWaalsContact C-N 3.33Å; C628-L630 PolarHBondContact O-N 2.82Å; L630-I633 PolarHBondContact O-N 3.42Å; L630-W634 WeakPolarHBondContact O-CB 3.37Å; L630-W634 PolarHBondContact O-N 3.25Å; L630-M701 HydrophobicContact CD1-CE 3.52Å
631	C	47	Very low	46.7	Very low	21 Å²	21	73.9 Å²	73.9	14%	0.142	38%	0.38	C	S	.	.	H	α-helix	trans	-64.6	-39.6	173.5	-98.1	0	0	0	0	111.9	T627 C628 W634 M635	T627-C631 PolarHBondContact O-N 3.06Å; C628-C631 PolarHBondContact O-N 3.45Å; C631-W634 PolarHBondContact O-N 3.2Å; C631-M635 WeakPolarHBondContact O-CB 3.13Å; C631-M635 WeakPolarHBondContact O-CG 3.36Å; C631-M635 PolarHBondContact O-N 3.26Å
632	I	47.4	Very low	46.8	Very low	103 Å²	103	72.1 Å²	72.1	53%	0.528	38%	0.38	S	S	.	.	H	α-helix	trans	-65.9	-47.7	175.2	-66.9	164.9	0	0	0	110.3	C628 V629 W634 M635 I636	C628-I632 VanDerWaalsContact O-CG1 3.31Å; C628-I632 WeakPolarHBondContact O-CG1 3.29Å; C628-I632 PolarHBondContact O-N 3.24Å; V629-I632 PolarHBondContact O-N 3.26Å; I632-W634 VanDerWaalsContact C-N 3.3Å; I632-W634 PolarHBondContact O-N 2.81Å; I632-M635 PolarHBondContact O-N 3.45Å; I632-I636 HydrophobicContact CG2-CD1 3.71Å; I632-I636 HydrophobicContact CG2-CG1 4.4Å; I632-I636 WeakPolarHBondContact O-CB 3.13Å; I632-I636 VanDerWaalsContact O-CG1 3.24Å; I632-I636 WeakPolarHBondContact O-CG1 3.21Å; I632-I636 PolarHBondContact O-N 3.27Å
633	I	46.9	Very low	46.5	Very low	87 Å²	87	75.5 Å²	75.5	45%	0.446	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-42.5	175.6	-68.3	168.6	0	0	0	110.2	V629 L630 I636 C637	V629-I633 HydrophobicContact CG1-CD1 3.67Å; V629-I633 HydrophobicContact CG1-CG1 4.32Å; V629-I633 WeakPolarHBondContact O-CB 3.34Å; V629-I633 VanDerWaalsContact O-CG1 3.26Å; V629-I633 WeakPolarHBondContact O-CG1 3.38Å; V629-I633 PolarHBondContact O-N 3.09Å; L630-I633 PolarHBondContact O-N 3.42Å; I633-I636 PolarHBondContact O-N 3.18Å; I633-C637 VanDerWaalsContact O-CB 3.3Å; I633-C637 WeakPolarHBondContact O-CB 3.37Å; I633-C637 PolarHBondContact O-N 2.85Å; I633-C637 PolarHBondContact O-SG 2.65Å
634	W	51.3	Low	46.4	Very low	48 Å²	48	76.8 Å²	76.8	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-65.3	-41.3	178.2	-173.4	84.3	0	0	0	111.8	F594 L601 L630 C631 I632 C637 L638	F594-W634 AromaticContact CD1-CZ2 3.69Å; F594-W634 HydrophobicContact CD1-CZ2 3.69Å; F594-W634 AromaticContact CE1-CE2 3.75Å; F594-W634 AromaticContact CE1-CZ2 3.73Å; F594-W634 HydrophobicContact CE1-CZ2 3.73Å; F594-W634 AromaticContact CE1-NE1 3.49Å; F594-W634 AromaticContact CZ-NE1 3.8Å; F594-W634 WeakPolarHBondContact O-CZ2 3.34Å; L601-W634 HydrophobicContact CD1-CG 4.46Å; L630-W634 WeakPolarHBondContact O-CB 3.37Å; L630-W634 PolarHBondContact O-N 3.25Å; C631-W634 PolarHBondContact O-N 3.2Å; I632-W634 VanDerWaalsContact C-N 3.3Å; I632-W634 PolarHBondContact O-N 2.81Å; W634-C637 PolarHBondContact O-N 3.13Å; W634-L638 HydrophobicContact CE3-CD1 4.33Å; W634-L638 HydrophobicContact CH2-CD1 3.16Å; W634-L638 HydrophobicContact CZ2-CD1 3.56Å; W634-L638 HydrophobicContact CZ3-CD1 3.62Å; W634-L638 VanDerWaalsContact O-CB 3.27Å; W634-L638 WeakPolarHBondContact O-CB 3.49Å; W634-L638 PolarHBondContact O-N 3.41Å
635	M	45.9	Very low	46	Very low	119 Å²	119	81.8 Å²	81.8	59%	0.586	42%	0.417	S	S	*	.	H	α-helix	trans	-64.6	-40.7	173.7	-73.5	-71.7	-71.6	0	0	112	C631 I632 L638 F639	C631-M635 WeakPolarHBondContact O-CB 3.13Å; C631-M635 WeakPolarHBondContact O-CG 3.36Å; C631-M635 PolarHBondContact O-N 3.26Å; I632-M635 PolarHBondContact O-N 3.45Å; M635-L638 PolarHBondContact O-N 3.35Å; M635-F639 WeakPolarHBondContact O-CB 3.39Å; M635-F639 PolarHBondContact O-N 2.69Å
636	I	50.4	Low	45.4	Very low	89 Å²	89	82 Å²	82	46%	0.456	43%	0.432	S	S	.	.	H	α-helix	trans	-65.5	-47.3	174.7	-69.3	166	0	0	0	110.2	I632 I633 L638 F639 I640	I632-I636 HydrophobicContact CG2-CD1 3.71Å; I632-I636 HydrophobicContact CG2-CG1 4.4Å; I632-I636 WeakPolarHBondContact O-CB 3.13Å; I632-I636 VanDerWaalsContact O-CG1 3.24Å; I632-I636 WeakPolarHBondContact O-CG1 3.21Å; I632-I636 PolarHBondContact O-N 3.27Å; I633-I636 PolarHBondContact O-N 3.18Å; I636-L638 VanDerWaalsContact C-N 3.28Å; I636-L638 PolarHBondContact O-N 3.32Å; I636-F639 WeakPolarHBondContact O-CB 3.26Å; I636-F639 PolarHBondContact O-N 3.42Å; I636-F639 VanDerWaalsContact O-N 3.12Å; I636-I640 HydrophobicContact CG2-CD1 3.63Å; I636-I640 HydrophobicContact CG2-CG1 4.3Å; I636-I640 VanDerWaalsContact O-CG1 3.31Å; I636-I640 WeakPolarHBondContact O-CG1 3.47Å; I636-I640 PolarHBondContact O-N 3.49Å
637	C	44.5	Very low	45	Very low	56 Å²	56	85.1 Å²	85.1	38%	0.378	45%	0.451	S	S	.	.	H	α-helix	trans	-59.2	-40.6	175.2	-76.6	0	0	0	0	111	I633 W634 F639 I640 Y641	I633-C637 VanDerWaalsContact O-CB 3.3Å; I633-C637 WeakPolarHBondContact O-CB 3.37Å; I633-C637 PolarHBondContact O-N 2.85Å; I633-C637 PolarHBondContact O-SG 2.65Å; W634-C637 PolarHBondContact O-N 3.13Å; C637-F639 VanDerWaalsContact C-N 3.35Å; C637-I640 PolarHBondContact O-N 2.86Å; C637-Y641 VanDerWaalsContact O-CB 3.23Å; C637-Y641 WeakPolarHBondContact O-CB 3.24Å; C637-Y641 PolarHBondContact O-N 3.01Å
638	L	46.8	Very low	44.6	Very low	51 Å²	51	90.9 Å²	90.9	27%	0.267	48%	0.48	S	S	.	.	H	α-helix	trans	-65.7	-37.9	176.1	-164.1	144.6	0	0	0	111.7	F594 W634 M635 I636 L642	F594-L638 HydrophobicContact CD1-CD1 4.21Å; F594-L638 HydrophobicContact CE1-CD1 4.23Å; W634-L638 HydrophobicContact CE3-CD1 4.33Å; W634-L638 HydrophobicContact CH2-CD1 3.16Å; W634-L638 HydrophobicContact CZ2-CD1 3.56Å; W634-L638 HydrophobicContact CZ3-CD1 3.62Å; W634-L638 VanDerWaalsContact O-CB 3.27Å; W634-L638 WeakPolarHBondContact O-CB 3.49Å; W634-L638 PolarHBondContact O-N 3.41Å; M635-L638 PolarHBondContact O-N 3.35Å; I636-L638 VanDerWaalsContact C-N 3.28Å; I636-L638 PolarHBondContact O-N 3.32Å; L638-L642 HydrophobicContact CD2-CD1 3.91Å; L638-L642 WeakPolarHBondContact O-CB 3.3Å; L638-L642 PolarHBondContact O-N 3.46Å
639	F	45.9	Very low	44.3	Very low	146 Å²	146	96.5 Å²	96.5	64%	0.64	51%	0.507	S	S	*	.	H	α-helix	trans	-67.8	-42.7	175.4	-152.9	-90.7	0	0	0	111.9	M635 I636 C637 F643	M635-F639 WeakPolarHBondContact O-CB 3.39Å; M635-F639 PolarHBondContact O-N 2.69Å; I636-F639 WeakPolarHBondContact O-CB 3.26Å; I636-F639 PolarHBondContact O-N 3.42Å; I636-F639 VanDerWaalsContact O-N 3.12Å; C637-F639 VanDerWaalsContact C-N 3.35Å; F639-F643 HydrophobicContact CD1-CD2 4.36Å; F639-F643 HydrophobicContact CD1-CE2 4.45Å; F639-F643 HydrophobicContact CE1-CD2 4.25Å; F639-F643 AromaticContact CE1-CE2 3.9Å; F639-F643 HydrophobicContact CE1-CE2 3.9Å; F639-F643 HydrophobicContact CZ-CE2 4.32Å
640	I	45.3	Very low	44.2	Very low	94 Å²	94	95 Å²	95	48%	0.482	50%	0.496	S	S	.	.	H	α-helix	trans	-69.6	-43.7	176.6	-64.8	170.2	0	0	0	110.7	I636 C637 L642 F643 S644	I636-I640 HydrophobicContact CG2-CD1 3.63Å; I636-I640 HydrophobicContact CG2-CG1 4.3Å; I636-I640 VanDerWaalsContact O-CG1 3.31Å; I636-I640 WeakPolarHBondContact O-CG1 3.47Å; I636-I640 PolarHBondContact O-N 3.49Å; C637-I640 PolarHBondContact O-N 2.86Å; I640-L642 VanDerWaalsContact C-N 3.3Å; I640-L642 PolarHBondContact O-N 3.02Å; I640-F643 PolarHBondContact O-N 3.21Å; I640-S644 PolarHBondContact O-N 3.2Å
641	Y	44.9	Very low	43.7	Very low	94 Å²	94	99.2 Å²	99.2	37%	0.369	51%	0.509	S	S	.	.	H	α-helix	trans	-60.1	-40	177	-115.1	-89.5	0	0	0	111.5	C637 F643 S644 Y645 L650	C637-Y641 VanDerWaalsContact O-CB 3.23Å; C637-Y641 WeakPolarHBondContact O-CB 3.24Å; C637-Y641 PolarHBondContact O-N 3.01Å; Y641-F643 PolarHBondContact O-N 3.13Å; Y641-S644 PolarHBondContact O-N 3.08Å; Y641-Y645 HydrophobicContact CD1-CD2 4.28Å; Y641-Y645 AromaticContact CD1-CE2 3.91Å; Y641-Y645 HydrophobicContact CD1-CE2 3.91Å; Y641-Y645 VanDerWaalsContact O-CD2 3.27Å; Y641-Y645 WeakPolarHBondContact O-CD2 3.38Å; Y641-L650 HydrophobicContact CE1-CD1 3.69Å; Y641-L650 WeakPolarHBondContact OH-CD1 3.5Å; Y641-L650 VanDerWaalsContact OH-CD2 3.27Å; Y641-L650 WeakPolarHBondContact OH-CD2 3.33Å
642	L	44.1	Very low	43.4	Very low	115 Å²	115	100.4 Å²	100.4	60%	0.602	52%	0.517	S	S	*	.	H	α-helix	trans	-60.8	-30.2	176.9	-122.1	101.9	0	0	0	112.6	L638 I640	L638-L642 HydrophobicContact CD2-CD1 3.91Å; L638-L642 WeakPolarHBondContact O-CB 3.3Å; L638-L642 PolarHBondContact O-N 3.46Å; I640-L642 VanDerWaalsContact C-N 3.3Å; I640-L642 PolarHBondContact O-N 3.02Å
643	F	43.3	Very low	43.3	Very low	164 Å²	164	98.1 Å²	98.1	72%	0.719	51%	0.505	S	S	*	.	H	α-helix	trans	-91.1	-24.2	-177.9	-93	-83.4	0	0	0	114.3	F639 I640 Y641	F639-F643 HydrophobicContact CD1-CD2 4.36Å; F639-F643 HydrophobicContact CD1-CE2 4.45Å; F639-F643 HydrophobicContact CE1-CD2 4.25Å; F639-F643 AromaticContact CE1-CE2 3.9Å; F639-F643 HydrophobicContact CE1-CE2 3.9Å; F639-F643 HydrophobicContact CZ-CE2 4.32Å; I640-F643 PolarHBondContact O-N 3.21Å; Y641-F643 PolarHBondContact O-N 3.13Å
644	S	41.6	Very low	42.8	Very low	76 Å²	76	95.1 Å²	95.1	53%	0.531	49%	0.492	S	S	.	.			trans	-104.8	15.7	-172	-63.5	0	0	0	0	115.9	I640 Y641 A646	I640-S644 PolarHBondContact O-N 3.2Å; Y641-S644 PolarHBondContact O-N 3.08Å; S644-A646 PolarHBondContact O-N 3.4Å
645	Y	37.1	Very low	42.2	Very low	121 Å²	121	94.5 Å²	94.5	48%	0.475	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	12.8	-167.5	-128.7	-77.5	0	0	0	117.3	M587 Y641	M587-Y645 HydrophobicContact CE-CE1 3.67Å; Y641-Y645 HydrophobicContact CD1-CD2 4.28Å; Y641-Y645 AromaticContact CD1-CE2 3.91Å; Y641-Y645 HydrophobicContact CD1-CE2 3.91Å; Y641-Y645 VanDerWaalsContact O-CD2 3.27Å; Y641-Y645 WeakPolarHBondContact O-CD2 3.38Å
646	A	36.6	Very low	41.9	Very low	95 Å²	95	90.1 Å²	90.1	79%	0.785	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-11.4	-173.4	0	0	0	0	0	115.5	S644	S644-A646 PolarHBondContact O-N 3.4Å
647	T	38.4	Very low	41.4	Very low	118 Å²	118	86.6 Å²	86.6	72%	0.724	45%	0.454	S	S	*	.	S	Bend	trans	-141.1	4.5	-159.6	51.6	0	0	0	0	119.4
648	L	38.7	Very low	41.1	Very low	134 Å²	134	89.6 Å²	89.6	70%	0.702	46%	0.458	S	S	*	.			trans	-128.8	118.3	-174.9	-87.3	125	0	0	0	115.1	L650	L648-L650 HydrophobicContact CB-CD1 4.44Å; L648-L650 PolarHBondContact O-N 2.96Å
649	D	39.6	Very low	40.8	Very low	171 Å²	171	88.8 Å²	88.8	91%	0.914	46%	0.455	S	S	*	.			trans	-74.3	108.3	172.6	-80.5	-30.6	0	0	0	111.2
650	L	45.1	Very low	40.7	Very low	38 Å²	38	84.3 Å²	84.3	20%	0.199	44%	0.437	C	S	.	.			trans	-109.2	34.9	-168.3	-77.2	150.6	0	0	0	114.5	Y641 L648 P652 I653	Y641-L650 HydrophobicContact CE1-CD1 3.69Å; Y641-L650 WeakPolarHBondContact OH-CD1 3.5Å; Y641-L650 VanDerWaalsContact OH-CD2 3.27Å; Y641-L650 WeakPolarHBondContact OH-CD2 3.33Å; L648-L650 HydrophobicContact CB-CD1 4.44Å; L648-L650 PolarHBondContact O-N 2.96Å; L650-P652 VanDerWaalsContact C-CD 3.4Å; L650-I653 HydrophobicContact CD2-CD1 3.42Å; L650-I653 VanDerWaalsContact CD2-CD1 3.42Å; L650-I653 HydrophobicContact CD2-CG1 4.16Å; L650-I653 PolarHBondContact O-N 2.9Å
651	Y	37.3	Very low	40.3	Very low	143 Å²	143	82 Å²	82	56%	0.561	42%	0.424	S	S	*	.	H	α-helix	trans	-60.9	-32.4	-178.9	-152.3	-95.2	0	0	0	116.5	S654	Y651-S654 PolarHBondContact O-OG 3.06Å
652	P	40.8	Very low	39.9	Very low	47 Å²	47	81 Å²	81	31%	0.305	43%	0.425	S	S	.	.	H	α-helix	trans	-72.1	-29.6	-179.3	24.6	-30.6	0	0	0	113.2	L650 S654 V655 F656 W707	L650-P652 VanDerWaalsContact C-CD 3.4Å; P652-S654 PolarHBondContact O-N 2.9Å; P652-V655 PolarHBondContact O-N 3.24Å; P652-F656 PolarHBondContact O-N 3.32Å; P652-W707 HydrophobicContact CB-CZ2 4.41Å
653	I	44.4	Very low	39.7	Very low	54 Å²	54	79 Å²	79	28%	0.277	42%	0.418	S	S	.	.	H	α-helix	trans	-69.2	-32.7	-178.2	-56.9	-169.4	0	0	0	111.8	L650 V655 F656 V657	L650-I653 HydrophobicContact CD2-CD1 3.42Å; L650-I653 VanDerWaalsContact CD2-CD1 3.42Å; L650-I653 HydrophobicContact CD2-CG1 4.16Å; L650-I653 PolarHBondContact O-N 2.9Å; I653-V655 PolarHBondContact O-N 3.29Å; I653-F656 PolarHBondContact O-N 2.86Å; I653-V657 HydrophobicContact CG2-CG2 4.06Å; I653-V657 WeakPolarHBondContact O-CB 3.3Å; I653-V657 WeakPolarHBondContact O-CG2 3.26Å; I653-V657 PolarHBondContact O-N 2.63Å
654	S	36.5	Very low	39.7	Very low	25 Å²	25	73.2 Å²	73.2	18%	0.175	39%	0.394	C	S	.	.	H	α-helix	trans	-67.1	-36.4	177.2	41	0	0	0	0	113.9	Y590 Y651 P652 F656 V657 Y658	Y590-S654 WeakPolarHBondContact CE1-OG 3.41Å; Y590-S654 VanDerWaalsContact CZ-CB 3.45Å; Y590-S654 PolarHBondContact OH-OG 3.34Å; Y651-S654 PolarHBondContact O-OG 3.06Å; P652-S654 PolarHBondContact O-N 2.9Å; S654-F656 VanDerWaalsContact C-N 3.35Å; S654-V657 PolarHBondContact O-N 3.39Å; S654-Y658 VanDerWaalsContact O-CB 3.22Å; S654-Y658 WeakPolarHBondContact O-CB 3.27Å; S654-Y658 PolarHBondContact O-N 3.33Å
655	V	38.3	Very low	39.5	Very low	34 Å²	34	74.5 Å²	74.5	21%	0.206	39%	0.388	C	S	.	.	H	α-helix	trans	-68	-42.1	-180	-177.7	0	0	0	0	109.5	P652 I653 Y658 T659	P652-V655 PolarHBondContact O-N 3.24Å; I653-V655 PolarHBondContact O-N 3.29Å; V655-Y658 PolarHBondContact O-N 3.18Å; V655-T659 WeakPolarHBondContact O-CB 2.85Å; V655-T659 WeakPolarHBondContact O-CG2 3.28Å; V655-T659 PolarHBondContact O-N 3.49Å; V655-T659 PolarHBondContact O-OG1 2.86Å
656	F	40.2	Very low	39.5	Very low	27 Å²	27	72 Å²	72	12%	0.118	39%	0.386	C	S	.	.	H	α-helix	trans	-61.5	-46.5	174.1	-174.4	-106.9	0	0	0	111.9	P652 I653 S654 Y658 T659 L660 W707 I773	P652-F656 PolarHBondContact O-N 3.32Å; I653-F656 PolarHBondContact O-N 2.86Å; S654-F656 VanDerWaalsContact C-N 3.35Å; F656-Y658 PolarHBondContact O-N 3.42Å; F656-T659 WeakPolarHBondContact CA-OG1 3.42Å; F656-T659 PolarHBondContact O-N 3.5Å; F656-T659 PolarHBondContact O-OG1 3.5Å; F656-L660 HydrophobicContact CD1-CD1 3.88Å; F656-L660 HydrophobicContact CD2-CD1 3.97Å; F656-L660 HydrophobicContact CE1-CD1 3.46Å; F656-L660 VanDerWaalsContact CE1-CD1 3.46Å; F656-L660 HydrophobicContact CE1-CD2 4.35Å; F656-L660 HydrophobicContact CE2-CD1 3.55Å; F656-L660 HydrophobicContact CG-CD1 4.13Å; F656-L660 HydrophobicContact CZ-CD1 3.28Å; F656-L660 WeakPolarHBondContact O-CB 3.21Å; F656-L660 PolarHBondContact O-N 2.79Å; F656-W707 HydrophobicContact CB-CH2 3.91Å; F656-W707 HydrophobicContact CB-CZ2 4.29Å; F656-W707 HydrophobicContact CB-CZ3 4.19Å; F656-W707 HydrophobicContact CD2-CD2 4.37Å; F656-W707 AromaticContact CD2-CE3 3.7Å; F656-W707 HydrophobicContact CD2-CE3 3.7Å; F656-W707 HydrophobicContact CD2-CH2 4.2Å; F656-W707 AromaticContact CD2-CZ3 3.6Å; F656-W707 HydrophobicContact CD2-CZ3 3.6Å; F656-W707 AromaticContact CE2-CE3 3.91Å; F656-W707 HydrophobicContact CE2-CE3 3.91Å; F656-W707 HydrophobicContact CE2-CZ3 4.26Å; F656-W707 HydrophobicContact CG-CE3 4.29Å; F656-W707 HydrophobicContact CG-CH2 4.27Å; F656-W707 HydrophobicContact CG-CZ3 4.12Å; F656-I773 HydrophobicContact CD2-CD1 3.56Å; F656-I773 HydrophobicContact CE2-CD1 3.54Å; F656-I773 HydrophobicContact CE2-CG1 4.19Å
657	V	40.5	Very low	39.5	Very low	16 Å²	16	69.1 Å²	69.1	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-67.7	-37.5	-179.7	171	0	0	0	0	112.1	N593 I597 I653 S654 Q661	N593-V657 HydrophobicContact CB-CG1 3.19Å; I597-V657 HydrophobicContact CD1-CB 4.47Å; I597-V657 HydrophobicContact CD1-CG1 3.9Å; I597-V657 HydrophobicContact CD1-CG2 3.84Å; I653-V657 HydrophobicContact CG2-CG2 4.06Å; I653-V657 WeakPolarHBondContact O-CB 3.3Å; I653-V657 WeakPolarHBondContact O-CG2 3.26Å; I653-V657 PolarHBondContact O-N 2.63Å; S654-V657 PolarHBondContact O-N 3.39Å; V657-Q661 VanDerWaalsContact O-CB 3.25Å; V657-Q661 WeakPolarHBondContact O-CB 3.08Å; V657-Q661 PolarHBondContact O-N 3.29Å
658	Y	38.5	Very low	39.7	Very low	119 Å²	119	66.6 Å²	66.6	47%	0.467	35%	0.348	S	S	.	.	H	α-helix	trans	-67.7	-37.9	176.2	-172.9	-98.4	0	0	0	112.4	S654 V655 F656 N662	S654-Y658 VanDerWaalsContact O-CB 3.22Å; S654-Y658 WeakPolarHBondContact O-CB 3.27Å; S654-Y658 PolarHBondContact O-N 3.33Å; V655-Y658 PolarHBondContact O-N 3.18Å; F656-Y658 PolarHBondContact O-N 3.42Å; Y658-N662 WeakPolarHBondContact CE1-ND2 3.15Å; Y658-N662 PolarHBondContact O-N 2.88Å; Y658-N662 PolarHBondContact O-ND2 3.15Å
659	T	40.2	Very low	39.6	Very low	34 Å²	34	66.8 Å²	66.8	21%	0.209	34%	0.343	C	S	.	.	H	α-helix	trans	-74.2	-42.3	177.8	48.9	0	0	0	0	111.7	V655 F656 Q661 N662 V663	V655-T659 WeakPolarHBondContact O-CB 2.85Å; V655-T659 WeakPolarHBondContact O-CG2 3.28Å; V655-T659 PolarHBondContact O-N 3.49Å; V655-T659 PolarHBondContact O-OG1 2.86Å; F656-T659 WeakPolarHBondContact CA-OG1 3.42Å; F656-T659 PolarHBondContact O-N 3.5Å; F656-T659 PolarHBondContact O-OG1 3.5Å; T659-Q661 VanDerWaalsContact C-N 3.3Å; T659-Q661 PolarHBondContact O-N 2.83Å; T659-N662 PolarHBondContact O-N 3.37Å; T659-V663 WeakPolarHBondContact O-CG2 3.37Å; T659-V663 PolarHBondContact O-N 3.07Å
660	L	42.3	Very low	39.5	Very low	51 Å²	51	63.7 Å²	63.7	27%	0.267	33%	0.326	S	S	.	.	H	α-helix	trans	-55.8	-46.6	169.5	-109.9	86.5	0	0	0	110.9	F656 N662 V663 I664	F656-L660 HydrophobicContact CD1-CD1 3.88Å; F656-L660 HydrophobicContact CD2-CD1 3.97Å; F656-L660 HydrophobicContact CE1-CD1 3.46Å; F656-L660 VanDerWaalsContact CE1-CD1 3.46Å; F656-L660 HydrophobicContact CE1-CD2 4.35Å; F656-L660 HydrophobicContact CE2-CD1 3.55Å; F656-L660 HydrophobicContact CG-CD1 4.13Å; F656-L660 HydrophobicContact CZ-CD1 3.28Å; F656-L660 WeakPolarHBondContact O-CB 3.21Å; F656-L660 PolarHBondContact O-N 2.79Å; L660-N662 VanDerWaalsContact C-N 3.31Å; L660-N662 PolarHBondContact O-N 3.22Å; L660-V663 PolarHBondContact O-N 3.05Å; L660-I664 HydrophobicContact CB-CD1 4.16Å; L660-I664 HydrophobicContact CD2-CD1 3.46Å; L660-I664 VanDerWaalsContact CD2-CD1 3.46Å; L660-I664 HydrophobicContact CG-CD1 3.5Å; L660-I664 HydrophobicContact CG-CG1 4.33Å; L660-I664 WeakPolarHBondContact O-CB 3.39Å; L660-I664 WeakPolarHBondContact O-CG1 3.44Å; L660-I664 PolarHBondContact O-N 3.19Å
661	Q	37.2	Very low	39.4	Very low	45 Å²	45	64.4 Å²	64.4	21%	0.21	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-36.3	-176.6	-161.5	-172	-17.5	0	0	112.5	N593 V657 T659 Y665	N593-Q661 PolarHBondContact ND2-OE1 3.39Å; N593-Q661 PolarHBondContact OD1-OE1 3.05Å; V657-Q661 VanDerWaalsContact O-CB 3.25Å; V657-Q661 WeakPolarHBondContact O-CB 3.08Å; V657-Q661 PolarHBondContact O-N 3.29Å; T659-Q661 VanDerWaalsContact C-N 3.3Å; T659-Q661 PolarHBondContact O-N 2.83Å; Q661-Y665 HydrophobicContact CB-CD2 4.3Å; Q661-Y665 HydrophobicContact CG-CD2 3.47Å; Q661-Y665 VanDerWaalsContact CG-CD2 3.47Å; Q661-Y665 HydrophobicContact CG-CE2 3.55Å; Q661-Y665 WeakPolarHBondContact O-CB 3.4Å; Q661-Y665 WeakPolarHBondContact O-CD2 3.44Å; Q661-Y665 PolarHBondContact O-N 2.95Å
662	N	37.9	Very low	39.6	Very low	73 Å²	73	59.9 Å²	59.9	39%	0.39	32%	0.319	S	S	.	.	H	α-helix	trans	-80.2	-20.1	-179.2	-71.7	-32.2	0	0	0	114	Y658 T659 L660 P666	Y658-N662 WeakPolarHBondContact CE1-ND2 3.15Å; Y658-N662 PolarHBondContact O-N 2.88Å; Y658-N662 PolarHBondContact O-ND2 3.15Å; T659-N662 PolarHBondContact O-N 3.37Å; L660-N662 VanDerWaalsContact C-N 3.31Å; L660-N662 PolarHBondContact O-N 3.22Å; N662-P666 WeakPolarHBondContact O-CD 3.04Å; N662-P666 VanDerWaalsContact O-CG 3.25Å; N662-P666 WeakPolarHBondContact O-CG 3.47Å
663	V	39.7	Very low	39.3	Very low	73 Å²	73	61.2 Å²	61.2	44%	0.442	33%	0.326	S	S	.	.	H	α-helix	trans	-98.8	-44.3	179.9	178.9	0	0	0	0	111	T659 L660 G667 L777	T659-V663 WeakPolarHBondContact O-CG2 3.37Å; T659-V663 PolarHBondContact O-N 3.07Å; L660-V663 PolarHBondContact O-N 3.05Å; V663-G667 WeakPolarHBondContact O-CA 3.47Å; V663-G667 PolarHBondContact O-N 3.07Å; V663-L777 HydrophobicContact CG1-CD1 4.41Å
664	I	43.1	Very low	39	Very low	43 Å²	43	59.8 Å²	59.8	22%	0.221	32%	0.322	C	S	.	.	H	α-helix	trans	-76	-37	-175.5	-64.2	-175.9	0	0	0	111.6	L660 G667 L668	L660-I664 HydrophobicContact CB-CD1 4.16Å; L660-I664 HydrophobicContact CD2-CD1 3.46Å; L660-I664 VanDerWaalsContact CD2-CD1 3.46Å; L660-I664 HydrophobicContact CG-CD1 3.5Å; L660-I664 HydrophobicContact CG-CG1 4.33Å; L660-I664 WeakPolarHBondContact O-CB 3.39Å; L660-I664 WeakPolarHBondContact O-CG1 3.44Å; L660-I664 PolarHBondContact O-N 3.19Å; I664-G667 PolarHBondContact O-N 2.61Å; I664-L668 HydrophobicContact CG2-CD1 3.25Å; I664-L668 HydrophobicContact CG2-CG 3.76Å; I664-L668 WeakPolarHBondContact O-CA 3.32Å; I664-L668 WeakPolarHBondContact O-CB 3.37Å; I664-L668 WeakPolarHBondContact O-CG 3.39Å; I664-L668 PolarHBondContact O-N 3Å
665	Y	38.1	Very low	39.4	Very low	104 Å²	104	60.9 Å²	60.9	41%	0.408	32%	0.324	S	S	.	.	H	α-helix	trans	-68.3	-47.3	-179.7	-85.9	-89.4	0	0	0	113.5	Q661 F669	Q661-Y665 HydrophobicContact CB-CD2 4.3Å; Q661-Y665 HydrophobicContact CG-CD2 3.47Å; Q661-Y665 VanDerWaalsContact CG-CD2 3.47Å; Q661-Y665 HydrophobicContact CG-CE2 3.55Å; Q661-Y665 WeakPolarHBondContact O-CB 3.4Å; Q661-Y665 WeakPolarHBondContact O-CD2 3.44Å; Q661-Y665 PolarHBondContact O-N 2.95Å; Y665-F669 WeakPolarHBondContact O-CB 3.39Å; Y665-F669 PolarHBondContact O-N 2.64Å
666	P	35.9	Very low	39.4	Very low	67 Å²	67	65 Å²	65	44%	0.435	34%	0.343	S	S	.	.	H	α-helix	trans	-67.8	-39.2	173.2	-18.4	32.6	0	0	0	111.2	N662 F669 I670	N662-P666 WeakPolarHBondContact O-CD 3.04Å; N662-P666 VanDerWaalsContact O-CG 3.25Å; N662-P666 WeakPolarHBondContact O-CG 3.47Å; P666-F669 PolarHBondContact O-N 3.11Å; P666-I670 VanDerWaalsContact O-CB 3.3Å; P666-I670 WeakPolarHBondContact O-CB 3.16Å; P666-I670 WeakPolarHBondContact O-CD1 3.09Å; P666-I670 WeakPolarHBondContact O-CG1 3.45Å; P666-I670 PolarHBondContact O-N 2.87Å
667	G	37.2	Very low	39.1	Very low	35 Å²	35	66.1 Å²	66.1	36%	0.361	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-55.4	177.6	0	0	0	0	0	112	V663 I664 I670 L671	V663-G667 WeakPolarHBondContact O-CA 3.47Å; V663-G667 PolarHBondContact O-N 3.07Å; I664-G667 PolarHBondContact O-N 2.61Å; G667-I670 PolarHBondContact O-N 3.05Å; G667-L671 VanDerWaalsContact O-CB 3.28Å; G667-L671 WeakPolarHBondContact O-CB 3.49Å; G667-L671 PolarHBondContact O-N 2.92Å
668	L	42.1	Very low	39.2	Very low	66 Å²	66	68 Å²	68	35%	0.346	36%	0.363	S	S	.	.	H	α-helix	trans	-69.6	-28.9	176	-72.6	175.6	0	0	0	113.1	L600 I664 L671 S672	L600-L668 HydrophobicContact CD1-CD1 3.94Å; I664-L668 HydrophobicContact CG2-CD1 3.25Å; I664-L668 HydrophobicContact CG2-CG 3.76Å; I664-L668 WeakPolarHBondContact O-CA 3.32Å; I664-L668 WeakPolarHBondContact O-CB 3.37Å; I664-L668 WeakPolarHBondContact O-CG 3.39Å; I664-L668 PolarHBondContact O-N 3Å; L668-L671 HydrophobicContact CD2-CD2 4.31Å; L668-S672 WeakPolarHBondContact O-CA 3.09Å; L668-S672 WeakPolarHBondContact O-CB 3.11Å; L668-S672 PolarHBondContact O-N 3.46Å; L668-S672 PolarHBondContact O-OG 3.34Å
669	F	36.9	Very low	39.3	Very low	137 Å²	137	67.7 Å²	67.7	60%	0.601	37%	0.368	S	S	*	.	H	α-helix	trans	-68.6	-46.8	173.4	-175.1	-98.5	0	0	0	110.5	Y665 P666 L671 S672 V673	Y665-F669 WeakPolarHBondContact O-CB 3.39Å; Y665-F669 PolarHBondContact O-N 2.64Å; P666-F669 PolarHBondContact O-N 3.11Å; F669-L671 VanDerWaalsContact C-N 3.34Å; F669-S672 WeakPolarHBondContact CA-OG 3.44Å; F669-S672 PolarHBondContact O-N 2.87Å; F669-S672 PolarHBondContact O-OG 2.96Å; F669-V673 HydrophobicContact CD1-CG2 4.2Å; F669-V673 HydrophobicContact CE1-CG2 3.87Å; F669-V673 HydrophobicContact CE2-CG2 4.44Å; F669-V673 HydrophobicContact CZ-CG2 4.01Å; F669-V673 VanDerWaalsContact O-CG2 3.31Å; F669-V673 WeakPolarHBondContact O-CG2 3.23Å; F669-V673 PolarHBondContact O-N 3.41Å
670	I	38.1	Very low	39.2	Very low	107 Å²	107	69.7 Å²	69.7	55%	0.549	38%	0.383	S	S	.	.	H	α-helix	trans	-61.5	-44.8	173	-66.8	164.3	0	0	0	109.9	P666 G667 S672 V673 A674	P666-I670 VanDerWaalsContact O-CB 3.3Å; P666-I670 WeakPolarHBondContact O-CB 3.16Å; P666-I670 WeakPolarHBondContact O-CD1 3.09Å; P666-I670 WeakPolarHBondContact O-CG1 3.45Å; P666-I670 PolarHBondContact O-N 2.87Å; G667-I670 PolarHBondContact O-N 3.05Å; I670-S672 VanDerWaalsContact C-N 3.31Å; I670-S672 PolarHBondContact O-N 2.91Å; I670-V673 PolarHBondContact O-N 3.18Å; I670-A674 WeakPolarHBondContact O-CB 3.28Å; I670-A674 PolarHBondContact O-N 3.43Å
671	L	42.1	Very low	39.1	Very low	53 Å²	53	72.7 Å²	72.7	28%	0.277	40%	0.399	S	S	.	.	H	α-helix	trans	-60.3	-41.7	175.1	-136	79.3	0	0	0	110.6	G667 L668 F669 A674 F675 I696	G667-L671 VanDerWaalsContact O-CB 3.28Å; G667-L671 WeakPolarHBondContact O-CB 3.49Å; G667-L671 PolarHBondContact O-N 2.92Å; L668-L671 HydrophobicContact CD2-CD2 4.31Å; F669-L671 VanDerWaalsContact C-N 3.34Å; L671-A674 CarbonylContact O-C 3.45Å; L671-A674 PolarHBondContact O-N 3.4Å; L671-F675 HydrophobicContact CB-CD2 4.21Å; L671-F675 HydrophobicContact CB-CE2 4.22Å; L671-F675 HydrophobicContact CD2-CD2 4.18Å; L671-F675 HydrophobicContact CD2-CE2 3.39Å; L671-F675 HydrophobicContact CD2-CZ 4.19Å; L671-F675 HydrophobicContact CG-CD2 3.9Å; L671-F675 HydrophobicContact CG-CE2 3.47Å; L671-F675 VanDerWaalsContact CG-CE2 3.47Å; L671-F675 HydrophobicContact CG-CZ 4.3Å; L671-F675 WeakPolarHBondContact O-CB 3.4Å; L671-F675 WeakPolarHBondContact O-CD2 3.4Å; L671-F675 VanDerWaalsContact O-CG 3.26Å; L671-F675 WeakPolarHBondContact O-CG 3.41Å; L671-F675 PolarHBondContact O-N 3.47Å; L671-I696 HydrophobicContact CD2-CD1 3.73Å
672	S	41.4	Very low	39.4	Very low	48 Å²	48	77.2 Å²	77.2	34%	0.336	42%	0.424	S	S	.	.	H	α-helix	trans	-69.8	-39.6	-179.9	71.2	0	0	0	0	112.3	L668 F669 I670 F675 I676	L668-S672 WeakPolarHBondContact O-CA 3.09Å; L668-S672 WeakPolarHBondContact O-CB 3.11Å; L668-S672 PolarHBondContact O-N 3.46Å; L668-S672 PolarHBondContact O-OG 3.34Å; F669-S672 WeakPolarHBondContact CA-OG 3.44Å; F669-S672 PolarHBondContact O-N 2.87Å; F669-S672 PolarHBondContact O-OG 2.96Å; I670-S672 VanDerWaalsContact C-N 3.31Å; I670-S672 PolarHBondContact O-N 2.91Å; S672-F675 PolarHBondContact O-N 3.16Å; S672-I676 WeakPolarHBondContact O-CB 3.44Å; S672-I676 WeakPolarHBondContact O-CD1 3.25Å; S672-I676 WeakPolarHBondContact O-CG1 3.49Å; S672-I676 PolarHBondContact O-N 3.29Å
673	V	35.3	Very low	39.8	Very low	75 Å²	75	76.7 Å²	76.7	46%	0.455	42%	0.423	S	S	.	.	H	α-helix	trans	-69	-39.9	174.7	173.4	0	0	0	0	110	F669 I670 I676 S677	F669-V673 HydrophobicContact CD1-CG2 4.2Å; F669-V673 HydrophobicContact CE1-CG2 3.87Å; F669-V673 HydrophobicContact CE2-CG2 4.44Å; F669-V673 HydrophobicContact CZ-CG2 4.01Å; F669-V673 VanDerWaalsContact O-CG2 3.31Å; F669-V673 WeakPolarHBondContact O-CG2 3.23Å; F669-V673 PolarHBondContact O-N 3.41Å; I670-V673 PolarHBondContact O-N 3.18Å; V673-I676 PolarHBondContact O-N 3.08Å; V673-S677 PolarHBondContact O-N 3.33Å; V673-S677 PolarHBondContact O-OG 3.16Å
674	A	37.7	Very low	40.1	Very low	23 Å²	23	76.1 Å²	76.1	19%	0.19	42%	0.418	C	S	.	.	H	α-helix	trans	-66.7	-38.6	174.1	0	0	0	0	0	111.9	I670 L671 S677 M678	I670-A674 WeakPolarHBondContact O-CB 3.28Å; I670-A674 PolarHBondContact O-N 3.43Å; L671-A674 CarbonylContact O-C 3.45Å; L671-A674 PolarHBondContact O-N 3.4Å; A674-S677 WeakPolarHBondContact CA-OG 3.37Å; A674-S677 PolarHBondContact O-N 2.82Å; A674-S677 PolarHBondContact O-OG 3.15Å; A674-M678 VanDerWaalsContact O-CB 3.28Å; A674-M678 WeakPolarHBondContact O-CB 3.22Å; A674-M678 VanDerWaalsContact O-CG 3.24Å; A674-M678 WeakPolarHBondContact O-CG 3.48Å; A674-M678 PolarHBondContact O-N 3.46Å
675	F	43.6	Very low	40.5	Very low	49 Å²	49	75.5 Å²	75.5	22%	0.215	42%	0.416	C	S	.	.	H	α-helix	trans	-68.2	-41.3	174.8	-82.8	-56.6	0	0	0	111.1	L671 S672 S677 M678 I679 L692	L671-F675 HydrophobicContact CB-CD2 4.21Å; L671-F675 HydrophobicContact CB-CE2 4.22Å; L671-F675 HydrophobicContact CD2-CD2 4.18Å; L671-F675 HydrophobicContact CD2-CE2 3.39Å; L671-F675 HydrophobicContact CD2-CZ 4.19Å; L671-F675 HydrophobicContact CG-CD2 3.9Å; L671-F675 HydrophobicContact CG-CE2 3.47Å; L671-F675 VanDerWaalsContact CG-CE2 3.47Å; L671-F675 HydrophobicContact CG-CZ 4.3Å; L671-F675 WeakPolarHBondContact O-CB 3.4Å; L671-F675 WeakPolarHBondContact O-CD2 3.4Å; L671-F675 VanDerWaalsContact O-CG 3.26Å; L671-F675 WeakPolarHBondContact O-CG 3.41Å; L671-F675 PolarHBondContact O-N 3.47Å; S672-F675 PolarHBondContact O-N 3.16Å; F675-S677 VanDerWaalsContact C-N 3.32Å; F675-S677 PolarHBondContact O-N 3.37Å; F675-M678 PolarHBondContact O-N 3.01Å; F675-I679 VanDerWaalsContact O-CB 3.29Å; F675-I679 WeakPolarHBondContact O-CB 3.15Å; F675-I679 WeakPolarHBondContact O-CD1 3.4Å; F675-I679 WeakPolarHBondContact O-CG1 3.44Å; F675-I679 PolarHBondContact O-N 2.93Å; F675-L692 HydrophobicContact CZ-CD2 4.41Å
676	I	39.6	Very low	40.9	Very low	119 Å²	119	74.2 Å²	74.2	61%	0.61	42%	0.421	S	S	*	.	H	α-helix	trans	-61.7	-42.8	173.3	-70.2	163.3	0	0	0	110	S672 V673 S680	S672-I676 WeakPolarHBondContact O-CB 3.44Å; S672-I676 WeakPolarHBondContact O-CD1 3.25Å; S672-I676 WeakPolarHBondContact O-CG1 3.49Å; S672-I676 PolarHBondContact O-N 3.29Å; V673-I676 PolarHBondContact O-N 3.08Å; I676-S680 WeakPolarHBondContact O-CB 3.19Å; I676-S680 PolarHBondContact O-N 3.38Å; I676-S680 PolarHBondContact O-OG 2.96Å
677	S	34.4	Very low	41.5	Very low	52 Å²	52	76 Å²	76	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-68.4	-39.3	176.4	68.4	0	0	0	0	112.6	V673 A674 F675 S680 I681	V673-S677 PolarHBondContact O-N 3.33Å; V673-S677 PolarHBondContact O-OG 3.16Å; A674-S677 WeakPolarHBondContact CA-OG 3.37Å; A674-S677 PolarHBondContact O-N 2.82Å; A674-S677 PolarHBondContact O-OG 3.15Å; F675-S677 VanDerWaalsContact C-N 3.32Å; F675-S677 PolarHBondContact O-N 3.37Å; S677-S680 WeakPolarHBondContact CA-OG 3.17Å; S677-S680 PolarHBondContact O-N 3.5Å; S677-S680 PolarHBondContact O-OG 3.44Å; S677-I681 VanDerWaalsContact O-CD1 3.32Å; S677-I681 WeakPolarHBondContact O-CD1 3.45Å; S677-I681 WeakPolarHBondContact O-CG1 3.43Å; S677-I681 PolarHBondContact O-N 3.35Å; S677-I681 VanDerWaalsContact O-N 3.16Å
678	M	41.9	Very low	41.9	Very low	55 Å²	55	75.2 Å²	75.2	27%	0.271	41%	0.414	S	S	.	.	H	α-helix	trans	-74.4	-32.1	-179	-73.8	-150.6	-79.7	0	0	112.7	A674 F675 I681 N682 L684	A674-M678 VanDerWaalsContact O-CB 3.28Å; A674-M678 WeakPolarHBondContact O-CB 3.22Å; A674-M678 VanDerWaalsContact O-CG 3.24Å; A674-M678 WeakPolarHBondContact O-CG 3.48Å; A674-M678 PolarHBondContact O-N 3.46Å; F675-M678 PolarHBondContact O-N 3.01Å; M678-I681 PolarHBondContact O-N 3.29Å; M678-N682 PolarHBondContact O-N 3.08Å; M678-L684 HydrophobicContact CB-CD1 4.33Å; M678-L684 HydrophobicContact CE-CD1 4.16Å; M678-L684 HydrophobicContact SD-CD1 3.94Å
679	I	40.1	Very low	42.2	Very low	113 Å²	113	74 Å²	74	58%	0.579	41%	0.409	S	S	*	.	H	α-helix	trans	-67.8	-41.7	169	-67.2	165.1	0	0	0	109.7	F675 I681 N682	F675-I679 VanDerWaalsContact O-CB 3.29Å; F675-I679 WeakPolarHBondContact O-CB 3.15Å; F675-I679 WeakPolarHBondContact O-CD1 3.4Å; F675-I679 WeakPolarHBondContact O-CG1 3.44Å; F675-I679 PolarHBondContact O-N 2.93Å; I679-I681 PolarHBondContact O-N 3.44Å; I679-N682 PolarHBondContact O-N 3.14Å; I679-N682 VanDerWaalsContact O-N 3.11Å
680	S	37.9	Very low	42.6	Very low	75 Å²	75	68.5 Å²	68.5	52%	0.524	39%	0.387	S	S	.	.	H	α-helix	trans	-64.3	-21	177.5	73.2	0	0	0	0	114.2	I676 S677	I676-S680 WeakPolarHBondContact O-CB 3.19Å; I676-S680 PolarHBondContact O-N 3.38Å; I676-S680 PolarHBondContact O-OG 2.96Å; S677-S680 WeakPolarHBondContact CA-OG 3.17Å; S677-S680 PolarHBondContact O-N 3.5Å; S677-S680 PolarHBondContact O-OG 3.44Å
681	I	41.2	Very low	43	Very low	115 Å²	115	70.1 Å²	70.1	59%	0.59	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	4	179.9	-54.1	161.6	0	0	0	111.2	S677 M678 I679 V683	S677-I681 VanDerWaalsContact O-CD1 3.32Å; S677-I681 WeakPolarHBondContact O-CD1 3.45Å; S677-I681 WeakPolarHBondContact O-CG1 3.43Å; S677-I681 PolarHBondContact O-N 3.35Å; S677-I681 VanDerWaalsContact O-N 3.16Å; M678-I681 PolarHBondContact O-N 3.29Å; I679-I681 PolarHBondContact O-N 3.44Å; I681-V683 HydrophobicContact CB-CG2 3.63Å; I681-V683 HydrophobicContact CG2-CG2 3.33Å; I681-V683 WeakPolarHBondContact O-CG2 3.4Å; I681-V683 PolarHBondContact O-N 2.94Å; I681-V683 VanDerWaalsContact O-N 3.12Å
682	N	43.2	Very low	43.4	Very low	140 Å²	140	70 Å²	70	75%	0.749	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	24.6	177.1	-107.9	-3.4	0	0	0	114.9	M678 I679	M678-N682 PolarHBondContact O-N 3.08Å; I679-N682 PolarHBondContact O-N 3.14Å; I679-N682 VanDerWaalsContact O-N 3.11Å
683	V	46	Very low	43.7	Very low	61 Å²	61	72 Å²	72	37%	0.37	40%	0.396	S	S	.	.			trans	-85	-16.3	-166	-171	0	0	0	0	113.7	I681 L807	I681-V683 HydrophobicContact CB-CG2 3.63Å; I681-V683 HydrophobicContact CG2-CG2 3.33Å; I681-V683 WeakPolarHBondContact O-CG2 3.4Å; I681-V683 PolarHBondContact O-N 2.94Å; I681-V683 VanDerWaalsContact O-N 3.12Å; V683-L807 HydrophobicContact CG1-CD1 3.57Å
684	L	45.5	Very low	44.2	Very low	61 Å²	61	72.5 Å²	72.5	32%	0.319	39%	0.393	S	S	.	.	S	Bend	trans	-123.9	128.9	-170	-84.3	154.9	0	0	0	113.4	M678 L688	M678-L684 HydrophobicContact CB-CD1 4.33Å; M678-L684 HydrophobicContact CE-CD1 4.16Å; M678-L684 HydrophobicContact SD-CD1 3.94Å; L684-L688 HydrophobicContact CD2-CB 3.97Å; L684-L688 HydrophobicContact CD2-CD2 3.19Å; L684-L688 HydrophobicContact CD2-CG 4.17Å
685	P	52	Low	44.7	Very low	30 Å²	30	73.1 Å²	73.1	20%	0.195	40%	0.395	C	S	.	.			trans	-67.5	148.3	167.6	28	-31.5	0	0	0	110.7	D687 L688 Y791	P685-D687 PolarHBondContact O-N 3.43Å; P685-L688 PolarHBondContact O-N 3.31Å; P685-Y791 WeakPolarHBondContact CG-OH 3.45Å
686	P	46.7	Very low	45	Very low	77 Å²	77	73.6 Å²	73.6	50%	0.5	40%	0.399	S	S	.	.	H	α-helix	trans	-59.9	-19	-176.3	23.3	-33.8	0	0	0	114.3	T689	P686-T689 PolarHBondContact O-OG1 3.16Å
687	D	47.7	Very low	45.2	Very low	105 Å²	105	71.3 Å²	71.3	56%	0.561	39%	0.385	S	S	*	.	H	α-helix	trans	-71.3	-31.4	-179.9	-58.1	-35.9	0	0	0	112.9	P685 F691	P685-D687 PolarHBondContact O-N 3.43Å; D687-F691 PolarHBondContact O-N 3.27Å
688	L	46.8	Very low	45.6	Very low	19 Å²	19	72.7 Å²	72.7	10%	0.099	39%	0.388	C	S	.	.	H	α-helix	trans	-74.9	-30.7	-179.2	-154.9	80.3	0	0	0	111.9	L684 P685 V690 F691 L692 L788 Y791	L684-L688 HydrophobicContact CD2-CB 3.97Å; L684-L688 HydrophobicContact CD2-CD2 3.19Å; L684-L688 HydrophobicContact CD2-CG 4.17Å; P685-L688 PolarHBondContact O-N 3.31Å; L688-V690 VanDerWaalsContact C-N 3.33Å; L688-F691 PolarHBondContact O-N 2.8Å; L688-L692 WeakPolarHBondContact O-CB 3.41Å; L688-L692 PolarHBondContact O-N 3.29Å; L688-L788 HydrophobicContact CD2-CD1 3.84Å; L688-Y791 HydrophobicContact CD1-CD1 3.56Å; L688-Y791 HydrophobicContact CD1-CD2 3.52Å; L688-Y791 HydrophobicContact CD1-CE1 3.76Å; L688-Y791 HydrophobicContact CD1-CE2 3.73Å; L688-Y791 HydrophobicContact CD1-CG 3.43Å; L688-Y791 VanDerWaalsContact CD1-CG 3.43Å; L688-Y791 HydrophobicContact CD2-CD1 3.93Å; L688-Y791 HydrophobicContact CD2-CE1 3.97Å; L688-Y791 HydrophobicContact CG-CD1 4.4Å; L688-Y791 HydrophobicContact CG-CE1 4.39Å
689	T	47.7	Very low	45.8	Very low	39 Å²	39	70.7 Å²	70.7	24%	0.239	38%	0.379	C	S	.	.	H	α-helix	trans	-67.3	-36.4	177.7	54.3	0	0	0	0	111.3	P686 L692 L693	P686-T689 PolarHBondContact O-OG1 3.16Å; T689-L692 PolarHBondContact O-N 2.87Å; T689-L693 WeakPolarHBondContact O-CB 3.37Å; T689-L693 PolarHBondContact O-N 3.34Å
690	V	45.6	Very low	46.1	Very low	23 Å²	23	68 Å²	68	14%	0.139	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-46	173.7	-174.1	0	0	0	0	111.2	L611 L615 L688 L692 L693 F694	L611-V690 HydrophobicContact CD2-CG2 3.34Å; L615-V690 HydrophobicContact CD2-CG2 4.04Å; L688-V690 VanDerWaalsContact C-N 3.33Å; V690-L692 VanDerWaalsContact C-N 3.34Å; V690-L692 PolarHBondContact O-N 3.48Å; V690-L693 PolarHBondContact O-N 3.14Å; V690-F694 VanDerWaalsContact O-CB 3.31Å; V690-F694 WeakPolarHBondContact O-CB 3.21Å; V690-F694 PolarHBondContact O-N 3.01Å
691	F	47.1	Very low	46.3	Very low	140 Å²	140	67.1 Å²	67.1	61%	0.614	36%	0.358	S	S	*	.	H	α-helix	trans	-63.8	-38.6	179.2	-100.5	-84.2	0	0	0	112.8	D687 L688 F694 S695	D687-F691 PolarHBondContact O-N 3.27Å; L688-F691 PolarHBondContact O-N 2.8Å; F691-F694 PolarHBondContact O-N 3.26Å; F691-S695 PolarHBondContact O-N 2.87Å
692	L	48.9	Very low	46.3	Very low	50 Å²	50	64.6 Å²	64.6	26%	0.262	35%	0.348	S	S	.	.	H	α-helix	trans	-71.3	-41.6	180	-135.4	147.5	0	0	0	111.3	F675 L688 T689 V690 F694 S695 I696 L788	F675-L692 HydrophobicContact CZ-CD2 4.41Å; L688-L692 WeakPolarHBondContact O-CB 3.41Å; L688-L692 PolarHBondContact O-N 3.29Å; T689-L692 PolarHBondContact O-N 2.87Å; V690-L692 VanDerWaalsContact C-N 3.34Å; V690-L692 PolarHBondContact O-N 3.48Å; L692-F694 VanDerWaalsContact C-N 3.31Å; L692-F694 PolarHBondContact O-N 2.92Å; L692-S695 PolarHBondContact O-N 3.45Å; L692-S695 PolarHBondContact O-OG 3.48Å; L692-I696 HydrophobicContact CD2-CD1 4.17Å; L692-I696 WeakPolarHBondContact O-CG1 3.37Å; L692-I696 PolarHBondContact O-N 3.23Å; L692-I696 VanDerWaalsContact O-N 3.08Å; L692-L788 HydrophobicContact CD1-CD1 4.45Å
693	L	49.8	Very low	46.4	Very low	90 Å²	90	59 Å²	59	47%	0.471	32%	0.319	S	S	.	.	H	α-helix	trans	-58.5	-41.8	168.9	-85.7	159.6	0	0	0	111.9	T689 V690 I696 F697	T689-L693 WeakPolarHBondContact O-CB 3.37Å; T689-L693 PolarHBondContact O-N 3.34Å; V690-L693 PolarHBondContact O-N 3.14Å; L693-I696 PolarHBondContact O-N 2.95Å; L693-F697 WeakPolarHBondContact O-CB 3.34Å; L693-F697 PolarHBondContact O-N 2.84Å
694	F	45.3	Very low	46.2	Very low	87 Å²	87	60 Å²	60	38%	0.382	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-36.7	177	-163.6	-106.7	0	0	0	112.3	V690 F691 L692 F697 I698	V690-F694 VanDerWaalsContact O-CB 3.31Å; V690-F694 WeakPolarHBondContact O-CB 3.21Å; V690-F694 PolarHBondContact O-N 3.01Å; F691-F694 PolarHBondContact O-N 3.26Å; L692-F694 VanDerWaalsContact C-N 3.31Å; L692-F694 PolarHBondContact O-N 2.92Å; F694-F697 WeakPolarHBondContact O-CB 3.45Å; F694-F697 PolarHBondContact O-N 3.45Å; F694-I698 HydrophobicContact CD1-CD1 3.65Å; F694-I698 HydrophobicContact CD1-CG1 4.28Å; F694-I698 HydrophobicContact CE1-CD1 3.37Å; F694-I698 HydrophobicContact CE1-CG1 4.12Å; F694-I698 HydrophobicContact CZ-CD1 4.13Å; F694-I698 WeakPolarHBondContact O-CG1 3.19Å; F694-I698 PolarHBondContact O-N 2.84Å
695	S	46.9	Very low	45.9	Very low	35 Å²	35	61 Å²	61	25%	0.245	33%	0.331	C	S	.	.	H	α-helix	trans	-66.2	-40.6	175.6	79.6	0	0	0	0	112.5	F691 L692 F697 I698 S699	F691-S695 PolarHBondContact O-N 2.87Å; L692-S695 PolarHBondContact O-N 3.45Å; L692-S695 PolarHBondContact O-OG 3.48Å; S695-F697 VanDerWaalsContact C-N 3.33Å; S695-I698 PolarHBondContact O-N 3.27Å; S695-S699 VanDerWaalsContact O-CB 3.32Å; S695-S699 WeakPolarHBondContact O-CB 3.44Å; S695-S699 PolarHBondContact O-N 2.91Å
696	I	50.3	Low	45.5	Very low	59 Å²	59	62 Å²	62	30%	0.303	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-39.8	174.6	-65.1	167.4	0	0	0	109.7	L671 L692 L693 S699 C700	L671-I696 HydrophobicContact CD2-CD1 3.73Å; L692-I696 HydrophobicContact CD2-CD1 4.17Å; L692-I696 WeakPolarHBondContact O-CG1 3.37Å; L692-I696 PolarHBondContact O-N 3.23Å; L692-I696 VanDerWaalsContact O-N 3.08Å; L693-I696 PolarHBondContact O-N 2.95Å; I696-S699 WeakPolarHBondContact O-CB 3.3Å; I696-S699 PolarHBondContact O-N 3.45Å; I696-C700 PolarHBondContact O-N 3.26Å; I696-C700 PolarHBondContact O-SG 2.88Å
697	F	45.1	Very low	45.3	Very low	71 Å²	71	60.3 Å²	60.3	31%	0.311	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-48.5	175.9	176.5	-98	0	0	0	112.6	L693 F694 S695 S699 C700 M701	L693-F697 WeakPolarHBondContact O-CB 3.34Å; L693-F697 PolarHBondContact O-N 2.84Å; F694-F697 WeakPolarHBondContact O-CB 3.45Å; F694-F697 PolarHBondContact O-N 3.45Å; S695-F697 VanDerWaalsContact C-N 3.33Å; F697-S699 VanDerWaalsContact C-N 3.29Å; F697-S699 PolarHBondContact O-N 3.01Å; F697-C700 PolarHBondContact O-N 3.47Å; F697-M701 HydrophobicContact CD1-CG 4.35Å; F697-M701 HydrophobicContact CD2-CE 4.37Å; F697-M701 HydrophobicContact CE1-CG 3.93Å; F697-M701 HydrophobicContact CE2-CE 3.47Å; F697-M701 VanDerWaalsContact CE2-CE 3.47Å; F697-M701 HydrophobicContact CE2-CG 4.27Å; F697-M701 HydrophobicContact CZ-CE 3.57Å; F697-M701 HydrophobicContact CZ-CG 3.89Å; F697-M701 HydrophobicContact CZ-SD 4.43Å; F697-M701 WeakPolarHBondContact O-CG 3.27Å; F697-M701 PolarHBondContact O-N 2.95Å
698	I	42.8	Very low	45	Very low	82 Å²	82	60.8 Å²	60.8	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-42.6	175.6	-70.7	176	0	0	0	110.1	F694 S695 C700 M701 V702	F694-I698 HydrophobicContact CD1-CD1 3.65Å; F694-I698 HydrophobicContact CD1-CG1 4.28Å; F694-I698 HydrophobicContact CE1-CD1 3.37Å; F694-I698 HydrophobicContact CE1-CG1 4.12Å; F694-I698 HydrophobicContact CZ-CD1 4.13Å; F694-I698 WeakPolarHBondContact O-CG1 3.19Å; F694-I698 PolarHBondContact O-N 2.84Å; S695-I698 PolarHBondContact O-N 3.27Å; I698-C700 VanDerWaalsContact C-N 3.35Å; I698-C700 PolarHBondContact O-N 3.49Å; I698-M701 PolarHBondContact O-N 2.91Å; I698-V702 HydrophobicContact CG2-CG2 4.12Å; I698-V702 WeakPolarHBondContact O-CB 3.31Å; I698-V702 VanDerWaalsContact O-CG2 3.3Å; I698-V702 WeakPolarHBondContact O-CG2 3.29Å; I698-V702 PolarHBondContact O-N 2.9Å
699	S	44.7	Very low	44.8	Very low	13 Å²	13	64.4 Å²	64.4	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-56.8	-47.1	175.7	178.7	0	0	0	0	112.1	S695 I696 F697 V702 C703 C780	S695-S699 VanDerWaalsContact O-CB 3.32Å; S695-S699 WeakPolarHBondContact O-CB 3.44Å; S695-S699 PolarHBondContact O-N 2.91Å; I696-S699 WeakPolarHBondContact O-CB 3.3Å; I696-S699 PolarHBondContact O-N 3.45Å; F697-S699 VanDerWaalsContact C-N 3.29Å; F697-S699 PolarHBondContact O-N 3.01Å; S699-V702 PolarHBondContact O-N 3.5Å; S699-C703 PolarHBondContact O-N 2.89Å; S699-C703 PolarHBondContact O-SG 2.91Å; S699-C780 WeakPolarHBondContact CB-SG 3.27Å; S699-C780 WeakPolarHBondContact OG-CB 3.5Å; S699-C780 PolarHBondContact OG-SG 3.3Å
700	C	47.1	Very low	44.6	Very low	57 Å²	57	64.5 Å²	64.5	39%	0.385	34%	0.338	S	S	.	.	H	α-helix	trans	-63.3	-41.6	175.2	-73	0	0	0	0	112.8	I696 F697 I698 C703 L704	I696-C700 PolarHBondContact O-N 3.26Å; I696-C700 PolarHBondContact O-SG 2.88Å; F697-C700 PolarHBondContact O-N 3.47Å; I698-C700 VanDerWaalsContact C-N 3.35Å; I698-C700 PolarHBondContact O-N 3.49Å; C700-C703 WeakPolarHBondContact O-CB 3.29Å; C700-C703 PolarHBondContact O-N 2.92Å; C700-L704 WeakPolarHBondContact O-CG 3.46Å; C700-L704 PolarHBondContact O-N 2.71Å
701	M	41.6	Very low	44.3	Very low	56 Å²	56	65.2 Å²	65.2	28%	0.276	34%	0.341	S	S	.	.	H	α-helix	trans	-65.7	-42.4	177.9	-73.8	-64	159.1	0	0	112.2	L630 F697 I698 C703 L704 V705	L630-M701 HydrophobicContact CD1-CE 3.52Å; F697-M701 HydrophobicContact CD1-CG 4.35Å; F697-M701 HydrophobicContact CD2-CE 4.37Å; F697-M701 HydrophobicContact CE1-CG 3.93Å; F697-M701 HydrophobicContact CE2-CE 3.47Å; F697-M701 VanDerWaalsContact CE2-CE 3.47Å; F697-M701 HydrophobicContact CE2-CG 4.27Å; F697-M701 HydrophobicContact CZ-CE 3.57Å; F697-M701 HydrophobicContact CZ-CG 3.89Å; F697-M701 HydrophobicContact CZ-SD 4.43Å; F697-M701 WeakPolarHBondContact O-CG 3.27Å; F697-M701 PolarHBondContact O-N 2.95Å; I698-M701 PolarHBondContact O-N 2.91Å; M701-C703 VanDerWaalsContact C-N 3.3Å; M701-C703 PolarHBondContact O-N 2.81Å; M701-L704 PolarHBondContact O-N 2.9Å; M701-L704 HydrophobicContact SD-CD1 4.29Å; M701-V705 WeakPolarHBondContact O-CG2 3.46Å; M701-V705 PolarHBondContact O-N 3.37Å
702	V	41.4	Very low	44	Very low	62 Å²	62	61.3 Å²	61.3	38%	0.376	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-39.2	174.9	172.6	0	0	0	0	110.7	I698 S699 L704 I706 I776	I698-V702 HydrophobicContact CG2-CG2 4.12Å; I698-V702 WeakPolarHBondContact O-CB 3.31Å; I698-V702 VanDerWaalsContact O-CG2 3.3Å; I698-V702 WeakPolarHBondContact O-CG2 3.29Å; I698-V702 PolarHBondContact O-N 2.9Å; S699-V702 PolarHBondContact O-N 3.5Å; V702-L704 PolarHBondContact O-N 2.93Å; V702-I706 HydrophobicContact CG1-CD1 3.66Å; V702-I706 HydrophobicContact CG1-CG1 4.43Å; V702-I706 WeakPolarHBondContact O-CB 3.25Å; V702-I706 VanDerWaalsContact O-CG1 3.26Å; V702-I706 WeakPolarHBondContact O-CG1 3.25Å; V702-I706 PolarHBondContact O-N 3.33Å; V702-I776 HydrophobicContact CG1-CG2 4.5Å
703	C	45.3	Very low	43.5	Very low	22 Å²	22	63.2 Å²	63.2	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-62.2	-41.1	173.7	-68.4	0	0	0	0	112.5	S699 C700 M701 W707 I776	S699-C703 PolarHBondContact O-N 2.89Å; S699-C703 PolarHBondContact O-SG 2.91Å; C700-C703 WeakPolarHBondContact O-CB 3.29Å; C700-C703 PolarHBondContact O-N 2.92Å; M701-C703 VanDerWaalsContact C-N 3.3Å; M701-C703 PolarHBondContact O-N 2.81Å; C703-W707 WeakPolarHBondContact O-CB 3.32Å; C703-W707 PolarHBondContact O-N 2.62Å; C703-W707 VanDerWaalsContact O-N 3.09Å; C703-I776 WeakPolarHBondContact SG-CG2 3.3Å
704	L	42.4	Very low	43.1	Very low	81 Å²	81	61 Å²	61	42%	0.424	33%	0.329	S	S	.	.	H	α-helix	trans	-68.1	-44.6	178.3	-74	169.4	0	0	0	112.1	C700 M701 V702 I706 W707 D708	C700-L704 WeakPolarHBondContact O-CG 3.46Å; C700-L704 PolarHBondContact O-N 2.71Å; M701-L704 PolarHBondContact O-N 2.9Å; M701-L704 HydrophobicContact SD-CD1 4.29Å; V702-L704 PolarHBondContact O-N 2.93Å; L704-I706 PolarHBondContact O-N 2.86Å; L704-W707 WeakPolarHBondContact O-CB 3.34Å; L704-W707 PolarHBondContact O-N 3.16Å; L704-D708 PolarHBondContact O-N 2.79Å
705	V	39.6	Very low	42.7	Very low	83 Å²	83	60.5 Å²	60.5	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-64.5	-42.3	179.5	172.3	0	0	0	0	111.4	M701 W707 D708 I709	M701-V705 WeakPolarHBondContact O-CG2 3.46Å; M701-V705 PolarHBondContact O-N 3.37Å; V705-W707 VanDerWaalsContact C-N 3.26Å; V705-W707 PolarHBondContact O-N 2.8Å; V705-D708 PolarHBondContact O-N 2.83Å; V705-I709 HydrophobicContact CG1-CD1 4.02Å; V705-I709 VanDerWaalsContact O-CG1 3.29Å; V705-I709 WeakPolarHBondContact O-CG1 3.33Å; V705-I709 PolarHBondContact O-N 3.41Å; V705-I709 VanDerWaalsContact O-N 3.13Å
706	I	41.8	Very low	42.2	Very low	51 Å²	51	63.5 Å²	63.5	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-67.4	-32.1	177	-67.1	170.7	0	0	0	110.9	V702 L704 N710 L772 I776	V702-I706 HydrophobicContact CG1-CD1 3.66Å; V702-I706 HydrophobicContact CG1-CG1 4.43Å; V702-I706 WeakPolarHBondContact O-CB 3.25Å; V702-I706 VanDerWaalsContact O-CG1 3.26Å; V702-I706 WeakPolarHBondContact O-CG1 3.25Å; V702-I706 PolarHBondContact O-N 3.33Å; L704-I706 PolarHBondContact O-N 2.86Å; I706-N710 PolarHBondContact O-N 3.41Å; I706-L772 HydrophobicContact CG2-CD2 3.52Å; I706-I776 HydrophobicContact CB-CD1 4.46Å; I706-I776 HydrophobicContact CD1-CD1 3.54Å; I706-I776 HydrophobicContact CD1-CG1 4.28Å; I706-I776 HydrophobicContact CG2-CD1 4.24Å
707	W	44.2	Very low	41.6	Very low	42 Å²	42	66.3 Å²	66.3	16%	0.159	36%	0.358	C	S	.	.	H	α-helix	trans	-65.9	-49.8	173.6	-174.4	-84.6	0	0	0	111.8	P652 F656 C703 L704 V705 I709 N710 D711 C769 I773	P652-W707 HydrophobicContact CB-CZ2 4.41Å; F656-W707 HydrophobicContact CB-CH2 3.91Å; F656-W707 HydrophobicContact CB-CZ2 4.29Å; F656-W707 HydrophobicContact CB-CZ3 4.19Å; F656-W707 HydrophobicContact CD2-CD2 4.37Å; F656-W707 AromaticContact CD2-CE3 3.7Å; F656-W707 HydrophobicContact CD2-CE3 3.7Å; F656-W707 HydrophobicContact CD2-CH2 4.2Å; F656-W707 AromaticContact CD2-CZ3 3.6Å; F656-W707 HydrophobicContact CD2-CZ3 3.6Å; F656-W707 AromaticContact CE2-CE3 3.91Å; F656-W707 HydrophobicContact CE2-CE3 3.91Å; F656-W707 HydrophobicContact CE2-CZ3 4.26Å; F656-W707 HydrophobicContact CG-CE3 4.29Å; F656-W707 HydrophobicContact CG-CH2 4.27Å; F656-W707 HydrophobicContact CG-CZ3 4.12Å; C703-W707 WeakPolarHBondContact O-CB 3.32Å; C703-W707 PolarHBondContact O-N 2.62Å; C703-W707 VanDerWaalsContact O-N 3.09Å; L704-W707 WeakPolarHBondContact O-CB 3.34Å; L704-W707 PolarHBondContact O-N 3.16Å; V705-W707 VanDerWaalsContact C-N 3.26Å; V705-W707 PolarHBondContact O-N 2.8Å; W707-I709 VanDerWaalsContact C-N 3.29Å; W707-I709 PolarHBondContact O-N 3.47Å; W707-N710 CarbonylContact O-C 3.6Å; W707-N710 PolarHBondContact O-N 2.8Å; W707-D711 PolarHBondContact NE1-OD2 3.06Å; W707-D711 PolarHBondContact O-N 3.21Å; W707-C769 HydrophobicContact CZ3-CB 4.35Å; W707-I773 HydrophobicContact CE3-CD1 4.47Å; W707-I773 HydrophobicContact CZ3-CD1 4.26Å
708	D	40.8	Very low	41.2	Very low	114 Å²	114	67.1 Å²	67.1	61%	0.61	37%	0.365	S	S	*	.	H	α-helix	trans	-59	-40	179.4	-86.8	-8	0	0	0	112.3	L704 V705 N710 D711 S712	L704-D708 PolarHBondContact O-N 2.79Å; V705-D708 PolarHBondContact O-N 2.83Å; D708-N710 VanDerWaalsContact C-N 3.34Å; D708-N710 PolarHBondContact O-N 3.4Å; D708-D711 PolarHBondContact O-N 2.83Å; D708-S712 PolarHBondContact O-N 2.95Å; D708-S712 VanDerWaalsContact O-N 3.13Å
709	I	42.1	Very low	40.7	Very low	95 Å²	95	72 Å²	72	49%	0.487	38%	0.378	S	S	.	.	H	α-helix	trans	-62.1	-44.2	175.9	-66.1	166.3	0	0	0	110.3	V705 W707 S712 L713	V705-I709 HydrophobicContact CG1-CD1 4.02Å; V705-I709 VanDerWaalsContact O-CG1 3.29Å; V705-I709 WeakPolarHBondContact O-CG1 3.33Å; V705-I709 PolarHBondContact O-N 3.41Å; V705-I709 VanDerWaalsContact O-N 3.13Å; W707-I709 VanDerWaalsContact C-N 3.29Å; W707-I709 PolarHBondContact O-N 3.47Å; I709-S712 PolarHBondContact O-OG 3.44Å; I709-L713 PolarHBondContact O-N 2.95Å
710	N	43.8	Very low	40.2	Very low	42 Å²	42	75.1 Å²	75.1	23%	0.225	40%	0.399	C	S	.	.	H	α-helix	trans	-75.1	-32.8	-179.7	-82.3	-16.9	0	0	0	113.4	I706 W707 D708 S712 L713 I714	I706-N710 PolarHBondContact O-N 3.41Å; W707-N710 CarbonylContact O-C 3.6Å; W707-N710 PolarHBondContact O-N 2.8Å; D708-N710 VanDerWaalsContact C-N 3.34Å; D708-N710 PolarHBondContact O-N 3.4Å; N710-S712 VanDerWaalsContact C-N 3.32Å; N710-S712 PolarHBondContact O-N 3.11Å; N710-L713 PolarHBondContact O-N 3.45Å; N710-I714 WeakPolarHBondContact O-CB 3.14Å; N710-I714 WeakPolarHBondContact O-CD1 3.24Å; N710-I714 WeakPolarHBondContact O-CG1 3.25Å; N710-I714 PolarHBondContact O-N 3.15Å
711	D	40.4	Very low	39.6	Very low	38 Å²	38	76.5 Å²	76.5	20%	0.203	41%	0.406	C	S	.	.	H	α-helix	trans	-66.3	-37.1	176.7	-124.2	-6.9	0	0	0	110.4	W707 D708 L713 I714 T715	W707-D711 PolarHBondContact NE1-OD2 3.06Å; W707-D711 PolarHBondContact O-N 3.21Å; D708-D711 PolarHBondContact O-N 2.83Å; D711-L713 VanDerWaalsContact C-N 3.33Å; D711-L713 PolarHBondContact O-N 3.05Å; D711-I714 PolarHBondContact O-N 3.17Å; D711-T715 VanDerWaalsContact O-CB 3.29Å; D711-T715 WeakPolarHBondContact O-CB 3.43Å; D711-T715 WeakPolarHBondContact O-CG2 3.28Å; D711-T715 PolarHBondContact O-N 2.97Å; D711-T715 PolarHBondContact O-OG1 3.31Å
712	S	40.2	Very low	39.3	Very low	58 Å²	58	77.9 Å²	77.9	41%	0.406	41%	0.414	S	S	.	.	H	α-helix	trans	-61.6	-41	171.8	75.5	0	0	0	0	112.3	D708 I709 N710 T715 D716	D708-S712 PolarHBondContact O-N 2.95Å; D708-S712 VanDerWaalsContact O-N 3.13Å; I709-S712 PolarHBondContact O-OG 3.44Å; N710-S712 VanDerWaalsContact C-N 3.32Å; N710-S712 PolarHBondContact O-N 3.11Å; S712-T715 WeakPolarHBondContact CA-OG1 3.36Å; S712-T715 PolarHBondContact O-OG1 3.05Å; S712-T715 VanDerWaalsContact O-OG1 3.12Å; S712-D716 WeakPolarHBondContact O-CB 3.35Å; S712-D716 PolarHBondContact O-N 3.24Å
713	L	38.7	Very low	38.9	Very low	90 Å²	90	78.8 Å²	78.8	47%	0.471	42%	0.419	S	S	.	.	H	α-helix	trans	-72.4	-36.3	-178.8	-133	142	0	0	0	112	I709 N710 D711 Q717	I709-L713 PolarHBondContact O-N 2.95Å; N710-L713 PolarHBondContact O-N 3.45Å; D711-L713 VanDerWaalsContact C-N 3.33Å; D711-L713 PolarHBondContact O-N 3.05Å; L713-Q717 WeakPolarHBondContact O-CB 3.44Å; L713-Q717 WeakPolarHBondContact O-CG 3.18Å; L713-Q717 PolarHBondContact O-N 3.05Å; L713-Q717 VanDerWaalsContact O-N 3.14Å
714	I	40	Very low	38.5	Very low	43 Å²	43	82.8 Å²	82.8	22%	0.221	44%	0.439	C	S	.	.	H	α-helix	trans	-74	-42.5	176.2	-68	165.4	0	0	0	110.4	N710 D711 Q717 I718	N710-I714 WeakPolarHBondContact O-CB 3.14Å; N710-I714 WeakPolarHBondContact O-CD1 3.24Å; N710-I714 WeakPolarHBondContact O-CG1 3.25Å; N710-I714 PolarHBondContact O-N 3.15Å; D711-I714 PolarHBondContact O-N 3.17Å; I714-Q717 PolarHBondContact O-N 2.66Å; I714-I718 HydrophobicContact CG2-CD1 3.6Å; I714-I718 HydrophobicContact CG2-CG1 4.32Å; I714-I718 WeakPolarHBondContact O-CB 3.44Å; I714-I718 WeakPolarHBondContact O-CG1 3.03Å; I714-I718 PolarHBondContact O-N 3.05Å
715	T	37.4	Very low	38.1	Very low	76 Å²	76	81.9 Å²	81.9	47%	0.466	44%	0.439	S	S	.	.	H	α-helix	trans	-65.9	-40.2	177	46.6	0	0	0	0	111.7	D711 S712 I718 R719	D711-T715 VanDerWaalsContact O-CB 3.29Å; D711-T715 WeakPolarHBondContact O-CB 3.43Å; D711-T715 WeakPolarHBondContact O-CG2 3.28Å; D711-T715 PolarHBondContact O-N 2.97Å; D711-T715 PolarHBondContact O-OG1 3.31Å; S712-T715 WeakPolarHBondContact CA-OG1 3.36Å; S712-T715 PolarHBondContact O-OG1 3.05Å; S712-T715 VanDerWaalsContact O-OG1 3.12Å; T715-I718 PolarHBondContact O-N 3.16Å; T715-R719 WeakPolarHBondContact O-CB 3.05Å; T715-R719 PolarHBondContact O-N 3.28Å
716	D	36.1	Very low	37.9	Very low	98 Å²	98	84.4 Å²	84.4	52%	0.524	45%	0.446	S	S	.	.	H	α-helix	trans	-66.3	-39.9	174.4	-82.2	-17.6	0	0	0	112.3	S712 R719 C720	S712-D716 WeakPolarHBondContact O-CB 3.35Å; S712-D716 PolarHBondContact O-N 3.24Å; D716-R719 PolarHBondContact O-N 3.46Å; D716-C720 WeakPolarHBondContact O-CB 3.49Å; D716-C720 PolarHBondContact O-N 2.86Å; D716-C720 PolarHBondContact O-SG 3.5Å; D716-C720 VanDerWaalsContact O-SG 3.4Å
717	Q	37.8	Very low	37.7	Very low	118 Å²	118	84.7 Å²	84.7	55%	0.551	45%	0.452	S	S	*	.	H	α-helix	trans	-67.3	-37.8	175.2	-77.3	-175.2	-0.7	0	0	113.1	L713 I714 T721	L713-Q717 WeakPolarHBondContact O-CB 3.44Å; L713-Q717 WeakPolarHBondContact O-CG 3.18Å; L713-Q717 PolarHBondContact O-N 3.05Å; L713-Q717 VanDerWaalsContact O-N 3.14Å; I714-Q717 PolarHBondContact O-N 2.66Å; Q717-T721 WeakPolarHBondContact O-CG2 3.25Å; Q717-T721 PolarHBondContact O-N 3.16Å; Q717-T721 VanDerWaalsContact O-N 3.14Å; Q717-T721 PolarHBondContact O-OG1 3.16Å
718	I	37.5	Very low	37.3	Very low	88 Å²	88	88 Å²	88	45%	0.451	47%	0.473	S	S	.	.	H	α-helix	trans	-69.6	-39.2	175.4	-68.7	170.8	0	0	0	110.3	I714 T715 T721 L722	I714-I718 HydrophobicContact CG2-CD1 3.6Å; I714-I718 HydrophobicContact CG2-CG1 4.32Å; I714-I718 WeakPolarHBondContact O-CB 3.44Å; I714-I718 WeakPolarHBondContact O-CG1 3.03Å; I714-I718 PolarHBondContact O-N 3.05Å; T715-I718 PolarHBondContact O-N 3.16Å; I718-T721 WeakPolarHBondContact CA-OG1 3.42Å; I718-T721 PolarHBondContact O-N 2.74Å; I718-T721 PolarHBondContact O-OG1 2.86Å; I718-L722 HydrophobicContact CG2-CD1 3.65Å; I718-L722 WeakPolarHBondContact O-CB 3.29Å; I718-L722 PolarHBondContact O-N 3.28Å
719	R	32.3	Very low	37.2	Very low	185 Å²	185	88.9 Å²	88.9	70%	0.698	48%	0.475	S	S	*	.	H	α-helix	trans	-67	-44.9	178.6	-157	175.6	-157.3	170.8	4.6	111.5	T715 D716 T721 L722 T723	T715-R719 WeakPolarHBondContact O-CB 3.05Å; T715-R719 PolarHBondContact O-N 3.28Å; D716-R719 PolarHBondContact O-N 3.46Å; R719-T721 VanDerWaalsContact C-N 3.28Å; R719-T721 PolarHBondContact O-N 2.92Å; R719-L722 PolarHBondContact O-N 3.45Å; R719-T723 WeakPolarHBondContact O-CG2 3.44Å; R719-T723 PolarHBondContact O-N 2.94Å; R719-T723 PolarHBondContact O-OG1 3.46Å; R719-T723 VanDerWaalsContact O-OG1 3.11Å
720	C	33.4	Very low	36.8	Very low	79 Å²	79	91.1 Å²	91.1	53%	0.534	49%	0.485	S	S	.	.	H	α-helix	trans	-63.3	-30.9	174.7	-75	0	0	0	0	113.4	D716 T723 N724	D716-C720 WeakPolarHBondContact O-CB 3.49Å; D716-C720 PolarHBondContact O-N 2.86Å; D716-C720 PolarHBondContact O-SG 3.5Å; D716-C720 VanDerWaalsContact O-SG 3.4Å; C720-T723 PolarHBondContact O-OG1 2.85Å; C720-T723 VanDerWaalsContact O-OG1 3.11Å; C720-N724 VanDerWaalsContact O-CG 3.31Å; C720-N724 PolarHBondContact O-N 2.99Å; C720-N724 PolarHBondContact O-ND2 2.98Å
721	T	35.6	Very low	36.6	Very low	86 Å²	86	94.6 Å²	94.6	53%	0.528	50%	0.501	S	S	.	.	H	α-helix	trans	-82.6	-32.1	177.4	47.3	0	0	0	0	113	Q717 I718 R719 C725	Q717-T721 WeakPolarHBondContact O-CG2 3.25Å; Q717-T721 PolarHBondContact O-N 3.16Å; Q717-T721 VanDerWaalsContact O-N 3.14Å; Q717-T721 PolarHBondContact O-OG1 3.16Å; I718-T721 WeakPolarHBondContact CA-OG1 3.42Å; I718-T721 PolarHBondContact O-N 2.74Å; I718-T721 PolarHBondContact O-OG1 2.86Å; R719-T721 VanDerWaalsContact C-N 3.28Å; R719-T721 PolarHBondContact O-N 2.92Å; T721-C725 PolarHBondContact O-N 3.32Å; T721-C725 VanDerWaalsContact O-N 3.13Å
722	L	34.6	Very low	36.7	Very low	84 Å²	84	97.6 Å²	97.6	44%	0.44	52%	0.521	S	S	.	.	H	α-helix	trans	-68	-42.1	172.2	-105.3	117.1	0	0	0	112.4	I718 R719 N724 C725 E726	I718-L722 HydrophobicContact CG2-CD1 3.65Å; I718-L722 WeakPolarHBondContact O-CB 3.29Å; I718-L722 PolarHBondContact O-N 3.28Å; R719-L722 PolarHBondContact O-N 3.45Å; L722-N724 VanDerWaalsContact C-N 3.29Å; L722-N724 PolarHBondContact O-N 3.36Å; L722-C725 PolarHBondContact O-N 3.42Å; L722-E726 PolarHBondContact O-N 2.78Å
723	T	33.6	Very low	36.7	Very low	81 Å²	81	101.2 Å²	101.2	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-63.3	-35.2	178	50.9	0	0	0	0	112.5	R719 C720 S727	R719-T723 WeakPolarHBondContact O-CG2 3.44Å; R719-T723 PolarHBondContact O-N 2.94Å; R719-T723 PolarHBondContact O-OG1 3.46Å; R719-T723 VanDerWaalsContact O-OG1 3.11Å; C720-T723 PolarHBondContact O-OG1 2.85Å; C720-T723 VanDerWaalsContact O-OG1 3.11Å; T723-S727 PolarHBondContact O-N 3.21Å; T723-S727 PolarHBondContact O-OG 2.85Å
724	N	36.1	Very low	36.8	Very low	106 Å²	106	105.4 Å²	105.4	57%	0.567	55%	0.549	S	S	*	.	H	α-helix	trans	-77.9	-28.3	177.5	-68.8	-1.9	0	0	0	112.8	C720 L722 S727 D728	C720-N724 VanDerWaalsContact O-CG 3.31Å; C720-N724 PolarHBondContact O-N 2.99Å; C720-N724 PolarHBondContact O-ND2 2.98Å; L722-N724 VanDerWaalsContact C-N 3.29Å; L722-N724 PolarHBondContact O-N 3.36Å; N724-S727 PolarHBondContact O-OG 3.04Å; N724-D728 PolarHBondContact O-N 3.48Å
725	C	34.3	Very low	36.9	Very low	63 Å²	63	110.6 Å²	110.6	43%	0.426	57%	0.573	S	S	.	*	H	α-helix	trans	-79	-31.5	176.1	-89.6	0	0	0	0	113.5	T721 L722 M729	T721-C725 PolarHBondContact O-N 3.32Å; T721-C725 VanDerWaalsContact O-N 3.13Å; L722-C725 PolarHBondContact O-N 3.42Å; C725-M729 PolarHBondContact O-N 2.91Å
726	E	36.5	Very low	36.7	Very low	136 Å²	136	116.1 Å²	116.1	64%	0.636	59%	0.59	S	S	*	*	H	α-helix	trans	-72.9	-32	174.9	-79.5	-175.8	162.4	0	0	112.2	L722 M730	L722-E726 PolarHBondContact O-N 2.78Å; E726-M730 PolarHBondContact O-N 3.47Å; E726-M730 VanDerWaalsContact O-N 3.14Å
727	S	37.8	Very low	36.6	Very low	57 Å²	57	118.7 Å²	118.7	40%	0.399	60%	0.604	S	S	.	*	H	α-helix	trans	-66.3	-40	171.9	59.5	0	0	0	0	112.4	T723 N724 M731	T723-S727 PolarHBondContact O-N 3.21Å; T723-S727 PolarHBondContact O-OG 2.85Å; N724-S727 PolarHBondContact O-OG 3.04Å; S727-M731 WeakPolarHBondContact O-CG 3.31Å; S727-M731 PolarHBondContact O-N 3Å
728	D	34.9	Very low	36.6	Very low	111 Å²	111	120 Å²	120	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-77.8	-30.8	-178.5	-74.7	-6.6	0	0	0	113.1	N724 T732	N724-D728 PolarHBondContact O-N 3.48Å; D728-T732 WeakPolarHBondContact O-CG2 3.22Å; D728-T732 PolarHBondContact O-N 3.43Å; D728-T732 PolarHBondContact O-OG1 3.47Å
729	M	37.8	Very low	36.4	Very low	133 Å²	133	122.3 Å²	122.3	66%	0.655	63%	0.628	S	S	*	*	H	α-helix	trans	-75.2	-30.4	173.2	-98.4	-169.1	-178	0	0	113.4	C725 T732 I733	C725-M729 PolarHBondContact O-N 2.91Å; M729-T732 PolarHBondContact O-OG1 3.23Å; M729-I733 WeakPolarHBondContact O-CD1 3.36Å; M729-I733 WeakPolarHBondContact O-CG1 3.32Å
730	M	35.4	Very low	36.5	Very low	141 Å²	141	118.6 Å²	118.6	70%	0.695	63%	0.631	S	S	*	*	H	α-helix	trans	-71.5	-38.5	171.5	-98.9	-158.1	-169	0	0	112.1	E726 T732 I733	E726-M730 PolarHBondContact O-N 3.47Å; E726-M730 VanDerWaalsContact O-N 3.14Å; M730-T732 VanDerWaalsContact C-N 3.33Å; M730-T732 PolarHBondContact O-N 3.39Å; M730-I733 PolarHBondContact O-N 3.12Å
731	M	38.8	Very low	36.4	Very low	115 Å²	115	119.7 Å²	119.7	57%	0.567	64%	0.639	S	S	*	*	H	α-helix	trans	-67.8	-32.3	179.2	-74.2	-67.1	-78.1	0	0	112.6	S727 I733	S727-M731 WeakPolarHBondContact O-CG 3.31Å; S727-M731 PolarHBondContact O-N 3Å; M731-I733 PolarHBondContact O-N 2.93Å
732	T	41.3	Very low	36.1	Very low	102 Å²	102	120.3 Å²	120.3	63%	0.626	65%	0.647	S	S	*	*	H	α-helix	trans	-81.7	-9	-179.1	47.8	0	0	0	0	115	D728 M729 M730	D728-T732 WeakPolarHBondContact O-CG2 3.22Å; D728-T732 PolarHBondContact O-N 3.43Å; D728-T732 PolarHBondContact O-OG1 3.47Å; M729-T732 PolarHBondContact O-OG1 3.23Å; M730-T732 VanDerWaalsContact C-N 3.33Å; M730-T732 PolarHBondContact O-N 3.39Å
733	I	41.3	Very low	35.9	Very low	133 Å²	133	124.2 Å²	124.2	68%	0.682	67%	0.667	S	S	*	*	H	α-helix	trans	-98.2	-13.3	177.2	-63.5	172.3	0	0	0	111.9	M729 M730 M731	M729-I733 WeakPolarHBondContact O-CD1 3.36Å; M729-I733 WeakPolarHBondContact O-CG1 3.32Å; M730-I733 PolarHBondContact O-N 3.12Å; M731-I733 PolarHBondContact O-N 2.93Å
734	F	40.9	Very low	35.6	Very low	179 Å²	179	130 Å²	130	79%	0.785	69%	0.686	S	S	*	*	H	α-helix	trans	-105	-3.2	179.3	-85.6	-82.9	0	0	0	115.5
735	E	41.1	Very low	35.3	Very low	152 Å²	152	130.6 Å²	130.6	71%	0.71	70%	0.698	S	S	*	*	S	Bend	trans	-107.5	27.1	-175.2	-95.4	-174.9	168.5	0	0	115.4
736	K	34.5	Very low	34.9	Very low	191 Å²	191	132.8 Å²	132.8	83%	0.83	71%	0.714	S	S	*	*			trans	-128.7	50.7	-179.8	-119.8	-178.4	-171.6	176	0	114.5
737	D	33.9	Very low	34.6	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	73%	0.725	S	S	*	*			trans	-136.6	97.2	153.1	-85.8	-33.6	0	0	0	106.5
738	D	37.4	Very low	34	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	75%	0.748	S	S	*	*			trans	168.1	109.8	141.4	-86.5	-28.9	0	0	0	111.5
739	N	33.5	Very low	33.7	Very low	138 Å²	138	146.3 Å²	146.3	74%	0.738	76%	0.761	S	S	*	*			trans	54.7	117.8	135.5	-60.2	-38.6	0	0	0	121
740	S	33.1	Very low	33.1	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	77%	0.768	S	S	*	*				96.6	115.1	127.5	74.4	0	0	0	0	120.2
741	S	32.2	Very low	32.8	Very low	101 Å²	101	143.9 Å²	143.9	71%	0.706	77%	0.771	S	S	*	*			trans	66.4	112.2	133	60.5	0	0	0	0	121.4
742	S	29.2	Very low	32.3	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	78%	0.782	S	S	*	*			trans	58.9	115.7	130.9	66.7	0	0	0	0	119.6
743	L	30	Very low	31.7	Very low	166 Å²	166	144.1 Å²	144.1	87%	0.869	78%	0.783	S	S	*	*				-168.9	139.1	103.3	-122	93.2	0	0	0	111.2
744	K	26.8	Very low	31	Very low	203 Å²	203	145.7 Å²	145.7	88%	0.883	79%	0.792	S	S	*	*			trans	-80.4	135	170.8	-69.4	168.3	173.6	174	0	109.5
745	S	31	Very low	30.3	Very low	118 Å²	118	144.4 Å²	144.4	83%	0.825	79%	0.793	S	S	*	*			trans	-162.1	129.5	142.4	53.1	0	0	0	0	111.2
746	S	26.5	Very low	29.8	Very low	109 Å²	109	142.9 Å²	142.9	76%	0.762	79%	0.79	S	S	*	*			trans	-57.1	138.4	177.4	50.8	0	0	0	0	114
747	E	29.3	Very low	29.8	Very low	185 Å²	185	138.3 Å²	138.3	86%	0.864	78%	0.78	S	S	*	*				-172.5	131.2	127.8	-102.9	171.3	-167.1	0	0	111.5	F749	E747-F749 PolarHBondContact O-N 3.31Å
748	K	25.9	Very low	29.7	Very low	203 Å²	203	139.4 Å²	139.4	88%	0.883	77%	0.772	S	S	*	*			trans	-10.9	105.9	171	-66.9	166.1	175.6	171.4	0	117.4
749	F	28	Very low	29.5	Very low	199 Å²	199	142.6 Å²	142.6	87%	0.873	77%	0.774	S	S	*	*			trans	-149.5	103.4	146.5	-99.7	-80.9	0	0	0	109.8	E747 S751	E747-F749 PolarHBondContact O-N 3.31Å; F749-S751 VanDerWaalsContact C-N 3.29Å; F749-S751 PolarHBondContact O-N 3.32Å
750	S	26	Very low	29.4	Very low	115 Å²	115	138.8 Å²	138.8	80%	0.804	76%	0.758	S	S	*	*			trans	-74.3	84.5	167.5	53.3	0	0	0	0	109	V752	S750-V752 PolarHBondContact O-N 3.34Å
751	S	28.2	Very low	29.5	Very low	108 Å²	108	140.4 Å²	140.4	76%	0.755	75%	0.753	S	S	*	*			trans	-77.6	93.6	171.5	55.7	0	0	0	0	110	F749 S753	F749-S751 VanDerWaalsContact C-N 3.29Å; F749-S751 PolarHBondContact O-N 3.32Å; S751-S753 PolarHBondContact O-N 3.45Å
752	V	28.8	Very low	29.6	Very low	130 Å²	130	139.3 Å²	139.3	79%	0.788	74%	0.742	S	S	*	*			trans	-84.7	99.7	171.5	178	0	0	0	0	108.8	S750	S750-V752 PolarHBondContact O-N 3.34Å
753	S	27.9	Very low	29.9	Very low	93 Å²	93	139.2 Å²	139.2	65%	0.65	74%	0.737	S	S	*	*			trans	44.1	94.9	157.2	56.9	0	0	0	0	119.4	S751 N755	S751-S753 PolarHBondContact O-N 3.45Å; S753-N755 PolarHBondContact O-N 2.71Å
754	L	26	Very low	30.2	Very low	166 Å²	166	134.7 Å²	134.7	87%	0.869	72%	0.716	S	S	*	*			trans	-53.8	121.7	145.2	-87.2	98.2	0	0	0	109.8
755	N	28.1	Very low	30.8	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	69%	0.691	S	S	*	*			trans	-152.3	106	155.7	-95.9	-25.7	0	0	0	109.8	S753	S753-N755 PolarHBondContact O-N 2.71Å
756	N	30.3	Very low	31.3	Very low	121 Å²	121	124.4 Å²	124.4	65%	0.647	67%	0.665	S	S	*	*			trans	72.2	87	164.2	-71	-22.6	0	0	0	120.5	R758	N756-R758 PolarHBondContact O-N 3.46Å
757	P	33.2	Very low	32.2	Very low	95 Å²	95	121.1 Å²	121.1	62%	0.617	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-13.9	163.5	26.7	-32.8	0	0	0	114.5	R759 S760	P757-R759 VanDerWaalsContact C-N 3.29Å; P757-R759 PolarHBondContact O-N 3.23Å; P757-S760 PolarHBondContact O-OG 3.24Å
758	R	33.1	Very low	33	Very low	174 Å²	174	116.5 Å²	116.5	66%	0.657	62%	0.619	S	S	*	*	H	α-helix	trans	-65.1	-21.1	-178.9	-77.6	-175.6	178	174.9	-0.2	115.1	N756	N756-R758 PolarHBondContact O-N 3.46Å
759	R	31.7	Very low	34	Very low	213 Å²	213	107.6 Å²	107.6	80%	0.804	58%	0.582	S	S	*	*	H	α-helix	trans	-94.6	-22.1	-176.7	-93.1	-176.9	177.8	168.8	0.7	114.9	P757 V763	P757-R759 VanDerWaalsContact C-N 3.29Å; P757-R759 PolarHBondContact O-N 3.23Å; R759-V763 WeakPolarHBondContact O-CG2 3.5Å
760	S	33	Very low	35	Very low	57 Å²	57	100.6 Å²	100.6	40%	0.399	55%	0.553	S	S	.	*	H	α-helix	trans	-80.4	-39.1	-178.7	49.6	0	0	0	0	112.3	P757 V763	P757-S760 PolarHBondContact O-OG 3.24Å; S760-V763 PolarHBondContact O-N 3.03Å
761	H	34.5	Very low	36.1	Very low	142 Å²	142	96.9 Å²	96.9	66%	0.657	52%	0.523	S	S	*	.	H	α-helix	trans	-68.6	-35.6	-177.9	-78	-81.9	0	0	0	113.7	V763 V764 C765	H761-V763 VanDerWaalsContact C-N 3.31Å; H761-V763 PolarHBondContact O-N 3Å; H761-V764 PolarHBondContact O-N 3.31Å; H761-C765 PolarHBondContact O-N 2.85Å
762	V	35.3	Very low	37.2	Very low	77 Å²	77	93.8 Å²	93.8	47%	0.467	50%	0.498	S	S	.	.	H	α-helix	trans	-66.8	-32.5	178	-179.2	0	0	0	0	112.1	N766	V762-N766 PolarHBondContact O-N 3.22Å; V762-N766 PolarHBondContact O-ND2 3.3Å
763	V	35.2	Very low	38.3	Very low	99 Å²	99	89 Å²	89	60%	0.6	47%	0.468	S	S	*	.	H	α-helix	trans	-71.9	-33.7	-180	176.9	0	0	0	0	111.6	R759 S760 H761 S767	R759-V763 WeakPolarHBondContact O-CG2 3.5Å; S760-V763 PolarHBondContact O-N 3.03Å; H761-V763 VanDerWaalsContact C-N 3.31Å; H761-V763 PolarHBondContact O-N 3Å; V763-S767 PolarHBondContact O-N 2.81Å
764	V	34.8	Very low	39.4	Very low	70 Å²	70	86.7 Å²	86.7	42%	0.424	45%	0.445	S	S	.	.	H	α-helix	trans	-70.6	-45.3	178.8	-179.2	0	0	0	0	111.2	H761 N766 S767 F768	H761-V764 PolarHBondContact O-N 3.31Å; V764-N766 PolarHBondContact O-N 2.88Å; V764-S767 PolarHBondContact O-N 2.92Å; V764-S767 PolarHBondContact O-OG 2.85Å; V764-F768 PolarHBondContact O-N 2.81Å
765	C	39.7	Very low	40.7	Very low	52 Å²	52	81.3 Å²	81.3	35%	0.351	42%	0.417	S	S	.	.	H	α-helix	trans	-60.5	-44.5	177	-101.4	0	0	0	0	112.6	H761 S767 F768 C769	H761-C765 PolarHBondContact O-N 2.85Å; C765-S767 VanDerWaalsContact C-N 3.3Å; C765-S767 PolarHBondContact O-N 3.25Å; C765-F768 PolarHBondContact O-N 3.28Å; C765-C769 PolarHBondContact O-N 2.95Å; C765-C769 VanDerWaalsContact O-N 3.07Å
766	N	42.9	Very low	41.9	Very low	53 Å²	53	74.9 Å²	74.9	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-60.8	-39.4	178.3	-74.3	-13.6	0	0	0	112.2	V762 V764 F768 E770	V762-N766 PolarHBondContact O-N 3.22Å; V762-N766 PolarHBondContact O-ND2 3.3Å; V764-N766 PolarHBondContact O-N 2.88Å; N766-F768 VanDerWaalsContact C-N 3.35Å; N766-F768 PolarHBondContact O-N 2.94Å; N766-E770 WeakPolarHBondContact O-CB 3.31Å; N766-E770 PolarHBondContact O-N 3.17Å; N766-E770 VanDerWaalsContact O-N 3.08Å
767	S	44.1	Very low	42.9	Very low	41 Å²	41	72.5 Å²	72.5	29%	0.287	37%	0.369	S	S	.	.	H	α-helix	trans	-66.5	-35.2	178.2	72.5	0	0	0	0	113.2	V763 V764 C765 L771	V763-S767 PolarHBondContact O-N 2.81Å; V764-S767 PolarHBondContact O-N 2.92Å; V764-S767 PolarHBondContact O-OG 2.85Å; C765-S767 VanDerWaalsContact C-N 3.3Å; C765-S767 PolarHBondContact O-N 3.25Å; S767-L771 PolarHBondContact O-N 3.47Å
768	F	45.8	Very low	43.8	Very low	87 Å²	87	68.3 Å²	68.3	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-70.8	-48.1	178.3	-175.5	-97.4	0	0	0	111.5	V764 C765 N766 E770 L771 L772 L850	V764-F768 PolarHBondContact O-N 2.81Å; C765-F768 PolarHBondContact O-N 3.28Å; N766-F768 VanDerWaalsContact C-N 3.35Å; N766-F768 PolarHBondContact O-N 2.94Å; F768-E770 VanDerWaalsContact C-N 3.3Å; F768-E770 PolarHBondContact O-N 3.44Å; F768-L771 PolarHBondContact O-N 2.81Å; F768-L772 HydrophobicContact CE1-CD1 3.73Å; F768-L772 HydrophobicContact CZ-CD1 3.89Å; F768-L772 WeakPolarHBondContact O-CB 3.35Å; F768-L772 PolarHBondContact O-N 3.46Å; F768-L850 HydrophobicContact CD2-CD1 4.25Å; F768-L850 HydrophobicContact CE2-CD1 3.63Å; F768-L850 HydrophobicContact CZ-CD1 4.48Å
769	C	47.5	Very low	44.8	Very low	16 Å²	16	62.8 Å²	62.8	11%	0.108	33%	0.327	C	S	.	.	H	α-helix	trans	-58.6	-41.9	176	-71	0	0	0	0	111.8	W707 C765 L771 L772 I773	W707-C769 HydrophobicContact CZ3-CB 4.35Å; C765-C769 PolarHBondContact O-N 2.95Å; C765-C769 VanDerWaalsContact O-N 3.07Å; C769-L771 VanDerWaalsContact C-N 3.34Å; C769-L771 PolarHBondContact O-N 3.42Å; C769-L772 PolarHBondContact O-N 2.89Å; C769-I773 WeakPolarHBondContact O-CD1 3.45Å; C769-I773 VanDerWaalsContact O-CG1 3.27Å; C769-I773 WeakPolarHBondContact O-CG1 3.21Å; C769-I773 PolarHBondContact O-N 3.12Å
770	E	48.8	Very low	45.8	Very low	53 Å²	53	54 Å²	54	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-66.7	-35.2	179.8	-155.1	-175.5	166.4	0	0	112.4	N766 F768 R774	N766-E770 WeakPolarHBondContact O-CB 3.31Å; N766-E770 PolarHBondContact O-N 3.17Å; N766-E770 VanDerWaalsContact O-N 3.08Å; F768-E770 VanDerWaalsContact C-N 3.3Å; F768-E770 PolarHBondContact O-N 3.44Å; E770-R774 WeakPolarHBondContact O-CD 3.45Å; E770-R774 WeakPolarHBondContact O-CG 3.23Å; E770-R774 PolarHBondContact O-N 3.49Å; E770-R774 IonicContact OE1-CZ 3.74Å; E770-R774 IonicContact OE1-NE 2.7Å; E770-R774 IonicContact OE1-NH2 3.63Å; E770-R774 PolarHBondContact OE1-NH2 3.4Å
771	L	49.9	Very low	46.8	Very low	36 Å²	36	52.3 Å²	52.3	19%	0.188	29%	0.286	C	S	.	.	H	α-helix	trans	-71.3	-36.6	175.2	-129.8	130.7	0	0	0	111.8	S767 F768 C769 R774 L775 L850 V851	S767-L771 PolarHBondContact O-N 3.47Å; F768-L771 PolarHBondContact O-N 2.81Å; C769-L771 VanDerWaalsContact C-N 3.34Å; C769-L771 PolarHBondContact O-N 3.42Å; L771-R774 PolarHBondContact O-N 2.81Å; L771-L775 PolarHBondContact O-N 3.32Å; L771-L850 HydrophobicContact CB-CD2 4.42Å; L771-L850 HydrophobicContact CD2-CB 3.95Å; L771-L850 HydrophobicContact CD2-CD2 3.25Å; L771-L850 HydrophobicContact CD2-CG 4.18Å; L771-L850 HydrophobicContact CG-CD2 4.41Å; L771-V851 HydrophobicContact CD1-CG2 4.23Å
772	L	51.1	Low	47.6	Very low	44 Å²	44	48 Å²	48	23%	0.23	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-43.7	178.3	-151.3	121.4	0	0	0	111.7	I706 F768 C769 R774 L775 I776	I706-L772 HydrophobicContact CG2-CD2 3.52Å; F768-L772 HydrophobicContact CE1-CD1 3.73Å; F768-L772 HydrophobicContact CZ-CD1 3.89Å; F768-L772 WeakPolarHBondContact O-CB 3.35Å; F768-L772 PolarHBondContact O-N 3.46Å; C769-L772 PolarHBondContact O-N 2.89Å; L772-R774 VanDerWaalsContact C-N 3.27Å; L772-R774 PolarHBondContact O-N 2.89Å; L772-L775 WeakPolarHBondContact O-CB 3.38Å; L772-L775 PolarHBondContact O-N 3.43Å; L772-I776 HydrophobicContact CD2-CD1 3.79Å; L772-I776 VanDerWaalsContact O-CG1 3.29Å; L772-I776 WeakPolarHBondContact O-CG1 3.36Å; L772-I776 PolarHBondContact O-N 3.38Å
773	I	52.2	Low	48.4	Very low	30 Å²	30	48.5 Å²	48.5	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-41.1	173.8	-68.2	160.3	0	0	0	110.9	F656 W707 C769 I776 L777	F656-I773 HydrophobicContact CD2-CD1 3.56Å; F656-I773 HydrophobicContact CE2-CD1 3.54Å; F656-I773 HydrophobicContact CE2-CG1 4.19Å; W707-I773 HydrophobicContact CE3-CD1 4.47Å; W707-I773 HydrophobicContact CZ3-CD1 4.26Å; C769-I773 WeakPolarHBondContact O-CD1 3.45Å; C769-I773 VanDerWaalsContact O-CG1 3.27Å; C769-I773 WeakPolarHBondContact O-CG1 3.21Å; C769-I773 PolarHBondContact O-N 3.12Å; I773-I776 PolarHBondContact O-N 2.88Å; I773-L777 HydrophobicContact CG2-CD1 4.01Å; I773-L777 WeakPolarHBondContact O-CB 3.26Å; I773-L777 WeakPolarHBondContact O-CG 3.29Å; I773-L777 PolarHBondContact O-N 3.23Å
774	R	49.9	Very low	49.2	Very low	43 Å²	43	45.4 Å²	45.4	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-69.3	-38.3	177.9	-70.6	170	-170.9	-141.9	9	112.3	E770 L771 L772 I776 L777 L778 S822 P826	E770-R774 WeakPolarHBondContact O-CD 3.45Å; E770-R774 WeakPolarHBondContact O-CG 3.23Å; E770-R774 PolarHBondContact O-N 3.49Å; E770-R774 IonicContact OE1-CZ 3.74Å; E770-R774 IonicContact OE1-NE 2.7Å; E770-R774 IonicContact OE1-NH2 3.63Å; E770-R774 PolarHBondContact OE1-NH2 3.4Å; L771-R774 PolarHBondContact O-N 2.81Å; L772-R774 VanDerWaalsContact C-N 3.27Å; L772-R774 PolarHBondContact O-N 2.89Å; R774-I776 VanDerWaalsContact C-N 3.31Å; R774-L777 PolarHBondContact O-N 3.36Å; R774-L778 WeakPolarHBondContact O-CB 3.36Å; R774-L778 PolarHBondContact O-N 2.99Å; R774-S822 PolarHBondContact NH1-O 2.61Å; R774-P826 VanDerWaalsContact NH1-CD 3.31Å; R774-P826 VanDerWaalsContact NH1-CG 3.33Å
775	L	53	Low	50.1	Low	53 Å²	53	43.1 Å²	43.1	28%	0.277	24%	0.239	S	C	.	.	H	α-helix	trans	-61.7	-43.5	173.2	-156.5	95.6	0	0	0	110.1	L771 L772 L778 T779 I853	L771-L775 PolarHBondContact O-N 3.32Å; L772-L775 WeakPolarHBondContact O-CB 3.38Å; L772-L775 PolarHBondContact O-N 3.43Å; L775-L778 PolarHBondContact O-N 2.65Å; L775-T779 WeakPolarHBondContact O-CG2 3.4Å; L775-T779 PolarHBondContact O-N 3.08Å; L775-T779 PolarHBondContact O-OG1 3.16Å; L775-I853 HydrophobicContact CD1-CG2 4.17Å
776	I	53.9	Low	50.8	Low	16 Å²	16	45.6 Å²	45.6	8%	0.082	25%	0.248	C	C	.	.	H	α-helix	trans	-64.5	-47.5	177.5	-64.9	160.5	0	0	0	110.8	V702 C703 I706 L772 I773 R774 L778 T779 C780	V702-I776 HydrophobicContact CG1-CG2 4.5Å; C703-I776 WeakPolarHBondContact SG-CG2 3.3Å; I706-I776 HydrophobicContact CB-CD1 4.46Å; I706-I776 HydrophobicContact CD1-CD1 3.54Å; I706-I776 HydrophobicContact CD1-CG1 4.28Å; I706-I776 HydrophobicContact CG2-CD1 4.24Å; L772-I776 HydrophobicContact CD2-CD1 3.79Å; L772-I776 VanDerWaalsContact O-CG1 3.29Å; L772-I776 WeakPolarHBondContact O-CG1 3.36Å; L772-I776 PolarHBondContact O-N 3.38Å; I773-I776 PolarHBondContact O-N 2.88Å; R774-I776 VanDerWaalsContact C-N 3.31Å; I776-L778 VanDerWaalsContact C-N 3.29Å; I776-L778 PolarHBondContact O-N 3.41Å; I776-T779 VanDerWaalsContact CA-OG1 3.29Å; I776-T779 WeakPolarHBondContact CA-OG1 3.25Å; I776-T779 CarbonylContact O-C 3.57Å; I776-T779 PolarHBondContact O-N 3.42Å; I776-T779 VanDerWaalsContact O-N 3.13Å; I776-T779 PolarHBondContact O-OG1 3.38Å; I776-C780 WeakPolarHBondContact O-CB 3.38Å; I776-C780 PolarHBondContact O-N 3.26Å; I776-C780 PolarHBondContact O-SG 3.2Å
777	L	51.6	Low	51.3	Low	71 Å²	71	46.3 Å²	46.3	37%	0.372	25%	0.254	S	S	.	.	H	α-helix	trans	-58.6	-40.3	175.5	-79.9	165.4	0	0	0	112.2	V663 I773 R774 C780 S781	V663-L777 HydrophobicContact CG1-CD1 4.41Å; I773-L777 HydrophobicContact CG2-CD1 4.01Å; I773-L777 WeakPolarHBondContact O-CB 3.26Å; I773-L777 WeakPolarHBondContact O-CG 3.29Å; I773-L777 PolarHBondContact O-N 3.23Å; R774-L777 PolarHBondContact O-N 3.36Å; L777-C780 PolarHBondContact O-N 2.78Å; L777-S781 WeakPolarHBondContact O-CB 3.48Å; L777-S781 PolarHBondContact O-N 2.78Å; L777-S781 PolarHBondContact O-OG 3.24Å
778	L	52.8	Low	51.7	Low	7 Å²	7	46 Å²	46	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-42.7	174.8	-166.9	85.7	0	0	0	111.5	R774 L775 I776 C780 S781 L782 M857	R774-L778 WeakPolarHBondContact O-CB 3.36Å; R774-L778 PolarHBondContact O-N 2.99Å; L775-L778 PolarHBondContact O-N 2.65Å; I776-L778 VanDerWaalsContact C-N 3.29Å; I776-L778 PolarHBondContact O-N 3.41Å; L778-C780 VanDerWaalsContact C-N 3.32Å; L778-S781 WeakPolarHBondContact CA-OG 3.49Å; L778-S781 PolarHBondContact O-N 3.36Å; L778-S781 PolarHBondContact O-OG 2.9Å; L778-L782 HydrophobicContact CD2-CD1 4.41Å; L778-L782 HydrophobicContact CG-CD1 4.2Å; L778-L782 VanDerWaalsContact O-CB 3.31Å; L778-L782 WeakPolarHBondContact O-CB 3.48Å; L778-L782 WeakPolarHBondContact O-CD1 3.2Å; L778-L782 VanDerWaalsContact O-CG 3.24Å; L778-L782 WeakPolarHBondContact O-CG 3.04Å; L778-L782 PolarHBondContact O-N 2.56Å; L778-M857 HydrophobicContact CD2-CB 3.63Å; L778-M857 HydrophobicContact CD2-CE 4.17Å; L778-M857 HydrophobicContact CD2-CG 4.3Å
779	T	53.9	Low	52.1	Low	59 Å²	59	44.4 Å²	44.4	36%	0.362	24%	0.244	S	C	.	.	H	α-helix	trans	-65.6	-37.4	175.4	56.5	0	0	0	0	111.6	L775 I776 L782 V783	L775-T779 WeakPolarHBondContact O-CG2 3.4Å; L775-T779 PolarHBondContact O-N 3.08Å; L775-T779 PolarHBondContact O-OG1 3.16Å; I776-T779 VanDerWaalsContact CA-OG1 3.29Å; I776-T779 WeakPolarHBondContact CA-OG1 3.25Å; I776-T779 CarbonylContact O-C 3.57Å; I776-T779 PolarHBondContact O-N 3.42Å; I776-T779 VanDerWaalsContact O-N 3.13Å; I776-T779 PolarHBondContact O-OG1 3.38Å; T779-L782 PolarHBondContact O-N 3.28Å; T779-V783 WeakPolarHBondContact O-CB 3.3Å; T779-V783 WeakPolarHBondContact O-CG2 3.44Å; T779-V783 PolarHBondContact O-N 3.35Å
780	C	51.7	Low	52.5	Low	29 Å²	29	48.2 Å²	48.2	20%	0.196	26%	0.262	C	S	.	.	H	α-helix	trans	-70.2	-40.7	178.3	-66.7	0	0	0	0	111.5	S699 I776 L777 L778 L782 V783 S784	S699-C780 WeakPolarHBondContact CB-SG 3.27Å; S699-C780 WeakPolarHBondContact OG-CB 3.5Å; S699-C780 PolarHBondContact OG-SG 3.3Å; I776-C780 WeakPolarHBondContact O-CB 3.38Å; I776-C780 PolarHBondContact O-N 3.26Å; I776-C780 PolarHBondContact O-SG 3.2Å; L777-C780 PolarHBondContact O-N 2.78Å; L778-C780 VanDerWaalsContact C-N 3.32Å; C780-L782 VanDerWaalsContact C-N 3.34Å; C780-V783 PolarHBondContact O-N 3.13Å; C780-S784 PolarHBondContact O-N 3.23Å; C780-S784 PolarHBondContact O-OG 2.95Å
781	S	53.3	Low	52.5	Low	20 Å²	20	49 Å²	49	14%	0.14	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-41.7	173.2	67.1	0	0	0	0	111.1	L777 L778 S784 L785	L777-S781 WeakPolarHBondContact O-CB 3.48Å; L777-S781 PolarHBondContact O-N 2.78Å; L777-S781 PolarHBondContact O-OG 3.24Å; L778-S781 WeakPolarHBondContact CA-OG 3.49Å; L778-S781 PolarHBondContact O-N 3.36Å; L778-S781 PolarHBondContact O-OG 2.9Å; S781-S784 WeakPolarHBondContact CA-OG 2.98Å; S781-S784 PolarHBondContact O-N 3.09Å; S781-S784 PolarHBondContact O-OG 3.5Å; S781-L785 VanDerWaalsContact O-CB 3.3Å; S781-L785 WeakPolarHBondContact O-CB 3.05Å; S781-L785 WeakPolarHBondContact O-CD1 3.38Å; S781-L785 PolarHBondContact O-N 3.3Å
782	L	52.9	Low	52.6	Low	53 Å²	53	48.8 Å²	48.8	28%	0.277	26%	0.262	S	S	.	.	H	α-helix	trans	-62.5	-39.9	173.4	-77.4	165.3	0	0	0	113	L778 T779 C780 L785 L786 M857	L778-L782 HydrophobicContact CD2-CD1 4.41Å; L778-L782 HydrophobicContact CG-CD1 4.2Å; L778-L782 VanDerWaalsContact O-CB 3.31Å; L778-L782 WeakPolarHBondContact O-CB 3.48Å; L778-L782 WeakPolarHBondContact O-CD1 3.2Å; L778-L782 VanDerWaalsContact O-CG 3.24Å; L778-L782 WeakPolarHBondContact O-CG 3.04Å; L778-L782 PolarHBondContact O-N 2.56Å; T779-L782 PolarHBondContact O-N 3.28Å; C780-L782 VanDerWaalsContact C-N 3.34Å; L782-L785 VanDerWaalsContact O-CB 3.25Å; L782-L785 WeakPolarHBondContact O-CB 3.15Å; L782-L785 PolarHBondContact O-N 3.42Å; L782-L786 WeakPolarHBondContact O-CB 3.16Å; L782-L786 PolarHBondContact O-N 2.86Å; L782-M857 HydrophobicContact CD1-CE 3.45Å; L782-M857 VanDerWaalsContact CD1-CE 3.45Å
783	V	52.5	Low	52.9	Low	86 Å²	86	51.5 Å²	51.5	52%	0.521	28%	0.276	S	S	.	.	H	α-helix	trans	-67.7	-43.9	176.1	170	0	0	0	0	110.7	T779 C780 L785 L786 V787	T779-V783 WeakPolarHBondContact O-CB 3.3Å; T779-V783 WeakPolarHBondContact O-CG2 3.44Å; T779-V783 PolarHBondContact O-N 3.35Å; C780-V783 PolarHBondContact O-N 3.13Å; V783-L785 PolarHBondContact O-N 3.2Å; V783-L786 PolarHBondContact O-N 3.45Å; V783-V787 WeakPolarHBondContact O-CG2 3.4Å; V783-V787 PolarHBondContact O-N 3.34Å
784	S	51.6	Low	53	Low	34 Å²	34	58.4 Å²	58.4	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-61	-36.3	173.2	58	0	0	0	0	111.9	C780 S781 L788	C780-S784 PolarHBondContact O-N 3.23Å; C780-S784 PolarHBondContact O-OG 2.95Å; S781-S784 WeakPolarHBondContact CA-OG 2.98Å; S781-S784 PolarHBondContact O-N 3.09Å; S781-S784 PolarHBondContact O-OG 3.5Å; S784-L788 WeakPolarHBondContact O-CB 3.27Å; S784-L788 PolarHBondContact O-N 2.91Å
785	L	53.2	Low	53.1	Low	23 Å²	23	63.2 Å²	63.2	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-45.5	174.4	-113.6	119.4	0	0	0	112.1	S781 L782 V783 L788 L789 F811 I815	S781-L785 VanDerWaalsContact O-CB 3.3Å; S781-L785 WeakPolarHBondContact O-CB 3.05Å; S781-L785 WeakPolarHBondContact O-CD1 3.38Å; S781-L785 PolarHBondContact O-N 3.3Å; L782-L785 VanDerWaalsContact O-CB 3.25Å; L782-L785 WeakPolarHBondContact O-CB 3.15Å; L782-L785 PolarHBondContact O-N 3.42Å; V783-L785 PolarHBondContact O-N 3.2Å; L785-L788 PolarHBondContact O-N 2.91Å; L785-L789 WeakPolarHBondContact O-CB 3.47Å; L785-L789 PolarHBondContact O-N 3.38Å; L785-F811 HydrophobicContact CB-CE2 4.35Å; L785-F811 HydrophobicContact CB-CZ 4.19Å; L785-F811 HydrophobicContact CD2-CD1 4.4Å; L785-F811 HydrophobicContact CD2-CD2 4.45Å; L785-F811 HydrophobicContact CD2-CE1 3.48Å; L785-F811 VanDerWaalsContact CD2-CE1 3.48Å; L785-F811 HydrophobicContact CD2-CE2 3.55Å; L785-F811 HydrophobicContact CD2-CZ 3.01Å; L785-F811 HydrophobicContact CG-CD2 4.5Å; L785-F811 HydrophobicContact CG-CE1 4.39Å; L785-F811 HydrophobicContact CG-CE2 3.53Å; L785-F811 HydrophobicContact CG-CZ 3.51Å; L785-I815 HydrophobicContact CD1-CG1 3.87Å; L785-I815 HydrophobicContact CD2-CD1 3.45Å; L785-I815 VanDerWaalsContact CD2-CD1 3.45Å; L785-I815 HydrophobicContact CD2-CG1 3.38Å; L785-I815 HydrophobicContact CG-CG1 4.21Å
786	L	55.2	Low	52.6	Low	103 Å²	103	64.8 Å²	64.8	54%	0.539	34%	0.341	S	S	.	.	H	α-helix	trans	-63.4	-43.8	179	-167.8	84.4	0	0	0	110.8	L782 V783 L789 I790	L782-L786 WeakPolarHBondContact O-CB 3.16Å; L782-L786 PolarHBondContact O-N 2.86Å; V783-L786 PolarHBondContact O-N 3.45Å; L786-L789 PolarHBondContact O-N 3.34Å; L786-I790 HydrophobicContact CD2-CD1 4.31Å; L786-I790 HydrophobicContact CG-CD1 4.11Å; L786-I790 VanDerWaalsContact O-CG1 3.26Å; L786-I790 WeakPolarHBondContact O-CG1 3.05Å; L786-I790 PolarHBondContact O-N 3.43Å
787	V	51.7	Low	52.2	Low	68 Å²	68	73.5 Å²	73.5	41%	0.412	38%	0.382	S	S	.	.	H	α-helix	trans	-65.9	-40.9	178.3	174.8	0	0	0	0	111	V783 I790 Y791	V783-V787 WeakPolarHBondContact O-CG2 3.4Å; V783-V787 PolarHBondContact O-N 3.34Å; V787-I790 PolarHBondContact O-N 2.68Å; V787-Y791 WeakPolarHBondContact O-CB 3.16Å; V787-Y791 PolarHBondContact O-N 3.43Å
788	L	52.7	Low	51.8	Low	34 Å²	34	74.4 Å²	74.4	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-63.3	-41.7	174.6	-163.3	82.5	0	0	0	111.6	L688 L692 S784 L785 Y791 L792 F811	L688-L788 HydrophobicContact CD2-CD1 3.84Å; L692-L788 HydrophobicContact CD1-CD1 4.45Å; S784-L788 WeakPolarHBondContact O-CB 3.27Å; S784-L788 PolarHBondContact O-N 2.91Å; L785-L788 PolarHBondContact O-N 2.91Å; L788-Y791 PolarHBondContact O-N 3.21Å; L788-L792 HydrophobicContact CD2-CD1 4.39Å; L788-L792 HydrophobicContact CG-CD1 4.27Å; L788-L792 WeakPolarHBondContact O-CB 3.27Å; L788-L792 WeakPolarHBondContact O-CG 3.47Å; L788-L792 PolarHBondContact O-N 2.95Å; L788-F811 HydrophobicContact CB-CE2 4.31Å; L788-F811 HydrophobicContact CD2-CD2 3.52Å; L788-F811 HydrophobicContact CD2-CE2 3.48Å; L788-F811 VanDerWaalsContact CD2-CE2 3.48Å; L788-F811 HydrophobicContact CG-CE2 4.45Å
789	L	54.5	Low	51.4	Low	54 Å²	54	78.2 Å²	78.2	28%	0.283	42%	0.417	S	S	.	.	H	α-helix	trans	-63.4	-45.3	177.1	-165.6	83.3	0	0	0	111.2	L785 L786 Y791 L792 I793 Y808 F811	L785-L789 WeakPolarHBondContact O-CB 3.47Å; L785-L789 PolarHBondContact O-N 3.38Å; L786-L789 PolarHBondContact O-N 3.34Å; L789-Y791 VanDerWaalsContact C-N 3.31Å; L789-Y791 PolarHBondContact O-N 2.83Å; L789-L792 PolarHBondContact O-N 3.31Å; L789-I793 HydrophobicContact CD2-CD1 4.31Å; L789-I793 HydrophobicContact CG-CD1 4.05Å; L789-I793 VanDerWaalsContact O-CG1 3.24Å; L789-I793 WeakPolarHBondContact O-CG1 2.91Å; L789-I793 PolarHBondContact O-N 3.48Å; L789-Y808 HydrophobicContact CD1-CE1 4.47Å; L789-F811 HydrophobicContact CD1-CE1 4.43Å
790	I	56.2	Low	51	Low	96 Å²	96	83 Å²	83	49%	0.492	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-43.3	175.9	-69.4	165.3	0	0	0	110.2	L786 V787 I793 H794	L786-I790 HydrophobicContact CD2-CD1 4.31Å; L786-I790 HydrophobicContact CG-CD1 4.11Å; L786-I790 VanDerWaalsContact O-CG1 3.26Å; L786-I790 WeakPolarHBondContact O-CG1 3.05Å; L786-I790 PolarHBondContact O-N 3.43Å; V787-I790 PolarHBondContact O-N 2.68Å; I790-I793 PolarHBondContact O-N 2.89Å; I790-H794 WeakPolarHBondContact O-CB 3.42Å; I790-H794 PolarHBondContact O-N 2.98Å
791	Y	49.3	Very low	51	Low	69 Å²	69	84.7 Å²	84.7	27%	0.271	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-42.3	178	-177.8	-100.1	0	0	0	112.9	P685 L688 V787 L788 L789 H794 R795	P685-Y791 WeakPolarHBondContact CG-OH 3.45Å; L688-Y791 HydrophobicContact CD1-CD1 3.56Å; L688-Y791 HydrophobicContact CD1-CD2 3.52Å; L688-Y791 HydrophobicContact CD1-CE1 3.76Å; L688-Y791 HydrophobicContact CD1-CE2 3.73Å; L688-Y791 HydrophobicContact CD1-CG 3.43Å; L688-Y791 VanDerWaalsContact CD1-CG 3.43Å; L688-Y791 HydrophobicContact CD2-CD1 3.93Å; L688-Y791 HydrophobicContact CD2-CE1 3.97Å; L688-Y791 HydrophobicContact CG-CD1 4.4Å; L688-Y791 HydrophobicContact CG-CE1 4.39Å; V787-Y791 WeakPolarHBondContact O-CB 3.16Å; V787-Y791 PolarHBondContact O-N 3.43Å; L788-Y791 PolarHBondContact O-N 3.21Å; L789-Y791 VanDerWaalsContact C-N 3.31Å; L789-Y791 PolarHBondContact O-N 2.83Å; Y791-H794 PolarHBondContact O-N 3.35Å; Y791-R795 PolarHBondContact O-N 3.08Å; Y791-R795 PolarHBondContact OH-NH1 3.48Å
792	L	52.4	Low	50.9	Low	32 Å²	32	89.4 Å²	89.4	17%	0.168	47%	0.47	C	S	.	.	H	α-helix	trans	-65.1	-38.8	176.4	-76.5	164.5	0	0	0	112.1	L788 L789 Y808	L788-L792 HydrophobicContact CD2-CD1 4.39Å; L788-L792 HydrophobicContact CG-CD1 4.27Å; L788-L792 WeakPolarHBondContact O-CB 3.27Å; L788-L792 WeakPolarHBondContact O-CG 3.47Å; L788-L792 PolarHBondContact O-N 2.95Å; L789-L792 PolarHBondContact O-N 3.31Å; L792-Y808 WeakPolarHBondContact CB-OH 3.35Å; L792-Y808 HydrophobicContact CD1-CD1 4.5Å; L792-Y808 HydrophobicContact CD1-CE1 3.82Å
793	I	56.2	Low	50.6	Low	101 Å²	101	91.9 Å²	91.9	52%	0.518	48%	0.484	S	S	.	.	H	α-helix	trans	-66.9	-40.2	174.9	-67.7	165.5	0	0	0	110.6	L789 I790 R795 S796	L789-I793 HydrophobicContact CD2-CD1 4.31Å; L789-I793 HydrophobicContact CG-CD1 4.05Å; L789-I793 VanDerWaalsContact O-CG1 3.24Å; L789-I793 WeakPolarHBondContact O-CG1 2.91Å; L789-I793 PolarHBondContact O-N 3.48Å; I790-I793 PolarHBondContact O-N 2.89Å; I793-R795 VanDerWaalsContact C-N 3.29Å; I793-R795 PolarHBondContact O-N 2.93Å; I793-S796 PolarHBondContact O-N 2.87Å; I793-S796 PolarHBondContact O-OG 2.86Å
794	H	55.2	Low	50.6	Low	175 Å²	175	89.9 Å²	89.9	81%	0.81	47%	0.47	S	S	*	.	H	α-helix	trans	-74.2	-17.6	-176.2	-132.3	50.7	0	0	0	114.1	I790 Y791	I790-H794 WeakPolarHBondContact O-CB 3.42Å; I790-H794 PolarHBondContact O-N 2.98Å; Y791-H794 PolarHBondContact O-N 3.35Å
795	R	51.8	Low	50.4	Low	144 Å²	144	89 Å²	89	54%	0.543	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	6.2	178.2	-141.3	177.8	-172.5	-170.9	4.7	113.7	Y791 I793 E797	Y791-R795 PolarHBondContact O-N 3.08Å; Y791-R795 PolarHBondContact OH-NH1 3.48Å; I793-R795 VanDerWaalsContact C-N 3.29Å; I793-R795 PolarHBondContact O-N 2.93Å; R795-E797 PolarHBondContact O-N 3.41Å
796	S	42.2	Very low	50.2	Low	86 Å²	86	92.4 Å²	92.4	60%	0.601	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	22.7	-168.9	81.3	0	0	0	0	116.1	I793 V798	I793-S796 PolarHBondContact O-N 2.87Å; I793-S796 PolarHBondContact O-OG 2.86Å; S796-V798 PolarHBondContact O-N 2.84Å
797	E	44.6	Very low	50	Low	200 Å²	200	90 Å²	90	94%	0.935	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.3	166	-74.5	-171.1	162.2	0	0	112.6	R795	R795-E797 PolarHBondContact O-N 3.41Å
798	V	43.7	Very low	50.1	Low	90 Å²	90	87.7 Å²	87.7	55%	0.545	45%	0.45	S	S	.	.	S	Bend	trans	-87.9	123.5	178.6	-171.7	0	0	0	0	110.1	S796 M800	S796-V798 PolarHBondContact O-N 2.84Å; V798-M800 PolarHBondContact O-N 3.4Å
799	S	45.7	Very low	50	Low	87 Å²	87	87 Å²	87	61%	0.608	45%	0.447	S	S	*	.			trans	-39.9	135.1	175.7	54.7	0	0	0	0	112.4	T801	S799-T801 WeakPolarHBondContact O-CG2 3.01Å; S799-T801 PolarHBondContact O-N 3.36Å; S799-T801 PolarHBondContact O-OG1 3.36Å
800	M	44.8	Very low	49.9	Very low	160 Å²	160	88.7 Å²	88.7	79%	0.788	46%	0.456	S	S	*	.			trans	-51.1	80	175.7	-66.9	-77.8	-102.5	0	0	111.5	V798	V798-M800 PolarHBondContact O-N 3.4Å
801	T	51.7	Low	49.8	Very low	64 Å²	64	84.6 Å²	84.6	39%	0.393	43%	0.434	S	S	.	.			trans	-88.7	147.3	175.6	43.7	0	0	0	0	108.5	S799 N803 I804	S799-T801 WeakPolarHBondContact O-CG2 3.01Å; S799-T801 PolarHBondContact O-N 3.36Å; S799-T801 PolarHBondContact O-OG1 3.36Å; T801-N803 PolarHBondContact O-N 2.76Å; T801-I804 PolarHBondContact O-N 2.87Å
802	D	50.9	Low	50	Low	118 Å²	118	81.3 Å²	81.3	63%	0.631	42%	0.421	S	S	*	.	H	α-helix	trans	-46.6	-29.5	-179.6	-66.1	-34.5	0	0	0	113.3	I804 C805 Q806	D802-I804 PolarHBondContact O-N 3.41Å; D802-C805 WeakPolarHBondContact O-CB 3.32Å; D802-C805 PolarHBondContact O-N 2.83Å; D802-Q806 WeakPolarHBondContact O-CG 3.34Å; D802-Q806 PolarHBondContact O-N 3.4Å
803	N	47.4	Very low	50.1	Low	106 Å²	106	81.6 Å²	81.6	57%	0.567	42%	0.423	S	S	*	.	H	α-helix	trans	-62.5	-38.5	177.5	-65.8	-6.9	0	0	0	113.6	T801 C805 L807	T801-N803 PolarHBondContact O-N 2.76Å; N803-C805 VanDerWaalsContact C-N 3.35Å; N803-L807 PolarHBondContact O-N 3.29Å
804	I	51.4	Low	50	Low	43 Å²	43	80.5 Å²	80.5	22%	0.221	42%	0.416	C	S	.	.	H	α-helix	trans	-67.9	-40.2	177.8	-62.9	178.4	0	0	0	109.7	T801 D802 L807 Y808	T801-I804 PolarHBondContact O-N 2.87Å; D802-I804 PolarHBondContact O-N 3.41Å; I804-L807 WeakPolarHBondContact O-CB 3.19Å; I804-L807 PolarHBondContact O-N 3.4Å; I804-Y808 HydrophobicContact CG2-CD2 3.69Å; I804-Y808 HydrophobicContact CG2-CE2 3.36Å; I804-Y808 WeakPolarHBondContact O-CD2 3.33Å; I804-Y808 PolarHBondContact O-N 3.48Å
805	C	48	Very low	50	Low	15 Å²	15	72.6 Å²	72.6	10%	0.101	38%	0.379	C	S	.	.	H	α-helix	trans	-64.9	-43	177.3	-171.4	0	0	0	0	112.1	D802 N803 L807 Y808 T809 F872 P874	D802-C805 WeakPolarHBondContact O-CB 3.32Å; D802-C805 PolarHBondContact O-N 2.83Å; N803-C805 VanDerWaalsContact C-N 3.35Å; C805-L807 VanDerWaalsContact C-N 3.29Å; C805-L807 PolarHBondContact O-N 3.23Å; C805-Y808 PolarHBondContact O-N 2.86Å; C805-T809 WeakPolarHBondContact O-CG2 3.5Å; C805-T809 PolarHBondContact O-N 2.87Å; C805-T809 PolarHBondContact O-OG1 3.39Å; C805-F872 PolarHBondContact SG-O 2.61Å; C805-P874 VanDerWaalsContact SG-CD 3.57Å
806	Q	49.4	Very low	50	Low	95 Å²	95	66.1 Å²	66.1	44%	0.444	36%	0.355	S	S	.	.	H	α-helix	trans	-60.3	-38.3	172.9	-71.9	176.9	8.6	0	0	112.2	D802 T809 I810	D802-Q806 WeakPolarHBondContact O-CG 3.34Å; D802-Q806 PolarHBondContact O-N 3.4Å; Q806-T809 WeakPolarHBondContact CA-OG1 3.23Å; Q806-T809 PolarHBondContact O-N 3.49Å; Q806-T809 PolarHBondContact O-OG1 3.46Å; Q806-I810 WeakPolarHBondContact O-CD1 2.97Å; Q806-I810 VanDerWaalsContact O-CG1 3.23Å; Q806-I810 WeakPolarHBondContact O-CG1 3.3Å; Q806-I810 PolarHBondContact O-N 3.17Å
807	L	50.8	Low	50.4	Low	52 Å²	52	64.4 Å²	64.4	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176	-119.7	140.1	0	0	0	112	V683 N803 I804 C805 I810 F811	V683-L807 HydrophobicContact CG1-CD1 3.57Å; N803-L807 PolarHBondContact O-N 3.29Å; I804-L807 WeakPolarHBondContact O-CB 3.19Å; I804-L807 PolarHBondContact O-N 3.4Å; C805-L807 VanDerWaalsContact C-N 3.29Å; C805-L807 PolarHBondContact O-N 3.23Å; L807-I810 PolarHBondContact O-N 3.36Å; L807-F811 VanDerWaalsContact O-CB 3.26Å; L807-F811 WeakPolarHBondContact O-CB 3.15Å; L807-F811 PolarHBondContact O-N 2.75Å
808	Y	54	Low	50.7	Low	20 Å²	20	57.9 Å²	57.9	8%	0.078	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-33.4	176	-76.3	-65.7	0	0	0	113.2	L789 L792 I804 C805 F811 S812 F872	L789-Y808 HydrophobicContact CD1-CE1 4.47Å; L792-Y808 WeakPolarHBondContact CB-OH 3.35Å; L792-Y808 HydrophobicContact CD1-CD1 4.5Å; L792-Y808 HydrophobicContact CD1-CE1 3.82Å; I804-Y808 HydrophobicContact CG2-CD2 3.69Å; I804-Y808 HydrophobicContact CG2-CE2 3.36Å; I804-Y808 WeakPolarHBondContact O-CD2 3.33Å; I804-Y808 PolarHBondContact O-N 3.48Å; C805-Y808 PolarHBondContact O-N 2.86Å; Y808-F811 WeakPolarHBondContact O-CB 3.4Å; Y808-F811 PolarHBondContact O-N 2.79Å; Y808-S812 WeakPolarHBondContact O-CB 3.13Å; Y808-S812 PolarHBondContact O-N 2.67Å; Y808-F872 HydrophobicContact CD1-CD2 4.13Å; Y808-F872 HydrophobicContact CD1-CE2 4.2Å; Y808-F872 HydrophobicContact CD2-CB 4.43Å; Y808-F872 HydrophobicContact CD2-CD1 4.06Å; Y808-F872 HydrophobicContact CD2-CD2 4.34Å; Y808-F872 HydrophobicContact CD2-CE1 4.45Å; Y808-F872 HydrophobicContact CD2-CG 4.02Å; Y808-F872 HydrophobicContact CE1-CE2 4.22Å; Y808-F872 HydrophobicContact CE1-CZ 4.35Å; Y808-F872 HydrophobicContact CE2-CD1 4.16Å; Y808-F872 HydrophobicContact CE2-CE1 4.12Å; Y808-F872 HydrophobicContact CE2-CG 4.49Å; Y808-F872 HydrophobicContact CE2-CZ 4.44Å; Y808-F872 HydrophobicContact CG-CB 4.45Å; Y808-F872 HydrophobicContact CG-CD2 4.02Å; Y808-F872 HydrophobicContact CG-CE2 4.47Å; Y808-F872 HydrophobicContact CG-CG 4.08Å
809	T	49.4	Very low	51.1	Low	19 Å²	19	53.7 Å²	53.7	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-69.9	-42	174.9	56.7	0	0	0	0	111.5	C805 Q806 F811 S812 L813 I882	C805-T809 WeakPolarHBondContact O-CG2 3.5Å; C805-T809 PolarHBondContact O-N 2.87Å; C805-T809 PolarHBondContact O-OG1 3.39Å; Q806-T809 WeakPolarHBondContact CA-OG1 3.23Å; Q806-T809 PolarHBondContact O-N 3.49Å; Q806-T809 PolarHBondContact O-OG1 3.46Å; T809-F811 VanDerWaalsContact C-N 3.34Å; T809-F811 PolarHBondContact O-N 3.22Å; T809-S812 PolarHBondContact O-N 3.38Å; T809-S812 PolarHBondContact O-OG 3.42Å; T809-L813 PolarHBondContact O-N 3.21Å; T809-I882 HydrophobicContact CG2-CD1 3.92Å
810	I	52.3	Low	51.2	Low	91 Å²	91	50.9 Å²	50.9	47%	0.467	27%	0.265	S	S	.	.	H	α-helix	trans	-58.9	-46.5	171.1	-67.4	166.1	0	0	0	110.2	Q806 L807 S812 L813 E814	Q806-I810 WeakPolarHBondContact O-CD1 2.97Å; Q806-I810 VanDerWaalsContact O-CG1 3.23Å; Q806-I810 WeakPolarHBondContact O-CG1 3.3Å; Q806-I810 PolarHBondContact O-N 3.17Å; L807-I810 PolarHBondContact O-N 3.36Å; I810-S812 PolarHBondContact O-N 2.93Å; I810-L813 WeakPolarHBondContact O-CA 3.31Å; I810-L813 WeakPolarHBondContact O-CB 3.38Å; I810-L813 PolarHBondContact O-N 3.23Å; I810-E814 PolarHBondContact O-N 3.22Å
811	F	54.9	Low	51.4	Low	9 Å²	9	47.9 Å²	47.9	4%	0.039	25%	0.251	C	S	.	.	H	α-helix	trans	-58.2	-44.2	177.2	-177.4	-106.7	0	0	0	112.8	L785 L788 L789 L807 Y808 T809 L813 E814 I815 L868	L785-F811 HydrophobicContact CB-CE2 4.35Å; L785-F811 HydrophobicContact CB-CZ 4.19Å; L785-F811 HydrophobicContact CD2-CD1 4.4Å; L785-F811 HydrophobicContact CD2-CD2 4.45Å; L785-F811 HydrophobicContact CD2-CE1 3.48Å; L785-F811 VanDerWaalsContact CD2-CE1 3.48Å; L785-F811 HydrophobicContact CD2-CE2 3.55Å; L785-F811 HydrophobicContact CD2-CZ 3.01Å; L785-F811 HydrophobicContact CG-CD2 4.5Å; L785-F811 HydrophobicContact CG-CE1 4.39Å; L785-F811 HydrophobicContact CG-CE2 3.53Å; L785-F811 HydrophobicContact CG-CZ 3.51Å; L788-F811 HydrophobicContact CB-CE2 4.31Å; L788-F811 HydrophobicContact CD2-CD2 3.52Å; L788-F811 HydrophobicContact CD2-CE2 3.48Å; L788-F811 VanDerWaalsContact CD2-CE2 3.48Å; L788-F811 HydrophobicContact CG-CE2 4.45Å; L789-F811 HydrophobicContact CD1-CE1 4.43Å; L807-F811 VanDerWaalsContact O-CB 3.26Å; L807-F811 WeakPolarHBondContact O-CB 3.15Å; L807-F811 PolarHBondContact O-N 2.75Å; Y808-F811 WeakPolarHBondContact O-CB 3.4Å; Y808-F811 PolarHBondContact O-N 2.79Å; T809-F811 VanDerWaalsContact C-N 3.34Å; T809-F811 PolarHBondContact O-N 3.22Å; F811-L813 VanDerWaalsContact C-N 3.3Å; F811-L813 PolarHBondContact O-N 2.85Å; F811-E814 PolarHBondContact O-N 3.02Å; F811-I815 HydrophobicContact CD1-CD1 3.86Å; F811-I815 HydrophobicContact CE1-CD1 3.81Å; F811-I815 WeakPolarHBondContact O-CG1 3.27Å; F811-I815 PolarHBondContact O-N 2.96Å; F811-L868 HydrophobicContact CD1-CD1 4.03Å; F811-L868 HydrophobicContact CE1-CD1 3.81Å
812	S	54.3	Low	51.2	Low	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-33.1	176.1	78	0	0	0	0	112.9	Y808 T809 I810 F816 R869	Y808-S812 WeakPolarHBondContact O-CB 3.13Å; Y808-S812 PolarHBondContact O-N 2.67Å; T809-S812 PolarHBondContact O-N 3.38Å; T809-S812 PolarHBondContact O-OG 3.42Å; I810-S812 PolarHBondContact O-N 2.93Å; S812-F816 WeakPolarHBondContact O-CB 3.32Å; S812-F816 PolarHBondContact O-N 2.88Å; S812-F816 VanDerWaalsContact O-N 3.16Å; S812-R869 WeakPolarHBondContact OG-CG 3.15Å; S812-R869 PolarHBondContact OG-NE 2.95Å
813	L	53	Low	51	Low	38 Å²	38	41.1 Å²	41.1	20%	0.199	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-39.7	174.1	-80.8	166	0	0	0	111.4	T809 I810 F811 F816 C817 L885	T809-L813 PolarHBondContact O-N 3.21Å; I810-L813 WeakPolarHBondContact O-CA 3.31Å; I810-L813 WeakPolarHBondContact O-CB 3.38Å; I810-L813 PolarHBondContact O-N 3.23Å; F811-L813 VanDerWaalsContact C-N 3.3Å; F811-L813 PolarHBondContact O-N 2.85Å; L813-F816 PolarHBondContact O-N 2.95Å; L813-C817 WeakPolarHBondContact O-CB 3.36Å; L813-C817 PolarHBondContact O-N 3.2Å; L813-C817 PolarHBondContact O-SG 3.15Å; L813-C817 VanDerWaalsContact O-SG 3.34Å; L813-L885 HydrophobicContact CD1-CD2 4.1Å; L813-L885 HydrophobicContact CD2-CD2 3.33Å; L813-L885 HydrophobicContact CG-CD2 4.38Å
814	E	54.1	Low	50.7	Low	79 Å²	79	37 Å²	37	37%	0.369	20%	0.198	S	C	.	.	H	α-helix	trans	-63.2	-47.3	175.3	-74.2	-172.6	161.1	0	0	111.8	I810 F811 F816 C817 I818	I810-E814 PolarHBondContact O-N 3.22Å; F811-E814 PolarHBondContact O-N 3.02Å; E814-F816 PolarHBondContact O-N 3.04Å; E814-C817 PolarHBondContact O-N 3.45Å; E814-I818 WeakPolarHBondContact O-CB 3.42Å; E814-I818 VanDerWaalsContact O-CG1 3.23Å; E814-I818 WeakPolarHBondContact O-CG1 3.3Å; E814-I818 PolarHBondContact O-N 3.33Å
815	I	56.1	Low	50.2	Low	8 Å²	8	42.9 Å²	42.9	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-54.2	-46.8	173.8	-65.1	160	0	0	0	110.2	L785 F811 A819 C861 L868	L785-I815 HydrophobicContact CD1-CG1 3.87Å; L785-I815 HydrophobicContact CD2-CD1 3.45Å; L785-I815 VanDerWaalsContact CD2-CD1 3.45Å; L785-I815 HydrophobicContact CD2-CG1 3.38Å; L785-I815 HydrophobicContact CG-CG1 4.21Å; F811-I815 HydrophobicContact CD1-CD1 3.86Å; F811-I815 HydrophobicContact CE1-CD1 3.81Å; F811-I815 WeakPolarHBondContact O-CG1 3.27Å; F811-I815 PolarHBondContact O-N 2.96Å; I815-A819 WeakPolarHBondContact O-CB 3.4Å; I815-A819 PolarHBondContact O-N 3.38Å; I815-C861 HydrophobicContact CG2-CB 3.86Å; I815-C861 WeakPolarHBondContact CG2-O 3.35Å; I815-L868 HydrophobicContact CD1-CD1 3.61Å
816	F	51.7	Low	49.7	Very low	8 Å²	8	44.1 Å²	44.1	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-47.3	179.7	-177.2	-97.6	0	0	0	111.7	S812 L813 E814 A819 Q820 P886 I889 F909	S812-F816 WeakPolarHBondContact O-CB 3.32Å; S812-F816 PolarHBondContact O-N 2.88Å; S812-F816 VanDerWaalsContact O-N 3.16Å; L813-F816 PolarHBondContact O-N 2.95Å; E814-F816 PolarHBondContact O-N 3.04Å; F816-A819 WeakPolarHBondContact O-CB 3.49Å; F816-A819 PolarHBondContact O-N 3Å; F816-Q820 HydrophobicContact CD1-CG 4.14Å; F816-Q820 HydrophobicContact CE1-CG 3.81Å; F816-Q820 HydrophobicContact CE2-CG 4.39Å; F816-Q820 HydrophobicContact CZ-CG 3.95Å; F816-Q820 VanDerWaalsContact O-CG 3.25Å; F816-Q820 WeakPolarHBondContact O-CG 3.43Å; F816-Q820 PolarHBondContact O-N 3.4Å; F816-P886 HydrophobicContact CE1-CB 4.22Å; F816-P886 HydrophobicContact CE2-CB 4.26Å; F816-P886 HydrophobicContact CZ-CB 3.9Å; F816-I889 HydrophobicContact CD1-CD1 4.24Å; F816-I889 HydrophobicContact CE1-CB 4.27Å; F816-I889 HydrophobicContact CE1-CD1 4.06Å; F816-I889 HydrophobicContact CE1-CG2 4.06Å; F816-F909 HydrophobicContact CD2-CE2 4.37Å; F816-F909 HydrophobicContact CD2-CZ 4.42Å; F816-F909 AromaticContact CE2-CE2 3.92Å; F816-F909 HydrophobicContact CE2-CE2 3.92Å; F816-F909 HydrophobicContact CE2-CZ 4.34Å
817	C	49.7	Very low	49	Very low	51 Å²	51	42.2 Å²	42.2	35%	0.345	22%	0.217	S	C	.	.	H	α-helix	trans	-63.3	-44.3	178.7	-74.7	0	0	0	0	112.2	L813 E814 A819 Q820 I821	L813-C817 WeakPolarHBondContact O-CB 3.36Å; L813-C817 PolarHBondContact O-N 3.2Å; L813-C817 PolarHBondContact O-SG 3.15Å; L813-C817 VanDerWaalsContact O-SG 3.34Å; E814-C817 PolarHBondContact O-N 3.45Å; C817-A819 VanDerWaalsContact C-N 3.33Å; C817-A819 PolarHBondContact O-N 3.31Å; C817-Q820 PolarHBondContact O-N 3.25Å; C817-I821 WeakPolarHBondContact O-CB 3.21Å; C817-I821 WeakPolarHBondContact O-CD1 3.47Å; C817-I821 WeakPolarHBondContact O-CG1 3.43Å; C817-I821 PolarHBondContact O-N 3.06Å
818	I	52	Low	48	Very low	63 Å²	63	45.7 Å²	45.7	32%	0.323	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-44.4	176.6	-67.7	166.7	0	0	0	110.1	E814 Q820 I821 S822	E814-I818 WeakPolarHBondContact O-CB 3.42Å; E814-I818 VanDerWaalsContact O-CG1 3.23Å; E814-I818 WeakPolarHBondContact O-CG1 3.3Å; E814-I818 PolarHBondContact O-N 3.33Å; I818-Q820 PolarHBondContact O-N 3.42Å; I818-I821 PolarHBondContact O-N 2.7Å; I818-S822 WeakPolarHBondContact O-CB 3.44Å; I818-S822 PolarHBondContact O-N 2.95Å; I818-S822 PolarHBondContact O-OG 2.88Å
819	A	51.5	Low	46.9	Very low	1 Å²	1	52.2 Å²	52.2	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-59.7	-44.6	175.4	0	0	0	0	0	111.6	I815 F816 C817 S822 V858 C861 I862	I815-A819 WeakPolarHBondContact O-CB 3.4Å; I815-A819 PolarHBondContact O-N 3.38Å; F816-A819 WeakPolarHBondContact O-CB 3.49Å; F816-A819 PolarHBondContact O-N 3Å; C817-A819 VanDerWaalsContact C-N 3.33Å; C817-A819 PolarHBondContact O-N 3.31Å; A819-S822 PolarHBondContact O-N 3.43Å; A819-S822 PolarHBondContact O-OG 3.42Å; A819-V858 HydrophobicContact CB-CG1 4.24Å; A819-C861 HydrophobicContact CB-CB 4.31Å; A819-I862 HydrophobicContact CB-CG1 4.36Å
820	Q	48.9	Very low	46.1	Very low	28 Å²	28	56.1 Å²	56.1	13%	0.131	27%	0.271	C	S	.	.	H	α-helix	trans	-67.5	-41.2	177.7	-66.6	-62.3	-27.4	0	0	112.8	F816 C817 I818 S822 V823 G824 H902	F816-Q820 HydrophobicContact CD1-CG 4.14Å; F816-Q820 HydrophobicContact CE1-CG 3.81Å; F816-Q820 HydrophobicContact CE2-CG 4.39Å; F816-Q820 HydrophobicContact CZ-CG 3.95Å; F816-Q820 VanDerWaalsContact O-CG 3.25Å; F816-Q820 WeakPolarHBondContact O-CG 3.43Å; F816-Q820 PolarHBondContact O-N 3.4Å; C817-Q820 PolarHBondContact O-N 3.25Å; I818-Q820 PolarHBondContact O-N 3.42Å; Q820-S822 VanDerWaalsContact C-N 3.35Å; Q820-S822 PolarHBondContact O-N 2.9Å; Q820-V823 PolarHBondContact O-N 3.38Å; Q820-G824 PolarHBondContact O-N 3.41Å; Q820-H902 PolarHBondContact OE1-CE1 2.84Å; Q820-H902 VanDerWaalsContact OE1-CE1 3.3Å
821	I	47.6	Very low	45.1	Very low	97 Å²	97	54.3 Å²	54.3	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-64.8	-40.1	178.6	-68.5	164.3	0	0	0	110.6	C817 I818 V823 G824	C817-I821 WeakPolarHBondContact O-CB 3.21Å; C817-I821 WeakPolarHBondContact O-CD1 3.47Å; C817-I821 WeakPolarHBondContact O-CG1 3.43Å; C817-I821 PolarHBondContact O-N 3.06Å; I818-I821 PolarHBondContact O-N 2.7Å; I821-V823 VanDerWaalsContact C-N 3.26Å; I821-V823 PolarHBondContact O-N 2.82Å; I821-G824 PolarHBondContact O-N 2.85Å
822	S	47.8	Very low	44.1	Very low	20 Å²	20	60 Å²	60	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-31	-179.6	73	0	0	0	0	113.5	R774 I818 A819 Q820	R774-S822 PolarHBondContact NH1-O 2.61Å; I818-S822 WeakPolarHBondContact O-CB 3.44Å; I818-S822 PolarHBondContact O-N 2.95Å; I818-S822 PolarHBondContact O-OG 2.88Å; A819-S822 PolarHBondContact O-N 3.43Å; A819-S822 PolarHBondContact O-OG 3.42Å; Q820-S822 VanDerWaalsContact C-N 3.35Å; Q820-S822 PolarHBondContact O-N 2.9Å
823	V	47.8	Very low	43	Very low	21 Å²	21	68.3 Å²	68.3	13%	0.127	33%	0.333	C	S	.	.	H	α-helix	trans	-94	-25	179.9	-177.6	0	0	0	0	113	Q820 I821 P826 V858	Q820-V823 PolarHBondContact O-N 3.38Å; I821-V823 VanDerWaalsContact C-N 3.26Å; I821-V823 PolarHBondContact O-N 2.82Å; V823-P826 WeakPolarHBondContact O-CD 3.44Å; V823-V858 HydrophobicContact CG2-CB 4.15Å; V823-V858 HydrophobicContact CG2-CG1 3.84Å; V823-V858 HydrophobicContact CG2-CG2 3.54Å
824	G	40.7	Very low	42	Very low	19 Å²	19	69.7 Å²	69.7	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-78.5	-26.2	-163.1	0	0	0	0	0	117.4	Q820 I821 L897	Q820-G824 PolarHBondContact O-N 3.41Å; I821-G824 PolarHBondContact O-N 2.85Å; G824-L897 VanDerWaalsContact CA-CD2 3.41Å; G824-L897 WeakPolarHBondContact O-CD2 3.4Å
825	Y	39.7	Very low	40.7	Very low	167 Å²	167	76.8 Å²	76.8	66%	0.655	37%	0.366	S	S	*	.	S	Bend	trans	-93.8	-19.2	-169.4	-103.6	-96.9	0	0	0	119.3
826	P	37.5	Very low	39.3	Very low	41 Å²	41	81.7 Å²	81.7	27%	0.266	40%	0.4	S	S	.	.	H	α-helix	trans	-76.9	-27	-170.2	27.3	-25.3	0	0	0	114.4	R774 V823 L830	R774-P826 VanDerWaalsContact NH1-CD 3.31Å; R774-P826 VanDerWaalsContact NH1-CG 3.33Å; V823-P826 WeakPolarHBondContact O-CD 3.44Å; P826-L830 WeakPolarHBondContact O-CD1 3.21Å; P826-L830 PolarHBondContact O-N 3.02Å
827	Q	35.5	Very low	38.1	Very low	54 Å²	54	93.2 Å²	93.2	25%	0.252	44%	0.443	S	S	.	.	H	α-helix	trans	-80.9	-23.9	-173.5	-81.3	177.6	-25.4	0	0	114.3	W829 C831 H898	Q827-W829 VanDerWaalsContact C-N 3.34Å; Q827-W829 PolarHBondContact O-N 3.39Å; Q827-C831 WeakPolarHBondContact O-CB 3.46Å; Q827-C831 PolarHBondContact O-N 3.42Å; Q827-C831 PolarHBondContact O-SG 3.39Å; Q827-C831 VanDerWaalsContact O-SG 3.35Å; Q827-H898 VanDerWaalsContact OE1-CB 3.26Å; Q827-H898 PolarHBondContact OE1-CD2 2.89Å
828	R	30.7	Very low	37.1	Very low	126 Å²	126	92.5 Å²	92.5	48%	0.475	44%	0.439	S	S	.	.	H	α-helix	trans	-69.5	-32.7	178.8	-107.7	177.4	160.1	165.3	-5.1	113.3	D832	R828-D832 WeakPolarHBondContact O-CB 3.48Å; R828-D832 PolarHBondContact O-N 2.9Å
829	W	30.5	Very low	36.1	Very low	157 Å²	157	97.4 Å²	97.4	60%	0.595	46%	0.464	S	S	*	.	H	α-helix	trans	-82.3	-35.1	177.7	-136.1	64.5	0	0	0	112.2	Q827	Q827-W829 VanDerWaalsContact C-N 3.34Å; Q827-W829 PolarHBondContact O-N 3.39Å
830	L	31.4	Very low	35.1	Very low	101 Å²	101	105.6 Å²	105.6	53%	0.529	50%	0.502	S	S	.	.	H	α-helix	trans	-71.6	-40.4	173.4	-93.8	103.4	0	0	0	113.2	P826 V834	P826-L830 WeakPolarHBondContact O-CD1 3.21Å; P826-L830 PolarHBondContact O-N 3.02Å; L830-V834 WeakPolarHBondContact O-CB 3.49Å; L830-V834 WeakPolarHBondContact O-CG2 3.44Å; L830-V834 PolarHBondContact O-N 3.04Å
831	C	32	Very low	34.2	Very low	52 Å²	52	109.7 Å²	109.7	35%	0.351	52%	0.524	S	S	.	.	H	α-helix	trans	-81.6	-27.8	-174.6	-69.2	0	0	0	0	114.2	Q827	Q827-C831 WeakPolarHBondContact O-CB 3.46Å; Q827-C831 PolarHBondContact O-N 3.42Å; Q827-C831 PolarHBondContact O-SG 3.39Å; Q827-C831 VanDerWaalsContact O-SG 3.35Å
832	D	33.6	Very low	33.6	Very low	130 Å²	130	111.7 Å²	111.7	70%	0.695	53%	0.534	S	S	*	.	H	α-helix	trans	-85.6	-11	-179	-75.6	-19.6	0	0	0	113.7	R828	R828-D832 WeakPolarHBondContact O-CB 3.48Å; R828-D832 PolarHBondContact O-N 2.9Å
833	K	31.7	Very low	32.9	Very low	173 Å²	173	116.9 Å²	116.9	75%	0.752	56%	0.561	S	S	*	*	H	α-helix	trans	-116.1	-17.4	173.9	-82.4	-169.3	175.8	-178.4	0	116
834	V	32.6	Very low	32.3	Very low	68 Å²	68	120.8 Å²	120.8	41%	0.412	58%	0.581	S	S	.	*			trans	-115.9	34.1	-174.3	-159.1	0	0	0	0	112.6	L830 C836 S838	L830-V834 WeakPolarHBondContact O-CB 3.49Å; L830-V834 WeakPolarHBondContact O-CG2 3.44Å; L830-V834 PolarHBondContact O-N 3.04Å; V834-C836 PolarHBondContact O-N 3.45Å; V834-C836 VanDerWaalsContact O-N 3.08Å; V834-S838 VanDerWaalsContact CG1-OG 3.28Å; V834-S838 WeakPolarHBondContact CG1-OG 3.34Å
835	R	25.7	Very low	32.3	Very low	227 Å²	227	126.1 Å²	126.1	86%	0.857	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	15.4	177.1	-132	176.7	-169.8	175.6	3	114.8
836	C	26.3	Very low	32.3	Very low	111 Å²	111	122.3 Å²	122.3	75%	0.75	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.6	113.3	174.1	-67.2	0	0	0	0	110	V834	V834-C836 PolarHBondContact O-N 3.45Å; V834-C836 VanDerWaalsContact O-N 3.08Å
837	R	26	Very low	32.7	Very low	250 Å²	250	123.1 Å²	123.1	94%	0.943	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.6	-2.1	160.5	-69.2	-179.3	170.5	169.7	-3.5	122.7
838	S	28.9	Very low	32.9	Very low	37 Å²	37	122.7 Å²	122.7	26%	0.259	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-101.1	19.2	-173.9	73.4	0	0	0	0	117.8	V834 Q840 L841	V834-S838 VanDerWaalsContact CG1-OG 3.28Å; V834-S838 WeakPolarHBondContact CG1-OG 3.34Å; S838-Q840 PolarHBondContact O-N 3.26Å; S838-L841 PolarHBondContact O-N 3.26Å
839	I	30.9	Very low	33.6	Very low	165 Å²	165	121 Å²	121	85%	0.846	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-65	-15.7	173.6	-69.8	170.8	0	0	0	111.8
840	Q	30.6	Very low	34.3	Very low	173 Å²	173	115.3 Å²	115.3	81%	0.808	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-94	-3.1	174.8	-75.3	178.4	-27.3	0	0	115.1	S838	S838-Q840 PolarHBondContact O-N 3.26Å
841	L	31.4	Very low	35	Very low	115 Å²	115	112.5 Å²	112.5	60%	0.602	59%	0.586	S	S	*	*	S	Bend	trans	-101.5	-3.6	-175.7	-95.4	151.6	0	0	0	114.3	S838	S838-L841 PolarHBondContact O-N 3.26Å
842	I	34.8	Very low	35.8	Very low	138 Å²	138	115.8 Å²	115.8	71%	0.708	60%	0.595	S	S	*	*	S	Bend	trans	-91.5	-3.1	178.5	-61.1	174.9	0	0	0	111.8	N844	I842-N844 PolarHBondContact O-N 3.14Å
843	D	32.7	Very low	36.8	Very low	130 Å²	130	113.2 Å²	113.2	70%	0.695	58%	0.58	S	S	*	*			trans	-76	7.7	175.4	-77.3	-19.1	0	0	0	114.4	N845	D843-N845 PolarHBondContact O-N 2.87Å; D843-N845 VanDerWaalsContact O-N 3.1Å
844	N	35	Very low	37.7	Very low	102 Å²	102	105.8 Å²	105.8	55%	0.545	55%	0.548	S	S	.	.			trans	-77.2	100.9	171.2	-87.9	-5.3	0	0	0	110.5	I842 S846 N847	I842-N844 PolarHBondContact O-N 3.14Å; N844-S846 PolarHBondContact O-N 2.7Å; N844-N847 PolarHBondContact O-N 2.96Å
845	N	39.9	Very low	38.5	Very low	132 Å²	132	104.5 Å²	104.5	71%	0.706	54%	0.539	S	S	*	.	H	α-helix	trans	-44.3	-22.4	179.9	-77.2	-22.2	0	0	0	116.4	D843	D843-N845 PolarHBondContact O-N 2.87Å; D843-N845 VanDerWaalsContact O-N 3.1Å
846	S	41.3	Very low	39.7	Very low	86 Å²	86	95.5 Å²	95.5	60%	0.601	51%	0.511	S	S	*	.	H	α-helix	trans	-74.7	-33.6	-178	53.3	0	0	0	0	114.2	N844	N844-S846 PolarHBondContact O-N 2.7Å
847	N	44.9	Very low	41	Very low	58 Å²	58	93.2 Å²	93.2	31%	0.31	49%	0.49	S	S	.	.	H	α-helix	trans	-79.4	-20.4	178.6	-80.9	-13.7	0	0	0	112.8	N844 V851	N844-N847 PolarHBondContact O-N 2.96Å; N847-V851 VanDerWaalsContact O-CG2 3.27Å; N847-V851 WeakPolarHBondContact O-CG2 3.44Å; N847-V851 PolarHBondContact O-N 2.72Å
848	G	39.5	Very low	42.4	Very low	45 Å²	45	81.6 Å²	81.6	46%	0.464	45%	0.447	S	S	.	.	H	α-helix	trans	-63.4	-41.5	177.7	0	0	0	0	0	112.9	F852	G848-F852 WeakPolarHBondContact O-CB 3.46Å; G848-F852 PolarHBondContact O-N 2.8Å
849	V	46	Very low	43.5	Very low	91 Å²	91	81.6 Å²	81.6	55%	0.552	44%	0.444	S	S	*	.	H	α-helix	trans	-65.4	-44	-179.1	-179.1	0	0	0	0	111.5	F852 I853	V849-F852 WeakPolarHBondContact O-CB 3.39Å; V849-F852 PolarHBondContact O-N 2.96Å; V849-I853 HydrophobicContact CG1-CD1 4.04Å; V849-I853 WeakPolarHBondContact O-CG1 3.48Å; V849-I853 PolarHBondContact O-N 2.83Å
850	L	44.8	Very low	44.8	Very low	37 Å²	37	77.9 Å²	77.9	19%	0.194	43%	0.428	C	S	.	.	H	α-helix	trans	-70.9	-37.5	-177.3	-122.4	146.7	0	0	0	111.6	F768 L771 F852 I853 L854	F768-L850 HydrophobicContact CD2-CD1 4.25Å; F768-L850 HydrophobicContact CE2-CD1 3.63Å; F768-L850 HydrophobicContact CZ-CD1 4.48Å; L771-L850 HydrophobicContact CB-CD2 4.42Å; L771-L850 HydrophobicContact CD2-CB 3.95Å; L771-L850 HydrophobicContact CD2-CD2 3.25Å; L771-L850 HydrophobicContact CD2-CG 4.18Å; L771-L850 HydrophobicContact CG-CD2 4.41Å; L850-F852 VanDerWaalsContact C-N 3.33Å; L850-I853 PolarHBondContact O-N 3.21Å; L850-L854 PolarHBondContact O-N 3.28Å
851	V	47.4	Very low	46	Very low	42 Å²	42	70.1 Å²	70.1	26%	0.255	39%	0.393	S	S	.	.	H	α-helix	trans	-63.8	-40	169.9	172.3	0	0	0	0	111	L771 N847 L854 I855	L771-V851 HydrophobicContact CD1-CG2 4.23Å; N847-V851 VanDerWaalsContact O-CG2 3.27Å; N847-V851 WeakPolarHBondContact O-CG2 3.44Å; N847-V851 PolarHBondContact O-N 2.72Å; V851-L854 PolarHBondContact O-N 2.85Å; V851-I855 HydrophobicContact CG1-CD1 3.71Å; V851-I855 HydrophobicContact CG1-CG1 4.4Å; V851-I855 WeakPolarHBondContact O-CD1 3.38Å; V851-I855 WeakPolarHBondContact O-CG1 3.43Å; V851-I855 PolarHBondContact O-N 2.81Å
852	F	48.4	Very low	47.2	Very low	122 Å²	122	64.8 Å²	64.8	54%	0.535	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-45.8	175.5	178.1	-95.6	0	0	0	112.1	G848 V849 L850 L854 I855 S856	G848-F852 WeakPolarHBondContact O-CB 3.46Å; G848-F852 PolarHBondContact O-N 2.8Å; V849-F852 WeakPolarHBondContact O-CB 3.39Å; V849-F852 PolarHBondContact O-N 2.96Å; L850-F852 VanDerWaalsContact C-N 3.33Å; F852-L854 VanDerWaalsContact C-N 3.32Å; F852-L854 PolarHBondContact O-N 2.86Å; F852-I855 PolarHBondContact O-N 3.5Å; F852-S856 VanDerWaalsContact O-CB 3.31Å; F852-S856 WeakPolarHBondContact O-CB 3.17Å; F852-S856 PolarHBondContact O-N 2.82Å; F852-S856 PolarHBondContact O-OG 3.26Å
853	I	53.4	Low	48.4	Very low	75 Å²	75	62 Å²	62	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-58.5	-45.7	176	-68.8	166.4	0	0	0	110.3	L775 V849 L850 S856 M857	L775-I853 HydrophobicContact CD1-CG2 4.17Å; V849-I853 HydrophobicContact CG1-CD1 4.04Å; V849-I853 WeakPolarHBondContact O-CG1 3.48Å; V849-I853 PolarHBondContact O-N 2.83Å; L850-I853 PolarHBondContact O-N 3.21Å; I853-S856 PolarHBondContact O-N 3.24Å; I853-M857 HydrophobicContact CG2-CG 4.28Å; I853-M857 WeakPolarHBondContact O-CB 3.43Å; I853-M857 VanDerWaalsContact O-CG 3.24Å; I853-M857 WeakPolarHBondContact O-CG 3.29Å; I853-M857 PolarHBondContact O-N 3.46Å
854	L	50.4	Low	49.6	Very low	17 Å²	17	59.4 Å²	59.4	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-62.5	-45.1	178.9	-169.9	75.3	0	0	0	112.1	L850 V851 F852 M857 V858	L850-L854 PolarHBondContact O-N 3.28Å; V851-L854 PolarHBondContact O-N 2.85Å; F852-L854 VanDerWaalsContact C-N 3.32Å; F852-L854 PolarHBondContact O-N 2.86Å; L854-M857 PolarHBondContact O-N 3.28Å; L854-V858 WeakPolarHBondContact O-CB 3.49Å; L854-V858 VanDerWaalsContact O-CG2 3.23Å; L854-V858 WeakPolarHBondContact O-CG2 3.23Å; L854-V858 PolarHBondContact O-N 3.34Å
855	I	51.1	Low	50.7	Low	41 Å²	41	54.6 Å²	54.6	21%	0.21	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-43.6	177.3	-67.9	166.2	0	0	0	110.5	V851 F852 V858 N859	V851-I855 HydrophobicContact CG1-CD1 3.71Å; V851-I855 HydrophobicContact CG1-CG1 4.4Å; V851-I855 WeakPolarHBondContact O-CD1 3.38Å; V851-I855 WeakPolarHBondContact O-CG1 3.43Å; V851-I855 PolarHBondContact O-N 2.81Å; F852-I855 PolarHBondContact O-N 3.5Å; I855-V858 PolarHBondContact O-N 3.45Å; I855-N859 WeakPolarHBondContact O-CB 3.46Å; I855-N859 VanDerWaalsContact O-CG 3.29Å; I855-N859 PolarHBondContact O-N 3.08Å; I855-N859 PolarHBondContact O-ND2 3.18Å
856	S	50.9	Low	51.5	Low	39 Å²	39	48.9 Å²	48.9	27%	0.273	28%	0.281	S	S	.	.	H	α-helix	trans	-61.5	-47.7	177.8	-67.7	0	0	0	0	111.4	F852 I853 V858 N859 V860	F852-S856 VanDerWaalsContact O-CB 3.31Å; F852-S856 WeakPolarHBondContact O-CB 3.17Å; F852-S856 PolarHBondContact O-N 2.82Å; F852-S856 PolarHBondContact O-OG 3.26Å; I853-S856 PolarHBondContact O-N 3.24Å; S856-V858 VanDerWaalsContact C-N 3.34Å; S856-V858 PolarHBondContact O-N 2.87Å; S856-N859 PolarHBondContact O-N 2.73Å; S856-V860 WeakPolarHBondContact O-CG2 3.28Å; S856-V860 PolarHBondContact O-N 3.04Å
857	M	53.3	Low	52.5	Low	63 Å²	63	49 Å²	49	31%	0.31	27%	0.274	S	S	.	.	H	α-helix	trans	-61.2	-41.3	177.2	-70.6	-69.2	-74.6	0	0	112.1	L778 L782 I853 L854 V860 C861	L778-M857 HydrophobicContact CD2-CB 3.63Å; L778-M857 HydrophobicContact CD2-CE 4.17Å; L778-M857 HydrophobicContact CD2-CG 4.3Å; L782-M857 HydrophobicContact CD1-CE 3.45Å; L782-M857 VanDerWaalsContact CD1-CE 3.45Å; I853-M857 HydrophobicContact CG2-CG 4.28Å; I853-M857 WeakPolarHBondContact O-CB 3.43Å; I853-M857 VanDerWaalsContact O-CG 3.24Å; I853-M857 WeakPolarHBondContact O-CG 3.29Å; I853-M857 PolarHBondContact O-N 3.46Å; L854-M857 PolarHBondContact O-N 3.28Å; M857-V860 PolarHBondContact O-N 3.5Å; M857-C861 PolarHBondContact O-N 2.91Å; M857-C861 PolarHBondContact O-SG 3.22Å
858	V	54.2	Low	53.1	Low	6 Å²	6	47 Å²	47	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-63	-44.1	175.6	167	0	0	0	0	111.4	A819 V823 L854 I855 S856 V860 C861 I862	A819-V858 HydrophobicContact CB-CG1 4.24Å; V823-V858 HydrophobicContact CG2-CB 4.15Å; V823-V858 HydrophobicContact CG2-CG1 3.84Å; V823-V858 HydrophobicContact CG2-CG2 3.54Å; L854-V858 WeakPolarHBondContact O-CB 3.49Å; L854-V858 VanDerWaalsContact O-CG2 3.23Å; L854-V858 WeakPolarHBondContact O-CG2 3.23Å; L854-V858 PolarHBondContact O-N 3.34Å; I855-V858 PolarHBondContact O-N 3.45Å; S856-V858 VanDerWaalsContact C-N 3.34Å; S856-V858 PolarHBondContact O-N 2.87Å; V858-V860 VanDerWaalsContact C-N 3.34Å; V858-V860 PolarHBondContact O-N 3.03Å; V858-C861 PolarHBondContact O-N 3.37Å; V858-I862 HydrophobicContact CG1-CD1 3.85Å; V858-I862 HydrophobicContact CG1-CG1 4.48Å; V858-I862 VanDerWaalsContact O-CG1 3.27Å; V858-I862 WeakPolarHBondContact O-CG1 3.41Å; V858-I862 PolarHBondContact O-N 3.42Å
859	N	53.2	Low	54	Low	37 Å²	37	45.2 Å²	45.2	20%	0.198	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-40.6	176.5	-72.3	-20.6	0	0	0	111.5	I855 S856 I862 I863	I855-N859 WeakPolarHBondContact O-CB 3.46Å; I855-N859 VanDerWaalsContact O-CG 3.29Å; I855-N859 PolarHBondContact O-N 3.08Å; I855-N859 PolarHBondContact O-ND2 3.18Å; S856-N859 PolarHBondContact O-N 2.73Å; N859-I862 PolarHBondContact O-N 3.03Å; N859-I863 WeakPolarHBondContact O-CB 3.33Å; N859-I863 VanDerWaalsContact O-CG1 3.23Å; N859-I863 WeakPolarHBondContact O-CG1 3.45Å; N859-I863 PolarHBondContact O-N 3.06Å
860	V	58.7	Low	54.5	Low	86 Å²	86	45.6 Å²	45.6	52%	0.521	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-45.8	173.6	175	0	0	0	0	110.7	S856 M857 V858 I862 I863 L864	S856-V860 WeakPolarHBondContact O-CG2 3.28Å; S856-V860 PolarHBondContact O-N 3.04Å; M857-V860 PolarHBondContact O-N 3.5Å; V858-V860 VanDerWaalsContact C-N 3.34Å; V858-V860 PolarHBondContact O-N 3.03Å; V860-I862 VanDerWaalsContact C-N 3.31Å; V860-I862 PolarHBondContact O-N 3.13Å; V860-I863 PolarHBondContact O-N 3.4Å; V860-L864 VanDerWaalsContact O-CB 3.32Å; V860-L864 WeakPolarHBondContact O-CB 2.91Å; V860-L864 PolarHBondContact O-N 3.25Å
861	C	55.8	Low	55.3	Low	10 Å²	10	50 Å²	50	7%	0.068	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-41.1	176	-70	0	0	0	0	112.2	I815 A819 M857 V858 L864 S865	I815-C861 HydrophobicContact CG2-CB 3.86Å; I815-C861 WeakPolarHBondContact CG2-O 3.35Å; A819-C861 HydrophobicContact CB-CB 4.31Å; M857-C861 PolarHBondContact O-N 2.91Å; M857-C861 PolarHBondContact O-SG 3.22Å; V858-C861 PolarHBondContact O-N 3.37Å; C861-L864 PolarHBondContact O-N 3.05Å; C861-S865 WeakPolarHBondContact O-CB 3.46Å; C861-S865 PolarHBondContact O-N 2.87Å
862	I	56.4	Low	55.6	Low	4 Å²	4	50.4 Å²	50.4	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-48.4	176.3	-68.4	167	0	0	0	110.2	A819 V858 N859 V860 L864 S865 V866 A905 F909	A819-I862 HydrophobicContact CB-CG1 4.36Å; V858-I862 HydrophobicContact CG1-CD1 3.85Å; V858-I862 HydrophobicContact CG1-CG1 4.48Å; V858-I862 VanDerWaalsContact O-CG1 3.27Å; V858-I862 WeakPolarHBondContact O-CG1 3.41Å; V858-I862 PolarHBondContact O-N 3.42Å; N859-I862 PolarHBondContact O-N 3.03Å; V860-I862 VanDerWaalsContact C-N 3.31Å; V860-I862 PolarHBondContact O-N 3.13Å; I862-L864 VanDerWaalsContact C-N 3.32Å; I862-L864 PolarHBondContact O-N 3.25Å; I862-S865 PolarHBondContact O-N 3.34Å; I862-S865 PolarHBondContact O-OG 2.97Å; I862-V866 WeakPolarHBondContact O-CG2 3.47Å; I862-V866 PolarHBondContact O-N 2.63Å; I862-A905 HydrophobicContact CD1-CB 3.94Å; I862-A905 HydrophobicContact CG2-CB 3.79Å; I862-F909 HydrophobicContact CG2-CE2 4.35Å
863	I	58.2	Low	55.8	Low	79 Å²	79	46.3 Å²	46.3	41%	0.405	24%	0.239	S	C	.	.	H	α-helix	trans	-59.9	-44.4	177.5	-68.4	164.7	0	0	0	110.4	N859 V860 S865 V866 I867	N859-I863 WeakPolarHBondContact O-CB 3.33Å; N859-I863 VanDerWaalsContact O-CG1 3.23Å; N859-I863 WeakPolarHBondContact O-CG1 3.45Å; N859-I863 PolarHBondContact O-N 3.06Å; V860-I863 PolarHBondContact O-N 3.4Å; I863-S865 PolarHBondContact O-N 3.42Å; I863-V866 WeakPolarHBondContact O-CB 3.4Å; I863-V866 PolarHBondContact O-N 3.31Å; I863-V866 VanDerWaalsContact O-N 3.17Å; I863-I867 HydrophobicContact CG2-CD1 3.73Å; I863-I867 HydrophobicContact CG2-CG1 4.36Å; I863-I867 WeakPolarHBondContact O-CG1 3.49Å; I863-I867 PolarHBondContact O-N 3.25Å
864	L	59.4	Low	55.6	Low	76 Å²	76	44.9 Å²	44.9	40%	0.398	24%	0.235	S	C	.	.	H	α-helix	trans	-60.9	-43.6	176.6	-160	89.5	0	0	0	111.3	V860 C861 I862 V866 I867 L868	V860-L864 VanDerWaalsContact O-CB 3.32Å; V860-L864 WeakPolarHBondContact O-CB 2.91Å; V860-L864 PolarHBondContact O-N 3.25Å; C861-L864 PolarHBondContact O-N 3.05Å; I862-L864 VanDerWaalsContact C-N 3.32Å; I862-L864 PolarHBondContact O-N 3.25Å; L864-V866 PolarHBondContact O-N 2.94Å; L864-I867 PolarHBondContact O-N 3.22Å; L864-L868 HydrophobicContact CD2-CD1 4.11Å; L864-L868 HydrophobicContact CG-CD1 4.18Å; L864-L868 WeakPolarHBondContact O-CB 3.45Å; L864-L868 VanDerWaalsContact O-CG 3.26Å; L864-L868 WeakPolarHBondContact O-CG 3.44Å; L864-L868 PolarHBondContact O-N 2.83Å
865	S	58.6	Low	55.5	Low	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-36.1	176.8	77.3	0	0	0	0	112.3	C861 I862 I863 R869	C861-S865 WeakPolarHBondContact O-CB 3.46Å; C861-S865 PolarHBondContact O-N 2.87Å; I862-S865 PolarHBondContact O-N 3.34Å; I862-S865 PolarHBondContact O-OG 2.97Å; I863-S865 PolarHBondContact O-N 3.42Å; S865-R869 WeakPolarHBondContact O-CG 3.16Å; S865-R869 PolarHBondContact O-N 2.94Å; S865-R869 VanDerWaalsContact O-N 3.13Å
866	V	56.1	Low	55.1	Low	12 Å²	12	55.1 Å²	55.1	7%	0.073	29%	0.287	C	S	.	.	H	α-helix	trans	-71.1	-43.8	177.1	171.4	0	0	0	0	110.8	I862 I863 L864 R869 Y870 F909 L912	I862-V866 WeakPolarHBondContact O-CG2 3.47Å; I862-V866 PolarHBondContact O-N 2.63Å; I863-V866 WeakPolarHBondContact O-CB 3.4Å; I863-V866 PolarHBondContact O-N 3.31Å; I863-V866 VanDerWaalsContact O-N 3.17Å; L864-V866 PolarHBondContact O-N 2.94Å; V866-R869 PolarHBondContact O-N 2.91Å; V866-Y870 WeakPolarHBondContact O-CB 3.15Å; V866-Y870 PolarHBondContact O-N 3.27Å; V866-F909 HydrophobicContact CG2-CD1 4.3Å; V866-F909 HydrophobicContact CG2-CE1 3.7Å; V866-F909 HydrophobicContact CG2-CE2 4.05Å; V866-F909 HydrophobicContact CG2-CZ 3.55Å; V866-L912 HydrophobicContact CG1-CD1 3.41Å; V866-L912 VanDerWaalsContact CG1-CD1 3.41Å; V866-L912 HydrophobicContact CG1-CD2 4.09Å; V866-L912 HydrophobicContact CG1-CG 4.22Å
867	I	61.4	Low	54.7	Low	89 Å²	89	55 Å²	55	46%	0.456	29%	0.286	S	S	.	.	H	α-helix	trans	-63.4	-44.1	176.7	-67	167.6	0	0	0	110.8	I863 L864 R869 Y870 Q871	I863-I867 HydrophobicContact CG2-CD1 3.73Å; I863-I867 HydrophobicContact CG2-CG1 4.36Å; I863-I867 WeakPolarHBondContact O-CG1 3.49Å; I863-I867 PolarHBondContact O-N 3.25Å; L864-I867 PolarHBondContact O-N 3.22Å; I867-R869 PolarHBondContact O-N 2.69Å; I867-Y870 WeakPolarHBondContact O-CB 3.46Å; I867-Y870 PolarHBondContact O-N 3.23Å; I867-Y870 VanDerWaalsContact O-N 3.11Å; I867-Q871 WeakPolarHBondContact O-CB 3.36Å; I867-Q871 PolarHBondContact O-N 2.99Å
868	L	57.1	Low	54.2	Low	17 Å²	17	58.2 Å²	58.2	9%	0.089	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-42.9	178.1	-71.8	168.3	0	0	0	111.4	F811 I815 L864 Y870 Q871 F872	F811-L868 HydrophobicContact CD1-CD1 4.03Å; F811-L868 HydrophobicContact CE1-CD1 3.81Å; I815-L868 HydrophobicContact CD1-CD1 3.61Å; L864-L868 HydrophobicContact CD2-CD1 4.11Å; L864-L868 HydrophobicContact CG-CD1 4.18Å; L864-L868 WeakPolarHBondContact O-CB 3.45Å; L864-L868 VanDerWaalsContact O-CG 3.26Å; L864-L868 WeakPolarHBondContact O-CG 3.44Å; L864-L868 PolarHBondContact O-N 2.83Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; L868-Y870 PolarHBondContact O-N 3.09Å; L868-Q871 PolarHBondContact O-N 3.33Å; L868-F872 HydrophobicContact CD2-CD2 4.48Å; L868-F872 HydrophobicContact CD2-CE2 3.97Å; L868-F872 VanDerWaalsContact O-CD2 3.24Å; L868-F872 WeakPolarHBondContact O-CD2 3.16Å; L868-F872 PolarHBondContact O-N 3.23Å
869	R	58.6	Low	53.9	Low	7 Å²	7	60.4 Å²	60.4	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-62.6	-39	172.8	-73.9	-178.9	-171	-157.7	3.1	112.5	S812 S865 V866 I867 C873 I882 F883	S812-R869 WeakPolarHBondContact OG-CG 3.15Å; S812-R869 PolarHBondContact OG-NE 2.95Å; S865-R869 WeakPolarHBondContact O-CG 3.16Å; S865-R869 PolarHBondContact O-N 2.94Å; S865-R869 VanDerWaalsContact O-N 3.13Å; V866-R869 PolarHBondContact O-N 2.91Å; I867-R869 PolarHBondContact O-N 2.69Å; R869-C873 WeakPolarHBondContact O-CB 3.41Å; R869-C873 PolarHBondContact O-N 3.02Å; R869-I882 PolarHBondContact NH1-O 3.25Å; R869-F883 HydrophobicContact CB-CE1 4.14Å; R869-F883 HydrophobicContact CB-CZ 4.22Å
870	Y	58.1	Low	53.8	Low	98 Å²	98	61.3 Å²	61.3	38%	0.384	32%	0.323	S	S	.	.	H	α-helix	trans	-63.6	-45.1	178.7	-179.9	-100.7	0	0	0	111.9	V866 I867 L868 Y915 M916 I919	V866-Y870 WeakPolarHBondContact O-CB 3.15Å; V866-Y870 PolarHBondContact O-N 3.27Å; I867-Y870 WeakPolarHBondContact O-CB 3.46Å; I867-Y870 PolarHBondContact O-N 3.23Å; I867-Y870 VanDerWaalsContact O-N 3.11Å; L868-Y870 VanDerWaalsContact C-N 3.31Å; L868-Y870 PolarHBondContact O-N 3.09Å; Y870-Y915 HydrophobicContact CD2-CE1 4.46Å; Y870-Y915 HydrophobicContact CE2-CD1 4.04Å; Y870-Y915 AromaticContact CE2-CE1 3.49Å; Y870-Y915 HydrophobicContact CE2-CE1 3.49Å; Y870-Y915 VanDerWaalsContact CE2-CE1 3.49Å; Y870-Y915 AromaticContact CZ-CE1 3.8Å; Y870-Y915 PolarHBondContact OH-OH 3.01Å; Y870-M916 HydrophobicContact CD2-CE 3.45Å; Y870-M916 VanDerWaalsContact CD2-CE 3.45Å; Y870-M916 HydrophobicContact CE2-CE 3.92Å; Y870-I919 HydrophobicContact CE2-CD1 4.23Å
871	Q	60.3	Low	53.2	Low	130 Å²	130	62.5 Å²	62.5	61%	0.607	32%	0.323	S	S	*	.	H	α-helix	trans	-73.3	-29.3	-172.3	-168	171.5	0.3	0	0	113.3	I867 L868	I867-Q871 WeakPolarHBondContact O-CB 3.36Å; I867-Q871 PolarHBondContact O-N 2.99Å; L868-Q871 PolarHBondContact O-N 3.33Å
872	F	54.3	Low	52.9	Low	50 Å²	50	63.9 Å²	63.9	22%	0.219	33%	0.33	C	S	.	.	H	α-helix	trans	-108.9	-7.3	-172.2	-64.2	-68.9	0	0	0	114.8	C805 Y808 L868 P874	C805-F872 PolarHBondContact SG-O 2.61Å; Y808-F872 HydrophobicContact CD1-CD2 4.13Å; Y808-F872 HydrophobicContact CD1-CE2 4.2Å; Y808-F872 HydrophobicContact CD2-CB 4.43Å; Y808-F872 HydrophobicContact CD2-CD1 4.06Å; Y808-F872 HydrophobicContact CD2-CD2 4.34Å; Y808-F872 HydrophobicContact CD2-CE1 4.45Å; Y808-F872 HydrophobicContact CD2-CG 4.02Å; Y808-F872 HydrophobicContact CE1-CE2 4.22Å; Y808-F872 HydrophobicContact CE1-CZ 4.35Å; Y808-F872 HydrophobicContact CE2-CD1 4.16Å; Y808-F872 HydrophobicContact CE2-CE1 4.12Å; Y808-F872 HydrophobicContact CE2-CG 4.49Å; Y808-F872 HydrophobicContact CE2-CZ 4.44Å; Y808-F872 HydrophobicContact CG-CB 4.45Å; Y808-F872 HydrophobicContact CG-CD2 4.02Å; Y808-F872 HydrophobicContact CG-CE2 4.47Å; Y808-F872 HydrophobicContact CG-CG 4.08Å; L868-F872 HydrophobicContact CD2-CD2 4.48Å; L868-F872 HydrophobicContact CD2-CE2 3.97Å; L868-F872 VanDerWaalsContact O-CD2 3.24Å; L868-F872 WeakPolarHBondContact O-CD2 3.16Å; L868-F872 PolarHBondContact O-N 3.23Å; F872-P874 WeakPolarHBondContact O-CD 3.36Å
873	C	53	Low	52.7	Low	37 Å²	37	64.5 Å²	64.5	25%	0.25	33%	0.332	C	S	.	.	S	Bend	trans	-68.6	123.1	173.5	-152.1	0	0	0	0	109.6	R869 S875	R869-C873 WeakPolarHBondContact O-CB 3.41Å; R869-C873 PolarHBondContact O-N 3.02Å; C873-S875 PolarHBondContact O-N 2.87Å
874	P	49.8	Very low	52.4	Low	45 Å²	45	61.9 Å²	61.9	29%	0.292	32%	0.318	S	S	.	.			trans	-59.5	137.9	176.6	-16.1	28.4	0	0	0	109	C805 F872 F876 S877	C805-P874 VanDerWaalsContact SG-CD 3.57Å; F872-P874 WeakPolarHBondContact O-CD 3.36Å; P874-F876 PolarHBondContact O-N 2.99Å; P874-S877 PolarHBondContact O-N 3.15Å
875	S	47.6	Very low	51.9	Low	76 Å²	76	61.4 Å²	61.4	53%	0.531	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-2.9	172.7	47.3	0	0	0	0	114.2	C873 K925	C873-S875 PolarHBondContact O-N 2.87Å; S875-K925 PolarHBondContact O-NZ 2.91Å
876	F	41.5	Very low	51.4	Low	196 Å²	196	61.6 Å²	61.6	86%	0.86	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	-6.5	-168.6	-84.1	-79.8	0	0	0	116.6	P874	P874-F876 PolarHBondContact O-N 2.99Å
877	S	43.2	Very low	51.3	Low	36 Å²	36	62.2 Å²	62.2	25%	0.252	32%	0.318	S	S	.	.			trans	-112.7	141.1	-172.7	65.9	0	0	0	0	114.4	P874 E879	P874-S877 PolarHBondContact O-N 3.15Å; S877-E879 PolarHBondContact O-N 3.39Å
878	T	42.5	Very low	50.7	Low	132 Å²	132	60.4 Å²	60.4	81%	0.81	31%	0.309	S	S	*	.			trans	-62.5	19.5	-178.5	45.1	0	0	0	0	115.4	I880	T878-I880 PolarHBondContact O-N 3.47Å
879	E	48.5	Very low	50.2	Low	51 Å²	51	61.3 Å²	61.3	24%	0.238	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83	29.3	-171.1	-64.4	-172.5	-179.8	0	0	113.8	S877 E881 I882	S877-E879 PolarHBondContact O-N 3.39Å; E879-E881 PolarHBondContact O-N 3.47Å; E879-E881 VanDerWaalsContact O-N 3.13Å; E879-I882 HydrophobicContact CB-CD1 3.88Å; E879-I882 HydrophobicContact CB-CG1 4.22Å; E879-I882 HydrophobicContact CG-CD1 4.28Å; E879-I882 WeakPolarHBondContact O-CB 3.48Å; E879-I882 PolarHBondContact O-N 2.91Å; E879-I882 VanDerWaalsContact OE2-CD1 3.31Å; E879-I882 WeakPolarHBondContact OE2-CD1 3.32Å
880	I	49.9	Very low	49.6	Very low	57 Å²	57	63 Å²	63	29%	0.292	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-24.2	173.8	-60.1	176.5	0	0	0	110.4	T878 I882 F883 F884 A1046	T878-I880 PolarHBondContact O-N 3.47Å; I880-I882 PolarHBondContact O-N 3.27Å; I880-F883 PolarHBondContact O-N 2.89Å; I880-F883 VanDerWaalsContact O-N 3.08Å; I880-F884 HydrophobicContact CG2-CD2 4.3Å; I880-F884 HydrophobicContact CG2-CE2 3.85Å; I880-F884 WeakPolarHBondContact O-CD2 2.89Å; I880-A1046 HydrophobicContact CD1-CB 3.45Å; I880-A1046 VanDerWaalsContact CD1-CB 3.45Å; I880-A1046 HydrophobicContact CG2-CB 4.45Å
881	E	47	Very low	48.9	Very low	111 Å²	111	60.7 Å²	60.7	52%	0.519	32%	0.317	S	S	.	.	H	α-helix	trans	-53.1	-34.3	171.8	-61.4	-172.7	169.5	0	0	113	E879 F883 F884 L885	E879-E881 PolarHBondContact O-N 3.47Å; E879-E881 VanDerWaalsContact O-N 3.13Å; E881-F883 VanDerWaalsContact C-N 3.3Å; E881-F883 PolarHBondContact O-N 3.07Å; E881-F884 PolarHBondContact O-N 2.87Å; E881-L885 PolarHBondContact O-N 3.33Å
882	I	50	Low	47.8	Very low	39 Å²	39	60.8 Å²	60.8	20%	0.2	32%	0.316	C	S	.	.	H	α-helix	trans	-70.6	-28.1	-178.3	-57.3	-178.9	0	0	0	111.2	T809 R869 E879 I880 P886	T809-I882 HydrophobicContact CG2-CD1 3.92Å; R869-I882 PolarHBondContact NH1-O 3.25Å; E879-I882 HydrophobicContact CB-CD1 3.88Å; E879-I882 HydrophobicContact CB-CG1 4.22Å; E879-I882 HydrophobicContact CG-CD1 4.28Å; E879-I882 WeakPolarHBondContact O-CB 3.48Å; E879-I882 PolarHBondContact O-N 2.91Å; E879-I882 VanDerWaalsContact OE2-CD1 3.31Å; E879-I882 WeakPolarHBondContact OE2-CD1 3.32Å; I880-I882 PolarHBondContact O-N 3.27Å; I882-P886 WeakPolarHBondContact O-CD 3.31Å
883	F	52	Low	47.4	Very low	17 Å²	17	63.6 Å²	63.6	8%	0.075	33%	0.329	C	S	.	.	H	α-helix	trans	-76.8	-20.4	175.3	-71.4	-78	0	0	0	113.3	R869 I880 E881 P886 L912 M916	R869-F883 HydrophobicContact CB-CE1 4.14Å; R869-F883 HydrophobicContact CB-CZ 4.22Å; I880-F883 PolarHBondContact O-N 2.89Å; I880-F883 VanDerWaalsContact O-N 3.08Å; E881-F883 VanDerWaalsContact C-N 3.3Å; E881-F883 PolarHBondContact O-N 3.07Å; F883-P886 WeakPolarHBondContact O-CD 2.84Å; F883-L912 HydrophobicContact CD1-CD2 3.87Å; F883-L912 HydrophobicContact CE1-CD2 3.31Å; F883-L912 HydrophobicContact CZ-CD2 4.15Å; F883-M916 HydrophobicContact CE1-CE 4.42Å; F883-M916 HydrophobicContact CE2-CE 4.34Å; F883-M916 HydrophobicContact CZ-CE 3.8Å
884	F	51.1	Low	46.7	Very low	23 Å²	23	62.2 Å²	62.2	10%	0.101	32%	0.321	C	S	.	.	H	α-helix	trans	-82.6	-20.5	173.8	-76.6	-77.2	0	0	0	113.2	F145 I880 E881 W887 I888 L913 I1049	F145-F884 HydrophobicContact CZ-CB 4.28Å; F145-F884 HydrophobicContact CZ-CD1 4.5Å; F145-F884 HydrophobicContact CZ-CD2 4.14Å; F145-F884 HydrophobicContact CZ-CG 4.06Å; I880-F884 HydrophobicContact CG2-CD2 4.3Å; I880-F884 HydrophobicContact CG2-CE2 3.85Å; I880-F884 WeakPolarHBondContact O-CD2 2.89Å; E881-F884 PolarHBondContact O-N 2.87Å; F884-W887 WeakPolarHBondContact O-CA 3.09Å; F884-W887 VanDerWaalsContact O-CB 3.27Å; F884-W887 WeakPolarHBondContact O-CB 3.3Å; F884-W887 PolarHBondContact O-N 3.48Å; F884-I888 WeakPolarHBondContact O-CG1 3.15Å; F884-I888 PolarHBondContact O-N 3.09Å; F884-L913 HydrophobicContact CE1-CD1 4.24Å; F884-L913 HydrophobicContact CZ-CD1 4.08Å; F884-I1049 HydrophobicContact CE1-CG2 3.98Å; F884-I1049 HydrophobicContact CE2-CG2 3.91Å; F884-I1049 HydrophobicContact CZ-CB 4.41Å; F884-I1049 HydrophobicContact CZ-CG2 3.38Å
885	L	49.1	Very low	46.2	Very low	67 Å²	67	65.8 Å²	65.8	35%	0.351	33%	0.332	S	S	.	.	H	α-helix	trans	-60.2	-41.3	-178.5	-151	93.1	0	0	0	114.3	L813 E881 W887 I888 I889	L813-L885 HydrophobicContact CD1-CD2 4.1Å; L813-L885 HydrophobicContact CD2-CD2 3.33Å; L813-L885 HydrophobicContact CG-CD2 4.38Å; E881-L885 PolarHBondContact O-N 3.33Å; L885-W887 VanDerWaalsContact C-N 3.26Å; L885-W887 PolarHBondContact O-N 3.27Å; L885-I888 WeakPolarHBondContact O-CB 3.48Å; L885-I888 PolarHBondContact O-N 2.83Å; L885-I888 VanDerWaalsContact O-N 3.13Å; L885-I889 HydrophobicContact CD2-CD1 4.02Å; L885-I889 HydrophobicContact CG-CD1 4.32Å; L885-I889 VanDerWaalsContact O-CG1 3.3Å; L885-I889 WeakPolarHBondContact O-CG1 3.17Å; L885-I889 PolarHBondContact O-N 3.4Å
886	P	48.8	Very low	45.9	Very low	4 Å²	4	67.6 Å²	67.6	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-33.9	173.1	-24.8	35.5	0	0	0	113.1	F816 I882 F883 F890 F909	F816-P886 HydrophobicContact CE1-CB 4.22Å; F816-P886 HydrophobicContact CE2-CB 4.26Å; F816-P886 HydrophobicContact CZ-CB 3.9Å; I882-P886 WeakPolarHBondContact O-CD 3.31Å; F883-P886 WeakPolarHBondContact O-CD 2.84Å; P886-F890 WeakPolarHBondContact O-CB 2.67Å; P886-F890 PolarHBondContact O-N 3.21Å; P886-F909 HydrophobicContact CB-CD2 4.41Å; P886-F909 HydrophobicContact CB-CE1 4.16Å; P886-F909 HydrophobicContact CB-CE2 4.06Å; P886-F909 HydrophobicContact CB-CZ 3.92Å; P886-F909 HydrophobicContact CG-CD1 4.41Å; P886-F909 HydrophobicContact CG-CE1 3.78Å; P886-F909 HydrophobicContact CG-CE2 4.45Å; P886-F909 HydrophobicContact CG-CZ 3.81Å
887	W	54	Low	45.7	Very low	24 Å²	24	59.9 Å²	59.9	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-68.5	-39.9	173.5	-72.5	80.9	0	0	0	112	F884 L885 F890 T891 L906 T910 L966 Y1053	F884-W887 WeakPolarHBondContact O-CA 3.09Å; F884-W887 VanDerWaalsContact O-CB 3.27Å; F884-W887 WeakPolarHBondContact O-CB 3.3Å; F884-W887 PolarHBondContact O-N 3.48Å; L885-W887 VanDerWaalsContact C-N 3.26Å; L885-W887 PolarHBondContact O-N 3.27Å; W887-F890 PolarHBondContact O-N 3.02Å; W887-T891 WeakPolarHBondContact O-CB 3.39Å; W887-T891 WeakPolarHBondContact O-CG2 3.39Å; W887-T891 PolarHBondContact O-N 3.24Å; W887-T891 PolarHBondContact O-OG1 2.97Å; W887-L906 HydrophobicContact CD2-CD2 4.32Å; W887-L906 HydrophobicContact CE3-CD2 4.18Å; W887-L906 HydrophobicContact CZ3-CD2 4.25Å; W887-T910 HydrophobicContact CH2-CG2 3.37Å; W887-T910 HydrophobicContact CZ2-CG2 3.26Å; W887-L966 HydrophobicContact CH2-CD2 4.38Å; W887-L966 HydrophobicContact CZ3-CD2 4.18Å; W887-Y1053 AromaticContact CH2-CE1 3.79Å; W887-Y1053 HydrophobicContact CH2-CE1 3.79Å; W887-Y1053 AromaticContact CH2-CZ 3.82Å; W887-Y1053 VanDerWaalsContact CH2-OH 3.26Å; W887-Y1053 WeakPolarHBondContact CH2-OH 3.1Å; W887-Y1053 HydrophobicContact CZ2-CE1 4.37Å; W887-Y1053 AromaticContact CZ3-CE1 3.93Å; W887-Y1053 HydrophobicContact CZ3-CE1 3.93Å; W887-Y1053 HydrophobicContact CZ3-CE2 4.49Å; W887-Y1053 AromaticContact CZ3-CZ 3.51Å; W887-Y1053 WeakPolarHBondContact CZ3-OH 3.08Å
888	I	47.6	Very low	45.7	Very low	52 Å²	52	63 Å²	63	27%	0.267	31%	0.31	S	S	.	.	H	α-helix	trans	-63.3	-47.5	174.6	-67	169.1	0	0	0	110	F884 L885 F890 T891 F892	F884-I888 WeakPolarHBondContact O-CG1 3.15Å; F884-I888 PolarHBondContact O-N 3.09Å; L885-I888 WeakPolarHBondContact O-CB 3.48Å; L885-I888 PolarHBondContact O-N 2.83Å; L885-I888 VanDerWaalsContact O-N 3.13Å; I888-F890 VanDerWaalsContact C-N 3.33Å; I888-F890 PolarHBondContact O-N 3.05Å; I888-T891 WeakPolarHBondContact CA-OG1 3Å; I888-T891 PolarHBondContact O-N 2.66Å; I888-T891 PolarHBondContact O-OG1 2.98Å; I888-F892 HydrophobicContact CG2-CD2 3.55Å; I888-F892 HydrophobicContact CG2-CE2 3.34Å; I888-F892 WeakPolarHBondContact O-CD2 3.49Å; I888-F892 PolarHBondContact O-N 2.98Å
889	I	46.8	Very low	45.9	Very low	36 Å²	36	58.7 Å²	58.7	19%	0.185	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-40.9	177.6	-64.9	164.3	0	0	0	110.9	F816 L885 F892 H893	F816-I889 HydrophobicContact CD1-CD1 4.24Å; F816-I889 HydrophobicContact CE1-CB 4.27Å; F816-I889 HydrophobicContact CE1-CD1 4.06Å; F816-I889 HydrophobicContact CE1-CG2 4.06Å; L885-I889 HydrophobicContact CD2-CD1 4.02Å; L885-I889 HydrophobicContact CG-CD1 4.32Å; L885-I889 VanDerWaalsContact O-CG1 3.3Å; L885-I889 WeakPolarHBondContact O-CG1 3.17Å; L885-I889 PolarHBondContact O-N 3.4Å; I889-F892 PolarHBondContact O-N 3.4Å; I889-H893 PolarHBondContact O-CD2 3.29Å; I889-H893 PolarHBondContact O-N 3.37Å; I889-H893 VanDerWaalsContact O-N 3.12Å
890	F	46.4	Very low	45.9	Very low	41 Å²	41	60.9 Å²	60.9	18%	0.18	29%	0.286	C	S	.	.	H	α-helix	trans	-68.1	-39.7	177.6	-169.4	-102.9	0	0	0	112.9	P886 W887 I888 F892 H893 G894 H902 L906	P886-F890 WeakPolarHBondContact O-CB 2.67Å; P886-F890 PolarHBondContact O-N 3.21Å; W887-F890 PolarHBondContact O-N 3.02Å; I888-F890 VanDerWaalsContact C-N 3.33Å; I888-F890 PolarHBondContact O-N 3.05Å; F890-F892 VanDerWaalsContact C-N 3.35Å; F890-H893 PolarHBondContact O-N 3.4Å; F890-G894 WeakPolarHBondContact O-CA 3.23Å; F890-G894 PolarHBondContact O-N 3.2Å; F890-H902 HydrophobicContact CD2-CB 4.38Å; F890-H902 HydrophobicContact CE2-CB 3.52Å; F890-H902 AromaticContact CE2-CG 3.98Å; F890-H902 HydrophobicContact CZ-CB 4.19Å; F890-L906 HydrophobicContact CB-CD2 4.45Å; F890-L906 HydrophobicContact CD1-CD1 3.5Å; F890-L906 VanDerWaalsContact CD1-CD1 3.5Å; F890-L906 HydrophobicContact CD1-CD2 3.93Å; F890-L906 HydrophobicContact CD1-CG 4.34Å; F890-L906 HydrophobicContact CD2-CD1 3.61Å; F890-L906 HydrophobicContact CE1-CD1 3.3Å; F890-L906 HydrophobicContact CE1-CD2 4.4Å; F890-L906 HydrophobicContact CE1-CG 4.49Å; F890-L906 HydrophobicContact CE2-CD1 3.43Å; F890-L906 VanDerWaalsContact CE2-CD1 3.43Å; F890-L906 HydrophobicContact CG-CD1 3.64Å; F890-L906 HydrophobicContact CG-CD2 4.15Å; F890-L906 HydrophobicContact CG-CG 4.38Å; F890-L906 HydrophobicContact CZ-CD1 3.26Å
891	T	43.8	Very low	45.9	Very low	50 Å²	50	61.4 Å²	61.4	31%	0.307	28%	0.284	S	S	.	.	H	α-helix	trans	-68.4	-32.6	176.8	48.5	0	0	0	0	112.5	W152 W887 I888	W152-T891 PolarHBondContact NE1-O 3.33Å; W887-T891 WeakPolarHBondContact O-CB 3.39Å; W887-T891 WeakPolarHBondContact O-CG2 3.39Å; W887-T891 PolarHBondContact O-N 3.24Å; W887-T891 PolarHBondContact O-OG1 2.97Å; I888-T891 WeakPolarHBondContact CA-OG1 3Å; I888-T891 PolarHBondContact O-N 2.66Å; I888-T891 PolarHBondContact O-OG1 2.98Å
892	F	38	Very low	46.1	Very low	133 Å²	133	56.6 Å²	56.6	58%	0.583	26%	0.261	S	S	*	.	H	α-helix	trans	-67.6	-37.8	171.7	-84.3	-62.5	0	0	0	113.3	V148 I888 I889 F890	V148-F892 HydrophobicContact CB-CZ 4.37Å; V148-F892 HydrophobicContact CG1-CE1 3.89Å; V148-F892 HydrophobicContact CG1-CE2 3.9Å; V148-F892 HydrophobicContact CG1-CZ 3.34Å; V148-F892 HydrophobicContact CG2-CZ 4.07Å; I888-F892 HydrophobicContact CG2-CD2 3.55Å; I888-F892 HydrophobicContact CG2-CE2 3.34Å; I888-F892 WeakPolarHBondContact O-CD2 3.49Å; I888-F892 PolarHBondContact O-N 2.98Å; I889-F892 PolarHBondContact O-N 3.4Å; F890-F892 VanDerWaalsContact C-N 3.35Å
893	H	45.3	Very low	46.3	Very low	108 Å²	108	56 Å²	56	50%	0.5	26%	0.26	S	S	.	.	H	α-helix	trans	-87.3	-4.6	179	-78.5	-65.4	0	0	0	114.7	I889 F890 K895 Q896 L897	I889-H893 PolarHBondContact O-CD2 3.29Å; I889-H893 PolarHBondContact O-N 3.37Å; I889-H893 VanDerWaalsContact O-N 3.12Å; F890-H893 PolarHBondContact O-N 3.4Å; H893-K895 VanDerWaalsContact C-N 3.26Å; H893-K895 PolarHBondContact O-N 3.05Å; H893-Q896 PolarHBondContact O-N 3.32Å; H893-L897 HydrophobicContact CB-CD1 4.33Å
894	G	38.6	Very low	46.4	Very low	8 Å²	8	59.6 Å²	59.6	8%	0.082	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	29.9	-162.6	0	0	0	0	0	118.8	R156 F890 R899	R156-G894 PolarHBondContact NH2-O 3.47Å; F890-G894 WeakPolarHBondContact O-CA 3.23Å; F890-G894 PolarHBondContact O-N 3.2Å; G894-R899 VanDerWaalsContact O-CZ 3.27Å; G894-R899 PolarHBondContact O-NE 2.84Å; G894-R899 PolarHBondContact O-NH2 3.16Å
895	K	39.3	Very low	46.6	Very low	120 Å²	120	58.9 Å²	58.9	52%	0.522	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.1	-3.8	165.4	-89.8	-172.3	-178.9	179.4	0	114.7	H893	H893-K895 VanDerWaalsContact C-N 3.26Å; H893-K895 PolarHBondContact O-N 3.05Å
896	Q	40.8	Very low	47	Very low	114 Å²	114	56.2 Å²	56.2	53%	0.533	26%	0.264	S	S	.	.	S	Bend	trans	-118.9	1.1	-164.3	-64.7	176.8	-4.9	0	0	114.8	H893	H893-Q896 PolarHBondContact O-N 3.32Å
897	L	36.4	Very low	47.5	Very low	35 Å²	35	57.5 Å²	57.5	18%	0.183	27%	0.271	C	S	.	.	S	Bend	trans	-120.8	138.1	-180	-67.2	168.1	0	0	0	109.8	G824 H893 R899	G824-L897 VanDerWaalsContact CA-CD2 3.41Å; G824-L897 WeakPolarHBondContact O-CD2 3.4Å; H893-L897 HydrophobicContact CB-CD1 4.33Å; L897-R899 WeakPolarHBondContact O-CG 3.28Å; L897-R899 PolarHBondContact O-N 2.99Å
898	H	43.3	Very low	47.8	Very low	102 Å²	102	58.3 Å²	58.3	47%	0.472	28%	0.28	S	S	.	.			trans	-60.2	108.4	170.4	-84.6	-95.2	0	0	0	109.1	Q827 Y900	Q827-H898 VanDerWaalsContact OE1-CB 3.26Å; Q827-H898 PolarHBondContact OE1-CD2 2.89Å; H898-Y900 VanDerWaalsContact C-N 3.35Å; H898-Y900 HydrophobicContact CB-CD1 4.02Å; H898-Y900 HydrophobicContact CB-CE1 3.71Å; H898-Y900 PolarHBondContact O-N 3.48Å
899	R	47	Very low	48.4	Very low	40 Å²	40	56.2 Å²	56.2	15%	0.151	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-79.7	-7	-156.5	-57.4	-177.1	-178	156.7	-4.4	115.7	G894 L897 R901 H902 Q969	G894-R899 VanDerWaalsContact O-CZ 3.27Å; G894-R899 PolarHBondContact O-NE 2.84Å; G894-R899 PolarHBondContact O-NH2 3.16Å; L897-R899 WeakPolarHBondContact O-CG 3.28Å; L897-R899 PolarHBondContact O-N 2.99Å; R899-R901 VanDerWaalsContact C-N 3.25Å; R899-R901 PolarHBondContact O-N 3.05Å; R899-H902 PolarHBondContact O-N 3.11Å; R899-Q969 WeakPolarHBondContact CD-O 3.35Å; R899-Q969 PolarHBondContact NE-O 3.03Å; R899-Q969 PolarHBondContact NH1-O 3.44Å
900	Y	49.4	Very low	49	Very low	98 Å²	98	55.2 Å²	55.2	38%	0.384	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-63.6	-29.1	-178.3	64.9	-92.3	0	0	0	113.4	H898 H902	H898-Y900 VanDerWaalsContact C-N 3.35Å; H898-Y900 HydrophobicContact CB-CD1 4.02Å; H898-Y900 HydrophobicContact CB-CE1 3.71Å; H898-Y900 PolarHBondContact O-N 3.48Å; Y900-H902 VanDerWaalsContact C-N 3.33Å; Y900-H902 PolarHBondContact O-N 3.15Å
901	R	49	Very low	49.9	Very low	67 Å²	67	58.7 Å²	58.7	25%	0.253	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-75.9	-16.7	-173.9	-61.6	-172.7	179.8	-172.5	-4.2	114.5	R899	R899-R901 VanDerWaalsContact C-N 3.25Å; R899-R901 PolarHBondContact O-N 3.05Å
902	H	52.5	Low	50.7	Low	10 Å²	10	57.6 Å²	57.6	5%	0.046	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-103.2	-5.8	-173	-59.9	-66.3	0	0	0	113.9	Q820 F890 R899 Y900 L904 A905 L906	Q820-H902 PolarHBondContact OE1-CE1 2.84Å; Q820-H902 VanDerWaalsContact OE1-CE1 3.3Å; F890-H902 HydrophobicContact CD2-CB 4.38Å; F890-H902 HydrophobicContact CE2-CB 3.52Å; F890-H902 AromaticContact CE2-CG 3.98Å; F890-H902 HydrophobicContact CZ-CB 4.19Å; R899-H902 PolarHBondContact O-N 3.11Å; Y900-H902 VanDerWaalsContact C-N 3.33Å; Y900-H902 PolarHBondContact O-N 3.15Å; H902-L904 VanDerWaalsContact C-N 3.34Å; H902-L904 PolarHBondContact O-N 3.29Å; H902-A905 PolarHBondContact O-N 3.34Å; H902-L906 HydrophobicContact CB-CD1 4.33Å; H902-L906 WeakPolarHBondContact O-CD1 3.14Å; H902-L906 PolarHBondContact O-N 3Å; H902-L906 VanDerWaalsContact O-N 3.09Å
903	V	53.5	Low	51.7	Low	27 Å²	27	52.2 Å²	52.2	16%	0.164	25%	0.254	C	S	.	.	H	α-helix	trans	-61.8	-42.8	-177.9	177.8	0	0	0	0	111.4	A905 L906 T907 S970 I972	V903-A905 PolarHBondContact O-N 3.39Å; V903-L906 PolarHBondContact O-N 2.61Å; V903-T907 HydrophobicContact CG1-CG2 4.09Å; V903-T907 WeakPolarHBondContact O-CB 3.03Å; V903-T907 VanDerWaalsContact O-CG2 3.31Å; V903-T907 WeakPolarHBondContact O-CG2 3.25Å; V903-T907 PolarHBondContact O-N 2.76Å; V903-T907 PolarHBondContact O-OG1 3.4Å; V903-T907 VanDerWaalsContact O-OG1 3.06Å; V903-S970 WeakPolarHBondContact CG2-OG 3.23Å; V903-I972 HydrophobicContact CB-CD1 4.1Å; V903-I972 HydrophobicContact CG1-CD1 4.4Å; V903-I972 HydrophobicContact CG2-CD1 3.5Å; V903-I972 VanDerWaalsContact CG2-CD1 3.5Å
904	L	54.1	Low	52.5	Low	93 Å²	93	48.8 Å²	48.8	49%	0.487	24%	0.24	S	C	.	.	H	α-helix	trans	-58	-47.8	178	-172	71.6	0	0	0	111.6	H902 L906 T907 C908	H902-L904 VanDerWaalsContact C-N 3.34Å; H902-L904 PolarHBondContact O-N 3.29Å; L904-L906 PolarHBondContact O-N 3.18Å; L904-T907 VanDerWaalsContact C-OG1 3.32Å; L904-T907 VanDerWaalsContact CA-OG1 3.27Å; L904-T907 WeakPolarHBondContact CA-OG1 3.36Å; L904-T907 PolarHBondContact O-N 2.86Å; L904-T907 PolarHBondContact O-OG1 3.41Å; L904-C908 PolarHBondContact O-N 2.78Å; L904-C908 PolarHBondContact O-SG 2.96Å
905	A	54.3	Low	53.7	Low	8 Å²	8	53.2 Å²	53.2	7%	0.066	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-47.1	178.5	0	0	0	0	0	112	I862 H902 V903 C908 F909	I862-A905 HydrophobicContact CD1-CB 3.94Å; I862-A905 HydrophobicContact CG2-CB 3.79Å; H902-A905 PolarHBondContact O-N 3.34Å; V903-A905 PolarHBondContact O-N 3.39Å; A905-C908 WeakPolarHBondContact O-CB 3.47Å; A905-C908 PolarHBondContact O-N 3.06Å; A905-F909 WeakPolarHBondContact O-CD2 3.41Å; A905-F909 PolarHBondContact O-N 2.8Å
906	L	57.4	Low	54.6	Low	11 Å²	11	48.9 Å²	48.9	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-67	-36.7	177.7	-83	137.7	0	0	0	112.8	W887 F890 H902 V903 L904 C908 F909 T910 L966	W887-L906 HydrophobicContact CD2-CD2 4.32Å; W887-L906 HydrophobicContact CE3-CD2 4.18Å; W887-L906 HydrophobicContact CZ3-CD2 4.25Å; F890-L906 HydrophobicContact CB-CD2 4.45Å; F890-L906 HydrophobicContact CD1-CD1 3.5Å; F890-L906 VanDerWaalsContact CD1-CD1 3.5Å; F890-L906 HydrophobicContact CD1-CD2 3.93Å; F890-L906 HydrophobicContact CD1-CG 4.34Å; F890-L906 HydrophobicContact CD2-CD1 3.61Å; F890-L906 HydrophobicContact CE1-CD1 3.3Å; F890-L906 HydrophobicContact CE1-CD2 4.4Å; F890-L906 HydrophobicContact CE1-CG 4.49Å; F890-L906 HydrophobicContact CE2-CD1 3.43Å; F890-L906 VanDerWaalsContact CE2-CD1 3.43Å; F890-L906 HydrophobicContact CG-CD1 3.64Å; F890-L906 HydrophobicContact CG-CD2 4.15Å; F890-L906 HydrophobicContact CG-CG 4.38Å; F890-L906 HydrophobicContact CZ-CD1 3.26Å; H902-L906 HydrophobicContact CB-CD1 4.33Å; H902-L906 WeakPolarHBondContact O-CD1 3.14Å; H902-L906 PolarHBondContact O-N 3Å; H902-L906 VanDerWaalsContact O-N 3.09Å; V903-L906 PolarHBondContact O-N 2.61Å; L904-L906 PolarHBondContact O-N 3.18Å; L906-C908 VanDerWaalsContact C-N 3.32Å; L906-F909 PolarHBondContact O-N 3.32Å; L906-T910 PolarHBondContact O-N 2.81Å; L906-T910 PolarHBondContact O-OG1 3.32Å; L906-L966 HydrophobicContact CB-CD1 3.96Å; L906-L966 HydrophobicContact CB-CD2 3.82Å; L906-L966 HydrophobicContact CD1-CD2 4.26Å; L906-L966 HydrophobicContact CD2-CD2 3.76Å; L906-L966 HydrophobicContact CG-CD2 4.16Å
907	T	60	Low	55.3	Low	30 Å²	30	44.4 Å²	44.4	18%	0.184	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-36.9	173.4	53.7	0	0	0	0	111.6	V903 L904 T910 I911 L966	V903-T907 HydrophobicContact CG1-CG2 4.09Å; V903-T907 WeakPolarHBondContact O-CB 3.03Å; V903-T907 VanDerWaalsContact O-CG2 3.31Å; V903-T907 WeakPolarHBondContact O-CG2 3.25Å; V903-T907 PolarHBondContact O-N 2.76Å; V903-T907 PolarHBondContact O-OG1 3.4Å; V903-T907 VanDerWaalsContact O-OG1 3.06Å; L904-T907 VanDerWaalsContact C-OG1 3.32Å; L904-T907 VanDerWaalsContact CA-OG1 3.27Å; L904-T907 WeakPolarHBondContact CA-OG1 3.36Å; L904-T907 PolarHBondContact O-N 2.86Å; L904-T907 PolarHBondContact O-OG1 3.41Å; T907-T910 VanDerWaalsContact CA-OG1 3.28Å; T907-T910 WeakPolarHBondContact CA-OG1 3.46Å; T907-T910 PolarHBondContact O-N 3.39Å; T907-T910 PolarHBondContact O-OG1 3.43Å; T907-I911 WeakPolarHBondContact O-CB 3.09Å; T907-I911 WeakPolarHBondContact O-CD1 3.13Å; T907-I911 WeakPolarHBondContact O-CG1 3.31Å; T907-I911 PolarHBondContact O-N 3.16Å; T907-L966 HydrophobicContact CG2-CD1 4.35Å
908	C	60.8	Low	56.6	Low	41 Å²	41	46.6 Å²	46.6	28%	0.277	23%	0.225	S	C	.	.	H	α-helix	trans	-64.7	-41.6	172.5	-68.1	0	0	0	0	111.1	L904 A905 L906 I911 L912	L904-C908 PolarHBondContact O-N 2.78Å; L904-C908 PolarHBondContact O-SG 2.96Å; A905-C908 WeakPolarHBondContact O-CB 3.47Å; A905-C908 PolarHBondContact O-N 3.06Å; L906-C908 VanDerWaalsContact C-N 3.32Å; C908-I911 PolarHBondContact O-N 2.83Å; C908-L912 WeakPolarHBondContact O-CB 3.11Å; C908-L912 PolarHBondContact O-N 3.1Å
909	F	59.1	Low	57.4	Low	8 Å²	8	43.6 Å²	43.6	4%	0.035	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-39.4	175.7	-82.1	-70.1	0	0	0	113.2	F816 I862 V866 P886 A905 L906 L912 L913	F816-F909 HydrophobicContact CD2-CE2 4.37Å; F816-F909 HydrophobicContact CD2-CZ 4.42Å; F816-F909 AromaticContact CE2-CE2 3.92Å; F816-F909 HydrophobicContact CE2-CE2 3.92Å; F816-F909 HydrophobicContact CE2-CZ 4.34Å; I862-F909 HydrophobicContact CG2-CE2 4.35Å; V866-F909 HydrophobicContact CG2-CD1 4.3Å; V866-F909 HydrophobicContact CG2-CE1 3.7Å; V866-F909 HydrophobicContact CG2-CE2 4.05Å; V866-F909 HydrophobicContact CG2-CZ 3.55Å; P886-F909 HydrophobicContact CB-CD2 4.41Å; P886-F909 HydrophobicContact CB-CE1 4.16Å; P886-F909 HydrophobicContact CB-CE2 4.06Å; P886-F909 HydrophobicContact CB-CZ 3.92Å; P886-F909 HydrophobicContact CG-CD1 4.41Å; P886-F909 HydrophobicContact CG-CE1 3.78Å; P886-F909 HydrophobicContact CG-CE2 4.45Å; P886-F909 HydrophobicContact CG-CZ 3.81Å; A905-F909 WeakPolarHBondContact O-CD2 3.41Å; A905-F909 PolarHBondContact O-N 2.8Å; L906-F909 PolarHBondContact O-N 3.32Å; F909-L912 PolarHBondContact O-N 3.43Å; F909-L913 VanDerWaalsContact O-CB 3.3Å; F909-L913 WeakPolarHBondContact O-CB 3.32Å; F909-L913 PolarHBondContact O-N 2.87Å
910	T	59.7	Low	57.7	Low	15 Å²	15	44.8 Å²	44.8	9%	0.092	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-45.6	173.5	48.1	0	0	0	0	110.9	W887 L906 T907 L912 L913 V914 H962 L966	W887-T910 HydrophobicContact CH2-CG2 3.37Å; W887-T910 HydrophobicContact CZ2-CG2 3.26Å; L906-T910 PolarHBondContact O-N 2.81Å; L906-T910 PolarHBondContact O-OG1 3.32Å; T907-T910 VanDerWaalsContact CA-OG1 3.28Å; T907-T910 WeakPolarHBondContact CA-OG1 3.46Å; T907-T910 PolarHBondContact O-N 3.39Å; T907-T910 PolarHBondContact O-OG1 3.43Å; T910-L912 VanDerWaalsContact C-N 3.32Å; T910-L912 PolarHBondContact O-N 3.18Å; T910-L913 PolarHBondContact O-N 2.84Å; T910-V914 VanDerWaalsContact O-CG2 3.24Å; T910-V914 WeakPolarHBondContact O-CG2 3.47Å; T910-V914 PolarHBondContact O-N 3.5Å; T910-H962 HydrophobicContact CG2-CB 4.48Å; T910-L966 HydrophobicContact CG2-CD1 3.75Å
911	I	64.8	Low	57.9	Low	115 Å²	115	40.6 Å²	40.6	59%	0.59	21%	0.205	S	C	*	.	H	α-helix	trans	-60.9	-43.7	177.6	-68.9	164.6	0	0	0	110.3	T907 C908 L913 V914 Y915	T907-I911 WeakPolarHBondContact O-CB 3.09Å; T907-I911 WeakPolarHBondContact O-CD1 3.13Å; T907-I911 WeakPolarHBondContact O-CG1 3.31Å; T907-I911 PolarHBondContact O-N 3.16Å; C908-I911 PolarHBondContact O-N 2.83Å; I911-L913 VanDerWaalsContact C-N 3.34Å; I911-L913 PolarHBondContact O-N 2.99Å; I911-V914 PolarHBondContact O-N 2.88Å; I911-Y915 WeakPolarHBondContact O-CB 3.3Å; I911-Y915 PolarHBondContact O-N 3.5Å
912	L	61.1	Low	58.1	Low	26 Å²	26	38.1 Å²	38.1	14%	0.136	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-37.2	178	-154.3	104.9	0	0	0	111.9	V866 F883 C908 F909 T910 Y915 M916	V866-L912 HydrophobicContact CG1-CD1 3.41Å; V866-L912 VanDerWaalsContact CG1-CD1 3.41Å; V866-L912 HydrophobicContact CG1-CD2 4.09Å; V866-L912 HydrophobicContact CG1-CG 4.22Å; F883-L912 HydrophobicContact CD1-CD2 3.87Å; F883-L912 HydrophobicContact CE1-CD2 3.31Å; F883-L912 HydrophobicContact CZ-CD2 4.15Å; C908-L912 WeakPolarHBondContact O-CB 3.11Å; C908-L912 PolarHBondContact O-N 3.1Å; F909-L912 PolarHBondContact O-N 3.43Å; T910-L912 VanDerWaalsContact C-N 3.32Å; T910-L912 PolarHBondContact O-N 3.18Å; L912-Y915 PolarHBondContact O-N 3.08Å; L912-M916 HydrophobicContact CD2-CE 4.14Å; L912-M916 WeakPolarHBondContact O-CB 3.17Å; L912-M916 VanDerWaalsContact O-CG 3.26Å; L912-M916 WeakPolarHBondContact O-CG 3.11Å; L912-M916 PolarHBondContact O-N 3.07Å
913	L	58.9	Low	58.4	Low	21 Å²	21	40.9 Å²	40.9	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-42.4	175.8	-170.2	140.6	0	0	0	111.2	F884 F909 T910 I911 Y915 M916 V917 F1050	F884-L913 HydrophobicContact CE1-CD1 4.24Å; F884-L913 HydrophobicContact CZ-CD1 4.08Å; F909-L913 VanDerWaalsContact O-CB 3.3Å; F909-L913 WeakPolarHBondContact O-CB 3.32Å; F909-L913 PolarHBondContact O-N 2.87Å; T910-L913 PolarHBondContact O-N 2.84Å; I911-L913 VanDerWaalsContact C-N 3.34Å; I911-L913 PolarHBondContact O-N 2.99Å; L913-Y915 VanDerWaalsContact C-N 3.32Å; L913-Y915 PolarHBondContact O-N 3.44Å; L913-M916 PolarHBondContact O-N 3.47Å; L913-V917 HydrophobicContact CD2-CG2 4.35Å; L913-V917 VanDerWaalsContact O-CG2 3.3Å; L913-V917 WeakPolarHBondContact O-CG2 3.35Å; L913-V917 PolarHBondContact O-N 3.37Å; L913-F1050 HydrophobicContact CD2-CD2 3.61Å; L913-F1050 HydrophobicContact CD2-CE2 4.05Å
914	V	62.9	Low	58.5	Low	35 Å²	35	43 Å²	43	21%	0.212	23%	0.225	C	C	.	.	H	α-helix	trans	-61.8	-41.7	173	173.4	0	0	0	0	110.7	T910 I911 V917 F918 C959	T910-V914 VanDerWaalsContact O-CG2 3.24Å; T910-V914 WeakPolarHBondContact O-CG2 3.47Å; T910-V914 PolarHBondContact O-N 3.5Å; I911-V914 PolarHBondContact O-N 2.88Å; V914-V917 PolarHBondContact O-N 3.48Å; V914-F918 WeakPolarHBondContact O-CB 3.41Å; V914-F918 PolarHBondContact O-N 2.9Å; V914-C959 WeakPolarHBondContact CG2-SG 3.48Å
915	Y	63.7	Low	58.3	Low	102 Å²	102	42.4 Å²	42.4	40%	0.4	22%	0.218	S	C	.	.	H	α-helix	trans	-66	-37.4	176	-175.2	-109.2	0	0	0	112.6	Y870 I911 L912 L913 F918 I919	Y870-Y915 HydrophobicContact CD2-CE1 4.46Å; Y870-Y915 HydrophobicContact CE2-CD1 4.04Å; Y870-Y915 AromaticContact CE2-CE1 3.49Å; Y870-Y915 HydrophobicContact CE2-CE1 3.49Å; Y870-Y915 VanDerWaalsContact CE2-CE1 3.49Å; Y870-Y915 AromaticContact CZ-CE1 3.8Å; Y870-Y915 PolarHBondContact OH-OH 3.01Å; I911-Y915 WeakPolarHBondContact O-CB 3.3Å; I911-Y915 PolarHBondContact O-N 3.5Å; L912-Y915 PolarHBondContact O-N 3.08Å; L913-Y915 VanDerWaalsContact C-N 3.32Å; L913-Y915 PolarHBondContact O-N 3.44Å; Y915-F918 WeakPolarHBondContact O-CB 3.04Å; Y915-F918 PolarHBondContact O-N 3.32Å; Y915-I919 HydrophobicContact CD1-CD1 3.72Å; Y915-I919 HydrophobicContact CD1-CG1 4.48Å; Y915-I919 HydrophobicContact CE1-CD1 3.16Å; Y915-I919 HydrophobicContact CE1-CG1 4.12Å; Y915-I919 HydrophobicContact CE2-CD1 4.25Å; Y915-I919 HydrophobicContact CE2-CG1 4.42Å; Y915-I919 HydrophobicContact CG-CD1 4.48Å; Y915-I919 VanDerWaalsContact CZ-CD1 3.45Å; Y915-I919 PolarHBondContact O-N 2.83Å
916	M	56.8	Low	58	Low	28 Å²	28	45.5 Å²	45.5	14%	0.138	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-43.2	174.7	-73.9	-60.6	178.5	0	0	112	Y870 F883 L912 L913 F918 I919 H920	Y870-M916 HydrophobicContact CD2-CE 3.45Å; Y870-M916 VanDerWaalsContact CD2-CE 3.45Å; Y870-M916 HydrophobicContact CE2-CE 3.92Å; F883-M916 HydrophobicContact CE1-CE 4.42Å; F883-M916 HydrophobicContact CE2-CE 4.34Å; F883-M916 HydrophobicContact CZ-CE 3.8Å; L912-M916 HydrophobicContact CD2-CE 4.14Å; L912-M916 WeakPolarHBondContact O-CB 3.17Å; L912-M916 VanDerWaalsContact O-CG 3.26Å; L912-M916 WeakPolarHBondContact O-CG 3.11Å; L912-M916 PolarHBondContact O-N 3.07Å; L913-M916 PolarHBondContact O-N 3.47Å; M916-F918 PolarHBondContact O-N 3.2Å; M916-I919 PolarHBondContact O-N 3.38Å; M916-H920 WeakPolarHBondContact O-CB 3.16Å; M916-H920 PolarHBondContact O-N 3.44Å; M916-H920 PolarHBondContact O-ND1 2.81Å
917	V	57.4	Low	57.2	Low	20 Å²	20	54.3 Å²	54.3	12%	0.121	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-38.1	171.8	172.7	0	0	0	0	110.1	L913 V914 S921 T955	L913-V917 HydrophobicContact CD2-CG2 4.35Å; L913-V917 VanDerWaalsContact O-CG2 3.3Å; L913-V917 WeakPolarHBondContact O-CG2 3.35Å; L913-V917 PolarHBondContact O-N 3.37Å; V914-V917 PolarHBondContact O-N 3.48Å; V917-S921 WeakPolarHBondContact O-CB 3.17Å; V917-S921 PolarHBondContact O-N 3.48Å; V917-T955 HydrophobicContact CG1-CG2 4.15Å
918	F	62.7	Low	56.4	Low	81 Å²	81	56.8 Å²	56.8	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-66.2	-49.9	176.1	-178.6	-105.8	0	0	0	113.1	V914 Y915 M916 H920 S921 V924 F952	V914-F918 WeakPolarHBondContact O-CB 3.41Å; V914-F918 PolarHBondContact O-N 2.9Å; Y915-F918 WeakPolarHBondContact O-CB 3.04Å; Y915-F918 PolarHBondContact O-N 3.32Å; M916-F918 PolarHBondContact O-N 3.2Å; F918-H920 VanDerWaalsContact C-N 3.29Å; F918-H920 PolarHBondContact O-N 3.05Å; F918-S921 VanDerWaalsContact O-CB 3.24Å; F918-S921 WeakPolarHBondContact O-CB 3.21Å; F918-S921 PolarHBondContact O-N 3.4Å; F918-S921 VanDerWaalsContact O-N 3.08Å; F918-S921 PolarHBondContact O-OG 2.67Å; F918-V924 HydrophobicContact CD1-CG2 4.13Å; F918-V924 HydrophobicContact CD2-CG2 4.49Å; F918-V924 HydrophobicContact CE1-CG2 3.79Å; F918-V924 HydrophobicContact CE2-CG2 4.19Å; F918-V924 HydrophobicContact CG-CG2 4.47Å; F918-V924 HydrophobicContact CZ-CG2 3.83Å; F918-V924 VanDerWaalsContact O-CG2 3.25Å; F918-V924 WeakPolarHBondContact O-CG2 3.31Å; F918-F952 AromaticContact CD2-CD2 3.87Å; F918-F952 HydrophobicContact CD2-CD2 3.87Å; F918-F952 AromaticContact CD2-CE2 3.44Å; F918-F952 HydrophobicContact CD2-CE2 3.44Å; F918-F952 VanDerWaalsContact CD2-CE2 3.44Å; F918-F952 HydrophobicContact CD2-CZ 4.49Å; F918-F952 HydrophobicContact CE2-CD2 4.08Å; F918-F952 AromaticContact CE2-CE2 3.45Å; F918-F952 HydrophobicContact CE2-CE2 3.45Å; F918-F952 VanDerWaalsContact CE2-CE2 3.45Å; F918-F952 HydrophobicContact CE2-CZ 4.13Å
919	I	59.8	Low	55.6	Low	39 Å²	39	56.3 Å²	56.3	20%	0.2	30%	0.304	C	S	.	.	H	α-helix	trans	-62.5	-37.8	177.7	-72.6	172.5	0	0	0	111.5	Y870 Y915 M916 S921	Y870-I919 HydrophobicContact CE2-CD1 4.23Å; Y915-I919 HydrophobicContact CD1-CD1 3.72Å; Y915-I919 HydrophobicContact CD1-CG1 4.48Å; Y915-I919 HydrophobicContact CE1-CD1 3.16Å; Y915-I919 HydrophobicContact CE1-CG1 4.12Å; Y915-I919 HydrophobicContact CE2-CD1 4.25Å; Y915-I919 HydrophobicContact CE2-CG1 4.42Å; Y915-I919 HydrophobicContact CG-CD1 4.48Å; Y915-I919 VanDerWaalsContact CZ-CD1 3.45Å; Y915-I919 PolarHBondContact O-N 2.83Å; M916-I919 PolarHBondContact O-N 3.38Å; I919-S921 PolarHBondContact O-N 3.17Å
920	H	53.1	Low	54.6	Low	65 Å²	65	61.4 Å²	61.4	30%	0.301	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-4.9	179.1	-70.5	76.1	0	0	0	112.8	M916 F918 K925	M916-H920 WeakPolarHBondContact O-CB 3.16Å; M916-H920 PolarHBondContact O-N 3.44Å; M916-H920 PolarHBondContact O-ND1 2.81Å; F918-H920 VanDerWaalsContact C-N 3.29Å; F918-H920 PolarHBondContact O-N 3.05Å; H920-K925 PolarHBondContact CD2-NZ 3.42Å; H920-K925 VanDerWaalsContact CD2-NZ 3.26Å; H920-K925 PolarHBondContact NE2-NZ 3.01Å
921	S	55	Low	53.6	Low	11 Å²	11	68.1 Å²	68.1	8%	0.077	38%	0.375	C	S	.	.	S	Bend	trans	-65	142.4	177.6	75.4	0	0	0	0	109.9	V917 F918 I919 I923 V924 K925	V917-S921 WeakPolarHBondContact O-CB 3.17Å; V917-S921 PolarHBondContact O-N 3.48Å; F918-S921 VanDerWaalsContact O-CB 3.24Å; F918-S921 WeakPolarHBondContact O-CB 3.21Å; F918-S921 PolarHBondContact O-N 3.4Å; F918-S921 VanDerWaalsContact O-N 3.08Å; F918-S921 PolarHBondContact O-OG 2.67Å; I919-S921 PolarHBondContact O-N 3.17Å; S921-I923 PolarHBondContact O-N 3.25Å; S921-V924 PolarHBondContact O-N 2.88Å; S921-K925 PolarHBondContact O-N 3.45Å; S921-K925 VanDerWaalsContact O-N 3.12Å
922	P	52.7	Low	52.4	Low	15 Å²	15	65.5 Å²	65.5	10%	0.097	37%	0.366	C	S	.	.	H	α-helix	trans	-57.7	-16.3	172.9	20.3	-32.5	0	0	0	113.6	G926 Y948 S1043	P922-G926 PolarHBondContact O-N 3.34Å; P922-Y948 HydrophobicContact CB-CD1 3.75Å; P922-Y948 HydrophobicContact CB-CE1 3.47Å; P922-Y948 VanDerWaalsContact CB-CE1 3.47Å; P922-Y948 HydrophobicContact CB-CE2 4.39Å; P922-Y948 HydrophobicContact CB-CG 4.29Å; P922-Y948 HydrophobicContact CG-CD1 3.11Å; P922-Y948 HydrophobicContact CG-CE1 3.2Å; P922-Y948 HydrophobicContact CG-CG 3.9Å; P922-S1043 WeakPolarHBondContact CD-OG 3.32Å
923	I	57.9	Low	51.6	Low	68 Å²	68	66.5 Å²	66.5	35%	0.349	37%	0.373	S	S	.	.	H	α-helix	trans	-66.2	-43.4	173.3	-54.8	176.6	0	0	0	111.2	S921 F952	S921-I923 PolarHBondContact O-N 3.25Å; I923-F952 HydrophobicContact CD1-CB 3.7Å; I923-F952 HydrophobicContact CD1-CG 4.14Å
924	V	56.3	Low	50.9	Low	72 Å²	72	67.5 Å²	67.5	44%	0.436	38%	0.377	S	S	.	.	H	α-helix	trans	-86	-41.7	-176.2	176.9	0	0	0	0	111.1	F918 S921	F918-V924 HydrophobicContact CD1-CG2 4.13Å; F918-V924 HydrophobicContact CD2-CG2 4.49Å; F918-V924 HydrophobicContact CE1-CG2 3.79Å; F918-V924 HydrophobicContact CE2-CG2 4.19Å; F918-V924 HydrophobicContact CG-CG2 4.47Å; F918-V924 HydrophobicContact CZ-CG2 3.83Å; F918-V924 VanDerWaalsContact O-CG2 3.25Å; F918-V924 WeakPolarHBondContact O-CG2 3.31Å; S921-V924 PolarHBondContact O-N 2.88Å
925	K	51	Low	49.9	Very low	79 Å²	79	72.4 Å²	72.4	34%	0.343	40%	0.402	S	S	.	.	H	α-helix	trans	-78.7	-18	-176.9	-82.2	-179.1	172.6	-177.4	0	113.4	S875 H920 S921 Y927	S875-K925 PolarHBondContact O-NZ 2.91Å; H920-K925 PolarHBondContact CD2-NZ 3.42Å; H920-K925 VanDerWaalsContact CD2-NZ 3.26Å; H920-K925 PolarHBondContact NE2-NZ 3.01Å; S921-K925 PolarHBondContact O-N 3.45Å; S921-K925 VanDerWaalsContact O-N 3.12Å; K925-Y927 WeakPolarHBondContact O-CD2 3.49Å; K925-Y927 PolarHBondContact O-N 3.18Å
926	G	46	Very low	48.9	Very low	73 Å²	73	72.9 Å²	72.9	75%	0.753	40%	0.403	S	S	*	.			trans	58.6	2.3	177.3	0	0	0	0	0	115.8	P922	P922-G926 PolarHBondContact O-N 3.34Å
927	Y	42.1	Very low	48	Very low	197 Å²	197	79.3 Å²	79.3	77%	0.773	43%	0.433	S	S	*	.	S	Bend	trans	-105.7	144.3	-173.7	-86.4	-76.9	0	0	0	110.1	K925	K925-Y927 WeakPolarHBondContact O-CD2 3.49Å; K925-Y927 PolarHBondContact O-N 3.18Å
928	A	43.5	Very low	47.1	Very low	81 Å²	81	86.2 Å²	86.2	67%	0.669	46%	0.461	S	S	*	.			trans	-51.5	126	169	0	0	0	0	0	109	S930	A928-S930 PolarHBondContact O-N 3.03Å
929	P	43.3	Very low	45.9	Very low	31 Å²	31	90.3 Å²	90.3	20%	0.201	48%	0.479	C	S	.	.			trans	-59.6	135.1	-175.5	21.9	-30.8	0	0	0	110	L931	P929-L931 PolarHBondContact O-N 3.46Å
930	S	39.1	Very low	44.5	Very low	116 Å²	116	92 Å²	92	81%	0.811	51%	0.506	S	S	*	.	S	Bend	trans	-60.4	106.6	172.1	51.2	0	0	0	0	109	A928	A928-S930 PolarHBondContact O-N 3.03Å
931	L	37.7	Very low	43.8	Very low	155 Å²	155	100 Å²	100	81%	0.812	53%	0.534	S	S	*	.	S	Bend	trans	52.3	113.8	179.4	-79.3	125.6	0	0	0	115.7	P929 T933	P929-L931 PolarHBondContact O-N 3.46Å; L931-T933 PolarHBondContact O-N 3.27Å
932	P	39.9	Very low	43.2	Very low	60 Å²	60	105.2 Å²	105.2	39%	0.39	57%	0.565	S	S	.	*			trans	-65.7	132.7	170.8	31.9	-34.1	0	0	0	109.2	F934 R936	P932-F934 WeakPolarHBondContact CB-O 3.24Å; P932-F934 PolarHBondContact O-N 2.91Å; P932-R936 HydrophobicContact CB-CG 4.03Å; P932-R936 HydrophobicContact CG-CG 4.38Å
933	T	44.6	Very low	43.1	Very low	47 Å²	47	108.9 Å²	108.9	29%	0.288	58%	0.584	S	S	.	*	S	Bend	trans	-65	-15.9	169.5	43.9	0	0	0	0	112.1	V78 L931	V78-T933 VanDerWaalsContact CG2-O 3.32Å; V78-T933 WeakPolarHBondContact CG2-O 3.31Å; L931-T933 PolarHBondContact O-N 3.27Å
934	F	43.9	Very low	43	Very low	42 Å²	42	108.2 Å²	108.2	18%	0.184	59%	0.585	C	S	.	*	S	Bend	trans	-123.8	134.6	-177.4	-61.3	-85.1	0	0	0	110.5	V78 L81 Y82 P932 R936	V78-F934 HydrophobicContact CG1-CD1 3.42Å; V78-F934 VanDerWaalsContact CG1-CD1 3.42Å; V78-F934 HydrophobicContact CG1-CE1 3.02Å; V78-F934 HydrophobicContact CG1-CE2 4.39Å; V78-F934 HydrophobicContact CG1-CG 4.27Å; V78-F934 HydrophobicContact CG1-CZ 3.57Å; L81-F934 HydrophobicContact CD2-CE1 4.39Å; L81-F934 HydrophobicContact CD2-CZ 4.18Å; Y82-F934 WeakPolarHBondContact OH-CD1 3.45Å; Y82-F934 WeakPolarHBondContact OH-CE1 3.11Å; P932-F934 WeakPolarHBondContact CB-O 3.24Å; P932-F934 PolarHBondContact O-N 2.91Å; F934-R936 PolarHBondContact O-N 2.68Å
935	D	40.9	Very low	43	Very low	139 Å²	139	109 Å²	109	74%	0.743	59%	0.592	S	S	*	*			trans	-58	104.7	167.2	-93.4	-33.2	0	0	0	108.9	Q937	D935-Q937 PolarHBondContact O-N 2.94Å
936	R	42.6	Very low	43.4	Very low	112 Å²	112	111.9 Å²	111.9	42%	0.423	61%	0.61	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	9.9	-177.8	-70.9	-179.7	171.5	-175.7	-4.5	113.9	P932 F934 F938 N943	P932-R936 HydrophobicContact CB-CG 4.03Å; P932-R936 HydrophobicContact CG-CG 4.38Å; F934-R936 PolarHBondContact O-N 2.68Å; R936-F938 PolarHBondContact O-N 2.74Å; R936-N943 PolarHBondContact NH1-OD1 3.5Å
937	Q	38.3	Very low	44	Very low	162 Å²	162	112.6 Å²	112.6	76%	0.757	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-27.1	-174.2	-68.5	-172.5	-9	0	0	113	D935	D935-Q937 PolarHBondContact O-N 2.94Å
938	F	38.4	Very low	44.8	Very low	165 Å²	165	105.1 Å²	105.1	72%	0.724	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.1	-22.9	-173.9	-101.1	-85.3	0	0	0	115.7	R936	R936-F938 PolarHBondContact O-N 2.74Å
939	F	37.2	Very low	45.8	Very low	168 Å²	168	108 Å²	108	74%	0.737	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	20.2	-179.6	-80.2	-73.4	0	0	0	114.1	R941	F939-R941 PolarHBondContact O-N 3.24Å
940	G	31.5	Very low	46.8	Very low	73 Å²	73	108.4 Å²	108.4	75%	0.753	56%	0.558	S	S	*	*			trans	51.4	0.5	156.3	0	0	0	0	0	120.6
941	R	37.3	Very low	47.9	Very low	235 Å²	235	103.2 Å²	103.2	89%	0.887	52%	0.521	S	S	*	.			trans	-147.1	110.8	-176.8	-84.7	-172.5	173.2	168.2	-1.9	110.9	F939	F939-R941 PolarHBondContact O-N 3.24Å
942	T	42.4	Very low	49.2	Very low	119 Å²	119	98.4 Å²	98.4	73%	0.73	49%	0.494	S	S	*	.			trans	-63.8	129.5	171.4	48	0	0	0	0	111.5
943	N	51.3	Low	50.5	Low	93 Å²	93	100.5 Å²	100.5	50%	0.497	50%	0.501	S	S	.	.			trans	58	60.9	157.7	-54.8	-15.2	0	0	0	117.1	R936	R936-N943 PolarHBondContact NH1-OD1 3.5Å
944	S	56.1	Low	51.6	Low	53 Å²	53	99.1 Å²	99.1	37%	0.371	49%	0.492	S	S	.	.			trans	-86.6	135.5	166.7	73.8	0	0	0	0	111.2	L946 Y947	S944-L946 PolarHBondContact O-N 3.45Å; S944-Y947 WeakPolarHBondContact O-CB 3.25Å; S944-Y947 PolarHBondContact O-N 2.94Å; S944-Y947 VanDerWaalsContact O-N 3.12Å
945	P	57.1	Low	52.6	Low	89 Å²	89	97.5 Å²	97.5	58%	0.578	49%	0.486	S	S	*	.	H	α-helix	trans	-61	-27.1	177.2	22.9	-32.3	0	0	0	112.5	Y947 Y948 W949	P945-Y947 PolarHBondContact O-N 3.13Å; P945-Y948 PolarHBondContact O-N 3.42Å; P945-W949 VanDerWaalsContact O-CD1 3.23Å; P945-W949 PolarHBondContact O-N 3.15Å; P945-W949 VanDerWaalsContact O-N 3.07Å
946	L	58.2	Low	54	Low	140 Å²	140	94.9 Å²	94.9	73%	0.733	47%	0.471	S	S	*	.	H	α-helix	trans	-55	-37.8	174.3	-88.4	159.2	0	0	0	112.9	S944 W949 S950	S944-L946 PolarHBondContact O-N 3.45Å; L946-W949 PolarHBondContact O-N 3.02Å; L946-S950 PolarHBondContact O-N 3.16Å; L946-S950 PolarHBondContact O-OG 3.05Å
947	Y	58.3	Low	55.1	Low	88 Å²	88	91.5 Å²	91.5	35%	0.345	47%	0.467	S	S	.	.	H	α-helix	trans	-69	-40.8	-178	-168	-95.3	0	0	0	111.7	S944 P945 S950 E951 F1040 V1041	S944-Y947 WeakPolarHBondContact O-CB 3.25Å; S944-Y947 PolarHBondContact O-N 2.94Å; S944-Y947 VanDerWaalsContact O-N 3.12Å; P945-Y947 PolarHBondContact O-N 3.13Å; Y947-S950 VanDerWaalsContact C-OG 3.31Å; Y947-S950 VanDerWaalsContact CA-OG 3.31Å; Y947-S950 WeakPolarHBondContact CA-OG 3.38Å; Y947-S950 PolarHBondContact O-N 3.28Å; Y947-S950 PolarHBondContact O-OG 3.43Å; Y947-E951 PolarHBondContact O-N 2.89Å; Y947-F1040 PolarHBondContact OH-O 3.49Å; Y947-V1041 HydrophobicContact CD1-CG1 4.07Å; Y947-V1041 HydrophobicContact CD2-CG1 4.09Å; Y947-V1041 HydrophobicContact CD2-CG2 4.36Å; Y947-V1041 HydrophobicContact CE1-CG1 4.01Å; Y947-V1041 WeakPolarHBondContact CE1-O 3.26Å; Y947-V1041 HydrophobicContact CE2-CB 4.11Å; Y947-V1041 HydrophobicContact CE2-CG1 4.02Å; Y947-V1041 HydrophobicContact CE2-CG2 3.95Å; Y947-V1041 HydrophobicContact CG-CG1 4.16Å; Y947-V1041 WeakPolarHBondContact O-CG1 3.17Å; Y947-V1041 WeakPolarHBondContact OH-CA 3.24Å; Y947-V1041 PolarHBondContact OH-O 3.1Å
948	Y	60.3	Low	56.5	Low	39 Å²	39	83.8 Å²	83.8	15%	0.153	43%	0.431	C	S	.	.	H	α-helix	trans	-68	-40.7	175.9	-54.8	-45.3	0	0	0	112.2	P922 P945 S950 E951 F952	P922-Y948 HydrophobicContact CB-CD1 3.75Å; P922-Y948 HydrophobicContact CB-CE1 3.47Å; P922-Y948 VanDerWaalsContact CB-CE1 3.47Å; P922-Y948 HydrophobicContact CB-CE2 4.39Å; P922-Y948 HydrophobicContact CB-CG 4.29Å; P922-Y948 HydrophobicContact CG-CD1 3.11Å; P922-Y948 HydrophobicContact CG-CE1 3.2Å; P922-Y948 HydrophobicContact CG-CG 3.9Å; P945-Y948 PolarHBondContact O-N 3.42Å; Y948-S950 VanDerWaalsContact C-N 3.3Å; Y948-S950 PolarHBondContact O-N 2.8Å; Y948-E951 PolarHBondContact O-N 3.45Å; Y948-F952 PolarHBondContact O-N 3.26Å
949	W	63.5	Low	57.9	Low	142 Å²	142	77.6 Å²	77.6	54%	0.538	41%	0.407	S	S	.	.	H	α-helix	trans	-62.1	-38.2	172.3	-82.7	106.8	0	0	0	112.1	P945 L946 F952 L953	P945-W949 VanDerWaalsContact O-CD1 3.23Å; P945-W949 PolarHBondContact O-N 3.15Å; P945-W949 VanDerWaalsContact O-N 3.07Å; L946-W949 PolarHBondContact O-N 3.02Å; W949-F952 HydrophobicContact CE3-CD1 4.07Å; W949-F952 HydrophobicContact CZ3-CD1 4.01Å; W949-F952 HydrophobicContact CZ3-CE1 4.14Å; W949-F952 PolarHBondContact O-N 2.63Å; W949-L953 VanDerWaalsContact O-CB 3.32Å; W949-L953 WeakPolarHBondContact O-CB 3.34Å; W949-L953 WeakPolarHBondContact O-CG 3.2Å; W949-L953 PolarHBondContact O-N 3.22Å
950	S	63.5	Low	59.4	Low	39 Å²	39	72 Å²	72	27%	0.273	39%	0.388	S	S	.	.	H	α-helix	trans	-66.3	-41.3	176.2	56.5	0	0	0	0	112.7	L946 Y947 Y948 L954 V1041	L946-S950 PolarHBondContact O-N 3.16Å; L946-S950 PolarHBondContact O-OG 3.05Å; Y947-S950 VanDerWaalsContact C-OG 3.31Å; Y947-S950 VanDerWaalsContact CA-OG 3.31Å; Y947-S950 WeakPolarHBondContact CA-OG 3.38Å; Y947-S950 PolarHBondContact O-N 3.28Å; Y947-S950 PolarHBondContact O-OG 3.43Å; Y948-S950 VanDerWaalsContact C-N 3.3Å; Y948-S950 PolarHBondContact O-N 2.8Å; S950-L954 VanDerWaalsContact O-CB 3.26Å; S950-L954 WeakPolarHBondContact O-CB 3.01Å; S950-L954 VanDerWaalsContact O-CD1 3.25Å; S950-L954 WeakPolarHBondContact O-CD1 3.21Å; S950-L954 WeakPolarHBondContact O-CG 3.19Å; S950-L954 PolarHBondContact O-N 3.41Å; S950-V1041 VanDerWaalsContact OG-CG1 3.3Å; S950-V1041 WeakPolarHBondContact OG-CG1 3.27Å
951	E	62.7	Low	61.2	Low	7 Å²	7	68.6 Å²	68.6	3%	0.033	35%	0.353	C	S	.	.	H	α-helix	trans	-58.2	-53	172.8	-162.5	174.5	-169.8	0	0	110.1	Y947 Y948 L953 L954 T955 Y1038 V1041 S1043 S1047	Y947-E951 PolarHBondContact O-N 2.89Å; Y948-E951 PolarHBondContact O-N 3.45Å; E951-L953 PolarHBondContact O-N 3.11Å; E951-L954 PolarHBondContact O-N 3.22Å; E951-T955 PolarHBondContact O-N 3.02Å; E951-T955 PolarHBondContact O-OG1 3.49Å; E951-Y1038 HydrophobicContact CG-CD2 4.47Å; E951-Y1038 HydrophobicContact CG-CE2 3.74Å; E951-Y1038 VanDerWaalsContact O-CE2 3.29Å; E951-Y1038 WeakPolarHBondContact O-CE2 3.28Å; E951-V1041 HydrophobicContact CB-CG1 3.9Å; E951-S1043 VanDerWaalsContact CD-OG 3.23Å; E951-S1043 PolarHBondContact OE1-N 3.3Å; E951-S1043 PolarHBondContact OE1-OG 3.11Å; E951-S1043 WeakPolarHBondContact OE2-CB 3.43Å; E951-S1043 PolarHBondContact OE2-OG 3.26Å; E951-S1047 WeakPolarHBondContact OE1-CB 3.31Å; E951-S1047 PolarHBondContact OE1-OG 3.37Å
952	F	65.2	Low	62.6	Low	55 Å²	55	57.7 Å²	57.7	24%	0.241	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-47	-178.6	176.9	-108	0	0	0	113.8	F918 I923 Y948 W949 L954 T955 I956	F918-F952 AromaticContact CD2-CD2 3.87Å; F918-F952 HydrophobicContact CD2-CD2 3.87Å; F918-F952 AromaticContact CD2-CE2 3.44Å; F918-F952 HydrophobicContact CD2-CE2 3.44Å; F918-F952 VanDerWaalsContact CD2-CE2 3.44Å; F918-F952 HydrophobicContact CD2-CZ 4.49Å; F918-F952 HydrophobicContact CE2-CD2 4.08Å; F918-F952 AromaticContact CE2-CE2 3.45Å; F918-F952 HydrophobicContact CE2-CE2 3.45Å; F918-F952 VanDerWaalsContact CE2-CE2 3.45Å; F918-F952 HydrophobicContact CE2-CZ 4.13Å; I923-F952 HydrophobicContact CD1-CB 3.7Å; I923-F952 HydrophobicContact CD1-CG 4.14Å; Y948-F952 PolarHBondContact O-N 3.26Å; W949-F952 HydrophobicContact CE3-CD1 4.07Å; W949-F952 HydrophobicContact CZ3-CD1 4.01Å; W949-F952 HydrophobicContact CZ3-CE1 4.14Å; W949-F952 PolarHBondContact O-N 2.63Å; F952-L954 VanDerWaalsContact C-N 3.29Å; F952-L954 PolarHBondContact O-N 3.26Å; F952-T955 PolarHBondContact O-N 2.87Å; F952-I956 HydrophobicContact CD1-CD1 4.05Å; F952-I956 HydrophobicContact CD2-CD1 4.27Å; F952-I956 HydrophobicContact CE1-CD1 3.48Å; F952-I956 VanDerWaalsContact CE1-CD1 3.48Å; F952-I956 HydrophobicContact CE2-CD1 3.71Å; F952-I956 HydrophobicContact CE2-CG1 4.43Å; F952-I956 HydrophobicContact CG-CD1 4.43Å; F952-I956 HydrophobicContact CZ-CD1 3.31Å; F952-I956 HydrophobicContact CZ-CG1 4.46Å; F952-I956 PolarHBondContact O-N 2.93Å; F952-I956 VanDerWaalsContact O-N 3.13Å
953	L	67.6	Low	63.7	Low	104 Å²	104	54.7 Å²	54.7	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-62.7	-38.4	178.5	-73.2	170.9	0	0	0	111.5	W949 E951 A957	W949-L953 VanDerWaalsContact O-CB 3.32Å; W949-L953 WeakPolarHBondContact O-CB 3.34Å; W949-L953 WeakPolarHBondContact O-CG 3.2Å; W949-L953 PolarHBondContact O-N 3.22Å; E951-L953 PolarHBondContact O-N 3.11Å; L953-A957 VanDerWaalsContact O-CB 3.31Å; L953-A957 WeakPolarHBondContact O-CB 3.19Å; L953-A957 PolarHBondContact O-N 3.14Å
954	L	66.7	Low	64.4	Low	18 Å²	18	51.3 Å²	51.3	9%	0.094	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-40.9	176.5	-76.6	163.6	0	0	0	112.2	S950 E951 F952 I956 A957 L958 F1034 Y1038	S950-L954 VanDerWaalsContact O-CB 3.26Å; S950-L954 WeakPolarHBondContact O-CB 3.01Å; S950-L954 VanDerWaalsContact O-CD1 3.25Å; S950-L954 WeakPolarHBondContact O-CD1 3.21Å; S950-L954 WeakPolarHBondContact O-CG 3.19Å; S950-L954 PolarHBondContact O-N 3.41Å; E951-L954 PolarHBondContact O-N 3.22Å; F952-L954 VanDerWaalsContact C-N 3.29Å; F952-L954 PolarHBondContact O-N 3.26Å; L954-I956 VanDerWaalsContact C-N 3.3Å; L954-I956 PolarHBondContact O-N 3.35Å; L954-A957 PolarHBondContact O-N 3.45Å; L954-L958 WeakPolarHBondContact O-CD1 3.36Å; L954-L958 VanDerWaalsContact O-CG 3.23Å; L954-L958 WeakPolarHBondContact O-CG 3.29Å; L954-L958 PolarHBondContact O-N 3.28Å; L954-F1034 HydrophobicContact CD2-CB 3.7Å; L954-F1034 HydrophobicContact CD2-CD1 3.68Å; L954-F1034 HydrophobicContact CD2-CG 4.06Å; L954-Y1038 HydrophobicContact CB-CD2 3.24Å; L954-Y1038 HydrophobicContact CB-CE2 3.77Å; L954-Y1038 HydrophobicContact CB-CG 4.18Å; L954-Y1038 HydrophobicContact CD1-CD2 3.82Å; L954-Y1038 HydrophobicContact CD1-CG 4.45Å; L954-Y1038 HydrophobicContact CG-CD2 4.1Å
955	T	65.4	Low	64.8	Low	7 Å²	7	49.8 Å²	49.8	4%	0.043	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-44.3	175.2	-45.1	0	0	0	0	111	V917 E951 F952 L958 C959 Y1038 F1050	V917-T955 HydrophobicContact CG1-CG2 4.15Å; E951-T955 PolarHBondContact O-N 3.02Å; E951-T955 PolarHBondContact O-OG1 3.49Å; F952-T955 PolarHBondContact O-N 2.87Å; T955-L958 PolarHBondContact O-N 3.43Å; T955-C959 PolarHBondContact O-N 2.89Å; T955-C959 PolarHBondContact O-SG 3.44Å; T955-Y1038 WeakPolarHBondContact OG1-CE2 3.28Å; T955-Y1038 PolarHBondContact OG1-OH 2.82Å; T955-F1050 HydrophobicContact CG2-CD1 4.37Å; T955-F1050 HydrophobicContact CG2-CE1 3.83Å; T955-F1050 HydrophobicContact CG2-CZ 4Å
956	I	69.6	Low	65	Low	84 Å²	84	45.9 Å²	45.9	43%	0.431	24%	0.236	S	C	.	.	H	α-helix	trans	-66.2	-44.1	177.4	-68.4	172.8	0	0	0	111	F952 L954 L958 C959 P960	F952-I956 HydrophobicContact CD1-CD1 4.05Å; F952-I956 HydrophobicContact CD2-CD1 4.27Å; F952-I956 HydrophobicContact CE1-CD1 3.48Å; F952-I956 VanDerWaalsContact CE1-CD1 3.48Å; F952-I956 HydrophobicContact CE2-CD1 3.71Å; F952-I956 HydrophobicContact CE2-CG1 4.43Å; F952-I956 HydrophobicContact CG-CD1 4.43Å; F952-I956 HydrophobicContact CZ-CD1 3.31Å; F952-I956 HydrophobicContact CZ-CG1 4.46Å; F952-I956 PolarHBondContact O-N 2.93Å; F952-I956 VanDerWaalsContact O-N 3.13Å; L954-I956 VanDerWaalsContact C-N 3.3Å; L954-I956 PolarHBondContact O-N 3.35Å; I956-L958 PolarHBondContact O-N 3.39Å; I956-C959 PolarHBondContact O-N 3.37Å; I956-P960 WeakPolarHBondContact O-CD 3.47Å
957	A	67.2	Low	65.1	Low	42 Å²	42	39.7 Å²	39.7	35%	0.347	21%	0.205	S	C	.	.	H	α-helix	trans	-61.8	-28.1	179.6	0	0	0	0	0	113.1	L953 L954 P960	L953-A957 VanDerWaalsContact O-CB 3.31Å; L953-A957 WeakPolarHBondContact O-CB 3.19Å; L953-A957 PolarHBondContact O-N 3.14Å; L954-A957 PolarHBondContact O-N 3.45Å; A957-P960 WeakPolarHBondContact O-CD 3.36Å
958	L	67.9	Low	65.2	Low	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-87.2	-18.2	-179.2	-66.4	167.9	0	0	0	113.6	L954 T955 I956 L961 H962 C1035 Y1038 F1050	L954-L958 WeakPolarHBondContact O-CD1 3.36Å; L954-L958 VanDerWaalsContact O-CG 3.23Å; L954-L958 WeakPolarHBondContact O-CG 3.29Å; L954-L958 PolarHBondContact O-N 3.28Å; T955-L958 PolarHBondContact O-N 3.43Å; I956-L958 PolarHBondContact O-N 3.39Å; L958-L961 HydrophobicContact CD2-CD1 3.81Å; L958-L961 WeakPolarHBondContact O-CB 3.5Å; L958-L961 PolarHBondContact O-N 2.79Å; L958-H962 PolarHBondContact O-N 3.42Å; L958-H962 PolarHBondContact O-ND1 2.94Å; L958-C1035 WeakPolarHBondContact CD2-SG 3.14Å; L958-Y1038 HydrophobicContact CD1-CG 4.46Å; L958-F1050 HydrophobicContact CB-CE1 4Å; L958-F1050 HydrophobicContact CB-CZ 4.24Å; L958-F1050 HydrophobicContact CD1-CE1 4.01Å
959	C	67.6	Low	65	Low	34 Å²	34	36.6 Å²	36.6	23%	0.23	20%	0.197	C	C	.	.	H	α-helix	trans	-55.6	-44.1	179.9	-73.2	0	0	0	0	114.4	V914 T955 I956 L961 H962 V963	V914-C959 WeakPolarHBondContact CG2-SG 3.48Å; T955-C959 PolarHBondContact O-N 2.89Å; T955-C959 PolarHBondContact O-SG 3.44Å; I956-C959 PolarHBondContact O-N 3.37Å; C959-L961 VanDerWaalsContact C-N 3.27Å; C959-L961 PolarHBondContact O-N 3.04Å; C959-H962 WeakPolarHBondContact O-CB 3.2Å; C959-H962 PolarHBondContact O-N 2.92Å; C959-H962 VanDerWaalsContact O-N 3.16Å; C959-V963 PolarHBondContact O-N 2.8Å
960	P	67.3	Low	64.5	Low	50 Å²	50	30.1 Å²	30.1	33%	0.325	17%	0.173	S	C	.	.	H	α-helix	trans	-61.5	-32.4	179.7	-22.8	33.9	0	0	0	113.7	I956 A957 H962 V963 L964 I1024	I956-P960 WeakPolarHBondContact O-CD 3.47Å; A957-P960 WeakPolarHBondContact O-CD 3.36Å; P960-H962 VanDerWaalsContact C-N 3.35Å; P960-V963 PolarHBondContact O-N 3.06Å; P960-L964 PolarHBondContact O-N 3.45Å; P960-I1024 HydrophobicContact CB-CD1 3.61Å; P960-I1024 HydrophobicContact CB-CG1 4.09Å; P960-I1024 HydrophobicContact CB-CG2 4.24Å
961	L	69.1	Low	64	Low	2 Å²	2	34.7 Å²	34.7	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-66.5	-36.7	177	-71.9	160.5	0	0	0	112.1	L958 C959 L964 F965 I1024 A1028 L1031 I1057 C1058 L1061	L958-L961 HydrophobicContact CD2-CD1 3.81Å; L958-L961 WeakPolarHBondContact O-CB 3.5Å; L958-L961 PolarHBondContact O-N 2.79Å; C959-L961 VanDerWaalsContact C-N 3.27Å; C959-L961 PolarHBondContact O-N 3.04Å; L961-L964 PolarHBondContact O-N 3.42Å; L961-F965 WeakPolarHBondContact O-CB 3.5Å; L961-F965 PolarHBondContact O-N 3.31Å; L961-I1024 HydrophobicContact CD2-CG2 3.8Å; L961-I1024 HydrophobicContact CG-CG2 4.11Å; L961-A1028 HydrophobicContact CD2-CB 3.71Å; L961-L1031 HydrophobicContact CD1-CB 4.29Å; L961-L1031 HydrophobicContact CD1-CD1 3.68Å; L961-L1031 HydrophobicContact CG-CD1 4.39Å; L961-I1057 HydrophobicContact CB-CG2 4.33Å; L961-C1058 VanDerWaalsContact CD1-SG 3.54Å; L961-L1061 HydrophobicContact CB-CD1 4.44Å; L961-L1061 HydrophobicContact CD2-CD1 3.83Å
962	H	68.5	Low	63.6	Low	6 Å²	6	35.6 Å²	35.6	3%	0.028	20%	0.199	C	C	.	.	H	α-helix	trans	-67.1	-40.6	176.1	-68.1	75.7	0	0	0	111.6	T910 L958 C959 P960 L964 F965 L966 F1050 Y1053 S1054 I1057	T910-H962 HydrophobicContact CG2-CB 4.48Å; L958-H962 PolarHBondContact O-N 3.42Å; L958-H962 PolarHBondContact O-ND1 2.94Å; C959-H962 WeakPolarHBondContact O-CB 3.2Å; C959-H962 PolarHBondContact O-N 2.92Å; C959-H962 VanDerWaalsContact O-N 3.16Å; P960-H962 VanDerWaalsContact C-N 3.35Å; H962-L964 VanDerWaalsContact C-N 3.35Å; H962-F965 WeakPolarHBondContact O-CB 3.5Å; H962-F965 PolarHBondContact O-N 3.48Å; H962-L966 VanDerWaalsContact O-CG 3.27Å; H962-L966 WeakPolarHBondContact O-CG 3.44Å; H962-L966 PolarHBondContact O-N 3.28Å; H962-F1050 AromaticContact CE1-CE2 3.76Å; H962-F1050 AromaticContact CE1-CZ 3.61Å; H962-F1050 AromaticContact NE2-CE2 3.72Å; H962-Y1053 AromaticContact CD2-CD1 3.68Å; H962-Y1053 AromaticContact CD2-CE1 3.18Å; H962-Y1053 WeakPolarHBondContact CD2-CE1 3.48Å; H962-Y1053 AromaticContact CD2-CZ 3.89Å; H962-Y1053 AromaticContact NE2-CD1 3.28Å; H962-Y1053 VanDerWaalsContact NE2-CD1 3.28Å; H962-Y1053 WeakPolarHBondContact NE2-CD1 3.28Å; H962-Y1053 AromaticContact NE2-CE1 3.35Å; H962-Y1053 WeakPolarHBondContact NE2-CE1 3.14Å; H962-S1054 PolarHBondContact CE1-OG 3.48Å; H962-I1057 HydrophobicContact CB-CD1 4.34Å; H962-I1057 WeakPolarHBondContact CD2-CD1 3.49Å; H962-I1057 WeakPolarHBondContact NE2-CD1 3.23Å
963	V	65.1	Low	63.2	Low	56 Å²	56	37 Å²	37	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-64.6	-42.1	175.3	178.8	0	0	0	0	110.5	C959 P960 L966 A967	C959-V963 PolarHBondContact O-N 2.8Å; P960-V963 PolarHBondContact O-N 3.06Å; V963-L966 PolarHBondContact O-N 2.9Å; V963-A967 WeakPolarHBondContact O-CB 3.45Å; V963-A967 PolarHBondContact O-N 2.92Å
964	L	65	Low	62.8	Low	22 Å²	22	34 Å²	34	12%	0.115	20%	0.199	C	C	.	.	H	α-helix	trans	-62.1	-42.9	175.5	-173.5	68	0	0	0	111.8	P960 L961 H962 L966 A967 D968 F1021 I1024 L1025 L1061	P960-L964 PolarHBondContact O-N 3.45Å; L961-L964 PolarHBondContact O-N 3.42Å; H962-L964 VanDerWaalsContact C-N 3.35Å; L964-L966 PolarHBondContact O-N 3.36Å; L964-A967 PolarHBondContact O-N 2.76Å; L964-D968 PolarHBondContact O-N 2.89Å; L964-F1021 HydrophobicContact CD1-CB 3.81Å; L964-F1021 HydrophobicContact CD1-CD1 3.57Å; L964-F1021 HydrophobicContact CD1-CE1 4.26Å; L964-F1021 HydrophobicContact CD1-CG 3.75Å; L964-I1024 HydrophobicContact CD2-CG2 4.19Å; L964-L1025 HydrophobicContact CD2-CB 4.31Å; L964-L1025 HydrophobicContact CD2-CD1 3.89Å; L964-L1061 HydrophobicContact CD2-CD1 4.02Å; L964-L1061 HydrophobicContact CD2-CD2 4.02Å; L964-L1061 HydrophobicContact CG-CD1 4.47Å; L964-L1061 HydrophobicContact CG-CD2 4Å
965	F	64.8	Low	62.1	Low	22 Å²	22	38.6 Å²	38.6	10%	0.096	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-44.3	173.7	174.1	-102.3	0	0	0	112.4	L961 H962 Q969 I1057 Y1060	L961-F965 WeakPolarHBondContact O-CB 3.5Å; L961-F965 PolarHBondContact O-N 3.31Å; H962-F965 WeakPolarHBondContact O-CB 3.5Å; H962-F965 PolarHBondContact O-N 3.48Å; F965-Q969 HydrophobicContact CD1-CG 4.42Å; F965-Q969 HydrophobicContact CD2-CG 4.43Å; F965-Q969 HydrophobicContact CE1-CG 4.05Å; F965-Q969 HydrophobicContact CE2-CG 4.07Å; F965-Q969 HydrophobicContact CZ-CG 3.86Å; F965-Q969 WeakPolarHBondContact O-CB 3.4Å; F965-Q969 VanDerWaalsContact O-CG 3.28Å; F965-Q969 WeakPolarHBondContact O-CG 3.48Å; F965-Q969 PolarHBondContact O-N 2.93Å; F965-I1057 HydrophobicContact CB-CG1 4.34Å; F965-I1057 HydrophobicContact CB-CG2 3.65Å; F965-I1057 HydrophobicContact CD1-CG1 4.21Å; F965-I1057 HydrophobicContact CD2-CG1 4.28Å; F965-I1057 HydrophobicContact CD2-CG2 4.33Å; F965-I1057 HydrophobicContact CG-CG1 4.02Å; F965-I1057 HydrophobicContact CG-CG2 4.12Å; F965-Y1060 AromaticContact CD2-CD1 3.35Å; F965-Y1060 HydrophobicContact CD2-CD1 3.35Å; F965-Y1060 AromaticContact CD2-CE1 3.58Å; F965-Y1060 HydrophobicContact CD2-CE1 3.58Å; F965-Y1060 HydrophobicContact CD2-CG 4.01Å; F965-Y1060 AromaticContact CE2-CD1 3.48Å; F965-Y1060 HydrophobicContact CE2-CD1 3.48Å; F965-Y1060 VanDerWaalsContact CE2-CD1 3.48Å; F965-Y1060 HydrophobicContact CE2-CD2 4.1Å; F965-Y1060 AromaticContact CE2-CE1 3.68Å; F965-Y1060 HydrophobicContact CE2-CE1 3.68Å; F965-Y1060 HydrophobicContact CE2-CE2 4.24Å; F965-Y1060 AromaticContact CE2-CG 3.71Å; F965-Y1060 HydrophobicContact CE2-CG 3.71Å
966	L	61.8	Low	61.6	Low	7 Å²	7	39.7 Å²	39.7	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-38.6	176.3	-70.1	173.8	0	0	0	111.8	W887 L906 T907 T910 H962 V963 L964 Q969 S970	W887-L966 HydrophobicContact CH2-CD2 4.38Å; W887-L966 HydrophobicContact CZ3-CD2 4.18Å; L906-L966 HydrophobicContact CB-CD1 3.96Å; L906-L966 HydrophobicContact CB-CD2 3.82Å; L906-L966 HydrophobicContact CD1-CD2 4.26Å; L906-L966 HydrophobicContact CD2-CD2 3.76Å; L906-L966 HydrophobicContact CG-CD2 4.16Å; T907-L966 HydrophobicContact CG2-CD1 4.35Å; T910-L966 HydrophobicContact CG2-CD1 3.75Å; H962-L966 VanDerWaalsContact O-CG 3.27Å; H962-L966 WeakPolarHBondContact O-CG 3.44Å; H962-L966 PolarHBondContact O-N 3.28Å; V963-L966 PolarHBondContact O-N 2.9Å; L964-L966 PolarHBondContact O-N 3.36Å; L966-Q969 PolarHBondContact O-N 3.24Å; L966-S970 VanDerWaalsContact O-CB 3.27Å; L966-S970 WeakPolarHBondContact O-CB 3.19Å; L966-S970 PolarHBondContact O-N 3.34Å; L966-S970 PolarHBondContact O-OG 2.87Å
967	A	59.6	Low	60.8	Low	10 Å²	10	37.4 Å²	37.4	8%	0.083	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-48.4	176.1	0	0	0	0	0	111.5	V963 L964 S970 N971 I972	V963-A967 WeakPolarHBondContact O-CB 3.45Å; V963-A967 PolarHBondContact O-N 2.92Å; L964-A967 PolarHBondContact O-N 2.76Å; A967-S970 WeakPolarHBondContact CA-OG 3.48Å; A967-S970 WeakPolarHBondContact O-CA 3.29Å; A967-S970 PolarHBondContact O-N 3.01Å; A967-S970 PolarHBondContact O-OG 3.28Å; A967-N971 PolarHBondContact O-N 3.02Å; A967-I972 PolarHBondContact O-N 3.26Å
968	D	61.3	Low	60.3	Low	49 Å²	49	35.4 Å²	35.4	26%	0.262	20%	0.201	S	C	.	.	H	α-helix	trans	-62.8	-46.2	175.3	176	64.6	0	0	0	111.7	L964 S970 N971 Y1060 R1064	L964-D968 PolarHBondContact O-N 2.89Å; D968-S970 PolarHBondContact O-N 2.94Å; D968-S970 VanDerWaalsContact O-N 3.13Å; D968-N971 PolarHBondContact O-N 3.3Å; D968-Y1060 VanDerWaalsContact OD2-CE1 3.29Å; D968-Y1060 WeakPolarHBondContact OD2-CE1 3.44Å; D968-Y1060 PolarHBondContact OD2-OH 3.5Å; D968-R1064 IonicContact OD2-NH1 3.91Å
969	Q	56.2	Low	59.6	Low	13 Å²	13	38.2 Å²	38.2	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-28.8	173.5	-70.6	-60.2	-25.2	0	0	110.8	R899 F965 L966 Y1060	R899-Q969 WeakPolarHBondContact CD-O 3.35Å; R899-Q969 PolarHBondContact NE-O 3.03Å; R899-Q969 PolarHBondContact NH1-O 3.44Å; F965-Q969 HydrophobicContact CD1-CG 4.42Å; F965-Q969 HydrophobicContact CD2-CG 4.43Å; F965-Q969 HydrophobicContact CE1-CG 4.05Å; F965-Q969 HydrophobicContact CE2-CG 4.07Å; F965-Q969 HydrophobicContact CZ-CG 3.86Å; F965-Q969 WeakPolarHBondContact O-CB 3.4Å; F965-Q969 VanDerWaalsContact O-CG 3.28Å; F965-Q969 WeakPolarHBondContact O-CG 3.48Å; F965-Q969 PolarHBondContact O-N 2.93Å; L966-Q969 PolarHBondContact O-N 3.24Å; Q969-Y1060 PolarHBondContact NE2-OH 3.42Å
970	S	52.9	Low	59	Low	6 Å²	6	41.2 Å²	41.2	4%	0.042	23%	0.229	C	C	.	.	H	α-helix	trans	-87.1	-5.7	-178.1	70.3	0	0	0	0	116.1	V903 L966 A967 D968 I972	V903-S970 WeakPolarHBondContact CG2-OG 3.23Å; L966-S970 VanDerWaalsContact O-CB 3.27Å; L966-S970 WeakPolarHBondContact O-CB 3.19Å; L966-S970 PolarHBondContact O-N 3.34Å; L966-S970 PolarHBondContact O-OG 2.87Å; A967-S970 WeakPolarHBondContact CA-OG 3.48Å; A967-S970 WeakPolarHBondContact O-CA 3.29Å; A967-S970 PolarHBondContact O-N 3.01Å; A967-S970 PolarHBondContact O-OG 3.28Å; D968-S970 PolarHBondContact O-N 2.94Å; D968-S970 VanDerWaalsContact O-N 3.13Å; S970-I972 PolarHBondContact O-N 3.26Å; S970-I972 WeakPolarHBondContact OG-CB 3.43Å; S970-I972 VanDerWaalsContact OG-CD1 3.31Å; S970-I972 WeakPolarHBondContact OG-CD1 3.3Å; S970-I972 WeakPolarHBondContact OG-CG1 3.31Å
971	N	52.6	Low	58.3	Low	135 Å²	135	44.1 Å²	44.1	72%	0.722	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	33.2	-169.6	-83.4	19.5	0	0	0	112.9	A967 D968	A967-N971 PolarHBondContact O-N 3.02Å; D968-N971 PolarHBondContact O-N 3.3Å
972	I	54.9	Low	57.5	Low	26 Å²	26	48 Å²	48	13%	0.133	26%	0.258	C	S	.	.			trans	-86.1	123.2	177.5	-71.2	177.8	0	0	0	108.9	V903 A967 S970 A976 L977 I980	V903-I972 HydrophobicContact CB-CD1 4.1Å; V903-I972 HydrophobicContact CG1-CD1 4.4Å; V903-I972 HydrophobicContact CG2-CD1 3.5Å; V903-I972 VanDerWaalsContact CG2-CD1 3.5Å; A967-I972 PolarHBondContact O-N 3.26Å; S970-I972 PolarHBondContact O-N 3.26Å; S970-I972 WeakPolarHBondContact OG-CB 3.43Å; S970-I972 VanDerWaalsContact OG-CD1 3.31Å; S970-I972 WeakPolarHBondContact OG-CD1 3.3Å; S970-I972 WeakPolarHBondContact OG-CG1 3.31Å; I972-A976 HydrophobicContact CG2-CB 4.07Å; I972-L977 HydrophobicContact CG2-CB 3.79Å; I972-L977 HydrophobicContact CG2-CD1 4.29Å; I972-L977 HydrophobicContact CG2-CG 4.38Å; I972-I980 HydrophobicContact CD1-CD1 4.31Å
973	T	57.1	Low	56.3	Low	85 Å²	85	55.6 Å²	55.6	52%	0.521	29%	0.291	S	S	.	.			trans	-71.7	151.7	167.4	57.7	0	0	0	0	109.7	Q975 A976 L977	T973-Q975 PolarHBondContact O-N 3.2Å; T973-Q975 VanDerWaalsContact O-N 3.14Å; T973-A976 PolarHBondContact O-N 3.16Å; T973-A976 WeakPolarHBondContact OG1-CB 3.38Å; T973-A976 PolarHBondContact OG1-N 3.49Å; T973-A976 VanDerWaalsContact OG1-N 3.16Å; T973-L977 PolarHBondContact O-N 2.85Å
974	T	57.3	Low	55.2	Low	41 Å²	41	54.8 Å²	54.8	25%	0.252	29%	0.285	S	S	.	.	H	α-helix	trans	-53	-36.4	174.3	51	0	0	0	0	111.6	L977 V978 F1021	T974-L977 WeakPolarHBondContact O-CB 3.14Å; T974-L977 PolarHBondContact O-N 3.17Å; T974-V978 WeakPolarHBondContact O-CG2 3.48Å; T974-V978 PolarHBondContact O-N 3.37Å; T974-V978 VanDerWaalsContact O-N 3.08Å; T974-F1021 HydrophobicContact CG2-CD2 3.86Å; T974-F1021 HydrophobicContact CG2-CE2 4.12Å
975	Q	52.7	Low	54.1	Low	113 Å²	113	62.2 Å²	62.2	53%	0.528	32%	0.319	S	S	.	.	H	α-helix	trans	-62	-45.2	173.5	-170.6	171.1	-1.7	0	0	113.1	T973 L977 V978 D979	T973-Q975 PolarHBondContact O-N 3.2Å; T973-Q975 VanDerWaalsContact O-N 3.14Å; Q975-L977 VanDerWaalsContact C-N 3.3Å; Q975-L977 PolarHBondContact O-N 3.45Å; Q975-V978 PolarHBondContact O-N 3.26Å; Q975-D979 VanDerWaalsContact O-CG 3.23Å; Q975-D979 PolarHBondContact O-N 3.5Å
976	A	54.4	Low	52.7	Low	30 Å²	30	67.7 Å²	67.7	25%	0.248	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-30.9	176.5	0	0	0	0	0	112.5	I972 T973 D979 I980	I972-A976 HydrophobicContact CG2-CB 4.07Å; T973-A976 PolarHBondContact O-N 3.16Å; T973-A976 WeakPolarHBondContact OG1-CB 3.38Å; T973-A976 PolarHBondContact OG1-N 3.49Å; T973-A976 VanDerWaalsContact OG1-N 3.16Å; A976-D979 WeakPolarHBondContact O-CB 3.31Å; A976-D979 PolarHBondContact O-N 2.89Å; A976-I980 WeakPolarHBondContact O-CD1 3.31Å; A976-I980 WeakPolarHBondContact O-CG1 3.25Å; A976-I980 PolarHBondContact O-N 3.29Å
977	L	54.5	Low	51.3	Low	36 Å²	36	70.2 Å²	70.2	19%	0.188	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-42.4	174.7	-156.2	150	0	0	0	111.1	I972 T973 T974 Q975 D979 I980 L981 F1021	I972-L977 HydrophobicContact CG2-CB 3.79Å; I972-L977 HydrophobicContact CG2-CD1 4.29Å; I972-L977 HydrophobicContact CG2-CG 4.38Å; T973-L977 PolarHBondContact O-N 2.85Å; T974-L977 WeakPolarHBondContact O-CB 3.14Å; T974-L977 PolarHBondContact O-N 3.17Å; Q975-L977 VanDerWaalsContact C-N 3.3Å; Q975-L977 PolarHBondContact O-N 3.45Å; L977-D979 VanDerWaalsContact C-N 3.35Å; L977-I980 PolarHBondContact O-N 3.27Å; L977-L981 HydrophobicContact CD2-CD1 3.52Å; L977-L981 HydrophobicContact CD2-CG 4.18Å; L977-L981 WeakPolarHBondContact O-CG 3.33Å; L977-L981 PolarHBondContact O-N 3.12Å; L977-F1021 HydrophobicContact CD1-CZ 4.5Å
978	V	55.6	Low	50.3	Low	0 Å²	0	77.5 Å²	77.5	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-65.7	-38	172.8	178	0	0	0	0	110.9	T974 Q975 I980 L981 F982 K1010 I1013 A1014 L1017	T974-V978 WeakPolarHBondContact O-CG2 3.48Å; T974-V978 PolarHBondContact O-N 3.37Å; T974-V978 VanDerWaalsContact O-N 3.08Å; Q975-V978 PolarHBondContact O-N 3.26Å; V978-I980 VanDerWaalsContact C-N 3.33Å; V978-I980 PolarHBondContact O-N 3.07Å; V978-L981 PolarHBondContact O-N 3.01Å; V978-F982 HydrophobicContact CG1-CD2 3.51Å; V978-F982 HydrophobicContact CG1-CE2 3.88Å; V978-F982 WeakPolarHBondContact O-CB 3.22Å; V978-F982 WeakPolarHBondContact O-CD2 3.47Å; V978-F982 PolarHBondContact O-N 3.2Å; V978-K1010 HydrophobicContact CG1-CG 3.56Å; V978-I1013 HydrophobicContact CG1-CG2 4.41Å; V978-I1013 HydrophobicContact CG2-CG2 3.83Å; V978-A1014 HydrophobicContact CG2-CB 4.05Å; V978-L1017 HydrophobicContact CG2-CD1 3.64Å
979	D	53.9	Low	49	Very low	59 Å²	59	78.3 Å²	78.3	32%	0.316	41%	0.409	S	S	.	.	H	α-helix	trans	-61	-40.5	174.9	-72.6	-31.7	0	0	0	113.1	Q975 A976 L977 F983 K1010	Q975-D979 VanDerWaalsContact O-CG 3.23Å; Q975-D979 PolarHBondContact O-N 3.5Å; A976-D979 WeakPolarHBondContact O-CB 3.31Å; A976-D979 PolarHBondContact O-N 2.89Å; L977-D979 VanDerWaalsContact C-N 3.35Å; D979-F983 PolarHBondContact O-N 3.21Å; D979-K1010 WeakPolarHBondContact OD1-CE 3.3Å; D979-K1010 IonicContact OD1-NZ 2.75Å; D979-K1010 PolarHBondContact OD1-NZ 2.87Å
980	I	54.1	Low	47.9	Very low	98 Å²	98	85.1 Å²	85.1	50%	0.503	44%	0.44	S	S	.	.	H	α-helix	trans	-69.6	-43.3	177.2	-67.7	162.9	0	0	0	110.6	I972 A976 L977 V978	I972-I980 HydrophobicContact CD1-CD1 4.31Å; A976-I980 WeakPolarHBondContact O-CD1 3.31Å; A976-I980 WeakPolarHBondContact O-CG1 3.25Å; A976-I980 PolarHBondContact O-N 3.29Å; L977-I980 PolarHBondContact O-N 3.27Å; V978-I980 VanDerWaalsContact C-N 3.33Å; V978-I980 PolarHBondContact O-N 3.07Å
981	L	52.5	Low	46.9	Very low	110 Å²	110	89.9 Å²	89.9	58%	0.576	47%	0.469	S	S	*	.	H	α-helix	trans	-69.5	-35.4	-179.6	-74.6	174.2	0	0	0	113.2	L977 V978	L977-L981 HydrophobicContact CD2-CD1 3.52Å; L977-L981 HydrophobicContact CD2-CG 4.18Å; L977-L981 WeakPolarHBondContact O-CG 3.33Å; L977-L981 PolarHBondContact O-N 3.12Å; V978-L981 PolarHBondContact O-N 3.01Å
982	F	51.9	Low	46.1	Very low	84 Å²	84	92.1 Å²	92.1	37%	0.368	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	15.5	-177.3	-76.7	-85.8	0	0	0	114.3	V978 N984 F1006 I1013	V978-F982 HydrophobicContact CG1-CD2 3.51Å; V978-F982 HydrophobicContact CG1-CE2 3.88Å; V978-F982 WeakPolarHBondContact O-CB 3.22Å; V978-F982 WeakPolarHBondContact O-CD2 3.47Å; V978-F982 PolarHBondContact O-N 3.2Å; F982-N984 VanDerWaalsContact C-N 3.26Å; F982-N984 PolarHBondContact O-N 2.9Å; F982-F1006 HydrophobicContact CD1-CZ 4.35Å; F982-I1013 HydrophobicContact CE1-CD1 4.48Å; F982-I1013 HydrophobicContact CE2-CD1 3.75Å; F982-I1013 HydrophobicContact CE2-CG2 4.3Å; F982-I1013 HydrophobicContact CZ-CD1 3.47Å; F982-I1013 VanDerWaalsContact CZ-CD1 3.47Å
983	F	45.2	Very low	44.9	Very low	165 Å²	165	100.1 Å²	100.1	72%	0.724	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.4	38.2	170	-84.6	-83.4	0	0	0	115.2	D979 Q985	D979-F983 PolarHBondContact O-N 3.21Å; F983-Q985 PolarHBondContact O-N 3.42Å
984	N	40.8	Very low	43.9	Very low	40 Å²	40	105 Å²	105	21%	0.214	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-95.7	20.1	-156.9	-133.4	-15.7	0	0	0	116.7	F982 L986 S987 F1006	F982-N984 VanDerWaalsContact C-N 3.26Å; F982-N984 PolarHBondContact O-N 2.9Å; N984-L986 PolarHBondContact O-N 3.49Å; N984-S987 PolarHBondContact O-OG 3.31Å; N984-S987 VanDerWaalsContact OD1-CB 3.31Å; N984-S987 WeakPolarHBondContact OD1-CB 3.19Å; N984-S987 PolarHBondContact OD1-OG 3.5Å; N984-F1006 WeakPolarHBondContact ND2-CE1 3.43Å
985	Q	42.5	Very low	42.6	Very low	177 Å²	177	112 Å²	112	83%	0.827	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-74.6	-13.1	169.3	-91.3	-174.8	-23.7	0	0	113.5	F983 S987	F983-Q985 PolarHBondContact O-N 3.42Å; Q985-S987 VanDerWaalsContact C-N 3.32Å; Q985-S987 PolarHBondContact O-N 2.84Å
986	L	34.5	Very low	41.8	Very low	138 Å²	138	110.9 Å²	110.9	72%	0.723	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-76.9	-13.1	175.3	-91	150.9	0	0	0	114	N984	N984-L986 PolarHBondContact O-N 3.49Å
987	S	33.8	Very low	40.9	Very low	59 Å²	59	116.4 Å²	116.4	41%	0.413	59%	0.591	S	S	.	*	S	Bend	trans	-93.8	-12.1	-177.4	64.1	0	0	0	0	115	N984 Q985	N984-S987 PolarHBondContact O-OG 3.31Å; N984-S987 VanDerWaalsContact OD1-CB 3.31Å; N984-S987 WeakPolarHBondContact OD1-CB 3.19Å; N984-S987 PolarHBondContact OD1-OG 3.5Å; Q985-S987 VanDerWaalsContact C-N 3.32Å; Q985-S987 PolarHBondContact O-N 2.84Å
988	Q	37.9	Very low	40.2	Very low	163 Å²	163	120.1 Å²	120.1	76%	0.762	62%	0.615	S	S	*	*	S	Bend	trans	-90.2	-11	-178.6	-78.4	-176.3	-25.5	0	0	114.7
989	S	33.7	Very low	39.5	Very low	67 Å²	67	122.5 Å²	122.5	47%	0.469	63%	0.632	S	S	.	*	S	Bend	trans	-93.7	-8.9	178.9	57.8	0	0	0	0	114.8
990	H	33.2	Very low	38.7	Very low	156 Å²	156	126.3 Å²	126.3	72%	0.722	65%	0.651	S	S	*	*	S	Bend	trans	-104.3	4.2	-175	-83.7	-64.4	0	0	0	115.9
991	T	32.1	Very low	37.9	Very low	105 Å²	105	126 Å²	126	64%	0.644	66%	0.658	S	S	*	*			trans	-106.8	56.3	179.2	61.9	0	0	0	0	112.6
992	H	34.6	Very low	37.4	Very low	182 Å²	182	124 Å²	124	84%	0.843	65%	0.653	S	S	*	*	S	Bend	trans	-148.7	109.9	155.4	-105.2	-77	0	0	0	107.3
993	K	31.1	Very low	37.1	Very low	194 Å²	194	124.2 Å²	124.2	84%	0.843	66%	0.657	S	S	*	*	S	Bend	trans	87.5	82.4	-178.5	-53	171.3	176.9	178.6	0	115.1
994	Q	35.2	Very low	36.9	Very low	187 Å²	187	120.2 Å²	120.2	87%	0.874	65%	0.646	S	S	*	*				172.9	130.4	111.2	-92.7	169.6	-10.7	0	0	111.5
995	H	31.5	Very low	37	Very low	188 Å²	188	121.6 Å²	121.6	87%	0.87	66%	0.658	S	S	*	*			trans	-22.1	123.8	167	-65	-87.4	0	0	0	117.1
996	S	35.7	Very low	37.5	Very low	90 Å²	90	118 Å²	118	63%	0.629	64%	0.64	S	S	*	*				179.4	132.6	126.2	55.9	0	0	0	0	110.2	T998	S996-T998 VanDerWaalsContact C-N 3.27Å; S996-T998 PolarHBondContact O-N 2.78Å; S996-T998 VanDerWaalsContact O-N 3.09Å
997	T	34.5	Very low	38.3	Very low	146 Å²	146	118.5 Å²	118.5	90%	0.896	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	30.1	-164.2	34.2	0	0	0	0	114.9
998	T	40.2	Very low	39.3	Very low	115 Å²	115	119 Å²	119	71%	0.706	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.5	-0.5	-168.9	47.2	0	0	0	0	116	S996	S996-T998 VanDerWaalsContact C-N 3.27Å; S996-T998 PolarHBondContact O-N 2.78Å; S996-T998 VanDerWaalsContact O-N 3.09Å
999	S	41.1	Very low	40.3	Very low	50 Å²	50	115 Å²	115	35%	0.35	62%	0.622	S	S	.	*			trans	-108.3	3.2	-177.2	60.7	0	0	0	0	115.5	S1001 S1002 I1003	S999-S1001 VanDerWaalsContact C-N 3.28Å; S999-S1001 PolarHBondContact O-N 3.43Å; S999-S1002 PolarHBondContact O-N 3.31Å; S999-S1002 PolarHBondContact O-OG 3.4Å; S999-I1003 WeakPolarHBondContact O-CD1 3.28Å; S999-I1003 VanDerWaalsContact O-CG1 3.31Å; S999-I1003 WeakPolarHBondContact O-CG1 3.42Å; S999-I1003 PolarHBondContact O-N 2.9Å; S999-I1003 VanDerWaalsContact O-N 3.08Å
1000	L	37.4	Very low	41.4	Very low	138 Å²	138	114 Å²	114	72%	0.723	61%	0.609	S	S	*	*	H	α-helix	trans	-64.9	-33.1	-177.9	-123.2	118.5	0	0	0	112.1	V1004	L1000-V1004 WeakPolarHBondContact O-CB 3.5Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.27Å; L1000-V1004 PolarHBondContact O-N 3.4Å; L1000-V1004 VanDerWaalsContact O-N 3.16Å
1001	S	36.4	Very low	42.6	Very low	93 Å²	93	112.3 Å²	112.3	65%	0.65	60%	0.6	S	S	*	*	H	α-helix	trans	-72.3	-35.6	176.8	57.5	0	0	0	0	113.1	S999 C1005	S999-S1001 VanDerWaalsContact C-N 3.28Å; S999-S1001 PolarHBondContact O-N 3.43Å; S1001-C1005 VanDerWaalsContact O-CB 3.27Å; S1001-C1005 WeakPolarHBondContact O-CB 3.42Å; S1001-C1005 PolarHBondContact O-N 3.09Å
1002	S	41.9	Very low	44.1	Very low	67 Å²	67	113.4 Å²	113.4	47%	0.469	60%	0.598	S	S	.	*	H	α-helix	trans	-76.4	-34.3	179.6	61.9	0	0	0	0	112.5	S999 C1005 F1006	S999-S1002 PolarHBondContact O-N 3.31Å; S999-S1002 PolarHBondContact O-OG 3.4Å; S1002-C1005 PolarHBondContact O-N 2.99Å; S1002-F1006 PolarHBondContact O-N 2.73Å
1003	I	46.6	Very low	45.5	Very low	88 Å²	88	107 Å²	107	45%	0.451	57%	0.57	S	S	.	*	H	α-helix	trans	-69.6	-38.3	174.2	-64.7	165.7	0	0	0	110.9	S999 K1007	S999-I1003 WeakPolarHBondContact O-CD1 3.28Å; S999-I1003 VanDerWaalsContact O-CG1 3.31Å; S999-I1003 WeakPolarHBondContact O-CG1 3.42Å; S999-I1003 PolarHBondContact O-N 2.9Å; S999-I1003 VanDerWaalsContact O-N 3.08Å; I1003-K1007 PolarHBondContact O-N 3.43Å; I1003-K1007 VanDerWaalsContact O-N 3.14Å
1004	V	39.2	Very low	46.7	Very low	82 Å²	82	98.2 Å²	98.2	50%	0.497	53%	0.533	S	S	.	.	H	α-helix	trans	-66.1	-43.2	172.2	172.3	0	0	0	0	110.3	L1000 F1006 K1007 C1008	L1000-V1004 WeakPolarHBondContact O-CB 3.5Å; L1000-V1004 WeakPolarHBondContact O-CG2 3.27Å; L1000-V1004 PolarHBondContact O-N 3.4Å; L1000-V1004 VanDerWaalsContact O-N 3.16Å; V1004-F1006 PolarHBondContact O-N 2.93Å; V1004-K1007 PolarHBondContact O-N 3.26Å; V1004-C1008 WeakPolarHBondContact O-CB 3.29Å; V1004-C1008 PolarHBondContact O-N 3.06Å; V1004-C1008 PolarHBondContact O-SG 3.4Å
1005	C	44.3	Very low	47.9	Very low	68 Å²	68	94 Å²	94	46%	0.459	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-41.9	178.2	-164.2	0	0	0	0	112.5	S1001 S1002 C1008 I1009	S1001-C1005 VanDerWaalsContact O-CB 3.27Å; S1001-C1005 WeakPolarHBondContact O-CB 3.42Å; S1001-C1005 PolarHBondContact O-N 3.09Å; S1002-C1005 PolarHBondContact O-N 2.99Å; C1005-C1008 WeakPolarHBondContact O-CB 3.26Å; C1005-C1008 PolarHBondContact O-N 2.86Å; C1005-I1009 VanDerWaalsContact O-CG1 3.29Å; C1005-I1009 WeakPolarHBondContact O-CG1 3.43Å; C1005-I1009 PolarHBondContact O-N 2.92Å
1006	F	52.7	Low	49.6	Very low	101 Å²	101	88.1 Å²	88.1	44%	0.443	49%	0.487	S	S	.	.	H	α-helix	trans	-67.9	-38.4	177.4	-158.5	-87	0	0	0	112.4	F982 N984 S1002 V1004 I1009 K1010	F982-F1006 HydrophobicContact CD1-CZ 4.35Å; N984-F1006 WeakPolarHBondContact ND2-CE1 3.43Å; S1002-F1006 PolarHBondContact O-N 2.73Å; V1004-F1006 PolarHBondContact O-N 2.93Å; F1006-I1009 PolarHBondContact O-N 3.19Å; F1006-K1010 WeakPolarHBondContact O-CB 3.35Å; F1006-K1010 PolarHBondContact O-N 2.95Å
1007	K	52.1	Low	50.9	Low	149 Å²	149	85.6 Å²	85.6	65%	0.648	47%	0.466	S	S	*	.	H	α-helix	trans	-63.3	-40.8	171.4	-79.5	-176.6	177.8	-179.8	0	111.7	I1003 V1004 F1011	I1003-K1007 PolarHBondContact O-N 3.43Å; I1003-K1007 VanDerWaalsContact O-N 3.14Å; V1004-K1007 PolarHBondContact O-N 3.26Å; K1007-F1011 VanDerWaalsContact O-CB 3.31Å; K1007-F1011 WeakPolarHBondContact O-CB 3.43Å; K1007-F1011 PolarHBondContact O-N 3.03Å
1008	C	53.2	Low	52.1	Low	70 Å²	70	81.3 Å²	81.3	47%	0.473	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-46.5	175.7	-70.3	0	0	0	0	112.1	V1004 C1005 K1010 F1011 Q1012	V1004-C1008 WeakPolarHBondContact O-CB 3.29Å; V1004-C1008 PolarHBondContact O-N 3.06Å; V1004-C1008 PolarHBondContact O-SG 3.4Å; C1005-C1008 WeakPolarHBondContact O-CB 3.26Å; C1005-C1008 PolarHBondContact O-N 2.86Å; C1008-K1010 PolarHBondContact O-N 3.37Å; C1008-F1011 PolarHBondContact O-N 3.39Å; C1008-Q1012 VanDerWaalsContact O-CB 3.27Å; C1008-Q1012 WeakPolarHBondContact O-CB 3.49Å; C1008-Q1012 PolarHBondContact O-N 3.07Å
1009	I	60	Low	53.3	Low	79 Å²	79	82 Å²	82	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-60.5	-46.8	176.9	-69.6	164.5	0	0	0	110.4	C1005 F1006 F1011 Q1012 I1013	C1005-I1009 VanDerWaalsContact O-CG1 3.29Å; C1005-I1009 WeakPolarHBondContact O-CG1 3.43Å; C1005-I1009 PolarHBondContact O-N 2.92Å; F1006-I1009 PolarHBondContact O-N 3.19Å; I1009-F1011 VanDerWaalsContact C-N 3.33Å; I1009-F1011 PolarHBondContact O-N 2.76Å; I1009-Q1012 CarbonylContact O-C 3.58Å; I1009-Q1012 PolarHBondContact O-N 3.49Å; I1009-I1013 HydrophobicContact CG2-CD1 3.71Å; I1009-I1013 HydrophobicContact CG2-CG1 4.33Å; I1009-I1013 VanDerWaalsContact O-CG1 3.25Å; I1009-I1013 WeakPolarHBondContact O-CG1 3.38Å; I1009-I1013 PolarHBondContact O-N 3.14Å
1010	K	55.7	Low	54.6	Low	47 Å²	47	83.9 Å²	83.9	20%	0.204	44%	0.438	C	S	.	.	H	α-helix	trans	-59.2	-44	177.4	-174.4	-174.8	178.5	-179.4	0	112.2	V978 D979 F1006 C1008 I1013 A1014	V978-K1010 HydrophobicContact CG1-CG 3.56Å; D979-K1010 WeakPolarHBondContact OD1-CE 3.3Å; D979-K1010 IonicContact OD1-NZ 2.75Å; D979-K1010 PolarHBondContact OD1-NZ 2.87Å; F1006-K1010 WeakPolarHBondContact O-CB 3.35Å; F1006-K1010 PolarHBondContact O-N 2.95Å; C1008-K1010 PolarHBondContact O-N 3.37Å; K1010-I1013 PolarHBondContact O-N 3.47Å; K1010-A1014 WeakPolarHBondContact O-CB 3.19Å; K1010-A1014 PolarHBondContact O-N 2.99Å
1011	F	58.1	Low	55.9	Low	120 Å²	120	78.8 Å²	78.8	53%	0.526	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-39.4	175.9	-168	-94.7	0	0	0	111.5	K1007 C1008 I1009 A1014 Y1015	K1007-F1011 VanDerWaalsContact O-CB 3.31Å; K1007-F1011 WeakPolarHBondContact O-CB 3.43Å; K1007-F1011 PolarHBondContact O-N 3.03Å; C1008-F1011 PolarHBondContact O-N 3.39Å; I1009-F1011 VanDerWaalsContact C-N 3.33Å; I1009-F1011 PolarHBondContact O-N 2.76Å; F1011-A1014 PolarHBondContact O-N 3.5Å; F1011-Y1015 VanDerWaalsContact O-CB 3.25Å; F1011-Y1015 WeakPolarHBondContact O-CB 3.47Å; F1011-Y1015 PolarHBondContact O-N 3.43Å
1012	Q	65.3	Low	57	Low	128 Å²	128	75.8 Å²	75.8	60%	0.598	39%	0.389	S	S	*	.	H	α-helix	trans	-67.8	-36	177	-167	167.5	0.2	0	0	112.2	C1008 I1009 Y1015 T1016	C1008-Q1012 VanDerWaalsContact O-CB 3.27Å; C1008-Q1012 WeakPolarHBondContact O-CB 3.49Å; C1008-Q1012 PolarHBondContact O-N 3.07Å; I1009-Q1012 CarbonylContact O-C 3.58Å; I1009-Q1012 PolarHBondContact O-N 3.49Å; Q1012-Y1015 PolarHBondContact O-N 3.12Å; Q1012-T1016 WeakPolarHBondContact O-CB 3.36Å; Q1012-T1016 VanDerWaalsContact O-CG2 3.3Å; Q1012-T1016 WeakPolarHBondContact O-CG2 3.24Å; Q1012-T1016 PolarHBondContact O-N 3.45Å; Q1012-T1016 PolarHBondContact O-OG1 3.04Å
1013	I	63.5	Low	58.3	Low	48 Å²	48	75 Å²	75	25%	0.246	38%	0.383	C	S	.	.	H	α-helix	trans	-68	-43.9	172.3	-66.4	168.8	0	0	0	110.5	V978 F982 I1009 K1010 Y1015 T1016 L1017	V978-I1013 HydrophobicContact CG1-CG2 4.41Å; V978-I1013 HydrophobicContact CG2-CG2 3.83Å; F982-I1013 HydrophobicContact CE1-CD1 4.48Å; F982-I1013 HydrophobicContact CE2-CD1 3.75Å; F982-I1013 HydrophobicContact CE2-CG2 4.3Å; F982-I1013 HydrophobicContact CZ-CD1 3.47Å; F982-I1013 VanDerWaalsContact CZ-CD1 3.47Å; I1009-I1013 HydrophobicContact CG2-CD1 3.71Å; I1009-I1013 HydrophobicContact CG2-CG1 4.33Å; I1009-I1013 VanDerWaalsContact O-CG1 3.25Å; I1009-I1013 WeakPolarHBondContact O-CG1 3.38Å; I1009-I1013 PolarHBondContact O-N 3.14Å; K1010-I1013 PolarHBondContact O-N 3.47Å; I1013-Y1015 VanDerWaalsContact C-N 3.32Å; I1013-Y1015 PolarHBondContact O-N 3.46Å; I1013-T1016 VanDerWaalsContact CA-OG1 3.29Å; I1013-T1016 WeakPolarHBondContact CA-OG1 3.45Å; I1013-T1016 PolarHBondContact O-N 2.93Å; I1013-T1016 PolarHBondContact O-OG1 3.37Å; I1013-L1017 HydrophobicContact CG2-CD1 3.86Å; I1013-L1017 VanDerWaalsContact O-CB 3.32Å; I1013-L1017 WeakPolarHBondContact O-CB 3.33Å; I1013-L1017 PolarHBondContact O-N 3.45Å
1014	A	57.1	Low	59.2	Low	9 Å²	9	71.9 Å²	71.9	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-63.5	-39.2	175.7	0	0	0	0	0	112	V978 K1010 F1011 S1018	V978-A1014 HydrophobicContact CG2-CB 4.05Å; K1010-A1014 WeakPolarHBondContact O-CB 3.19Å; K1010-A1014 PolarHBondContact O-N 2.99Å; F1011-A1014 PolarHBondContact O-N 3.5Å; A1014-S1018 WeakPolarHBondContact O-CB 3.45Å; A1014-S1018 PolarHBondContact O-N 2.87Å
1015	Y	60.5	Low	60.3	Low	99 Å²	99	69 Å²	69	39%	0.388	35%	0.348	S	S	.	.	H	α-helix	trans	-66.5	-46.6	176.2	-178.8	-95.2	0	0	0	112	F1011 Q1012 I1013 S1018 Y1019 Y1074	F1011-Y1015 VanDerWaalsContact O-CB 3.25Å; F1011-Y1015 WeakPolarHBondContact O-CB 3.47Å; F1011-Y1015 PolarHBondContact O-N 3.43Å; Q1012-Y1015 PolarHBondContact O-N 3.12Å; I1013-Y1015 VanDerWaalsContact C-N 3.32Å; I1013-Y1015 PolarHBondContact O-N 3.46Å; Y1015-S1018 WeakPolarHBondContact O-CB 3.34Å; Y1015-S1018 PolarHBondContact O-N 3Å; Y1015-Y1019 WeakPolarHBondContact O-CB 3.49Å; Y1015-Y1019 PolarHBondContact O-N 3.34Å; Y1015-Y1074 HydrophobicContact CD2-CD2 4.39Å; Y1015-Y1074 HydrophobicContact CD2-CE2 4.25Å; Y1015-Y1074 HydrophobicContact CE2-CD2 4Å; Y1015-Y1074 AromaticContact CE2-CE2 3.94Å; Y1015-Y1074 HydrophobicContact CE2-CE2 3.94Å
1016	T	65.7	Low	61.3	Low	64 Å²	64	71.7 Å²	71.7	39%	0.393	35%	0.35	S	S	.	.	H	α-helix	trans	-64.7	-40.4	176.4	46.9	0	0	0	0	111.9	Q1012 I1013 Y1019 I1020	Q1012-T1016 WeakPolarHBondContact O-CB 3.36Å; Q1012-T1016 VanDerWaalsContact O-CG2 3.3Å; Q1012-T1016 WeakPolarHBondContact O-CG2 3.24Å; Q1012-T1016 PolarHBondContact O-N 3.45Å; Q1012-T1016 PolarHBondContact O-OG1 3.04Å; I1013-T1016 VanDerWaalsContact CA-OG1 3.29Å; I1013-T1016 WeakPolarHBondContact CA-OG1 3.45Å; I1013-T1016 PolarHBondContact O-N 2.93Å; I1013-T1016 PolarHBondContact O-OG1 3.37Å; T1016-Y1019 PolarHBondContact O-N 3.08Å; T1016-I1020 WeakPolarHBondContact O-CB 3.34Å; T1016-I1020 WeakPolarHBondContact O-CD1 3.35Å; T1016-I1020 WeakPolarHBondContact O-CG1 3.22Å; T1016-I1020 PolarHBondContact O-N 3.05Å
1017	L	63	Low	62	Low	37 Å²	37	70.1 Å²	70.1	19%	0.194	35%	0.349	C	S	.	.	H	α-helix	trans	-60.4	-43.7	170.7	-86.6	157.6	0	0	0	111.9	V978 I1013 Y1019 I1020 F1021	V978-L1017 HydrophobicContact CG2-CD1 3.64Å; I1013-L1017 HydrophobicContact CG2-CD1 3.86Å; I1013-L1017 VanDerWaalsContact O-CB 3.32Å; I1013-L1017 WeakPolarHBondContact O-CB 3.33Å; I1013-L1017 PolarHBondContact O-N 3.45Å; L1017-Y1019 VanDerWaalsContact C-N 3.3Å; L1017-Y1019 PolarHBondContact O-N 3.48Å; L1017-I1020 PolarHBondContact O-N 3.3Å; L1017-F1021 HydrophobicContact CB-CE2 4.41Å; L1017-F1021 HydrophobicContact CD2-CE2 4.19Å; L1017-F1021 HydrophobicContact CD2-CZ 4.26Å; L1017-F1021 WeakPolarHBondContact O-CB 3.31Å; L1017-F1021 WeakPolarHBondContact O-CD2 3.27Å; L1017-F1021 WeakPolarHBondContact O-CG 3.48Å; L1017-F1021 PolarHBondContact O-N 2.84Å
1018	S	60.1	Low	62.5	Low	55 Å²	55	63 Å²	63	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-61.9	-39.9	175.7	-167.3	0	0	0	0	111.9	A1014 Y1015 S1022	A1014-S1018 WeakPolarHBondContact O-CB 3.45Å; A1014-S1018 PolarHBondContact O-N 2.87Å; Y1015-S1018 WeakPolarHBondContact O-CB 3.34Å; Y1015-S1018 PolarHBondContact O-N 3Å; S1018-S1022 WeakPolarHBondContact O-CB 3.48Å; S1018-S1022 PolarHBondContact O-N 3.34Å
1019	Y	65.7	Low	62.9	Low	130 Å²	130	66.2 Å²	66.2	51%	0.51	32%	0.321	S	S	.	.	H	α-helix	trans	-66.9	-45.2	176.3	-171.8	-96.4	0	0	0	111.3	Y1015 T1016 L1017 F1021 S1022 C1023	Y1015-Y1019 WeakPolarHBondContact O-CB 3.49Å; Y1015-Y1019 PolarHBondContact O-N 3.34Å; T1016-Y1019 PolarHBondContact O-N 3.08Å; L1017-Y1019 VanDerWaalsContact C-N 3.3Å; L1017-Y1019 PolarHBondContact O-N 3.48Å; Y1019-F1021 PolarHBondContact O-N 3.5Å; Y1019-S1022 WeakPolarHBondContact O-CB 3.37Å; Y1019-S1022 PolarHBondContact O-N 2.88Å; Y1019-C1023 VanDerWaalsContact CE1-SG 3.55Å; Y1019-C1023 PolarHBondContact O-N 3.39Å; Y1019-C1023 PolarHBondContact O-SG 2.89Å
1020	I	67.8	Low	63.1	Low	89 Å²	89	64.4 Å²	64.4	46%	0.456	32%	0.321	S	S	.	.	H	α-helix	trans	-59.7	-45.2	174.9	-70	163.6	0	0	0	110.6	T1016 L1017 S1022 C1023 I1024	T1016-I1020 WeakPolarHBondContact O-CB 3.34Å; T1016-I1020 WeakPolarHBondContact O-CD1 3.35Å; T1016-I1020 WeakPolarHBondContact O-CG1 3.22Å; T1016-I1020 PolarHBondContact O-N 3.05Å; L1017-I1020 PolarHBondContact O-N 3.3Å; I1020-S1022 PolarHBondContact O-N 3.47Å; I1020-C1023 WeakPolarHBondContact O-CB 3.39Å; I1020-C1023 PolarHBondContact O-N 2.95Å; I1020-I1024 HydrophobicContact CG2-CD1 3.63Å; I1020-I1024 HydrophobicContact CG2-CG1 4.35Å; I1020-I1024 WeakPolarHBondContact O-CB 3.41Å; I1020-I1024 WeakPolarHBondContact O-CD1 3.38Å; I1020-I1024 WeakPolarHBondContact O-CG1 3.26Å; I1020-I1024 PolarHBondContact O-N 2.62Å
1021	F	64.1	Low	63.5	Low	31 Å²	31	63.3 Å²	63.3	14%	0.136	32%	0.318	C	S	.	.	H	α-helix	trans	-64.8	-38.4	176.6	-72.2	-41.8	0	0	0	112.7	L964 T974 L977 L1017 Y1019 I1024 L1025	L964-F1021 HydrophobicContact CD1-CB 3.81Å; L964-F1021 HydrophobicContact CD1-CD1 3.57Å; L964-F1021 HydrophobicContact CD1-CE1 4.26Å; L964-F1021 HydrophobicContact CD1-CG 3.75Å; T974-F1021 HydrophobicContact CG2-CD2 3.86Å; T974-F1021 HydrophobicContact CG2-CE2 4.12Å; L977-F1021 HydrophobicContact CD1-CZ 4.5Å; L1017-F1021 HydrophobicContact CB-CE2 4.41Å; L1017-F1021 HydrophobicContact CD2-CE2 4.19Å; L1017-F1021 HydrophobicContact CD2-CZ 4.26Å; L1017-F1021 WeakPolarHBondContact O-CB 3.31Å; L1017-F1021 WeakPolarHBondContact O-CD2 3.27Å; L1017-F1021 WeakPolarHBondContact O-CG 3.48Å; L1017-F1021 PolarHBondContact O-N 2.84Å; Y1019-F1021 PolarHBondContact O-N 3.5Å; F1021-I1024 HydrophobicContact CD1-CD1 4.16Å; F1021-I1024 PolarHBondContact O-N 2.99Å; F1021-L1025 WeakPolarHBondContact O-CB 3.19Å; F1021-L1025 PolarHBondContact O-N 2.59Å
1022	S	61.3	Low	63.8	Low	31 Å²	31	58.2 Å²	58.2	22%	0.217	30%	0.296	C	S	.	.	H	α-helix	trans	-61.5	-47.9	172.3	-172.6	0	0	0	0	110.8	S1018 Y1019 I1020 I1024 L1025 Y1026	S1018-S1022 WeakPolarHBondContact O-CB 3.48Å; S1018-S1022 PolarHBondContact O-N 3.34Å; Y1019-S1022 WeakPolarHBondContact O-CB 3.37Å; Y1019-S1022 PolarHBondContact O-N 2.88Å; I1020-S1022 PolarHBondContact O-N 3.47Å; S1022-I1024 VanDerWaalsContact C-N 3.35Å; S1022-I1024 PolarHBondContact O-N 2.84Å; S1022-L1025 WeakPolarHBondContact O-CB 3.44Å; S1022-L1025 PolarHBondContact O-N 3.43Å; S1022-Y1026 WeakPolarHBondContact O-CD2 3.04Å; S1022-Y1026 PolarHBondContact O-N 2.88Å; S1022-Y1026 WeakPolarHBondContact OG-CE2 3.47Å
1023	C	67.9	Low	63.5	Low	50 Å²	50	54.6 Å²	54.6	34%	0.338	28%	0.284	S	S	.	.	H	α-helix	trans	-58.1	-44.8	173.8	-69.3	0	0	0	0	111.9	Y1019 I1020 L1025 Y1026 T1027	Y1019-C1023 VanDerWaalsContact CE1-SG 3.55Å; Y1019-C1023 PolarHBondContact O-N 3.39Å; Y1019-C1023 PolarHBondContact O-SG 2.89Å; I1020-C1023 WeakPolarHBondContact O-CB 3.39Å; I1020-C1023 PolarHBondContact O-N 2.95Å; C1023-L1025 VanDerWaalsContact C-N 3.32Å; C1023-L1025 PolarHBondContact O-N 3.29Å; C1023-Y1026 PolarHBondContact O-N 3.09Å; C1023-T1027 VanDerWaalsContact O-CG2 3.31Å; C1023-T1027 WeakPolarHBondContact O-CG2 3.33Å; C1023-T1027 PolarHBondContact O-N 3.41Å; C1023-T1027 PolarHBondContact O-OG1 2.92Å
1024	I	65.9	Low	63.6	Low	22 Å²	22	57.4 Å²	57.4	11%	0.113	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-42.8	177	-68.9	160.3	0	0	0	110.5	P960 L961 L964 I1020 F1021 S1022 T1027 A1028	P960-I1024 HydrophobicContact CB-CD1 3.61Å; P960-I1024 HydrophobicContact CB-CG1 4.09Å; P960-I1024 HydrophobicContact CB-CG2 4.24Å; L961-I1024 HydrophobicContact CD2-CG2 3.8Å; L961-I1024 HydrophobicContact CG-CG2 4.11Å; L964-I1024 HydrophobicContact CD2-CG2 4.19Å; I1020-I1024 HydrophobicContact CG2-CD1 3.63Å; I1020-I1024 HydrophobicContact CG2-CG1 4.35Å; I1020-I1024 WeakPolarHBondContact O-CB 3.41Å; I1020-I1024 WeakPolarHBondContact O-CD1 3.38Å; I1020-I1024 WeakPolarHBondContact O-CG1 3.26Å; I1020-I1024 PolarHBondContact O-N 2.62Å; F1021-I1024 HydrophobicContact CD1-CD1 4.16Å; F1021-I1024 PolarHBondContact O-N 2.99Å; S1022-I1024 VanDerWaalsContact C-N 3.35Å; S1022-I1024 PolarHBondContact O-N 2.84Å; I1024-T1027 VanDerWaalsContact C-OG1 3.3Å; I1024-T1027 VanDerWaalsContact CA-OG1 3.24Å; I1024-T1027 WeakPolarHBondContact CA-OG1 3.49Å; I1024-T1027 CarbonylContact O-C 3.58Å; I1024-T1027 PolarHBondContact O-N 2.82Å; I1024-T1027 VanDerWaalsContact O-N 3.17Å; I1024-T1027 PolarHBondContact O-OG1 3.29Å; I1024-A1028 PolarHBondContact O-N 2.93Å
1025	L	63.5	Low	64	Low	21 Å²	21	57 Å²	57	11%	0.11	29%	0.291	C	S	.	.	H	α-helix	trans	-63.8	-42	176.7	-165	78.4	0	0	0	111.5	L964 F1021 S1022 C1023 T1027 A1028 L1061 V1065 I1067	L964-L1025 HydrophobicContact CD2-CB 4.31Å; L964-L1025 HydrophobicContact CD2-CD1 3.89Å; F1021-L1025 WeakPolarHBondContact O-CB 3.19Å; F1021-L1025 PolarHBondContact O-N 2.59Å; S1022-L1025 WeakPolarHBondContact O-CB 3.44Å; S1022-L1025 PolarHBondContact O-N 3.43Å; C1023-L1025 VanDerWaalsContact C-N 3.32Å; C1023-L1025 PolarHBondContact O-N 3.29Å; L1025-T1027 VanDerWaalsContact C-N 3.32Å; L1025-T1027 PolarHBondContact O-N 3.21Å; L1025-A1028 WeakPolarHBondContact O-CB 3.44Å; L1025-A1028 PolarHBondContact O-N 3.01Å; L1025-A1028 VanDerWaalsContact O-N 3.13Å; L1025-L1061 HydrophobicContact CD1-CB 4.08Å; L1025-L1061 HydrophobicContact CD1-CD2 4.47Å; L1025-V1065 HydrophobicContact CD1-CB 4.03Å; L1025-V1065 HydrophobicContact CD1-CG1 4.06Å; L1025-V1065 HydrophobicContact CD1-CG2 4.33Å; L1025-V1065 HydrophobicContact CD2-CB 4.31Å; L1025-V1065 HydrophobicContact CD2-CG1 3.71Å; L1025-I1067 HydrophobicContact CD2-CG1 4.33Å
1026	Y	65.3	Low	64.1	Low	126 Å²	126	53.9 Å²	53.9	49%	0.494	28%	0.28	S	S	.	.	H	α-helix	trans	-63.5	-37.4	172	-79.8	-67.3	0	0	0	112.1	S1022 C1023 A1028 Y1029	S1022-Y1026 WeakPolarHBondContact O-CD2 3.04Å; S1022-Y1026 PolarHBondContact O-N 2.88Å; S1022-Y1026 WeakPolarHBondContact OG-CE2 3.47Å; C1023-Y1026 PolarHBondContact O-N 3.09Å; Y1026-A1028 VanDerWaalsContact C-N 3.27Å; Y1026-A1028 PolarHBondContact O-N 3.38Å; Y1026-Y1029 PolarHBondContact O-N 2.95Å
1027	T	67.3	Low	63.8	Low	67 Å²	67	52.9 Å²	52.9	41%	0.411	28%	0.276	S	S	.	.	H	α-helix	trans	-70.2	-21.8	174.2	61.6	0	0	0	0	112.6	C1023 I1024 L1025 Y1029 G1030 L1031	C1023-T1027 VanDerWaalsContact O-CG2 3.31Å; C1023-T1027 WeakPolarHBondContact O-CG2 3.33Å; C1023-T1027 PolarHBondContact O-N 3.41Å; C1023-T1027 PolarHBondContact O-OG1 2.92Å; I1024-T1027 VanDerWaalsContact C-OG1 3.3Å; I1024-T1027 VanDerWaalsContact CA-OG1 3.24Å; I1024-T1027 WeakPolarHBondContact CA-OG1 3.49Å; I1024-T1027 CarbonylContact O-C 3.58Å; I1024-T1027 PolarHBondContact O-N 2.82Å; I1024-T1027 VanDerWaalsContact O-N 3.17Å; I1024-T1027 PolarHBondContact O-OG1 3.29Å; L1025-T1027 VanDerWaalsContact C-N 3.32Å; L1025-T1027 PolarHBondContact O-N 3.21Å; T1027-Y1029 PolarHBondContact O-N 3.38Å; T1027-G1030 CarbonylContact O-C 3.6Å; T1027-G1030 WeakPolarHBondContact O-CA 3.21Å; T1027-G1030 PolarHBondContact O-N 3.4Å; T1027-L1031 VanDerWaalsContact O-CB 3.27Å; T1027-L1031 WeakPolarHBondContact O-CB 3.48Å; T1027-L1031 WeakPolarHBondContact O-CG 3.42Å; T1027-L1031 PolarHBondContact O-N 3.25Å; T1027-L1031 WeakPolarHBondContact OG1-CD1 3.49Å
1028	A	62.2	Low	64	Low	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-35	177.2	0	0	0	0	0	112.1	L961 I1024 L1025 Y1026 L1031 L1032 L1062	L961-A1028 HydrophobicContact CD2-CB 3.71Å; I1024-A1028 PolarHBondContact O-N 2.93Å; L1025-A1028 WeakPolarHBondContact O-CB 3.44Å; L1025-A1028 PolarHBondContact O-N 3.01Å; L1025-A1028 VanDerWaalsContact O-N 3.13Å; Y1026-A1028 VanDerWaalsContact C-N 3.27Å; Y1026-A1028 PolarHBondContact O-N 3.38Å; A1028-L1031 PolarHBondContact O-N 2.93Å; A1028-L1032 PolarHBondContact O-N 3.37Å; A1028-L1062 HydrophobicContact CB-CD2 4.44Å
1029	Y	60.5	Low	64	Low	138 Å²	138	49.5 Å²	49.5	54%	0.541	25%	0.252	S	S	.	.	H	α-helix	trans	-62.9	-41.7	171.9	-77.2	-83.6	0	0	0	112.4	Y1026 T1027 L1062	Y1026-Y1029 PolarHBondContact O-N 2.95Å; T1027-Y1029 PolarHBondContact O-N 3.38Å; Y1029-L1062 HydrophobicContact CD1-CD2 3.68Å; Y1029-L1062 HydrophobicContact CD2-CD2 3.5Å; Y1029-L1062 VanDerWaalsContact CD2-CD2 3.5Å; Y1029-L1062 HydrophobicContact CE1-CD2 3.51Å; Y1029-L1062 HydrophobicContact CE2-CD2 3.31Å; Y1029-L1062 HydrophobicContact CG-CD2 3.67Å
1030	G	63.9	Low	63.6	Low	40 Å²	40	47.6 Å²	47.6	41%	0.412	25%	0.247	S	C	.	.	H	α-helix	trans	-79.8	-20.9	177.7	0	0	0	0	0	114.4	T1027 P1033 F1034	T1027-G1030 CarbonylContact O-C 3.6Å; T1027-G1030 WeakPolarHBondContact O-CA 3.21Å; T1027-G1030 PolarHBondContact O-N 3.4Å; G1030-P1033 WeakPolarHBondContact O-CD 3.19Å; G1030-F1034 VanDerWaalsContact O-CD2 3.25Å; G1030-F1034 WeakPolarHBondContact O-CD2 3.46Å
1031	L	65.5	Low	63.3	Low	24 Å²	24	44.3 Å²	44.3	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-90.1	-13.1	-177.5	-73.1	167	0	0	0	113.5	L961 T1027 A1028 F1034 C1035	L961-L1031 HydrophobicContact CD1-CB 4.29Å; L961-L1031 HydrophobicContact CD1-CD1 3.68Å; L961-L1031 HydrophobicContact CG-CD1 4.39Å; T1027-L1031 VanDerWaalsContact O-CB 3.27Å; T1027-L1031 WeakPolarHBondContact O-CB 3.48Å; T1027-L1031 WeakPolarHBondContact O-CG 3.42Å; T1027-L1031 PolarHBondContact O-N 3.25Å; T1027-L1031 WeakPolarHBondContact OG1-CD1 3.49Å; A1028-L1031 PolarHBondContact O-N 2.93Å; L1031-F1034 HydrophobicContact CD2-CB 4.19Å; L1031-F1034 HydrophobicContact CD2-CD2 4.04Å; L1031-F1034 HydrophobicContact CD2-CG 4.39Å; L1031-F1034 CarbonylContact O-C 3.6Å; L1031-F1034 WeakPolarHBondContact O-CA 3.12Å; L1031-F1034 WeakPolarHBondContact O-CB 3.35Å; L1031-F1034 PolarHBondContact O-N 3.28Å; L1031-C1035 PolarHBondContact O-N 3.43Å; L1031-C1035 PolarHBondContact O-SG 2.87Å
1032	L	63.3	Low	63.1	Low	14 Å²	14	43 Å²	43	7%	0.073	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-43.5	175.7	-153.6	132.1	0	0	0	112.9	A1028 F1034 C1035 I1036 F1055 C1058 L1062	A1028-L1032 PolarHBondContact O-N 3.37Å; L1032-F1034 VanDerWaalsContact C-N 3.26Å; L1032-F1034 PolarHBondContact O-N 2.76Å; L1032-C1035 PolarHBondContact O-N 3.19Å; L1032-I1036 HydrophobicContact CD2-CD1 4.47Å; L1032-I1036 PolarHBondContact O-N 2.93Å; L1032-F1055 HydrophobicContact CD2-CD2 4.42Å; L1032-F1055 HydrophobicContact CD2-CE2 3.79Å; L1032-F1055 HydrophobicContact CG-CD2 4.29Å; L1032-F1055 HydrophobicContact CG-CE2 4.09Å; L1032-C1058 HydrophobicContact CD1-CB 4.22Å; L1032-L1062 HydrophobicContact CD1-CD1 3.44Å; L1032-L1062 VanDerWaalsContact CD1-CD1 3.44Å
1033	P	59.6	Low	62.9	Low	52 Å²	52	42.3 Å²	42.3	34%	0.338	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-29.5	168.9	-17	30.5	0	0	0	113	Y11 G1030 I1036 S1037	Y11-P1033 HydrophobicContact CD2-CG 4.24Å; Y11-P1033 HydrophobicContact CE2-CG 4.38Å; G1030-P1033 WeakPolarHBondContact O-CD 3.19Å; P1033-I1036 PolarHBondContact O-N 2.93Å; P1033-S1037 WeakPolarHBondContact O-CB 3.1Å; P1033-S1037 PolarHBondContact O-N 3.48Å; P1033-S1037 PolarHBondContact O-OG 3.4Å
1034	F	65.4	Low	62.2	Low	106 Å²	106	41.7 Å²	41.7	47%	0.465	22%	0.218	S	C	.	.	H	α-helix	trans	-71.3	-33	175.3	-75.6	-68.9	0	0	0	112.4	L954 G1030 L1031 L1032 S1037 Y1038	L954-F1034 HydrophobicContact CD2-CB 3.7Å; L954-F1034 HydrophobicContact CD2-CD1 3.68Å; L954-F1034 HydrophobicContact CD2-CG 4.06Å; G1030-F1034 VanDerWaalsContact O-CD2 3.25Å; G1030-F1034 WeakPolarHBondContact O-CD2 3.46Å; L1031-F1034 HydrophobicContact CD2-CB 4.19Å; L1031-F1034 HydrophobicContact CD2-CD2 4.04Å; L1031-F1034 HydrophobicContact CD2-CG 4.39Å; L1031-F1034 CarbonylContact O-C 3.6Å; L1031-F1034 WeakPolarHBondContact O-CA 3.12Å; L1031-F1034 WeakPolarHBondContact O-CB 3.35Å; L1031-F1034 PolarHBondContact O-N 3.28Å; L1032-F1034 VanDerWaalsContact C-N 3.26Å; L1032-F1034 PolarHBondContact O-N 2.76Å; F1034-S1037 WeakPolarHBondContact CA-OG 3.21Å; F1034-S1037 PolarHBondContact O-OG 3.19Å; F1034-S1037 VanDerWaalsContact O-OG 3.11Å; F1034-Y1038 WeakPolarHBondContact O-CB 3.35Å; F1034-Y1038 PolarHBondContact O-N 2.96Å
1035	C	64.9	Low	61.6	Low	2 Å²	2	46.1 Å²	46.1	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-66.5	-39.6	171.8	-60.6	0	0	0	0	111.7	L958 L1031 L1032 W1039 F1055	L958-C1035 WeakPolarHBondContact CD2-SG 3.14Å; L1031-C1035 PolarHBondContact O-N 3.43Å; L1031-C1035 PolarHBondContact O-SG 2.87Å; L1032-C1035 PolarHBondContact O-N 3.19Å; C1035-W1039 PolarHBondContact O-N 2.83Å; C1035-F1055 HydrophobicContact CB-CB 4.15Å; C1035-F1055 HydrophobicContact CB-CD2 4.47Å
1036	I	62.3	Low	61.1	Low	32 Å²	32	45.8 Å²	45.8	16%	0.164	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-45.7	176.4	-64.6	168.4	0	0	0	110.2	L85 L1032 P1033 W1039 F1040 F1055	L85-I1036 HydrophobicContact CD2-CG2 3.97Å; L1032-I1036 HydrophobicContact CD2-CD1 4.47Å; L1032-I1036 PolarHBondContact O-N 2.93Å; P1033-I1036 PolarHBondContact O-N 2.93Å; I1036-W1039 WeakPolarHBondContact O-CB 3.47Å; I1036-W1039 PolarHBondContact O-N 3.47Å; I1036-W1039 VanDerWaalsContact O-N 3.16Å; I1036-F1040 HydrophobicContact CG2-CD2 4.31Å; I1036-F1040 HydrophobicContact CG2-CE2 3.9Å; I1036-F1040 WeakPolarHBondContact O-CD2 3.19Å; I1036-F1040 PolarHBondContact O-N 2.94Å; I1036-F1055 HydrophobicContact CD1-CE2 4.34Å; I1036-F1055 HydrophobicContact CG1-CD2 4.32Å; I1036-F1055 HydrophobicContact CG1-CE2 4.32Å
1037	S	61.1	Low	60.8	Low	43 Å²	43	39.8 Å²	39.8	30%	0.301	22%	0.217	S	C	.	.	H	α-helix	trans	-67.9	-34.5	176.3	52.6	0	0	0	0	113.1	P1033 F1034 W1039 F1040 V1041	P1033-S1037 WeakPolarHBondContact O-CB 3.1Å; P1033-S1037 PolarHBondContact O-N 3.48Å; P1033-S1037 PolarHBondContact O-OG 3.4Å; F1034-S1037 WeakPolarHBondContact CA-OG 3.21Å; F1034-S1037 PolarHBondContact O-OG 3.19Å; F1034-S1037 VanDerWaalsContact O-OG 3.11Å; S1037-W1039 PolarHBondContact O-N 3.42Å; S1037-F1040 CarbonylContact O-C 3.59Å; S1037-F1040 WeakPolarHBondContact O-CB 3.33Å; S1037-F1040 PolarHBondContact O-N 2.91Å; S1037-V1041 VanDerWaalsContact O-CG2 3.29Å; S1037-V1041 WeakPolarHBondContact O-CG2 3.47Å; S1037-V1041 PolarHBondContact O-N 3.14Å
1038	Y	65.8	Low	60.5	Low	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-34	170.8	-174.7	-103.6	0	0	0	112	E951 L954 T955 L958 F1034 V1041 A1042 S1047 F1050	E951-Y1038 HydrophobicContact CG-CD2 4.47Å; E951-Y1038 HydrophobicContact CG-CE2 3.74Å; E951-Y1038 VanDerWaalsContact O-CE2 3.29Å; E951-Y1038 WeakPolarHBondContact O-CE2 3.28Å; L954-Y1038 HydrophobicContact CB-CD2 3.24Å; L954-Y1038 HydrophobicContact CB-CE2 3.77Å; L954-Y1038 HydrophobicContact CB-CG 4.18Å; L954-Y1038 HydrophobicContact CD1-CD2 3.82Å; L954-Y1038 HydrophobicContact CD1-CG 4.45Å; L954-Y1038 HydrophobicContact CG-CD2 4.1Å; T955-Y1038 WeakPolarHBondContact OG1-CE2 3.28Å; T955-Y1038 PolarHBondContact OG1-OH 2.82Å; L958-Y1038 HydrophobicContact CD1-CG 4.46Å; F1034-Y1038 WeakPolarHBondContact O-CB 3.35Å; F1034-Y1038 PolarHBondContact O-N 2.96Å; Y1038-V1041 CarbonylContact O-C 3.49Å; Y1038-V1041 PolarHBondContact O-N 3.48Å; Y1038-V1041 VanDerWaalsContact O-N 3.15Å; Y1038-A1042 PolarHBondContact O-N 3.43Å; Y1038-S1047 WeakPolarHBondContact CE1-O 3.37Å; Y1038-F1050 HydrophobicContact CD1-CD1 4.47Å; Y1038-F1050 HydrophobicContact CE1-CB 4.28Å; Y1038-F1050 AromaticContact CE1-CD1 3.57Å; Y1038-F1050 HydrophobicContact CE1-CD1 3.57Å; Y1038-F1050 HydrophobicContact CE1-CE1 4.46Å; Y1038-F1050 HydrophobicContact CE1-CG 4.4Å; Y1038-F1050 AromaticContact CZ-CD1 3.77Å
1039	W	61.2	Low	60.3	Low	22 Å²	22	39 Å²	39	8%	0.083	21%	0.211	C	C	.	.	H	α-helix	trans	-66.7	-37.5	176.3	-151.5	20.3	0	0	0	113.5	L81 L84 L85 C1035 I1036 S1037 V1041 A1042 L1052	L81-W1039 HydrophobicContact CB-CH2 4.19Å; L81-W1039 HydrophobicContact CB-CZ2 4.3Å; L81-W1039 HydrophobicContact CD1-CH2 4.16Å; L81-W1039 HydrophobicContact CD1-CZ2 3.42Å; L81-W1039 VanDerWaalsContact CD1-CZ2 3.42Å; L81-W1039 HydrophobicContact CD2-CD2 3.4Å; L81-W1039 HydrophobicContact CD2-CE3 3.63Å; L81-W1039 HydrophobicContact CD2-CG 4.25Å; L81-W1039 HydrophobicContact CD2-CH2 3.35Å; L81-W1039 HydrophobicContact CD2-CZ2 3.11Å; L81-W1039 HydrophobicContact CD2-CZ3 3.57Å; L81-W1039 HydrophobicContact CG-CD2 4.26Å; L81-W1039 VanDerWaalsContact CG-CE2 3.48Å; L81-W1039 HydrophobicContact CG-CE3 4.45Å; L81-W1039 HydrophobicContact CG-CH2 3.22Å; L81-W1039 HydrophobicContact CG-CZ2 2.97Å; L81-W1039 HydrophobicContact CG-CZ3 3.96Å; L84-W1039 HydrophobicContact CD2-CH2 4.24Å; L85-W1039 HydrophobicContact CB-CZ3 4.35Å; L85-W1039 HydrophobicContact CD1-CE3 3.48Å; L85-W1039 VanDerWaalsContact CD1-CE3 3.48Å; L85-W1039 HydrophobicContact CD1-CZ3 3.35Å; L85-W1039 HydrophobicContact CG-CE3 4.17Å; L85-W1039 HydrophobicContact CG-CZ3 3.68Å; C1035-W1039 PolarHBondContact O-N 2.83Å; I1036-W1039 WeakPolarHBondContact O-CB 3.47Å; I1036-W1039 PolarHBondContact O-N 3.47Å; I1036-W1039 VanDerWaalsContact O-N 3.16Å; S1037-W1039 PolarHBondContact O-N 3.42Å; W1039-V1041 PolarHBondContact O-N 3.45Å; W1039-A1042 WeakPolarHBondContact O-CB 3.43Å; W1039-L1052 HydrophobicContact CZ2-CD1 3.9Å
1040	F	57.5	Low	60.5	Low	89 Å²	89	32.7 Å²	32.7	39%	0.39	19%	0.187	S	C	.	.	H	α-helix	trans	-74.6	-16.3	173.3	-72.8	-78	0	0	0	112.9	Y82 L85 Y947 I1036 S1037	Y82-F1040 HydrophobicContact CE1-CE1 4Å; Y82-F1040 HydrophobicContact CE1-CZ 4.42Å; L85-F1040 HydrophobicContact CD1-CE2 4.07Å; L85-F1040 HydrophobicContact CD1-CZ 4Å; Y947-F1040 PolarHBondContact OH-O 3.49Å; I1036-F1040 HydrophobicContact CG2-CD2 4.31Å; I1036-F1040 HydrophobicContact CG2-CE2 3.9Å; I1036-F1040 WeakPolarHBondContact O-CD2 3.19Å; I1036-F1040 PolarHBondContact O-N 2.94Å; S1037-F1040 CarbonylContact O-C 3.59Å; S1037-F1040 WeakPolarHBondContact O-CB 3.33Å; S1037-F1040 PolarHBondContact O-N 2.91Å
1041	V	61.1	Low	60.4	Low	20 Å²	20	30.9 Å²	30.9	12%	0.121	17%	0.168	C	C	.	.	H	α-helix	trans	-98.2	-9.6	178.7	-178.9	0	0	0	0	112.3	Y947 S950 E951 S1037 Y1038 W1039 S1043	Y947-V1041 HydrophobicContact CD1-CG1 4.07Å; Y947-V1041 HydrophobicContact CD2-CG1 4.09Å; Y947-V1041 HydrophobicContact CD2-CG2 4.36Å; Y947-V1041 HydrophobicContact CE1-CG1 4.01Å; Y947-V1041 WeakPolarHBondContact CE1-O 3.26Å; Y947-V1041 HydrophobicContact CE2-CB 4.11Å; Y947-V1041 HydrophobicContact CE2-CG1 4.02Å; Y947-V1041 HydrophobicContact CE2-CG2 3.95Å; Y947-V1041 HydrophobicContact CG-CG1 4.16Å; Y947-V1041 WeakPolarHBondContact O-CG1 3.17Å; Y947-V1041 WeakPolarHBondContact OH-CA 3.24Å; Y947-V1041 PolarHBondContact OH-O 3.1Å; S950-V1041 VanDerWaalsContact OG-CG1 3.3Å; S950-V1041 WeakPolarHBondContact OG-CG1 3.27Å; E951-V1041 HydrophobicContact CB-CG1 3.9Å; S1037-V1041 VanDerWaalsContact O-CG2 3.29Å; S1037-V1041 WeakPolarHBondContact O-CG2 3.47Å; S1037-V1041 PolarHBondContact O-N 3.14Å; Y1038-V1041 CarbonylContact O-C 3.49Å; Y1038-V1041 PolarHBondContact O-N 3.48Å; Y1038-V1041 VanDerWaalsContact O-N 3.15Å; W1039-V1041 PolarHBondContact O-N 3.45Å; V1041-S1043 PolarHBondContact O-N 3.09Å; V1041-S1043 VanDerWaalsContact O-N 3.15Å
1042	A	59.9	Low	60.3	Low	5 Å²	5	32.8 Å²	32.8	4%	0.041	18%	0.178	C	C	.	.			trans	-60.7	116.7	-173.8	0	0	0	0	0	112.2	Y1038 W1039 S1044 S1047 A1048	Y1038-A1042 PolarHBondContact O-N 3.43Å; W1039-A1042 WeakPolarHBondContact O-CB 3.43Å; A1042-S1044 VanDerWaalsContact C-N 3.31Å; A1042-S1047 WeakPolarHBondContact CA-OG 3.32Å; A1042-S1047 WeakPolarHBondContact CB-OG 3.2Å; A1042-A1048 HydrophobicContact CB-CB 4.14Å
1043	S	56.1	Low	60.2	Low	15 Å²	15	34 Å²	34	11%	0.105	18%	0.182	C	C	.	.	S	Bend	trans	-80.9	-10.3	177.2	61.9	0	0	0	0	113.9	P922 E951 V1041 S1047	P922-S1043 WeakPolarHBondContact CD-OG 3.32Å; E951-S1043 VanDerWaalsContact CD-OG 3.23Å; E951-S1043 PolarHBondContact OE1-N 3.3Å; E951-S1043 PolarHBondContact OE1-OG 3.11Å; E951-S1043 WeakPolarHBondContact OE2-CB 3.43Å; E951-S1043 PolarHBondContact OE2-OG 3.26Å; V1041-S1043 PolarHBondContact O-N 3.09Å; V1041-S1043 VanDerWaalsContact O-N 3.15Å; S1043-S1047 PolarHBondContact N-OG 2.93Å
1044	S	54.3	Low	60.6	Low	38 Å²	38	31.6 Å²	31.6	27%	0.266	17%	0.166	S	C	.	.	S	Bend	trans	-148.1	161.5	-175.8	69.3	0	0	0	0	112.7	A1042 A1046 S1047 A1048	A1042-S1044 VanDerWaalsContact C-N 3.31Å; S1044-A1046 PolarHBondContact O-N 3.08Å; S1044-A1046 PolarHBondContact OG-N 2.94Å; S1044-S1047 PolarHBondContact N-OG 2.9Å; S1044-S1047 VanDerWaalsContact N-OG 3.09Å; S1044-S1047 PolarHBondContact O-N 3.33Å; S1044-S1047 PolarHBondContact O-OG 3.46Å; S1044-S1047 PolarHBondContact OG-N 3.19Å; S1044-S1047 VanDerWaalsContact OG-N 3.13Å; S1044-S1047 PolarHBondContact OG-OG 2.97Å; S1044-S1047 VanDerWaalsContact OG-OG 3.09Å; S1044-A1048 PolarHBondContact O-N 2.98Å
1045	L	52.8	Low	60.6	Low	115 Å²	115	28.4 Å²	28.4	60%	0.602	15%	0.152	S	C	*	.	H	α-helix	trans	-56.1	-34.1	170.2	-177.1	69.3	0	0	0	111.6	A1048 I1049	L1045-A1048 PolarHBondContact O-N 3.26Å; L1045-I1049 HydrophobicContact CD1-CD1 4.45Å; L1045-I1049 HydrophobicContact CD2-CD1 4.42Å; L1045-I1049 HydrophobicContact CG-CD1 3.92Å; L1045-I1049 HydrophobicContact CG-CG1 4.46Å; L1045-I1049 VanDerWaalsContact O-CG1 3.23Å; L1045-I1049 WeakPolarHBondContact O-CG1 3.44Å; L1045-I1049 PolarHBondContact O-N 3.26Å
1046	A	53.5	Low	60.5	Low	13 Å²	13	32.3 Å²	32.3	11%	0.107	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-43.5	178.6	0	0	0	0	0	112.4	I880 S1044 I1049 F1050	I880-A1046 HydrophobicContact CD1-CB 3.45Å; I880-A1046 VanDerWaalsContact CD1-CB 3.45Å; I880-A1046 HydrophobicContact CG2-CB 4.45Å; S1044-A1046 PolarHBondContact O-N 3.08Å; S1044-A1046 PolarHBondContact OG-N 2.94Å; A1046-I1049 PolarHBondContact O-N 2.94Å; A1046-F1050 WeakPolarHBondContact O-CB 3.34Å; A1046-F1050 PolarHBondContact O-N 2.66Å
1047	S	59.1	Low	60.6	Low	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-70.7	-34.2	174.6	46.8	0	0	0	0	111.9	E951 Y1038 A1042 S1043 S1044 I1049 F1050 G1051	E951-S1047 WeakPolarHBondContact OE1-CB 3.31Å; E951-S1047 PolarHBondContact OE1-OG 3.37Å; Y1038-S1047 WeakPolarHBondContact CE1-O 3.37Å; A1042-S1047 WeakPolarHBondContact CA-OG 3.32Å; A1042-S1047 WeakPolarHBondContact CB-OG 3.2Å; S1043-S1047 PolarHBondContact N-OG 2.93Å; S1044-S1047 PolarHBondContact N-OG 2.9Å; S1044-S1047 VanDerWaalsContact N-OG 3.09Å; S1044-S1047 PolarHBondContact O-N 3.33Å; S1044-S1047 PolarHBondContact O-OG 3.46Å; S1044-S1047 PolarHBondContact OG-N 3.19Å; S1044-S1047 VanDerWaalsContact OG-N 3.13Å; S1044-S1047 PolarHBondContact OG-OG 2.97Å; S1044-S1047 VanDerWaalsContact OG-OG 3.09Å; S1047-I1049 PolarHBondContact O-N 2.94Å; S1047-F1050 PolarHBondContact O-N 3Å; S1047-G1051 PolarHBondContact O-N 3.21Å
1048	A	60	Low	60.8	Low	9 Å²	9	28.8 Å²	28.8	7%	0.074	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-42.8	172	0	0	0	0	0	112.5	A1042 S1044 L1045 G1051 L1052	A1042-A1048 HydrophobicContact CB-CB 4.14Å; S1044-A1048 PolarHBondContact O-N 2.98Å; L1045-A1048 PolarHBondContact O-N 3.26Å; A1048-G1051 PolarHBondContact O-N 2.92Å; A1048-L1052 PolarHBondContact O-N 2.82Å
1049	I	59.6	Low	60.7	Low	42 Å²	42	30.2 Å²	30.2	22%	0.215	16%	0.16	C	C	.	.	H	α-helix	trans	-66.3	-41.5	175.4	-66.3	165.1	0	0	0	110.8	F145 F884 L1045 A1046 S1047 G1051 L1052 Y1053	F145-I1049 HydrophobicContact CE1-CG2 4.32Å; F884-I1049 HydrophobicContact CE1-CG2 3.98Å; F884-I1049 HydrophobicContact CE2-CG2 3.91Å; F884-I1049 HydrophobicContact CZ-CB 4.41Å; F884-I1049 HydrophobicContact CZ-CG2 3.38Å; L1045-I1049 HydrophobicContact CD1-CD1 4.45Å; L1045-I1049 HydrophobicContact CD2-CD1 4.42Å; L1045-I1049 HydrophobicContact CG-CD1 3.92Å; L1045-I1049 HydrophobicContact CG-CG1 4.46Å; L1045-I1049 VanDerWaalsContact O-CG1 3.23Å; L1045-I1049 WeakPolarHBondContact O-CG1 3.44Å; L1045-I1049 PolarHBondContact O-N 3.26Å; A1046-I1049 PolarHBondContact O-N 2.94Å; S1047-I1049 PolarHBondContact O-N 2.94Å; I1049-G1051 VanDerWaalsContact C-N 3.33Å; I1049-G1051 PolarHBondContact O-N 3.47Å; I1049-L1052 PolarHBondContact O-N 3.49Å; I1049-Y1053 VanDerWaalsContact O-CB 3.31Å; I1049-Y1053 WeakPolarHBondContact O-CB 3.36Å; I1049-Y1053 PolarHBondContact O-N 3.4Å
1050	F	62.7	Low	60.7	Low	6 Å²	6	30.7 Å²	30.7	3%	0.026	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-40.2	175.5	-176.7	-95.2	0	0	0	111.9	L913 T955 L958 H962 Y1038 A1046 S1047 Y1053 S1054	L913-F1050 HydrophobicContact CD2-CD2 3.61Å; L913-F1050 HydrophobicContact CD2-CE2 4.05Å; T955-F1050 HydrophobicContact CG2-CD1 4.37Å; T955-F1050 HydrophobicContact CG2-CE1 3.83Å; T955-F1050 HydrophobicContact CG2-CZ 4Å; L958-F1050 HydrophobicContact CB-CE1 4Å; L958-F1050 HydrophobicContact CB-CZ 4.24Å; L958-F1050 HydrophobicContact CD1-CE1 4.01Å; H962-F1050 AromaticContact CE1-CE2 3.76Å; H962-F1050 AromaticContact CE1-CZ 3.61Å; H962-F1050 AromaticContact NE2-CE2 3.72Å; Y1038-F1050 HydrophobicContact CD1-CD1 4.47Å; Y1038-F1050 HydrophobicContact CE1-CB 4.28Å; Y1038-F1050 AromaticContact CE1-CD1 3.57Å; Y1038-F1050 HydrophobicContact CE1-CD1 3.57Å; Y1038-F1050 HydrophobicContact CE1-CE1 4.46Å; Y1038-F1050 HydrophobicContact CE1-CG 4.4Å; Y1038-F1050 AromaticContact CZ-CD1 3.77Å; A1046-F1050 WeakPolarHBondContact O-CB 3.34Å; A1046-F1050 PolarHBondContact O-N 2.66Å; S1047-F1050 PolarHBondContact O-N 3Å; F1050-Y1053 PolarHBondContact O-N 3.28Å; F1050-S1054 WeakPolarHBondContact O-CB 3.39Å; F1050-S1054 PolarHBondContact O-N 3Å; F1050-S1054 PolarHBondContact O-OG 2.89Å
1051	G	63.2	Low	60.8	Low	2 Å²	2	26.5 Å²	26.5	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-61.9	-46.2	174.8	0	0	0	0	0	112.9	S1047 A1048 I1049 S1054 F1055	S1047-G1051 PolarHBondContact O-N 3.21Å; A1048-G1051 PolarHBondContact O-N 2.92Å; I1049-G1051 VanDerWaalsContact C-N 3.33Å; I1049-G1051 PolarHBondContact O-N 3.47Å; G1051-S1054 WeakPolarHBondContact O-CB 3.4Å; G1051-S1054 PolarHBondContact O-N 3.04Å; G1051-F1055 WeakPolarHBondContact O-CB 2.8Å; G1051-F1055 PolarHBondContact O-N 3.37Å
1052	L	62.5	Low	60.9	Low	64 Å²	64	27.6 Å²	27.6	34%	0.335	15%	0.149	S	C	.	.	H	α-helix	trans	-65.5	-40.5	176.9	-174.1	142	0	0	0	111.9	L84 W1039 A1048 I1049 F1055 I1056	L84-L1052 HydrophobicContact CD2-CD1 4.37Å; W1039-L1052 HydrophobicContact CZ2-CD1 3.9Å; A1048-L1052 PolarHBondContact O-N 2.82Å; I1049-L1052 PolarHBondContact O-N 3.49Å; L1052-F1055 WeakPolarHBondContact O-CB 3.46Å; L1052-F1055 PolarHBondContact O-N 3.02Å; L1052-I1056 HydrophobicContact CD2-CD1 3.58Å; L1052-I1056 HydrophobicContact CD2-CG1 4.42Å; L1052-I1056 WeakPolarHBondContact O-CG1 3.4Å; L1052-I1056 PolarHBondContact O-N 3.31Å
1053	Y	62.4	Low	60.8	Low	39 Å²	39	33.3 Å²	33.3	15%	0.153	18%	0.178	C	C	.	.	H	α-helix	trans	-63.9	-43.4	174.8	178.3	-132.4	0	0	0	111.9	W887 H962 I1049 F1050 F1055 I1056 I1057	W887-Y1053 AromaticContact CH2-CE1 3.79Å; W887-Y1053 HydrophobicContact CH2-CE1 3.79Å; W887-Y1053 AromaticContact CH2-CZ 3.82Å; W887-Y1053 VanDerWaalsContact CH2-OH 3.26Å; W887-Y1053 WeakPolarHBondContact CH2-OH 3.1Å; W887-Y1053 HydrophobicContact CZ2-CE1 4.37Å; W887-Y1053 AromaticContact CZ3-CE1 3.93Å; W887-Y1053 HydrophobicContact CZ3-CE1 3.93Å; W887-Y1053 HydrophobicContact CZ3-CE2 4.49Å; W887-Y1053 AromaticContact CZ3-CZ 3.51Å; W887-Y1053 WeakPolarHBondContact CZ3-OH 3.08Å; H962-Y1053 AromaticContact CD2-CD1 3.68Å; H962-Y1053 AromaticContact CD2-CE1 3.18Å; H962-Y1053 WeakPolarHBondContact CD2-CE1 3.48Å; H962-Y1053 AromaticContact CD2-CZ 3.89Å; H962-Y1053 AromaticContact NE2-CD1 3.28Å; H962-Y1053 VanDerWaalsContact NE2-CD1 3.28Å; H962-Y1053 WeakPolarHBondContact NE2-CD1 3.28Å; H962-Y1053 AromaticContact NE2-CE1 3.35Å; H962-Y1053 WeakPolarHBondContact NE2-CE1 3.14Å; I1049-Y1053 VanDerWaalsContact O-CB 3.31Å; I1049-Y1053 WeakPolarHBondContact O-CB 3.36Å; I1049-Y1053 PolarHBondContact O-N 3.4Å; F1050-Y1053 PolarHBondContact O-N 3.28Å; Y1053-F1055 VanDerWaalsContact C-N 3.31Å; Y1053-F1055 PolarHBondContact O-N 2.95Å; Y1053-I1056 PolarHBondContact O-N 2.74Å; Y1053-I1057 HydrophobicContact CD1-CD1 3.94Å; Y1053-I1057 HydrophobicContact CD2-CD1 4.07Å; Y1053-I1057 HydrophobicContact CD2-CG1 4.18Å; Y1053-I1057 HydrophobicContact CE1-CD1 3.51Å; Y1053-I1057 HydrophobicContact CE2-CD1 3.54Å; Y1053-I1057 HydrophobicContact CE2-CG1 3.64Å; Y1053-I1057 HydrophobicContact CG-CD1 4.19Å; Y1053-I1057 WeakPolarHBondContact O-CG1 3.32Å; Y1053-I1057 PolarHBondContact O-N 3.28Å; Y1053-I1057 WeakPolarHBondContact OH-CD1 3.44Å
1054	S	67.5	Low	60.7	Low	1 Å²	1	38.4 Å²	38.4	1%	0.007	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-41.2	174.8	-57.5	0	0	0	0	111.7	H962 F1050 G1051 I1057 C1058	H962-S1054 PolarHBondContact CE1-OG 3.48Å; F1050-S1054 WeakPolarHBondContact O-CB 3.39Å; F1050-S1054 PolarHBondContact O-N 3Å; F1050-S1054 PolarHBondContact O-OG 2.89Å; G1051-S1054 WeakPolarHBondContact O-CB 3.4Å; G1051-S1054 PolarHBondContact O-N 3.04Å; S1054-I1057 PolarHBondContact O-N 3.43Å; S1054-C1058 WeakPolarHBondContact O-CB 3.38Å; S1054-C1058 PolarHBondContact O-N 2.84Å; S1054-C1058 PolarHBondContact O-SG 2.87Å
1055	F	65.4	Low	60.6	Low	40 Å²	40	38.5 Å²	38.5	18%	0.175	19%	0.194	C	C	.	.	H	α-helix	trans	-60.8	-48.2	174.1	179.6	-95.5	0	0	0	111.6	L1032 C1035 I1036 G1051 L1052 Y1053 I1057 C1058 S1059	L1032-F1055 HydrophobicContact CD2-CD2 4.42Å; L1032-F1055 HydrophobicContact CD2-CE2 3.79Å; L1032-F1055 HydrophobicContact CG-CD2 4.29Å; L1032-F1055 HydrophobicContact CG-CE2 4.09Å; C1035-F1055 HydrophobicContact CB-CB 4.15Å; C1035-F1055 HydrophobicContact CB-CD2 4.47Å; I1036-F1055 HydrophobicContact CD1-CE2 4.34Å; I1036-F1055 HydrophobicContact CG1-CD2 4.32Å; I1036-F1055 HydrophobicContact CG1-CE2 4.32Å; G1051-F1055 WeakPolarHBondContact O-CB 2.8Å; G1051-F1055 PolarHBondContact O-N 3.37Å; L1052-F1055 WeakPolarHBondContact O-CB 3.46Å; L1052-F1055 PolarHBondContact O-N 3.02Å; Y1053-F1055 VanDerWaalsContact C-N 3.31Å; Y1053-F1055 PolarHBondContact O-N 2.95Å; F1055-I1057 VanDerWaalsContact C-N 3.31Å; F1055-I1057 PolarHBondContact O-N 2.89Å; F1055-C1058 PolarHBondContact O-N 3.48Å; F1055-S1059 PolarHBondContact O-N 3.03Å; F1055-S1059 PolarHBondContact O-OG 3.2Å; F1055-S1059 VanDerWaalsContact O-OG 3.07Å
1056	I	63.2	Low	60.1	Low	83 Å²	83	39.5 Å²	39.5	43%	0.426	20%	0.199	S	C	.	.	H	α-helix	trans	-59.8	-41.4	176.7	-68.2	169.2	0	0	0	111.2	L1052 Y1053 S1059 Y1060	L1052-I1056 HydrophobicContact CD2-CD1 3.58Å; L1052-I1056 HydrophobicContact CD2-CG1 4.42Å; L1052-I1056 WeakPolarHBondContact O-CG1 3.4Å; L1052-I1056 PolarHBondContact O-N 3.31Å; Y1053-I1056 PolarHBondContact O-N 2.74Å; I1056-S1059 PolarHBondContact O-N 3.32Å; I1056-Y1060 WeakPolarHBondContact O-CB 3.45Å; I1056-Y1060 PolarHBondContact O-N 3.07Å
1057	I	64.6	Low	59.2	Low	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-48.2	176.6	-72	165.6	0	0	0	111.1	L961 H962 F965 Y1053 S1054 F1055 S1059 Y1060 L1061	L961-I1057 HydrophobicContact CB-CG2 4.33Å; H962-I1057 HydrophobicContact CB-CD1 4.34Å; H962-I1057 WeakPolarHBondContact CD2-CD1 3.49Å; H962-I1057 WeakPolarHBondContact NE2-CD1 3.23Å; F965-I1057 HydrophobicContact CB-CG1 4.34Å; F965-I1057 HydrophobicContact CB-CG2 3.65Å; F965-I1057 HydrophobicContact CD1-CG1 4.21Å; F965-I1057 HydrophobicContact CD2-CG1 4.28Å; F965-I1057 HydrophobicContact CD2-CG2 4.33Å; F965-I1057 HydrophobicContact CG-CG1 4.02Å; F965-I1057 HydrophobicContact CG-CG2 4.12Å; Y1053-I1057 HydrophobicContact CD1-CD1 3.94Å; Y1053-I1057 HydrophobicContact CD2-CD1 4.07Å; Y1053-I1057 HydrophobicContact CD2-CG1 4.18Å; Y1053-I1057 HydrophobicContact CE1-CD1 3.51Å; Y1053-I1057 HydrophobicContact CE2-CD1 3.54Å; Y1053-I1057 HydrophobicContact CE2-CG1 3.64Å; Y1053-I1057 HydrophobicContact CG-CD1 4.19Å; Y1053-I1057 WeakPolarHBondContact O-CG1 3.32Å; Y1053-I1057 PolarHBondContact O-N 3.28Å; Y1053-I1057 WeakPolarHBondContact OH-CD1 3.44Å; S1054-I1057 PolarHBondContact O-N 3.43Å; F1055-I1057 VanDerWaalsContact C-N 3.31Å; F1055-I1057 PolarHBondContact O-N 2.89Å; I1057-S1059 VanDerWaalsContact C-N 3.35Å; I1057-S1059 PolarHBondContact O-N 3.12Å; I1057-Y1060 WeakPolarHBondContact O-CB 3.47Å; I1057-Y1060 PolarHBondContact O-N 3.36Å; I1057-L1061 HydrophobicContact CG2-CD1 3.7Å; I1057-L1061 HydrophobicContact CG2-CG 4.23Å; I1057-L1061 WeakPolarHBondContact O-CB 3.24Å; I1057-L1061 WeakPolarHBondContact O-CG 3.31Å; I1057-L1061 PolarHBondContact O-N 2.96Å
1058	C	65.2	Low	57.9	Low	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-49.5	176.4	-73	0	0	0	0	110.5	L961 L1032 S1054 F1055 Y1060 L1061 L1062	L961-C1058 VanDerWaalsContact CD1-SG 3.54Å; L1032-C1058 HydrophobicContact CD1-CB 4.22Å; S1054-C1058 WeakPolarHBondContact O-CB 3.38Å; S1054-C1058 PolarHBondContact O-N 2.84Å; S1054-C1058 PolarHBondContact O-SG 2.87Å; F1055-C1058 PolarHBondContact O-N 3.48Å; C1058-Y1060 VanDerWaalsContact C-N 3.33Å; C1058-Y1060 PolarHBondContact O-N 2.94Å; C1058-L1061 PolarHBondContact O-N 3.32Å; C1058-L1062 WeakPolarHBondContact O-CB 3.16Å; C1058-L1062 WeakPolarHBondContact O-CD1 3.43Å; C1058-L1062 WeakPolarHBondContact O-CG 3.43Å; C1058-L1062 PolarHBondContact O-N 3.37Å
1059	S	62.2	Low	56.6	Low	30 Å²	30	49.5 Å²	49.5	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-59.1	-43.1	176.1	-58.2	0	0	0	0	112.1	F1055 I1056 I1057 L1062 I1063	F1055-S1059 PolarHBondContact O-N 3.03Å; F1055-S1059 PolarHBondContact O-OG 3.2Å; F1055-S1059 VanDerWaalsContact O-OG 3.07Å; I1056-S1059 PolarHBondContact O-N 3.32Å; I1057-S1059 VanDerWaalsContact C-N 3.35Å; I1057-S1059 PolarHBondContact O-N 3.12Å; S1059-L1062 PolarHBondContact O-N 3.03Å; S1059-I1063 WeakPolarHBondContact O-CB 3.34Å; S1059-I1063 WeakPolarHBondContact O-CD1 3.18Å; S1059-I1063 WeakPolarHBondContact O-CG1 3.31Å; S1059-I1063 PolarHBondContact O-N 3.28Å
1060	Y	61.3	Low	55.4	Low	32 Å²	32	53 Å²	53	13%	0.125	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-45.7	177.2	169.6	-83.9	0	0	0	112.1	F965 D968 Q969 I1056 I1057 C1058 L1062 I1063 R1064	F965-Y1060 AromaticContact CD2-CD1 3.35Å; F965-Y1060 HydrophobicContact CD2-CD1 3.35Å; F965-Y1060 AromaticContact CD2-CE1 3.58Å; F965-Y1060 HydrophobicContact CD2-CE1 3.58Å; F965-Y1060 HydrophobicContact CD2-CG 4.01Å; F965-Y1060 AromaticContact CE2-CD1 3.48Å; F965-Y1060 HydrophobicContact CE2-CD1 3.48Å; F965-Y1060 VanDerWaalsContact CE2-CD1 3.48Å; F965-Y1060 HydrophobicContact CE2-CD2 4.1Å; F965-Y1060 AromaticContact CE2-CE1 3.68Å; F965-Y1060 HydrophobicContact CE2-CE1 3.68Å; F965-Y1060 HydrophobicContact CE2-CE2 4.24Å; F965-Y1060 AromaticContact CE2-CG 3.71Å; F965-Y1060 HydrophobicContact CE2-CG 3.71Å; D968-Y1060 VanDerWaalsContact OD2-CE1 3.29Å; D968-Y1060 WeakPolarHBondContact OD2-CE1 3.44Å; D968-Y1060 PolarHBondContact OD2-OH 3.5Å; Q969-Y1060 PolarHBondContact NE2-OH 3.42Å; I1056-Y1060 WeakPolarHBondContact O-CB 3.45Å; I1056-Y1060 PolarHBondContact O-N 3.07Å; I1057-Y1060 WeakPolarHBondContact O-CB 3.47Å; I1057-Y1060 PolarHBondContact O-N 3.36Å; C1058-Y1060 VanDerWaalsContact C-N 3.33Å; C1058-Y1060 PolarHBondContact O-N 2.94Å; Y1060-L1062 VanDerWaalsContact C-N 3.31Å; Y1060-L1062 PolarHBondContact O-N 2.86Å; Y1060-I1063 PolarHBondContact O-N 2.95Å; Y1060-R1064 HydrophobicContact CE1-CB 4.47Å; Y1060-R1064 HydrophobicContact CE2-CB 4.36Å; Y1060-R1064 VanDerWaalsContact CE2-CD 3.45Å; Y1060-R1064 VanDerWaalsContact O-CB 3.31Å; Y1060-R1064 WeakPolarHBondContact O-CB 3.48Å; Y1060-R1064 PolarHBondContact O-N 3.28Å; Y1060-R1064 WeakPolarHBondContact OH-CD 3.48Å; Y1060-R1064 PolarHBondContact OH-NH1 3.43Å
1061	L	61.2	Low	53.9	Low	1 Å²	1	59.5 Å²	59.5	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-40.1	179.7	-73.5	169.4	0	0	0	110.6	L961 L964 L1025 I1057 C1058 V1065	L961-L1061 HydrophobicContact CB-CD1 4.44Å; L961-L1061 HydrophobicContact CD2-CD1 3.83Å; L964-L1061 HydrophobicContact CD2-CD1 4.02Å; L964-L1061 HydrophobicContact CD2-CD2 4.02Å; L964-L1061 HydrophobicContact CG-CD1 4.47Å; L964-L1061 HydrophobicContact CG-CD2 4Å; L1025-L1061 HydrophobicContact CD1-CB 4.08Å; L1025-L1061 HydrophobicContact CD1-CD2 4.47Å; I1057-L1061 HydrophobicContact CG2-CD1 3.7Å; I1057-L1061 HydrophobicContact CG2-CG 4.23Å; I1057-L1061 WeakPolarHBondContact O-CB 3.24Å; I1057-L1061 WeakPolarHBondContact O-CG 3.31Å; I1057-L1061 PolarHBondContact O-N 2.96Å; C1058-L1061 PolarHBondContact O-N 3.32Å; L1061-V1065 HydrophobicContact CD2-CG2 3.83Å; L1061-V1065 VanDerWaalsContact O-CB 3.28Å; L1061-V1065 WeakPolarHBondContact O-CB 3.5Å; L1061-V1065 PolarHBondContact O-N 3.19Å; L1061-V1065 VanDerWaalsContact O-N 3.09Å
1062	L	63.1	Low	52.5	Low	44 Å²	44	69.4 Å²	69.4	23%	0.23	34%	0.337	C	S	.	.	H	α-helix	trans	-68.6	-33.1	177.1	-65.7	167	0	0	0	113.4	A1028 Y1029 L1032 C1058 S1059 Y1060	A1028-L1062 HydrophobicContact CB-CD2 4.44Å; Y1029-L1062 HydrophobicContact CD1-CD2 3.68Å; Y1029-L1062 HydrophobicContact CD2-CD2 3.5Å; Y1029-L1062 VanDerWaalsContact CD2-CD2 3.5Å; Y1029-L1062 HydrophobicContact CE1-CD2 3.51Å; Y1029-L1062 HydrophobicContact CE2-CD2 3.31Å; Y1029-L1062 HydrophobicContact CG-CD2 3.67Å; L1032-L1062 HydrophobicContact CD1-CD1 3.44Å; L1032-L1062 VanDerWaalsContact CD1-CD1 3.44Å; C1058-L1062 WeakPolarHBondContact O-CB 3.16Å; C1058-L1062 WeakPolarHBondContact O-CD1 3.43Å; C1058-L1062 WeakPolarHBondContact O-CG 3.43Å; C1058-L1062 PolarHBondContact O-N 3.37Å; S1059-L1062 PolarHBondContact O-N 3.03Å; Y1060-L1062 VanDerWaalsContact C-N 3.31Å; Y1060-L1062 PolarHBondContact O-N 2.86Å
1063	I	56.3	Low	51.1	Low	125 Å²	125	69.4 Å²	69.4	64%	0.641	34%	0.342	S	S	*	.	H	α-helix	trans	-82.8	-34.9	-178.7	-68.3	164.6	0	0	0	112	S1059 Y1060	S1059-I1063 WeakPolarHBondContact O-CB 3.34Å; S1059-I1063 WeakPolarHBondContact O-CD1 3.18Å; S1059-I1063 WeakPolarHBondContact O-CG1 3.31Å; S1059-I1063 PolarHBondContact O-N 3.28Å; Y1060-I1063 PolarHBondContact O-N 2.95Å
1064	R	53.9	Low	49.8	Very low	121 Å²	121	73.4 Å²	73.4	46%	0.457	36%	0.358	S	S	.	.	H	α-helix	trans	-110.4	-26.1	-165	-150.6	-170.4	-173.4	-142.1	-15	114.7	D968 Y1060 D1066	D968-R1064 IonicContact OD2-NH1 3.91Å; Y1060-R1064 HydrophobicContact CE1-CB 4.47Å; Y1060-R1064 HydrophobicContact CE2-CB 4.36Å; Y1060-R1064 VanDerWaalsContact CE2-CD 3.45Å; Y1060-R1064 VanDerWaalsContact O-CB 3.31Å; Y1060-R1064 WeakPolarHBondContact O-CB 3.48Å; Y1060-R1064 PolarHBondContact O-N 3.28Å; Y1060-R1064 WeakPolarHBondContact OH-CD 3.48Å; Y1060-R1064 PolarHBondContact OH-NH1 3.43Å; R1064-D1066 PolarHBondContact O-N 3.47Å
1065	V	52.4	Low	48.4	Very low	41 Å²	41	82.7 Å²	82.7	25%	0.248	39%	0.394	C	S	.	.			trans	-88.6	89.3	177.7	-173.4	0	0	0	0	107	L1025 L1061 I1067	L1025-V1065 HydrophobicContact CD1-CB 4.03Å; L1025-V1065 HydrophobicContact CD1-CG1 4.06Å; L1025-V1065 HydrophobicContact CD1-CG2 4.33Å; L1025-V1065 HydrophobicContact CD2-CB 4.31Å; L1025-V1065 HydrophobicContact CD2-CG1 3.71Å; L1061-V1065 HydrophobicContact CD2-CG2 3.83Å; L1061-V1065 VanDerWaalsContact O-CB 3.28Å; L1061-V1065 WeakPolarHBondContact O-CB 3.5Å; L1061-V1065 PolarHBondContact O-N 3.19Å; L1061-V1065 VanDerWaalsContact O-N 3.09Å; V1065-I1067 PolarHBondContact O-N 2.7Å
1066	D	42.7	Very low	47.1	Very low	135 Å²	135	85 Å²	85	72%	0.722	42%	0.416	S	S	*	.			trans	-52.8	130.5	161.9	-80.4	-32.5	0	0	0	107	R1064 V1068	R1064-D1066 PolarHBondContact O-N 3.47Å; D1066-V1068 HydrophobicContact CB-CG2 4.14Å; D1066-V1068 PolarHBondContact O-N 3.4Å
1067	I	35.2	Very low	45.8	Very low	78 Å²	78	91.3 Å²	91.3	40%	0.4	44%	0.436	S	S	.	.			trans	-69.4	63.2	172.9	-53.2	169.2	0	0	0	107.4	L1025 V1065 T1069	L1025-I1067 HydrophobicContact CD2-CG1 4.33Å; V1065-I1067 PolarHBondContact O-N 2.7Å; I1067-T1069 HydrophobicContact CG2-CG2 3.82Å; I1067-T1069 PolarHBondContact O-N 2.89Å
1068	V	31.4	Very low	44.5	Very low	107 Å²	107	98.1 Å²	98.1	65%	0.648	48%	0.477	S	S	*	.			trans	-77.4	79.5	158.7	-171.8	0	0	0	0	104.2	D1066 D1070	D1066-V1068 HydrophobicContact CB-CG2 4.14Å; D1066-V1068 PolarHBondContact O-N 3.4Å; V1068-D1070 PolarHBondContact O-N 2.86Å
1069	T	33.5	Very low	43.4	Very low	47 Å²	47	103.1 Å²	103.1	29%	0.288	50%	0.501	S	S	.	.			trans	-59.5	112.1	156.5	45.4	0	0	0	0	105.8	I1067 Y1071	I1067-T1069 HydrophobicContact CG2-CG2 3.82Å; I1067-T1069 PolarHBondContact O-N 2.89Å; T1069-Y1071 HydrophobicContact CG2-CD2 3.85Å; T1069-Y1071 HydrophobicContact CG2-CE2 4.07Å; T1069-Y1071 PolarHBondContact O-N 3.11Å
1070	D	32.8	Very low	42.4	Very low	117 Å²	117	106.9 Å²	106.9	63%	0.626	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-66.3	34.2	168.4	-79.2	-27.7	0	0	0	111.5	V1068 Y1072 S1073	V1068-D1070 PolarHBondContact O-N 2.86Å; D1070-Y1072 PolarHBondContact O-N 2.78Å; D1070-Y1072 VanDerWaalsContact O-N 3.08Å; D1070-S1073 PolarHBondContact O-N 3.04Å; D1070-S1073 PolarHBondContact O-OG 3.48Å
1071	Y	32.6	Very low	41.4	Very low	142 Å²	142	111.1 Å²	111.1	56%	0.557	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	-52.9	-24.8	168.3	-97.2	-65.3	0	0	0	111.1	T1069	T1069-Y1071 HydrophobicContact CG2-CD2 3.85Å; T1069-Y1071 HydrophobicContact CG2-CE2 4.07Å; T1069-Y1071 PolarHBondContact O-N 3.11Å
1072	Y	32.6	Very low	40.2	Very low	210 Å²	210	117.5 Å²	117.5	82%	0.824	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-81.3	-13.8	178.1	-82	-80.1	0	0	0	115.5	D1070	D1070-Y1072 PolarHBondContact O-N 2.78Å; D1070-Y1072 VanDerWaalsContact O-N 3.08Å
1073	S	34.3	Very low	38.8	Very low	63 Å²	63	122.1 Å²	122.1	44%	0.441	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-18.9	174.9	67.2	0	0	0	0	113.1	D1070 S1076	D1070-S1073 PolarHBondContact O-N 3.04Å; D1070-S1073 PolarHBondContact O-OG 3.48Å; S1073-S1076 PolarHBondContact O-OG 2.88Å
1074	Y	34.6	Very low	37.6	Very low	124 Å²	124	121.9 Å²	121.9	49%	0.486	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.1	-26.5	179.4	-154.5	-90.8	0	0	0	112.7	Y1015 T1078	Y1015-Y1074 HydrophobicContact CD2-CD2 4.39Å; Y1015-Y1074 HydrophobicContact CD2-CE2 4.25Å; Y1015-Y1074 HydrophobicContact CE2-CD2 4Å; Y1015-Y1074 AromaticContact CE2-CE2 3.94Å; Y1015-Y1074 HydrophobicContact CE2-CE2 3.94Å; Y1074-T1078 PolarHBondContact O-OG1 3.08Å
1075	Y	37.6	Very low	36.5	Very low	195 Å²	195	122 Å²	122	77%	0.765	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-7.3	179.7	-92.7	-79.7	0	0	0	114.7
1076	S	38.3	Very low	35.2	Very low	89 Å²	89	128.2 Å²	128.2	62%	0.622	62%	0.624	S	S	*	*	S	Bend	trans	-100.2	-7.2	178.6	58.3	0	0	0	0	114	S1073	S1073-S1076 PolarHBondContact O-OG 2.88Å
1077	Y	36.4	Very low	34.6	Very low	216 Å²	216	127.7 Å²	127.7	85%	0.847	62%	0.616	S	S	*	*			trans	-113.3	-11.2	178.9	-98.6	-83.6	0	0	0	114.6
1078	T	36.2	Very low	34.6	Very low	144 Å²	144	132.2 Å²	132.2	88%	0.883	64%	0.635	S	S	*	*			trans	-89.2	0	159.8	55	0	0	0	0	109.2	Y1074	Y1074-T1078 PolarHBondContact O-OG1 3.08Å

Retrieved 1,078 of 1,078 residues in 337.7 ms (Link to these results)

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