A0A087YMV4_POEFO Loading...

Eukaryotic translation initiation factor 3 subunit E

Component of the eukaryotic translation initiation factor 3 (eIF-3) complex, which is involved in protein synthesis of a specialized repertoire of mRNAs and, together with other initiation factors, stimulates binding of mRNA and methionyl-tRNAi to the 40S ribosome. The eIF-3 complex specifically targets and initiates translation of a subset of mRNAs involved in cell proliferation.

AlphaFold DB , UniProt , Accession A0A087YMV4, Species POEFO (Poecilia formosa, Amazon molly), Gene EIF3E, Length 454 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	59.5	Low	168 Å²	168	71.5 Å²	71.5	83%	0.828	38%	0.376	S	S	*	.				0	-52.3	0	-78.7	176.7	166.3	0	0	110.7
2	A	43.3	Very low	60.8	Low	47 Å²	47	78 Å²	78	39%	0.388	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-79	-6.7	170.4	0	0	0	0	0	115.9	Y4 D5 Y32	A2-Y4 VanDerWaalsContact C-N 3.35Å; A2-D5 WeakPolarHBondContact CA-OD2 3.43Å; A2-Y32 HydrophobicContact CB-CE1 3.83Å; A2-Y32 PolarHBondContact O-OH 2.92Å
3	E	51.1	Low	61.5	Low	172 Å²	172	74.1 Å²	74.1	80%	0.804	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-77.4	-17.8	-175.1	-70.7	-177.3	154	0	0	113.9
4	Y	56.5	Low	62.4	Low	72 Å²	72	70.1 Å²	70.1	28%	0.282	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-103.4	5.9	-179.3	-60.1	-68.5	0	0	0	113.1	A2 L6 P301 V328	A2-Y4 VanDerWaalsContact C-N 3.35Å; Y4-L6 WeakPolarHBondContact O-CD1 3.31Å; Y4-L6 PolarHBondContact O-N 2.71Å; Y4-P301 VanDerWaalsContact CE1-CD 3.42Å; Y4-P301 HydrophobicContact CE1-CG 3.9Å; Y4-P301 HydrophobicContact CE2-CG 4.23Å; Y4-V328 HydrophobicContact CD2-CG2 3.68Å; Y4-V328 HydrophobicContact CE2-CG2 4.1Å; Y4-V328 HydrophobicContact CG-CG2 4.18Å
5	D	58.3	Low	62.9	Low	21 Å²	21	69.7 Å²	69.7	11%	0.112	36%	0.359	C	S	.	.			trans	-74.2	102.6	-178.1	-71.6	-29.6	0	0	0	110.3	A2 T7 Y32	A2-D5 WeakPolarHBondContact CA-OD2 3.43Å; D5-T7 PolarHBondContact O-N 3.21Å; D5-Y32 HydrophobicContact CB-CE2 4.47Å; D5-Y32 WeakPolarHBondContact OD2-CE2 3.27Å; D5-Y32 PolarHBondContact OD2-OH 3.5Å
6	L	65.6	Low	63.4	Low	7 Å²	7	73.6 Å²	73.6	4%	0.037	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.3	-179.9	-76.2	137.2	0	0	0	112.9	Y4 T8 K9 I10 H262	Y4-L6 WeakPolarHBondContact O-CD1 3.31Å; Y4-L6 PolarHBondContact O-N 2.71Å; L6-T8 PolarHBondContact O-N 3.3Å; L6-K9 PolarHBondContact O-N 3.28Å; L6-I10 HydrophobicContact CB-CD1 3.64Å; L6-I10 HydrophobicContact CB-CG1 4.17Å; L6-I10 WeakPolarHBondContact O-CB 3.49Å; L6-I10 WeakPolarHBondContact O-CG1 3.23Å; L6-I10 PolarHBondContact O-N 2.78Å; L6-H262 HydrophobicContact CD2-CB 3.13Å
7	T	66.1	Low	63.8	Low	30 Å²	30	69.6 Å²	69.6	18%	0.184	35%	0.348	C	S	.	.	H	α-helix	trans	-57.4	-37.4	-173.8	-40.9	0	0	0	0	111.9	D5 A11 L22 L26	D5-T7 PolarHBondContact O-N 3.21Å; T7-A11 WeakPolarHBondContact O-CA 3.48Å; T7-A11 WeakPolarHBondContact O-CB 3.42Å; T7-A11 PolarHBondContact O-N 3.41Å; T7-L22 HydrophobicContact CG2-CB 4Å; T7-L22 HydrophobicContact CG2-CD1 4.25Å; T7-L26 HydrophobicContact CG2-CD1 3.72Å
8	T	67.3	Low	64.2	Low	112 Å²	112	65.8 Å²	65.8	69%	0.687	33%	0.329	S	S	*	.	H	α-helix	trans	-67.3	-39.9	176.9	53.8	0	0	0	0	112.8	L6	L6-T8 PolarHBondContact O-N 3.3Å
9	K	69	Low	64.8	Low	118 Å²	118	63 Å²	63	51%	0.513	32%	0.316	S	S	.	.	H	α-helix	trans	-73.8	-41.9	177.6	-69.9	-177.9	179.9	175	0	111.7	L6 H12 F13	L6-K9 PolarHBondContact O-N 3.28Å; K9-H12 PolarHBondContact O-N 2.9Å; K9-F13 WeakPolarHBondContact O-CD2 3.24Å; K9-F13 WeakPolarHBondContact O-CE2 2.98Å
10	I	70.2	Confident	65.2	Low	8 Å²	8	61.5 Å²	61.5	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-68.5	-38.3	178.4	-69	171.3	0	0	0	110.3	L6 H12 F13 L14 L22 Y266	L6-I10 HydrophobicContact CB-CD1 3.64Å; L6-I10 HydrophobicContact CB-CG1 4.17Å; L6-I10 WeakPolarHBondContact O-CB 3.49Å; L6-I10 WeakPolarHBondContact O-CG1 3.23Å; L6-I10 PolarHBondContact O-N 2.78Å; I10-H12 PolarHBondContact O-N 3.26Å; I10-F13 PolarHBondContact O-N 2.96Å; I10-L14 HydrophobicContact CG2-CD1 3.42Å; I10-L14 VanDerWaalsContact CG2-CD1 3.42Å; I10-L14 HydrophobicContact CG2-CG 4.04Å; I10-L14 WeakPolarHBondContact O-CG 3.44Å; I10-L14 PolarHBondContact O-N 2.97Å; I10-L22 HydrophobicContact CG2-CD1 4.48Å; I10-Y266 HydrophobicContact CD1-CE2 3.95Å
11	A	68.9	Low	65.6	Low	32 Å²	32	60.6 Å²	60.6	26%	0.264	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-28.1	177.3	0	0	0	0	0	113.2	T7 F13 L14 V19	T7-A11 WeakPolarHBondContact O-CA 3.48Å; T7-A11 WeakPolarHBondContact O-CB 3.42Å; T7-A11 PolarHBondContact O-N 3.41Å; A11-F13 PolarHBondContact O-N 3.03Å; A11-L14 PolarHBondContact O-N 3.33Å; A11-V19 HydrophobicContact CB-CG1 4.27Å; A11-V19 HydrophobicContact CB-CG2 3.99Å
12	H	75.9	Confident	67.2	Low	149 Å²	149	53 Å²	53	69%	0.69	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-22.3	175	-167.6	73.4	0	0	0	113.3	K9 I10	K9-H12 PolarHBondContact O-N 2.9Å; I10-H12 PolarHBondContact O-N 3.26Å
13	F	70.1	Confident	68.5	Low	27 Å²	27	52.1 Å²	52.1	12%	0.118	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	4.3	-179.7	-57.7	-70.6	0	0	0	112.9	K9 I10 A11 T222 W223 H226 W227 C260	K9-F13 WeakPolarHBondContact O-CD2 3.24Å; K9-F13 WeakPolarHBondContact O-CE2 2.98Å; I10-F13 PolarHBondContact O-N 2.96Å; A11-F13 PolarHBondContact O-N 3.03Å; F13-T222 HydrophobicContact CD1-CG2 3.91Å; F13-T222 HydrophobicContact CE1-CG2 3.85Å; F13-T222 HydrophobicContact CZ-CG2 4.47Å; F13-W223 AromaticContact CD1-CD1 3.69Å; F13-W223 AromaticContact CD1-NE1 3.77Å; F13-H226 HydrophobicContact CB-CB 4.2Å; F13-H226 AromaticContact CD2-CD2 3.99Å; F13-H226 AromaticContact CD2-CE1 3.68Å; F13-H226 AromaticContact CD2-NE2 3.47Å; F13-H226 WeakPolarHBondContact CD2-NE2 3.41Å; F13-H226 AromaticContact CG-CE1 3.83Å; F13-H226 AromaticContact CG-ND1 3.99Å; F13-H226 AromaticContact CG-NE2 3.98Å; F13-W227 PolarHBondContact O-NE1 3.27Å; F13-W227 VanDerWaalsContact O-NE1 3.09Å; F13-C260 VanDerWaalsContact CE2-SG 3.57Å; F13-C260 WeakPolarHBondContact CZ-SG 3.33Å
14	L	73.2	Confident	69.5	Low	19 Å²	19	49.9 Å²	49.9	10%	0.099	25%	0.247	C	C	.	.	S	Bend	trans	-113.8	155.2	-178.5	-70.2	173.5	0	0	0	112.2	I10 A11 L18 V19 L22 H226 W227 F230	I10-L14 HydrophobicContact CG2-CD1 3.42Å; I10-L14 VanDerWaalsContact CG2-CD1 3.42Å; I10-L14 HydrophobicContact CG2-CG 4.04Å; I10-L14 WeakPolarHBondContact O-CG 3.44Å; I10-L14 PolarHBondContact O-N 2.97Å; A11-L14 PolarHBondContact O-N 3.33Å; L14-L18 HydrophobicContact CB-CB 4.44Å; L14-L18 HydrophobicContact CD2-CB 4.41Å; L14-L18 HydrophobicContact CD2-CD1 4.15Å; L14-V19 HydrophobicContact CB-CG2 4.12Å; L14-L22 HydrophobicContact CD1-CD1 3.72Å; L14-H226 HydrophobicContact CD2-CB 4.49Å; L14-W227 HydrophobicContact CD2-CG 4.39Å; L14-F230 HydrophobicContact CD1-CE2 3.69Å; L14-F230 HydrophobicContact CD1-CZ 3.53Å; L14-F230 HydrophobicContact CD2-CD2 4.17Å; L14-F230 HydrophobicContact CD2-CE2 3.31Å; L14-F230 HydrophobicContact CD2-CZ 3.84Å; L14-F230 HydrophobicContact CG-CE2 4.13Å; L14-F230 HydrophobicContact CG-CZ 4.36Å
15	D	70.6	Confident	70.1	Confident	63 Å²	63	48.4 Å²	48.4	34%	0.337	24%	0.241	S	C	.	.			trans	-71.2	148.9	167.9	-103.4	-15.2	0	0	0	111.3	H17 L18 V19 W227	D15-H17 PolarHBondContact O-N 3.42Å; D15-H17 VanDerWaalsContact O-N 3.1Å; D15-L18 HydrophobicContact CB-CD1 4.44Å; D15-L18 PolarHBondContact O-N 3.31Å; D15-V19 PolarHBondContact O-N 2.94Å; D15-W227 HydrophobicContact CB-CH2 4.14Å; D15-W227 HydrophobicContact CB-CZ2 3.85Å; D15-W227 VanDerWaalsContact OD2-CH2 3.31Å; D15-W227 WeakPolarHBondContact OD2-CH2 3.49Å
16	R	71.2	Confident	70.7	Confident	132 Å²	132	47.9 Å²	47.9	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-51.7	-38.4	-176.9	-64.4	177	174.2	142.6	-8.5	113	V19 L44 T48	R16-V19 PolarHBondContact O-N 3.1Å; R16-L44 HydrophobicContact CB-CD1 4.26Å; R16-L44 HydrophobicContact CG-CD1 4.13Å; R16-T48 HydrophobicContact CB-CG2 4.09Å
17	H	69.9	Low	70.7	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.028	25%	0.245	C	C	.	.	H	α-helix	trans	-72.2	-30.1	179.6	-70	-93	0	0	0	113.7	D15 V19 F20 P21 Y149 Y154 L188	D15-H17 PolarHBondContact O-N 3.42Å; D15-H17 VanDerWaalsContact O-N 3.1Å; H17-V19 PolarHBondContact O-N 2.94Å; H17-F20 HydrophobicContact CB-CD2 4.37Å; H17-F20 HydrophobicContact CB-CE2 4.5Å; H17-F20 AromaticContact ND1-CE2 3.91Å; H17-F20 WeakPolarHBondContact O-CD2 3.32Å; H17-F20 PolarHBondContact O-N 3.09Å; H17-P21 WeakPolarHBondContact O-CD 3.22Å; H17-Y149 HydrophobicContact CB-CE1 4.48Å; H17-Y149 AromaticContact CD2-CD1 3.99Å; H17-Y149 AromaticContact CD2-CE1 3.41Å; H17-Y149 VanDerWaalsContact CD2-CE1 3.41Å; H17-Y149 WeakPolarHBondContact CD2-CE1 3.17Å; H17-Y149 AromaticContact CD2-CZ 3.9Å; H17-Y149 PolarHBondContact CE1-O 3.08Å; H17-Y154 PolarHBondContact ND1-OH 2.77Å; H17-L188 HydrophobicContact CB-CD1 3.72Å; H17-L188 HydrophobicContact CB-CD2 4.45Å
18	L	70.9	Confident	70.9	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-76	-14.4	177	-66.9	174.5	0	0	0	112.7	L14 D15 I187 L188 W227 F230	L14-L18 HydrophobicContact CB-CB 4.44Å; L14-L18 HydrophobicContact CD2-CB 4.41Å; L14-L18 HydrophobicContact CD2-CD1 4.15Å; D15-L18 HydrophobicContact CB-CD1 4.44Å; D15-L18 PolarHBondContact O-N 3.31Å; L18-I187 HydrophobicContact CD2-CB 4.09Å; L18-I187 HydrophobicContact CD2-CG2 3.5Å; L18-L188 HydrophobicContact CD2-CD2 3.99Å; L18-L188 HydrophobicContact CD2-CG 3.95Å; L18-W227 HydrophobicContact CD1-CD2 4.05Å; L18-W227 HydrophobicContact CD1-CE3 4.17Å; L18-W227 HydrophobicContact CD1-CH2 4.41Å; L18-W227 HydrophobicContact CD1-CZ2 4.25Å; L18-W227 HydrophobicContact CD1-CZ3 4.36Å; L18-F230 HydrophobicContact CB-CZ 4.46Å
19	V	75.2	Confident	70.8	Confident	13 Å²	13	50.8 Å²	50.8	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-78.5	-22.9	174.4	-176.5	0	0	0	0	111.3	A11 L14 D15 R16 H17 L22 L23 L44	A11-V19 HydrophobicContact CB-CG1 4.27Å; A11-V19 HydrophobicContact CB-CG2 3.99Å; L14-V19 HydrophobicContact CB-CG2 4.12Å; D15-V19 PolarHBondContact O-N 2.94Å; R16-V19 PolarHBondContact O-N 3.1Å; H17-V19 PolarHBondContact O-N 2.94Å; V19-L22 PolarHBondContact O-N 2.97Å; V19-L23 HydrophobicContact CG1-CD1 3.81Å; V19-L23 HydrophobicContact CG1-CG 3.89Å; V19-L23 WeakPolarHBondContact O-CG 3.43Å; V19-L23 PolarHBondContact O-N 3.06Å; V19-L44 HydrophobicContact CB-CD2 4.11Å; V19-L44 HydrophobicContact CG1-CD2 4.11Å
20	F	73.1	Confident	70.5	Confident	33 Å²	33	53 Å²	53	15%	0.145	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-49.3	-179.5	-64.6	-58.2	0	0	0	114	H17 L22 L23 E24 L44 L45 M50	H17-F20 HydrophobicContact CB-CD2 4.37Å; H17-F20 HydrophobicContact CB-CE2 4.5Å; H17-F20 AromaticContact ND1-CE2 3.91Å; H17-F20 WeakPolarHBondContact O-CD2 3.32Å; H17-F20 PolarHBondContact O-N 3.09Å; F20-L22 PolarHBondContact O-N 3.36Å; F20-L23 PolarHBondContact O-N 3.5Å; F20-L23 VanDerWaalsContact O-N 3.15Å; F20-E24 WeakPolarHBondContact O-CB 3.1Å; F20-E24 PolarHBondContact O-N 3.5Å; F20-L44 HydrophobicContact CD1-CD2 4.09Å; F20-L44 HydrophobicContact CE1-CB 4.5Å; F20-L44 HydrophobicContact CE1-CD2 3.63Å; F20-L44 HydrophobicContact CE1-CG 4.16Å; F20-L44 HydrophobicContact CZ-CD2 4Å; F20-L44 HydrophobicContact CZ-CG 4.24Å; F20-L45 HydrophobicContact CE1-CD2 3.69Å; F20-L45 HydrophobicContact CE1-CG 3.81Å; F20-L45 HydrophobicContact CZ-CD2 3.63Å; F20-L45 HydrophobicContact CZ-CG 4.12Å; F20-M50 HydrophobicContact CD2-CE 3.73Å; F20-M50 HydrophobicContact CE2-CE 3.31Å; F20-M50 HydrophobicContact CZ-CE 3.79Å
21	P	73.6	Confident	70	Confident	43 Å²	43	54.7 Å²	54.7	28%	0.279	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-35	176.7	-24.2	34.6	0	0	0	112.7	H17 F25 F333	H17-P21 WeakPolarHBondContact O-CD 3.22Å; P21-F25 WeakPolarHBondContact O-CB 3.39Å; P21-F25 PolarHBondContact O-N 2.87Å; P21-F333 HydrophobicContact CB-CE2 4.5Å; P21-F333 HydrophobicContact CB-CZ 4.03Å
22	L	71.8	Confident	69.6	Low	8 Å²	8	57.4 Å²	57.4	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-67.4	-43.7	176.5	-63.1	179.8	0	0	0	111.7	T7 I10 L14 V19 F20 F25 L26 F230 F333 F334	T7-L22 HydrophobicContact CG2-CB 4Å; T7-L22 HydrophobicContact CG2-CD1 4.25Å; I10-L22 HydrophobicContact CG2-CD1 4.48Å; L14-L22 HydrophobicContact CD1-CD1 3.72Å; V19-L22 PolarHBondContact O-N 2.97Å; F20-L22 PolarHBondContact O-N 3.36Å; L22-F25 PolarHBondContact O-N 3.47Å; L22-L26 WeakPolarHBondContact O-CG 3.38Å; L22-L26 PolarHBondContact O-N 3.27Å; L22-F230 HydrophobicContact CD1-CZ 4.1Å; L22-F230 HydrophobicContact CG-CZ 4.45Å; L22-F333 HydrophobicContact CD2-CB 3.73Å; L22-F333 HydrophobicContact CD2-CD1 3.46Å; L22-F333 VanDerWaalsContact CD2-CD1 3.46Å; L22-F333 HydrophobicContact CD2-CD2 4.37Å; L22-F333 HydrophobicContact CD2-CE1 4.11Å; L22-F333 HydrophobicContact CD2-CG 3.6Å; L22-F334 HydrophobicContact CD2-CE2 4.08Å; L22-F334 HydrophobicContact CD2-CZ 4.09Å
23	L	70.9	Confident	69.1	Low	29 Å²	29	55 Å²	55	15%	0.152	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-36	177.2	-71.8	175.6	0	0	0	112.2	V19 F20 L26 S27 L37 K41 L44	V19-L23 HydrophobicContact CG1-CD1 3.81Å; V19-L23 HydrophobicContact CG1-CG 3.89Å; V19-L23 WeakPolarHBondContact O-CG 3.43Å; V19-L23 PolarHBondContact O-N 3.06Å; F20-L23 PolarHBondContact O-N 3.5Å; F20-L23 VanDerWaalsContact O-N 3.15Å; L23-L26 HydrophobicContact CD2-CD1 4.32Å; L23-L26 PolarHBondContact O-N 2.9Å; L23-S27 PolarHBondContact O-N 3.02Å; L23-S27 PolarHBondContact O-OG 3.29Å; L23-L37 HydrophobicContact CB-CD2 4.21Å; L23-L37 HydrophobicContact CD2-CD2 4.18Å; L23-L37 HydrophobicContact CD2-CG 4.48Å; L23-K41 HydrophobicContact CB-CG 4.29Å; L23-K41 HydrophobicContact CD1-CG 3.95Å; L23-L44 HydrophobicContact CD1-CD2 4.05Å
24	E	70.1	Confident	68.8	Low	125 Å²	125	59.3 Å²	59.3	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-64.8	-44.8	174.7	-170	170	-169.6	0	0	111.2	F20 L26 S27 V28	F20-E24 WeakPolarHBondContact O-CB 3.1Å; F20-E24 PolarHBondContact O-N 3.5Å; E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.48Å; E24-S27 WeakPolarHBondContact O-CA 3.48Å; E24-S27 VanDerWaalsContact O-CB 3.31Å; E24-S27 WeakPolarHBondContact O-CB 3.4Å; E24-S27 PolarHBondContact O-N 3.46Å; E24-V28 WeakPolarHBondContact O-CG2 3.17Å; E24-V28 PolarHBondContact O-N 3.19Å
25	F	70.9	Confident	68.3	Low	40 Å²	40	63.9 Å²	63.9	18%	0.175	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-42.1	173.8	179.4	-100.3	0	0	0	113.1	P21 L22 S27 V28 K29 N331 F333 V336	P21-F25 WeakPolarHBondContact O-CB 3.39Å; P21-F25 PolarHBondContact O-N 2.87Å; L22-F25 PolarHBondContact O-N 3.47Å; F25-S27 PolarHBondContact O-N 2.88Å; F25-V28 PolarHBondContact O-N 3.43Å; F25-K29 HydrophobicContact CD1-CG 4.3Å; F25-K29 HydrophobicContact CE1-CG 3.95Å; F25-K29 HydrophobicContact CE2-CG 4.41Å; F25-K29 HydrophobicContact CZ-CD 4.45Å; F25-K29 HydrophobicContact CZ-CG 4.03Å; F25-K29 WeakPolarHBondContact O-CB 3.23Å; F25-K29 WeakPolarHBondContact O-CG 3.36Å; F25-K29 PolarHBondContact O-N 3.3Å; F25-N331 WeakPolarHBondContact CE1-O 3.18Å; F25-F333 HydrophobicContact CB-CD2 3.45Å; F25-F333 VanDerWaalsContact CB-CD2 3.45Å; F25-F333 HydrophobicContact CB-CE2 3.93Å; F25-F333 HydrophobicContact CB-CG 4.49Å; F25-F333 HydrophobicContact CD1-CB 3.94Å; F25-F333 HydrophobicContact CD1-CD2 4.02Å; F25-F333 AromaticContact CD2-CD2 3.73Å; F25-F333 HydrophobicContact CD2-CD2 3.73Å; F25-F333 HydrophobicContact CD2-CE2 4.38Å; F25-F333 HydrophobicContact CE1-CB 4.15Å; F25-F333 HydrophobicContact CE2-CD2 4.42Å; F25-F333 HydrophobicContact CG-CB 4.29Å; F25-F333 AromaticContact CG-CD2 3.48Å; F25-F333 HydrophobicContact CG-CD2 3.48Å; F25-F333 VanDerWaalsContact CG-CD2 3.48Å; F25-F333 HydrophobicContact CG-CE2 4.3Å; F25-F333 HydrophobicContact CG-CG 4.37Å; F25-V336 HydrophobicContact CE2-CG2 4.19Å; F25-V336 HydrophobicContact CZ-CG2 3.97Å
26	L	69.9	Low	68.2	Low	11 Å²	11	67.2 Å²	67.2	6%	0.058	32%	0.323	C	S	.	.	H	α-helix	trans	-63.4	-30.8	174.3	-75.7	165.4	0	0	0	112.5	T7 L22 L23 E24 E30 Y32 L37	T7-L26 HydrophobicContact CG2-CD1 3.72Å; L22-L26 WeakPolarHBondContact O-CG 3.38Å; L22-L26 PolarHBondContact O-N 3.27Å; L23-L26 HydrophobicContact CD2-CD1 4.32Å; L23-L26 PolarHBondContact O-N 2.9Å; E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.48Å; L26-E30 PolarHBondContact O-N 3.44Å; L26-Y32 HydrophobicContact CD2-CE2 4.44Å; L26-L37 HydrophobicContact CB-CD1 3.76Å
27	S	65.5	Low	68.1	Low	24 Å²	24	61.7 Å²	61.7	17%	0.168	30%	0.304	C	S	.	.	H	α-helix	trans	-69.6	-45.4	175.5	-50.2	0	0	0	0	111	L23 E24 F25 K29 E30 L37 K41	L23-S27 PolarHBondContact O-N 3.02Å; L23-S27 PolarHBondContact O-OG 3.29Å; E24-S27 WeakPolarHBondContact O-CA 3.48Å; E24-S27 VanDerWaalsContact O-CB 3.31Å; E24-S27 WeakPolarHBondContact O-CB 3.4Å; E24-S27 PolarHBondContact O-N 3.46Å; F25-S27 PolarHBondContact O-N 2.88Å; S27-K29 PolarHBondContact O-N 3.36Å; S27-E30 PolarHBondContact O-N 2.97Å; S27-L37 VanDerWaalsContact OG-CD2 3.27Å; S27-L37 WeakPolarHBondContact OG-CD2 3.42Å; S27-K41 WeakPolarHBondContact OG-CE 3.4Å; S27-K41 PolarHBondContact OG-NZ 3.49Å
28	V	70.9	Confident	67.9	Low	116 Å²	116	62.2 Å²	62.2	70%	0.703	31%	0.307	S	S	*	.	H	α-helix	trans	-63.8	-29.7	177.5	175.2	0	0	0	0	112	E24 F25	E24-V28 WeakPolarHBondContact O-CG2 3.17Å; E24-V28 PolarHBondContact O-N 3.19Å; F25-V28 PolarHBondContact O-N 3.43Å
29	K	64.5	Low	67.7	Low	70 Å²	70	68.6 Å²	68.6	30%	0.304	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-12.8	179.2	-78	-75.6	-170.1	174.3	0	114.2	F25 S27 I31 V330	F25-K29 HydrophobicContact CD1-CG 4.3Å; F25-K29 HydrophobicContact CE1-CG 3.95Å; F25-K29 HydrophobicContact CE2-CG 4.41Å; F25-K29 HydrophobicContact CZ-CD 4.45Å; F25-K29 HydrophobicContact CZ-CG 4.03Å; F25-K29 WeakPolarHBondContact O-CB 3.23Å; F25-K29 WeakPolarHBondContact O-CG 3.36Å; F25-K29 PolarHBondContact O-N 3.3Å; S27-K29 PolarHBondContact O-N 3.36Å; K29-I31 HydrophobicContact CB-CD1 3.87Å; K29-I31 HydrophobicContact CB-CG1 3.94Å; K29-I31 PolarHBondContact O-N 3Å; K29-I31 VanDerWaalsContact O-N 3.09Å; K29-V330 WeakPolarHBondContact CE-O 3.39Å; K29-V330 PolarHBondContact NZ-O 2.84Å
30	E	63	Low	67.4	Low	163 Å²	163	69.8 Å²	69.8	76%	0.762	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	32.5	179.2	-62.4	179.5	177	0	0	114.3	L26 S27 Y32	L26-E30 PolarHBondContact O-N 3.44Å; S27-E30 PolarHBondContact O-N 2.97Å; E30-Y32 VanDerWaalsContact C-N 3.32Å
31	I	60.5	Low	67.1	Low	44 Å²	44	69.6 Å²	69.6	23%	0.226	34%	0.344	C	S	.	.			trans	-74.7	-28	-178.7	-62.3	167.1	0	0	0	111.1	K29 N331	K29-I31 HydrophobicContact CB-CD1 3.87Å; K29-I31 HydrophobicContact CB-CG1 3.94Å; K29-I31 PolarHBondContact O-N 3Å; K29-I31 VanDerWaalsContact O-N 3.09Å; I31-N331 HydrophobicContact CD1-CB 3.96Å
32	Y	60.4	Low	66.7	Low	89 Å²	89	68.7 Å²	68.7	35%	0.349	34%	0.337	S	S	.	.	S	Bend	trans	-118.7	162.2	178.7	-67.9	-79	0	0	0	111.3	A2 D5 L26 E30 E34	A2-Y32 HydrophobicContact CB-CE1 3.83Å; A2-Y32 PolarHBondContact O-OH 2.92Å; D5-Y32 HydrophobicContact CB-CE2 4.47Å; D5-Y32 WeakPolarHBondContact OD2-CE2 3.27Å; D5-Y32 PolarHBondContact OD2-OH 3.5Å; L26-Y32 HydrophobicContact CD2-CE2 4.44Å; E30-Y32 VanDerWaalsContact C-N 3.32Å; Y32-E34 PolarHBondContact O-N 2.79Å
33	N	65.3	Low	66.6	Low	98 Å²	98	73.8 Å²	73.8	52%	0.524	36%	0.364	S	S	.	.			trans	-62.2	124.2	174	-162.8	7.3	0	0	0	109.8	E35 E36 L37	N33-E35 PolarHBondContact O-N 3.29Å; N33-E35 VanDerWaalsContact O-N 3.16Å; N33-E36 PolarHBondContact O-N 3.36Å; N33-E36 VanDerWaalsContact O-N 3.11Å; N33-L37 PolarHBondContact O-N 2.84Å
34	E	62.7	Low	66.6	Low	118 Å²	118	74.1 Å²	74.1	55%	0.551	37%	0.366	S	S	*	.	H	α-helix	trans	-58.9	-33.5	-171.8	-157.2	179.7	175	0	0	111.5	Y32 E36 L37 L38	Y32-E34 PolarHBondContact O-N 2.79Å; E34-E36 PolarHBondContact O-N 2.98Å; E34-L37 PolarHBondContact O-N 3.41Å; E34-L38 HydrophobicContact CG-CD1 3.94Å; E34-L38 HydrophobicContact CG-CG 4.32Å; E34-L38 VanDerWaalsContact O-CB 3.26Å; E34-L38 WeakPolarHBondContact O-CB 3.43Å; E34-L38 WeakPolarHBondContact O-CD1 3.41Å; E34-L38 WeakPolarHBondContact O-CG 3.44Å; E34-L38 PolarHBondContact O-N 3.14Å
35	E	63.8	Low	66.3	Low	115 Å²	115	68.5 Å²	68.5	54%	0.537	34%	0.34	S	S	.	.	H	α-helix	trans	-64.7	-39	178.1	-63.9	-174.4	169.7	0	0	114	N33 R39	N33-E35 PolarHBondContact O-N 3.29Å; N33-E35 VanDerWaalsContact O-N 3.16Å; E35-R39 WeakPolarHBondContact O-CB 3.45Å; E35-R39 VanDerWaalsContact O-CG 3.29Å; E35-R39 WeakPolarHBondContact O-CG 3.2Å; E35-R39 PolarHBondContact O-N 3.04Å
36	E	68.3	Low	65.9	Low	133 Å²	133	69.1 Å²	69.1	62%	0.621	35%	0.349	S	S	*	.	H	α-helix	trans	-72.1	-37.1	178.4	-70.4	-174.4	167.2	0	0	110.9	N33 E34 R39 G40	N33-E36 PolarHBondContact O-N 3.36Å; N33-E36 VanDerWaalsContact O-N 3.11Å; E34-E36 PolarHBondContact O-N 2.98Å; E36-R39 PolarHBondContact O-N 3.01Å; E36-G40 PolarHBondContact O-N 3.17Å
37	L	67.9	Low	65.5	Low	16 Å²	16	73.7 Å²	73.7	8%	0.084	37%	0.374	C	S	.	.	H	α-helix	trans	-70.9	-40	178.4	-153.9	157.8	0	0	0	111	L23 L26 S27 N33 E34 G40 K41	L23-L37 HydrophobicContact CB-CD2 4.21Å; L23-L37 HydrophobicContact CD2-CD2 4.18Å; L23-L37 HydrophobicContact CD2-CG 4.48Å; L26-L37 HydrophobicContact CB-CD1 3.76Å; S27-L37 VanDerWaalsContact OG-CD2 3.27Å; S27-L37 WeakPolarHBondContact OG-CD2 3.42Å; N33-L37 PolarHBondContact O-N 2.84Å; E34-L37 PolarHBondContact O-N 3.41Å; L37-G40 PolarHBondContact O-N 3.46Å; L37-K41 HydrophobicContact CD2-CD 3.96Å; L37-K41 VanDerWaalsContact CD2-CE 3.46Å; L37-K41 HydrophobicContact CD2-CG 4.19Å; L37-K41 WeakPolarHBondContact O-CG 3.38Å; L37-K41 PolarHBondContact O-N 3.39Å
38	L	66.4	Low	65.3	Low	17 Å²	17	73 Å²	73	9%	0.089	37%	0.369	C	S	.	.	H	α-helix	trans	-67.6	-35.1	173.6	-70.9	168.6	0	0	0	112.1	E34 K41 L42 V57 L61	E34-L38 HydrophobicContact CG-CD1 3.94Å; E34-L38 HydrophobicContact CG-CG 4.32Å; E34-L38 VanDerWaalsContact O-CB 3.26Å; E34-L38 WeakPolarHBondContact O-CB 3.43Å; E34-L38 WeakPolarHBondContact O-CD1 3.41Å; E34-L38 WeakPolarHBondContact O-CG 3.44Å; E34-L38 PolarHBondContact O-N 3.14Å; L38-K41 HydrophobicContact CD2-CD 4.31Å; L38-K41 PolarHBondContact O-N 3.4Å; L38-L42 WeakPolarHBondContact O-CB 3.32Å; L38-L42 PolarHBondContact O-N 3.48Å; L38-V57 HydrophobicContact CB-CG1 4.48Å; L38-V57 HydrophobicContact CD2-CG1 3.83Å; L38-L61 HydrophobicContact CB-CD1 3.33Å; L38-L61 HydrophobicContact CD1-CD1 3.96Å; L38-L61 HydrophobicContact CG-CD1 4.3Å
39	R	66.8	Low	64.8	Low	136 Å²	136	69.8 Å²	69.8	51%	0.513	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-44.2	169.5	-77.8	177.9	-173.6	179.2	5.9	112.1	E35 E36 K41 L42 D43 L61	E35-R39 WeakPolarHBondContact O-CB 3.45Å; E35-R39 VanDerWaalsContact O-CG 3.29Å; E35-R39 WeakPolarHBondContact O-CG 3.2Å; E35-R39 PolarHBondContact O-N 3.04Å; E36-R39 PolarHBondContact O-N 3.01Å; R39-K41 VanDerWaalsContact C-N 3.32Å; R39-K41 PolarHBondContact O-N 2.83Å; R39-L42 WeakPolarHBondContact O-CB 3.24Å; R39-L42 PolarHBondContact O-N 3.33Å; R39-L42 VanDerWaalsContact O-N 3.13Å; R39-D43 PolarHBondContact O-N 3.09Å; R39-L61 HydrophobicContact CG-CD1 4.42Å; R39-L61 HydrophobicContact CG-CD2 4.12Å
40	G	68.5	Low	64.5	Low	37 Å²	37	67.3 Å²	67.3	38%	0.381	34%	0.337	S	S	.	.	H	α-helix	trans	-62	-38.1	174.1	0	0	0	0	0	112.9	E36 L37 L44	E36-G40 PolarHBondContact O-N 3.17Å; L37-G40 PolarHBondContact O-N 3.46Å; G40-L44 WeakPolarHBondContact O-CB 3.38Å; G40-L44 PolarHBondContact O-N 3.01Å; G40-L44 VanDerWaalsContact O-N 3.11Å
41	K	67.3	Low	64.5	Low	29 Å²	29	60.2 Å²	60.2	13%	0.126	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-43.7	170.9	-77.4	174.2	174.3	177.6	0	111.4	L23 S27 L37 L38 R39 L44 L45 V57	L23-K41 HydrophobicContact CB-CG 4.29Å; L23-K41 HydrophobicContact CD1-CG 3.95Å; S27-K41 WeakPolarHBondContact OG-CE 3.4Å; S27-K41 PolarHBondContact OG-NZ 3.49Å; L37-K41 HydrophobicContact CD2-CD 3.96Å; L37-K41 VanDerWaalsContact CD2-CE 3.46Å; L37-K41 HydrophobicContact CD2-CG 4.19Å; L37-K41 WeakPolarHBondContact O-CG 3.38Å; L37-K41 PolarHBondContact O-N 3.39Å; L38-K41 HydrophobicContact CD2-CD 4.31Å; L38-K41 PolarHBondContact O-N 3.4Å; R39-K41 VanDerWaalsContact C-N 3.32Å; R39-K41 PolarHBondContact O-N 2.83Å; K41-L44 PolarHBondContact O-N 3.31Å; K41-L45 HydrophobicContact CB-CD1 4.4Å; K41-L45 WeakPolarHBondContact O-CB 3.45Å; K41-L45 WeakPolarHBondContact O-CD1 3.36Å; K41-L45 WeakPolarHBondContact O-CG 3.21Å; K41-L45 PolarHBondContact O-N 3.32Å; K41-V57 HydrophobicContact CB-CG1 4.17Å
42	L	66	Low	64.8	Low	24 Å²	24	62 Å²	62	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-63.9	-42.5	178.6	-86.9	162.4	0	0	0	112.8	L38 R39 L45 S46 V57 Y58 L61	L38-L42 WeakPolarHBondContact O-CB 3.32Å; L38-L42 PolarHBondContact O-N 3.48Å; R39-L42 WeakPolarHBondContact O-CB 3.24Å; R39-L42 PolarHBondContact O-N 3.33Å; R39-L42 VanDerWaalsContact O-N 3.13Å; L42-L45 CarbonylContact O-C 3.55Å; L42-L45 PolarHBondContact O-N 2.97Å; L42-S46 VanDerWaalsContact O-CB 3.3Å; L42-S46 WeakPolarHBondContact O-CB 3.39Å; L42-S46 PolarHBondContact O-N 2.74Å; L42-V57 HydrophobicContact CD1-CG1 4.31Å; L42-V57 HydrophobicContact CD2-CG1 4.34Å; L42-V57 HydrophobicContact CG-CG1 3.81Å; L42-Y58 HydrophobicContact CD1-CD2 4.08Å; L42-Y58 HydrophobicContact CD2-CD2 3.96Å; L42-L61 HydrophobicContact CD1-CB 4.28Å; L42-L61 HydrophobicContact CD1-CD2 3.69Å; L42-L61 HydrophobicContact CD1-CG 4.48Å
43	D	69.6	Low	64.9	Low	115 Å²	115	63.9 Å²	63.9	62%	0.615	33%	0.325	S	S	*	.	H	α-helix	trans	-63.7	-44.1	176.1	-76.7	-9.7	0	0	0	110.7	R39 L45 S46	R39-D43 PolarHBondContact O-N 3.09Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 3.49Å; D43-S46 PolarHBondContact O-N 3.34Å; D43-S46 PolarHBondContact O-OG 3.48Å
44	L	69.6	Low	64.6	Low	37 Å²	37	59.3 Å²	59.3	19%	0.194	30%	0.301	C	S	.	.	H	α-helix	trans	-65.1	-35.6	176	-165.2	72.9	0	0	0	112.7	R16 V19 F20 L23 G40 K41 T48	R16-L44 HydrophobicContact CB-CD1 4.26Å; R16-L44 HydrophobicContact CG-CD1 4.13Å; V19-L44 HydrophobicContact CB-CD2 4.11Å; V19-L44 HydrophobicContact CG1-CD2 4.11Å; F20-L44 HydrophobicContact CD1-CD2 4.09Å; F20-L44 HydrophobicContact CE1-CB 4.5Å; F20-L44 HydrophobicContact CE1-CD2 3.63Å; F20-L44 HydrophobicContact CE1-CG 4.16Å; F20-L44 HydrophobicContact CZ-CD2 4Å; F20-L44 HydrophobicContact CZ-CG 4.24Å; L23-L44 HydrophobicContact CD1-CD2 4.05Å; G40-L44 WeakPolarHBondContact O-CB 3.38Å; G40-L44 PolarHBondContact O-N 3.01Å; G40-L44 VanDerWaalsContact O-N 3.11Å; K41-L44 PolarHBondContact O-N 3.31Å; L44-T48 PolarHBondContact O-N 2.95Å; L44-T48 PolarHBondContact O-OG1 3.39Å
45	L	64.8	Low	64.5	Low	7 Å²	7	54.4 Å²	54.4	4%	0.037	28%	0.278	C	S	.	.	H	α-helix	trans	-76	-25.5	176.6	-75.4	164.2	0	0	0	112.4	F20 K41 L42 D43 D47 T48 M50 F53 A54 V57	F20-L45 HydrophobicContact CE1-CD2 3.69Å; F20-L45 HydrophobicContact CE1-CG 3.81Å; F20-L45 HydrophobicContact CZ-CD2 3.63Å; F20-L45 HydrophobicContact CZ-CG 4.12Å; K41-L45 HydrophobicContact CB-CD1 4.4Å; K41-L45 WeakPolarHBondContact O-CB 3.45Å; K41-L45 WeakPolarHBondContact O-CD1 3.36Å; K41-L45 WeakPolarHBondContact O-CG 3.21Å; K41-L45 PolarHBondContact O-N 3.32Å; L42-L45 CarbonylContact O-C 3.55Å; L42-L45 PolarHBondContact O-N 2.97Å; D43-L45 VanDerWaalsContact C-N 3.33Å; D43-L45 PolarHBondContact O-N 3.49Å; L45-D47 VanDerWaalsContact C-N 3.25Å; L45-D47 PolarHBondContact O-N 3.46Å; L45-T48 WeakPolarHBondContact CA-OG1 3.45Å; L45-T48 PolarHBondContact O-N 2.94Å; L45-T48 PolarHBondContact O-OG1 2.95Å; L45-M50 HydrophobicContact CD2-CB 4.21Å; L45-M50 HydrophobicContact CD2-CE 3.97Å; L45-F53 HydrophobicContact CD2-CB 4.11Å; L45-A54 HydrophobicContact CB-CB 3.9Å; L45-V57 HydrophobicContact CD1-CB 4.11Å; L45-V57 HydrophobicContact CD1-CG1 4.49Å; L45-V57 HydrophobicContact CD1-CG2 3.75Å
46	S	61.3	Low	64.7	Low	52 Å²	52	53 Å²	53	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-70.9	-26	179.5	76.7	0	0	0	0	112.9	L42 D43 K74	L42-S46 VanDerWaalsContact O-CB 3.3Å; L42-S46 WeakPolarHBondContact O-CB 3.39Å; L42-S46 PolarHBondContact O-N 2.74Å; D43-S46 PolarHBondContact O-N 3.34Å; D43-S46 PolarHBondContact O-OG 3.48Å; S46-K74 PolarHBondContact O-NZ 2.99Å
47	D	61.9	Low	64.4	Low	108 Å²	108	47.5 Å²	47.5	58%	0.578	25%	0.25	S	C	*	.	S	Bend	trans	-92.5	-11	176.2	-76.9	-13.7	0	0	0	113.2	L45	L45-D47 VanDerWaalsContact C-N 3.25Å; L45-D47 PolarHBondContact O-N 3.46Å
48	T	62.2	Low	64.1	Low	9 Å²	9	49.4 Å²	49.4	6%	0.055	26%	0.256	C	S	.	.	S	Bend	trans	-108.3	145.7	174.8	55	0	0	0	0	110.4	R16 L44 L45 M50	R16-T48 HydrophobicContact CB-CG2 4.09Å; L44-T48 PolarHBondContact O-N 2.95Å; L44-T48 PolarHBondContact O-OG1 3.39Å; L45-T48 WeakPolarHBondContact CA-OG1 3.45Å; L45-T48 PolarHBondContact O-N 2.94Å; L45-T48 PolarHBondContact O-OG1 2.95Å; T48-M50 PolarHBondContact O-N 3.22Å
49	N	59.3	Low	64	Low	48 Å²	48	55.1 Å²	55.1	26%	0.257	28%	0.277	S	S	.	.	S	Bend	trans	-78.6	17.2	-176.2	-68.5	-32.2	0	0	0	113.2	V51 V78 E150	N49-V51 WeakPolarHBondContact O-CG2 3.33Å; N49-V51 PolarHBondContact O-N 3.02Å; N49-V78 HydrophobicContact CB-CG1 4.08Å; N49-V78 HydrophobicContact CB-CG2 4.1Å; N49-E150 HydrophobicContact CB-CB 4.22Å; N49-E150 PolarHBondContact ND2-OE2 3.44Å
50	M	59.9	Low	63.9	Low	19 Å²	19	54 Å²	54	9%	0.094	28%	0.281	C	S	.	.			trans	-80.2	64.8	171.8	-63.8	-156.2	-53.9	0	0	110.8	F20 L45 T48 D52 F53 A54 E150	F20-M50 HydrophobicContact CD2-CE 3.73Å; F20-M50 HydrophobicContact CE2-CE 3.31Å; F20-M50 HydrophobicContact CZ-CE 3.79Å; L45-M50 HydrophobicContact CD2-CB 4.21Å; L45-M50 HydrophobicContact CD2-CE 3.97Å; T48-M50 PolarHBondContact O-N 3.22Å; M50-D52 VanDerWaalsContact C-N 3.26Å; M50-D52 PolarHBondContact O-N 3.35Å; M50-F53 HydrophobicContact CB-CB 4.37Å; M50-F53 PolarHBondContact O-N 3.35Å; M50-F53 HydrophobicContact SD-CD2 4.48Å; M50-A54 PolarHBondContact O-N 2.93Å; M50-E150 VanDerWaalsContact CG-O 3.29Å; M50-E150 WeakPolarHBondContact CG-O 3.38Å
51	V	61.5	Low	63.6	Low	14 Å²	14	53.8 Å²	53.8	9%	0.085	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-33.8	-174.1	-130.4	0	0	0	0	111.6	N49 A54 M55 L71 K74 R75 V78	N49-V51 WeakPolarHBondContact O-CG2 3.33Å; N49-V51 PolarHBondContact O-N 3.02Å; V51-A54 WeakPolarHBondContact O-CB 3.29Å; V51-A54 PolarHBondContact O-N 2.85Å; V51-M55 WeakPolarHBondContact O-CG 2.87Å; V51-M55 PolarHBondContact O-N 3.14Å; V51-L71 HydrophobicContact CG1-CD2 4.1Å; V51-K74 HydrophobicContact CG1-CB 4.37Å; V51-R75 HydrophobicContact CB-CB 4.3Å; V51-R75 HydrophobicContact CG1-CB 4.22Å; V51-R75 HydrophobicContact CG2-CB 4.4Å; V51-V78 HydrophobicContact CG2-CB 4.4Å; V51-V78 HydrophobicContact CG2-CG1 4.38Å; V51-V78 HydrophobicContact CG2-CG2 4.35Å
52	D	66.6	Low	63.2	Low	80 Å²	80	57.3 Å²	57.3	43%	0.428	28%	0.284	S	S	.	.	H	α-helix	trans	-69.2	-42.2	-179.4	-70.8	-23.1	0	0	0	112	M50 M55 D56 R75	M50-D52 VanDerWaalsContact C-N 3.26Å; M50-D52 PolarHBondContact O-N 3.35Å; D52-M55 WeakPolarHBondContact O-CB 3.35Å; D52-M55 PolarHBondContact O-N 2.84Å; D52-D56 PolarHBondContact O-N 3.38Å; D52-D56 VanDerWaalsContact O-N 3.1Å; D52-R75 IonicContact OD1-CZ 2.97Å; D52-R75 IonicContact OD1-NE 3.02Å; D52-R75 PolarHBondContact OD1-NE 3.04Å; D52-R75 IonicContact OD1-NH1 3.67Å; D52-R75 IonicContact OD1-NH2 2.92Å; D52-R75 PolarHBondContact OD1-NH2 3.31Å; D52-R75 IonicContact OD2-CZ 3.95Å; D52-R75 IonicContact OD2-NH2 3.21Å; D52-R75 PolarHBondContact OD2-NH2 3Å
53	F	62.3	Low	62.7	Low	130 Å²	130	63.6 Å²	63.6	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-66.5	-37.7	171.5	-89	-86	0	0	0	112.3	L45 M50 M55 D56 V57	L45-F53 HydrophobicContact CD2-CB 4.11Å; M50-F53 HydrophobicContact CB-CB 4.37Å; M50-F53 PolarHBondContact O-N 3.35Å; M50-F53 HydrophobicContact SD-CD2 4.48Å; F53-M55 PolarHBondContact O-N 3.31Å; F53-D56 PolarHBondContact O-N 2.9Å; F53-V57 VanDerWaalsContact O-CG2 3.32Å; F53-V57 WeakPolarHBondContact O-CG2 3.46Å; F53-V57 PolarHBondContact O-N 3.22Å
54	A	60.7	Low	61.6	Low	2 Å²	2	66.2 Å²	66.2	2%	0.017	33%	0.332	C	S	.	.	H	α-helix	trans	-59.7	-38.3	173.3	0	0	0	0	0	111.6	L45 M50 V51 Y58 L71	L45-A54 HydrophobicContact CB-CB 3.9Å; M50-A54 PolarHBondContact O-N 2.93Å; V51-A54 WeakPolarHBondContact O-CB 3.29Å; V51-A54 PolarHBondContact O-N 2.85Å; A54-Y58 VanDerWaalsContact O-CB 3.27Å; A54-Y58 WeakPolarHBondContact O-CB 3.24Å; A54-Y58 PolarHBondContact O-N 3.34Å; A54-L71 HydrophobicContact CB-CD2 4.18Å
55	M	60.7	Low	60.4	Low	15 Å²	15	68.4 Å²	68.4	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-68	-40.1	177.1	-58	-132.2	-65	0	0	112.2	V51 D52 F53 Y58 R59 I67	V51-M55 WeakPolarHBondContact O-CG 2.87Å; V51-M55 PolarHBondContact O-N 3.14Å; D52-M55 WeakPolarHBondContact O-CB 3.35Å; D52-M55 PolarHBondContact O-N 2.84Å; F53-M55 PolarHBondContact O-N 3.31Å; M55-Y58 PolarHBondContact O-N 2.94Å; M55-R59 VanDerWaalsContact O-CG 3.31Å; M55-R59 WeakPolarHBondContact O-CG 3.36Å; M55-R59 PolarHBondContact O-N 2.69Å; M55-I67 HydrophobicContact CE-CD1 3.73Å; M55-I67 HydrophobicContact CG-CG2 4.42Å; M55-I67 HydrophobicContact SD-CB 4.25Å; M55-I67 HydrophobicContact SD-CD1 3.68Å; M55-I67 HydrophobicContact SD-CG1 4.02Å; M55-I67 HydrophobicContact SD-CG2 3.24Å; M55-I67 WeakPolarHBondContact SD-CG2 3.43Å
56	D	66.6	Low	59.2	Low	85 Å²	85	77 Å²	77	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-69.1	-41.7	178.1	-72.4	-17.5	0	0	0	111.8	D52 F53 Y58 R59 N60	D52-D56 PolarHBondContact O-N 3.38Å; D52-D56 VanDerWaalsContact O-N 3.1Å; F53-D56 PolarHBondContact O-N 2.9Å; D56-Y58 VanDerWaalsContact C-N 3.32Å; D56-Y58 PolarHBondContact O-N 2.9Å; D56-R59 PolarHBondContact O-N 2.93Å; D56-N60 VanDerWaalsContact O-CG 3.27Å; D56-N60 PolarHBondContact O-N 2.85Å; D56-N60 PolarHBondContact O-ND2 3.01Å
57	V	62.8	Low	58.7	Low	18 Å²	18	76.6 Å²	76.6	11%	0.109	38%	0.38	C	S	.	.	H	α-helix	trans	-65	-37.2	174.4	177.3	0	0	0	0	111.1	L38 K41 L42 L45 F53 N60 L61	L38-V57 HydrophobicContact CB-CG1 4.48Å; L38-V57 HydrophobicContact CD2-CG1 3.83Å; K41-V57 HydrophobicContact CB-CG1 4.17Å; L42-V57 HydrophobicContact CD1-CG1 4.31Å; L42-V57 HydrophobicContact CD2-CG1 4.34Å; L42-V57 HydrophobicContact CG-CG1 3.81Å; L45-V57 HydrophobicContact CD1-CB 4.11Å; L45-V57 HydrophobicContact CD1-CG1 4.49Å; L45-V57 HydrophobicContact CD1-CG2 3.75Å; F53-V57 VanDerWaalsContact O-CG2 3.32Å; F53-V57 WeakPolarHBondContact O-CG2 3.46Å; F53-V57 PolarHBondContact O-N 3.22Å; V57-N60 PolarHBondContact O-N 2.93Å; V57-L61 PolarHBondContact O-N 3.43Å
58	Y	61.1	Low	58.2	Low	55 Å²	55	73 Å²	73	22%	0.216	36%	0.362	C	S	.	.	H	α-helix	trans	-66.7	-39.5	175.5	-162.5	-91	0	0	0	112.5	L42 A54 M55 D56 N60 L61 Y62 P68	L42-Y58 HydrophobicContact CD1-CD2 4.08Å; L42-Y58 HydrophobicContact CD2-CD2 3.96Å; A54-Y58 VanDerWaalsContact O-CB 3.27Å; A54-Y58 WeakPolarHBondContact O-CB 3.24Å; A54-Y58 PolarHBondContact O-N 3.34Å; M55-Y58 PolarHBondContact O-N 2.94Å; D56-Y58 VanDerWaalsContact C-N 3.32Å; D56-Y58 PolarHBondContact O-N 2.9Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.23Å; Y58-L61 PolarHBondContact O-N 2.79Å; Y58-Y62 HydrophobicContact CD1-CD2 4.38Å; Y58-Y62 HydrophobicContact CD2-CD2 4.4Å; Y58-Y62 AromaticContact CE1-CD2 3.93Å; Y58-Y62 HydrophobicContact CE1-CD2 3.93Å; Y58-Y62 AromaticContact CE2-CD2 3.97Å; Y58-Y62 HydrophobicContact CE2-CD2 3.97Å; Y58-Y62 AromaticContact CE2-CE2 3.91Å; Y58-Y62 HydrophobicContact CE2-CE2 3.91Å; Y58-Y62 AromaticContact CZ-CD2 3.72Å; Y58-Y62 AromaticContact CZ-CE2 3.92Å; Y58-Y62 PolarHBondContact O-N 3.41Å; Y58-P68 HydrophobicContact CD1-CG 4.41Å; Y58-P68 VanDerWaalsContact CE1-CD 3.41Å; Y58-P68 HydrophobicContact CE1-CG 3.75Å; Y58-P68 HydrophobicContact CE2-CG 4.03Å
59	R	64.6	Low	57.9	Low	137 Å²	137	79.3 Å²	79.3	52%	0.517	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-37.8	173.5	-75.9	177.1	-171.2	-152.9	5.8	112.1	M55 D56 Y62	M55-R59 VanDerWaalsContact O-CG 3.31Å; M55-R59 WeakPolarHBondContact O-CG 3.36Å; M55-R59 PolarHBondContact O-N 2.69Å; D56-R59 PolarHBondContact O-N 2.93Å; R59-Y62 CarbonylContact O-C 3.6Å
60	N	65.1	Low	57.8	Low	113 Å²	113	81.3 Å²	81.3	60%	0.604	41%	0.405	S	S	*	.	H	α-helix	trans	-71.3	-34	176.8	-68.9	-15	0	0	0	112.4	D56 V57 Y58	D56-N60 VanDerWaalsContact O-CG 3.27Å; D56-N60 PolarHBondContact O-N 2.85Å; D56-N60 PolarHBondContact O-ND2 3.01Å; V57-N60 PolarHBondContact O-N 2.93Å; Y58-N60 VanDerWaalsContact C-N 3.31Å; Y58-N60 PolarHBondContact O-N 3.23Å
61	L	61.3	Low	57.8	Low	32 Å²	32	81.5 Å²	81.5	17%	0.168	41%	0.407	C	S	.	.	H	α-helix	trans	-75.4	-38.5	179.4	-165.2	86.8	0	0	0	112.5	L38 R39 L42 V57 Y58	L38-L61 HydrophobicContact CB-CD1 3.33Å; L38-L61 HydrophobicContact CD1-CD1 3.96Å; L38-L61 HydrophobicContact CG-CD1 4.3Å; R39-L61 HydrophobicContact CG-CD1 4.42Å; R39-L61 HydrophobicContact CG-CD2 4.12Å; L42-L61 HydrophobicContact CD1-CB 4.28Å; L42-L61 HydrophobicContact CD1-CD2 3.69Å; L42-L61 HydrophobicContact CD1-CG 4.48Å; V57-L61 PolarHBondContact O-N 3.43Å; Y58-L61 PolarHBondContact O-N 2.79Å
62	Y	60	Low	57.9	Low	103 Å²	103	88.9 Å²	88.9	40%	0.404	43%	0.433	S	S	.	.	S	Bend	trans	-121.9	86	177.7	-62.5	-80.7	0	0	0	109.5	Y58 R59 D64 T65	Y58-Y62 HydrophobicContact CD1-CD2 4.38Å; Y58-Y62 HydrophobicContact CD2-CD2 4.4Å; Y58-Y62 AromaticContact CE1-CD2 3.93Å; Y58-Y62 HydrophobicContact CE1-CD2 3.93Å; Y58-Y62 AromaticContact CE2-CD2 3.97Å; Y58-Y62 HydrophobicContact CE2-CD2 3.97Å; Y58-Y62 AromaticContact CE2-CE2 3.91Å; Y58-Y62 HydrophobicContact CE2-CE2 3.91Å; Y58-Y62 AromaticContact CZ-CD2 3.72Å; Y58-Y62 AromaticContact CZ-CE2 3.92Å; Y58-Y62 PolarHBondContact O-N 3.41Å; R59-Y62 CarbonylContact O-C 3.6Å; Y62-D64 PolarHBondContact O-N 3.34Å; Y62-T65 VanDerWaalsContact CB-OG1 3.23Å; Y62-T65 WeakPolarHBondContact CB-OG1 3.01Å; Y62-T65 PolarHBondContact O-N 2.84Å
63	N	54.1	Low	58.1	Low	156 Å²	156	91.1 Å²	91.1	83%	0.834	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.3	98	172.4	-102.3	-8.3	0	0	0	111.4
64	D	46.8	Very low	58.4	Low	170 Å²	170	89.8 Å²	89.8	91%	0.909	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	29.6	173.9	-85.1	-22.5	0	0	0	119.3	Y62	Y62-D64 PolarHBondContact O-N 3.34Å
65	T	45	Very low	58.8	Low	84 Å²	84	94.5 Å²	94.5	52%	0.515	45%	0.452	S	S	.	.			trans	-97.8	127.6	159.5	50.3	0	0	0	0	112	Y62	Y62-T65 VanDerWaalsContact CB-OG1 3.23Å; Y62-T65 WeakPolarHBondContact CB-OG1 3.01Å; Y62-T65 PolarHBondContact O-N 2.84Å
66	E	39.6	Very low	59.4	Low	186 Å²	186	98.4 Å²	98.4	87%	0.869	48%	0.477	S	S	*	.			trans	-45.7	137.2	-169.2	-65.4	-177.9	155.6	0	0	114.4	P68	E66-P68 WeakPolarHBondContact O-CD 3.47Å
67	I	50.5	Low	59.9	Low	44 Å²	44	99.9 Å²	99.9	23%	0.226	48%	0.481	C	S	.	.			trans	-46.4	123.6	172.2	-65.6	159.1	0	0	0	109.6	M55 H69 L71	M55-I67 HydrophobicContact CE-CD1 3.73Å; M55-I67 HydrophobicContact CG-CG2 4.42Å; M55-I67 HydrophobicContact SD-CB 4.25Å; M55-I67 HydrophobicContact SD-CD1 3.68Å; M55-I67 HydrophobicContact SD-CG1 4.02Å; M55-I67 HydrophobicContact SD-CG2 3.24Å; M55-I67 WeakPolarHBondContact SD-CG2 3.43Å; I67-H69 PolarHBondContact O-N 3.15Å; I67-L71 HydrophobicContact CG2-CB 4.27Å
68	P	52.3	Low	60.3	Low	32 Å²	32	99.6 Å²	99.6	21%	0.208	48%	0.48	C	S	.	.			trans	-52.5	131.1	175.6	-27.7	33.2	0	0	0	111.9	Y58 E66 T70 L71 R72	Y58-P68 HydrophobicContact CD1-CG 4.41Å; Y58-P68 VanDerWaalsContact CE1-CD 3.41Å; Y58-P68 HydrophobicContact CE1-CG 3.75Å; Y58-P68 HydrophobicContact CE2-CG 4.03Å; E66-P68 WeakPolarHBondContact O-CD 3.47Å; P68-T70 WeakPolarHBondContact CB-OG1 3.06Å; P68-T70 PolarHBondContact O-N 3.02Å; P68-L71 HydrophobicContact CB-CD1 4.25Å; P68-L71 HydrophobicContact CG-CD1 4.01Å; P68-L71 PolarHBondContact O-N 3.11Å; P68-R72 PolarHBondContact O-N 3.49Å
69	H	54	Low	61	Low	142 Å²	142	100 Å²	100	66%	0.657	49%	0.488	S	S	*	.	H	α-helix	trans	-52.5	-28.9	176.2	-103.2	-93.2	0	0	0	112.9	I67 R72 E73	I67-H69 PolarHBondContact O-N 3.15Å; H69-R72 PolarHBondContact O-N 2.86Å; H69-E73 PolarHBondContact O-N 3.49Å
70	T	59	Low	61.7	Low	90 Å²	90	95.8 Å²	95.8	55%	0.552	48%	0.482	S	S	*	.	H	α-helix	trans	-63.7	-37.9	175.6	49	0	0	0	0	113.7	P68 R72 K74	P68-T70 WeakPolarHBondContact CB-OG1 3.06Å; P68-T70 PolarHBondContact O-N 3.02Å; T70-R72 VanDerWaalsContact C-N 3.35Å; T70-K74 WeakPolarHBondContact O-CB 3.44Å; T70-K74 WeakPolarHBondContact O-CG 3.4Å; T70-K74 PolarHBondContact O-N 3.42Å
71	L	60.2	Low	62	Low	24 Å²	24	94 Å²	94	13%	0.126	47%	0.47	C	S	.	.	H	α-helix	trans	-72.4	-32.9	175.5	-80.1	156.6	0	0	0	111.2	V51 A54 I67 P68 R75	V51-L71 HydrophobicContact CG1-CD2 4.1Å; A54-L71 HydrophobicContact CB-CD2 4.18Å; I67-L71 HydrophobicContact CG2-CB 4.27Å; P68-L71 HydrophobicContact CB-CD1 4.25Å; P68-L71 HydrophobicContact CG-CD1 4.01Å; P68-L71 PolarHBondContact O-N 3.11Å; L71-R75 WeakPolarHBondContact O-CB 3.41Å; L71-R75 PolarHBondContact O-N 3.33Å
72	R	62.2	Low	62.6	Low	169 Å²	169	94.5 Å²	94.5	64%	0.638	47%	0.472	S	S	*	.	H	α-helix	trans	-71.5	-39.5	176.6	-153	175.5	-172.9	174.3	2.4	111.9	P68 H69 T70 R75 T76	P68-R72 PolarHBondContact O-N 3.49Å; H69-R72 PolarHBondContact O-N 2.86Å; T70-R72 VanDerWaalsContact C-N 3.35Å; R72-R75 WeakPolarHBondContact O-CB 3.27Å; R72-R75 PolarHBondContact O-N 3.12Å; R72-T76 PolarHBondContact O-N 3.23Å; R72-T76 VanDerWaalsContact O-N 3.09Å; R72-T76 PolarHBondContact O-OG1 2.84Å
73	E	72.1	Confident	63.3	Low	126 Å²	126	96.5 Å²	96.5	59%	0.589	48%	0.483	S	S	*	.	H	α-helix	trans	-63.8	-48.5	172.2	-80.1	178.8	172.7	0	0	111.7	H69 R75 T76 E77	H69-E73 PolarHBondContact O-N 3.49Å; E73-R75 VanDerWaalsContact C-N 3.26Å; E73-R75 PolarHBondContact O-N 3.16Å; E73-T76 WeakPolarHBondContact CA-OG1 3.34Å; E73-T76 PolarHBondContact O-N 3.37Å; E73-T76 VanDerWaalsContact O-N 3.08Å; E73-T76 PolarHBondContact O-OG1 3.49Å; E73-E77 PolarHBondContact O-N 2.83Å
74	K	67.3	Low	64.4	Low	103 Å²	103	95.4 Å²	95.4	45%	0.448	47%	0.473	S	S	.	.	H	α-helix	trans	-55.3	-41.3	172.8	-81.1	-173.1	172.6	-170.7	0	111.7	S46 V51 T70 T76 E77 V78	S46-K74 PolarHBondContact O-NZ 2.99Å; V51-K74 HydrophobicContact CG1-CB 4.37Å; T70-K74 WeakPolarHBondContact O-CB 3.44Å; T70-K74 WeakPolarHBondContact O-CG 3.4Å; T70-K74 PolarHBondContact O-N 3.42Å; K74-T76 PolarHBondContact O-N 3.19Å; K74-E77 PolarHBondContact O-N 2.73Å; K74-V78 WeakPolarHBondContact O-CB 3.38Å; K74-V78 WeakPolarHBondContact O-CG2 3.47Å; K74-V78 PolarHBondContact O-N 2.73Å
75	R	69.1	Low	65.7	Low	100 Å²	100	88.6 Å²	88.6	38%	0.377	44%	0.437	S	S	.	.	H	α-helix	trans	-60.5	-46.2	175.1	-171.6	-176.7	-172.3	-177.6	10.2	112.1	V51 D52 L71 R72 E73 E77 V78 V79	V51-R75 HydrophobicContact CB-CB 4.3Å; V51-R75 HydrophobicContact CG1-CB 4.22Å; V51-R75 HydrophobicContact CG2-CB 4.4Å; D52-R75 IonicContact OD1-CZ 2.97Å; D52-R75 IonicContact OD1-NE 3.02Å; D52-R75 PolarHBondContact OD1-NE 3.04Å; D52-R75 IonicContact OD1-NH1 3.67Å; D52-R75 IonicContact OD1-NH2 2.92Å; D52-R75 PolarHBondContact OD1-NH2 3.31Å; D52-R75 IonicContact OD2-CZ 3.95Å; D52-R75 IonicContact OD2-NH2 3.21Å; D52-R75 PolarHBondContact OD2-NH2 3Å; L71-R75 WeakPolarHBondContact O-CB 3.41Å; L71-R75 PolarHBondContact O-N 3.33Å; R72-R75 WeakPolarHBondContact O-CB 3.27Å; R72-R75 PolarHBondContact O-N 3.12Å; E73-R75 VanDerWaalsContact C-N 3.26Å; E73-R75 PolarHBondContact O-N 3.16Å; R75-E77 VanDerWaalsContact C-N 3.32Å; R75-E77 PolarHBondContact O-N 2.97Å; R75-V78 PolarHBondContact O-N 3.42Å; R75-V79 HydrophobicContact CG-CG2 4.33Å; R75-V79 VanDerWaalsContact O-CB 3.32Å; R75-V79 WeakPolarHBondContact O-CB 3.45Å; R75-V79 WeakPolarHBondContact O-CG2 3.46Å; R75-V79 PolarHBondContact O-N 2.89Å
76	T	73.6	Confident	66.8	Low	97 Å²	97	89.1 Å²	89.1	60%	0.595	43%	0.433	S	S	*	.	H	α-helix	trans	-63	-37.4	176	20.5	0	0	0	0	112.8	R72 E73 K74 A80	R72-T76 PolarHBondContact O-N 3.23Å; R72-T76 VanDerWaalsContact O-N 3.09Å; R72-T76 PolarHBondContact O-OG1 2.84Å; E73-T76 WeakPolarHBondContact CA-OG1 3.34Å; E73-T76 PolarHBondContact O-N 3.37Å; E73-T76 VanDerWaalsContact O-N 3.08Å; E73-T76 PolarHBondContact O-OG1 3.49Å; K74-T76 PolarHBondContact O-N 3.19Å; T76-A80 WeakPolarHBondContact O-CB 3.13Å; T76-A80 PolarHBondContact O-N 3.3Å
77	E	76.9	Confident	68.3	Low	117 Å²	117	82.2 Å²	82.2	55%	0.547	41%	0.412	S	S	.	.	H	α-helix	trans	-68.1	-47.4	177.2	-168.8	176.3	-174.9	0	0	111.6	E73 K74 R75 V79 A80 Q81	E73-E77 PolarHBondContact O-N 2.83Å; K74-E77 PolarHBondContact O-N 2.73Å; R75-E77 VanDerWaalsContact C-N 3.32Å; R75-E77 PolarHBondContact O-N 2.97Å; E77-V79 PolarHBondContact O-N 2.8Å; E77-A80 PolarHBondContact O-N 3.38Å; E77-Q81 WeakPolarHBondContact O-CG 3.31Å; E77-Q81 PolarHBondContact O-N 3.49Å
78	V	72.1	Confident	69.1	Low	12 Å²	12	85.4 Å²	85.4	7%	0.073	43%	0.426	C	S	.	.	H	α-helix	trans	-60.5	-44.9	175.3	171.6	0	0	0	0	110.3	N49 V51 K74 R75 A80 Q81 L82 F147	N49-V78 HydrophobicContact CB-CG1 4.08Å; N49-V78 HydrophobicContact CB-CG2 4.1Å; V51-V78 HydrophobicContact CG2-CB 4.4Å; V51-V78 HydrophobicContact CG2-CG1 4.38Å; V51-V78 HydrophobicContact CG2-CG2 4.35Å; K74-V78 WeakPolarHBondContact O-CB 3.38Å; K74-V78 WeakPolarHBondContact O-CG2 3.47Å; K74-V78 PolarHBondContact O-N 2.73Å; R75-V78 PolarHBondContact O-N 3.42Å; V78-A80 VanDerWaalsContact C-N 3.33Å; V78-A80 PolarHBondContact O-N 3.24Å; V78-Q81 PolarHBondContact O-N 3.02Å; V78-L82 WeakPolarHBondContact O-CB 3.26Å; V78-L82 PolarHBondContact O-N 3.3Å; V78-F147 HydrophobicContact CB-CZ 4.38Å; V78-F147 HydrophobicContact CG1-CE1 4.28Å; V78-F147 HydrophobicContact CG1-CE2 4.46Å; V78-F147 HydrophobicContact CG1-CZ 3.63Å; V78-F147 VanDerWaalsContact O-CZ 3.24Å; V78-F147 WeakPolarHBondContact O-CZ 3.25Å
79	V	75.1	Confident	69.6	Low	64 Å²	64	84 Å²	84	39%	0.388	42%	0.417	S	S	.	.	H	α-helix	trans	-67.7	-33.1	177.6	173	0	0	0	0	112.1	R75 E77 L82 K83	R75-V79 HydrophobicContact CG-CG2 4.33Å; R75-V79 VanDerWaalsContact O-CB 3.32Å; R75-V79 WeakPolarHBondContact O-CB 3.45Å; R75-V79 WeakPolarHBondContact O-CG2 3.46Å; R75-V79 PolarHBondContact O-N 2.89Å; E77-V79 PolarHBondContact O-N 2.8Å; V79-L82 PolarHBondContact O-N 3.43Å; V79-K83 WeakPolarHBondContact O-CG 3.49Å; V79-K83 PolarHBondContact O-N 2.79Å
80	A	79.1	Confident	70.1	Confident	48 Å²	48	81.9 Å²	81.9	40%	0.397	41%	0.407	S	S	.	.	H	α-helix	trans	-68.4	-44	174.9	0	0	0	0	0	111.6	T76 E77 V78 L82 K83 Q84	T76-A80 WeakPolarHBondContact O-CB 3.13Å; T76-A80 PolarHBondContact O-N 3.3Å; E77-A80 PolarHBondContact O-N 3.38Å; V78-A80 VanDerWaalsContact C-N 3.33Å; V78-A80 PolarHBondContact O-N 3.24Å; A80-L82 VanDerWaalsContact C-N 3.33Å; A80-K83 PolarHBondContact O-N 3.23Å; A80-Q84 PolarHBondContact O-N 3.2Å
81	Q	72.7	Confident	70.4	Confident	74 Å²	74	81 Å²	81	35%	0.346	40%	0.403	S	S	.	.	H	α-helix	trans	-62	-41	173.1	-70.7	179	11.7	0	0	111.1	E77 V78 K83 Q84 L85 F147	E77-Q81 WeakPolarHBondContact O-CG 3.31Å; E77-Q81 PolarHBondContact O-N 3.49Å; V78-Q81 PolarHBondContact O-N 3.02Å; Q81-K83 PolarHBondContact O-N 3.35Å; Q81-Q84 PolarHBondContact O-N 3.36Å; Q81-L85 WeakPolarHBondContact O-CB 3.34Å; Q81-L85 WeakPolarHBondContact O-CD1 3.12Å; Q81-L85 PolarHBondContact O-N 3.36Å; Q81-F147 HydrophobicContact CB-CE2 4Å; Q81-F147 HydrophobicContact CB-CZ 3.96Å
82	L	72.9	Confident	70.4	Confident	43 Å²	43	80.5 Å²	80.5	23%	0.225	40%	0.4	C	S	.	.	H	α-helix	trans	-57.3	-48.6	174.7	-158.6	153.6	0	0	0	110.9	V78 V79 A80 L85 Q86 F147	V78-L82 WeakPolarHBondContact O-CB 3.26Å; V78-L82 PolarHBondContact O-N 3.3Å; V79-L82 PolarHBondContact O-N 3.43Å; A80-L82 VanDerWaalsContact C-N 3.33Å; L82-L85 PolarHBondContact O-N 3.31Å; L82-Q86 WeakPolarHBondContact O-CB 3.49Å; L82-Q86 PolarHBondContact O-N 3.48Å; L82-F147 HydrophobicContact CB-CD1 4.39Å; L82-F147 HydrophobicContact CB-CE1 3.57Å; L82-F147 HydrophobicContact CB-CZ 4.3Å; L82-F147 HydrophobicContact CD1-CE1 3.97Å; L82-F147 HydrophobicContact CG-CD1 4.3Å; L82-F147 HydrophobicContact CG-CE1 3.83Å
83	K	74.9	Confident	70.5	Confident	146 Å²	146	74.1 Å²	74.1	64%	0.635	38%	0.38	S	S	*	.	H	α-helix	trans	-66.6	-37.1	179.9	-75.7	-179.8	179.7	-178.8	0	113.1	V79 A80 Q81 G87	V79-K83 WeakPolarHBondContact O-CG 3.49Å; V79-K83 PolarHBondContact O-N 2.79Å; A80-K83 PolarHBondContact O-N 3.23Å; Q81-K83 PolarHBondContact O-N 3.35Å; K83-G87 PolarHBondContact O-N 3Å
84	Q	77.1	Confident	70	Confident	133 Å²	133	73.8 Å²	73.8	62%	0.621	38%	0.377	S	S	*	.	H	α-helix	trans	-65.1	-52.3	175	-77.9	-179.9	-15.6	0	0	111.1	A80 Q81 Q86 G87 E88	A80-Q84 PolarHBondContact O-N 3.2Å; Q81-Q84 PolarHBondContact O-N 3.36Å; Q84-Q86 VanDerWaalsContact C-N 3.31Å; Q84-Q86 PolarHBondContact O-N 2.89Å; Q84-G87 PolarHBondContact O-N 3.34Å; Q84-G87 VanDerWaalsContact O-N 3.14Å; Q84-E88 WeakPolarHBondContact O-CG 3.27Å; Q84-E88 PolarHBondContact O-N 2.91Å
85	L	73.3	Confident	69.6	Low	27 Å²	27	71.4 Å²	71.4	14%	0.141	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-36.6	178.3	-77.9	153.2	0	0	0	112.1	Q81 L82 E88 T89 R143 Y144 F147	Q81-L85 WeakPolarHBondContact O-CB 3.34Å; Q81-L85 WeakPolarHBondContact O-CD1 3.12Å; Q81-L85 PolarHBondContact O-N 3.36Å; L82-L85 PolarHBondContact O-N 3.31Å; L85-E88 PolarHBondContact O-N 3.35Å; L85-T89 WeakPolarHBondContact O-CB 3.18Å; L85-T89 VanDerWaalsContact O-CG2 3.29Å; L85-T89 WeakPolarHBondContact O-CG2 3.3Å; L85-T89 PolarHBondContact O-N 2.9Å; L85-T89 PolarHBondContact O-OG1 2.81Å; L85-R143 HydrophobicContact CD2-CB 4.31Å; L85-Y144 HydrophobicContact CB-CD2 3.88Å; L85-F147 HydrophobicContact CD1-CB 4.23Å; L85-F147 HydrophobicContact CD1-CD1 4.44Å; L85-F147 HydrophobicContact CD1-CD2 4.14Å; L85-F147 HydrophobicContact CD1-CG 4Å
86	Q	69	Low	69	Low	95 Å²	95	68 Å²	68	44%	0.444	36%	0.356	S	S	.	.	H	α-helix	trans	-65.6	-39.6	174.6	-170.2	174.6	9.9	0	0	111.4	L82 Q84 T89 E90 Y144	L82-Q86 WeakPolarHBondContact O-CB 3.49Å; L82-Q86 PolarHBondContact O-N 3.48Å; Q84-Q86 VanDerWaalsContact C-N 3.31Å; Q84-Q86 PolarHBondContact O-N 2.89Å; Q86-T89 WeakPolarHBondContact CA-OG1 3.47Å; Q86-T89 PolarHBondContact O-N 3.42Å; Q86-T89 PolarHBondContact O-OG1 3.09Å; Q86-E90 WeakPolarHBondContact O-CB 3.46Å; Q86-E90 PolarHBondContact O-N 3.13Å; Q86-Y144 HydrophobicContact CB-CE2 4.42Å
87	G	70.1	Confident	68.1	Low	41 Å²	41	70 Å²	70	42%	0.423	36%	0.359	S	S	.	.	H	α-helix	trans	-66.2	-37.5	174.7	0	0	0	0	0	113.3	K83 Q84 P91	K83-G87 PolarHBondContact O-N 3Å; Q84-G87 PolarHBondContact O-N 3.34Å; Q84-G87 VanDerWaalsContact O-N 3.14Å; G87-P91 WeakPolarHBondContact O-CD 3.31Å
88	E	68.1	Low	67.1	Low	111 Å²	111	67.8 Å²	67.8	52%	0.519	35%	0.35	S	S	.	.	H	α-helix	trans	-71.3	-30.6	175.1	-70.2	176.3	-177.5	0	0	112.7	Q84 L85 T140	Q84-E88 WeakPolarHBondContact O-CG 3.27Å; Q84-E88 PolarHBondContact O-N 2.91Å; L85-E88 PolarHBondContact O-N 3.35Å; E88-T140 HydrophobicContact CB-CG2 4.15Å
89	T	63.3	Low	66.1	Low	2 Å²	2	71.4 Å²	71.4	1%	0.012	37%	0.374	C	S	.	.	H	α-helix	trans	-92.6	-12.6	179.6	54.9	0	0	0	0	113.9	L85 Q86 I92 V93 T140 Y144	L85-T89 WeakPolarHBondContact O-CB 3.18Å; L85-T89 VanDerWaalsContact O-CG2 3.29Å; L85-T89 WeakPolarHBondContact O-CG2 3.3Å; L85-T89 PolarHBondContact O-N 2.9Å; L85-T89 PolarHBondContact O-OG1 2.81Å; Q86-T89 WeakPolarHBondContact CA-OG1 3.47Å; Q86-T89 PolarHBondContact O-N 3.42Å; Q86-T89 PolarHBondContact O-OG1 3.09Å; T89-I92 HydrophobicContact CG2-CD1 4.19Å; T89-I92 CarbonylContact O-C 3.54Å; T89-I92 WeakPolarHBondContact O-CA 3.39Å; T89-I92 VanDerWaalsContact O-CB 3.24Å; T89-I92 WeakPolarHBondContact O-CB 3.29Å; T89-I92 PolarHBondContact O-N 2.92Å; T89-V93 WeakPolarHBondContact O-CG2 3.41Å; T89-V93 PolarHBondContact O-N 3.39Å; T89-T140 HydrophobicContact CG2-CG2 4.13Å; T89-Y144 HydrophobicContact CG2-CD1 3.93Å; T89-Y144 HydrophobicContact CG2-CD2 4.33Å; T89-Y144 HydrophobicContact CG2-CG 3.75Å
90	E	64.6	Low	65	Low	97 Å²	97	74.8 Å²	74.8	45%	0.453	39%	0.386	S	S	.	.	H	α-helix	trans	-58.5	-42.4	178.5	-156.3	-171.2	151.8	0	0	113.4	Q86 I92 V93 K94	Q86-E90 WeakPolarHBondContact O-CB 3.46Å; Q86-E90 PolarHBondContact O-N 3.13Å; E90-I92 PolarHBondContact O-N 2.91Å; E90-V93 PolarHBondContact O-N 3.18Å; E90-K94 WeakPolarHBondContact O-CG 3.47Å; E90-K94 PolarHBondContact O-N 3.48Å; E90-K94 WeakPolarHBondContact OE1-CE 3.38Å; E90-K94 IonicContact OE1-NZ 3.37Å; E90-K94 PolarHBondContact OE1-NZ 3.49Å
91	P	64.2	Low	63.8	Low	73 Å²	73	72.8 Å²	72.8	47%	0.474	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-35.2	170.8	-21.7	33.9	0	0	0	112.2	G87 M95	G87-P91 WeakPolarHBondContact O-CD 3.31Å; P91-M95 WeakPolarHBondContact O-CG 3.38Å; P91-M95 PolarHBondContact O-N 3.21Å; P91-M95 VanDerWaalsContact O-N 3.09Å
92	I	61.7	Low	62.9	Low	12 Å²	12	71.3 Å²	71.3	6%	0.062	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-46	-179.3	-53.7	177.3	0	0	0	110.2	T89 E90 K94 M95 F96 Y137 L141	T89-I92 HydrophobicContact CG2-CD1 4.19Å; T89-I92 CarbonylContact O-C 3.54Å; T89-I92 WeakPolarHBondContact O-CA 3.39Å; T89-I92 VanDerWaalsContact O-CB 3.24Å; T89-I92 WeakPolarHBondContact O-CB 3.29Å; T89-I92 PolarHBondContact O-N 2.92Å; E90-I92 PolarHBondContact O-N 2.91Å; I92-K94 VanDerWaalsContact C-N 3.35Å; I92-K94 PolarHBondContact O-N 3.5Å; I92-M95 WeakPolarHBondContact O-CB 3.29Å; I92-M95 PolarHBondContact O-N 3.46Å; I92-F96 HydrophobicContact CG2-CD2 3.78Å; I92-F96 HydrophobicContact CG2-CE2 3.36Å; I92-F96 HydrophobicContact CG2-CZ 4.47Å; I92-F96 WeakPolarHBondContact O-CD2 3.32Å; I92-F96 PolarHBondContact O-N 3.47Å; I92-Y137 HydrophobicContact CD1-CD1 3.76Å; I92-Y137 HydrophobicContact CD1-CE1 4.49Å; I92-Y137 HydrophobicContact CG1-CD1 4.07Å; I92-Y137 HydrophobicContact CG1-CE1 4.43Å; I92-L141 HydrophobicContact CG2-CD1 4.36Å
93	V	63	Low	62	Low	36 Å²	36	78.4 Å²	78.4	22%	0.218	39%	0.389	C	S	.	.	H	α-helix	trans	-62	-42.9	176.3	177.2	0	0	0	0	110.7	T89 E90 M95 F96 E97 Y160	T89-V93 WeakPolarHBondContact O-CG2 3.41Å; T89-V93 PolarHBondContact O-N 3.39Å; E90-V93 PolarHBondContact O-N 3.18Å; V93-M95 VanDerWaalsContact C-N 3.27Å; V93-M95 PolarHBondContact O-N 3.28Å; V93-F96 CarbonylContact O-C 3.43Å; V93-F96 PolarHBondContact O-N 3.42Å; V93-E97 HydrophobicContact CG1-CG 4.18Å; V93-E97 PolarHBondContact O-N 3.05Å; V93-Y160 HydrophobicContact CG2-CE1 4.07Å
94	K	62.4	Low	60.9	Low	118 Å²	118	74.7 Å²	74.7	51%	0.513	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-31.4	175.5	-75	175.6	-174.6	161.7	0	113.3	E90 I92 F96	E90-K94 WeakPolarHBondContact O-CG 3.47Å; E90-K94 PolarHBondContact O-N 3.48Å; E90-K94 WeakPolarHBondContact OE1-CE 3.38Å; E90-K94 IonicContact OE1-NZ 3.37Å; E90-K94 PolarHBondContact OE1-NZ 3.49Å; I92-K94 VanDerWaalsContact C-N 3.35Å; I92-K94 PolarHBondContact O-N 3.5Å; K94-F96 VanDerWaalsContact C-N 3.28Å; K94-F96 PolarHBondContact O-N 2.89Å
95	M	58.6	Low	59.6	Low	54 Å²	54	68.9 Å²	68.9	27%	0.266	35%	0.347	S	S	.	.	H	α-helix	trans	-71.2	-23.5	173.9	-68.7	-66.4	-85.6	0	0	112.9	P91 I92 V93 T101 Y122	P91-M95 WeakPolarHBondContact O-CG 3.38Å; P91-M95 PolarHBondContact O-N 3.21Å; P91-M95 VanDerWaalsContact O-N 3.09Å; I92-M95 WeakPolarHBondContact O-CB 3.29Å; I92-M95 PolarHBondContact O-N 3.46Å; V93-M95 VanDerWaalsContact C-N 3.27Å; V93-M95 PolarHBondContact O-N 3.28Å; M95-T101 PolarHBondContact O-OG1 3.47Å; M95-Y122 HydrophobicContact CE-CD1 4.49Å; M95-Y122 HydrophobicContact CE-CD2 4.02Å; M95-Y122 HydrophobicContact CE-CE1 3.85Å; M95-Y122 HydrophobicContact CE-CE2 3.3Å; M95-Y122 VanDerWaalsContact CE-OH 3.27Å; M95-Y122 WeakPolarHBondContact CE-OH 3.29Å
96	F	55.6	Low	58.6	Low	27 Å²	27	74.8 Å²	74.8	12%	0.118	37%	0.373	C	S	.	.	H	α-helix	trans	-99	-21.5	179.6	-67.2	-55.7	0	0	0	114.3	I92 V93 K94 D98 M105 L167	I92-F96 HydrophobicContact CG2-CD2 3.78Å; I92-F96 HydrophobicContact CG2-CE2 3.36Å; I92-F96 HydrophobicContact CG2-CZ 4.47Å; I92-F96 WeakPolarHBondContact O-CD2 3.32Å; I92-F96 PolarHBondContact O-N 3.47Å; V93-F96 CarbonylContact O-C 3.43Å; V93-F96 PolarHBondContact O-N 3.42Å; K94-F96 VanDerWaalsContact C-N 3.28Å; K94-F96 PolarHBondContact O-N 2.89Å; F96-D98 PolarHBondContact O-N 2.85Å; F96-M105 HydrophobicContact CD1-CE 3.67Å; F96-M105 HydrophobicContact CD1-SD 4.42Å; F96-M105 HydrophobicContact CE1-CE 3.37Å; F96-M105 HydrophobicContact CZ-CE 4.48Å; F96-L167 HydrophobicContact CE1-CD1 3.75Å; F96-L167 HydrophobicContact CZ-CD1 3.56Å; F96-L167 HydrophobicContact CZ-CD2 4.48Å
97	E	55.4	Low	57.6	Low	140 Å²	140	74.4 Å²	74.4	65%	0.654	38%	0.381	S	S	*	.	S	Bend	trans	-68.4	-12.8	171.8	-82.7	-176.7	159.3	0	0	113.2	V93 P99	V93-E97 HydrophobicContact CG1-CG 4.18Å; V93-E97 PolarHBondContact O-N 3.05Å; E97-P99 VanDerWaalsContact O-CD 3.23Å; E97-P99 WeakPolarHBondContact O-CD 3.31Å
98	D	55	Low	56.3	Low	70 Å²	70	74.2 Å²	74.2	37%	0.374	37%	0.374	S	S	.	.			trans	-61.5	116.8	171.9	-96.8	-8.7	0	0	0	110.4	F96 E100 T101 T102 K121	F96-D98 PolarHBondContact O-N 2.85Å; D98-E100 PolarHBondContact O-N 3.35Å; D98-E100 VanDerWaalsContact O-N 3.11Å; D98-T101 WeakPolarHBondContact CB-OG1 3.43Å; D98-T101 PolarHBondContact O-N 3.48Å; D98-T101 VanDerWaalsContact O-N 3.15Å; D98-T101 PolarHBondContact O-OG1 2.86Å; D98-T102 PolarHBondContact O-N 3.39Å; D98-T102 PolarHBondContact O-OG1 2.82Å; D98-K121 IonicContact OD2-NZ 3.03Å; D98-K121 PolarHBondContact OD2-NZ 2.81Å
99	P	51.7	Low	55.4	Low	89 Å²	89	80.3 Å²	80.3	58%	0.578	39%	0.392	S	S	*	.	H	α-helix	trans	-67.9	-13.8	-174.4	22.9	-31.4	0	0	0	114.5	E97 T102 R103	E97-P99 VanDerWaalsContact O-CD 3.23Å; E97-P99 WeakPolarHBondContact O-CD 3.31Å; P99-T102 WeakPolarHBondContact CA-OG1 3.25Å; P99-R103 WeakPolarHBondContact O-CB 3.18Å; P99-R103 WeakPolarHBondContact O-CG 3.27Å; P99-R103 PolarHBondContact O-N 3.5Å
100	E	52.6	Low	54.4	Low	134 Å²	134	85.4 Å²	85.4	63%	0.626	42%	0.419	S	S	*	.	H	α-helix	trans	-78.7	-37.8	172.6	-76	-163.4	146	0	0	112.6	D98 Q104	D98-E100 PolarHBondContact O-N 3.35Å; D98-E100 VanDerWaalsContact O-N 3.11Å; E100-Q104 WeakPolarHBondContact O-CB 3.43Å; E100-Q104 WeakPolarHBondContact O-CG 3.48Å; E100-Q104 PolarHBondContact O-N 3.4Å
101	T	52.8	Low	53.6	Low	6 Å²	6	82 Å²	82	4%	0.037	41%	0.41	C	S	.	.	H	α-helix	trans	-73.6	-37.6	179	40.4	0	0	0	0	111.3	M95 D98 Q104 M105 Y117 K121	M95-T101 PolarHBondContact O-OG1 3.47Å; D98-T101 WeakPolarHBondContact CB-OG1 3.43Å; D98-T101 PolarHBondContact O-N 3.48Å; D98-T101 VanDerWaalsContact O-N 3.15Å; D98-T101 PolarHBondContact O-OG1 2.86Å; T101-Q104 PolarHBondContact O-N 2.81Å; T101-M105 WeakPolarHBondContact O-CB 3.47Å; T101-M105 WeakPolarHBondContact O-CG 3.06Å; T101-M105 PolarHBondContact O-N 3.43Å; T101-Y117 HydrophobicContact CG2-CE1 4.41Å; T101-K121 HydrophobicContact CG2-CD 4.14Å
102	T	53.8	Low	52.9	Low	44 Å²	44	88.1 Å²	88.1	27%	0.27	42%	0.423	S	S	.	.	H	α-helix	trans	-67.7	-38.4	174.8	21.7	0	0	0	0	113.1	D98 P99 M105 Q106	D98-T102 PolarHBondContact O-N 3.39Å; D98-T102 PolarHBondContact O-OG1 2.82Å; P99-T102 WeakPolarHBondContact CA-OG1 3.25Å; T102-M105 PolarHBondContact O-N 2.86Å; T102-Q106 WeakPolarHBondContact O-CG 3.27Å; T102-Q106 PolarHBondContact O-N 3.4Å
103	R	54.7	Low	52.3	Low	192 Å²	192	93.5 Å²	93.5	73%	0.725	45%	0.45	S	S	*	.	H	α-helix	trans	-69.5	-38.6	174	-78.8	179.9	175.7	-179.9	0.9	112.4	P99 M105 Q106 S107	P99-R103 WeakPolarHBondContact O-CB 3.18Å; P99-R103 WeakPolarHBondContact O-CG 3.27Å; P99-R103 PolarHBondContact O-N 3.5Å; R103-M105 VanDerWaalsContact C-N 3.35Å; R103-Q106 PolarHBondContact O-N 3.44Å; R103-S107 PolarHBondContact O-N 3.29Å; R103-S107 VanDerWaalsContact O-N 3.14Å; R103-S107 PolarHBondContact O-OG 2.91Å
104	Q	51.4	Low	51.9	Low	67 Å²	67	92.1 Å²	92.1	31%	0.313	44%	0.441	S	S	.	.	H	α-helix	trans	-71.8	-28.6	175.3	-73.2	-159.5	12.7	0	0	113.3	E100 T101 Q106 S107 S108 Y117	E100-Q104 WeakPolarHBondContact O-CB 3.43Å; E100-Q104 WeakPolarHBondContact O-CG 3.48Å; E100-Q104 PolarHBondContact O-N 3.4Å; T101-Q104 PolarHBondContact O-N 2.81Å; Q104-Q106 VanDerWaalsContact C-N 3.31Å; Q104-Q106 PolarHBondContact O-N 2.9Å; Q104-S107 WeakPolarHBondContact CA-OG 3.33Å; Q104-S107 PolarHBondContact O-N 2.96Å; Q104-S107 PolarHBondContact O-OG 3.09Å; Q104-S107 VanDerWaalsContact O-OG 3.09Å; Q104-S108 VanDerWaalsContact O-CB 3.24Å; Q104-S108 WeakPolarHBondContact O-CB 3.3Å; Q104-S108 PolarHBondContact O-N 3.32Å; Q104-S108 PolarHBondContact O-OG 3.28Å; Q104-Y117 VanDerWaalsContact OE1-CE2 3.26Å
105	M	49.6	Very low	51.3	Low	12 Å²	12	89 Å²	89	6%	0.059	43%	0.427	C	S	.	.	H	α-helix	trans	-62.4	-36.3	169.9	-82.9	-180	171	0	0	113.2	F96 T101 T102 R103 L114 F163 V166 L167	F96-M105 HydrophobicContact CD1-CE 3.67Å; F96-M105 HydrophobicContact CD1-SD 4.42Å; F96-M105 HydrophobicContact CE1-CE 3.37Å; F96-M105 HydrophobicContact CZ-CE 4.48Å; T101-M105 WeakPolarHBondContact O-CB 3.47Å; T101-M105 WeakPolarHBondContact O-CG 3.06Å; T101-M105 PolarHBondContact O-N 3.43Å; T102-M105 PolarHBondContact O-N 2.86Å; R103-M105 VanDerWaalsContact C-N 3.35Å; M105-L114 HydrophobicContact CB-CD2 4.33Å; M105-L114 HydrophobicContact CE-CD2 4.29Å; M105-L114 HydrophobicContact CG-CD1 4.21Å; M105-L114 HydrophobicContact CG-CD2 3.41Å; M105-L114 VanDerWaalsContact CG-CD2 3.41Å; M105-L114 HydrophobicContact CG-CG 4.45Å; M105-F163 HydrophobicContact SD-CD1 4.17Å; M105-F163 HydrophobicContact SD-CE1 4.47Å; M105-V166 HydrophobicContact CG-CG1 4.18Å; M105-L167 HydrophobicContact CE-CD1 3.79Å
106	Q	52	Low	51.1	Low	150 Å²	150	91 Å²	91	70%	0.701	44%	0.439	S	S	*	.	H	α-helix	trans	-79.1	-28.7	177.6	-68.9	177	-1.1	0	0	112.6	T102 R103 Q104	T102-Q106 WeakPolarHBondContact O-CG 3.27Å; T102-Q106 PolarHBondContact O-N 3.4Å; R103-Q106 PolarHBondContact O-N 3.44Å; Q104-Q106 VanDerWaalsContact C-N 3.31Å; Q104-Q106 PolarHBondContact O-N 2.9Å
107	S	49.6	Very low	51.2	Low	88 Å²	88	92.5 Å²	92.5	62%	0.615	45%	0.445	S	S	*	.	H	α-helix	trans	-82.8	-32.2	177.7	63.7	0	0	0	0	113.5	R103 Q104 R109	R103-S107 PolarHBondContact O-N 3.29Å; R103-S107 VanDerWaalsContact O-N 3.14Å; R103-S107 PolarHBondContact O-OG 2.91Å; Q104-S107 WeakPolarHBondContact CA-OG 3.33Å; Q104-S107 PolarHBondContact O-N 2.96Å; Q104-S107 PolarHBondContact O-OG 3.09Å; Q104-S107 VanDerWaalsContact O-OG 3.09Å; S107-R109 PolarHBondContact O-N 2.84Å
108	S	41.9	Very low	51.2	Low	37 Å²	37	86.9 Å²	86.9	26%	0.259	42%	0.419	S	S	.	.			trans	-95.6	93	-175.7	-62.6	0	0	0	0	110.2	Q104 D110 L114	Q104-S108 VanDerWaalsContact O-CB 3.24Å; Q104-S108 WeakPolarHBondContact O-CB 3.3Å; Q104-S108 PolarHBondContact O-N 3.32Å; Q104-S108 PolarHBondContact O-OG 3.28Å; S108-D110 PolarHBondContact O-N 2.85Å; S108-L114 VanDerWaalsContact O-CD1 3.3Å; S108-L114 WeakPolarHBondContact O-CD1 3.4Å
109	R	49.6	Very low	51	Low	239 Å²	239	86.9 Å²	86.9	90%	0.902	42%	0.417	S	S	*	.			trans	-67.3	-10	177.6	-114.5	178.9	175.2	-174	-2	114.5	S107	S107-R109 PolarHBondContact O-N 2.84Å
110	D	43.1	Very low	51.2	Low	109 Å²	109	88.7 Å²	88.7	58%	0.583	42%	0.417	S	S	*	.			trans	-105.1	114.2	-178.9	-77.3	-45	0	0	0	111.1	S108 R112 M113 L114	S108-D110 PolarHBondContact O-N 2.85Å; D110-R112 PolarHBondContact O-N 3.42Å; D110-R112 VanDerWaalsContact O-N 3.09Å; D110-M113 HydrophobicContact CB-CG 4.38Å; D110-M113 PolarHBondContact O-N 2.86Å; D110-M113 VanDerWaalsContact O-N 3.08Å; D110-L114 PolarHBondContact O-N 3.46Å
111	G	46.7	Very low	51.2	Low	25 Å²	25	85.3 Å²	85.3	26%	0.258	40%	0.401	S	S	.	.	H	α-helix	trans	-52.9	-32.6	177.7	0	0	0	0	0	113	L114 F115	G111-L114 PolarHBondContact O-N 3.13Å; G111-F115 WeakPolarHBondContact O-CD2 3.36Å; G111-F115 PolarHBondContact O-N 3.26Å
112	R	49.2	Very low	51	Low	202 Å²	202	88.5 Å²	88.5	76%	0.762	41%	0.413	S	S	*	.	H	α-helix	trans	-65.4	-38.7	177.5	-85.4	-176.3	179	-167.7	-1.4	114.6	D110 L114 F115 D116	D110-R112 PolarHBondContact O-N 3.42Å; D110-R112 VanDerWaalsContact O-N 3.09Å; R112-L114 VanDerWaalsContact C-N 3.33Å; R112-F115 WeakPolarHBondContact O-CB 2.95Å; R112-F115 PolarHBondContact O-N 3.45Å; R112-D116 PolarHBondContact O-N 2.84Å
113	M	50.8	Low	50.7	Low	125 Å²	125	91.1 Å²	91.1	62%	0.616	43%	0.425	S	S	*	.	H	α-helix	trans	-74.1	-29.7	179.2	-70.2	-104.1	-107.3	0	0	111.4	D110 Y117	D110-M113 HydrophobicContact CB-CG 4.38Å; D110-M113 PolarHBondContact O-N 2.86Å; D110-M113 VanDerWaalsContact O-N 3.08Å; M113-Y117 WeakPolarHBondContact O-CB 3.25Å; M113-Y117 PolarHBondContact O-N 3.48Å
114	L	54.2	Low	50.2	Low	6 Å²	6	88.6 Å²	88.6	3%	0.031	43%	0.426	C	S	.	.	H	α-helix	trans	-70.5	-38.4	168.4	-95.2	146.8	0	0	0	112.2	M105 S108 D110 G111 R112 Y117 L118 V166	M105-L114 HydrophobicContact CB-CD2 4.33Å; M105-L114 HydrophobicContact CE-CD2 4.29Å; M105-L114 HydrophobicContact CG-CD1 4.21Å; M105-L114 HydrophobicContact CG-CD2 3.41Å; M105-L114 VanDerWaalsContact CG-CD2 3.41Å; M105-L114 HydrophobicContact CG-CG 4.45Å; S108-L114 VanDerWaalsContact O-CD1 3.3Å; S108-L114 WeakPolarHBondContact O-CD1 3.4Å; D110-L114 PolarHBondContact O-N 3.46Å; G111-L114 PolarHBondContact O-N 3.13Å; R112-L114 VanDerWaalsContact C-N 3.33Å; L114-Y117 PolarHBondContact O-N 3.33Å; L114-L118 WeakPolarHBondContact O-CB 3.34Å; L114-L118 WeakPolarHBondContact O-CD1 3.32Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.24Å; L114-L118 PolarHBondContact O-N 2.86Å; L114-V166 HydrophobicContact CD1-CG1 3.56Å
115	F	49.5	Very low	49.9	Very low	52 Å²	52	91 Å²	91	23%	0.228	44%	0.44	C	S	.	.	H	α-helix	trans	-58.5	-49.1	171.3	-94.7	-72	0	0	0	111.8	G111 R112 E119 L167 P169	G111-F115 WeakPolarHBondContact O-CD2 3.36Å; G111-F115 PolarHBondContact O-N 3.26Å; R112-F115 WeakPolarHBondContact O-CB 2.95Å; R112-F115 PolarHBondContact O-N 3.45Å; F115-E119 WeakPolarHBondContact O-CB 3.24Å; F115-E119 PolarHBondContact O-N 2.9Å; F115-L167 WeakPolarHBondContact CE2-O 3.15Å; F115-L167 WeakPolarHBondContact CZ-O 3.37Å; F115-P169 HydrophobicContact CD2-CG 4.44Å; F115-P169 VanDerWaalsContact CE2-CD 3.5Å; F115-P169 HydrophobicContact CE2-CG 3.6Å; F115-P169 HydrophobicContact CZ-CG 3.97Å
116	D	54.8	Low	49.3	Very low	97 Å²	97	98.6 Å²	98.6	52%	0.519	47%	0.47	S	S	.	.	H	α-helix	trans	-68	-38.4	179.4	-68.4	-12.1	0	0	0	111.1	R112 E119 E120	R112-D116 PolarHBondContact O-N 2.84Å; D116-E119 CarbonylContact O-C 3.57Å; D116-E119 WeakPolarHBondContact O-CB 3.49Å; D116-E119 PolarHBondContact O-N 3.37Å; D116-E120 VanDerWaalsContact O-CB 3.3Å; D116-E120 WeakPolarHBondContact O-CB 3.21Å; D116-E120 PolarHBondContact O-N 3.43Å
117	Y	57.3	Low	48.7	Very low	59 Å²	59	98.6 Å²	98.6	23%	0.231	47%	0.474	C	S	.	.	H	α-helix	trans	-70.2	-39.7	177	-176.4	-101.8	0	0	0	113.1	T101 Q104 M113 L114 E119 E120 K121	T101-Y117 HydrophobicContact CG2-CE1 4.41Å; Q104-Y117 VanDerWaalsContact OE1-CE2 3.26Å; M113-Y117 WeakPolarHBondContact O-CB 3.25Å; M113-Y117 PolarHBondContact O-N 3.48Å; L114-Y117 PolarHBondContact O-N 3.33Å; Y117-E119 VanDerWaalsContact C-N 3.31Å; Y117-E120 PolarHBondContact O-N 3.29Å; Y117-K121 WeakPolarHBondContact O-CB 3.33Å; Y117-K121 PolarHBondContact O-N 3.48Å
118	L	55.6	Low	48.2	Very low	21 Å²	21	102.7 Å²	102.7	11%	0.11	48%	0.483	C	S	.	.	H	α-helix	trans	-65.5	-38.9	172	-76.7	159.9	0	0	0	110.2	L114 K121 Y122 L167	L114-L118 WeakPolarHBondContact O-CB 3.34Å; L114-L118 WeakPolarHBondContact O-CD1 3.32Å; L114-L118 VanDerWaalsContact O-CG 3.24Å; L114-L118 WeakPolarHBondContact O-CG 3.24Å; L114-L118 PolarHBondContact O-N 2.86Å; L118-K121 PolarHBondContact O-N 3.14Å; L118-Y122 VanDerWaalsContact O-CB 3.24Å; L118-Y122 WeakPolarHBondContact O-CB 3.2Å; L118-Y122 WeakPolarHBondContact O-CD2 3.27Å; L118-Y122 PolarHBondContact O-N 2.82Å; L118-L167 HydrophobicContact CD1-CD2 3.71Å; L118-L167 HydrophobicContact CD1-CG 4.18Å
119	E	50.4	Low	48.2	Very low	70 Å²	70	105 Å²	105	33%	0.327	49%	0.492	S	S	.	.	H	α-helix	trans	-63.3	-39.9	173	-172.1	158.8	-129.4	0	0	112.2	F115 D116 Y117 Y122 N123 R134	F115-E119 WeakPolarHBondContact O-CB 3.24Å; F115-E119 PolarHBondContact O-N 2.9Å; D116-E119 CarbonylContact O-C 3.57Å; D116-E119 WeakPolarHBondContact O-CB 3.49Å; D116-E119 PolarHBondContact O-N 3.37Å; Y117-E119 VanDerWaalsContact C-N 3.31Å; E119-Y122 PolarHBondContact O-N 2.88Å; E119-N123 VanDerWaalsContact O-CB 3.27Å; E119-N123 WeakPolarHBondContact O-CB 3.24Å; E119-N123 VanDerWaalsContact O-CG 3.29Å; E119-N123 PolarHBondContact O-N 3.09Å; E119-N123 PolarHBondContact O-ND2 3.25Å; E119-R134 IonicContact OE1-CZ 2.67Å; E119-R134 IonicContact OE1-NH1 2.97Å; E119-R134 IonicContact OE1-NH2 3.96Å; E119-R134 PolarHBondContact OE1-NH2 2.92Å
120	E	55.4	Low	47.6	Very low	127 Å²	127	97.8 Å²	97.8	59%	0.593	48%	0.479	S	S	*	.	H	α-helix	trans	-70.7	-37.7	178	-155.1	173.8	-157.4	0	0	112.1	D116 Y117 N124	D116-E120 VanDerWaalsContact O-CB 3.3Å; D116-E120 WeakPolarHBondContact O-CB 3.21Å; D116-E120 PolarHBondContact O-N 3.43Å; Y117-E120 PolarHBondContact O-N 3.29Å; E120-N124 PolarHBondContact O-ND2 3.48Å
121	K	53.5	Low	47.7	Very low	64 Å²	64	96.5 Å²	96.5	28%	0.278	48%	0.478	S	S	.	.	H	α-helix	trans	-73	-35.6	173.9	-157.2	-176.2	176.4	-169.9	0	111.9	D98 T101 Y117 L118 N124	D98-K121 IonicContact OD2-NZ 3.03Å; D98-K121 PolarHBondContact OD2-NZ 2.81Å; T101-K121 HydrophobicContact CG2-CD 4.14Å; Y117-K121 WeakPolarHBondContact O-CB 3.33Å; Y117-K121 PolarHBondContact O-N 3.48Å; L118-K121 PolarHBondContact O-N 3.14Å; K121-N124 PolarHBondContact O-N 3.43Å
122	Y	48.9	Very low	47.4	Very low	73 Å²	73	100.9 Å²	100.9	29%	0.286	50%	0.496	S	S	.	.	H	α-helix	trans	-74.9	-37.1	177.2	-96.8	-89.3	0	0	0	113.4	M95 L118 E119 N124 L125 Y126	M95-Y122 HydrophobicContact CE-CD1 4.49Å; M95-Y122 HydrophobicContact CE-CD2 4.02Å; M95-Y122 HydrophobicContact CE-CE1 3.85Å; M95-Y122 HydrophobicContact CE-CE2 3.3Å; M95-Y122 VanDerWaalsContact CE-OH 3.27Å; M95-Y122 WeakPolarHBondContact CE-OH 3.29Å; L118-Y122 VanDerWaalsContact O-CB 3.24Å; L118-Y122 WeakPolarHBondContact O-CB 3.2Å; L118-Y122 WeakPolarHBondContact O-CD2 3.27Å; L118-Y122 PolarHBondContact O-N 2.82Å; E119-Y122 PolarHBondContact O-N 2.88Å; Y122-N124 PolarHBondContact O-N 3.33Å; Y122-L125 PolarHBondContact O-N 2.8Å; Y122-L125 VanDerWaalsContact O-N 3.12Å; Y122-Y126 PolarHBondContact O-N 3.22Å
123	N	46.7	Very low	47.1	Very low	99 Å²	99	95.3 Å²	95.3	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-58.9	-30.2	173	-85.1	-31.5	0	0	0	112	E119	E119-N123 VanDerWaalsContact O-CB 3.27Å; E119-N123 WeakPolarHBondContact O-CB 3.24Å; E119-N123 VanDerWaalsContact O-CG 3.29Å; E119-N123 PolarHBondContact O-N 3.09Å; E119-N123 PolarHBondContact O-ND2 3.25Å
124	N	44.9	Very low	47.1	Very low	139 Å²	139	92.2 Å²	92.2	74%	0.743	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-15	178.6	-78.3	-56.9	0	0	0	114.6	E120 K121 Y122	E120-N124 PolarHBondContact O-ND2 3.48Å; K121-N124 PolarHBondContact O-N 3.43Å; Y122-N124 PolarHBondContact O-N 3.33Å
125	L	43.4	Very low	47.2	Very low	118 Å²	118	98.4 Å²	98.4	62%	0.618	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-34.9	-176.2	-140.2	85.5	0	0	0	114.2	Y122	Y122-L125 PolarHBondContact O-N 2.8Å; Y122-L125 VanDerWaalsContact O-N 3.12Å
126	Y	37.4	Very low	47.8	Very low	171 Å²	171	101.7 Å²	101.7	67%	0.671	50%	0.503	S	S	*	.			trans	-146.7	108.8	176.6	-86.7	-89.8	0	0	0	110.5	Y122 H128	Y122-Y126 PolarHBondContact O-N 3.22Å; Y126-H128 PolarHBondContact O-N 2.86Å
127	N	40	Very low	48.3	Very low	150 Å²	150	100.5 Å²	100.5	80%	0.802	49%	0.492	S	S	*	.	S	Bend	trans	-62	20.2	178.1	-100.5	-33.6	0	0	0	115.8
128	H	39.3	Very low	48.6	Very low	173 Å²	173	99.2 Å²	99.2	80%	0.801	49%	0.489	S	S	*	.			trans	-154	52.4	-175.6	-75	-59.2	0	0	0	113.7	Y126	Y126-H128 PolarHBondContact O-N 2.86Å
129	L	41.2	Very low	49.2	Very low	85 Å²	85	100.8 Å²	100.8	45%	0.445	50%	0.498	S	S	.	.			trans	-135.1	99.5	164.3	-81.4	103.9	0	0	0	112.4	F133	L129-F133 HydrophobicContact CD2-CB 3.8Å; L129-F133 HydrophobicContact CD2-CD1 3Å; L129-F133 HydrophobicContact CD2-CD2 4.38Å; L129-F133 HydrophobicContact CD2-CE1 3.52Å; L129-F133 HydrophobicContact CD2-CG 3.51Å; L129-F133 HydrophobicContact CD2-CZ 4.42Å; L129-F133 HydrophobicContact CG-CD1 4.46Å
130	S	37.7	Very low	50.2	Low	89 Å²	89	98.8 Å²	98.8	62%	0.622	49%	0.49	S	S	*	.			trans	-46.7	146.4	170.3	-43.6	0	0	0	0	112.1	D132 F133	S130-D132 PolarHBondContact O-N 3.34Å; S130-F133 PolarHBondContact O-N 3.32Å
131	S	44.9	Very low	50.9	Low	82 Å²	82	93 Å²	93	57%	0.573	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.7	-28.4	172.8	-160.8	0	0	0	0	115.4	R134	S131-R134 PolarHBondContact O-N 3.11Å
132	D	40.3	Very low	51.7	Low	117 Å²	117	92.4 Å²	92.4	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-68.2	-33.3	-179.4	-63.9	-42.4	0	0	0	114.6	S130 R134 Q135	S130-D132 PolarHBondContact O-N 3.34Å; D132-R134 PolarHBondContact O-N 2.87Å; D132-Q135 PolarHBondContact O-N 3.28Å
133	F	42.5	Very low	52.8	Low	85 Å²	85	95.9 Å²	95.9	37%	0.373	47%	0.472	S	S	.	.	H	α-helix	trans	-70.5	-20.3	-178.2	-147.7	-120.1	0	0	0	112.3	L129 S130 E136 Y137	L129-F133 HydrophobicContact CD2-CB 3.8Å; L129-F133 HydrophobicContact CD2-CD1 3Å; L129-F133 HydrophobicContact CD2-CD2 4.38Å; L129-F133 HydrophobicContact CD2-CE1 3.52Å; L129-F133 HydrophobicContact CD2-CG 3.51Å; L129-F133 HydrophobicContact CD2-CZ 4.42Å; L129-F133 HydrophobicContact CG-CD1 4.46Å; S130-F133 PolarHBondContact O-N 3.32Å; F133-E136 WeakPolarHBondContact CD2-OE2 3.44Å; F133-Y137 HydrophobicContact CD1-CD2 4.01Å; F133-Y137 HydrophobicContact CD1-CE1 4.29Å; F133-Y137 AromaticContact CD1-CE2 3.17Å; F133-Y137 HydrophobicContact CD1-CE2 3.17Å; F133-Y137 AromaticContact CD1-CZ 3.35Å; F133-Y137 WeakPolarHBondContact CD1-OH 3.49Å; F133-Y137 HydrophobicContact CE1-CE1 4.02Å; F133-Y137 AromaticContact CE1-CE2 3.69Å; F133-Y137 HydrophobicContact CE1-CE2 3.69Å; F133-Y137 AromaticContact CE1-CZ 3.29Å; F133-Y137 WeakPolarHBondContact CE1-OH 3.38Å; F133-Y137 HydrophobicContact CG-CE2 4.14Å; F133-Y137 WeakPolarHBondContact O-CD2 3.46Å; F133-Y137 PolarHBondContact O-N 3.13Å; F133-Y137 VanDerWaalsContact O-N 3.13Å
134	R	51.2	Low	54.2	Low	60 Å²	60	91.6 Å²	91.6	23%	0.226	45%	0.449	C	S	.	.	H	α-helix	trans	-75.3	-30.8	177.7	-78.4	-176.3	-82.2	172.1	-3.9	113.4	E119 S131 D132 L138	E119-R134 IonicContact OE1-CZ 2.67Å; E119-R134 IonicContact OE1-NH1 2.97Å; E119-R134 IonicContact OE1-NH2 3.96Å; E119-R134 PolarHBondContact OE1-NH2 2.92Å; S131-R134 PolarHBondContact O-N 3.11Å; D132-R134 PolarHBondContact O-N 2.87Å; R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 3.44Å; R134-L138 VanDerWaalsContact O-N 3.16Å
135	Q	56.3	Low	55.5	Low	136 Å²	136	85 Å²	85	64%	0.636	41%	0.414	S	S	*	.	H	α-helix	trans	-72	-37.3	172.7	-74.4	-177.1	-2.4	0	0	111.6	D132 L138 D139	D132-Q135 PolarHBondContact O-N 3.28Å; Q135-L138 PolarHBondContact O-N 3.34Å; Q135-D139 PolarHBondContact O-N 3.09Å
136	E	61.5	Low	57	Low	120 Å²	120	85 Å²	85	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-63	-41.1	172.9	-70.7	-174	158	0	0	111.4	F133 L138 D139 T140	F133-E136 WeakPolarHBondContact CD2-OE2 3.44Å; E136-L138 PolarHBondContact O-N 3.33Å; E136-D139 PolarHBondContact O-N 2.93Å; E136-T140 WeakPolarHBondContact O-CB 3.41Å; E136-T140 PolarHBondContact O-N 3.04Å; E136-T140 PolarHBondContact O-OG1 3.37Å
137	Y	65.1	Low	58.7	Low	73 Å²	73	77.4 Å²	77.4	29%	0.286	38%	0.379	S	S	.	.	H	α-helix	trans	-63.3	-38.3	174.1	-72.8	-54.5	0	0	0	114	I92 F133 L141	I92-Y137 HydrophobicContact CD1-CD1 3.76Å; I92-Y137 HydrophobicContact CD1-CE1 4.49Å; I92-Y137 HydrophobicContact CG1-CD1 4.07Å; I92-Y137 HydrophobicContact CG1-CE1 4.43Å; F133-Y137 HydrophobicContact CD1-CD2 4.01Å; F133-Y137 HydrophobicContact CD1-CE1 4.29Å; F133-Y137 AromaticContact CD1-CE2 3.17Å; F133-Y137 HydrophobicContact CD1-CE2 3.17Å; F133-Y137 AromaticContact CD1-CZ 3.35Å; F133-Y137 WeakPolarHBondContact CD1-OH 3.49Å; F133-Y137 HydrophobicContact CE1-CE1 4.02Å; F133-Y137 AromaticContact CE1-CE2 3.69Å; F133-Y137 HydrophobicContact CE1-CE2 3.69Å; F133-Y137 AromaticContact CE1-CZ 3.29Å; F133-Y137 WeakPolarHBondContact CE1-OH 3.38Å; F133-Y137 HydrophobicContact CG-CE2 4.14Å; F133-Y137 WeakPolarHBondContact O-CD2 3.46Å; F133-Y137 PolarHBondContact O-N 3.13Å; F133-Y137 VanDerWaalsContact O-N 3.13Å; Y137-L141 VanDerWaalsContact O-CB 3.3Å; Y137-L141 WeakPolarHBondContact O-CB 3.43Å; Y137-L141 PolarHBondContact O-N 3.04Å
138	L	64.6	Low	60.2	Low	31 Å²	31	71 Å²	71	16%	0.162	35%	0.345	C	S	.	.	H	α-helix	trans	-66.6	-40.4	174.8	-77.6	166.9	0	0	0	111.4	R134 Q135 E136 L141 Y142 F164 L167 V168	R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 3.44Å; R134-L138 VanDerWaalsContact O-N 3.16Å; Q135-L138 PolarHBondContact O-N 3.34Å; E136-L138 PolarHBondContact O-N 3.33Å; L138-L141 PolarHBondContact O-N 3Å; L138-Y142 WeakPolarHBondContact O-CB 3.38Å; L138-Y142 PolarHBondContact O-N 2.85Å; L138-F164 HydrophobicContact CB-CD2 4.49Å; L138-F164 HydrophobicContact CB-CE2 4Å; L138-F164 HydrophobicContact CD2-CD2 3.78Å; L138-F164 HydrophobicContact CD2-CE2 3.98Å; L138-F164 WeakPolarHBondContact O-CE2 3.2Å; L138-L167 HydrophobicContact CD2-CB 4Å; L138-V168 HydrophobicContact CD1-CG2 4.35Å; L138-V168 HydrophobicContact CD2-CG2 4.04Å
139	D	68.3	Low	61.9	Low	55 Å²	55	64 Å²	64	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-68.1	-40.2	175.9	-165.3	44.7	0	0	0	111.6	Q135 E136 Y142 R143	Q135-D139 PolarHBondContact O-N 3.09Å; E136-D139 PolarHBondContact O-N 2.93Å; D139-Y142 PolarHBondContact O-N 3.11Å; D139-R143 WeakPolarHBondContact O-CB 3.39Å; D139-R143 VanDerWaalsContact O-CG 3.25Å; D139-R143 WeakPolarHBondContact O-CG 3.46Å; D139-R143 PolarHBondContact O-N 2.73Å; D139-R143 IonicContact OD1-NE 3.75Å; D139-R143 IonicContact OD2-CZ 2.71Å; D139-R143 IonicContact OD2-NE 2.74Å; D139-R143 PolarHBondContact OD2-NE 3.03Å; D139-R143 IonicContact OD2-NH2 3.06Å; D139-R143 PolarHBondContact OD2-NH2 3.01Å
140	T	70.4	Confident	63.3	Low	27 Å²	27	62.2 Å²	62.2	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-41.1	173.8	-57.7	0	0	0	0	111.6	E88 T89 E136 Y142 R143 Y144	E88-T140 HydrophobicContact CB-CG2 4.15Å; T89-T140 HydrophobicContact CG2-CG2 4.13Å; E136-T140 WeakPolarHBondContact O-CB 3.41Å; E136-T140 PolarHBondContact O-N 3.04Å; E136-T140 PolarHBondContact O-OG1 3.37Å; T140-Y142 VanDerWaalsContact C-N 3.35Å; T140-Y142 PolarHBondContact O-N 3.42Å; T140-R143 PolarHBondContact O-N 3.42Å; T140-Y144 VanDerWaalsContact O-CB 3.31Å; T140-Y144 WeakPolarHBondContact O-CB 3.41Å; T140-Y144 PolarHBondContact O-N 3.48Å
141	L	70.1	Confident	64.7	Low	6 Å²	6	59.8 Å²	59.8	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-41.4	173.7	-173.4	71.9	0	0	0	111.3	I92 Y137 L138 Y144 A145 Y160 F164	I92-L141 HydrophobicContact CG2-CD1 4.36Å; Y137-L141 VanDerWaalsContact O-CB 3.3Å; Y137-L141 WeakPolarHBondContact O-CB 3.43Å; Y137-L141 PolarHBondContact O-N 3.04Å; L138-L141 PolarHBondContact O-N 3Å; L141-Y144 PolarHBondContact O-N 2.85Å; L141-A145 WeakPolarHBondContact O-CB 3.2Å; L141-A145 PolarHBondContact O-N 2.93Å; L141-Y160 HydrophobicContact CD1-CD1 3.96Å; L141-Y160 HydrophobicContact CD1-CG 4.36Å; L141-F164 HydrophobicContact CD2-CB 4.16Å; L141-F164 HydrophobicContact CD2-CD2 4.45Å
142	Y	70.9	Confident	65.8	Low	51 Å²	51	57.1 Å²	57.1	20%	0.2	27%	0.269	C	S	.	.	H	α-helix	trans	-66.5	-43	176.5	-179.4	-98.7	0	0	0	112.1	L138 D139 T140 Y144 A145 K146 F164	L138-Y142 WeakPolarHBondContact O-CB 3.38Å; L138-Y142 PolarHBondContact O-N 2.85Å; D139-Y142 PolarHBondContact O-N 3.11Å; T140-Y142 VanDerWaalsContact C-N 3.35Å; T140-Y142 PolarHBondContact O-N 3.42Å; Y142-Y144 VanDerWaalsContact C-N 3.32Å; Y142-Y144 PolarHBondContact O-N 3.15Å; Y142-A145 PolarHBondContact O-N 3.27Å; Y142-K146 WeakPolarHBondContact O-CB 3.29Å; Y142-K146 PolarHBondContact O-N 3.3Å; Y142-F164 HydrophobicContact CD2-CE1 4.41Å; Y142-F164 HydrophobicContact CD2-CZ 4.33Å
143	R	73.4	Confident	67.4	Low	146 Å²	146	54.8 Å²	54.8	55%	0.551	26%	0.256	S	S	*	.	H	α-helix	trans	-61.4	-41.5	173.9	-72.3	173.6	-167.7	-168.8	5.1	111.2	L85 D139 T140 K146 F147	L85-R143 HydrophobicContact CD2-CB 4.31Å; D139-R143 WeakPolarHBondContact O-CB 3.39Å; D139-R143 VanDerWaalsContact O-CG 3.25Å; D139-R143 WeakPolarHBondContact O-CG 3.46Å; D139-R143 PolarHBondContact O-N 2.73Å; D139-R143 IonicContact OD1-NE 3.75Å; D139-R143 IonicContact OD2-CZ 2.71Å; D139-R143 IonicContact OD2-NE 2.74Å; D139-R143 PolarHBondContact OD2-NE 3.03Å; D139-R143 IonicContact OD2-NH2 3.06Å; D139-R143 PolarHBondContact OD2-NH2 3.01Å; T140-R143 PolarHBondContact O-N 3.42Å; R143-K146 PolarHBondContact O-N 3.44Å; R143-F147 VanDerWaalsContact O-CB 3.31Å; R143-F147 WeakPolarHBondContact O-CB 3.43Å; R143-F147 PolarHBondContact O-N 2.93Å
144	Y	75	Confident	68.8	Low	9 Å²	9	52.3 Å²	52.3	4%	0.035	25%	0.245	C	C	.	.	H	α-helix	trans	-67.1	-43.6	175.9	-177.4	-117.9	0	0	0	112.4	L85 Q86 T89 T140 L141 Y142 K146 F147 Q148 Y160	L85-Y144 HydrophobicContact CB-CD2 3.88Å; Q86-Y144 HydrophobicContact CB-CE2 4.42Å; T89-Y144 HydrophobicContact CG2-CD1 3.93Å; T89-Y144 HydrophobicContact CG2-CD2 4.33Å; T89-Y144 HydrophobicContact CG2-CG 3.75Å; T140-Y144 VanDerWaalsContact O-CB 3.31Å; T140-Y144 WeakPolarHBondContact O-CB 3.41Å; T140-Y144 PolarHBondContact O-N 3.48Å; L141-Y144 PolarHBondContact O-N 2.85Å; Y142-Y144 VanDerWaalsContact C-N 3.32Å; Y142-Y144 PolarHBondContact O-N 3.15Å; Y144-K146 VanDerWaalsContact C-N 3.34Å; Y144-K146 PolarHBondContact O-N 3.36Å; Y144-F147 PolarHBondContact O-N 3.42Å; Y144-Q148 HydrophobicContact CD1-CG 4.32Å; Y144-Q148 HydrophobicContact CD2-CG 4.35Å; Y144-Q148 HydrophobicContact CE1-CG 4.07Å; Y144-Q148 HydrophobicContact CE2-CG 4.11Å; Y144-Q148 HydrophobicContact CG-CG 4.49Å; Y144-Q148 WeakPolarHBondContact O-CB 3.33Å; Y144-Q148 WeakPolarHBondContact O-CG 3.25Å; Y144-Q148 PolarHBondContact O-N 3.37Å; Y144-Q148 PolarHBondContact OH-NE2 2.97Å; Y144-Y160 HydrophobicContact CD1-CD2 4.1Å; Y144-Y160 HydrophobicContact CD1-CE2 4.01Å; Y144-Y160 AromaticContact CE1-CD2 3.97Å; Y144-Y160 HydrophobicContact CE1-CD2 3.97Å; Y144-Y160 HydrophobicContact CE1-CE1 4.42Å; Y144-Y160 AromaticContact CE1-CE2 3.41Å; Y144-Y160 HydrophobicContact CE1-CE2 3.41Å; Y144-Y160 VanDerWaalsContact CE1-CE2 3.41Å; Y144-Y160 AromaticContact CE1-CZ 3.67Å
145	A	71.6	Confident	69.7	Low	2 Å²	2	52.1 Å²	52.1	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-41.9	175.3	0	0	0	0	0	111.6	L141 Y142 F147 Q148 Y149 L161	L141-A145 WeakPolarHBondContact O-CB 3.2Å; L141-A145 PolarHBondContact O-N 2.93Å; Y142-A145 PolarHBondContact O-N 3.27Å; A145-F147 VanDerWaalsContact C-N 3.33Å; A145-F147 PolarHBondContact O-N 3.1Å; A145-Q148 PolarHBondContact O-N 2.67Å; A145-Y149 WeakPolarHBondContact O-CB 2.9Å; A145-Y149 PolarHBondContact O-N 3.04Å; A145-L161 HydrophobicContact CB-CD2 3.96Å; A145-L161 HydrophobicContact CB-CG 4.08Å
146	K	74.8	Confident	70.4	Confident	117 Å²	117	46.2 Å²	46.2	51%	0.509	23%	0.228	S	C	.	.	H	α-helix	trans	-60.5	-43.8	173.2	-172.9	-175	178.7	-159.1	0	111.2	Y142 R143 Y144 Y149 E150	Y142-K146 WeakPolarHBondContact O-CB 3.29Å; Y142-K146 PolarHBondContact O-N 3.3Å; R143-K146 PolarHBondContact O-N 3.44Å; Y144-K146 VanDerWaalsContact C-N 3.34Å; Y144-K146 PolarHBondContact O-N 3.36Å; K146-Y149 PolarHBondContact O-N 3.33Å; K146-E150 WeakPolarHBondContact CE-OE1 3.42Å; K146-E150 IonicContact NZ-OE1 3.65Å; K146-E150 WeakPolarHBondContact O-CG 3.43Å; K146-E150 PolarHBondContact O-N 3.07Å
147	F	75	Confident	70.8	Confident	11 Å²	11	40.5 Å²	40.5	5%	0.048	20%	0.201	C	C	.	.	H	α-helix	trans	-67.1	-40.5	178.9	-163.7	-92.1	0	0	0	112.4	V78 Q81 L82 L85 R143 Y144 A145 Y149 E150 C151	V78-F147 HydrophobicContact CB-CZ 4.38Å; V78-F147 HydrophobicContact CG1-CE1 4.28Å; V78-F147 HydrophobicContact CG1-CE2 4.46Å; V78-F147 HydrophobicContact CG1-CZ 3.63Å; V78-F147 VanDerWaalsContact O-CZ 3.24Å; V78-F147 WeakPolarHBondContact O-CZ 3.25Å; Q81-F147 HydrophobicContact CB-CE2 4Å; Q81-F147 HydrophobicContact CB-CZ 3.96Å; L82-F147 HydrophobicContact CB-CD1 4.39Å; L82-F147 HydrophobicContact CB-CE1 3.57Å; L82-F147 HydrophobicContact CB-CZ 4.3Å; L82-F147 HydrophobicContact CD1-CE1 3.97Å; L82-F147 HydrophobicContact CG-CD1 4.3Å; L82-F147 HydrophobicContact CG-CE1 3.83Å; L85-F147 HydrophobicContact CD1-CB 4.23Å; L85-F147 HydrophobicContact CD1-CD1 4.44Å; L85-F147 HydrophobicContact CD1-CD2 4.14Å; L85-F147 HydrophobicContact CD1-CG 4Å; R143-F147 VanDerWaalsContact O-CB 3.31Å; R143-F147 WeakPolarHBondContact O-CB 3.43Å; R143-F147 PolarHBondContact O-N 2.93Å; Y144-F147 PolarHBondContact O-N 3.42Å; A145-F147 VanDerWaalsContact C-N 3.33Å; A145-F147 PolarHBondContact O-N 3.1Å; F147-Y149 VanDerWaalsContact C-N 3.34Å; F147-E150 PolarHBondContact O-N 3.19Å; F147-C151 WeakPolarHBondContact CE1-SG 3.3Å; F147-C151 WeakPolarHBondContact O-CB 3.37Å; F147-C151 PolarHBondContact O-N 3.04Å; F147-C151 PolarHBondContact O-SG 3.08Å
148	Q	70.9	Confident	70.9	Confident	16 Å²	16	37.6 Å²	37.6	8%	0.075	19%	0.192	C	C	.	.	H	α-helix	trans	-63	-39.8	173.7	-73.9	-70.3	-8.5	0	0	111.8	Y144 A145 C151 G152 N153 A157	Y144-Q148 HydrophobicContact CD1-CG 4.32Å; Y144-Q148 HydrophobicContact CD2-CG 4.35Å; Y144-Q148 HydrophobicContact CE1-CG 4.07Å; Y144-Q148 HydrophobicContact CE2-CG 4.11Å; Y144-Q148 HydrophobicContact CG-CG 4.49Å; Y144-Q148 WeakPolarHBondContact O-CB 3.33Å; Y144-Q148 WeakPolarHBondContact O-CG 3.25Å; Y144-Q148 PolarHBondContact O-N 3.37Å; Y144-Q148 PolarHBondContact OH-NE2 2.97Å; A145-Q148 PolarHBondContact O-N 2.67Å; Q148-C151 PolarHBondContact O-N 3.42Å; Q148-G152 PolarHBondContact O-N 3.41Å; Q148-G152 VanDerWaalsContact O-N 3.13Å; Q148-N153 PolarHBondContact O-N 3.18Å; Q148-N153 VanDerWaalsContact OE1-CB 3.3Å; Q148-N153 PolarHBondContact OE1-ND2 3.47Å; Q148-A157 HydrophobicContact CB-CB 4.33Å
149	Y	74.3	Confident	71.2	Confident	25 Å²	25	41.7 Å²	41.7	10%	0.098	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-45.9	174.1	-178.5	-98.2	0	0	0	111.9	H17 A145 K146 F147 C151 G152 Y154 A184 L188	H17-Y149 HydrophobicContact CB-CE1 4.48Å; H17-Y149 AromaticContact CD2-CD1 3.99Å; H17-Y149 AromaticContact CD2-CE1 3.41Å; H17-Y149 VanDerWaalsContact CD2-CE1 3.41Å; H17-Y149 WeakPolarHBondContact CD2-CE1 3.17Å; H17-Y149 AromaticContact CD2-CZ 3.9Å; H17-Y149 PolarHBondContact CE1-O 3.08Å; A145-Y149 WeakPolarHBondContact O-CB 2.9Å; A145-Y149 PolarHBondContact O-N 3.04Å; K146-Y149 PolarHBondContact O-N 3.33Å; F147-Y149 VanDerWaalsContact C-N 3.34Å; Y149-C151 VanDerWaalsContact C-N 3.26Å; Y149-C151 PolarHBondContact O-N 2.98Å; Y149-G152 PolarHBondContact O-N 2.96Å; Y149-G152 VanDerWaalsContact O-N 3.09Å; Y149-Y154 AromaticContact CD2-CD1 3.78Å; Y149-Y154 HydrophobicContact CD2-CD1 3.78Å; Y149-Y154 AromaticContact CD2-CE1 3.98Å; Y149-Y154 HydrophobicContact CD2-CE1 3.98Å; Y149-Y154 AromaticContact CE2-CD1 3.98Å; Y149-Y154 HydrophobicContact CE2-CD1 3.98Å; Y149-Y154 HydrophobicContact CE2-CE1 4Å; Y149-A184 HydrophobicContact CE2-CB 3.81Å; Y149-A184 VanDerWaalsContact OH-CB 3.25Å; Y149-A184 WeakPolarHBondContact OH-CB 3.37Å; Y149-L188 HydrophobicContact CE2-CD1 3.8Å
150	E	71.6	Confident	71.2	Confident	48 Å²	48	41.1 Å²	41.1	22%	0.224	21%	0.205	C	C	.	.	H	α-helix	trans	-64.4	-29.1	175.7	-73.5	177	-177	0	0	113	N49 M50 K146 F147 G152	N49-E150 HydrophobicContact CB-CB 4.22Å; N49-E150 PolarHBondContact ND2-OE2 3.44Å; M50-E150 VanDerWaalsContact CG-O 3.29Å; M50-E150 WeakPolarHBondContact CG-O 3.38Å; K146-E150 WeakPolarHBondContact CE-OE1 3.42Å; K146-E150 IonicContact NZ-OE1 3.65Å; K146-E150 WeakPolarHBondContact O-CG 3.43Å; K146-E150 PolarHBondContact O-N 3.07Å; F147-E150 PolarHBondContact O-N 3.19Å; E150-G152 VanDerWaalsContact C-N 3.34Å
151	C	65.8	Low	71.1	Confident	39 Å²	39	40.2 Å²	40.2	26%	0.264	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-6.8	175.1	-67.2	0	0	0	0	113.7	F147 Q148 Y149	F147-C151 WeakPolarHBondContact CE1-SG 3.3Å; F147-C151 WeakPolarHBondContact O-CB 3.37Å; F147-C151 PolarHBondContact O-N 3.04Å; F147-C151 PolarHBondContact O-SG 3.08Å; Q148-C151 PolarHBondContact O-N 3.42Å; Y149-C151 VanDerWaalsContact C-N 3.26Å; Y149-C151 PolarHBondContact O-N 2.98Å
152	G	68.8	Low	71	Confident	25 Å²	25	44 Å²	44	26%	0.258	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.1	12.5	176.4	0	0	0	0	0	115.8	Q148 Y149 E150 Y154	Q148-G152 PolarHBondContact O-N 3.41Å; Q148-G152 VanDerWaalsContact O-N 3.13Å; Y149-G152 PolarHBondContact O-N 2.96Å; Y149-G152 VanDerWaalsContact O-N 3.09Å; E150-G152 VanDerWaalsContact C-N 3.34Å; G152-Y154 WeakPolarHBondContact O-CE2 3.29Å; G152-Y154 PolarHBondContact O-N 2.78Å
153	N	72.6	Confident	70.7	Confident	69 Å²	69	43.2 Å²	43.2	37%	0.369	21%	0.211	S	C	.	.			trans	-94.6	82.6	175	-168.9	4.6	0	0	0	111.1	Q148 S155 A157	Q148-N153 PolarHBondContact O-N 3.18Å; Q148-N153 VanDerWaalsContact OE1-CB 3.3Å; Q148-N153 PolarHBondContact OE1-ND2 3.47Å; N153-S155 PolarHBondContact O-N 2.88Å; N153-S155 PolarHBondContact OD1-OG 3.34Å; N153-A157 WeakPolarHBondContact O-CB 3.37Å; N153-A157 PolarHBondContact O-N 3.02Å
154	Y	72.3	Confident	70.3	Confident	32 Å²	32	36.6 Å²	36.6	13%	0.125	19%	0.186	C	C	.	.	H	α-helix	trans	-74.7	-24.3	-172	-48.2	-63.2	0	0	0	114.2	H17 Y149 G152 A158 L188 M189	H17-Y154 PolarHBondContact ND1-OH 2.77Å; Y149-Y154 AromaticContact CD2-CD1 3.78Å; Y149-Y154 HydrophobicContact CD2-CD1 3.78Å; Y149-Y154 AromaticContact CD2-CE1 3.98Å; Y149-Y154 HydrophobicContact CD2-CE1 3.98Å; Y149-Y154 AromaticContact CE2-CD1 3.98Å; Y149-Y154 HydrophobicContact CE2-CD1 3.98Å; Y149-Y154 HydrophobicContact CE2-CE1 4Å; G152-Y154 WeakPolarHBondContact O-CE2 3.29Å; G152-Y154 PolarHBondContact O-N 2.78Å; Y154-A158 VanDerWaalsContact O-CB 3.29Å; Y154-A158 WeakPolarHBondContact O-CB 3.32Å; Y154-A158 PolarHBondContact O-N 3.38Å; Y154-L188 HydrophobicContact CD1-CB 4.26Å; Y154-L188 HydrophobicContact CD1-CD1 3.69Å; Y154-L188 HydrophobicContact CD2-CB 3.86Å; Y154-L188 HydrophobicContact CE1-CB 4.48Å; Y154-L188 HydrophobicContact CE1-CD1 3.38Å; Y154-L188 HydrophobicContact CE1-CG 4.46Å; Y154-L188 HydrophobicContact CE2-CB 4.07Å; Y154-L188 HydrophobicContact CE2-CD1 4.23Å; Y154-L188 HydrophobicContact CG-CB 3.96Å; Y154-L188 HydrophobicContact CG-CD1 4.25Å; Y154-M189 HydrophobicContact CD2-CE 4.4Å
155	S	71.3	Confident	69.7	Low	57 Å²	57	39.8 Å²	39.8	40%	0.399	20%	0.198	S	C	.	.	H	α-helix	trans	-73.7	-49.1	-178.2	45.7	0	0	0	0	110.3	N153 A157 A158 E159 M189	N153-S155 PolarHBondContact O-N 2.88Å; N153-S155 PolarHBondContact OD1-OG 3.34Å; S155-A157 VanDerWaalsContact C-N 3.32Å; S155-A157 PolarHBondContact O-N 3.36Å; S155-A158 PolarHBondContact O-N 3.44Å; S155-E159 PolarHBondContact O-N 3.16Å; S155-E159 VanDerWaalsContact O-N 3.09Å; S155-M189 VanDerWaalsContact N-CE 3.28Å
156	G	69.8	Low	69.2	Low	11 Å²	11	41 Å²	41	11%	0.113	21%	0.205	C	C	.	.	H	α-helix	trans	-59.5	-44.4	172.2	0	0	0	0	0	111.3	A158 E159 Y160	G156-A158 PolarHBondContact O-N 3.14Å; G156-E159 PolarHBondContact O-N 2.94Å; G156-Y160 VanDerWaalsContact C-CD2 3.47Å; G156-Y160 WeakPolarHBondContact O-CB 3.41Å; G156-Y160 WeakPolarHBondContact O-CD2 3.11Å; G156-Y160 VanDerWaalsContact O-CG 3.28Å; G156-Y160 PolarHBondContact O-N 3.16Å
157	A	70.7	Confident	68.4	Low	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61	-41.6	177.2	0	0	0	0	0	112.8	Q148 N153 S155 Y160 L161	Q148-A157 HydrophobicContact CB-CB 4.33Å; N153-A157 WeakPolarHBondContact O-CB 3.37Å; N153-A157 PolarHBondContact O-N 3.02Å; S155-A157 VanDerWaalsContact C-N 3.32Å; S155-A157 PolarHBondContact O-N 3.36Å; A157-Y160 PolarHBondContact O-N 3.31Å; A157-L161 VanDerWaalsContact O-CB 3.27Å; A157-L161 WeakPolarHBondContact O-CB 3.27Å; A157-L161 WeakPolarHBondContact O-CG 3.39Å; A157-L161 PolarHBondContact O-N 2.85Å
158	A	67.4	Low	67.6	Low	12 Å²	12	36.9 Å²	36.9	10%	0.099	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-42.8	177.5	0	0	0	0	0	112.1	Y154 S155 G156 Y162	Y154-A158 VanDerWaalsContact O-CB 3.29Å; Y154-A158 WeakPolarHBondContact O-CB 3.32Å; Y154-A158 PolarHBondContact O-N 3.38Å; S155-A158 PolarHBondContact O-N 3.44Å; G156-A158 PolarHBondContact O-N 3.14Å; A158-Y162 VanDerWaalsContact O-CB 3.25Å; A158-Y162 WeakPolarHBondContact O-CB 3.38Å; A158-Y162 PolarHBondContact O-N 2.96Å
159	E	69.6	Low	66.8	Low	118 Å²	118	38.5 Å²	38.5	55%	0.551	20%	0.202	S	C	*	.	H	α-helix	trans	-65.5	-47.2	175.6	-70.9	-179.3	177.6	0	0	111.5	S155 G156 L161 Y162 F163	S155-E159 PolarHBondContact O-N 3.16Å; S155-E159 VanDerWaalsContact O-N 3.09Å; G156-E159 PolarHBondContact O-N 2.94Å; E159-L161 VanDerWaalsContact C-N 3.34Å; E159-L161 PolarHBondContact O-N 3Å; E159-Y162 WeakPolarHBondContact O-CB 3.43Å; E159-Y162 PolarHBondContact O-N 3.13Å; E159-Y162 VanDerWaalsContact O-N 3.16Å; E159-F163 HydrophobicContact CB-CE2 4.06Å; E159-F163 WeakPolarHBondContact O-CD2 3.34Å; E159-F163 VanDerWaalsContact O-CG 3.27Å; E159-F163 WeakPolarHBondContact O-CG 3.3Å; E159-F163 PolarHBondContact O-N 2.93Å
160	Y	68.8	Low	65.6	Low	42 Å²	42	43.3 Å²	43.3	17%	0.165	24%	0.239	C	C	.	.	H	α-helix	trans	-63.7	-37.4	177.9	-65	-49.5	0	0	0	112.7	V93 L141 Y144 G156 A157 F163 F164	V93-Y160 HydrophobicContact CG2-CE1 4.07Å; L141-Y160 HydrophobicContact CD1-CD1 3.96Å; L141-Y160 HydrophobicContact CD1-CG 4.36Å; Y144-Y160 HydrophobicContact CD1-CD2 4.1Å; Y144-Y160 HydrophobicContact CD1-CE2 4.01Å; Y144-Y160 AromaticContact CE1-CD2 3.97Å; Y144-Y160 HydrophobicContact CE1-CD2 3.97Å; Y144-Y160 HydrophobicContact CE1-CE1 4.42Å; Y144-Y160 AromaticContact CE1-CE2 3.41Å; Y144-Y160 HydrophobicContact CE1-CE2 3.41Å; Y144-Y160 VanDerWaalsContact CE1-CE2 3.41Å; Y144-Y160 AromaticContact CE1-CZ 3.67Å; G156-Y160 VanDerWaalsContact C-CD2 3.47Å; G156-Y160 WeakPolarHBondContact O-CB 3.41Å; G156-Y160 WeakPolarHBondContact O-CD2 3.11Å; G156-Y160 VanDerWaalsContact O-CG 3.28Å; G156-Y160 PolarHBondContact O-N 3.16Å; A157-Y160 PolarHBondContact O-N 3.31Å; Y160-F163 HydrophobicContact CD1-CD2 4.33Å; Y160-F163 PolarHBondContact O-N 3.24Å; Y160-F164 WeakPolarHBondContact O-CB 3.35Å; Y160-F164 PolarHBondContact O-N 3.34Å
161	L	69	Low	64.5	Low	8 Å²	8	46.8 Å²	46.8	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-73.5	-30.7	174.6	-69.4	172.8	0	0	0	112.3	A145 A157 E159 R165 K182	A145-L161 HydrophobicContact CB-CD2 3.96Å; A145-L161 HydrophobicContact CB-CG 4.08Å; A157-L161 VanDerWaalsContact O-CB 3.27Å; A157-L161 WeakPolarHBondContact O-CB 3.27Å; A157-L161 WeakPolarHBondContact O-CG 3.39Å; A157-L161 PolarHBondContact O-N 2.85Å; E159-L161 VanDerWaalsContact C-N 3.34Å; E159-L161 PolarHBondContact O-N 3Å; L161-R165 VanDerWaalsContact O-CB 3.27Å; L161-R165 WeakPolarHBondContact O-CB 2.72Å; L161-R165 PolarHBondContact O-N 3.21Å; L161-K182 HydrophobicContact CB-CB 4.25Å; L161-K182 HydrophobicContact CD1-CB 4.47Å
162	Y	67.8	Low	63.7	Low	86 Å²	86	49.2 Å²	49.2	34%	0.337	27%	0.274	S	S	.	.	H	α-helix	trans	-64.8	-44.6	169.3	179.9	-96	0	0	0	111	A158 E159 R165 V166	A158-Y162 VanDerWaalsContact O-CB 3.25Å; A158-Y162 WeakPolarHBondContact O-CB 3.38Å; A158-Y162 PolarHBondContact O-N 2.96Å; E159-Y162 WeakPolarHBondContact O-CB 3.43Å; E159-Y162 PolarHBondContact O-N 3.13Å; E159-Y162 VanDerWaalsContact O-N 3.16Å; Y162-R165 WeakPolarHBondContact O-CB 2.94Å; Y162-R165 PolarHBondContact O-N 3.21Å; Y162-V166 HydrophobicContact CD1-CG2 4.35Å; Y162-V166 HydrophobicContact CE1-CG2 3.96Å; Y162-V166 WeakPolarHBondContact O-CG2 3.44Å; Y162-V166 PolarHBondContact O-N 3.12Å
163	F	64.7	Low	63	Low	35 Å²	35	58.7 Å²	58.7	15%	0.154	30%	0.302	C	S	.	.	H	α-helix	trans	-64.2	-46.7	175.1	-61.9	-43.5	0	0	0	111.6	M105 E159 Y160 R165 V166 L167	M105-F163 HydrophobicContact SD-CD1 4.17Å; M105-F163 HydrophobicContact SD-CE1 4.47Å; E159-F163 HydrophobicContact CB-CE2 4.06Å; E159-F163 WeakPolarHBondContact O-CD2 3.34Å; E159-F163 VanDerWaalsContact O-CG 3.27Å; E159-F163 WeakPolarHBondContact O-CG 3.3Å; E159-F163 PolarHBondContact O-N 2.93Å; Y160-F163 HydrophobicContact CD1-CD2 4.33Å; Y160-F163 PolarHBondContact O-N 3.24Å; F163-R165 PolarHBondContact O-N 3.07Å; F163-V166 PolarHBondContact O-N 2.73Å; F163-V166 VanDerWaalsContact O-N 3.13Å; F163-L167 WeakPolarHBondContact O-CB 3.3Å; F163-L167 VanDerWaalsContact O-CD1 3.25Å; F163-L167 WeakPolarHBondContact O-CD1 3.26Å; F163-L167 PolarHBondContact O-N 3.48Å
164	F	64.4	Low	62.3	Low	6 Å²	6	58.1 Å²	58.1	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-55.5	-37.1	173.8	-175.6	-96	0	0	0	111.7	L138 L141 Y142 Y160 L167 V168 N174	L138-F164 HydrophobicContact CB-CD2 4.49Å; L138-F164 HydrophobicContact CB-CE2 4Å; L138-F164 HydrophobicContact CD2-CD2 3.78Å; L138-F164 HydrophobicContact CD2-CE2 3.98Å; L138-F164 WeakPolarHBondContact O-CE2 3.2Å; L141-F164 HydrophobicContact CD2-CB 4.16Å; L141-F164 HydrophobicContact CD2-CD2 4.45Å; Y142-F164 HydrophobicContact CD2-CE1 4.41Å; Y142-F164 HydrophobicContact CD2-CZ 4.33Å; Y160-F164 WeakPolarHBondContact O-CB 3.35Å; Y160-F164 PolarHBondContact O-N 3.34Å; F164-L167 PolarHBondContact O-N 2.98Å; F164-V168 HydrophobicContact CD1-CG2 4.11Å; F164-V168 HydrophobicContact CD2-CG2 4.2Å; F164-V168 HydrophobicContact CE1-CG2 3.86Å; F164-V168 HydrophobicContact CE2-CG2 3.95Å; F164-V168 HydrophobicContact CG-CG2 4.28Å; F164-V168 HydrophobicContact CZ-CG2 3.77Å; F164-V168 WeakPolarHBondContact O-CB 3.18Å; F164-V168 WeakPolarHBondContact O-CG2 3.45Å; F164-V168 PolarHBondContact O-N 3.5Å; F164-V168 VanDerWaalsContact O-N 3.12Å; F164-N174 HydrophobicContact CE1-CB 4.27Å; F164-N174 HydrophobicContact CZ-CB 4.05Å
165	R	62.4	Low	61.8	Low	77 Å²	77	57.6 Å²	57.6	29%	0.291	30%	0.301	S	S	.	.	H	α-helix	trans	-68.3	-44.4	176.3	176.6	-176	170.2	-142.5	-14.8	113.2	L161 Y162 F163 L167 V168 D198 R201	L161-R165 VanDerWaalsContact O-CB 3.27Å; L161-R165 WeakPolarHBondContact O-CB 2.72Å; L161-R165 PolarHBondContact O-N 3.21Å; Y162-R165 WeakPolarHBondContact O-CB 2.94Å; Y162-R165 PolarHBondContact O-N 3.21Å; F163-R165 PolarHBondContact O-N 3.07Å; R165-L167 PolarHBondContact O-N 2.86Å; R165-V168 PolarHBondContact O-N 3.22Å; R165-D198 IonicContact NH1-OD1 3.08Å; R165-R201 VanDerWaalsContact NH2-CD 3.28Å
166	V	61.7	Low	61.6	Low	26 Å²	26	55.8 Å²	55.8	16%	0.158	29%	0.287	C	S	.	.	H	α-helix	trans	-64.4	-32.6	178.2	172.8	0	0	0	0	110.8	M105 L114 Y162 F163	M105-V166 HydrophobicContact CG-CG1 4.18Å; L114-V166 HydrophobicContact CD1-CG1 3.56Å; Y162-V166 HydrophobicContact CD1-CG2 4.35Å; Y162-V166 HydrophobicContact CE1-CG2 3.96Å; Y162-V166 WeakPolarHBondContact O-CG2 3.44Å; Y162-V166 PolarHBondContact O-N 3.12Å; F163-V166 PolarHBondContact O-N 2.73Å; F163-V166 VanDerWaalsContact O-N 3.13Å
167	L	58.1	Low	61.6	Low	23 Å²	23	58.6 Å²	58.6	12%	0.12	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-4	-179.7	-89.6	120.8	0	0	0	115.5	F96 M105 F115 L118 L138 F163 F164 R165	F96-L167 HydrophobicContact CE1-CD1 3.75Å; F96-L167 HydrophobicContact CZ-CD1 3.56Å; F96-L167 HydrophobicContact CZ-CD2 4.48Å; M105-L167 HydrophobicContact CE-CD1 3.79Å; F115-L167 WeakPolarHBondContact CE2-O 3.15Å; F115-L167 WeakPolarHBondContact CZ-O 3.37Å; L118-L167 HydrophobicContact CD1-CD2 3.71Å; L118-L167 HydrophobicContact CD1-CG 4.18Å; L138-L167 HydrophobicContact CD2-CB 4Å; F163-L167 WeakPolarHBondContact O-CB 3.3Å; F163-L167 VanDerWaalsContact O-CD1 3.25Å; F163-L167 WeakPolarHBondContact O-CD1 3.26Å; F163-L167 PolarHBondContact O-N 3.48Å; F164-L167 PolarHBondContact O-N 2.98Å; R165-L167 PolarHBondContact O-N 2.86Å
168	V	57.1	Low	61.4	Low	19 Å²	19	58.8 Å²	58.8	12%	0.115	30%	0.301	C	S	.	.	S	Bend	trans	-113.9	130.4	-176.9	172.1	0	0	0	0	110.6	L138 F164 R165 D172	L138-V168 HydrophobicContact CD1-CG2 4.35Å; L138-V168 HydrophobicContact CD2-CG2 4.04Å; F164-V168 HydrophobicContact CD1-CG2 4.11Å; F164-V168 HydrophobicContact CD2-CG2 4.2Å; F164-V168 HydrophobicContact CE1-CG2 3.86Å; F164-V168 HydrophobicContact CE2-CG2 3.95Å; F164-V168 HydrophobicContact CG-CG2 4.28Å; F164-V168 HydrophobicContact CZ-CG2 3.77Å; F164-V168 WeakPolarHBondContact O-CB 3.18Å; F164-V168 WeakPolarHBondContact O-CG2 3.45Å; F164-V168 PolarHBondContact O-N 3.5Å; F164-V168 VanDerWaalsContact O-N 3.12Å; R165-V168 PolarHBondContact O-N 3.22Å; V168-D172 HydrophobicContact CG1-CB 4.22Å
169	P	54.3	Low	61.7	Low	50 Å²	50	59 Å²	59	33%	0.325	30%	0.3	S	S	.	.			trans	-65.3	146.2	171	-13.2	29.7	0	0	0	109.6	F115 T171	F115-P169 HydrophobicContact CD2-CG 4.44Å; F115-P169 VanDerWaalsContact CE2-CD 3.5Å; F115-P169 HydrophobicContact CE2-CG 3.6Å; F115-P169 HydrophobicContact CZ-CG 3.97Å; P169-T171 PolarHBondContact O-N 3.45Å
170	S	48.8	Very low	62.1	Low	126 Å²	126	54.3 Å²	54.3	88%	0.881	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	13.3	-176	10.1	0	0	0	0	116
171	T	49.1	Very low	62.5	Low	121 Å²	121	53.1 Å²	53.1	74%	0.742	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-11.3	-171.5	47.9	0	0	0	0	114.7	P169	P169-T171 PolarHBondContact O-N 3.45Å
172	D	50	Low	62.9	Low	91 Å²	91	53.4 Å²	53.4	49%	0.487	28%	0.278	S	S	.	.	S	Bend	trans	-94.4	144.2	-174.5	-77.6	-30	0	0	0	114.6	V168 N174 A175	V168-D172 HydrophobicContact CG1-CB 4.22Å; D172-N174 PolarHBondContact O-N 2.92Å; D172-A175 VanDerWaalsContact O-CB 3.31Å; D172-A175 WeakPolarHBondContact O-CB 3.16Å; D172-A175 PolarHBondContact O-N 3.28Å
173	R	54.3	Low	63.4	Low	224 Å²	224	49.3 Å²	49.3	85%	0.845	26%	0.262	S	S	*	.	H	α-helix	trans	-54.1	-21.4	179.2	-169.6	156.3	71.1	172.7	3.2	113.8
174	N	57	Low	64	Low	57 Å²	57	47.6 Å²	47.6	31%	0.305	26%	0.255	S	S	.	.	H	α-helix	trans	-87.5	-11.9	178.5	-70.4	-8.3	0	0	0	114	F164 D172 L176 N177 S178	F164-N174 HydrophobicContact CE1-CB 4.27Å; F164-N174 HydrophobicContact CZ-CB 4.05Å; D172-N174 PolarHBondContact O-N 2.92Å; N174-L176 VanDerWaalsContact C-N 3.34Å; N174-L176 PolarHBondContact O-N 2.91Å; N174-N177 PolarHBondContact O-N 3.4Å; N174-S178 WeakPolarHBondContact O-CB 3.34Å; N174-S178 PolarHBondContact O-N 3.42Å; N174-S178 PolarHBondContact O-OG 3.44Å
175	A	60.8	Low	64.6	Low	20 Å²	20	47.3 Å²	47.3	17%	0.165	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-36.2	177.5	0	0	0	0	0	112.2	D172 S178 L179	D172-A175 VanDerWaalsContact O-CB 3.31Å; D172-A175 WeakPolarHBondContact O-CB 3.16Å; D172-A175 PolarHBondContact O-N 3.28Å; A175-S178 WeakPolarHBondContact CA-OG 3.36Å; A175-S178 PolarHBondContact O-OG 3.25Å; A175-L179 WeakPolarHBondContact O-CB 3.46Å; A175-L179 WeakPolarHBondContact O-CD1 3.31Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.4Å; A175-L179 PolarHBondContact O-N 2.71Å; A175-L179 VanDerWaalsContact O-N 3.11Å
176	L	68.3	Low	65.3	Low	19 Å²	19	44.9 Å²	44.9	10%	0.099	25%	0.246	C	C	.	.	H	α-helix	trans	-68.1	-44.5	175	-173.5	68.3	0	0	0	110.9	N174 L179 W180 L202 T205 I206 Q220	N174-L176 VanDerWaalsContact C-N 3.34Å; N174-L176 PolarHBondContact O-N 2.91Å; L176-L179 WeakPolarHBondContact O-CB 3.44Å; L176-L179 PolarHBondContact O-N 2.88Å; L176-W180 PolarHBondContact O-N 3.5Å; L176-L202 HydrophobicContact CD1-CD1 3.65Å; L176-T205 HydrophobicContact CD1-CG2 4.34Å; L176-I206 HydrophobicContact CD1-CG1 3.96Å; L176-Q220 VanDerWaalsContact CD2-NE2 3.33Å
177	N	68.6	Low	66	Low	71 Å²	71	44 Å²	44	38%	0.38	24%	0.24	S	C	.	.	H	α-helix	trans	-67.1	-37.5	-179.6	-64.9	-18	0	0	0	112.1	N174 W180 G181	N174-N177 PolarHBondContact O-N 3.4Å; N177-W180 PolarHBondContact O-N 3.18Å; N177-G181 PolarHBondContact O-N 3.25Å
178	S	68.4	Low	66.9	Low	4 Å²	4	44.5 Å²	44.5	3%	0.028	24%	0.243	C	C	.	.	H	α-helix	trans	-67.8	-35.8	174.8	64.9	0	0	0	0	112.2	N174 A175 G181 K182	N174-S178 WeakPolarHBondContact O-CB 3.34Å; N174-S178 PolarHBondContact O-N 3.42Å; N174-S178 PolarHBondContact O-OG 3.44Å; A175-S178 WeakPolarHBondContact CA-OG 3.36Å; A175-S178 PolarHBondContact O-OG 3.25Å; S178-G181 PolarHBondContact O-N 3.37Å; S178-K182 VanDerWaalsContact O-CB 3.32Å; S178-K182 WeakPolarHBondContact O-CB 3.43Å; S178-K182 PolarHBondContact O-N 3.3Å
179	L	73.5	Confident	67.8	Low	15 Å²	15	47.8 Å²	47.8	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-63.4	-42.6	172	-78.6	161.7	0	0	0	112.1	A175 L176 K182 L183 L202 T205	A175-L179 WeakPolarHBondContact O-CB 3.46Å; A175-L179 WeakPolarHBondContact O-CD1 3.31Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.4Å; A175-L179 PolarHBondContact O-N 2.71Å; A175-L179 VanDerWaalsContact O-N 3.11Å; L176-L179 WeakPolarHBondContact O-CB 3.44Å; L176-L179 PolarHBondContact O-N 2.88Å; L179-K182 PolarHBondContact O-N 3.2Å; L179-L183 WeakPolarHBondContact O-CB 3.29Å; L179-L183 PolarHBondContact O-N 3.32Å; L179-L202 HydrophobicContact CB-CD1 3.95Å; L179-L202 HydrophobicContact CD1-CD1 4.48Å; L179-T205 HydrophobicContact CD1-CG2 4.17Å
180	W	78.1	Confident	68.8	Low	21 Å²	21	52.1 Å²	52.1	8%	0.08	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-48.4	173.8	-74.5	114.1	0	0	0	111.6	L176 N177 K182 L183 A184 L202 I206 W223 L224 W227	L176-W180 PolarHBondContact O-N 3.5Å; N177-W180 PolarHBondContact O-N 3.18Å; W180-K182 VanDerWaalsContact C-N 3.28Å; W180-K182 PolarHBondContact O-N 3.37Å; W180-L183 HydrophobicContact CE3-CD2 4.48Å; W180-L183 HydrophobicContact CZ3-CD2 4.44Å; W180-L183 PolarHBondContact O-N 2.92Å; W180-A184 WeakPolarHBondContact O-CB 3.22Å; W180-A184 PolarHBondContact O-N 2.95Å; W180-L202 HydrophobicContact CD2-CD1 4.38Å; W180-L202 HydrophobicContact CD2-CD2 3.91Å; W180-L202 HydrophobicContact CE3-CD2 3.73Å; W180-L202 HydrophobicContact CH2-CD2 3.83Å; W180-L202 HydrophobicContact CZ2-CD1 4.34Å; W180-L202 HydrophobicContact CZ2-CD2 3.99Å; W180-L202 HydrophobicContact CZ2-CG 4.47Å; W180-L202 HydrophobicContact CZ3-CD2 3.7Å; W180-I206 HydrophobicContact CZ2-CD1 3.94Å; W180-W223 HydrophobicContact CH2-CB 3.85Å; W180-W223 HydrophobicContact CZ2-CB 4.41Å; W180-W223 HydrophobicContact CZ3-CB 4.36Å; W180-L224 HydrophobicContact CH2-CB 3.96Å; W180-L224 HydrophobicContact CH2-CD1 4.24Å; W180-W227 HydrophobicContact CB-CH2 4.49Å; W180-W227 AromaticContact CE3-CD2 3.87Å; W180-W227 HydrophobicContact CE3-CD2 3.87Å; W180-W227 AromaticContact CE3-CE3 3.59Å; W180-W227 HydrophobicContact CE3-CE3 3.59Å; W180-W227 AromaticContact CE3-CH2 3.77Å; W180-W227 HydrophobicContact CE3-CH2 3.77Å; W180-W227 HydrophobicContact CE3-CZ2 4.08Å; W180-W227 AromaticContact CE3-CZ3 3.52Å; W180-W227 HydrophobicContact CE3-CZ3 3.52Å; W180-W227 HydrophobicContact CZ3-CB 4.39Å; W180-W227 AromaticContact CZ3-CD2 3.63Å; W180-W227 HydrophobicContact CZ3-CD2 3.63Å; W180-W227 AromaticContact CZ3-CE2 4Å; W180-W227 AromaticContact CZ3-CE3 3.74Å; W180-W227 HydrophobicContact CZ3-CE3 3.74Å; W180-W227 AromaticContact CZ3-CG 3.96Å; W180-W227 HydrophobicContact CZ3-CG 3.96Å; W180-W227 HydrophobicContact CZ3-CH2 4.46Å; W180-W227 HydrophobicContact CZ3-CZ2 4.41Å; W180-W227 HydrophobicContact CZ3-CZ3 4.15Å; W180-W227 WeakPolarHBondContact O-CZ3 3.34Å
181	G	76.5	Confident	70.2	Confident	17 Å²	17	49.5 Å²	49.5	18%	0.175	25%	0.25	C	C	.	.	H	α-helix	trans	-61.3	-35.9	177.2	0	0	0	0	0	113.1	N177 S178 S185	N177-G181 PolarHBondContact O-N 3.25Å; S178-G181 PolarHBondContact O-N 3.37Å; G181-S185 WeakPolarHBondContact O-CB 3.39Å; G181-S185 PolarHBondContact O-N 3.43Å; G181-S185 PolarHBondContact O-OG 2.89Å
182	K	77.9	Confident	71.4	Confident	13 Å²	13	46 Å²	46	6%	0.057	22%	0.223	C	C	.	.	H	α-helix	trans	-68.4	-48.8	177.3	-171.7	174.3	-169.6	-85.6	0	111	L161 S178 L179 W180 A184 S185 E186 D198	L161-K182 HydrophobicContact CB-CB 4.25Å; L161-K182 HydrophobicContact CD1-CB 4.47Å; S178-K182 VanDerWaalsContact O-CB 3.32Å; S178-K182 WeakPolarHBondContact O-CB 3.43Å; S178-K182 PolarHBondContact O-N 3.3Å; L179-K182 PolarHBondContact O-N 3.2Å; W180-K182 VanDerWaalsContact C-N 3.28Å; W180-K182 PolarHBondContact O-N 3.37Å; K182-A184 VanDerWaalsContact C-N 3.29Å; K182-A184 PolarHBondContact O-N 3.24Å; K182-S185 PolarHBondContact O-N 3.36Å; K182-E186 WeakPolarHBondContact O-CG 3.49Å; K182-E186 PolarHBondContact O-N 3.37Å; K182-D198 IonicContact NZ-OD1 3.12Å; K182-D198 PolarHBondContact NZ-OD1 2.9Å; K182-D198 IonicContact NZ-OD2 3.67Å; K182-D198 PolarHBondContact NZ-OD2 3.31Å
183	L	76.9	Confident	72.7	Confident	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-43.6	176.6	-175.8	70.5	0	0	0	110.9	L179 W180 S185 E186 I187 A195 D198 L199 L202 W227	L179-L183 WeakPolarHBondContact O-CB 3.29Å; L179-L183 PolarHBondContact O-N 3.32Å; W180-L183 HydrophobicContact CE3-CD2 4.48Å; W180-L183 HydrophobicContact CZ3-CD2 4.44Å; W180-L183 PolarHBondContact O-N 2.92Å; L183-S185 PolarHBondContact O-N 3.02Å; L183-E186 PolarHBondContact O-N 3.12Å; L183-I187 HydrophobicContact CD1-CD1 4.29Å; L183-I187 HydrophobicContact CD2-CD1 4.48Å; L183-I187 HydrophobicContact CG-CD1 3.88Å; L183-I187 VanDerWaalsContact O-CG1 3.22Å; L183-I187 WeakPolarHBondContact O-CG1 3.46Å; L183-I187 PolarHBondContact O-N 3.28Å; L183-A195 HydrophobicContact CD1-CB 4.43Å; L183-D198 HydrophobicContact CD1-CB 4.28Å; L183-L199 HydrophobicContact CD1-CB 4.46Å; L183-L199 HydrophobicContact CD1-CD1 4.42Å; L183-L199 HydrophobicContact CD2-CD1 4.31Å; L183-L202 HydrophobicContact CD2-CD2 3.68Å; L183-W227 HydrophobicContact CB-CE3 4.47Å; L183-W227 HydrophobicContact CB-CZ3 4.46Å; L183-W227 HydrophobicContact CD2-CB 4.27Å; L183-W227 HydrophobicContact CD2-CE3 3.64Å; L183-W227 HydrophobicContact CD2-CZ3 4.35Å; L183-W227 HydrophobicContact CG-CE3 4.09Å
184	A	78.3	Confident	73.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-43.2	177.6	0	0	0	0	0	112.1	Y149 W180 K182 I187 L188 W227	Y149-A184 HydrophobicContact CE2-CB 3.81Å; Y149-A184 VanDerWaalsContact OH-CB 3.25Å; Y149-A184 WeakPolarHBondContact OH-CB 3.37Å; W180-A184 WeakPolarHBondContact O-CB 3.22Å; W180-A184 PolarHBondContact O-N 2.95Å; K182-A184 VanDerWaalsContact C-N 3.29Å; K182-A184 PolarHBondContact O-N 3.24Å; A184-I187 PolarHBondContact O-N 3.34Å; A184-L188 WeakPolarHBondContact O-CD1 3.47Å; A184-L188 VanDerWaalsContact O-CG 3.29Å; A184-L188 WeakPolarHBondContact O-CG 3.27Å; A184-L188 PolarHBondContact O-N 2.84Å; A184-W227 HydrophobicContact CB-CH2 3.97Å; A184-W227 HydrophobicContact CB-CZ3 3.7Å
185	S	76.7	Confident	74.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-41.3	178.9	-57.1	0	0	0	0	112.2	G181 K182 L183 L188 M189	G181-S185 WeakPolarHBondContact O-CB 3.39Å; G181-S185 PolarHBondContact O-N 3.43Å; G181-S185 PolarHBondContact O-OG 2.89Å; K182-S185 PolarHBondContact O-N 3.36Å; L183-S185 PolarHBondContact O-N 3.02Å; S185-L188 PolarHBondContact O-N 3.47Å; S185-M189 PolarHBondContact O-N 3.11Å
186	E	76.9	Confident	75.1	Confident	25 Å²	25	37.4 Å²	37.4	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-37.3	177	-68.8	-74.9	-179.4	0	0	112.4	K182 L183 M189 Q190 N191 A195	K182-E186 WeakPolarHBondContact O-CG 3.49Å; K182-E186 PolarHBondContact O-N 3.37Å; L183-E186 PolarHBondContact O-N 3.12Å; E186-M189 PolarHBondContact O-N 3.18Å; E186-Q190 PolarHBondContact O-N 3.41Å; E186-N191 PolarHBondContact O-N 3.13Å; E186-N191 VanDerWaalsContact O-N 3.08Å; E186-N191 VanDerWaalsContact OE2-CB 3.29Å; E186-N191 WeakPolarHBondContact OE2-CB 3.42Å; E186-N191 PolarHBondContact OE2-ND2 3.47Å; E186-A195 HydrophobicContact CB-CB 4.16Å
187	I	77	Confident	75.5	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.036	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-43.2	174.9	-68.9	167.4	0	0	0	110.5	L18 L183 A184 M189 Q190 W192 W227 F230 V231	L18-I187 HydrophobicContact CD2-CB 4.09Å; L18-I187 HydrophobicContact CD2-CG2 3.5Å; L183-I187 HydrophobicContact CD1-CD1 4.29Å; L183-I187 HydrophobicContact CD2-CD1 4.48Å; L183-I187 HydrophobicContact CG-CD1 3.88Å; L183-I187 VanDerWaalsContact O-CG1 3.22Å; L183-I187 WeakPolarHBondContact O-CG1 3.46Å; L183-I187 PolarHBondContact O-N 3.28Å; A184-I187 PolarHBondContact O-N 3.34Å; I187-M189 VanDerWaalsContact C-N 3.32Å; I187-M189 PolarHBondContact O-N 2.99Å; I187-Q190 PolarHBondContact O-N 2.99Å; I187-Q190 VanDerWaalsContact O-N 3.07Å; I187-W192 HydrophobicContact CG2-CH2 4.31Å; I187-W192 HydrophobicContact CG2-CZ3 4.27Å; I187-W227 HydrophobicContact CD1-CE3 4.41Å; I187-F230 HydrophobicContact CD1-CB 4.44Å; I187-F230 HydrophobicContact CG2-CB 4.09Å; I187-F230 HydrophobicContact CG2-CD1 4.2Å; I187-F230 HydrophobicContact CG2-CG 4.39Å; I187-V231 HydrophobicContact CD1-CG2 3.96Å; I187-V231 HydrophobicContact CG1-CG2 3.85Å
188	L	76.4	Confident	75.9	Confident	35 Å²	35	38 Å²	38	18%	0.183	19%	0.189	C	C	.	.	H	α-helix	trans	-68.1	-31.8	179.3	-71	163.3	0	0	0	112.5	H17 L18 Y149 Y154 A184 S185 Q190	H17-L188 HydrophobicContact CB-CD1 3.72Å; H17-L188 HydrophobicContact CB-CD2 4.45Å; L18-L188 HydrophobicContact CD2-CD2 3.99Å; L18-L188 HydrophobicContact CD2-CG 3.95Å; Y149-L188 HydrophobicContact CE2-CD1 3.8Å; Y154-L188 HydrophobicContact CD1-CB 4.26Å; Y154-L188 HydrophobicContact CD1-CD1 3.69Å; Y154-L188 HydrophobicContact CD2-CB 3.86Å; Y154-L188 HydrophobicContact CE1-CB 4.48Å; Y154-L188 HydrophobicContact CE1-CD1 3.38Å; Y154-L188 HydrophobicContact CE1-CG 4.46Å; Y154-L188 HydrophobicContact CE2-CB 4.07Å; Y154-L188 HydrophobicContact CE2-CD1 4.23Å; Y154-L188 HydrophobicContact CG-CB 3.96Å; Y154-L188 HydrophobicContact CG-CD1 4.25Å; A184-L188 WeakPolarHBondContact O-CD1 3.47Å; A184-L188 VanDerWaalsContact O-CG 3.29Å; A184-L188 WeakPolarHBondContact O-CG 3.27Å; A184-L188 PolarHBondContact O-N 2.84Å; S185-L188 PolarHBondContact O-N 3.47Å; L188-Q190 PolarHBondContact O-N 2.63Å
189	M	76.6	Confident	76.3	Confident	88 Å²	88	37.9 Å²	37.9	43%	0.433	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-1.5	171.7	-76.2	-64.2	-178.9	0	0	114.2	Y154 S155 S185 E186 I187 N191	Y154-M189 HydrophobicContact CD2-CE 4.4Å; S155-M189 VanDerWaalsContact N-CE 3.28Å; S185-M189 PolarHBondContact O-N 3.11Å; E186-M189 PolarHBondContact O-N 3.18Å; I187-M189 VanDerWaalsContact C-N 3.32Å; I187-M189 PolarHBondContact O-N 2.99Å; M189-N191 PolarHBondContact O-N 3.5Å
190	Q	74.8	Confident	76.6	Confident	140 Å²	140	39.6 Å²	39.6	65%	0.654	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	59	28.1	-178.5	-52.3	-177.8	-3.5	0	0	113.9	E186 I187 L188 W192	E186-Q190 PolarHBondContact O-N 3.41Å; I187-Q190 PolarHBondContact O-N 2.99Å; I187-Q190 VanDerWaalsContact O-N 3.07Å; L188-Q190 PolarHBondContact O-N 2.63Å; Q190-W192 HydrophobicContact CB-CZ2 3.89Å; Q190-W192 HydrophobicContact CG-CZ2 4.15Å; Q190-W192 PolarHBondContact O-N 3.11Å; Q190-W192 PolarHBondContact O-NE1 3.41Å
191	N	77.5	Confident	76.4	Confident	71 Å²	71	41.6 Å²	41.6	38%	0.38	21%	0.207	S	C	.	.			trans	-93.7	85.5	179.3	-175.2	12.4	0	0	0	111.1	E186 M189 E193 A194 A195	E186-N191 PolarHBondContact O-N 3.13Å; E186-N191 VanDerWaalsContact O-N 3.08Å; E186-N191 VanDerWaalsContact OE2-CB 3.29Å; E186-N191 WeakPolarHBondContact OE2-CB 3.42Å; E186-N191 PolarHBondContact OE2-ND2 3.47Å; M189-N191 PolarHBondContact O-N 3.5Å; N191-E193 PolarHBondContact O-N 3.45Å; N191-A194 WeakPolarHBondContact ND2-CB 3.48Å; N191-A195 VanDerWaalsContact O-CB 3.3Å; N191-A195 WeakPolarHBondContact O-CB 3.1Å; N191-A195 PolarHBondContact O-N 2.81Å; N191-A195 VanDerWaalsContact O-N 3.14Å
192	W	74.3	Confident	76.4	Confident	49 Å²	49	40.8 Å²	40.8	19%	0.186	20%	0.199	C	C	.	.	H	α-helix	trans	-72.7	-25.6	-168.9	-50.7	106.9	0	0	0	114.8	I187 Q190 M196 F230 N234	I187-W192 HydrophobicContact CG2-CH2 4.31Å; I187-W192 HydrophobicContact CG2-CZ3 4.27Å; Q190-W192 HydrophobicContact CB-CZ2 3.89Å; Q190-W192 HydrophobicContact CG-CZ2 4.15Å; Q190-W192 PolarHBondContact O-N 3.11Å; Q190-W192 PolarHBondContact O-NE1 3.41Å; W192-M196 WeakPolarHBondContact O-CB 3.34Å; W192-M196 PolarHBondContact O-N 3.43Å; W192-M196 VanDerWaalsContact O-N 3.13Å; W192-F230 VanDerWaalsContact CZ3-O 3.29Å; W192-F230 WeakPolarHBondContact CZ3-O 3.42Å; W192-N234 HydrophobicContact CD2-CB 3.63Å; W192-N234 VanDerWaalsContact CE2-ND2 3.31Å; W192-N234 HydrophobicContact CE3-CB 4Å; W192-N234 HydrophobicContact CG-CB 4.09Å; W192-N234 HydrophobicContact CH2-CB 4.28Å; W192-N234 WeakPolarHBondContact CH2-ND2 3.34Å; W192-N234 HydrophobicContact CZ2-CB 3.98Å; W192-N234 WeakPolarHBondContact CZ2-ND2 3.49Å; W192-N234 HydrophobicContact CZ3-CB 4.28Å
193	E	77.1	Confident	76.3	Confident	152 Å²	152	44 Å²	44	71%	0.71	21%	0.211	S	C	*	.	H	α-helix	trans	-74	-46.1	179.4	-69.6	-169.3	166.8	0	0	111.9	N191 M196 E197	N191-E193 PolarHBondContact O-N 3.45Å; E193-M196 PolarHBondContact O-N 3.09Å; E193-E197 PolarHBondContact O-N 2.66Å
194	A	74.8	Confident	76.4	Confident	26 Å²	26	49.2 Å²	49.2	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-41.1	175	0	0	0	0	0	111.3	N191 M196 E197 D198	N191-A194 WeakPolarHBondContact ND2-CB 3.48Å; A194-M196 VanDerWaalsContact C-N 3.25Å; A194-M196 PolarHBondContact O-N 3.43Å; A194-E197 PolarHBondContact O-N 2.96Å; A194-E197 VanDerWaalsContact O-N 3.11Å; A194-D198 PolarHBondContact O-N 3.43Å
195	A	75.6	Confident	76.2	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.4	-34.6	175.9	0	0	0	0	0	112.7	L183 E186 N191 D198 L199 V231	L183-A195 HydrophobicContact CD1-CB 4.43Å; E186-A195 HydrophobicContact CB-CB 4.16Å; N191-A195 VanDerWaalsContact O-CB 3.3Å; N191-A195 WeakPolarHBondContact O-CB 3.1Å; N191-A195 PolarHBondContact O-N 2.81Å; N191-A195 VanDerWaalsContact O-N 3.14Å; A195-D198 PolarHBondContact O-N 3.41Å; A195-L199 VanDerWaalsContact O-CB 3.27Å; A195-L199 WeakPolarHBondContact O-CB 3.37Å; A195-L199 PolarHBondContact O-N 3.08Å; A195-V231 HydrophobicContact CB-CG1 4.07Å; A195-V231 HydrophobicContact CB-CG2 3.94Å
196	M	73.4	Confident	76	Confident	33 Å²	33	51.9 Å²	51.9	16%	0.163	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-39	176	-177.2	69.7	-142.5	0	0	112.5	W192 E193 A194 T200 V231 F232 N241	W192-M196 WeakPolarHBondContact O-CB 3.34Å; W192-M196 PolarHBondContact O-N 3.43Å; W192-M196 VanDerWaalsContact O-N 3.13Å; E193-M196 PolarHBondContact O-N 3.09Å; A194-M196 VanDerWaalsContact C-N 3.25Å; A194-M196 PolarHBondContact O-N 3.43Å; M196-T200 PolarHBondContact O-N 3.41Å; M196-T200 VanDerWaalsContact O-N 3.14Å; M196-T200 PolarHBondContact O-OG1 3.34Å; M196-V231 HydrophobicContact CB-CG1 4.46Å; M196-F232 HydrophobicContact CE-CE1 3.81Å; M196-F232 HydrophobicContact CE-CZ 4.48Å; M196-F232 HydrophobicContact SD-CD1 4.09Å; M196-F232 HydrophobicContact SD-CE1 3.56Å; M196-F232 VanDerWaalsContact SD-CE1 3.56Å; M196-N241 HydrophobicContact CE-CB 4.33Å; M196-N241 WeakPolarHBondContact CE-ND2 3.47Å
197	E	77.3	Confident	75.8	Confident	100 Å²	100	53 Å²	53	47%	0.467	26%	0.258	S	S	.	.	H	α-helix	trans	-68.4	-43.3	176.1	-160.7	-168.3	-161.5	0	0	110.8	E193 A194 L199 T200 R201	E193-E197 PolarHBondContact O-N 2.66Å; A194-E197 PolarHBondContact O-N 2.96Å; A194-E197 VanDerWaalsContact O-N 3.11Å; E197-L199 VanDerWaalsContact C-N 3.32Å; E197-L199 PolarHBondContact O-N 3.16Å; E197-T200 PolarHBondContact O-N 3.33Å; E197-R201 WeakPolarHBondContact O-CG 3.02Å; E197-R201 PolarHBondContact O-N 2.72Å; E197-R201 VanDerWaalsContact O-N 3.14Å; E197-R201 IonicContact OE1-CZ 3.79Å; E197-R201 VanDerWaalsContact OE1-CZ 3.22Å; E197-R201 IonicContact OE1-NH1 3.59Å; E197-R201 PolarHBondContact OE1-NH1 2.85Å; E197-R201 IonicContact OE1-NH2 2.72Å; E197-R201 PolarHBondContact OE1-NH2 3.09Å; E197-R201 IonicContact OE2-CZ 3.91Å; E197-R201 IonicContact OE2-NH1 2.85Å; E197-R201 PolarHBondContact OE2-NH1 2.8Å; E197-R201 IonicContact OE2-NH2 2.97Å; E197-R201 PolarHBondContact OE2-NH2 3.2Å
198	D	75.8	Confident	75.6	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-65.2	-35.4	176.5	-71.3	-31.4	0	0	0	112.1	R165 K182 L183 A194 A195 R201 L202	R165-D198 IonicContact NH1-OD1 3.08Å; K182-D198 IonicContact NZ-OD1 3.12Å; K182-D198 PolarHBondContact NZ-OD1 2.9Å; K182-D198 IonicContact NZ-OD2 3.67Å; K182-D198 PolarHBondContact NZ-OD2 3.31Å; L183-D198 HydrophobicContact CD1-CB 4.28Å; A194-D198 PolarHBondContact O-N 3.43Å; A195-D198 PolarHBondContact O-N 3.41Å; D198-R201 PolarHBondContact O-N 3.08Å; D198-L202 WeakPolarHBondContact O-CB 3.23Å; D198-L202 PolarHBondContact O-N 3.03Å
199	L	77.1	Confident	75.2	Confident	2 Å²	2	59.8 Å²	59.8	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-46.2	174.9	-167.5	102.2	0	0	0	111.9	L183 A195 E197 R201 L202 R203 L224 F232	L183-L199 HydrophobicContact CD1-CB 4.46Å; L183-L199 HydrophobicContact CD1-CD1 4.42Å; L183-L199 HydrophobicContact CD2-CD1 4.31Å; A195-L199 VanDerWaalsContact O-CB 3.27Å; A195-L199 WeakPolarHBondContact O-CB 3.37Å; A195-L199 PolarHBondContact O-N 3.08Å; E197-L199 VanDerWaalsContact C-N 3.32Å; E197-L199 PolarHBondContact O-N 3.16Å; L199-R201 VanDerWaalsContact C-N 3.26Å; L199-R201 PolarHBondContact O-N 3.11Å; L199-L202 PolarHBondContact O-N 3.47Å; L199-R203 WeakPolarHBondContact O-CB 3.49Å; L199-R203 PolarHBondContact O-N 3.25Å; L199-L224 HydrophobicContact CD1-CD1 4.07Å; L199-L224 HydrophobicContact CG-CD1 4.43Å; L199-F232 HydrophobicContact CD2-CE1 3.83Å; L199-F232 HydrophobicContact CD2-CE2 3.84Å; L199-F232 HydrophobicContact CD2-CZ 3.28Å
200	T	79.2	Confident	74.3	Confident	52 Å²	52	61 Å²	61	32%	0.319	31%	0.312	S	S	.	.	H	α-helix	trans	-59.7	-41.3	178.1	-54.1	0	0	0	0	110.8	M196 E197 R203 E204	M196-T200 PolarHBondContact O-N 3.41Å; M196-T200 VanDerWaalsContact O-N 3.14Å; M196-T200 PolarHBondContact O-OG1 3.34Å; E197-T200 PolarHBondContact O-N 3.33Å; T200-R203 WeakPolarHBondContact O-CB 3.44Å; T200-R203 PolarHBondContact O-N 3.4Å; T200-E204 WeakPolarHBondContact O-CG 3.02Å; T200-E204 PolarHBondContact O-N 3.15Å
201	R	73.6	Confident	73.5	Confident	62 Å²	62	60.5 Å²	60.5	23%	0.234	32%	0.318	C	S	.	.	H	α-helix	trans	-70.7	-39.6	177.8	-72	173.1	173.6	147.3	3.4	113.3	R165 E197 D198 L199 R203 E204 T205	R165-R201 VanDerWaalsContact NH2-CD 3.28Å; E197-R201 WeakPolarHBondContact O-CG 3.02Å; E197-R201 PolarHBondContact O-N 2.72Å; E197-R201 VanDerWaalsContact O-N 3.14Å; E197-R201 IonicContact OE1-CZ 3.79Å; E197-R201 VanDerWaalsContact OE1-CZ 3.22Å; E197-R201 IonicContact OE1-NH1 3.59Å; E197-R201 PolarHBondContact OE1-NH1 2.85Å; E197-R201 IonicContact OE1-NH2 2.72Å; E197-R201 PolarHBondContact OE1-NH2 3.09Å; E197-R201 IonicContact OE2-CZ 3.91Å; E197-R201 IonicContact OE2-NH1 2.85Å; E197-R201 PolarHBondContact OE2-NH1 2.8Å; E197-R201 IonicContact OE2-NH2 2.97Å; E197-R201 PolarHBondContact OE2-NH2 3.2Å; D198-R201 PolarHBondContact O-N 3.08Å; L199-R201 VanDerWaalsContact C-N 3.26Å; L199-R201 PolarHBondContact O-N 3.11Å; R201-R203 VanDerWaalsContact C-N 3.29Å; R201-R203 PolarHBondContact O-N 3.21Å; R201-E204 PolarHBondContact O-N 2.74Å; R201-T205 WeakPolarHBondContact O-CB 3.45Å; R201-T205 PolarHBondContact O-N 2.95Å; R201-T205 PolarHBondContact O-OG1 2.78Å
202	L	78.4	Confident	72.8	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-41.3	175.1	-179.3	59.1	0	0	0	110.5	L176 L179 W180 L183 D198 L199 T205 I206 L224	L176-L202 HydrophobicContact CD1-CD1 3.65Å; L179-L202 HydrophobicContact CB-CD1 3.95Å; L179-L202 HydrophobicContact CD1-CD1 4.48Å; W180-L202 HydrophobicContact CD2-CD1 4.38Å; W180-L202 HydrophobicContact CD2-CD2 3.91Å; W180-L202 HydrophobicContact CE3-CD2 3.73Å; W180-L202 HydrophobicContact CH2-CD2 3.83Å; W180-L202 HydrophobicContact CZ2-CD1 4.34Å; W180-L202 HydrophobicContact CZ2-CD2 3.99Å; W180-L202 HydrophobicContact CZ2-CG 4.47Å; W180-L202 HydrophobicContact CZ3-CD2 3.7Å; L183-L202 HydrophobicContact CD2-CD2 3.68Å; D198-L202 WeakPolarHBondContact O-CB 3.23Å; D198-L202 PolarHBondContact O-N 3.03Å; L199-L202 PolarHBondContact O-N 3.47Å; L202-T205 PolarHBondContact O-N 3.01Å; L202-I206 HydrophobicContact CD1-CD1 3.9Å; L202-I206 HydrophobicContact CD1-CG1 4.29Å; L202-I206 HydrophobicContact CG-CD1 3.85Å; L202-I206 WeakPolarHBondContact O-CB 3.42Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.35Å; L202-I206 PolarHBondContact O-N 2.81Å; L202-L224 HydrophobicContact CB-CD1 4.38Å; L202-L224 HydrophobicContact CD2-CD1 3.51Å; L202-L224 HydrophobicContact CG-CD1 3.86Å
203	R	73.9	Confident	72.8	Confident	81 Å²	81	58.8 Å²	58.8	31%	0.306	32%	0.319	S	S	.	.	H	α-helix	trans	-58.9	-51.3	172.1	-178.1	-158.9	178.5	-172.4	-1.4	111.9	L199 T200 R201 T205 I206 D207 L224 L245	L199-R203 WeakPolarHBondContact O-CB 3.49Å; L199-R203 PolarHBondContact O-N 3.25Å; T200-R203 WeakPolarHBondContact O-CB 3.44Å; T200-R203 PolarHBondContact O-N 3.4Å; R201-R203 VanDerWaalsContact C-N 3.29Å; R201-R203 PolarHBondContact O-N 3.21Å; R203-T205 PolarHBondContact O-N 3.34Å; R203-I206 PolarHBondContact O-N 3.32Å; R203-D207 IonicContact NE-OD2 2.66Å; R203-D207 WeakPolarHBondContact O-CB 3.41Å; R203-D207 PolarHBondContact O-N 2.81Å; R203-L224 HydrophobicContact CB-CD2 4.11Å; R203-L245 HydrophobicContact CG-CD1 4.45Å
204	E	78.9	Confident	72.6	Confident	109 Å²	109	56.7 Å²	56.7	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-57.8	-40.1	178	-75.2	175.9	179.1	0	0	111.7	T200 R201 N208	T200-E204 WeakPolarHBondContact O-CG 3.02Å; T200-E204 PolarHBondContact O-N 3.15Å; R201-E204 PolarHBondContact O-N 2.74Å; E204-N208 WeakPolarHBondContact O-CB 3.39Å; E204-N208 PolarHBondContact O-N 3.28Å; E204-N208 PolarHBondContact O-ND2 3.18Å
205	T	74.4	Confident	72.8	Confident	54 Å²	54	61.2 Å²	61.2	33%	0.331	34%	0.338	S	S	.	.	H	α-helix	trans	-67.3	-42.3	179	-52.9	0	0	0	0	111.6	L176 L179 R201 L202 R203 N209	L176-T205 HydrophobicContact CD1-CG2 4.34Å; L179-T205 HydrophobicContact CD1-CG2 4.17Å; R201-T205 WeakPolarHBondContact O-CB 3.45Å; R201-T205 PolarHBondContact O-N 2.95Å; R201-T205 PolarHBondContact O-OG1 2.78Å; L202-T205 PolarHBondContact O-N 3.01Å; R203-T205 PolarHBondContact O-N 3.34Å; T205-N209 WeakPolarHBondContact O-CB 3.44Å; T205-N209 PolarHBondContact O-N 3.33Å; T205-N209 VanDerWaalsContact O-N 3.13Å
206	I	73.8	Confident	72.8	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-68.1	-40.3	177.9	-69.4	166.3	0	0	0	111	L176 W180 L202 R203 N209 Q220 R221 L224	L176-I206 HydrophobicContact CD1-CG1 3.96Å; W180-I206 HydrophobicContact CZ2-CD1 3.94Å; L202-I206 HydrophobicContact CD1-CD1 3.9Å; L202-I206 HydrophobicContact CD1-CG1 4.29Å; L202-I206 HydrophobicContact CG-CD1 3.85Å; L202-I206 WeakPolarHBondContact O-CB 3.42Å; L202-I206 VanDerWaalsContact O-CG1 3.27Å; L202-I206 WeakPolarHBondContact O-CG1 3.35Å; L202-I206 PolarHBondContact O-N 2.81Å; R203-I206 PolarHBondContact O-N 3.32Å; I206-N209 PolarHBondContact O-N 3Å; I206-Q220 HydrophobicContact CD1-CB 4.44Å; I206-R221 HydrophobicContact CG2-CG 3.8Å; I206-L224 HydrophobicContact CD1-CB 4.4Å; I206-L224 HydrophobicContact CD1-CD2 4.13Å
207	D	72.8	Confident	72.8	Confident	47 Å²	47	65.4 Å²	65.4	25%	0.251	36%	0.359	S	S	.	.	H	α-helix	trans	-73.6	-30.4	-179.4	-73.8	-16.9	0	0	0	112.4	R203 R221 Q249 Y252	R203-D207 IonicContact NE-OD2 2.66Å; R203-D207 WeakPolarHBondContact O-CB 3.41Å; R203-D207 PolarHBondContact O-N 2.81Å; D207-R221 IonicContact OD1-CZ 3.45Å; D207-R221 IonicContact OD1-NE 3.22Å; D207-R221 IonicContact OD1-NH2 2.78Å; D207-R221 PolarHBondContact OD1-NH2 3.08Å; D207-Q249 PolarHBondContact OD2-NE2 3.49Å; D207-Y252 PolarHBondContact OD1-OH 3.05Å
208	N	72.6	Confident	72.9	Confident	128 Å²	128	62.4 Å²	62.4	68%	0.684	35%	0.346	S	S	*	.	H	α-helix	trans	-83.5	-11.8	175.8	-68.8	-30.7	0	0	0	113.7	E204 S210	E204-N208 WeakPolarHBondContact O-CB 3.39Å; E204-N208 PolarHBondContact O-N 3.28Å; E204-N208 PolarHBondContact O-ND2 3.18Å; N208-S210 PolarHBondContact O-N 2.94Å
209	N	68.4	Low	73	Confident	57 Å²	57	66.3 Å²	66.3	31%	0.305	36%	0.364	S	S	.	.			trans	-78.4	86.1	-177.6	-169.1	-5.2	0	0	0	112	T205 I206 V211 S212	T205-N209 WeakPolarHBondContact O-CB 3.44Å; T205-N209 PolarHBondContact O-N 3.33Å; T205-N209 VanDerWaalsContact O-N 3.13Å; I206-N209 PolarHBondContact O-N 3Å; N209-V211 VanDerWaalsContact C-N 3.28Å; N209-V211 PolarHBondContact O-N 3.32Å; N209-V211 PolarHBondContact OD1-N 2.97Å; N209-S212 PolarHBondContact O-OG 3.09Å
210	S	57.8	Low	72.9	Confident	114 Å²	114	67.8 Å²	67.8	80%	0.797	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-9.2	178.7	56	0	0	0	0	114.9	N208	N208-S210 PolarHBondContact O-N 2.94Å
211	V	57.2	Low	72.8	Confident	130 Å²	130	67.2 Å²	67.2	79%	0.788	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-7.5	-170.3	-170.1	0	0	0	0	112.5	N209	N209-V211 VanDerWaalsContact C-N 3.28Å; N209-V211 PolarHBondContact O-N 3.32Å; N209-V211 PolarHBondContact OD1-N 2.97Å
212	S	62.3	Low	73.2	Confident	24 Å²	24	64.3 Å²	64.3	17%	0.168	35%	0.352	C	S	.	.	S	Bend	trans	-85	147.5	179.9	58.5	0	0	0	0	112.8	N209 S217	N209-S212 PolarHBondContact O-OG 3.09Å; S212-S217 PolarHBondContact OG-OG 2.95Å
213	S	74.9	Confident	73.3	Confident	60 Å²	60	68.3 Å²	68.3	42%	0.42	37%	0.367	S	S	.	.			trans	-60.1	136.6	172.2	171.8	0	0	0	0	109.6	L215 Q216 S217	S213-L215 PolarHBondContact O-N 2.82Å; S213-Q216 WeakPolarHBondContact O-CA 3.29Å; S213-Q216 PolarHBondContact O-N 3.24Å; S213-S217 PolarHBondContact O-N 3.29Å; S213-S217 PolarHBondContact O-OG 2.98Å; S213-S217 VanDerWaalsContact O-OG 3.07Å
214	P	73.5	Confident	73.7	Confident	108 Å²	108	64.5 Å²	64.5	70%	0.701	35%	0.353	S	S	*	.	H	α-helix	trans	-52.3	-31.6	-179.2	-28	34.2	0	0	0	114.1	L218	P214-L218 VanDerWaalsContact O-CB 3.27Å; P214-L218 WeakPolarHBondContact O-CB 3.32Å; P214-L218 PolarHBondContact O-N 3.27Å
215	L	77.6	Confident	73.8	Confident	120 Å²	120	59.4 Å²	59.4	63%	0.628	33%	0.329	S	S	*	.	H	α-helix	trans	-67.6	-42.8	175.3	179.8	64.1	0	0	0	112.3	S213 L218 Q219	S213-L215 PolarHBondContact O-N 2.82Å; L215-L218 WeakPolarHBondContact O-CB 3.22Å; L215-L218 PolarHBondContact O-N 2.86Å; L215-Q219 PolarHBondContact O-N 3.15Å
216	Q	75.9	Confident	74.1	Confident	109 Å²	109	56.9 Å²	56.9	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-70.7	-39.6	178.5	-70.6	176.7	-17.8	0	0	111	S213 L218 Q219 Q220	S213-Q216 WeakPolarHBondContact O-CA 3.29Å; S213-Q216 PolarHBondContact O-N 3.24Å; Q216-L218 VanDerWaalsContact C-N 3.3Å; Q216-L218 PolarHBondContact O-N 3.42Å; Q216-Q219 PolarHBondContact O-N 2.92Å; Q216-Q220 WeakPolarHBondContact O-CB 3.49Å; Q216-Q220 VanDerWaalsContact O-CG 3.27Å; Q216-Q220 WeakPolarHBondContact O-CG 3.1Å; Q216-Q220 PolarHBondContact O-N 3.35Å
217	S	74.6	Confident	74.4	Confident	13 Å²	13	57.2 Å²	57.2	9%	0.091	32%	0.315	C	S	.	.	H	α-helix	trans	-62.9	-39.4	173.1	-31.2	0	0	0	0	110.9	S212 S213 Q220 R221	S212-S217 PolarHBondContact OG-OG 2.95Å; S213-S217 PolarHBondContact O-N 3.29Å; S213-S217 PolarHBondContact O-OG 2.98Å; S213-S217 VanDerWaalsContact O-OG 3.07Å; S217-Q220 PolarHBondContact O-N 3.09Å; S217-R221 WeakPolarHBondContact O-CB 3.09Å; S217-R221 VanDerWaalsContact O-CG 3.25Å; S217-R221 WeakPolarHBondContact O-CG 3.38Å; S217-R221 PolarHBondContact O-N 3.32Å
218	L	77.8	Confident	74.6	Confident	37 Å²	37	55 Å²	55	19%	0.194	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-43.5	175.5	-169	72.5	0	0	0	111.6	P214 L215 Q216 R221 T222 A255 M259	P214-L218 VanDerWaalsContact O-CB 3.27Å; P214-L218 WeakPolarHBondContact O-CB 3.32Å; P214-L218 PolarHBondContact O-N 3.27Å; L215-L218 WeakPolarHBondContact O-CB 3.22Å; L215-L218 PolarHBondContact O-N 2.86Å; Q216-L218 VanDerWaalsContact C-N 3.3Å; Q216-L218 PolarHBondContact O-N 3.42Å; L218-R221 PolarHBondContact O-N 3.44Å; L218-T222 WeakPolarHBondContact O-CB 3.47Å; L218-T222 PolarHBondContact O-N 3.43Å; L218-T222 PolarHBondContact O-OG1 3.29Å; L218-A255 HydrophobicContact CD1-CB 3.61Å; L218-A255 HydrophobicContact CG-CB 4.37Å; L218-M259 HydrophobicContact CD2-CG 4.23Å
219	Q	78.7	Confident	74.7	Confident	82 Å²	82	49 Å²	49	38%	0.383	27%	0.271	S	S	.	.	H	α-helix	trans	-63.2	-44.9	176.4	-173.3	175.7	11.2	0	0	111.7	L215 Q216 R221 T222 W223	L215-Q219 PolarHBondContact O-N 3.15Å; Q216-Q219 PolarHBondContact O-N 2.92Å; Q219-R221 VanDerWaalsContact C-N 3.34Å; Q219-R221 PolarHBondContact O-N 3.48Å; Q219-T222 WeakPolarHBondContact O-CA 3.29Å; Q219-T222 VanDerWaalsContact O-CB 3.31Å; Q219-T222 WeakPolarHBondContact O-CB 3.04Å; Q219-T222 PolarHBondContact O-N 3.37Å; Q219-T222 VanDerWaalsContact O-N 3.09Å; Q219-W223 HydrophobicContact CG-CD2 4.32Å; Q219-W223 HydrophobicContact CG-CZ2 3.91Å; Q219-W223 PolarHBondContact O-N 3.36Å
220	Q	75.4	Confident	74.9	Confident	33 Å²	33	46.8 Å²	46.8	15%	0.154	26%	0.258	C	S	.	.	H	α-helix	trans	-62	-41	176.4	-71.9	170.1	3.4	0	0	112.1	L176 I206 Q216 S217 T222 W223 L224	L176-Q220 VanDerWaalsContact CD2-NE2 3.33Å; I206-Q220 HydrophobicContact CD1-CB 4.44Å; Q216-Q220 WeakPolarHBondContact O-CB 3.49Å; Q216-Q220 VanDerWaalsContact O-CG 3.27Å; Q216-Q220 WeakPolarHBondContact O-CG 3.1Å; Q216-Q220 PolarHBondContact O-N 3.35Å; S217-Q220 PolarHBondContact O-N 3.09Å; Q220-T222 VanDerWaalsContact C-N 3.3Å; Q220-T222 PolarHBondContact O-N 2.85Å; Q220-W223 PolarHBondContact O-N 3.16Å; Q220-L224 WeakPolarHBondContact O-CB 3.31Å; Q220-L224 PolarHBondContact O-N 2.93Å
221	R	77	Confident	75.7	Confident	40 Å²	40	41.3 Å²	41.3	15%	0.151	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-39.3	172.5	-74	177.2	176.9	151.3	5	111.9	I206 D207 S217 L218 Q219 L224 I225 Q251 Y252	I206-R221 HydrophobicContact CG2-CG 3.8Å; D207-R221 IonicContact OD1-CZ 3.45Å; D207-R221 IonicContact OD1-NE 3.22Å; D207-R221 IonicContact OD1-NH2 2.78Å; D207-R221 PolarHBondContact OD1-NH2 3.08Å; S217-R221 WeakPolarHBondContact O-CB 3.09Å; S217-R221 VanDerWaalsContact O-CG 3.25Å; S217-R221 WeakPolarHBondContact O-CG 3.38Å; S217-R221 PolarHBondContact O-N 3.32Å; L218-R221 PolarHBondContact O-N 3.44Å; Q219-R221 VanDerWaalsContact C-N 3.34Å; Q219-R221 PolarHBondContact O-N 3.48Å; R221-L224 WeakPolarHBondContact O-CB 3.49Å; R221-L224 PolarHBondContact O-N 3.38Å; R221-I225 WeakPolarHBondContact O-CD1 3.33Å; R221-I225 VanDerWaalsContact O-CG1 3.26Å; R221-I225 WeakPolarHBondContact O-CG1 3.44Å; R221-I225 PolarHBondContact O-N 3.37Å; R221-Q251 VanDerWaalsContact CZ-OE1 3.25Å; R221-Y252 HydrophobicContact CB-CD1 3.97Å; R221-Y252 HydrophobicContact CB-CE1 3.73Å; R221-Y252 HydrophobicContact CG-CD1 4.19Å; R221-Y252 HydrophobicContact CG-CE1 3.59Å
222	T	80.6	Confident	76.3	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-46.2	177.1	-56.6	0	0	0	0	110.9	F13 L218 Q219 Q220 L224 I225 H226 M259 C260	F13-T222 HydrophobicContact CD1-CG2 3.91Å; F13-T222 HydrophobicContact CE1-CG2 3.85Å; F13-T222 HydrophobicContact CZ-CG2 4.47Å; L218-T222 WeakPolarHBondContact O-CB 3.47Å; L218-T222 PolarHBondContact O-N 3.43Å; L218-T222 PolarHBondContact O-OG1 3.29Å; Q219-T222 WeakPolarHBondContact O-CA 3.29Å; Q219-T222 VanDerWaalsContact O-CB 3.31Å; Q219-T222 WeakPolarHBondContact O-CB 3.04Å; Q219-T222 PolarHBondContact O-N 3.37Å; Q219-T222 VanDerWaalsContact O-N 3.09Å; Q220-T222 VanDerWaalsContact C-N 3.3Å; Q220-T222 PolarHBondContact O-N 2.85Å; T222-L224 VanDerWaalsContact C-N 3.32Å; T222-L224 PolarHBondContact O-N 3.26Å; T222-I225 WeakPolarHBondContact O-CB 3.16Å; T222-I225 PolarHBondContact O-N 2.77Å; T222-H226 PolarHBondContact O-N 3.38Å; T222-H226 PolarHBondContact O-ND1 2.94Å; T222-M259 HydrophobicContact CG2-CB 4.29Å; T222-C260 HydrophobicContact CG2-CB 4.34Å; T222-C260 WeakPolarHBondContact CG2-SG 3.48Å
223	W	82	Confident	76.6	Confident	85 Å²	85	34.6 Å²	34.6	32%	0.322	18%	0.178	S	C	.	.	H	α-helix	trans	-61.3	-42.1	173.4	-64	-16	0	0	0	111.6	F13 W180 Q219 Q220 I225 H226 W227	F13-W223 AromaticContact CD1-CD1 3.69Å; F13-W223 AromaticContact CD1-NE1 3.77Å; W180-W223 HydrophobicContact CH2-CB 3.85Å; W180-W223 HydrophobicContact CZ2-CB 4.41Å; W180-W223 HydrophobicContact CZ3-CB 4.36Å; Q219-W223 HydrophobicContact CG-CD2 4.32Å; Q219-W223 HydrophobicContact CG-CZ2 3.91Å; Q219-W223 PolarHBondContact O-N 3.36Å; Q220-W223 PolarHBondContact O-N 3.16Å; W223-I225 VanDerWaalsContact C-N 3.28Å; W223-I225 PolarHBondContact O-N 3.37Å; W223-H226 PolarHBondContact O-N 2.91Å; W223-H226 VanDerWaalsContact O-N 3.09Å; W223-W227 PolarHBondContact O-N 3.14Å
224	L	81.5	Confident	76.2	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-41	178.9	-174.5	69	0	0	0	111.1	W180 L199 L202 R203 I206 Q220 R221 T222 H226 W227 S228 Y252	W180-L224 HydrophobicContact CH2-CB 3.96Å; W180-L224 HydrophobicContact CH2-CD1 4.24Å; L199-L224 HydrophobicContact CD1-CD1 4.07Å; L199-L224 HydrophobicContact CG-CD1 4.43Å; L202-L224 HydrophobicContact CB-CD1 4.38Å; L202-L224 HydrophobicContact CD2-CD1 3.51Å; L202-L224 HydrophobicContact CG-CD1 3.86Å; R203-L224 HydrophobicContact CB-CD2 4.11Å; I206-L224 HydrophobicContact CD1-CB 4.4Å; I206-L224 HydrophobicContact CD1-CD2 4.13Å; Q220-L224 WeakPolarHBondContact O-CB 3.31Å; Q220-L224 PolarHBondContact O-N 2.93Å; R221-L224 WeakPolarHBondContact O-CB 3.49Å; R221-L224 PolarHBondContact O-N 3.38Å; T222-L224 VanDerWaalsContact C-N 3.32Å; T222-L224 PolarHBondContact O-N 3.26Å; L224-H226 VanDerWaalsContact C-N 3.35Å; L224-H226 PolarHBondContact O-N 2.9Å; L224-W227 PolarHBondContact O-N 3.14Å; L224-S228 WeakPolarHBondContact O-CB 3.37Å; L224-S228 PolarHBondContact O-N 2.93Å; L224-S228 PolarHBondContact O-OG 2.79Å; L224-S228 VanDerWaalsContact O-OG 3.13Å; L224-Y252 HydrophobicContact CD2-CE1 3.93Å
225	I	80.9	Confident	75.9	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-49.2	175.7	-69.6	158.3	0	0	0	110.3	R221 T222 W223 W227 S228 L229 F246 Y252 A255 I256 I263	R221-I225 WeakPolarHBondContact O-CD1 3.33Å; R221-I225 VanDerWaalsContact O-CG1 3.26Å; R221-I225 WeakPolarHBondContact O-CG1 3.44Å; R221-I225 PolarHBondContact O-N 3.37Å; T222-I225 WeakPolarHBondContact O-CB 3.16Å; T222-I225 PolarHBondContact O-N 2.77Å; W223-I225 VanDerWaalsContact C-N 3.28Å; W223-I225 PolarHBondContact O-N 3.37Å; I225-W227 PolarHBondContact O-N 3.32Å; I225-S228 PolarHBondContact O-N 3.31Å; I225-S228 PolarHBondContact O-OG 3.47Å; I225-L229 PolarHBondContact O-N 2.85Å; I225-F246 HydrophobicContact CB-CE1 4Å; I225-F246 HydrophobicContact CB-CZ 4.39Å; I225-F246 HydrophobicContact CG1-CD1 4.21Å; I225-F246 HydrophobicContact CG1-CE1 3.67Å; I225-F246 HydrophobicContact CG2-CE1 3.72Å; I225-F246 HydrophobicContact CG2-CZ 3.79Å; I225-Y252 HydrophobicContact CD1-CD1 4.01Å; I225-Y252 HydrophobicContact CG1-CD1 3.93Å; I225-A255 HydrophobicContact CD1-CB 4.08Å; I225-I256 HydrophobicContact CD1-CD1 4.42Å; I225-I256 HydrophobicContact CD1-CG1 3.87Å; I225-I263 HydrophobicContact CG2-CB 4.36Å; I225-I263 HydrophobicContact CG2-CD1 4.08Å; I225-I263 HydrophobicContact CG2-CG1 3.85Å; I225-I263 HydrophobicContact CG2-CG2 3.75Å
226	H	80.1	Confident	75.1	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-42	-179.5	-70.2	75.4	0	0	0	112.3	F13 L14 T222 W223 L224 L229 F230 C260 H262	F13-H226 HydrophobicContact CB-CB 4.2Å; F13-H226 AromaticContact CD2-CD2 3.99Å; F13-H226 AromaticContact CD2-CE1 3.68Å; F13-H226 AromaticContact CD2-NE2 3.47Å; F13-H226 WeakPolarHBondContact CD2-NE2 3.41Å; F13-H226 AromaticContact CG-CE1 3.83Å; F13-H226 AromaticContact CG-ND1 3.99Å; F13-H226 AromaticContact CG-NE2 3.98Å; L14-H226 HydrophobicContact CD2-CB 4.49Å; T222-H226 PolarHBondContact O-N 3.38Å; T222-H226 PolarHBondContact O-ND1 2.94Å; W223-H226 PolarHBondContact O-N 2.91Å; W223-H226 VanDerWaalsContact O-N 3.09Å; L224-H226 VanDerWaalsContact C-N 3.35Å; L224-H226 PolarHBondContact O-N 2.9Å; H226-L229 WeakPolarHBondContact O-CB 3.18Å; H226-L229 PolarHBondContact O-N 2.97Å; H226-F230 WeakPolarHBondContact O-CD2 3.43Å; H226-C260 PolarHBondContact CE1-SG 3.37Å; H226-H262 AromaticContact CD2-NE2 3.81Å; H226-H262 AromaticContact CE1-NE2 3.85Å; H226-H262 AromaticContact NE2-CD2 3.99Å; H226-H262 AromaticContact NE2-CE1 3.49Å; H226-H262 PolarHBondContact NE2-CE1 2.95Å; H226-H262 AromaticContact NE2-NE2 2.86Å; H226-H262 PolarHBondContact NE2-NE2 3.45Å
227	W	80.2	Confident	74.5	Confident	8 Å²	8	33.7 Å²	33.7	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-74.9	-35.7	-178.3	-70.4	41	0	0	0	111.8	F13 L14 D15 L18 W180 L183 A184 I187 W223 L224 I225 L229 F230	F13-W227 PolarHBondContact O-NE1 3.27Å; F13-W227 VanDerWaalsContact O-NE1 3.09Å; L14-W227 HydrophobicContact CD2-CG 4.39Å; D15-W227 HydrophobicContact CB-CH2 4.14Å; D15-W227 HydrophobicContact CB-CZ2 3.85Å; D15-W227 VanDerWaalsContact OD2-CH2 3.31Å; D15-W227 WeakPolarHBondContact OD2-CH2 3.49Å; L18-W227 HydrophobicContact CD1-CD2 4.05Å; L18-W227 HydrophobicContact CD1-CE3 4.17Å; L18-W227 HydrophobicContact CD1-CH2 4.41Å; L18-W227 HydrophobicContact CD1-CZ2 4.25Å; L18-W227 HydrophobicContact CD1-CZ3 4.36Å; W180-W227 HydrophobicContact CB-CH2 4.49Å; W180-W227 AromaticContact CE3-CD2 3.87Å; W180-W227 HydrophobicContact CE3-CD2 3.87Å; W180-W227 AromaticContact CE3-CE3 3.59Å; W180-W227 HydrophobicContact CE3-CE3 3.59Å; W180-W227 AromaticContact CE3-CH2 3.77Å; W180-W227 HydrophobicContact CE3-CH2 3.77Å; W180-W227 HydrophobicContact CE3-CZ2 4.08Å; W180-W227 AromaticContact CE3-CZ3 3.52Å; W180-W227 HydrophobicContact CE3-CZ3 3.52Å; W180-W227 HydrophobicContact CZ3-CB 4.39Å; W180-W227 AromaticContact CZ3-CD2 3.63Å; W180-W227 HydrophobicContact CZ3-CD2 3.63Å; W180-W227 AromaticContact CZ3-CE2 4Å; W180-W227 AromaticContact CZ3-CE3 3.74Å; W180-W227 HydrophobicContact CZ3-CE3 3.74Å; W180-W227 AromaticContact CZ3-CG 3.96Å; W180-W227 HydrophobicContact CZ3-CG 3.96Å; W180-W227 HydrophobicContact CZ3-CH2 4.46Å; W180-W227 HydrophobicContact CZ3-CZ2 4.41Å; W180-W227 HydrophobicContact CZ3-CZ3 4.15Å; W180-W227 WeakPolarHBondContact O-CZ3 3.34Å; L183-W227 HydrophobicContact CB-CE3 4.47Å; L183-W227 HydrophobicContact CB-CZ3 4.46Å; L183-W227 HydrophobicContact CD2-CB 4.27Å; L183-W227 HydrophobicContact CD2-CE3 3.64Å; L183-W227 HydrophobicContact CD2-CZ3 4.35Å; L183-W227 HydrophobicContact CG-CE3 4.09Å; A184-W227 HydrophobicContact CB-CH2 3.97Å; A184-W227 HydrophobicContact CB-CZ3 3.7Å; I187-W227 HydrophobicContact CD1-CE3 4.41Å; W223-W227 PolarHBondContact O-N 3.14Å; L224-W227 PolarHBondContact O-N 3.14Å; I225-W227 PolarHBondContact O-N 3.32Å; W227-L229 PolarHBondContact O-N 2.71Å; W227-F230 WeakPolarHBondContact O-CB 3.25Å; W227-F230 PolarHBondContact O-N 3.42Å; W227-F230 VanDerWaalsContact O-N 3.15Å
228	S	76.9	Confident	73.8	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-28.8	174.1	75.9	0	0	0	0	112	L224 I225 F230 V231 F232 F246	L224-S228 WeakPolarHBondContact O-CB 3.37Å; L224-S228 PolarHBondContact O-N 2.93Å; L224-S228 PolarHBondContact O-OG 2.79Å; L224-S228 VanDerWaalsContact O-OG 3.13Å; I225-S228 PolarHBondContact O-N 3.31Å; I225-S228 PolarHBondContact O-OG 3.47Å; S228-F230 VanDerWaalsContact C-N 3.33Å; S228-F230 PolarHBondContact O-N 3.08Å; S228-V231 PolarHBondContact O-N 3.27Å; S228-F232 VanDerWaalsContact CB-CE2 3.47Å; S228-F232 VanDerWaalsContact O-CB 3.32Å; S228-F232 WeakPolarHBondContact O-CB 3.12Å; S228-F232 WeakPolarHBondContact O-CD2 3.28Å; S228-F232 VanDerWaalsContact O-CG 3.22Å; S228-F232 WeakPolarHBondContact O-CG 3.49Å; S228-F232 PolarHBondContact O-N 3.19Å; S228-F246 WeakPolarHBondContact OG-CZ 3.29Å
229	L	76.3	Confident	73.2	Confident	4 Å²	4	33 Å²	33	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-57.8	-45.4	174.3	-150.2	73.9	0	0	0	111.9	I225 H226 W227 V231 F232 F233 Y266 F334	I225-L229 PolarHBondContact O-N 2.85Å; H226-L229 WeakPolarHBondContact O-CB 3.18Å; H226-L229 PolarHBondContact O-N 2.97Å; W227-L229 PolarHBondContact O-N 2.71Å; L229-V231 VanDerWaalsContact C-N 3.3Å; L229-V231 PolarHBondContact O-N 3.4Å; L229-F232 PolarHBondContact O-N 3.31Å; L229-F233 HydrophobicContact CD1-CD2 3.89Å; L229-F233 HydrophobicContact CD1-CE2 3.41Å; L229-F233 VanDerWaalsContact CD1-CE2 3.41Å; L229-F233 HydrophobicContact CG-CD2 3.7Å; L229-F233 HydrophobicContact CG-CE2 3.68Å; L229-F233 WeakPolarHBondContact O-CB 3.43Å; L229-F233 VanDerWaalsContact O-CD2 3.29Å; L229-F233 WeakPolarHBondContact O-CD2 3.4Å; L229-F233 PolarHBondContact O-N 3.01Å; L229-F233 VanDerWaalsContact O-N 3.08Å; L229-Y266 HydrophobicContact CD1-CD2 4.48Å; L229-Y266 HydrophobicContact CD1-CG 4.1Å; L229-Y266 HydrophobicContact CD2-CD1 3.99Å; L229-Y266 HydrophobicContact CD2-CD2 3.53Å; L229-Y266 HydrophobicContact CD2-CE1 4.33Å; L229-Y266 HydrophobicContact CD2-CE2 3.87Å; L229-Y266 HydrophobicContact CD2-CG 3.61Å; L229-Y266 HydrophobicContact CG-CG 4.33Å; L229-F334 HydrophobicContact CD2-CD2 4.31Å; L229-F334 HydrophobicContact CD2-CE2 4.49Å
230	F	72.6	Confident	72.7	Confident	9 Å²	9	31.4 Å²	31.4	4%	0.039	15%	0.15	C	C	.	.	H	α-helix	trans	-58.8	-44.9	178	-74.6	-104.3	0	0	0	111.3	L14 L18 L22 I187 W192 H226 W227 S228 F334	L14-F230 HydrophobicContact CD1-CE2 3.69Å; L14-F230 HydrophobicContact CD1-CZ 3.53Å; L14-F230 HydrophobicContact CD2-CD2 4.17Å; L14-F230 HydrophobicContact CD2-CE2 3.31Å; L14-F230 HydrophobicContact CD2-CZ 3.84Å; L14-F230 HydrophobicContact CG-CE2 4.13Å; L14-F230 HydrophobicContact CG-CZ 4.36Å; L18-F230 HydrophobicContact CB-CZ 4.46Å; L22-F230 HydrophobicContact CD1-CZ 4.1Å; L22-F230 HydrophobicContact CG-CZ 4.45Å; I187-F230 HydrophobicContact CD1-CB 4.44Å; I187-F230 HydrophobicContact CG2-CB 4.09Å; I187-F230 HydrophobicContact CG2-CD1 4.2Å; I187-F230 HydrophobicContact CG2-CG 4.39Å; W192-F230 VanDerWaalsContact CZ3-O 3.29Å; W192-F230 WeakPolarHBondContact CZ3-O 3.42Å; H226-F230 WeakPolarHBondContact O-CD2 3.43Å; W227-F230 WeakPolarHBondContact O-CB 3.25Å; W227-F230 PolarHBondContact O-N 3.42Å; W227-F230 VanDerWaalsContact O-N 3.15Å; S228-F230 VanDerWaalsContact C-N 3.33Å; S228-F230 PolarHBondContact O-N 3.08Å; F230-F334 HydrophobicContact CB-CE1 4.23Å; F230-F334 AromaticContact CD1-CE1 3.46Å; F230-F334 HydrophobicContact CD1-CE1 3.46Å; F230-F334 VanDerWaalsContact CD1-CE1 3.46Å; F230-F334 AromaticContact CD1-CZ 3.54Å; F230-F334 HydrophobicContact CD1-CZ 3.54Å; F230-F334 HydrophobicContact CD2-CE1 4.1Å; F230-F334 AromaticContact CD2-CZ 3.77Å; F230-F334 HydrophobicContact CD2-CZ 3.77Å; F230-F334 AromaticContact CE1-CE1 3.8Å; F230-F334 HydrophobicContact CE1-CE1 3.8Å; F230-F334 AromaticContact CE1-CZ 3.4Å; F230-F334 HydrophobicContact CE1-CZ 3.4Å; F230-F334 VanDerWaalsContact CE1-CZ 3.4Å; F230-F334 HydrophobicContact CE2-CE1 4.33Å; F230-F334 HydrophobicContact CE2-CE2 4.38Å; F230-F334 AromaticContact CE2-CZ 3.57Å; F230-F334 HydrophobicContact CE2-CZ 3.57Å; F230-F334 AromaticContact CG-CE1 3.65Å; F230-F334 HydrophobicContact CG-CE1 3.65Å; F230-F334 AromaticContact CG-CZ 3.75Å; F230-F334 HydrophobicContact CG-CZ 3.75Å; F230-F334 HydrophobicContact CZ-CE1 4.24Å; F230-F334 HydrophobicContact CZ-CE2 4.35Å; F230-F334 AromaticContact CZ-CZ 3.44Å; F230-F334 HydrophobicContact CZ-CZ 3.44Å; F230-F334 VanDerWaalsContact CZ-CZ 3.44Å
231	V	73.5	Confident	72.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.3	-43.7	-177.2	-176.9	0	0	0	0	111.6	I187 A195 M196 S228 L229 H235	I187-V231 HydrophobicContact CD1-CG2 3.96Å; I187-V231 HydrophobicContact CG1-CG2 3.85Å; A195-V231 HydrophobicContact CB-CG1 4.07Å; A195-V231 HydrophobicContact CB-CG2 3.94Å; M196-V231 HydrophobicContact CB-CG1 4.46Å; S228-V231 PolarHBondContact O-N 3.27Å; L229-V231 VanDerWaalsContact C-N 3.3Å; L229-V231 PolarHBondContact O-N 3.4Å; V231-H235 WeakPolarHBondContact O-CB 3.39Å; V231-H235 PolarHBondContact O-N 3.48Å
232	F	70.7	Confident	72.2	Confident	1 Å²	1	31 Å²	31	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-78.6	-27.3	-172	-67.3	-45.1	0	0	0	114.5	M196 L199 S228 L229 N241 I242	M196-F232 HydrophobicContact CE-CE1 3.81Å; M196-F232 HydrophobicContact CE-CZ 4.48Å; M196-F232 HydrophobicContact SD-CD1 4.09Å; M196-F232 HydrophobicContact SD-CE1 3.56Å; M196-F232 VanDerWaalsContact SD-CE1 3.56Å; L199-F232 HydrophobicContact CD2-CE1 3.83Å; L199-F232 HydrophobicContact CD2-CE2 3.84Å; L199-F232 HydrophobicContact CD2-CZ 3.28Å; S228-F232 VanDerWaalsContact CB-CE2 3.47Å; S228-F232 VanDerWaalsContact O-CB 3.32Å; S228-F232 WeakPolarHBondContact O-CB 3.12Å; S228-F232 WeakPolarHBondContact O-CD2 3.28Å; S228-F232 VanDerWaalsContact O-CG 3.22Å; S228-F232 WeakPolarHBondContact O-CG 3.49Å; S228-F232 PolarHBondContact O-N 3.19Å; L229-F232 PolarHBondContact O-N 3.31Å; F232-N241 HydrophobicContact CD1-CB 4.41Å; F232-N241 HydrophobicContact CE1-CB 3.67Å; F232-N241 HydrophobicContact CZ-CB 4.01Å; F232-I242 HydrophobicContact CB-CD1 3.4Å; F232-I242 VanDerWaalsContact CB-CD1 3.4Å; F232-I242 HydrophobicContact CB-CG1 3.42Å; F232-I242 VanDerWaalsContact CB-CG1 3.42Å; F232-I242 HydrophobicContact CD1-CG1 4.4Å; F232-I242 HydrophobicContact CD2-CD1 4.22Å; F232-I242 HydrophobicContact CD2-CG1 3.36Å; F232-I242 HydrophobicContact CE2-CG1 4.11Å; F232-I242 HydrophobicContact CG-CD1 4.11Å; F232-I242 HydrophobicContact CG-CG1 3.52Å
233	F	68.2	Low	71.7	Confident	12 Å²	12	31.1 Å²	31.1	5%	0.053	15%	0.153	C	C	.	.	H	α-helix	trans	-73.3	-32.2	176.2	-88.3	-89.1	0	0	0	112.5	L229 I242 Y266 A270 F334 L335	L229-F233 HydrophobicContact CD1-CD2 3.89Å; L229-F233 HydrophobicContact CD1-CE2 3.41Å; L229-F233 VanDerWaalsContact CD1-CE2 3.41Å; L229-F233 HydrophobicContact CG-CD2 3.7Å; L229-F233 HydrophobicContact CG-CE2 3.68Å; L229-F233 WeakPolarHBondContact O-CB 3.43Å; L229-F233 VanDerWaalsContact O-CD2 3.29Å; L229-F233 WeakPolarHBondContact O-CD2 3.4Å; L229-F233 PolarHBondContact O-N 3.01Å; L229-F233 VanDerWaalsContact O-N 3.08Å; F233-I242 HydrophobicContact CD2-CD1 4.5Å; F233-I242 HydrophobicContact CE2-CD1 4.25Å; F233-Y266 HydrophobicContact CE2-CD1 4.31Å; F233-Y266 HydrophobicContact CE2-CG 4.47Å; F233-Y266 HydrophobicContact CZ-CD1 4.08Å; F233-Y266 HydrophobicContact CZ-CG 4.45Å; F233-A270 HydrophobicContact CZ-CB 4.39Å; F233-F334 HydrophobicContact CB-CB 4.3Å; F233-F334 HydrophobicContact CB-CD1 4.37Å; F233-F334 HydrophobicContact CD1-CB 4.21Å; F233-F334 WeakPolarHBondContact CD1-O 3.37Å; F233-F334 HydrophobicContact CG-CB 4.06Å; F233-L335 HydrophobicContact CD1-CD2 4.22Å; F233-L335 HydrophobicContact CE1-CD2 3.43Å; F233-L335 VanDerWaalsContact CE1-CD2 3.43Å; F233-L335 HydrophobicContact CZ-CD2 3.99Å
234	N	67.3	Low	71.1	Confident	81 Å²	81	30.1 Å²	30.1	43%	0.433	15%	0.154	S	C	.	.	H	α-helix	trans	-85	-19.6	177.5	-79.9	6.6	0	0	0	113.7	W192	W192-N234 HydrophobicContact CD2-CB 3.63Å; W192-N234 VanDerWaalsContact CE2-ND2 3.31Å; W192-N234 HydrophobicContact CE3-CB 4Å; W192-N234 HydrophobicContact CG-CB 4.09Å; W192-N234 HydrophobicContact CH2-CB 4.28Å; W192-N234 WeakPolarHBondContact CH2-ND2 3.34Å; W192-N234 HydrophobicContact CZ2-CB 3.98Å; W192-N234 WeakPolarHBondContact CZ2-ND2 3.49Å; W192-N234 HydrophobicContact CZ3-CB 4.28Å
235	H	66.4	Low	70.5	Confident	34 Å²	34	30.6 Å²	30.6	16%	0.157	16%	0.156	C	C	.	.	S	Bend	trans	-96.2	122.5	176.8	-163.6	-90	0	0	0	112.8	V231 K237 G238	V231-H235 WeakPolarHBondContact O-CB 3.39Å; V231-H235 PolarHBondContact O-N 3.48Å; H235-K237 VanDerWaalsContact C-N 3.25Å; H235-K237 PolarHBondContact ND1-N 2.75Å; H235-K237 VanDerWaalsContact ND1-N 3.12Å; H235-K237 PolarHBondContact O-N 3.25Å; H235-K237 VanDerWaalsContact O-N 3.16Å; H235-G238 PolarHBondContact ND1-N 3.37Å; H235-G238 PolarHBondContact O-N 3.48Å
236	P	60.7	Low	69.8	Low	105 Å²	105	30.5 Å²	30.5	68%	0.682	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.9	-176.8	24.1	-33.2	0	0	0	114.2
237	K	62.4	Low	69.1	Low	158 Å²	158	31.8 Å²	31.8	69%	0.687	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-5.5	171.9	-51.5	-179.1	176.1	171.8	0	114	H235 R239	H235-K237 VanDerWaalsContact C-N 3.25Å; H235-K237 PolarHBondContact ND1-N 2.75Å; H235-K237 VanDerWaalsContact ND1-N 3.12Å; H235-K237 PolarHBondContact O-N 3.25Å; H235-K237 VanDerWaalsContact O-N 3.16Å; K237-R239 PolarHBondContact O-N 2.97Å
238	G	61.3	Low	68.6	Low	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.2	-24.2	178.1	0	0	0	0	0	112.8	H235 D240 N241 I242	H235-G238 PolarHBondContact ND1-N 3.37Å; H235-G238 PolarHBondContact O-N 3.48Å; G238-D240 PolarHBondContact O-N 3.38Å; G238-N241 CarbonylContact O-C 3.16Å; G238-N241 WeakPolarHBondContact O-CB 3.19Å; G238-N241 PolarHBondContact O-N 3.08Å; G238-N241 VanDerWaalsContact O-N 3.11Å; G238-I242 WeakPolarHBondContact O-CG1 3.43Å; G238-I242 PolarHBondContact O-N 3.15Å
239	R	64.4	Low	68.2	Low	36 Å²	36	39.1 Å²	39.1	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-63.6	-35.4	-176.8	-59.3	-176.7	-176.2	176.7	1	113.9	K237 I243 C338 D341	K237-R239 PolarHBondContact O-N 2.97Å; R239-I243 WeakPolarHBondContact O-CG1 3.43Å; R239-I243 PolarHBondContact O-N 3.27Å; R239-C338 PolarHBondContact NH2-SG 3.08Å; R239-C338 VanDerWaalsContact NH2-SG 3.42Å; R239-D341 IonicContact NH1-OD2 3.48Å; R239-D341 PolarHBondContact NH1-OD2 3.3Å
240	D	68.7	Low	68	Low	48 Å²	48	42.7 Å²	42.7	26%	0.257	22%	0.216	S	C	.	.	H	α-helix	trans	-70.2	-40.8	173.1	-78	-33.7	0	0	0	111.1	G238 I242 I243 D244 N274 K279	G238-D240 PolarHBondContact O-N 3.38Å; D240-I242 VanDerWaalsContact C-N 3.33Å; D240-I242 PolarHBondContact O-N 3.3Å; D240-I243 PolarHBondContact O-N 2.77Å; D240-I243 VanDerWaalsContact O-N 3.16Å; D240-D244 PolarHBondContact O-N 3.03Å; D240-N274 PolarHBondContact OD1-ND2 3.26Å; D240-K279 IonicContact OD1-NZ 3.58Å
241	N	69.1	Low	68.1	Low	61 Å²	61	46.2 Å²	46.2	33%	0.326	23%	0.232	S	C	.	.	H	α-helix	trans	-67.2	-32.5	178.2	-66.9	-24.4	0	0	0	112.2	M196 F232 G238 I243 D244 L245	M196-N241 HydrophobicContact CE-CB 4.33Å; M196-N241 WeakPolarHBondContact CE-ND2 3.47Å; F232-N241 HydrophobicContact CD1-CB 4.41Å; F232-N241 HydrophobicContact CE1-CB 3.67Å; F232-N241 HydrophobicContact CZ-CB 4.01Å; G238-N241 CarbonylContact O-C 3.16Å; G238-N241 WeakPolarHBondContact O-CB 3.19Å; G238-N241 PolarHBondContact O-N 3.08Å; G238-N241 VanDerWaalsContact O-N 3.11Å; N241-I243 VanDerWaalsContact C-N 3.33Å; N241-D244 PolarHBondContact O-N 2.91Å; N241-L245 WeakPolarHBondContact O-CB 3.4Å; N241-L245 PolarHBondContact O-N 3.15Å
242	I	72.4	Confident	68.1	Low	3 Å²	3	46.2 Å²	46.2	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-56.5	-50.3	169.8	-75.1	177	0	0	0	110	F232 F233 G238 D240 D244 L245 F246 A270	F232-I242 HydrophobicContact CB-CD1 3.4Å; F232-I242 VanDerWaalsContact CB-CD1 3.4Å; F232-I242 HydrophobicContact CB-CG1 3.42Å; F232-I242 VanDerWaalsContact CB-CG1 3.42Å; F232-I242 HydrophobicContact CD1-CG1 4.4Å; F232-I242 HydrophobicContact CD2-CD1 4.22Å; F232-I242 HydrophobicContact CD2-CG1 3.36Å; F232-I242 HydrophobicContact CE2-CG1 4.11Å; F232-I242 HydrophobicContact CG-CD1 4.11Å; F232-I242 HydrophobicContact CG-CG1 3.52Å; F233-I242 HydrophobicContact CD2-CD1 4.5Å; F233-I242 HydrophobicContact CE2-CD1 4.25Å; G238-I242 WeakPolarHBondContact O-CG1 3.43Å; G238-I242 PolarHBondContact O-N 3.15Å; D240-I242 VanDerWaalsContact C-N 3.33Å; D240-I242 PolarHBondContact O-N 3.3Å; I242-D244 VanDerWaalsContact C-N 3.33Å; I242-D244 PolarHBondContact O-N 2.93Å; I242-L245 PolarHBondContact O-N 2.83Å; I242-F246 HydrophobicContact CB-CD2 4.39Å; I242-F246 HydrophobicContact CB-CE2 4.47Å; I242-F246 HydrophobicContact CG1-CE2 4.38Å; I242-F246 HydrophobicContact CG2-CD2 3.48Å; I242-F246 VanDerWaalsContact CG2-CD2 3.48Å; I242-F246 HydrophobicContact CG2-CE2 3.77Å; I242-F246 VanDerWaalsContact O-CB 3.32Å; I242-F246 WeakPolarHBondContact O-CB 3.15Å; I242-F246 PolarHBondContact O-N 3.02Å; I242-A270 HydrophobicContact CD1-CB 3.97Å; I242-A270 HydrophobicContact CG2-CB 3.91Å
243	I	69.3	Low	68.3	Low	3 Å²	3	47.6 Å²	47.6	2%	0.015	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-46	-176.8	-67.4	174.8	0	0	0	109.4	R239 D240 N241 L245 L247 V271 N274 V283	R239-I243 WeakPolarHBondContact O-CG1 3.43Å; R239-I243 PolarHBondContact O-N 3.27Å; D240-I243 PolarHBondContact O-N 2.77Å; D240-I243 VanDerWaalsContact O-N 3.16Å; N241-I243 VanDerWaalsContact C-N 3.33Å; I243-L245 VanDerWaalsContact C-N 3.35Å; I243-L245 PolarHBondContact O-N 2.91Å; I243-L247 HydrophobicContact CG2-CD1 4.4Å; I243-L247 WeakPolarHBondContact O-CB 3.37Å; I243-L247 PolarHBondContact O-N 2.86Å; I243-V271 HydrophobicContact CD1-CG2 4.25Å; I243-V271 HydrophobicContact CG1-CG2 3.97Å; I243-N274 HydrophobicContact CD1-CB 4.03Å; I243-N274 WeakPolarHBondContact CD1-ND2 3.44Å; I243-V283 HydrophobicContact CG2-CB 4.44Å; I243-V283 HydrophobicContact CG2-CG1 3.91Å; I243-V283 HydrophobicContact CG2-CG2 3.62Å
244	D	70.9	Confident	68.7	Low	65 Å²	65	51 Å²	51	35%	0.348	26%	0.258	S	S	.	.	H	α-helix	trans	-68.2	-36.6	-178.3	-68.5	-12.9	0	0	0	112.2	D240 N241 I242 Y248	D240-D244 PolarHBondContact O-N 3.03Å; N241-D244 PolarHBondContact O-N 2.91Å; I242-D244 VanDerWaalsContact C-N 3.33Å; I242-D244 PolarHBondContact O-N 2.93Å; D244-Y248 HydrophobicContact CB-CD2 4.13Å; D244-Y248 WeakPolarHBondContact O-CB 3.48Å; D244-Y248 PolarHBondContact O-N 3.21Å; D244-Y248 WeakPolarHBondContact OD1-CD2 3.47Å; D244-Y248 WeakPolarHBondContact OD1-CE2 3.43Å
245	L	68.8	Low	69.2	Low	10 Å²	10	47.1 Å²	47.1	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-81.3	-38	-176.6	-165	138.7	0	0	0	112.8	R203 N241 I242 I243 Y252	R203-L245 HydrophobicContact CG-CD1 4.45Å; N241-L245 WeakPolarHBondContact O-CB 3.4Å; N241-L245 PolarHBondContact O-N 3.15Å; I242-L245 PolarHBondContact O-N 2.83Å; I243-L245 VanDerWaalsContact C-N 3.35Å; I243-L245 PolarHBondContact O-N 2.91Å; L245-Y252 HydrophobicContact CD2-CG 4.47Å
246	F	66.8	Low	69.6	Low	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-88.9	-34.9	-179.2	-62.1	-29.7	0	0	0	114.1	I225 S228 I242 I256 L267	I225-F246 HydrophobicContact CB-CE1 4Å; I225-F246 HydrophobicContact CB-CZ 4.39Å; I225-F246 HydrophobicContact CG1-CD1 4.21Å; I225-F246 HydrophobicContact CG1-CE1 3.67Å; I225-F246 HydrophobicContact CG2-CE1 3.72Å; I225-F246 HydrophobicContact CG2-CZ 3.79Å; S228-F246 WeakPolarHBondContact OG-CZ 3.29Å; I242-F246 HydrophobicContact CB-CD2 4.39Å; I242-F246 HydrophobicContact CB-CE2 4.47Å; I242-F246 HydrophobicContact CG1-CE2 4.38Å; I242-F246 HydrophobicContact CG2-CD2 3.48Å; I242-F246 VanDerWaalsContact CG2-CD2 3.48Å; I242-F246 HydrophobicContact CG2-CE2 3.77Å; I242-F246 VanDerWaalsContact O-CB 3.32Å; I242-F246 WeakPolarHBondContact O-CB 3.15Å; I242-F246 PolarHBondContact O-N 3.02Å; F246-I256 HydrophobicContact CB-CD1 4.29Å; F246-I256 HydrophobicContact CD1-CD1 4.37Å; F246-I256 HydrophobicContact CG-CD1 4.36Å; F246-L267 HydrophobicContact CB-CD1 3.63Å; F246-L267 HydrophobicContact CD2-CD1 4.14Å; F246-L267 HydrophobicContact CG-CD1 4.27Å
247	L	65.2	Low	70.2	Confident	29 Å²	29	43.2 Å²	43.2	15%	0.152	21%	0.211	C	C	.	.	H	α-helix	trans	-91.4	-44	179.2	-83.4	96.1	0	0	0	113.8	I243 L267 V271 V283 D286	I243-L247 HydrophobicContact CG2-CD1 4.4Å; I243-L247 WeakPolarHBondContact O-CB 3.37Å; I243-L247 PolarHBondContact O-N 2.86Å; L247-L267 HydrophobicContact CD1-CD1 4.32Å; L247-L267 HydrophobicContact CD1-CD2 3.87Å; L247-L267 HydrophobicContact CD1-CG 4.31Å; L247-V271 HydrophobicContact CD1-CG2 4.34Å; L247-V283 HydrophobicContact CD1-CG1 4Å; L247-V283 HydrophobicContact CD2-CB 4.46Å; L247-V283 HydrophobicContact CD2-CG1 3.65Å; L247-V283 HydrophobicContact CG-CG1 4.44Å; L247-D286 HydrophobicContact CD2-CB 4.15Å
248	Y	68.3	Low	70.7	Confident	131 Å²	131	40.5 Å²	40.5	51%	0.514	21%	0.207	S	C	.	.	S	Bend	trans	-80.9	-17.5	-173	-66.6	-53.1	0	0	0	113.6	D244 P250	D244-Y248 HydrophobicContact CB-CD2 4.13Å; D244-Y248 WeakPolarHBondContact O-CB 3.48Å; D244-Y248 PolarHBondContact O-N 3.21Å; D244-Y248 WeakPolarHBondContact OD1-CD2 3.47Å; D244-Y248 WeakPolarHBondContact OD1-CE2 3.43Å; Y248-P250 VanDerWaalsContact O-CD 3.29Å; Y248-P250 WeakPolarHBondContact O-CD 3.24Å
249	Q	70.2	Confident	71	Confident	30 Å²	30	44.7 Å²	44.7	14%	0.14	23%	0.228	C	C	.	.			trans	-102.7	102.7	178.7	-161.4	164.4	-0.9	0	0	111.1	D207 Q251 Y252 L253	D207-Q249 PolarHBondContact OD2-NE2 3.49Å; Q249-Q251 HydrophobicContact CG-CB 4.46Å; Q249-Q251 PolarHBondContact O-N 3.1Å; Q249-Y252 HydrophobicContact CB-CD2 3.86Å; Q249-Y252 HydrophobicContact CG-CD2 3.69Å; Q249-Y252 HydrophobicContact CG-CE2 4.03Å; Q249-Y252 PolarHBondContact O-N 3.38Å; Q249-Y252 VanDerWaalsContact O-N 3.1Å; Q249-L253 PolarHBondContact O-N 3.46Å
250	P	70.9	Confident	71.1	Confident	80 Å²	80	43 Å²	43	52%	0.519	22%	0.222	S	C	.	.	H	α-helix	trans	-64.2	-20.6	-173	24.8	-34.3	0	0	0	113.1	Y248 L253 N254	Y248-P250 VanDerWaalsContact O-CD 3.29Å; Y248-P250 WeakPolarHBondContact O-CD 3.24Å; P250-L253 PolarHBondContact O-N 2.87Å; P250-N254 WeakPolarHBondContact O-CB 3.27Å; P250-N254 PolarHBondContact O-N 3.3Å; P250-N254 PolarHBondContact O-ND2 3.38Å; P250-N254 PolarHBondContact O-OD1 2.77Å
251	Q	74.4	Confident	71.3	Confident	82 Å²	82	41.9 Å²	41.9	38%	0.383	22%	0.217	S	C	.	.	H	α-helix	trans	-66.7	-37.1	177.1	-64	175.6	-1.6	0	0	112.7	R221 Q249 A255	R221-Q251 VanDerWaalsContact CZ-OE1 3.25Å; Q249-Q251 HydrophobicContact CG-CB 4.46Å; Q249-Q251 PolarHBondContact O-N 3.1Å; Q251-A255 PolarHBondContact O-N 3.27Å
252	Y	73.2	Confident	71.6	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-79.6	-36.1	175.7	-68.4	-80.3	0	0	0	110.7	D207 R221 L224 I225 L245 Q249 N254 A255 I256	D207-Y252 PolarHBondContact OD1-OH 3.05Å; R221-Y252 HydrophobicContact CB-CD1 3.97Å; R221-Y252 HydrophobicContact CB-CE1 3.73Å; R221-Y252 HydrophobicContact CG-CD1 4.19Å; R221-Y252 HydrophobicContact CG-CE1 3.59Å; L224-Y252 HydrophobicContact CD2-CE1 3.93Å; I225-Y252 HydrophobicContact CD1-CD1 4.01Å; I225-Y252 HydrophobicContact CG1-CD1 3.93Å; L245-Y252 HydrophobicContact CD2-CG 4.47Å; Q249-Y252 HydrophobicContact CB-CD2 3.86Å; Q249-Y252 HydrophobicContact CG-CD2 3.69Å; Q249-Y252 HydrophobicContact CG-CE2 4.03Å; Q249-Y252 PolarHBondContact O-N 3.38Å; Q249-Y252 VanDerWaalsContact O-N 3.1Å; Y252-N254 VanDerWaalsContact C-N 3.35Å; Y252-N254 PolarHBondContact O-N 2.87Å; Y252-A255 WeakPolarHBondContact O-CB 3.29Å; Y252-A255 PolarHBondContact O-N 2.88Å; Y252-A255 VanDerWaalsContact O-N 3.11Å; Y252-I256 WeakPolarHBondContact O-CG1 3.42Å; Y252-I256 PolarHBondContact O-N 3.48Å
253	L	75.9	Confident	71.9	Confident	30 Å²	30	39.1 Å²	39.1	16%	0.157	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-44.5	173.4	-171.2	68.2	0	0	0	112.2	Q249 P250 A255 I256 Q257 V290	Q249-L253 PolarHBondContact O-N 3.46Å; P250-L253 PolarHBondContact O-N 2.87Å; L253-A255 VanDerWaalsContact C-N 3.25Å; L253-A255 PolarHBondContact O-N 3.34Å; L253-I256 WeakPolarHBondContact O-CB 3.28Å; L253-I256 PolarHBondContact O-N 3.35Å; L253-Q257 WeakPolarHBondContact O-CB 3.18Å; L253-Q257 WeakPolarHBondContact O-CG 3.16Å; L253-Q257 PolarHBondContact O-N 3Å; L253-V290 HydrophobicContact CD1-CG1 3.93Å; L253-V290 HydrophobicContact CD1-CG2 3.9Å; L253-V290 HydrophobicContact CD2-CG2 4.2Å
254	N	77	Confident	72.2	Confident	83 Å²	83	39.2 Å²	39.2	44%	0.444	20%	0.203	S	C	.	.	H	α-helix	trans	-62.1	-34.1	176.1	-68.6	-9.4	0	0	0	112.2	P250 Y252 T258	P250-N254 WeakPolarHBondContact O-CB 3.27Å; P250-N254 PolarHBondContact O-N 3.3Å; P250-N254 PolarHBondContact O-ND2 3.38Å; P250-N254 PolarHBondContact O-OD1 2.77Å; Y252-N254 VanDerWaalsContact C-N 3.35Å; Y252-N254 PolarHBondContact O-N 2.87Å; N254-T258 WeakPolarHBondContact O-CB 3.48Å; N254-T258 PolarHBondContact O-N 3.49Å; N254-T258 PolarHBondContact O-OG1 2.78Å
255	A	76.3	Confident	72.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.4	-42.6	175.6	0	0	0	0	0	111.6	L218 I225 Q251 Y252 L253 T258 M259	L218-A255 HydrophobicContact CD1-CB 3.61Å; L218-A255 HydrophobicContact CG-CB 4.37Å; I225-A255 HydrophobicContact CD1-CB 4.08Å; Q251-A255 PolarHBondContact O-N 3.27Å; Y252-A255 WeakPolarHBondContact O-CB 3.29Å; Y252-A255 PolarHBondContact O-N 2.88Å; Y252-A255 VanDerWaalsContact O-N 3.11Å; L253-A255 VanDerWaalsContact C-N 3.25Å; L253-A255 PolarHBondContact O-N 3.34Å; A255-T258 PolarHBondContact O-N 2.93Å; A255-M259 PolarHBondContact O-N 2.73Å
256	I	76.2	Confident	72.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.6	-50.8	174.3	-65.2	168.2	0	0	0	109.7	I225 F246 Y252 L253 T258 C260 I263 L264 L267	I225-I256 HydrophobicContact CD1-CD1 4.42Å; I225-I256 HydrophobicContact CD1-CG1 3.87Å; F246-I256 HydrophobicContact CB-CD1 4.29Å; F246-I256 HydrophobicContact CD1-CD1 4.37Å; F246-I256 HydrophobicContact CG-CD1 4.36Å; Y252-I256 WeakPolarHBondContact O-CG1 3.42Å; Y252-I256 PolarHBondContact O-N 3.48Å; L253-I256 WeakPolarHBondContact O-CB 3.28Å; L253-I256 PolarHBondContact O-N 3.35Å; I256-T258 VanDerWaalsContact C-N 3.29Å; I256-T258 PolarHBondContact O-N 3.47Å; I256-C260 CarbonylContact O-C 3.52Å; I256-C260 PolarHBondContact O-N 3.41Å; I256-C260 VanDerWaalsContact O-N 3.12Å; I256-I263 HydrophobicContact CD1-CG2 4.24Å; I256-I263 HydrophobicContact CG1-CG2 4.41Å; I256-L264 HydrophobicContact CG2-CD2 4.04Å; I256-L264 HydrophobicContact CG2-CG 4.34Å; I256-L267 HydrophobicContact CD1-CD1 4.41Å
257	Q	71.8	Confident	73.4	Confident	58 Å²	58	36.1 Å²	36.1	27%	0.271	19%	0.186	S	C	.	.	H	α-helix	trans	-60.8	-32.7	-179	-75.8	179	-18.8	0	0	114.1	L253 Q293 E294	L253-Q257 WeakPolarHBondContact O-CB 3.18Å; L253-Q257 WeakPolarHBondContact O-CG 3.16Å; L253-Q257 PolarHBondContact O-N 3Å; Q257-Q293 VanDerWaalsContact NE2-OE1 3.16Å; Q257-E294 WeakPolarHBondContact CA-OE1 3.32Å; Q257-E294 HydrophobicContact CG-CG 4.4Å; Q257-E294 WeakPolarHBondContact CG-OE1 3.45Å
258	T	73.4	Confident	73.8	Confident	100 Å²	100	34.8 Å²	34.8	61%	0.613	18%	0.178	S	C	*	.	H	α-helix	trans	-94.7	-41.5	-173	-49.3	0	0	0	0	112.8	N254 A255 I256	N254-T258 WeakPolarHBondContact O-CB 3.48Å; N254-T258 PolarHBondContact O-N 3.49Å; N254-T258 PolarHBondContact O-OG1 2.78Å; A255-T258 PolarHBondContact O-N 2.93Å; I256-T258 VanDerWaalsContact C-N 3.29Å; I256-T258 PolarHBondContact O-N 3.47Å
259	M	69	Low	74.1	Confident	88 Å²	88	28.5 Å²	28.5	43%	0.433	15%	0.154	S	C	.	.	H	α-helix	trans	-114.7	-30.7	-167.5	-63.3	-68.1	-71	0	0	113.4	L218 T222 A255	L218-M259 HydrophobicContact CD2-CG 4.23Å; T222-M259 HydrophobicContact CG2-CB 4.29Å; A255-M259 PolarHBondContact O-N 2.73Å
260	C	64.6	Low	74.3	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.007	15%	0.148	C	C	.	.			trans	-142.6	72	-165	-65.8	0	0	0	0	113.5	F13 T222 H226 I256 H262 I263	F13-C260 VanDerWaalsContact CE2-SG 3.57Å; F13-C260 WeakPolarHBondContact CZ-SG 3.33Å; T222-C260 HydrophobicContact CG2-CB 4.34Å; T222-C260 WeakPolarHBondContact CG2-SG 3.48Å; H226-C260 PolarHBondContact CE1-SG 3.37Å; I256-C260 CarbonylContact O-C 3.52Å; I256-C260 PolarHBondContact O-N 3.41Å; I256-C260 VanDerWaalsContact O-N 3.12Å; C260-H262 PolarHBondContact O-N 2.9Å; C260-I263 HydrophobicContact CB-CG1 4.14Å; C260-I263 PolarHBondContact O-N 2.79Å
261	P	74.1	Confident	74.4	Confident	25 Å²	25	23.3 Å²	23.3	16%	0.162	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-18.7	-178.4	31.2	-37.3	0	0	0	112.7	I263 L264 E294 T297 Y298	P261-I263 PolarHBondContact O-N 3.01Å; P261-L264 WeakPolarHBondContact O-CB 3.26Å; P261-L264 WeakPolarHBondContact O-CG 3.46Å; P261-L264 PolarHBondContact O-N 3.27Å; P261-E294 WeakPolarHBondContact CA-OE2 3.48Å; P261-T297 HydrophobicContact CB-CG2 4.36Å; P261-T297 HydrophobicContact CG-CG2 4.01Å; P261-Y298 HydrophobicContact CB-CG 4.38Å
262	H	75.9	Confident	74.4	Confident	6 Å²	6	19.6 Å²	19.6	3%	0.028	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.7	179.2	56.7	-76.8	0	0	0	114.6	L6 H226 C260 L264 R265 Y298	L6-H262 HydrophobicContact CD2-CB 3.13Å; H226-H262 AromaticContact CD2-NE2 3.81Å; H226-H262 AromaticContact CE1-NE2 3.85Å; H226-H262 AromaticContact NE2-CD2 3.99Å; H226-H262 AromaticContact NE2-CE1 3.49Å; H226-H262 PolarHBondContact NE2-CE1 2.95Å; H226-H262 AromaticContact NE2-NE2 2.86Å; H226-H262 PolarHBondContact NE2-NE2 3.45Å; C260-H262 PolarHBondContact O-N 2.9Å; H262-L264 PolarHBondContact O-N 3.46Å; H262-R265 WeakPolarHBondContact O-CB 3.4Å; H262-R265 PolarHBondContact O-N 3.47Å; H262-Y298 HydrophobicContact CB-CE1 4.4Å; H262-Y298 HydrophobicContact CB-CE2 4.14Å
263	I	77	Confident	74.3	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-64.3	-22.7	175.1	-64.6	-62.7	0	0	0	111.3	I225 I256 C260 P261 R265 Y266 L267	I225-I263 HydrophobicContact CG2-CB 4.36Å; I225-I263 HydrophobicContact CG2-CD1 4.08Å; I225-I263 HydrophobicContact CG2-CG1 3.85Å; I225-I263 HydrophobicContact CG2-CG2 3.75Å; I256-I263 HydrophobicContact CD1-CG2 4.24Å; I256-I263 HydrophobicContact CG1-CG2 4.41Å; C260-I263 HydrophobicContact CB-CG1 4.14Å; C260-I263 PolarHBondContact O-N 2.79Å; P261-I263 PolarHBondContact O-N 3.01Å; I263-R265 PolarHBondContact O-N 2.77Å; I263-Y266 HydrophobicContact CD1-CD2 4.27Å; I263-Y266 PolarHBondContact O-N 2.9Å; I263-L267 WeakPolarHBondContact O-CB 3.43Å; I263-L267 PolarHBondContact O-N 3.4Å
264	L	75.6	Confident	74	Confident	5 Å²	5	18.7 Å²	18.7	3%	0.026	10%	0.101	C	C	.	.	H	α-helix	trans	-57.7	-30.1	174.3	-68.7	-170.4	0	0	0	113.4	I256 P261 H262 L267 T268 V290 I291 E294 T303	I256-L264 HydrophobicContact CG2-CD2 4.04Å; I256-L264 HydrophobicContact CG2-CG 4.34Å; P261-L264 WeakPolarHBondContact O-CB 3.26Å; P261-L264 WeakPolarHBondContact O-CG 3.46Å; P261-L264 PolarHBondContact O-N 3.27Å; H262-L264 PolarHBondContact O-N 3.46Å; L264-L267 PolarHBondContact O-N 2.94Å; L264-T268 WeakPolarHBondContact O-CB 3.47Å; L264-T268 VanDerWaalsContact O-CG2 3.28Å; L264-T268 WeakPolarHBondContact O-CG2 3.49Å; L264-T268 PolarHBondContact O-N 3.45Å; L264-T268 PolarHBondContact O-OG1 3.28Å; L264-V290 HydrophobicContact CD2-CG1 3.78Å; L264-I291 HydrophobicContact CD1-CG1 4.41Å; L264-E294 HydrophobicContact CD1-CB 3.67Å; L264-E294 VanDerWaalsContact CD1-CD 3.42Å; L264-E294 HydrophobicContact CD1-CG 4.06Å; L264-E294 WeakPolarHBondContact CD1-OE2 3.33Å; L264-E294 WeakPolarHBondContact CG-OE2 3.31Å; L264-T303 HydrophobicContact CB-CG2 4.22Å
265	R	78.3	Confident	73.3	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62	-44.5	173.6	179.1	-179.6	175.9	-166	-9.2	111.7	H262 I263 T268 T269 D300 I302 V328 D332	H262-R265 WeakPolarHBondContact O-CB 3.4Å; H262-R265 PolarHBondContact O-N 3.47Å; I263-R265 PolarHBondContact O-N 2.77Å; R265-T268 WeakPolarHBondContact CA-OG1 3.03Å; R265-T268 PolarHBondContact O-OG1 3.19Å; R265-T269 WeakPolarHBondContact O-CG2 3.48Å; R265-T269 PolarHBondContact O-N 3.31Å; R265-T269 PolarHBondContact O-OG1 3.47Å; R265-D300 WeakPolarHBondContact CD-OD2 3.48Å; R265-D300 WeakPolarHBondContact CG-OD2 3.47Å; R265-D300 IonicContact NE-OD2 2.63Å; R265-I302 HydrophobicContact CG-CD1 3.81Å; R265-V328 PolarHBondContact NH2-O 2.88Å; R265-D332 IonicContact CZ-OD1 3.63Å; R265-D332 IonicContact CZ-OD2 3.51Å; R265-D332 IonicContact NE-OD2 2.81Å; R265-D332 IonicContact NH1-OD1 3.94Å; R265-D332 PolarHBondContact NH1-OD1 3.5Å; R265-D332 IonicContact NH1-OD2 3.47Å; R265-D332 PolarHBondContact NH1-OD2 3.25Å; R265-D332 VanDerWaalsContact NH1-OD2 3.08Å; R265-D332 IonicContact NH2-OD1 3.88Å; R265-D332 PolarHBondContact NH2-OD1 3.24Å; R265-D332 IonicContact NH2-OD2 2.73Å; R265-D332 PolarHBondContact NH2-OD2 2.9Å
266	Y	77.4	Confident	72.6	Confident	7 Å²	7	27 Å²	27	3%	0.027	14%	0.137	C	C	.	.	H	α-helix	trans	-75.7	-32.1	179.1	-59.5	-69.4	0	0	0	112.1	I10 L229 F233 I263 T269 A270 D332 F334 L335	I10-Y266 HydrophobicContact CD1-CE2 3.95Å; L229-Y266 HydrophobicContact CD1-CD2 4.48Å; L229-Y266 HydrophobicContact CD1-CG 4.1Å; L229-Y266 HydrophobicContact CD2-CD1 3.99Å; L229-Y266 HydrophobicContact CD2-CD2 3.53Å; L229-Y266 HydrophobicContact CD2-CE1 4.33Å; L229-Y266 HydrophobicContact CD2-CE2 3.87Å; L229-Y266 HydrophobicContact CD2-CG 3.61Å; L229-Y266 HydrophobicContact CG-CG 4.33Å; F233-Y266 HydrophobicContact CE2-CD1 4.31Å; F233-Y266 HydrophobicContact CE2-CG 4.47Å; F233-Y266 HydrophobicContact CZ-CD1 4.08Å; F233-Y266 HydrophobicContact CZ-CG 4.45Å; I263-Y266 HydrophobicContact CD1-CD2 4.27Å; I263-Y266 PolarHBondContact O-N 2.9Å; Y266-T269 VanDerWaalsContact CA-OG1 3.29Å; Y266-T269 WeakPolarHBondContact CA-OG1 3.27Å; Y266-T269 PolarHBondContact O-OG1 2.96Å; Y266-A270 WeakPolarHBondContact O-CB 3.37Å; Y266-A270 PolarHBondContact O-N 2.94Å; Y266-D332 WeakPolarHBondContact CE1-OD2 3.31Å; Y266-D332 PolarHBondContact OH-OD2 3.39Å; Y266-F334 HydrophobicContact CE1-CB 4.47Å; Y266-F334 HydrophobicContact CE1-CD2 4.34Å; Y266-L335 HydrophobicContact CD1-CD1 4.07Å; Y266-L335 HydrophobicContact CD1-CD2 4.1Å; Y266-L335 HydrophobicContact CD1-CG 4.15Å; Y266-L335 HydrophobicContact CE1-CD1 3.85Å; Y266-L335 HydrophobicContact CE1-CD2 4.49Å; Y266-L335 HydrophobicContact CE1-CG 4.03Å
267	L	76.3	Confident	71.9	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-69.7	-42.9	176.9	-167.2	157.7	0	0	0	111	F246 L247 I256 I263 L264 A270 V271 L287	F246-L267 HydrophobicContact CB-CD1 3.63Å; F246-L267 HydrophobicContact CD2-CD1 4.14Å; F246-L267 HydrophobicContact CG-CD1 4.27Å; L247-L267 HydrophobicContact CD1-CD1 4.32Å; L247-L267 HydrophobicContact CD1-CD2 3.87Å; L247-L267 HydrophobicContact CD1-CG 4.31Å; I256-L267 HydrophobicContact CD1-CD1 4.41Å; I263-L267 WeakPolarHBondContact O-CB 3.43Å; I263-L267 PolarHBondContact O-N 3.4Å; L264-L267 PolarHBondContact O-N 2.94Å; L267-A270 PolarHBondContact O-N 3.26Å; L267-V271 HydrophobicContact CD2-CG2 4.03Å; L267-V271 WeakPolarHBondContact O-CB 3.4Å; L267-V271 WeakPolarHBondContact O-CG2 3.2Å; L267-V271 PolarHBondContact O-N 3.09Å; L267-L287 HydrophobicContact CD2-CD1 3.24Å; L267-L287 HydrophobicContact CD2-CD2 4.37Å; L267-L287 HydrophobicContact CD2-CG 4.36Å
268	T	75	Confident	71.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61	-47.1	174.1	44.8	0	0	0	0	112	L264 R265 V271 I272 L287 I291 I302 V306	L264-T268 WeakPolarHBondContact O-CB 3.47Å; L264-T268 VanDerWaalsContact O-CG2 3.28Å; L264-T268 WeakPolarHBondContact O-CG2 3.49Å; L264-T268 PolarHBondContact O-N 3.45Å; L264-T268 PolarHBondContact O-OG1 3.28Å; R265-T268 WeakPolarHBondContact CA-OG1 3.03Å; R265-T268 PolarHBondContact O-OG1 3.19Å; T268-V271 PolarHBondContact O-N 2.9Å; T268-I272 WeakPolarHBondContact O-CB 3.49Å; T268-I272 WeakPolarHBondContact O-CD1 3.46Å; T268-I272 VanDerWaalsContact O-CG1 3.26Å; T268-I272 WeakPolarHBondContact O-CG1 3.33Å; T268-I272 PolarHBondContact O-N 3.42Å; T268-L287 HydrophobicContact CG2-CD1 4.24Å; T268-L287 HydrophobicContact CG2-CD2 4.15Å; T268-L287 HydrophobicContact CG2-CG 4.5Å; T268-I291 HydrophobicContact CG2-CD1 3.44Å; T268-I291 VanDerWaalsContact CG2-CD1 3.44Å; T268-I291 HydrophobicContact CG2-CG1 4.33Å; T268-I302 WeakPolarHBondContact OG1-CG2 3.09Å; T268-V306 HydrophobicContact CG2-CG2 4.2Å
269	T	74.5	Confident	70.9	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-41.9	176.8	47.8	0	0	0	0	112.3	R265 Y266 I272 T273 I302 L329 L335 F342	R265-T269 WeakPolarHBondContact O-CG2 3.48Å; R265-T269 PolarHBondContact O-N 3.31Å; R265-T269 PolarHBondContact O-OG1 3.47Å; Y266-T269 VanDerWaalsContact CA-OG1 3.29Å; Y266-T269 WeakPolarHBondContact CA-OG1 3.27Å; Y266-T269 PolarHBondContact O-OG1 2.96Å; T269-I272 PolarHBondContact O-N 3.38Å; T269-T273 WeakPolarHBondContact O-CB 3.42Å; T269-T273 VanDerWaalsContact O-CG2 3.28Å; T269-T273 WeakPolarHBondContact O-CG2 3.44Å; T269-T273 PolarHBondContact O-N 3.4Å; T269-T273 PolarHBondContact O-OG1 3.05Å; T269-I302 HydrophobicContact CG2-CD1 4.02Å; T269-I302 HydrophobicContact CG2-CG2 4.09Å; T269-L329 HydrophobicContact CG2-CD2 4.19Å; T269-L335 HydrophobicContact CG2-CD1 4.34Å; T269-L335 HydrophobicContact CG2-CD2 4.13Å; T269-L335 WeakPolarHBondContact OG1-CD2 3.33Å; T269-F342 HydrophobicContact CG2-CD2 3.98Å; T269-F342 HydrophobicContact CG2-CE2 3.85Å; T269-F342 HydrophobicContact CG2-CZ 4.5Å
270	A	73.3	Confident	70.6	Confident	1 Å²	1	34 Å²	34	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-64.7	-41.1	176.3	0	0	0	0	0	112.8	F233 I242 Y266 L267 T273 N274	F233-A270 HydrophobicContact CZ-CB 4.39Å; I242-A270 HydrophobicContact CD1-CB 3.97Å; I242-A270 HydrophobicContact CG2-CB 3.91Å; Y266-A270 WeakPolarHBondContact O-CB 3.37Å; Y266-A270 PolarHBondContact O-N 2.94Å; L267-A270 PolarHBondContact O-N 3.26Å; A270-T273 PolarHBondContact O-OG1 3.1Å; A270-N274 PolarHBondContact O-N 2.63Å
271	V	73.6	Confident	70.7	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.9	-42.8	177.1	170.2	0	0	0	0	111.1	I243 L247 L267 T268 N274 R280 V283 L284 L287	I243-V271 HydrophobicContact CD1-CG2 4.25Å; I243-V271 HydrophobicContact CG1-CG2 3.97Å; L247-V271 HydrophobicContact CD1-CG2 4.34Å; L267-V271 HydrophobicContact CD2-CG2 4.03Å; L267-V271 WeakPolarHBondContact O-CB 3.4Å; L267-V271 WeakPolarHBondContact O-CG2 3.2Å; L267-V271 PolarHBondContact O-N 3.09Å; T268-V271 PolarHBondContact O-N 2.9Å; V271-N274 PolarHBondContact O-N 3.43Å; V271-R280 HydrophobicContact CG1-CG 4.47Å; V271-R280 WeakPolarHBondContact O-CG 3.44Å; V271-V283 HydrophobicContact CG1-CG1 3.79Å; V271-V283 HydrophobicContact CG2-CG1 3.8Å; V271-L284 HydrophobicContact CG1-CG 4.44Å; V271-L287 HydrophobicContact CB-CD2 3.93Å; V271-L287 HydrophobicContact CG1-CD2 3.84Å; V271-L287 HydrophobicContact CG2-CD2 4.14Å
272	I	73.3	Confident	70.4	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-68.2	-35.5	-178.9	-71.7	166.4	0	0	0	111.5	T268 T269 R280 V306 F342 N345 F349	T268-I272 WeakPolarHBondContact O-CB 3.49Å; T268-I272 WeakPolarHBondContact O-CD1 3.46Å; T268-I272 VanDerWaalsContact O-CG1 3.26Å; T268-I272 WeakPolarHBondContact O-CG1 3.33Å; T268-I272 PolarHBondContact O-N 3.42Å; T269-I272 PolarHBondContact O-N 3.38Å; I272-R280 PolarHBondContact O-NE 3.45Å; I272-R280 PolarHBondContact O-NH1 2.9Å; I272-R280 PolarHBondContact O-NH2 3.13Å; I272-R280 VanDerWaalsContact O-NH2 3.1Å; I272-V306 HydrophobicContact CD1-CG2 3.95Å; I272-F342 HydrophobicContact CB-CD2 3.98Å; I272-F342 HydrophobicContact CB-CE2 3.95Å; I272-F342 HydrophobicContact CD1-CD2 4.45Å; I272-F342 HydrophobicContact CD1-CE2 3.56Å; I272-F342 HydrophobicContact CD1-CZ 4.19Å; I272-F342 HydrophobicContact CG1-CE2 4.34Å; I272-F342 HydrophobicContact CG2-CD2 3.66Å; I272-F342 HydrophobicContact CG2-CE2 3.82Å; I272-N345 HydrophobicContact CG2-CB 3.76Å; I272-N345 WeakPolarHBondContact O-CB 3.34Å; I272-F349 HydrophobicContact CG2-CE2 4.49Å
273	T	71.9	Confident	70.1	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-81.9	-9.1	180	54.7	0	0	0	0	114.3	T269 A270 K275 C338 D341 F342	T269-T273 WeakPolarHBondContact O-CB 3.42Å; T269-T273 VanDerWaalsContact O-CG2 3.28Å; T269-T273 WeakPolarHBondContact O-CG2 3.44Å; T269-T273 PolarHBondContact O-N 3.4Å; T269-T273 PolarHBondContact O-OG1 3.05Å; A270-T273 PolarHBondContact O-OG1 3.1Å; T273-K275 PolarHBondContact O-N 2.85Å; T273-C338 HydrophobicContact CG2-CB 4.21Å; T273-D341 HydrophobicContact CG2-CB 4.06Å; T273-F342 HydrophobicContact CG2-CB 3.96Å
274	N	69.3	Low	69.7	Low	9 Å²	9	44.7 Å²	44.7	5%	0.048	20%	0.199	C	C	.	.			trans	-67.4	125	-178.7	-173.6	-9.5	0	0	0	111.8	D240 I243 A270 V271 D276 R280	D240-N274 PolarHBondContact OD1-ND2 3.26Å; I243-N274 HydrophobicContact CD1-CB 4.03Å; I243-N274 WeakPolarHBondContact CD1-ND2 3.44Å; A270-N274 PolarHBondContact O-N 2.63Å; V271-N274 PolarHBondContact O-N 3.43Å; N274-D276 PolarHBondContact O-N 3.41Å; N274-D276 VanDerWaalsContact O-N 3.13Å; N274-D276 PolarHBondContact OD1-N 3.33Å; N274-R280 PolarHBondContact O-NE 3.41Å; N274-R280 PolarHBondContact O-NH2 3.25Å
275	K	62.4	Low	69.6	Low	174 Å²	174	51.8 Å²	51.8	76%	0.757	23%	0.229	S	C	*	.	S	Bend	trans	-59.7	-23.7	-175	-61.1	-174.5	178.1	-175.8	0	114.5	T273 V277	T273-K275 PolarHBondContact O-N 2.85Å; K275-V277 PolarHBondContact O-N 3.31Å
276	D	61.8	Low	69.5	Low	82 Å²	82	55.4 Å²	55.4	44%	0.439	25%	0.249	S	C	.	.			trans	-85.5	96.1	-177.4	-90.5	-20.8	0	0	0	114.1	N274 R278 K279 R280	N274-D276 PolarHBondContact O-N 3.41Å; N274-D276 VanDerWaalsContact O-N 3.13Å; N274-D276 PolarHBondContact OD1-N 3.33Å; D276-R278 PolarHBondContact O-N 3.21Å; D276-R278 VanDerWaalsContact O-N 3.08Å; D276-K279 HydrophobicContact CB-CB 4.34Å; D276-K279 HydrophobicContact CB-CD 4.48Å; D276-K279 HydrophobicContact CB-CG 4.46Å; D276-K279 PolarHBondContact O-N 3.13Å; D276-R280 VanDerWaalsContact O-CB 3.31Å; D276-R280 WeakPolarHBondContact O-CB 3.19Å; D276-R280 PolarHBondContact O-N 2.92Å
277	V	61.8	Low	69.5	Low	79 Å²	79	55.1 Å²	55.1	48%	0.479	25%	0.248	S	C	.	.	H	α-helix	trans	-53.7	-31.4	178.6	-177.4	0	0	0	0	113.6	K275 R281	K275-V277 PolarHBondContact O-N 3.31Å; V277-R281 PolarHBondContact O-N 3.26Å
278	R	61.7	Low	69.6	Low	223 Å²	223	56 Å²	56	84%	0.842	25%	0.253	S	S	*	.	H	α-helix	trans	-74.2	-49.3	-178.7	-82.8	-172.1	-89.8	-167.9	-5.2	113.3	D276 R280 R281	D276-R278 PolarHBondContact O-N 3.21Å; D276-R278 VanDerWaalsContact O-N 3.08Å; R278-R280 VanDerWaalsContact C-N 3.27Å; R278-R280 PolarHBondContact O-N 3.01Å; R278-R281 PolarHBondContact O-N 2.75Å
279	K	62.3	Low	69.7	Low	78 Å²	78	61.7 Å²	61.7	34%	0.339	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-41.8	174.1	-71.3	-175.3	-179.8	179.5	0	109.8	D240 D276 R281 Q282 V283	D240-K279 IonicContact OD1-NZ 3.58Å; D276-K279 HydrophobicContact CB-CB 4.34Å; D276-K279 HydrophobicContact CB-CD 4.48Å; D276-K279 HydrophobicContact CB-CG 4.46Å; D276-K279 PolarHBondContact O-N 3.13Å; K279-R281 PolarHBondContact O-N 3.44Å; K279-Q282 PolarHBondContact O-N 2.87Å; K279-Q282 VanDerWaalsContact O-N 3.14Å; K279-V283 WeakPolarHBondContact O-CB 3.47Å; K279-V283 WeakPolarHBondContact O-CG2 3.39Å; K279-V283 PolarHBondContact O-N 2.97Å
280	R	63.3	Low	69.8	Low	14 Å²	14	62.4 Å²	62.4	5%	0.053	28%	0.282	C	S	.	.	H	α-helix	trans	-53	-47.2	178.1	-151.3	-170.6	-76.6	-176.3	-5.4	112.9	V271 I272 N274 D276 R278 Q282 V283 L284 N345 F349	V271-R280 HydrophobicContact CG1-CG 4.47Å; V271-R280 WeakPolarHBondContact O-CG 3.44Å; I272-R280 PolarHBondContact O-NE 3.45Å; I272-R280 PolarHBondContact O-NH1 2.9Å; I272-R280 PolarHBondContact O-NH2 3.13Å; I272-R280 VanDerWaalsContact O-NH2 3.1Å; N274-R280 PolarHBondContact O-NE 3.41Å; N274-R280 PolarHBondContact O-NH2 3.25Å; D276-R280 VanDerWaalsContact O-CB 3.31Å; D276-R280 WeakPolarHBondContact O-CB 3.19Å; D276-R280 PolarHBondContact O-N 2.92Å; R278-R280 VanDerWaalsContact C-N 3.27Å; R278-R280 PolarHBondContact O-N 3.01Å; R280-Q282 VanDerWaalsContact C-N 3.35Å; R280-Q282 PolarHBondContact O-N 3.11Å; R280-V283 PolarHBondContact O-N 3.44Å; R280-L284 HydrophobicContact CG-CD1 4Å; R280-L284 WeakPolarHBondContact O-CB 3.09Å; R280-L284 VanDerWaalsContact O-CD1 3.31Å; R280-L284 WeakPolarHBondContact O-CD1 3.37Å; R280-L284 WeakPolarHBondContact O-CG 3.31Å; R280-L284 PolarHBondContact O-N 3.43Å; R280-N345 PolarHBondContact NH1-OD1 3.31Å; R280-N345 PolarHBondContact NH2-OD1 3.46Å; R280-F349 HydrophobicContact CG-CZ 4.01Å
281	R	65	Low	70	Confident	116 Å²	116	62.7 Å²	62.7	44%	0.438	28%	0.283	S	S	.	.	H	α-helix	trans	-65.3	-30.4	-179.8	-78	-176.7	-178.1	176.7	5.1	114.6	V277 R278 K279 E352	V277-R281 PolarHBondContact O-N 3.26Å; R278-R281 PolarHBondContact O-N 2.75Å; K279-R281 PolarHBondContact O-N 3.44Å; R281-E352 IonicContact CZ-OE1 3.86Å; R281-E352 IonicContact NE-OE1 2.64Å; R281-E352 IonicContact NH2-OE1 3.59Å; R281-E352 PolarHBondContact NH2-OE1 3.41Å
282	Q	68.1	Low	70.1	Confident	129 Å²	129	67.8 Å²	67.8	60%	0.603	31%	0.307	S	S	*	.	H	α-helix	trans	-77.6	-50.6	177.2	-68.9	176.2	-13.2	0	0	110	K279 R280 L284 K285	K279-Q282 PolarHBondContact O-N 2.87Å; K279-Q282 VanDerWaalsContact O-N 3.14Å; R280-Q282 VanDerWaalsContact C-N 3.35Å; R280-Q282 PolarHBondContact O-N 3.11Å; Q282-L284 VanDerWaalsContact C-N 3.3Å; Q282-L284 PolarHBondContact O-N 2.83Å; Q282-K285 PolarHBondContact O-N 3.43Å
283	V	70.3	Confident	70.2	Confident	2 Å²	2	73.1 Å²	73.1	1%	0.012	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-37.1	179.9	171.4	0	0	0	0	111.8	I243 L247 V271 K279 R280 K285 D286 L287	I243-V283 HydrophobicContact CG2-CB 4.44Å; I243-V283 HydrophobicContact CG2-CG1 3.91Å; I243-V283 HydrophobicContact CG2-CG2 3.62Å; L247-V283 HydrophobicContact CD1-CG1 4Å; L247-V283 HydrophobicContact CD2-CB 4.46Å; L247-V283 HydrophobicContact CD2-CG1 3.65Å; L247-V283 HydrophobicContact CG-CG1 4.44Å; V271-V283 HydrophobicContact CG1-CG1 3.79Å; V271-V283 HydrophobicContact CG2-CG1 3.8Å; K279-V283 WeakPolarHBondContact O-CB 3.47Å; K279-V283 WeakPolarHBondContact O-CG2 3.39Å; K279-V283 PolarHBondContact O-N 2.97Å; R280-V283 PolarHBondContact O-N 3.44Å; V283-K285 VanDerWaalsContact C-N 3.29Å; V283-K285 PolarHBondContact O-N 3.16Å; V283-D286 PolarHBondContact O-N 3.39Å; V283-L287 VanDerWaalsContact O-CB 3.3Å; V283-L287 WeakPolarHBondContact O-CB 3.5Å; V283-L287 PolarHBondContact O-N 2.87Å
284	L	69.7	Low	70	Confident	9 Å²	9	73.4 Å²	73.4	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-58.6	-36.5	178.7	-91	160.3	0	0	0	113.5	V271 R280 Q282 V288 Y310 F349	V271-L284 HydrophobicContact CG1-CG 4.44Å; R280-L284 HydrophobicContact CG-CD1 4Å; R280-L284 WeakPolarHBondContact O-CB 3.09Å; R280-L284 VanDerWaalsContact O-CD1 3.31Å; R280-L284 WeakPolarHBondContact O-CD1 3.37Å; R280-L284 WeakPolarHBondContact O-CG 3.31Å; R280-L284 PolarHBondContact O-N 3.43Å; Q282-L284 VanDerWaalsContact C-N 3.3Å; Q282-L284 PolarHBondContact O-N 2.83Å; L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.27Å; L284-V288 PolarHBondContact O-N 3.49Å; L284-Y310 HydrophobicContact CD2-CE2 3.71Å; L284-F349 HydrophobicContact CD1-CE1 3.81Å; L284-F349 HydrophobicContact CD1-CE2 4.24Å; L284-F349 HydrophobicContact CD1-CZ 3.44Å; L284-F349 VanDerWaalsContact CD1-CZ 3.44Å
285	K	73.4	Confident	69.8	Low	155 Å²	155	74.4 Å²	74.4	67%	0.674	34%	0.341	S	S	*	.	H	α-helix	trans	-68.4	-40	179.6	-71.6	-174.5	177.4	-176.3	0	111.9	Q282 V283 K289	Q282-K285 PolarHBondContact O-N 3.43Å; V283-K285 VanDerWaalsContact C-N 3.29Å; V283-K285 PolarHBondContact O-N 3.16Å; K285-K289 WeakPolarHBondContact O-CG 3.21Å; K285-K289 PolarHBondContact O-N 3.32Å
286	D	75.5	Confident	70.2	Confident	76 Å²	76	75 Å²	75	41%	0.406	34%	0.34	S	S	.	.	H	α-helix	trans	-75.5	-36.9	179.2	-63.9	-31.1	0	0	0	110.5	L247 V283 K289 V290	L247-D286 HydrophobicContact CD2-CB 4.15Å; V283-D286 PolarHBondContact O-N 3.39Å; D286-K289 WeakPolarHBondContact O-CB 3.25Å; D286-K289 PolarHBondContact O-N 2.93Å; D286-K289 IonicContact OD1-NZ 3.79Å; D286-V290 WeakPolarHBondContact O-CG2 3.21Å; D286-V290 PolarHBondContact O-N 3.13Å
287	L	77.8	Confident	70.5	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-58.1	-48.5	171.4	177.5	56.8	0	0	0	112.5	L267 T268 V271 V283 K289 V290 I291	L267-L287 HydrophobicContact CD2-CD1 3.24Å; L267-L287 HydrophobicContact CD2-CD2 4.37Å; L267-L287 HydrophobicContact CD2-CG 4.36Å; T268-L287 HydrophobicContact CG2-CD1 4.24Å; T268-L287 HydrophobicContact CG2-CD2 4.15Å; T268-L287 HydrophobicContact CG2-CG 4.5Å; V271-L287 HydrophobicContact CB-CD2 3.93Å; V271-L287 HydrophobicContact CG1-CD2 3.84Å; V271-L287 HydrophobicContact CG2-CD2 4.14Å; V283-L287 VanDerWaalsContact O-CB 3.3Å; V283-L287 WeakPolarHBondContact O-CB 3.5Å; V283-L287 PolarHBondContact O-N 2.87Å; L287-K289 VanDerWaalsContact C-N 3.25Å; L287-K289 PolarHBondContact O-N 3.32Å; L287-V290 PolarHBondContact O-N 3.22Å; L287-V290 VanDerWaalsContact O-N 3.13Å; L287-I291 HydrophobicContact CD1-CD1 3.75Å; L287-I291 HydrophobicContact CD1-CG1 4Å; L287-I291 HydrophobicContact CD2-CD1 4.42Å; L287-I291 HydrophobicContact CG-CD1 3.71Å; L287-I291 HydrophobicContact CG-CG1 4.39Å; L287-I291 WeakPolarHBondContact O-CG1 3.27Å; L287-I291 PolarHBondContact O-N 3.46Å
288	V	78.1	Confident	70.8	Confident	22 Å²	22	72.4 Å²	72.4	13%	0.133	32%	0.324	C	S	.	.	H	α-helix	trans	-60.9	-36.8	178.9	170.8	0	0	0	0	111	L284 Q292 V306 Y310 V311	L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.27Å; L284-V288 PolarHBondContact O-N 3.49Å; V288-Q292 VanDerWaalsContact O-CB 3.29Å; V288-Q292 WeakPolarHBondContact O-CB 3.35Å; V288-Q292 PolarHBondContact O-N 3.01Å; V288-V306 HydrophobicContact CG2-CG1 4.01Å; V288-Y310 HydrophobicContact CG2-CD2 3.78Å; V288-Y310 HydrophobicContact CG2-CG 3.85Å; V288-V311 HydrophobicContact CG1-CG2 4.13Å
289	K	77.8	Confident	70.9	Confident	120 Å²	120	69.2 Å²	69.2	52%	0.522	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-43.1	174.4	-72.1	174.1	-176.2	167.4	0	112.4	K285 D286 L287 Q292 Q293	K285-K289 WeakPolarHBondContact O-CG 3.21Å; K285-K289 PolarHBondContact O-N 3.32Å; D286-K289 WeakPolarHBondContact O-CB 3.25Å; D286-K289 PolarHBondContact O-N 2.93Å; D286-K289 IonicContact OD1-NZ 3.79Å; L287-K289 VanDerWaalsContact C-N 3.25Å; L287-K289 PolarHBondContact O-N 3.32Å; K289-Q292 PolarHBondContact O-N 3Å; K289-Q293 VanDerWaalsContact O-CG 3.31Å; K289-Q293 WeakPolarHBondContact O-CG 3.45Å; K289-Q293 PolarHBondContact O-N 3.39Å
290	V	76.4	Confident	71.4	Confident	15 Å²	15	65.5 Å²	65.5	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-64.1	-45.7	177.8	174.3	0	0	0	0	110.4	L253 L264 D286 L287 Q292 Q293 E294	L253-V290 HydrophobicContact CD1-CG1 3.93Å; L253-V290 HydrophobicContact CD1-CG2 3.9Å; L253-V290 HydrophobicContact CD2-CG2 4.2Å; L264-V290 HydrophobicContact CD2-CG1 3.78Å; D286-V290 WeakPolarHBondContact O-CG2 3.21Å; D286-V290 PolarHBondContact O-N 3.13Å; L287-V290 PolarHBondContact O-N 3.22Å; L287-V290 VanDerWaalsContact O-N 3.13Å; V290-Q292 VanDerWaalsContact C-N 3.33Å; V290-Q292 PolarHBondContact O-N 2.94Å; V290-Q293 WeakPolarHBondContact O-CB 3.16Å; V290-Q293 PolarHBondContact O-N 3.15Å; V290-E294 PolarHBondContact O-N 2.72Å
291	I	76.4	Confident	72	Confident	6 Å²	6	64.8 Å²	64.8	3%	0.031	30%	0.298	C	S	.	.	H	α-helix	trans	-61.6	-43	177.1	-66.5	166.7	0	0	0	110.9	L264 T268 L287 Q293 E294 S295 V306	L264-I291 HydrophobicContact CD1-CG1 4.41Å; T268-I291 HydrophobicContact CG2-CD1 3.44Å; T268-I291 VanDerWaalsContact CG2-CD1 3.44Å; T268-I291 HydrophobicContact CG2-CG1 4.33Å; L287-I291 HydrophobicContact CD1-CD1 3.75Å; L287-I291 HydrophobicContact CD1-CG1 4Å; L287-I291 HydrophobicContact CD2-CD1 4.42Å; L287-I291 HydrophobicContact CG-CD1 3.71Å; L287-I291 HydrophobicContact CG-CG1 4.39Å; L287-I291 WeakPolarHBondContact O-CG1 3.27Å; L287-I291 PolarHBondContact O-N 3.46Å; I291-Q293 VanDerWaalsContact C-N 3.29Å; I291-Q293 PolarHBondContact O-N 2.97Å; I291-E294 CarbonylContact O-C 3.59Å; I291-E294 PolarHBondContact O-N 3.03Å; I291-E294 VanDerWaalsContact O-N 3.11Å; I291-S295 PolarHBondContact O-N 3.28Å; I291-V306 HydrophobicContact CD1-CB 4.14Å; I291-V306 HydrophobicContact CD1-CG1 3.75Å
292	Q	75.3	Confident	72.6	Confident	107 Å²	107	59.3 Å²	59.3	50%	0.5	28%	0.277	S	S	.	.	H	α-helix	trans	-62.3	-39.2	178.1	-171.4	177.2	19.8	0	0	111.6	V288 K289 V290 E294 S295	V288-Q292 VanDerWaalsContact O-CB 3.29Å; V288-Q292 WeakPolarHBondContact O-CB 3.35Å; V288-Q292 PolarHBondContact O-N 3.01Å; K289-Q292 PolarHBondContact O-N 3Å; V290-Q292 VanDerWaalsContact C-N 3.33Å; V290-Q292 PolarHBondContact O-N 2.94Å; Q292-E294 VanDerWaalsContact C-N 3.31Å; Q292-E294 PolarHBondContact O-N 3.18Å; Q292-S295 PolarHBondContact O-OG 2.88Å
293	Q	75.3	Confident	73	Confident	117 Å²	117	53.5 Å²	53.5	55%	0.547	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-33.2	174.8	-73.4	174.6	-4.4	0	0	112.4	Q257 K289 V290 I291 Y296	Q257-Q293 VanDerWaalsContact NE2-OE1 3.16Å; K289-Q293 VanDerWaalsContact O-CG 3.31Å; K289-Q293 WeakPolarHBondContact O-CG 3.45Å; K289-Q293 PolarHBondContact O-N 3.39Å; V290-Q293 WeakPolarHBondContact O-CB 3.16Å; V290-Q293 PolarHBondContact O-N 3.15Å; I291-Q293 VanDerWaalsContact C-N 3.29Å; I291-Q293 PolarHBondContact O-N 2.97Å; Q293-Y296 WeakPolarHBondContact O-CD1 3.36Å; Q293-Y296 WeakPolarHBondContact O-CE1 3.47Å
294	E	68.9	Low	73.4	Confident	7 Å²	7	56.3 Å²	56.3	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-98	-1.7	-176.8	-68.5	-172.8	-148.3	0	0	114.8	Q257 P261 L264 V290 I291 Q292 Y296 T297 Y298	Q257-E294 WeakPolarHBondContact CA-OE1 3.32Å; Q257-E294 HydrophobicContact CG-CG 4.4Å; Q257-E294 WeakPolarHBondContact CG-OE1 3.45Å; P261-E294 WeakPolarHBondContact CA-OE2 3.48Å; L264-E294 HydrophobicContact CD1-CB 3.67Å; L264-E294 VanDerWaalsContact CD1-CD 3.42Å; L264-E294 HydrophobicContact CD1-CG 4.06Å; L264-E294 WeakPolarHBondContact CD1-OE2 3.33Å; L264-E294 WeakPolarHBondContact CG-OE2 3.31Å; V290-E294 PolarHBondContact O-N 2.72Å; I291-E294 CarbonylContact O-C 3.59Å; I291-E294 PolarHBondContact O-N 3.03Å; I291-E294 VanDerWaalsContact O-N 3.11Å; Q292-E294 VanDerWaalsContact C-N 3.31Å; Q292-E294 PolarHBondContact O-N 3.18Å; E294-Y296 PolarHBondContact O-N 3.3Å; E294-T297 PolarHBondContact O-N 3.24Å; E294-Y298 PolarHBondContact O-N 3.23Å
295	S	64.6	Low	73.9	Confident	31 Å²	31	56 Å²	56	22%	0.217	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-19.4	179.9	62.3	0	0	0	0	114.7	I291 Q292	I291-S295 PolarHBondContact O-N 3.28Å; Q292-S295 PolarHBondContact O-OG 2.88Å
296	Y	71	Confident	74.2	Confident	186 Å²	186	48.8 Å²	48.8	73%	0.729	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-26.5	177.4	76.3	-86.9	0	0	0	113.8	Q293 E294	Q293-Y296 WeakPolarHBondContact O-CD1 3.36Å; Q293-Y296 WeakPolarHBondContact O-CE1 3.47Å; E294-Y296 PolarHBondContact O-N 3.3Å
297	T	68.2	Low	74.4	Confident	77 Å²	77	47.5 Å²	47.5	47%	0.472	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	-38.1	-172.8	-51.6	0	0	0	0	112.1	P261 E294	P261-T297 HydrophobicContact CB-CG2 4.36Å; P261-T297 HydrophobicContact CG-CG2 4.01Å; E294-T297 PolarHBondContact O-N 3.24Å
298	Y	68.1	Low	74.3	Confident	30 Å²	30	48 Å²	48	12%	0.118	23%	0.225	C	C	.	.			trans	-139.2	128	-172.6	-172.9	-106.3	0	0	0	111.2	P261 H262 E294 D300	P261-Y298 HydrophobicContact CB-CG 4.38Å; H262-Y298 HydrophobicContact CB-CE1 4.4Å; H262-Y298 HydrophobicContact CB-CE2 4.14Å; E294-Y298 PolarHBondContact O-N 3.23Å; Y298-D300 HydrophobicContact CD1-CB 4.23Å; Y298-D300 HydrophobicContact CE1-CB 3.45Å; Y298-D300 VanDerWaalsContact CE1-CB 3.45Å
299	K	64.1	Low	74.3	Confident	155 Å²	155	47 Å²	47	67%	0.674	22%	0.219	S	C	*	.			trans	-123.9	115.1	177.5	-68.1	-169.6	175.9	-168.9	0	109.1
300	D	72.7	Confident	74.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.206	C	C	.	.			trans	-127.2	146.7	175.5	-174.8	55.4	0	0	0	109.2	R265 Y298 I302 T303 E304	R265-D300 WeakPolarHBondContact CD-OD2 3.48Å; R265-D300 WeakPolarHBondContact CG-OD2 3.47Å; R265-D300 IonicContact NE-OD2 2.63Å; Y298-D300 HydrophobicContact CD1-CB 4.23Å; Y298-D300 HydrophobicContact CE1-CB 3.45Å; Y298-D300 VanDerWaalsContact CE1-CB 3.45Å; D300-I302 PolarHBondContact O-N 3.43Å; D300-T303 HydrophobicContact CB-CG2 4.33Å; D300-T303 PolarHBondContact N-OG1 3.45Å; D300-T303 VanDerWaalsContact N-OG1 3.14Å; D300-T303 PolarHBondContact O-N 2.92Å; D300-T303 VanDerWaalsContact O-N 3.08Å; D300-T303 PolarHBondContact O-OG1 3.23Å; D300-E304 VanDerWaalsContact O-CB 3.27Å; D300-E304 WeakPolarHBondContact O-CB 3.38Å; D300-E304 PolarHBondContact O-N 3.21Å
301	P	75.5	Confident	74.3	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.4	-28.7	-179	-29	38.2	0	0	0	113.1	Y4 F305 K321 E324 C325 V328	Y4-P301 VanDerWaalsContact CE1-CD 3.42Å; Y4-P301 HydrophobicContact CE1-CG 3.9Å; Y4-P301 HydrophobicContact CE2-CG 4.23Å; P301-F305 WeakPolarHBondContact O-CB 3.21Å; P301-F305 PolarHBondContact O-N 3.26Å; P301-K321 HydrophobicContact CB-CD 4.48Å; P301-E324 HydrophobicContact CB-CB 4.21Å; P301-C325 PolarHBondContact O-SG 3.29Å; P301-C325 VanDerWaalsContact O-SG 3.38Å; P301-V328 HydrophobicContact CG-CG2 4.46Å
302	I	77.1	Confident	74.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-75.7	-43.7	177.7	-62.6	166.4	0	0	0	111.4	R265 T268 T269 D300 E304 F305 V306 C325 L329 F342	R265-I302 HydrophobicContact CG-CD1 3.81Å; T268-I302 WeakPolarHBondContact OG1-CG2 3.09Å; T269-I302 HydrophobicContact CG2-CD1 4.02Å; T269-I302 HydrophobicContact CG2-CG2 4.09Å; D300-I302 PolarHBondContact O-N 3.43Å; I302-E304 VanDerWaalsContact C-N 3.33Å; I302-F305 WeakPolarHBondContact O-CB 3.2Å; I302-F305 PolarHBondContact O-N 3.07Å; I302-V306 PolarHBondContact O-N 3.12Å; I302-C325 HydrophobicContact CG1-CB 4.07Å; I302-C325 VanDerWaalsContact CG1-SG 3.5Å; I302-L329 HydrophobicContact CD1-CD2 4.24Å; I302-L329 HydrophobicContact CD1-CG 4.26Å; I302-F342 HydrophobicContact CG2-CE2 4.42Å; I302-F342 HydrophobicContact CG2-CZ 4.1Å
303	T	76.4	Confident	74.2	Confident	7 Å²	7	50.2 Å²	50.2	4%	0.043	24%	0.239	C	C	.	.	H	α-helix	trans	-67.8	-39.4	176.3	59.3	0	0	0	0	110.7	L264 D300 F305 V306 E307	L264-T303 HydrophobicContact CB-CG2 4.22Å; D300-T303 HydrophobicContact CB-CG2 4.33Å; D300-T303 PolarHBondContact N-OG1 3.45Å; D300-T303 VanDerWaalsContact N-OG1 3.14Å; D300-T303 PolarHBondContact O-N 2.92Å; D300-T303 VanDerWaalsContact O-N 3.08Å; D300-T303 PolarHBondContact O-OG1 3.23Å; T303-F305 VanDerWaalsContact C-N 3.35Å; T303-V306 PolarHBondContact O-N 2.93Å; T303-E307 PolarHBondContact O-N 3.14Å
304	E	78.9	Confident	74.4	Confident	62 Å²	62	47.7 Å²	47.7	29%	0.29	23%	0.229	S	C	.	.	H	α-helix	trans	-66.6	-35.5	176	-168.9	173.5	-165	0	0	111.4	D300 I302 V306 E307 C308 K321	D300-E304 VanDerWaalsContact O-CB 3.27Å; D300-E304 WeakPolarHBondContact O-CB 3.38Å; D300-E304 PolarHBondContact O-N 3.21Å; I302-E304 VanDerWaalsContact C-N 3.33Å; E304-V306 PolarHBondContact O-N 3.03Å; E304-E307 PolarHBondContact O-N 3.38Å; E304-C308 VanDerWaalsContact O-CB 3.31Å; E304-C308 WeakPolarHBondContact O-CB 3.26Å; E304-C308 PolarHBondContact O-N 2.87Å; E304-C308 PolarHBondContact O-SG 3.48Å; E304-C308 VanDerWaalsContact O-SG 3.36Å; E304-K321 HydrophobicContact CB-CD 4.48Å; E304-K321 VanDerWaalsContact CD-CE 3.46Å; E304-K321 HydrophobicContact CG-CD 4.24Å; E304-K321 IonicContact OE1-NZ 3.93Å; E304-K321 WeakPolarHBondContact OE2-CE 3.27Å; E304-K321 IonicContact OE2-NZ 3.42Å; E304-K321 PolarHBondContact OE2-NZ 3.21Å
305	F	80.7	Confident	74.5	Confident	3 Å²	3	48.7 Å²	48.7	1%	0.013	23%	0.233	C	C	.	.	H	α-helix	trans	-58.1	-46.5	171.9	170.8	-102.1	0	0	0	112	P301 I302 T303 C308 L309 A318 K321 L322 A346 I350	P301-F305 WeakPolarHBondContact O-CB 3.21Å; P301-F305 PolarHBondContact O-N 3.26Å; I302-F305 WeakPolarHBondContact O-CB 3.2Å; I302-F305 PolarHBondContact O-N 3.07Å; T303-F305 VanDerWaalsContact C-N 3.35Å; F305-C308 PolarHBondContact O-N 2.83Å; F305-L309 HydrophobicContact CE1-CD2 4.4Å; F305-L309 HydrophobicContact CZ-CD2 4.29Å; F305-L309 WeakPolarHBondContact O-CB 3.38Å; F305-L309 PolarHBondContact O-N 2.89Å; F305-A318 HydrophobicContact CD2-CB 4Å; F305-A318 VanDerWaalsContact CD2-O 3.27Å; F305-A318 WeakPolarHBondContact CD2-O 3.48Å; F305-A318 HydrophobicContact CE2-CB 3.89Å; F305-A318 WeakPolarHBondContact CE2-O 3.37Å; F305-K321 HydrophobicContact CB-CB 4.27Å; F305-L322 HydrophobicContact CE2-CB 4.36Å; F305-L322 HydrophobicContact CE2-CD1 4.3Å; F305-L322 HydrophobicContact CZ-CD1 4.43Å; F305-A346 HydrophobicContact CE1-CB 3.96Å; F305-A346 HydrophobicContact CZ-CB 3.94Å; F305-I350 HydrophobicContact CE2-CD1 3.65Å; F305-I350 HydrophobicContact CE2-CG1 4.01Å; F305-I350 HydrophobicContact CZ-CD1 3.72Å; F305-I350 HydrophobicContact CZ-CG1 3.78Å
306	V	80	Confident	75.2	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-39.6	178.4	177.5	0	0	0	0	111.1	T268 I272 V288 I291 I302 T303 E304 L309 Y310	T268-V306 HydrophobicContact CG2-CG2 4.2Å; I272-V306 HydrophobicContact CD1-CG2 3.95Å; V288-V306 HydrophobicContact CG2-CG1 4.01Å; I291-V306 HydrophobicContact CD1-CB 4.14Å; I291-V306 HydrophobicContact CD1-CG1 3.75Å; I302-V306 PolarHBondContact O-N 3.12Å; T303-V306 PolarHBondContact O-N 2.93Å; E304-V306 PolarHBondContact O-N 3.03Å; V306-L309 PolarHBondContact O-N 3.23Å; V306-Y310 HydrophobicContact CG1-CD2 3.96Å; V306-Y310 HydrophobicContact CG1-CE2 4.49Å; V306-Y310 PolarHBondContact O-N 3.08Å
307	E	79.3	Confident	75.4	Confident	48 Å²	48	44.6 Å²	44.6	22%	0.224	23%	0.225	C	C	.	.	H	α-helix	trans	-63.2	-47.6	175.5	-171	176.3	-173.7	0	0	111.6	T303 E304 L309 V311 N312	T303-E307 PolarHBondContact O-N 3.14Å; E304-E307 PolarHBondContact O-N 3.38Å; E307-L309 VanDerWaalsContact C-N 3.29Å; E307-L309 PolarHBondContact O-N 3.42Å; E307-V311 HydrophobicContact CG-CB 4.31Å; E307-V311 HydrophobicContact CG-CG2 4.16Å; E307-V311 WeakPolarHBondContact O-CA 3.48Å; E307-V311 VanDerWaalsContact O-CB 3.24Å; E307-V311 WeakPolarHBondContact O-CB 3.22Å; E307-V311 PolarHBondContact O-N 3.28Å; E307-N312 PolarHBondContact O-N 2.78Å
308	C	76.1	Confident	75.8	Confident	11 Å²	11	41 Å²	41	7%	0.074	20%	0.202	C	C	.	.	I	π-helix	trans	-59.8	-38.5	175.1	-76.8	0	0	0	0	112.3	E304 F305 N312 F313 D314 A318	E304-C308 VanDerWaalsContact O-CB 3.31Å; E304-C308 WeakPolarHBondContact O-CB 3.26Å; E304-C308 PolarHBondContact O-N 2.87Å; E304-C308 PolarHBondContact O-SG 3.48Å; E304-C308 VanDerWaalsContact O-SG 3.36Å; F305-C308 PolarHBondContact O-N 2.83Å; C308-N312 CarbonylContact O-C 3.55Å; C308-F313 WeakPolarHBondContact O-CA 3.39Å; C308-F313 PolarHBondContact O-N 3.17Å; C308-D314 PolarHBondContact O-N 3.18Å; C308-D314 VanDerWaalsContact O-N 3.15Å; C308-A318 HydrophobicContact CB-CB 4.37Å
309	L	78.4	Confident	76.1	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.206	C	C	.	.	I	π-helix	trans	-74.5	-41.1	-177.3	-175.5	62.3	0	0	0	113.2	F305 V306 E307 F313 F315 F349 I350	F305-L309 HydrophobicContact CE1-CD2 4.4Å; F305-L309 HydrophobicContact CZ-CD2 4.29Å; F305-L309 WeakPolarHBondContact O-CB 3.38Å; F305-L309 PolarHBondContact O-N 2.89Å; V306-L309 PolarHBondContact O-N 3.23Å; E307-L309 VanDerWaalsContact C-N 3.29Å; E307-L309 PolarHBondContact O-N 3.42Å; L309-F313 WeakPolarHBondContact O-CD1 3.28Å; L309-F315 HydrophobicContact CD1-CD1 4.34Å; L309-F315 HydrophobicContact CD1-CE1 4.04Å; L309-F349 HydrophobicContact CD2-CB 4.04Å; L309-I350 HydrophobicContact CD1-CG1 4.17Å
310	Y	75.4	Confident	76.9	Confident	61 Å²	61	40.8 Å²	40.8	24%	0.239	20%	0.203	C	C	.	.	I	π-helix	trans	-105.1	-20.9	-172.2	-74.1	-70.8	0	0	0	115.5	L284 V288 V306 F313	L284-Y310 HydrophobicContact CD2-CE2 3.71Å; V288-Y310 HydrophobicContact CG2-CD2 3.78Å; V288-Y310 HydrophobicContact CG2-CG 3.85Å; V306-Y310 HydrophobicContact CG1-CD2 3.96Å; V306-Y310 HydrophobicContact CG1-CE2 4.49Å; V306-Y310 PolarHBondContact O-N 3.08Å; Y310-F313 VanDerWaalsContact O-CE2 3.26Å; Y310-F313 WeakPolarHBondContact O-CE2 3.38Å
311	V	77.9	Confident	77.2	Confident	57 Å²	57	42.5 Å²	42.5	35%	0.345	21%	0.21	S	C	.	.	I	π-helix	trans	-102.2	-54.2	178.8	-175.5	0	0	0	0	110.3	V288 E307	V288-V311 HydrophobicContact CG1-CG2 4.13Å; E307-V311 HydrophobicContact CG-CB 4.31Å; E307-V311 HydrophobicContact CG-CG2 4.16Å; E307-V311 WeakPolarHBondContact O-CA 3.48Å; E307-V311 VanDerWaalsContact O-CB 3.24Å; E307-V311 WeakPolarHBondContact O-CB 3.22Å; E307-V311 PolarHBondContact O-N 3.28Å
312	N	74.7	Confident	77.4	Confident	99 Å²	99	43.3 Å²	43.3	53%	0.529	21%	0.214	S	C	.	.	I	π-helix	trans	-88.1	-21.1	-174.1	-60.7	-32.1	0	0	0	113.3	E307 C308 D314	E307-N312 PolarHBondContact O-N 2.78Å; C308-N312 CarbonylContact O-C 3.55Å; N312-D314 PolarHBondContact O-N 3.24Å
313	F	74.9	Confident	77.5	Confident	99 Å²	99	49.7 Å²	49.7	43%	0.434	24%	0.238	S	C	.	.			trans	50.5	34.6	-172.7	-66.7	-86.4	0	0	0	113.3	C308 L309 Y310 T353 I357	C308-F313 WeakPolarHBondContact O-CA 3.39Å; C308-F313 PolarHBondContact O-N 3.17Å; L309-F313 WeakPolarHBondContact O-CD1 3.28Å; Y310-F313 VanDerWaalsContact O-CE2 3.26Å; Y310-F313 WeakPolarHBondContact O-CE2 3.38Å; F313-T353 HydrophobicContact CD1-CG2 3.86Å; F313-T353 HydrophobicContact CE1-CG2 3.78Å; F313-I357 HydrophobicContact CD1-CD1 4.06Å
314	D	78.8	Confident	77.6	Confident	63 Å²	63	53 Å²	53	34%	0.337	25%	0.254	S	S	.	.			trans	-95.5	104.2	177.5	-176.9	-5	0	0	0	110.5	C308 N312 D316 S317 A318	C308-D314 PolarHBondContact O-N 3.18Å; C308-D314 VanDerWaalsContact O-N 3.15Å; N312-D314 PolarHBondContact O-N 3.24Å; D314-D316 PolarHBondContact OD1-N 3.26Å; D314-S317 PolarHBondContact OD1-N 3.32Å; D314-S317 VanDerWaalsContact OD1-N 3.17Å; D314-S317 WeakPolarHBondContact OD2-CB 3.44Å; D314-S317 PolarHBondContact OD2-OG 3.37Å; D314-A318 WeakPolarHBondContact O-CB 3.37Å; D314-A318 PolarHBondContact O-N 3.26Å
315	F	72.4	Confident	77.5	Confident	28 Å²	28	50.1 Å²	50.1	12%	0.123	24%	0.24	C	C	.	.	H	α-helix	trans	-77.2	-26.3	-177	-58.2	-72.2	0	0	0	113.8	L309 Q319 I350 T353 F354 I357	L309-F315 HydrophobicContact CD1-CD1 4.34Å; L309-F315 HydrophobicContact CD1-CE1 4.04Å; F315-Q319 WeakPolarHBondContact O-CB 3.43Å; F315-Q319 PolarHBondContact O-N 3.12Å; F315-Q319 VanDerWaalsContact O-N 3.12Å; F315-I350 HydrophobicContact CD1-CG2 4.01Å; F315-T353 HydrophobicContact CE1-CG2 4.14Å; F315-T353 HydrophobicContact CZ-CG2 4.08Å; F315-F354 HydrophobicContact CD1-CD2 4.3Å; F315-F354 AromaticContact CD2-CD2 3.82Å; F315-F354 HydrophobicContact CD2-CD2 3.82Å; F315-F354 HydrophobicContact CD2-CE2 4.24Å; F315-F354 HydrophobicContact CE1-CB 4.29Å; F315-F354 HydrophobicContact CE1-CD2 4.35Å; F315-F354 AromaticContact CE2-CD2 3.9Å; F315-F354 HydrophobicContact CE2-CD2 3.9Å; F315-F354 HydrophobicContact CG-CD2 4.03Å; F315-F354 HydrophobicContact CZ-CB 4.42Å; F315-F354 HydrophobicContact CZ-CD2 4.16Å; F315-I357 HydrophobicContact CE2-CD1 4.3Å; F315-I357 HydrophobicContact CZ-CD1 3.94Å
316	D	77.9	Confident	77.3	Confident	90 Å²	90	54.1 Å²	54.1	48%	0.481	26%	0.259	S	S	.	.	H	α-helix	trans	-76.1	-42.7	179.6	-75	-17.9	0	0	0	110.2	D314 Q319 K320 K369	D314-D316 PolarHBondContact OD1-N 3.26Å; D316-Q319 PolarHBondContact O-N 3.12Å; D316-K320 PolarHBondContact O-N 3.45Å; D316-K369 IonicContact OD1-NZ 3.17Å; D316-K369 PolarHBondContact OD1-NZ 2.94Å
317	S	76.4	Confident	77	Confident	42 Å²	42	56.7 Å²	56.7	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-66.9	-42.9	172.9	-63.3	0	0	0	0	111.5	D314 Q319 K320 K321	D314-S317 PolarHBondContact OD1-N 3.32Å; D314-S317 VanDerWaalsContact OD1-N 3.17Å; D314-S317 WeakPolarHBondContact OD2-CB 3.44Å; D314-S317 PolarHBondContact OD2-OG 3.37Å; S317-Q319 PolarHBondContact O-N 3.49Å; S317-K320 PolarHBondContact O-N 3.43Å; S317-K321 WeakPolarHBondContact O-CB 3.5Å; S317-K321 VanDerWaalsContact O-CG 3.25Å; S317-K321 WeakPolarHBondContact O-CG 3.27Å; S317-K321 PolarHBondContact O-N 3.21Å
318	A	76.3	Confident	76.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.2	-36.7	176.2	0	0	0	0	0	112.4	F305 C308 D314 K321 L322	F305-A318 HydrophobicContact CD2-CB 4Å; F305-A318 VanDerWaalsContact CD2-O 3.27Å; F305-A318 WeakPolarHBondContact CD2-O 3.48Å; F305-A318 HydrophobicContact CE2-CB 3.89Å; F305-A318 WeakPolarHBondContact CE2-O 3.37Å; C308-A318 HydrophobicContact CB-CB 4.37Å; D314-A318 WeakPolarHBondContact O-CB 3.37Å; D314-A318 PolarHBondContact O-N 3.26Å; A318-K321 PolarHBondContact O-N 3.13Å; A318-L322 WeakPolarHBondContact O-CB 3.49Å; A318-L322 PolarHBondContact O-N 3Å
319	Q	73.8	Confident	76.6	Confident	40 Å²	40	54.3 Å²	54.3	19%	0.187	27%	0.266	C	S	.	.	H	α-helix	trans	-72.4	-39.9	178.8	-170.5	-176.1	-15.4	0	0	113.1	F315 D316 S317 K321 L322 R323 K369	F315-Q319 WeakPolarHBondContact O-CB 3.43Å; F315-Q319 PolarHBondContact O-N 3.12Å; F315-Q319 VanDerWaalsContact O-N 3.12Å; D316-Q319 PolarHBondContact O-N 3.12Å; S317-Q319 PolarHBondContact O-N 3.49Å; Q319-K321 VanDerWaalsContact C-N 3.3Å; Q319-L322 PolarHBondContact O-N 2.98Å; Q319-R323 PolarHBondContact O-N 2.84Å; Q319-K369 VanDerWaalsContact NE2-C 3.35Å; Q319-K369 PolarHBondContact NE2-O 3.44Å
320	K	81.2	Confident	76.3	Confident	142 Å²	142	57 Å²	57	62%	0.617	28%	0.282	S	S	*	.	H	α-helix	trans	-60.7	-44.4	171.6	-71.8	177	-177.7	173.9	0	110.5	D316 S317 L322 R323 E324	D316-K320 PolarHBondContact O-N 3.45Å; S317-K320 PolarHBondContact O-N 3.43Å; K320-L322 VanDerWaalsContact C-N 3.31Å; K320-L322 PolarHBondContact O-N 3.36Å; K320-R323 WeakPolarHBondContact O-CB 3.42Å; K320-R323 PolarHBondContact O-N 2.97Å; K320-R323 VanDerWaalsContact O-N 3.15Å; K320-E324 PolarHBondContact O-N 2.73Å; K320-E324 VanDerWaalsContact O-N 3.08Å
321	K	80.1	Confident	75.8	Confident	36 Å²	36	55.6 Å²	55.6	16%	0.157	28%	0.279	C	S	.	.	H	α-helix	trans	-62.6	-34.9	176.2	-67.8	-74.4	162.5	-174.1	0	112.5	P301 E304 F305 S317 A318 Q319 R323 E324 C325	P301-K321 HydrophobicContact CB-CD 4.48Å; E304-K321 HydrophobicContact CB-CD 4.48Å; E304-K321 VanDerWaalsContact CD-CE 3.46Å; E304-K321 HydrophobicContact CG-CD 4.24Å; E304-K321 IonicContact OE1-NZ 3.93Å; E304-K321 WeakPolarHBondContact OE2-CE 3.27Å; E304-K321 IonicContact OE2-NZ 3.42Å; E304-K321 PolarHBondContact OE2-NZ 3.21Å; F305-K321 HydrophobicContact CB-CB 4.27Å; S317-K321 WeakPolarHBondContact O-CB 3.5Å; S317-K321 VanDerWaalsContact O-CG 3.25Å; S317-K321 WeakPolarHBondContact O-CG 3.27Å; S317-K321 PolarHBondContact O-N 3.21Å; A318-K321 PolarHBondContact O-N 3.13Å; Q319-K321 VanDerWaalsContact C-N 3.3Å; K321-R323 PolarHBondContact O-N 2.89Å; K321-E324 WeakPolarHBondContact CD-OE2 3.35Å; K321-E324 WeakPolarHBondContact CE-OE2 3.23Å; K321-E324 IonicContact NZ-OE2 2.64Å; K321-E324 PolarHBondContact NZ-OE2 3.49Å; K321-E324 PolarHBondContact O-N 2.88Å; K321-C325 WeakPolarHBondContact O-CB 3.46Å; K321-C325 PolarHBondContact O-N 3.39Å; K321-C325 PolarHBondContact O-SG 2.96Å
322	L	78.3	Confident	75.4	Confident	16 Å²	16	53.4 Å²	53.4	8%	0.084	27%	0.265	C	S	.	.	H	α-helix	trans	-63.3	-39.9	174.4	-164.4	156.7	0	0	0	112	F305 A318 Q319 K320 C325 E326 A346 R347 I350	F305-L322 HydrophobicContact CE2-CB 4.36Å; F305-L322 HydrophobicContact CE2-CD1 4.3Å; F305-L322 HydrophobicContact CZ-CD1 4.43Å; A318-L322 WeakPolarHBondContact O-CB 3.49Å; A318-L322 PolarHBondContact O-N 3Å; Q319-L322 PolarHBondContact O-N 2.98Å; K320-L322 VanDerWaalsContact C-N 3.31Å; K320-L322 PolarHBondContact O-N 3.36Å; L322-C325 WeakPolarHBondContact O-CB 3.48Å; L322-C325 PolarHBondContact O-N 2.96Å; L322-E326 PolarHBondContact O-N 3.42Å; L322-A346 HydrophobicContact CD1-CB 3.98Å; L322-R347 HydrophobicContact CD1-CG 4.44Å; L322-I350 HydrophobicContact CD1-CD1 3.81Å
323	R	79.8	Confident	75	Confident	134 Å²	134	52.4 Å²	52.4	51%	0.506	26%	0.256	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.2	-66.2	-177.1	178.7	-176.2	-1.2	112	Q319 K320 K321 C325 E326 S327 N371	Q319-R323 PolarHBondContact O-N 2.84Å; K320-R323 WeakPolarHBondContact O-CB 3.42Å; K320-R323 PolarHBondContact O-N 2.97Å; K320-R323 VanDerWaalsContact O-N 3.15Å; K321-R323 PolarHBondContact O-N 2.89Å; R323-C325 VanDerWaalsContact C-N 3.34Å; R323-E326 PolarHBondContact O-N 3.42Å; R323-S327 PolarHBondContact O-N 2.96Å; R323-N371 PolarHBondContact NH2-OD1 2.9Å
324	E	79.1	Confident	74.4	Confident	78 Å²	78	48.3 Å²	48.3	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-63	-42.1	172.5	-69.4	169.3	-159	0	0	110.9	P301 K320 K321 E326 S327 V328	P301-E324 HydrophobicContact CB-CB 4.21Å; K320-E324 PolarHBondContact O-N 2.73Å; K320-E324 VanDerWaalsContact O-N 3.08Å; K321-E324 WeakPolarHBondContact CD-OE2 3.35Å; K321-E324 WeakPolarHBondContact CE-OE2 3.23Å; K321-E324 IonicContact NZ-OE2 2.64Å; K321-E324 PolarHBondContact NZ-OE2 3.49Å; K321-E324 PolarHBondContact O-N 2.88Å; E324-E326 VanDerWaalsContact C-N 3.31Å; E324-E326 PolarHBondContact O-N 3.46Å; E324-S327 PolarHBondContact O-N 2.98Å; E324-S327 PolarHBondContact O-OG 3Å; E324-V328 WeakPolarHBondContact O-CG2 3.36Å; E324-V328 PolarHBondContact O-N 3.07Å; E324-V328 VanDerWaalsContact O-N 3.11Å
325	C	76.3	Confident	73.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-59.4	-40.4	176	-68.5	0	0	0	0	111.8	P301 I302 K321 L322 R323 S327 V328 L329	P301-C325 PolarHBondContact O-SG 3.29Å; P301-C325 VanDerWaalsContact O-SG 3.38Å; I302-C325 HydrophobicContact CG1-CB 4.07Å; I302-C325 VanDerWaalsContact CG1-SG 3.5Å; K321-C325 WeakPolarHBondContact O-CB 3.46Å; K321-C325 PolarHBondContact O-N 3.39Å; K321-C325 PolarHBondContact O-SG 2.96Å; L322-C325 WeakPolarHBondContact O-CB 3.48Å; L322-C325 PolarHBondContact O-N 2.96Å; R323-C325 VanDerWaalsContact C-N 3.34Å; C325-S327 PolarHBondContact O-N 2.85Å; C325-V328 CarbonylContact O-C 3.58Å; C325-V328 PolarHBondContact O-N 3.47Å; C325-V328 VanDerWaalsContact O-N 3.16Å; C325-L329 HydrophobicContact CB-CD1 4.15Å; C325-L329 VanDerWaalsContact O-CB 3.25Å; C325-L329 WeakPolarHBondContact O-CB 3.32Å; C325-L329 VanDerWaalsContact O-CD1 3.28Å; C325-L329 WeakPolarHBondContact O-CD1 3.43Å; C325-L329 WeakPolarHBondContact O-CG 3.25Å; C325-L329 PolarHBondContact O-N 3.47Å
326	E	75.9	Confident	73.5	Confident	86 Å²	86	47.7 Å²	47.7	40%	0.402	24%	0.238	S	C	.	.	H	α-helix	trans	-58.5	-48.1	178	-174.8	173.7	-171.5	0	0	111	L322 R323 E324 V328 L329 V330 I343	L322-E326 PolarHBondContact O-N 3.42Å; R323-E326 PolarHBondContact O-N 3.42Å; E324-E326 VanDerWaalsContact C-N 3.31Å; E324-E326 PolarHBondContact O-N 3.46Å; E326-V328 VanDerWaalsContact C-N 3.26Å; E326-V328 PolarHBondContact O-N 3.2Å; E326-L329 PolarHBondContact O-N 3.37Å; E326-V330 VanDerWaalsContact O-CG2 3.26Å; E326-V330 WeakPolarHBondContact O-CG2 3.4Å; E326-V330 PolarHBondContact O-N 2.85Å; E326-V330 VanDerWaalsContact O-N 3.08Å; E326-I343 HydrophobicContact CG-CD1 4.09Å
327	S	74.3	Confident	73	Confident	58 Å²	58	47 Å²	47	41%	0.406	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-33.8	176.4	72.2	0	0	0	0	113.3	R323 E324 C325 N331	R323-S327 PolarHBondContact O-N 2.96Å; E324-S327 PolarHBondContact O-N 2.98Å; E324-S327 PolarHBondContact O-OG 3Å; C325-S327 PolarHBondContact O-N 2.85Å; S327-N331 PolarHBondContact O-ND2 2.7Å; S327-N331 VanDerWaalsContact O-ND2 3.09Å
328	V	75	Confident	72.5	Confident	9 Å²	9	45.1 Å²	45.1	6%	0.055	23%	0.232	C	C	.	.	H	α-helix	trans	-78.8	-34.9	-179.3	168.1	0	0	0	0	111.5	Y4 R265 P301 E324 C325 E326 N331	Y4-V328 HydrophobicContact CD2-CG2 3.68Å; Y4-V328 HydrophobicContact CE2-CG2 4.1Å; Y4-V328 HydrophobicContact CG-CG2 4.18Å; R265-V328 PolarHBondContact NH2-O 2.88Å; P301-V328 HydrophobicContact CG-CG2 4.46Å; E324-V328 WeakPolarHBondContact O-CG2 3.36Å; E324-V328 PolarHBondContact O-N 3.07Å; E324-V328 VanDerWaalsContact O-N 3.11Å; C325-V328 CarbonylContact O-C 3.58Å; C325-V328 PolarHBondContact O-N 3.47Å; C325-V328 VanDerWaalsContact O-N 3.16Å; E326-V328 VanDerWaalsContact C-N 3.26Å; E326-V328 PolarHBondContact O-N 3.2Å; V328-N331 PolarHBondContact O-N 3.4Å
329	L	72.6	Confident	72.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69.9	-38.2	176.6	-78.1	156.4	0	0	0	112.3	T269 I302 C325 E326 N331 D332 L335 L339 F342	T269-L329 HydrophobicContact CG2-CD2 4.19Å; I302-L329 HydrophobicContact CD1-CD2 4.24Å; I302-L329 HydrophobicContact CD1-CG 4.26Å; C325-L329 HydrophobicContact CB-CD1 4.15Å; C325-L329 VanDerWaalsContact O-CB 3.25Å; C325-L329 WeakPolarHBondContact O-CB 3.32Å; C325-L329 VanDerWaalsContact O-CD1 3.28Å; C325-L329 WeakPolarHBondContact O-CD1 3.43Å; C325-L329 WeakPolarHBondContact O-CG 3.25Å; C325-L329 PolarHBondContact O-N 3.47Å; E326-L329 PolarHBondContact O-N 3.37Å; L329-N331 PolarHBondContact O-N 3.49Å; L329-D332 PolarHBondContact O-N 3.34Å; L329-L335 HydrophobicContact CD2-CB 3.74Å; L329-L335 HydrophobicContact CD2-CD1 3.81Å; L329-L335 HydrophobicContact CD2-CG 4.23Å; L329-L339 HydrophobicContact CB-CD1 4.13Å; L329-L339 HydrophobicContact CB-CG 4.31Å; L329-F342 HydrophobicContact CD1-CD1 3.53Å; L329-F342 HydrophobicContact CD1-CE1 3.82Å; L329-F342 HydrophobicContact CD1-CG 4.33Å
330	V	70.5	Confident	72.3	Confident	57 Å²	57	52.1 Å²	52.1	35%	0.345	27%	0.266	S	S	.	.	H	α-helix	trans	-61.5	-28.4	177.5	171	0	0	0	0	111.7	K29 E326 L339	K29-V330 WeakPolarHBondContact CE-O 3.39Å; K29-V330 PolarHBondContact NZ-O 2.84Å; E326-V330 VanDerWaalsContact O-CG2 3.26Å; E326-V330 WeakPolarHBondContact O-CG2 3.4Å; E326-V330 PolarHBondContact O-N 2.85Å; E326-V330 VanDerWaalsContact O-N 3.08Å; V330-L339 HydrophobicContact CB-CD1 4.42Å; V330-L339 HydrophobicContact CG2-CD1 3.41Å; V330-L339 VanDerWaalsContact CG2-CD1 3.41Å
331	N	66.2	Low	72.1	Confident	33 Å²	33	48.2 Å²	48.2	18%	0.176	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.2	-174.4	-64	-19.2	0	0	0	113.8	F25 I31 S327 V328 L329	F25-N331 WeakPolarHBondContact CE1-O 3.18Å; I31-N331 HydrophobicContact CD1-CB 3.96Å; S327-N331 PolarHBondContact O-ND2 2.7Å; S327-N331 VanDerWaalsContact O-ND2 3.09Å; V328-N331 PolarHBondContact O-N 3.4Å; L329-N331 PolarHBondContact O-N 3.49Å
332	D	68.8	Low	72.1	Confident	11 Å²	11	46.6 Å²	46.6	6%	0.059	24%	0.244	C	C	.	.			trans	-97.4	126.7	-178.6	-99.7	47	0	0	0	112	R265 Y266 L329 F334 L335 V336	R265-D332 IonicContact CZ-OD1 3.63Å; R265-D332 IonicContact CZ-OD2 3.51Å; R265-D332 IonicContact NE-OD2 2.81Å; R265-D332 IonicContact NH1-OD1 3.94Å; R265-D332 PolarHBondContact NH1-OD1 3.5Å; R265-D332 IonicContact NH1-OD2 3.47Å; R265-D332 PolarHBondContact NH1-OD2 3.25Å; R265-D332 VanDerWaalsContact NH1-OD2 3.08Å; R265-D332 IonicContact NH2-OD1 3.88Å; R265-D332 PolarHBondContact NH2-OD1 3.24Å; R265-D332 IonicContact NH2-OD2 2.73Å; R265-D332 PolarHBondContact NH2-OD2 2.9Å; Y266-D332 WeakPolarHBondContact CE1-OD2 3.31Å; Y266-D332 PolarHBondContact OH-OD2 3.39Å; L329-D332 PolarHBondContact O-N 3.34Å; D332-F334 VanDerWaalsContact C-N 3.31Å; D332-F334 PolarHBondContact O-N 2.99Å; D332-L335 HydrophobicContact CB-CB 3.86Å; D332-L335 HydrophobicContact CB-CD1 3.87Å; D332-L335 HydrophobicContact CB-CG 4.03Å; D332-L335 PolarHBondContact O-N 3.4Å; D332-L335 WeakPolarHBondContact OD2-CD1 3.17Å; D332-V336 WeakPolarHBondContact O-CG2 3.21Å; D332-V336 PolarHBondContact O-N 3.49Å
333	F	65.7	Low	72.1	Confident	77 Å²	77	46.4 Å²	46.4	34%	0.338	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-43.2	-179.6	-178	-104.4	0	0	0	113.6	P21 L22 F25	P21-F333 HydrophobicContact CB-CE2 4.5Å; P21-F333 HydrophobicContact CB-CZ 4.03Å; L22-F333 HydrophobicContact CD2-CB 3.73Å; L22-F333 HydrophobicContact CD2-CD1 3.46Å; L22-F333 VanDerWaalsContact CD2-CD1 3.46Å; L22-F333 HydrophobicContact CD2-CD2 4.37Å; L22-F333 HydrophobicContact CD2-CE1 4.11Å; L22-F333 HydrophobicContact CD2-CG 3.6Å; F25-F333 HydrophobicContact CB-CD2 3.45Å; F25-F333 VanDerWaalsContact CB-CD2 3.45Å; F25-F333 HydrophobicContact CB-CE2 3.93Å; F25-F333 HydrophobicContact CB-CG 4.49Å; F25-F333 HydrophobicContact CD1-CB 3.94Å; F25-F333 HydrophobicContact CD1-CD2 4.02Å; F25-F333 AromaticContact CD2-CD2 3.73Å; F25-F333 HydrophobicContact CD2-CD2 3.73Å; F25-F333 HydrophobicContact CD2-CE2 4.38Å; F25-F333 HydrophobicContact CE1-CB 4.15Å; F25-F333 HydrophobicContact CE2-CD2 4.42Å; F25-F333 HydrophobicContact CG-CB 4.29Å; F25-F333 AromaticContact CG-CD2 3.48Å; F25-F333 HydrophobicContact CG-CD2 3.48Å; F25-F333 VanDerWaalsContact CG-CD2 3.48Å; F25-F333 HydrophobicContact CG-CE2 4.3Å; F25-F333 HydrophobicContact CG-CG 4.37Å
334	F	63.6	Low	72	Confident	13 Å²	13	45.5 Å²	45.5	6%	0.057	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-20.8	-176.6	-60.8	-69.3	0	0	0	114.3	L22 L229 F230 F233 Y266 D332	L22-F334 HydrophobicContact CD2-CE2 4.08Å; L22-F334 HydrophobicContact CD2-CZ 4.09Å; L229-F334 HydrophobicContact CD2-CD2 4.31Å; L229-F334 HydrophobicContact CD2-CE2 4.49Å; F230-F334 HydrophobicContact CB-CE1 4.23Å; F230-F334 AromaticContact CD1-CE1 3.46Å; F230-F334 HydrophobicContact CD1-CE1 3.46Å; F230-F334 VanDerWaalsContact CD1-CE1 3.46Å; F230-F334 AromaticContact CD1-CZ 3.54Å; F230-F334 HydrophobicContact CD1-CZ 3.54Å; F230-F334 HydrophobicContact CD2-CE1 4.1Å; F230-F334 AromaticContact CD2-CZ 3.77Å; F230-F334 HydrophobicContact CD2-CZ 3.77Å; F230-F334 AromaticContact CE1-CE1 3.8Å; F230-F334 HydrophobicContact CE1-CE1 3.8Å; F230-F334 AromaticContact CE1-CZ 3.4Å; F230-F334 HydrophobicContact CE1-CZ 3.4Å; F230-F334 VanDerWaalsContact CE1-CZ 3.4Å; F230-F334 HydrophobicContact CE2-CE1 4.33Å; F230-F334 HydrophobicContact CE2-CE2 4.38Å; F230-F334 AromaticContact CE2-CZ 3.57Å; F230-F334 HydrophobicContact CE2-CZ 3.57Å; F230-F334 AromaticContact CG-CE1 3.65Å; F230-F334 HydrophobicContact CG-CE1 3.65Å; F230-F334 AromaticContact CG-CZ 3.75Å; F230-F334 HydrophobicContact CG-CZ 3.75Å; F230-F334 HydrophobicContact CZ-CE1 4.24Å; F230-F334 HydrophobicContact CZ-CE2 4.35Å; F230-F334 AromaticContact CZ-CZ 3.44Å; F230-F334 HydrophobicContact CZ-CZ 3.44Å; F230-F334 VanDerWaalsContact CZ-CZ 3.44Å; F233-F334 HydrophobicContact CB-CB 4.3Å; F233-F334 HydrophobicContact CB-CD1 4.37Å; F233-F334 HydrophobicContact CD1-CB 4.21Å; F233-F334 WeakPolarHBondContact CD1-O 3.37Å; F233-F334 HydrophobicContact CG-CB 4.06Å; Y266-F334 HydrophobicContact CE1-CB 4.47Å; Y266-F334 HydrophobicContact CE1-CD2 4.34Å; D332-F334 VanDerWaalsContact C-N 3.31Å; D332-F334 PolarHBondContact O-N 2.99Å
335	L	65.8	Low	71.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-4.8	-166.7	-62.9	174.3	0	0	0	113.5	F233 Y266 T269 L329 D332 A337 C338 L339	F233-L335 HydrophobicContact CD1-CD2 4.22Å; F233-L335 HydrophobicContact CE1-CD2 3.43Å; F233-L335 VanDerWaalsContact CE1-CD2 3.43Å; F233-L335 HydrophobicContact CZ-CD2 3.99Å; Y266-L335 HydrophobicContact CD1-CD1 4.07Å; Y266-L335 HydrophobicContact CD1-CD2 4.1Å; Y266-L335 HydrophobicContact CD1-CG 4.15Å; Y266-L335 HydrophobicContact CE1-CD1 3.85Å; Y266-L335 HydrophobicContact CE1-CD2 4.49Å; Y266-L335 HydrophobicContact CE1-CG 4.03Å; T269-L335 HydrophobicContact CG2-CD1 4.34Å; T269-L335 HydrophobicContact CG2-CD2 4.13Å; T269-L335 WeakPolarHBondContact OG1-CD2 3.33Å; L329-L335 HydrophobicContact CD2-CB 3.74Å; L329-L335 HydrophobicContact CD2-CD1 3.81Å; L329-L335 HydrophobicContact CD2-CG 4.23Å; D332-L335 HydrophobicContact CB-CB 3.86Å; D332-L335 HydrophobicContact CB-CD1 3.87Å; D332-L335 HydrophobicContact CB-CG 4.03Å; D332-L335 PolarHBondContact O-N 3.4Å; D332-L335 WeakPolarHBondContact OD2-CD1 3.17Å; L335-A337 VanDerWaalsContact C-N 3.31Å; L335-A337 PolarHBondContact O-N 2.95Å; L335-C338 PolarHBondContact O-N 2.78Å; L335-L339 PolarHBondContact O-N 3.03Å
336	V	65.3	Low	71.9	Confident	78 Å²	78	42.8 Å²	42.8	47%	0.473	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-55.5	-45.5	177.5	-176.3	0	0	0	0	111.6	F25 D332 C338	F25-V336 HydrophobicContact CE2-CG2 4.19Å; F25-V336 HydrophobicContact CZ-CG2 3.97Å; D332-V336 WeakPolarHBondContact O-CG2 3.21Å; D332-V336 PolarHBondContact O-N 3.49Å; V336-C338 PolarHBondContact O-N 3.32Å
337	A	67.4	Low	71.9	Confident	77 Å²	77	42 Å²	42	64%	0.636	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-71.6	-15.6	179.7	0	0	0	0	0	113.8	L335	L335-A337 VanDerWaalsContact C-N 3.31Å; L335-A337 PolarHBondContact O-N 2.95Å
338	C	66.2	Low	72	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-102.8	-2.8	-176	-71.4	0	0	0	0	112.9	R239 T273 L335 V336 F342	R239-C338 PolarHBondContact NH2-SG 3.08Å; R239-C338 VanDerWaalsContact NH2-SG 3.42Å; T273-C338 HydrophobicContact CG2-CB 4.21Å; L335-C338 PolarHBondContact O-N 2.78Å; V336-C338 PolarHBondContact O-N 3.32Å; C338-F342 WeakPolarHBondContact O-CB 3.14Å; C338-F342 PolarHBondContact O-N 3.41Å
339	L	71.9	Confident	72	Confident	30 Å²	30	41.6 Å²	41.6	16%	0.157	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-54.6	-171.3	-173.6	156.8	0	0	0	112.1	L329 V330 L335 F342 I343	L329-L339 HydrophobicContact CB-CD1 4.13Å; L329-L339 HydrophobicContact CB-CG 4.31Å; V330-L339 HydrophobicContact CB-CD1 4.42Å; V330-L339 HydrophobicContact CG2-CD1 3.41Å; V330-L339 VanDerWaalsContact CG2-CD1 3.41Å; L335-L339 PolarHBondContact O-N 3.03Å; L339-F342 PolarHBondContact O-N 3.47Å; L339-I343 HydrophobicContact CD2-CD1 3.48Å; L339-I343 VanDerWaalsContact CD2-CD1 3.48Å; L339-I343 HydrophobicContact CD2-CG1 4.37Å; L339-I343 HydrophobicContact CG-CD1 4.24Å; L339-I343 WeakPolarHBondContact O-CG1 3.31Å; L339-I343 PolarHBondContact O-N 3.35Å
340	E	74.7	Confident	72.1	Confident	157 Å²	157	42.4 Å²	42.4	73%	0.734	22%	0.223	S	C	*	.	H	α-helix	trans	-64.8	-49.1	-176.8	-65.8	-176.1	171.6	0	0	111.1	F342 I343 E344	E340-F342 VanDerWaalsContact C-N 3.26Å; E340-F342 PolarHBondContact O-N 2.86Å; E340-I343 PolarHBondContact O-N 3.21Å; E340-E344 PolarHBondContact O-N 3.39Å
341	D	76.6	Confident	72.2	Confident	60 Å²	60	40.5 Å²	40.5	32%	0.321	21%	0.21	S	C	.	.	H	α-helix	trans	-54.4	-43.5	174.5	-80.9	-10	0	0	0	111.3	R239 T273 N345	R239-D341 IonicContact NH1-OD2 3.48Å; R239-D341 PolarHBondContact NH1-OD2 3.3Å; T273-D341 HydrophobicContact CG2-CB 4.06Å; D341-N345 VanDerWaalsContact O-CB 3.27Å; D341-N345 WeakPolarHBondContact O-CB 3.33Å; D341-N345 VanDerWaalsContact O-CG 3.31Å; D341-N345 PolarHBondContact O-N 3.39Å; D341-N345 PolarHBondContact O-ND2 3.44Å
342	F	79.4	Confident	72.6	Confident	2 Å²	2	39.5 Å²	39.5	1%	0.009	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-46	-179.1	178.2	-93.7	0	0	0	111.5	T269 I272 T273 I302 L329 C338 L339 E340 E344 N345 A346	T269-F342 HydrophobicContact CG2-CD2 3.98Å; T269-F342 HydrophobicContact CG2-CE2 3.85Å; T269-F342 HydrophobicContact CG2-CZ 4.5Å; I272-F342 HydrophobicContact CB-CD2 3.98Å; I272-F342 HydrophobicContact CB-CE2 3.95Å; I272-F342 HydrophobicContact CD1-CD2 4.45Å; I272-F342 HydrophobicContact CD1-CE2 3.56Å; I272-F342 HydrophobicContact CD1-CZ 4.19Å; I272-F342 HydrophobicContact CG1-CE2 4.34Å; I272-F342 HydrophobicContact CG2-CD2 3.66Å; I272-F342 HydrophobicContact CG2-CE2 3.82Å; T273-F342 HydrophobicContact CG2-CB 3.96Å; I302-F342 HydrophobicContact CG2-CE2 4.42Å; I302-F342 HydrophobicContact CG2-CZ 4.1Å; L329-F342 HydrophobicContact CD1-CD1 3.53Å; L329-F342 HydrophobicContact CD1-CE1 3.82Å; L329-F342 HydrophobicContact CD1-CG 4.33Å; C338-F342 WeakPolarHBondContact O-CB 3.14Å; C338-F342 PolarHBondContact O-N 3.41Å; L339-F342 PolarHBondContact O-N 3.47Å; E340-F342 VanDerWaalsContact C-N 3.26Å; E340-F342 PolarHBondContact O-N 2.86Å; F342-E344 PolarHBondContact O-N 3.04Å; F342-N345 PolarHBondContact O-N 2.79Å; F342-A346 HydrophobicContact CE1-CB 4.35Å; F342-A346 WeakPolarHBondContact O-CB 3.21Å; F342-A346 PolarHBondContact O-N 2.96Å
343	I	79.2	Confident	73	Confident	13 Å²	13	39.5 Å²	39.5	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-45.6	179.9	-70.4	176.9	0	0	0	110.5	E326 L339 E340 A346 R347	E326-I343 HydrophobicContact CG-CD1 4.09Å; L339-I343 HydrophobicContact CD2-CD1 3.48Å; L339-I343 VanDerWaalsContact CD2-CD1 3.48Å; L339-I343 HydrophobicContact CD2-CG1 4.37Å; L339-I343 HydrophobicContact CG-CD1 4.24Å; L339-I343 WeakPolarHBondContact O-CG1 3.31Å; L339-I343 PolarHBondContact O-N 3.35Å; E340-I343 PolarHBondContact O-N 3.21Å; I343-A346 PolarHBondContact O-N 2.6Å; I343-R347 HydrophobicContact CG2-CG 4.46Å; I343-R347 VanDerWaalsContact CG2-CZ 3.45Å; I343-R347 VanDerWaalsContact CG2-NE 3.34Å; I343-R347 WeakPolarHBondContact O-CB 2.98Å; I343-R347 WeakPolarHBondContact O-CD 3.05Å; I343-R347 WeakPolarHBondContact O-CG 3.4Å; I343-R347 PolarHBondContact O-N 2.61Å
344	E	76.6	Confident	73.4	Confident	114 Å²	114	37.9 Å²	37.9	53%	0.533	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-48	177.2	-71.4	-167.2	166.8	0	0	111.4	E340 F342 A346 R347 L348	E340-E344 PolarHBondContact O-N 3.39Å; F342-E344 PolarHBondContact O-N 3.04Å; E344-A346 PolarHBondContact O-N 3.06Å; E344-R347 PolarHBondContact O-N 3.17Å; E344-L348 VanDerWaalsContact O-CG 3.24Å; E344-L348 WeakPolarHBondContact O-CG 3.44Å; E344-L348 PolarHBondContact O-N 3.36Å
345	N	76.2	Confident	73.8	Confident	23 Å²	23	38 Å²	38	12%	0.123	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-39.5	179	-77.8	-62.6	0	0	0	113	I272 R280 D341 F342 L348 F349	I272-N345 HydrophobicContact CG2-CB 3.76Å; I272-N345 WeakPolarHBondContact O-CB 3.34Å; R280-N345 PolarHBondContact NH1-OD1 3.31Å; R280-N345 PolarHBondContact NH2-OD1 3.46Å; D341-N345 VanDerWaalsContact O-CB 3.27Å; D341-N345 WeakPolarHBondContact O-CB 3.33Å; D341-N345 VanDerWaalsContact O-CG 3.31Å; D341-N345 PolarHBondContact O-N 3.39Å; D341-N345 PolarHBondContact O-ND2 3.44Å; F342-N345 PolarHBondContact O-N 2.79Å; N345-L348 PolarHBondContact O-N 3.43Å; N345-F349 WeakPolarHBondContact O-CD2 3.33Å; N345-F349 PolarHBondContact O-N 2.88Å
346	A	78.1	Confident	74.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.9	-43.8	175.9	0	0	0	0	0	111	F305 L322 F342 I343 E344 F349 I350	F305-A346 HydrophobicContact CE1-CB 3.96Å; F305-A346 HydrophobicContact CZ-CB 3.94Å; L322-A346 HydrophobicContact CD1-CB 3.98Å; F342-A346 HydrophobicContact CE1-CB 4.35Å; F342-A346 WeakPolarHBondContact O-CB 3.21Å; F342-A346 PolarHBondContact O-N 2.96Å; I343-A346 PolarHBondContact O-N 2.6Å; E344-A346 PolarHBondContact O-N 3.06Å; A346-F349 PolarHBondContact O-N 3.36Å; A346-I350 VanDerWaalsContact O-CG1 3.32Å; A346-I350 WeakPolarHBondContact O-CG1 3.47Å; A346-I350 PolarHBondContact O-N 2.98Å
347	R	75.9	Confident	74.7	Confident	68 Å²	68	45.4 Å²	45.4	26%	0.257	23%	0.225	S	C	.	.	H	α-helix	trans	-58.6	-51.7	172.5	-72.5	168.3	178.4	-179.5	3.8	110.3	L322 I343 E344 F349 I350 F351 L370 W380	L322-R347 HydrophobicContact CD1-CG 4.44Å; I343-R347 HydrophobicContact CG2-CG 4.46Å; I343-R347 VanDerWaalsContact CG2-CZ 3.45Å; I343-R347 VanDerWaalsContact CG2-NE 3.34Å; I343-R347 WeakPolarHBondContact O-CB 2.98Å; I343-R347 WeakPolarHBondContact O-CD 3.05Å; I343-R347 WeakPolarHBondContact O-CG 3.4Å; I343-R347 PolarHBondContact O-N 2.61Å; E344-R347 PolarHBondContact O-N 3.17Å; R347-F349 PolarHBondContact O-N 2.98Å; R347-F349 VanDerWaalsContact O-N 3.13Å; R347-I350 PolarHBondContact O-N 3.32Å; R347-F351 HydrophobicContact CB-CD2 4.45Å; R347-F351 WeakPolarHBondContact O-CD2 3.25Å; R347-F351 PolarHBondContact O-N 3.4Å; R347-L370 HydrophobicContact CB-CD2 4.27Å; R347-L370 VanDerWaalsContact CD-CD2 3.49Å; R347-L370 HydrophobicContact CG-CD2 3.69Å; R347-W380 HydrophobicContact CB-CH2 4.34Å; R347-W380 HydrophobicContact CB-CZ2 3.87Å
348	L	75.9	Confident	75.1	Confident	45 Å²	45	45.2 Å²	45.2	24%	0.236	21%	0.211	C	C	.	.	H	α-helix	trans	-51.9	-39.1	177.2	-70	170.9	0	0	0	111.8	E344 N345 E352 W380 L384	E344-L348 VanDerWaalsContact O-CG 3.24Å; E344-L348 WeakPolarHBondContact O-CG 3.44Å; E344-L348 PolarHBondContact O-N 3.36Å; N345-L348 PolarHBondContact O-N 3.43Å; L348-E352 VanDerWaalsContact O-CB 3.23Å; L348-E352 WeakPolarHBondContact O-CB 3.42Å; L348-E352 PolarHBondContact O-N 2.96Å; L348-W380 HydrophobicContact CB-CZ2 4.47Å; L348-W380 HydrophobicContact CD2-CH2 3.87Å; L348-W380 HydrophobicContact CD2-CZ2 3.45Å; L348-W380 VanDerWaalsContact CD2-CZ2 3.45Å; L348-W380 HydrophobicContact CG-CH2 4.42Å; L348-W380 HydrophobicContact CG-CZ2 3.83Å; L348-L384 HydrophobicContact CB-CD1 4.4Å; L348-L384 HydrophobicContact CD2-CB 4.26Å; L348-L384 HydrophobicContact CD2-CD1 3.45Å; L348-L384 VanDerWaalsContact CD2-CD1 3.45Å; L348-L384 HydrophobicContact CD2-CG 4.4Å
349	F	74.6	Confident	75.3	Confident	14 Å²	14	50.9 Å²	50.9	6%	0.061	24%	0.237	C	C	.	.	H	α-helix	trans	-73.8	-43.8	179	-83.5	-52.6	0	0	0	115.6	I272 R280 L284 L309 N345 A346 R347 F351 E352 T353	I272-F349 HydrophobicContact CG2-CE2 4.49Å; R280-F349 HydrophobicContact CG-CZ 4.01Å; L284-F349 HydrophobicContact CD1-CE1 3.81Å; L284-F349 HydrophobicContact CD1-CE2 4.24Å; L284-F349 HydrophobicContact CD1-CZ 3.44Å; L284-F349 VanDerWaalsContact CD1-CZ 3.44Å; L309-F349 HydrophobicContact CD2-CB 4.04Å; N345-F349 WeakPolarHBondContact O-CD2 3.33Å; N345-F349 PolarHBondContact O-N 2.88Å; A346-F349 PolarHBondContact O-N 3.36Å; R347-F349 PolarHBondContact O-N 2.98Å; R347-F349 VanDerWaalsContact O-N 3.13Å; F349-F351 PolarHBondContact O-N 3Å; F349-E352 PolarHBondContact O-N 3.26Å; F349-T353 WeakPolarHBondContact O-CB 3.35Å; F349-T353 PolarHBondContact O-N 2.73Å; F349-T353 PolarHBondContact O-OG1 2.98Å
350	I	75.6	Confident	75.2	Confident	18 Å²	18	53.6 Å²	53.6	9%	0.092	26%	0.258	C	S	.	.	H	α-helix	trans	-54.8	-48.3	173.2	-67.1	167.2	0	0	0	108.1	F305 L309 F315 L322 A346 R347 T353 F354	F305-I350 HydrophobicContact CE2-CD1 3.65Å; F305-I350 HydrophobicContact CE2-CG1 4.01Å; F305-I350 HydrophobicContact CZ-CD1 3.72Å; F305-I350 HydrophobicContact CZ-CG1 3.78Å; L309-I350 HydrophobicContact CD1-CG1 4.17Å; F315-I350 HydrophobicContact CD1-CG2 4.01Å; L322-I350 HydrophobicContact CD1-CD1 3.81Å; A346-I350 VanDerWaalsContact O-CG1 3.32Å; A346-I350 WeakPolarHBondContact O-CG1 3.47Å; A346-I350 PolarHBondContact O-N 2.98Å; R347-I350 PolarHBondContact O-N 3.32Å; I350-T353 PolarHBondContact O-N 3.05Å; I350-F354 WeakPolarHBondContact O-CB 3.21Å; I350-F354 PolarHBondContact O-N 3.35Å
351	F	72.4	Confident	75.2	Confident	16 Å²	16	46.5 Å²	46.5	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-69.6	-43.4	-179.1	-76.4	-63	0	0	0	113.4	R347 F349 T353 F354 C355 L366 L370 W380 L384	R347-F351 HydrophobicContact CB-CD2 4.45Å; R347-F351 WeakPolarHBondContact O-CD2 3.25Å; R347-F351 PolarHBondContact O-N 3.4Å; F349-F351 PolarHBondContact O-N 3Å; F351-T353 VanDerWaalsContact C-N 3.27Å; F351-T353 PolarHBondContact O-N 3.08Å; F351-F354 PolarHBondContact O-N 3.02Å; F351-C355 VanDerWaalsContact O-CB 3.25Å; F351-C355 WeakPolarHBondContact O-CB 3.42Å; F351-C355 PolarHBondContact O-N 3.28Å; F351-C355 PolarHBondContact O-SG 3.47Å; F351-L366 HydrophobicContact CD1-CD1 3.6Å; F351-L366 HydrophobicContact CD1-CD2 4.19Å; F351-L366 HydrophobicContact CD1-CG 4.03Å; F351-L366 HydrophobicContact CE1-CD1 3.13Å; F351-L366 HydrophobicContact CE1-CD2 3.66Å; F351-L366 HydrophobicContact CE1-CG 3.2Å; F351-L366 HydrophobicContact CZ-CD1 4.04Å; F351-L366 HydrophobicContact CZ-CD2 3.79Å; F351-L366 HydrophobicContact CZ-CG 3.57Å; F351-L370 HydrophobicContact CD2-CD1 4.41Å; F351-L370 HydrophobicContact CE2-CD1 3.48Å; F351-L370 VanDerWaalsContact CE2-CD1 3.48Å; F351-L370 HydrophobicContact CE2-CD2 3.61Å; F351-L370 HydrophobicContact CE2-CG 3.6Å; F351-L370 HydrophobicContact CZ-CD1 3.63Å; F351-L370 HydrophobicContact CZ-CD2 4.2Å; F351-L370 HydrophobicContact CZ-CG 3.71Å; F351-W380 HydrophobicContact CB-CH2 3.76Å; F351-W380 HydrophobicContact CB-CZ3 3.81Å; F351-W380 HydrophobicContact CD1-CZ3 4.4Å; F351-W380 HydrophobicContact CD2-CE3 4.42Å; F351-W380 AromaticContact CD2-CH2 3.18Å; F351-W380 HydrophobicContact CD2-CH2 3.18Å; F351-W380 HydrophobicContact CD2-CZ2 4.2Å; F351-W380 AromaticContact CD2-CZ3 3.3Å; F351-W380 HydrophobicContact CD2-CZ3 3.3Å; F351-W380 HydrophobicContact CE2-CH2 4.08Å; F351-W380 HydrophobicContact CE2-CZ3 4.03Å; F351-W380 AromaticContact CG-CH2 3.68Å; F351-W380 HydrophobicContact CG-CH2 3.68Å; F351-W380 AromaticContact CG-CZ3 3.52Å; F351-W380 HydrophobicContact CG-CZ3 3.52Å; F351-L384 HydrophobicContact CB-CD2 3.99Å
352	E	75.2	Confident	75.2	Confident	13 Å²	13	45.3 Å²	45.3	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-42.1	176.2	-176.1	178.9	-158.7	0	0	111.3	R281 L348 F349 R356	R281-E352 IonicContact CZ-OE1 3.86Å; R281-E352 IonicContact NE-OE1 2.64Å; R281-E352 IonicContact NH2-OE1 3.59Å; R281-E352 PolarHBondContact NH2-OE1 3.41Å; L348-E352 VanDerWaalsContact O-CB 3.23Å; L348-E352 WeakPolarHBondContact O-CB 3.42Å; L348-E352 PolarHBondContact O-N 2.96Å; F349-E352 PolarHBondContact O-N 3.26Å; E352-R356 VanDerWaalsContact O-CG 3.3Å; E352-R356 WeakPolarHBondContact O-CG 3.25Å; E352-R356 PolarHBondContact O-N 3.34Å; E352-R356 VanDerWaalsContact O-N 3.13Å; E352-R356 IonicContact OE1-CZ 3.76Å; E352-R356 IonicContact OE1-NE 2.85Å; E352-R356 IonicContact OE1-NH2 2.82Å; E352-R356 PolarHBondContact OE1-NH2 3.44Å; E352-R356 IonicContact OE2-NH2 3.87Å; E352-R356 PolarHBondContact OE2-NH2 3.07Å
353	T	77	Confident	74.9	Confident	10 Å²	10	45.6 Å²	45.6	6%	0.061	22%	0.223	C	C	.	.	H	α-helix	trans	-67.6	-42.5	177.2	-52.4	0	0	0	0	110.8	F313 F315 F349 I350 F351 C355 R356 I357	F313-T353 HydrophobicContact CD1-CG2 3.86Å; F313-T353 HydrophobicContact CE1-CG2 3.78Å; F315-T353 HydrophobicContact CE1-CG2 4.14Å; F315-T353 HydrophobicContact CZ-CG2 4.08Å; F349-T353 WeakPolarHBondContact O-CB 3.35Å; F349-T353 PolarHBondContact O-N 2.73Å; F349-T353 PolarHBondContact O-OG1 2.98Å; I350-T353 PolarHBondContact O-N 3.05Å; F351-T353 VanDerWaalsContact C-N 3.27Å; F351-T353 PolarHBondContact O-N 3.08Å; T353-C355 PolarHBondContact O-N 2.81Å; T353-R356 PolarHBondContact O-N 3.29Å; T353-I357 HydrophobicContact CG2-CD1 4.17Å; T353-I357 WeakPolarHBondContact O-CG1 3.43Å; T353-I357 PolarHBondContact O-N 2.95Å
354	F	74.5	Confident	74.6	Confident	43 Å²	43	48.5 Å²	48.5	19%	0.189	24%	0.244	C	C	.	.	H	α-helix	trans	-61.8	-44.3	177.3	-166.7	-97.6	0	0	0	112.3	F315 I350 F351 R356 I357 H358 I361	F315-F354 HydrophobicContact CD1-CD2 4.3Å; F315-F354 AromaticContact CD2-CD2 3.82Å; F315-F354 HydrophobicContact CD2-CD2 3.82Å; F315-F354 HydrophobicContact CD2-CE2 4.24Å; F315-F354 HydrophobicContact CE1-CB 4.29Å; F315-F354 HydrophobicContact CE1-CD2 4.35Å; F315-F354 AromaticContact CE2-CD2 3.9Å; F315-F354 HydrophobicContact CE2-CD2 3.9Å; F315-F354 HydrophobicContact CG-CD2 4.03Å; F315-F354 HydrophobicContact CZ-CB 4.42Å; F315-F354 HydrophobicContact CZ-CD2 4.16Å; I350-F354 WeakPolarHBondContact O-CB 3.21Å; I350-F354 PolarHBondContact O-N 3.35Å; F351-F354 PolarHBondContact O-N 3.02Å; F354-R356 VanDerWaalsContact C-N 3.32Å; F354-R356 PolarHBondContact O-N 2.84Å; F354-I357 PolarHBondContact O-N 3.41Å; F354-H358 AromaticContact CD2-CE1 3.76Å; F354-H358 AromaticContact CD2-ND1 3.63Å; F354-H358 HydrophobicContact CE1-CB 4.34Å; F354-H358 AromaticContact CE1-ND1 3.98Å; F354-H358 AromaticContact CE2-CE1 3.43Å; F354-H358 VanDerWaalsContact CE2-CE1 3.43Å; F354-H358 WeakPolarHBondContact CE2-CE1 3.35Å; F354-H358 AromaticContact CE2-ND1 3.54Å; F354-H358 AromaticContact CG-ND1 3.89Å; F354-H358 AromaticContact CZ-CE1 3.89Å; F354-H358 AromaticContact CZ-ND1 3.72Å; F354-H358 PolarHBondContact O-N 2.8Å; F354-H358 PolarHBondContact O-ND1 3.2Å; F354-H358 VanDerWaalsContact O-ND1 3.13Å; F354-I361 HydrophobicContact CD1-CD1 3.98Å; F354-I361 HydrophobicContact CD1-CG1 4.12Å; F354-I361 HydrophobicContact CD1-CG2 4.43Å; F354-I361 HydrophobicContact CE1-CB 4.46Å; F354-I361 HydrophobicContact CE1-CD1 4.29Å; F354-I361 HydrophobicContact CE1-CG1 3.92Å; F354-I361 HydrophobicContact CE1-CG2 3.98Å
355	C	70.8	Confident	74.4	Confident	16 Å²	16	47.9 Å²	47.9	11%	0.108	24%	0.243	C	C	.	.	H	α-helix	trans	-67	-27.4	178	-67.4	0	0	0	0	113.6	F351 T353 I361 M403	F351-C355 VanDerWaalsContact O-CB 3.25Å; F351-C355 WeakPolarHBondContact O-CB 3.42Å; F351-C355 PolarHBondContact O-N 3.28Å; F351-C355 PolarHBondContact O-SG 3.47Å; T353-C355 PolarHBondContact O-N 2.81Å; C355-I361 HydrophobicContact CB-CD1 4.27Å; C355-I361 WeakPolarHBondContact SG-CD1 3.47Å; C355-M403 HydrophobicContact CB-CE 3.48Å; C355-M403 VanDerWaalsContact CB-CE 3.48Å; C355-M403 HydrophobicContact CB-SD 4.2Å; C355-M403 WeakPolarHBondContact SG-CE 3.34Å
356	R	72.3	Confident	74.1	Confident	140 Å²	140	47.1 Å²	47.1	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-75.4	-26.8	175	-74.8	176.5	-167.9	169	6.4	112.9	E352 T353 F354	E352-R356 VanDerWaalsContact O-CG 3.3Å; E352-R356 WeakPolarHBondContact O-CG 3.25Å; E352-R356 PolarHBondContact O-N 3.34Å; E352-R356 VanDerWaalsContact O-N 3.13Å; E352-R356 IonicContact OE1-CZ 3.76Å; E352-R356 IonicContact OE1-NE 2.85Å; E352-R356 IonicContact OE1-NH2 2.82Å; E352-R356 PolarHBondContact OE1-NH2 3.44Å; E352-R356 IonicContact OE2-NH2 3.87Å; E352-R356 PolarHBondContact OE2-NH2 3.07Å; T353-R356 PolarHBondContact O-N 3.29Å; F354-R356 VanDerWaalsContact C-N 3.32Å; F354-R356 PolarHBondContact O-N 2.84Å
357	I	78.1	Confident	73.8	Confident	93 Å²	93	47.5 Å²	47.5	48%	0.477	24%	0.242	S	C	.	.	H	α-helix	trans	-92.7	-41.2	-176.8	-59.7	167	0	0	0	110.6	F313 F315 T353 F354	F313-I357 HydrophobicContact CD1-CD1 4.06Å; F315-I357 HydrophobicContact CE2-CD1 4.3Å; F315-I357 HydrophobicContact CZ-CD1 3.94Å; T353-I357 HydrophobicContact CG2-CD1 4.17Å; T353-I357 WeakPolarHBondContact O-CG1 3.43Å; T353-I357 PolarHBondContact O-N 2.95Å; F354-I357 PolarHBondContact O-N 3.41Å
358	H	75.4	Confident	73.7	Confident	73 Å²	73	50.1 Å²	50.1	34%	0.338	26%	0.261	S	S	.	.			trans	-100.5	130.8	-174.4	-60.3	86.5	0	0	0	112	F354 I361	F354-H358 AromaticContact CD2-CE1 3.76Å; F354-H358 AromaticContact CD2-ND1 3.63Å; F354-H358 HydrophobicContact CE1-CB 4.34Å; F354-H358 AromaticContact CE1-ND1 3.98Å; F354-H358 AromaticContact CE2-CE1 3.43Å; F354-H358 VanDerWaalsContact CE2-CE1 3.43Å; F354-H358 WeakPolarHBondContact CE2-CE1 3.35Å; F354-H358 AromaticContact CE2-ND1 3.54Å; F354-H358 AromaticContact CG-ND1 3.89Å; F354-H358 AromaticContact CZ-CE1 3.89Å; F354-H358 AromaticContact CZ-ND1 3.72Å; F354-H358 PolarHBondContact O-N 2.8Å; F354-H358 PolarHBondContact O-ND1 3.2Å; F354-H358 VanDerWaalsContact O-ND1 3.13Å; H358-I361 HydrophobicContact CB-CG1 4.36Å
359	Q	70.4	Confident	73.3	Confident	121 Å²	121	50.4 Å²	50.4	57%	0.565	26%	0.26	S	S	*	.	S	Bend	trans	-81.8	-27.5	175.6	-69.2	-176.5	-10.3	0	0	113.2	V402 M403	Q359-V402 CarbonylContact O-C 3.56Å; Q359-V402 VanDerWaalsContact O-CA 3.3Å; Q359-V402 WeakPolarHBondContact O-CA 3.5Å; Q359-M403 PolarHBondContact O-N 2.8Å
360	C	70.3	Confident	73	Confident	86 Å²	86	50.3 Å²	50.3	58%	0.581	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.2	179.7	-61.5	0	0	0	0	109.4	V401	C360-V401 WeakPolarHBondContact CA-O 3.3Å
361	I	75.4	Confident	72.6	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.041	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129.2	-178.5	-56.2	172.3	0	0	0	108.6	F354 C355 H358 L366 H400 V401 M403	F354-I361 HydrophobicContact CD1-CD1 3.98Å; F354-I361 HydrophobicContact CD1-CG1 4.12Å; F354-I361 HydrophobicContact CD1-CG2 4.43Å; F354-I361 HydrophobicContact CE1-CB 4.46Å; F354-I361 HydrophobicContact CE1-CD1 4.29Å; F354-I361 HydrophobicContact CE1-CG1 3.92Å; F354-I361 HydrophobicContact CE1-CG2 3.98Å; C355-I361 HydrophobicContact CB-CD1 4.27Å; C355-I361 WeakPolarHBondContact SG-CD1 3.47Å; H358-I361 HydrophobicContact CB-CG1 4.36Å; I361-L366 HydrophobicContact CG2-CD1 3.57Å; I361-H400 CarbonylContact O-C 3.53Å; I361-H400 VanDerWaalsContact O-CA 3.25Å; I361-H400 WeakPolarHBondContact O-CA 3.39Å; I361-V401 HydrophobicContact CB-CB 4.34Å; I361-V401 PolarHBondContact N-O 3.13Å; I361-V401 PolarHBondContact O-N 3.44Å; I361-M403 HydrophobicContact CD1-CE 3.7Å
362	S	76.8	Confident	72.6	Confident	36 Å²	36	56.4 Å²	56.4	25%	0.252	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	130	171.2	49.6	0	0	0	0	111	S364 M365 L366	S362-S364 VanDerWaalsContact C-N 3.3Å; S362-S364 PolarHBondContact O-N 3.05Å; S362-M365 WeakPolarHBondContact OG-CB 3.38Å; S362-L366 PolarHBondContact O-N 2.89Å
363	I	72.7	Confident	72.7	Confident	7 Å²	7	58.5 Å²	58.5	4%	0.036	31%	0.309	C	S	.	.	H	α-helix	trans	-68.4	-32.1	178.9	-64.3	170.4	0	0	0	110.8	L366 A367 A374 E378 I394 G399 V401	I363-L366 WeakPolarHBondContact O-CB 3.2Å; I363-L366 PolarHBondContact O-N 3.13Å; I363-A367 WeakPolarHBondContact O-CB 3.3Å; I363-A367 PolarHBondContact O-N 3.32Å; I363-A374 HydrophobicContact CG2-CB 4.29Å; I363-E378 HydrophobicContact CD1-CG 3.97Å; I363-E378 HydrophobicContact CG2-CG 4.33Å; I363-I394 HydrophobicContact CD1-CG2 4.42Å; I363-G399 WeakPolarHBondContact CG1-O 3.47Å; I363-G399 PolarHBondContact N-O 3.05Å; I363-V401 HydrophobicContact CD1-CG2 4.21Å; I363-V401 HydrophobicContact CG1-CG2 3.99Å
364	S	71.7	Confident	72.5	Confident	75 Å²	75	60.6 Å²	60.6	52%	0.524	33%	0.327	S	S	.	.	H	α-helix	trans	-63.1	-48.9	178.5	49.9	0	0	0	0	113	S362 L366 A367 D368	S362-S364 VanDerWaalsContact C-N 3.3Å; S362-S364 PolarHBondContact O-N 3.05Å; S364-L366 PolarHBondContact O-N 3.4Å; S364-A367 PolarHBondContact O-N 2.86Å; S364-D368 PolarHBondContact O-N 3.11Å
365	M	72.8	Confident	72.6	Confident	100 Å²	100	64.1 Å²	64.1	49%	0.493	35%	0.345	S	S	.	.	H	α-helix	trans	-63	-29.5	176.7	-165.5	176.8	-171.1	0	0	111.3	S362 K369	S362-M365 WeakPolarHBondContact OG-CB 3.38Å; M365-K369 HydrophobicContact CG-CD 4.27Å; M365-K369 VanDerWaalsContact O-CB 3.31Å; M365-K369 WeakPolarHBondContact O-CB 3.32Å; M365-K369 WeakPolarHBondContact O-CD 3.21Å; M365-K369 WeakPolarHBondContact O-CG 3.31Å; M365-K369 PolarHBondContact O-N 2.82Å
366	L	71.1	Confident	72.9	Confident	7 Å²	7	68.5 Å²	68.5	4%	0.037	36%	0.363	C	S	.	.	H	α-helix	trans	-73.5	-46.2	178.2	-144.4	120.6	0	0	0	112.2	F351 I361 S362 I363 S364 K369 L370 A377 I381	F351-L366 HydrophobicContact CD1-CD1 3.6Å; F351-L366 HydrophobicContact CD1-CD2 4.19Å; F351-L366 HydrophobicContact CD1-CG 4.03Å; F351-L366 HydrophobicContact CE1-CD1 3.13Å; F351-L366 HydrophobicContact CE1-CD2 3.66Å; F351-L366 HydrophobicContact CE1-CG 3.2Å; F351-L366 HydrophobicContact CZ-CD1 4.04Å; F351-L366 HydrophobicContact CZ-CD2 3.79Å; F351-L366 HydrophobicContact CZ-CG 3.57Å; I361-L366 HydrophobicContact CG2-CD1 3.57Å; S362-L366 PolarHBondContact O-N 2.89Å; I363-L366 WeakPolarHBondContact O-CB 3.2Å; I363-L366 PolarHBondContact O-N 3.13Å; S364-L366 PolarHBondContact O-N 3.4Å; L366-K369 PolarHBondContact O-N 3.49Å; L366-L370 HydrophobicContact CD2-CD1 3.67Å; L366-L370 HydrophobicContact CG-CD1 4.44Å; L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 PolarHBondContact O-N 2.81Å; L366-A377 HydrophobicContact CD2-CB 4.44Å; L366-I381 HydrophobicContact CD2-CD1 4Å; L366-I381 HydrophobicContact CD2-CG1 4.07Å
367	A	71.9	Confident	73.1	Confident	8 Å²	8	61.9 Å²	61.9	7%	0.066	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-45.9	177.3	0	0	0	0	0	111.3	I363 S364 K369 L370 N371 M372 A374 A377	I363-A367 WeakPolarHBondContact O-CB 3.3Å; I363-A367 PolarHBondContact O-N 3.32Å; S364-A367 PolarHBondContact O-N 2.86Å; A367-K369 VanDerWaalsContact C-N 3.3Å; A367-K369 PolarHBondContact O-N 2.91Å; A367-L370 PolarHBondContact O-N 3.19Å; A367-N371 PolarHBondContact O-N 3Å; A367-M372 WeakPolarHBondContact CB-O 3.2Å; A367-M372 PolarHBondContact O-N 3.33Å; A367-A374 HydrophobicContact CB-CB 4.48Å; A367-A377 HydrophobicContact CB-CB 4.36Å
368	D	72.5	Confident	73	Confident	124 Å²	124	60 Å²	60	66%	0.663	33%	0.328	S	S	*	.	H	α-helix	trans	-64	-35.5	176.4	-71	-18.4	0	0	0	112.1	S364 N371	S364-D368 PolarHBondContact O-N 3.11Å; D368-N371 PolarHBondContact O-OD1 3.48Å
369	K	68.7	Low	73.2	Confident	50 Å²	50	63.9 Å²	63.9	22%	0.217	34%	0.339	C	S	.	.	H	α-helix	trans	-75.1	-33	178.9	-76.3	176	168.4	-82.9	0	113	D316 Q319 M365 L366 A367	D316-K369 IonicContact OD1-NZ 3.17Å; D316-K369 PolarHBondContact OD1-NZ 2.94Å; Q319-K369 VanDerWaalsContact NE2-C 3.35Å; Q319-K369 PolarHBondContact NE2-O 3.44Å; M365-K369 HydrophobicContact CG-CD 4.27Å; M365-K369 VanDerWaalsContact O-CB 3.31Å; M365-K369 WeakPolarHBondContact O-CB 3.32Å; M365-K369 WeakPolarHBondContact O-CD 3.21Å; M365-K369 WeakPolarHBondContact O-CG 3.31Å; M365-K369 PolarHBondContact O-N 2.82Å; L366-K369 PolarHBondContact O-N 3.49Å; A367-K369 VanDerWaalsContact C-N 3.3Å; A367-K369 PolarHBondContact O-N 2.91Å
370	L	67.3	Low	73.5	Confident	12 Å²	12	60 Å²	60	6%	0.063	32%	0.32	C	S	.	.	H	α-helix	trans	-89.9	-4	-179.2	-81.3	173.9	0	0	0	113.9	R347 F351 L366 A367 M372 W380	R347-L370 HydrophobicContact CB-CD2 4.27Å; R347-L370 VanDerWaalsContact CD-CD2 3.49Å; R347-L370 HydrophobicContact CG-CD2 3.69Å; F351-L370 HydrophobicContact CD2-CD1 4.41Å; F351-L370 HydrophobicContact CE2-CD1 3.48Å; F351-L370 VanDerWaalsContact CE2-CD1 3.48Å; F351-L370 HydrophobicContact CE2-CD2 3.61Å; F351-L370 HydrophobicContact CE2-CG 3.6Å; F351-L370 HydrophobicContact CZ-CD1 3.63Å; F351-L370 HydrophobicContact CZ-CD2 4.2Å; F351-L370 HydrophobicContact CZ-CG 3.71Å; L366-L370 HydrophobicContact CD2-CD1 3.67Å; L366-L370 HydrophobicContact CG-CD1 4.44Å; L366-L370 WeakPolarHBondContact O-CB 3.34Å; L366-L370 PolarHBondContact O-N 2.81Å; A367-L370 PolarHBondContact O-N 3.19Å; L370-M372 HydrophobicContact CB-CE 3.75Å; L370-M372 HydrophobicContact CB-CG 3.58Å; L370-M372 HydrophobicContact CB-SD 3.73Å; L370-M372 HydrophobicContact CD1-CE 3.88Å; L370-M372 HydrophobicContact CD1-CG 4.37Å; L370-M372 HydrophobicContact CD1-SD 3.51Å; L370-M372 VanDerWaalsContact CD1-SD 3.51Å; L370-M372 HydrophobicContact CD2-CE 4.25Å; L370-M372 HydrophobicContact CG-CE 4.19Å; L370-M372 HydrophobicContact CG-SD 4.22Å; L370-M372 PolarHBondContact O-N 2.84Å; L370-W380 HydrophobicContact CD1-CE3 4.32Å
371	N	66.7	Low	73.7	Confident	125 Å²	125	56.6 Å²	56.6	67%	0.668	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	37.8	-171.4	-65.7	-17.5	0	0	0	112.3	R323 A367 D368	R323-N371 PolarHBondContact NH2-OD1 2.9Å; A367-N371 PolarHBondContact O-N 3Å; D368-N371 PolarHBondContact O-OD1 3.48Å
372	M	72.3	Confident	73.8	Confident	37 Å²	37	59 Å²	59	18%	0.182	31%	0.31	C	S	.	.	S	Bend	trans	-124	160.2	178.9	62	-176.1	47.4	0	0	110.3	A367 L370 E376 A377 W380	A367-M372 WeakPolarHBondContact CB-O 3.2Å; A367-M372 PolarHBondContact O-N 3.33Å; L370-M372 HydrophobicContact CB-CE 3.75Å; L370-M372 HydrophobicContact CB-CG 3.58Å; L370-M372 HydrophobicContact CB-SD 3.73Å; L370-M372 HydrophobicContact CD1-CE 3.88Å; L370-M372 HydrophobicContact CD1-CG 4.37Å; L370-M372 HydrophobicContact CD1-SD 3.51Å; L370-M372 VanDerWaalsContact CD1-SD 3.51Å; L370-M372 HydrophobicContact CD2-CE 4.25Å; L370-M372 HydrophobicContact CG-CE 4.19Å; L370-M372 HydrophobicContact CG-SD 4.22Å; L370-M372 PolarHBondContact O-N 2.84Å; M372-E376 HydrophobicContact CB-CB 4.26Å; M372-A377 HydrophobicContact CG-CB 4.02Å; M372-A377 VanDerWaalsContact SD-CA 3.57Å; M372-A377 HydrophobicContact SD-CB 3.89Å; M372-W380 HydrophobicContact SD-CB 4.5Å
373	S	77.7	Confident	73.8	Confident	57 Å²	57	61.4 Å²	61.4	40%	0.399	32%	0.32	S	S	.	.			trans	-64.9	153	175.1	64.5	0	0	0	0	111	E375 E376 A377	S373-E375 PolarHBondContact O-N 3.35Å; S373-E375 VanDerWaalsContact O-N 3.15Å; S373-E376 PolarHBondContact N-OE2 3.45Å; S373-E376 VanDerWaalsContact N-OE2 3.15Å; S373-E376 PolarHBondContact O-N 2.86Å; S373-E376 VanDerWaalsContact O-N 3.15Å; S373-E376 WeakPolarHBondContact OG-CB 3.29Å; S373-E376 VanDerWaalsContact OG-CG 3.23Å; S373-E376 WeakPolarHBondContact OG-CG 3.05Å; S373-E376 PolarHBondContact OG-N 3.29Å; S373-E376 PolarHBondContact OG-OE2 3.12Å; S373-A377 WeakPolarHBondContact O-CB 3.4Å; S373-A377 PolarHBondContact O-N 3.22Å
374	A	74.1	Confident	73.8	Confident	54 Å²	54	61.6 Å²	61.6	45%	0.446	32%	0.321	S	S	.	.	H	α-helix	trans	-57.1	-30.2	177.7	0	0	0	0	0	112.5	I363 A367 E378	I363-A374 HydrophobicContact CG2-CB 4.29Å; A367-A374 HydrophobicContact CB-CB 4.48Å; A374-E378 WeakPolarHBondContact O-CG 3.24Å; A374-E378 PolarHBondContact O-N 2.97Å
375	E	76.8	Confident	73.8	Confident	118 Å²	118	59.6 Å²	59.6	55%	0.551	30%	0.304	S	S	*	.	H	α-helix	trans	-75.9	-38.6	178.6	-161.5	-177.1	154.3	0	0	112.6	S373 E378 R379	S373-E375 PolarHBondContact O-N 3.35Å; S373-E375 VanDerWaalsContact O-N 3.15Å; E375-E378 PolarHBondContact O-N 3.46Å; E375-R379 WeakPolarHBondContact O-CG 3.1Å; E375-R379 PolarHBondContact O-N 3.31Å; E375-R379 VanDerWaalsContact O-N 3.1Å; E375-R379 IonicContact OE1-CZ 3.39Å; E375-R379 IonicContact OE1-NH2 2.61Å; E375-R379 PolarHBondContact OE1-NH2 3.1Å
376	E	76.4	Confident	73.8	Confident	108 Å²	108	63.5 Å²	63.5	51%	0.505	31%	0.314	S	S	.	.	H	α-helix	trans	-67.9	-38.5	172.4	-73.6	164.7	154.1	0	0	111.4	M372 S373 E378 R379 W380	M372-E376 HydrophobicContact CB-CB 4.26Å; S373-E376 PolarHBondContact N-OE2 3.45Å; S373-E376 VanDerWaalsContact N-OE2 3.15Å; S373-E376 PolarHBondContact O-N 2.86Å; S373-E376 VanDerWaalsContact O-N 3.15Å; S373-E376 WeakPolarHBondContact OG-CB 3.29Å; S373-E376 VanDerWaalsContact OG-CG 3.23Å; S373-E376 WeakPolarHBondContact OG-CG 3.05Å; S373-E376 PolarHBondContact OG-N 3.29Å; S373-E376 PolarHBondContact OG-OE2 3.12Å; E376-E378 VanDerWaalsContact C-N 3.32Å; E376-E378 PolarHBondContact O-N 3.38Å; E376-R379 PolarHBondContact O-N 3.06Å; E376-W380 VanDerWaalsContact O-CB 3.29Å; E376-W380 WeakPolarHBondContact O-CB 3.43Å; E376-W380 PolarHBondContact O-N 3.29Å
377	A	75.6	Confident	73.7	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.2	-43.7	172.9	0	0	0	0	0	111.1	L366 A367 M372 S373 W380 I381	L366-A377 HydrophobicContact CD2-CB 4.44Å; A367-A377 HydrophobicContact CB-CB 4.36Å; M372-A377 HydrophobicContact CG-CB 4.02Å; M372-A377 VanDerWaalsContact SD-CA 3.57Å; M372-A377 HydrophobicContact SD-CB 3.89Å; S373-A377 WeakPolarHBondContact O-CB 3.4Å; S373-A377 PolarHBondContact O-N 3.22Å; A377-W380 PolarHBondContact O-N 3.34Å; A377-I381 WeakPolarHBondContact O-CD1 3.4Å; A377-I381 WeakPolarHBondContact O-CG1 3.39Å; A377-I381 PolarHBondContact O-N 2.64Å
378	E	76.8	Confident	73.3	Confident	54 Å²	54	70.2 Å²	70.2	25%	0.252	35%	0.352	S	S	.	.	H	α-helix	trans	-60.1	-47.5	174.7	-80.6	-171.9	171.3	0	0	112.3	I363 A374 E375 E376 W380 I381 V382 S396	I363-E378 HydrophobicContact CD1-CG 3.97Å; I363-E378 HydrophobicContact CG2-CG 4.33Å; A374-E378 WeakPolarHBondContact O-CG 3.24Å; A374-E378 PolarHBondContact O-N 2.97Å; E375-E378 PolarHBondContact O-N 3.46Å; E376-E378 VanDerWaalsContact C-N 3.32Å; E376-E378 PolarHBondContact O-N 3.38Å; E378-W380 VanDerWaalsContact C-N 3.28Å; E378-W380 PolarHBondContact O-N 3.31Å; E378-I381 PolarHBondContact O-N 3.15Å; E378-V382 WeakPolarHBondContact O-CG2 3.47Å; E378-V382 PolarHBondContact O-N 3.14Å; E378-S396 PolarHBondContact OE1-OG 3.49Å
379	R	78.9	Confident	72.9	Confident	155 Å²	155	75.1 Å²	75.1	59%	0.585	36%	0.361	S	S	*	.	H	α-helix	trans	-61	-39.8	177.3	-69	178.2	-168.7	179.5	7	111.6	E375 E376 V382 N383	E375-R379 WeakPolarHBondContact O-CG 3.1Å; E375-R379 PolarHBondContact O-N 3.31Å; E375-R379 VanDerWaalsContact O-N 3.1Å; E375-R379 IonicContact OE1-CZ 3.39Å; E375-R379 IonicContact OE1-NH2 2.61Å; E375-R379 PolarHBondContact OE1-NH2 3.1Å; E376-R379 PolarHBondContact O-N 3.06Å; R379-V382 PolarHBondContact O-N 3.22Å; R379-N383 PolarHBondContact O-N 3.46Å
380	W	76.7	Confident	72.9	Confident	40 Å²	40	74.5 Å²	74.5	15%	0.152	36%	0.36	C	S	.	.	H	α-helix	trans	-66	-43.7	177.8	-170.8	88.4	0	0	0	111.9	R347 L348 F351 L370 M372 E376 A377 E378 V382 N383 L384	R347-W380 HydrophobicContact CB-CH2 4.34Å; R347-W380 HydrophobicContact CB-CZ2 3.87Å; L348-W380 HydrophobicContact CB-CZ2 4.47Å; L348-W380 HydrophobicContact CD2-CH2 3.87Å; L348-W380 HydrophobicContact CD2-CZ2 3.45Å; L348-W380 VanDerWaalsContact CD2-CZ2 3.45Å; L348-W380 HydrophobicContact CG-CH2 4.42Å; L348-W380 HydrophobicContact CG-CZ2 3.83Å; F351-W380 HydrophobicContact CB-CH2 3.76Å; F351-W380 HydrophobicContact CB-CZ3 3.81Å; F351-W380 HydrophobicContact CD1-CZ3 4.4Å; F351-W380 HydrophobicContact CD2-CE3 4.42Å; F351-W380 AromaticContact CD2-CH2 3.18Å; F351-W380 HydrophobicContact CD2-CH2 3.18Å; F351-W380 HydrophobicContact CD2-CZ2 4.2Å; F351-W380 AromaticContact CD2-CZ3 3.3Å; F351-W380 HydrophobicContact CD2-CZ3 3.3Å; F351-W380 HydrophobicContact CE2-CH2 4.08Å; F351-W380 HydrophobicContact CE2-CZ3 4.03Å; F351-W380 AromaticContact CG-CH2 3.68Å; F351-W380 HydrophobicContact CG-CH2 3.68Å; F351-W380 AromaticContact CG-CZ3 3.52Å; F351-W380 HydrophobicContact CG-CZ3 3.52Å; L370-W380 HydrophobicContact CD1-CE3 4.32Å; M372-W380 HydrophobicContact SD-CB 4.5Å; E376-W380 VanDerWaalsContact O-CB 3.29Å; E376-W380 WeakPolarHBondContact O-CB 3.43Å; E376-W380 PolarHBondContact O-N 3.29Å; A377-W380 PolarHBondContact O-N 3.34Å; E378-W380 VanDerWaalsContact C-N 3.28Å; E378-W380 PolarHBondContact O-N 3.31Å; W380-V382 VanDerWaalsContact C-N 3.35Å; W380-V382 PolarHBondContact O-N 3.49Å; W380-N383 PolarHBondContact O-N 3.01Å; W380-L384 HydrophobicContact CH2-CD2 4.41Å; W380-L384 HydrophobicContact CZ3-CD2 4.13Å; W380-L384 PolarHBondContact O-N 3.21Å
381	I	75.7	Confident	72.7	Confident	13 Å²	13	79.8 Å²	79.8	7%	0.067	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-42.5	174.4	-66.2	161.7	0	0	0	111	L366 A377 E378 N383 L384 I385 I394 V401	L366-I381 HydrophobicContact CD2-CD1 4Å; L366-I381 HydrophobicContact CD2-CG1 4.07Å; A377-I381 WeakPolarHBondContact O-CD1 3.4Å; A377-I381 WeakPolarHBondContact O-CG1 3.39Å; A377-I381 PolarHBondContact O-N 2.64Å; E378-I381 PolarHBondContact O-N 3.15Å; I381-N383 VanDerWaalsContact C-N 3.34Å; I381-N383 PolarHBondContact O-N 2.78Å; I381-L384 WeakPolarHBondContact O-CB 3.3Å; I381-L384 PolarHBondContact O-N 3.11Å; I381-I385 HydrophobicContact CG2-CD1 3.71Å; I381-I385 HydrophobicContact CG2-CG1 4.34Å; I381-I385 WeakPolarHBondContact O-CG1 3.43Å; I381-I385 PolarHBondContact O-N 2.87Å; I381-I394 HydrophobicContact CG2-CD1 4.32Å; I381-V401 HydrophobicContact CD1-CG2 4.17Å; I381-V401 HydrophobicContact CG2-CG2 4.45Å
382	V	77.2	Confident	72.8	Confident	59 Å²	59	75.1 Å²	75.1	36%	0.358	37%	0.368	S	S	.	.	H	α-helix	trans	-62.8	-41.7	177.8	171.2	0	0	0	0	111.2	E378 R379 W380 L384 I385 R386 I394	E378-V382 WeakPolarHBondContact O-CG2 3.47Å; E378-V382 PolarHBondContact O-N 3.14Å; R379-V382 PolarHBondContact O-N 3.22Å; W380-V382 VanDerWaalsContact C-N 3.35Å; W380-V382 PolarHBondContact O-N 3.49Å; V382-L384 VanDerWaalsContact C-N 3.34Å; V382-I385 PolarHBondContact O-N 3.13Å; V382-R386 WeakPolarHBondContact O-CB 3.29Å; V382-R386 PolarHBondContact O-N 2.86Å; V382-I394 HydrophobicContact CG2-CD1 3.66Å
383	N	76.4	Confident	72.9	Confident	86 Å²	86	80.3 Å²	80.3	46%	0.46	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-39.7	174.3	-75.8	-19.6	0	0	0	111.8	R379 W380 I381 R386 N387	R379-N383 PolarHBondContact O-N 3.46Å; W380-N383 PolarHBondContact O-N 3.01Å; I381-N383 VanDerWaalsContact C-N 3.34Å; I381-N383 PolarHBondContact O-N 2.78Å; N383-R386 PolarHBondContact O-N 3.29Å; N383-N387 WeakPolarHBondContact O-CB 3.48Å; N383-N387 VanDerWaalsContact O-CG 3.24Å; N383-N387 PolarHBondContact O-N 2.87Å; N383-N387 PolarHBondContact O-ND2 3.48Å
384	L	72.5	Confident	72.7	Confident	12 Å²	12	80.2 Å²	80.2	6%	0.063	38%	0.384	C	S	.	.	H	α-helix	trans	-61.9	-48.8	174.2	176.2	71.9	0	0	0	111.6	L348 F351 W380 I381 V382 R386 N387 A388	L348-L384 HydrophobicContact CB-CD1 4.4Å; L348-L384 HydrophobicContact CD2-CB 4.26Å; L348-L384 HydrophobicContact CD2-CD1 3.45Å; L348-L384 VanDerWaalsContact CD2-CD1 3.45Å; L348-L384 HydrophobicContact CD2-CG 4.4Å; F351-L384 HydrophobicContact CB-CD2 3.99Å; W380-L384 HydrophobicContact CH2-CD2 4.41Å; W380-L384 HydrophobicContact CZ3-CD2 4.13Å; W380-L384 PolarHBondContact O-N 3.21Å; I381-L384 WeakPolarHBondContact O-CB 3.3Å; I381-L384 PolarHBondContact O-N 3.11Å; V382-L384 VanDerWaalsContact C-N 3.34Å; L384-R386 VanDerWaalsContact C-N 3.3Å; L384-R386 PolarHBondContact O-N 3.2Å; L384-N387 PolarHBondContact O-N 3.03Å; L384-A388 HydrophobicContact CD1-CB 4.5Å; L384-A388 WeakPolarHBondContact O-CB 3.39Å; L384-A388 PolarHBondContact O-N 3.04Å
385	I	72	Confident	72.8	Confident	32 Å²	32	80.4 Å²	80.4	16%	0.164	38%	0.377	C	S	.	.	H	α-helix	trans	-59.5	-42.9	178.9	-71.5	164.1	0	0	0	110.7	I381 V382 N387 R389 L390 A392 I394	I381-I385 HydrophobicContact CG2-CD1 3.71Å; I381-I385 HydrophobicContact CG2-CG1 4.34Å; I381-I385 WeakPolarHBondContact O-CG1 3.43Å; I381-I385 PolarHBondContact O-N 2.87Å; V382-I385 PolarHBondContact O-N 3.13Å; I385-N387 PolarHBondContact O-N 3.43Å; I385-R389 WeakPolarHBondContact O-CA 3.26Å; I385-R389 PolarHBondContact O-N 3.39Å; I385-L390 WeakPolarHBondContact CG2-O 3.19Å; I385-A392 HydrophobicContact CD1-CB 3.71Å; I385-A392 HydrophobicContact CG1-CB 4.03Å; I385-I394 HydrophobicContact CD1-CD1 4.13Å; I385-I394 HydrophobicContact CD1-CG1 4.37Å
386	R	73.4	Confident	72.4	Confident	182 Å²	182	78.6 Å²	78.6	69%	0.687	38%	0.377	S	S	*	.	H	α-helix	trans	-63.8	-41	178.6	-170.1	178.6	-68.8	177.7	-0.4	112.1	V382 N383 L384	V382-R386 WeakPolarHBondContact O-CB 3.29Å; V382-R386 PolarHBondContact O-N 2.86Å; N383-R386 PolarHBondContact O-N 3.29Å; L384-R386 VanDerWaalsContact C-N 3.3Å; L384-R386 PolarHBondContact O-N 3.2Å
387	N	68.7	Low	72.1	Confident	131 Å²	131	83.7 Å²	83.7	70%	0.701	40%	0.398	S	S	*	.	H	α-helix	trans	-78.6	-39.7	-179.1	-69.9	-14	0	0	0	112.7	N383 L384 I385	N383-N387 WeakPolarHBondContact O-CB 3.48Å; N383-N387 VanDerWaalsContact O-CG 3.24Å; N383-N387 PolarHBondContact O-N 2.87Å; N383-N387 PolarHBondContact O-ND2 3.48Å; L384-N387 PolarHBondContact O-N 3.03Å; I385-N387 PolarHBondContact O-N 3.43Å
388	A	63.5	Low	71.7	Confident	26 Å²	26	90 Å²	90	22%	0.215	43%	0.431	C	S	.	.	H	α-helix	trans	-86.6	-9.5	-176.2	0	0	0	0	0	113.8	L384 L390	L384-A388 HydrophobicContact CD1-CB 4.5Å; L384-A388 WeakPolarHBondContact O-CB 3.39Å; L384-A388 PolarHBondContact O-N 3.04Å; A388-L390 HydrophobicContact CB-CD1 3.79Å; A388-L390 HydrophobicContact CB-CG 3.89Å; A388-L390 PolarHBondContact O-N 3.41Å
389	R	64.4	Low	71.4	Confident	227 Å²	227	88.5 Å²	88.5	86%	0.857	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	46.8	-174.4	-61.2	-175	178.5	-168.7	-1.8	112	I385	I385-R389 WeakPolarHBondContact O-CA 3.26Å; I385-R389 PolarHBondContact O-N 3.39Å
390	L	67.1	Low	71.3	Confident	36 Å²	36	84.9 Å²	84.9	19%	0.188	42%	0.42	C	S	.	.			trans	-88.9	133.9	175.3	-70.6	165.4	0	0	0	109	I385 A388 A392	I385-L390 WeakPolarHBondContact CG2-O 3.19Å; A388-L390 HydrophobicContact CB-CD1 3.79Å; A388-L390 HydrophobicContact CB-CG 3.89Å; A388-L390 PolarHBondContact O-N 3.41Å; L390-A392 PolarHBondContact O-N 2.9Å; L390-A392 VanDerWaalsContact O-N 3.12Å
391	D	63.4	Low	71.2	Confident	123 Å²	123	83 Å²	83	66%	0.658	41%	0.413	S	S	*	.			trans	-79.2	96.6	172.9	-68.2	-39.3	0	0	0	108.3	G404	D391-G404 WeakPolarHBondContact O-CA 3.46Å; D391-G404 PolarHBondContact O-N 2.73Å
392	A	69.2	Low	71.2	Confident	28 Å²	28	84.8 Å²	84.8	23%	0.231	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.7	179.7	0	0	0	0	0	110.7	I385 L390 V401 M403	I385-A392 HydrophobicContact CD1-CB 3.71Å; I385-A392 HydrophobicContact CG1-CB 4.03Å; L390-A392 PolarHBondContact O-N 2.9Å; L390-A392 VanDerWaalsContact O-N 3.12Å; A392-V401 HydrophobicContact CB-CG1 4.3Å; A392-M403 HydrophobicContact CB-CE 4.08Å; A392-M403 HydrophobicContact CB-SD 3.5Å; A392-M403 VanDerWaalsContact CB-SD 3.5Å
393	K	74.3	Confident	71	Confident	146 Å²	146	83.2 Å²	83.2	64%	0.635	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.4	177.1	-169.4	174.3	179.4	-177	0	109.3	V402	K393-V402 PolarHBondContact N-O 2.64Å; K393-V402 PolarHBondContact O-N 2.91Å
394	I	73.6	Confident	70.5	Confident	55 Å²	55	80.7 Å²	80.7	28%	0.282	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	115.7	-179.7	-56.5	172.7	0	0	0	108.3	I363 I381 V382 I385 S396 V401	I363-I394 HydrophobicContact CD1-CG2 4.42Å; I381-I394 HydrophobicContact CG2-CD1 4.32Å; V382-I394 HydrophobicContact CG2-CD1 3.66Å; I385-I394 HydrophobicContact CD1-CD1 4.13Å; I385-I394 HydrophobicContact CD1-CG1 4.37Å; I394-S396 PolarHBondContact O-N 2.95Å; I394-V401 HydrophobicContact CG1-CG1 4.23Å; I394-V401 HydrophobicContact CG1-CG2 4.25Å; I394-V401 HydrophobicContact CG2-CG2 4.36Å
395	D	75.4	Confident	70	Confident	58 Å²	58	85.9 Å²	85.9	31%	0.31	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	79.3	173.9	-68.6	-45.7	0	0	0	109.5	K397 L398 G399 H400	D395-K397 PolarHBondContact O-N 3.44Å; D395-K397 VanDerWaalsContact O-N 3.12Å; D395-L398 PolarHBondContact O-N 3.3Å; D395-L398 VanDerWaalsContact O-N 3.08Å; D395-G399 PolarHBondContact O-N 2.94Å; D395-H400 WeakPolarHBondContact CA-O 3.31Å; D395-H400 WeakPolarHBondContact CB-O 3.46Å; D395-H400 PolarHBondContact N-O 2.78Å; D395-H400 PolarHBondContact O-N 2.87Å
396	S	68.2	Low	69.5	Low	79 Å²	79	90.2 Å²	90.2	55%	0.552	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.3	-178.1	-177.9	0	0	0	0	113.4	E378 I394 L398 G399	E378-S396 PolarHBondContact OE1-OG 3.49Å; I394-S396 PolarHBondContact O-N 2.95Å; S396-L398 PolarHBondContact O-N 3.25Å; S396-G399 PolarHBondContact O-N 3.38Å
397	K	71.1	Confident	69	Low	215 Å²	215	85.2 Å²	85.2	94%	0.935	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.7	177.7	-68.4	-174.9	179.3	-178.7	0	114.5	D395	D395-K397 PolarHBondContact O-N 3.44Å; D395-K397 VanDerWaalsContact O-N 3.12Å
398	L	67.3	Low	69	Low	132 Å²	132	84.2 Å²	84.2	69%	0.691	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-3.5	179.4	-68.7	169.6	0	0	0	111.8	D395 S396 H400	D395-L398 PolarHBondContact O-N 3.3Å; D395-L398 VanDerWaalsContact O-N 3.08Å; S396-L398 PolarHBondContact O-N 3.25Å; L398-H400 VanDerWaalsContact C-N 3.25Å; L398-H400 PolarHBondContact O-CD2 3.24Å; L398-H400 PolarHBondContact O-N 3.33Å
399	G	70.4	Confident	69.7	Low	24 Å²	24	85.4 Å²	85.4	25%	0.247	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.8	28.7	-175.9	0	0	0	0	0	112.9	I363 D395 S396	I363-G399 WeakPolarHBondContact CG1-O 3.47Å; I363-G399 PolarHBondContact N-O 3.05Å; D395-G399 PolarHBondContact O-N 2.94Å; S396-G399 PolarHBondContact O-N 3.38Å
400	H	77.1	Confident	70.6	Confident	78 Å²	78	79 Å²	79	36%	0.361	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.8	-177.9	-66.9	-49.1	0	0	0	112.1	I361 D395 L398	I361-H400 CarbonylContact O-C 3.53Å; I361-H400 VanDerWaalsContact O-CA 3.25Å; I361-H400 WeakPolarHBondContact O-CA 3.39Å; D395-H400 WeakPolarHBondContact CA-O 3.31Å; D395-H400 WeakPolarHBondContact CB-O 3.46Å; D395-H400 PolarHBondContact N-O 2.78Å; D395-H400 PolarHBondContact O-N 2.87Å; L398-H400 VanDerWaalsContact C-N 3.25Å; L398-H400 PolarHBondContact O-CD2 3.24Å; L398-H400 PolarHBondContact O-N 3.33Å
401	V	75.1	Confident	71.5	Confident	2 Å²	2	86.1 Å²	86.1	1%	0.012	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.4	167.4	-175.2	0	0	0	0	107.7	C360 I361 I363 I381 A392 I394 M403	C360-V401 WeakPolarHBondContact CA-O 3.3Å; I361-V401 HydrophobicContact CB-CB 4.34Å; I361-V401 PolarHBondContact N-O 3.13Å; I361-V401 PolarHBondContact O-N 3.44Å; I363-V401 HydrophobicContact CD1-CG2 4.21Å; I363-V401 HydrophobicContact CG1-CG2 3.99Å; I381-V401 HydrophobicContact CD1-CG2 4.17Å; I381-V401 HydrophobicContact CG2-CG2 4.45Å; A392-V401 HydrophobicContact CB-CG1 4.3Å; I394-V401 HydrophobicContact CG1-CG1 4.23Å; I394-V401 HydrophobicContact CG1-CG2 4.25Å; I394-V401 HydrophobicContact CG2-CG2 4.36Å; V401-M403 HydrophobicContact CG1-CE 4Å
402	V	75.3	Confident	72.4	Confident	50 Å²	50	85.6 Å²	85.6	30%	0.303	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	119.3	177.4	-177.4	0	0	0	0	108.8	Q359 K393	Q359-V402 CarbonylContact O-C 3.56Å; Q359-V402 VanDerWaalsContact O-CA 3.3Å; Q359-V402 WeakPolarHBondContact O-CA 3.5Å; K393-V402 PolarHBondContact N-O 2.64Å; K393-V402 PolarHBondContact O-N 2.91Å
403	M	71.7	Confident	73	Confident	25 Å²	25	88.8 Å²	88.8	12%	0.123	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	137.3	174.7	-63.9	-68.3	161.1	0	0	109.9	C355 Q359 I361 A392 V401 N405	C355-M403 HydrophobicContact CB-CE 3.48Å; C355-M403 VanDerWaalsContact CB-CE 3.48Å; C355-M403 HydrophobicContact CB-SD 4.2Å; C355-M403 WeakPolarHBondContact SG-CE 3.34Å; Q359-M403 PolarHBondContact O-N 2.8Å; I361-M403 HydrophobicContact CD1-CE 3.7Å; A392-M403 HydrophobicContact CB-CE 4.08Å; A392-M403 HydrophobicContact CB-SD 3.5Å; A392-M403 VanDerWaalsContact CB-SD 3.5Å; V401-M403 HydrophobicContact CG1-CE 4Å; M403-N405 PolarHBondContact O-N 3.25Å
404	G	67.6	Low	73.6	Confident	34 Å²	34	86 Å²	86	35%	0.351	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-59	132.4	171.9	0	0	0	0	0	109.9	D391 N406	D391-G404 WeakPolarHBondContact O-CA 3.46Å; D391-G404 PolarHBondContact O-N 2.73Å; G404-N406 PolarHBondContact O-N 2.88Å
405	N	61.6	Low	74.2	Confident	120 Å²	120	88.5 Å²	88.5	64%	0.642	48%	0.482	S	S	*	.			trans	-70.3	105.6	-176.6	-159.7	9.1	0	0	0	109.5	M403 A407	M403-N405 PolarHBondContact O-N 3.25Å; N405-A407 PolarHBondContact O-N 3.02Å
406	N	61.1	Low	74.7	Confident	124 Å²	124	91.9 Å²	91.9	66%	0.663	50%	0.496	S	S	*	.			trans	-76.7	44.7	177.4	-72.6	-23.7	0	0	0	112.2	G404 I408	G404-N406 PolarHBondContact O-N 2.88Å; N406-I408 PolarHBondContact O-N 2.99Å
407	A	62.4	Low	75.4	Confident	76 Å²	76	95.1 Å²	95.1	63%	0.628	50%	0.5	S	S	*	.			trans	-73.3	95	173.3	0	0	0	0	0	108.7	N405 S409	N405-A407 PolarHBondContact O-N 3.02Å; A407-S409 PolarHBondContact O-N 3.07Å
408	I	69.6	Low	76.3	Confident	111 Å²	111	88.6 Å²	88.6	57%	0.569	48%	0.478	S	S	*	.			trans	-65.6	111.9	171.4	-55.3	172	0	0	0	107.1	N406 Q412 Q413	N406-I408 PolarHBondContact O-N 2.99Å; I408-Q412 HydrophobicContact CG2-CB 4.44Å; I408-Q413 HydrophobicContact CG2-CG 3.83Å
409	S	77.6	Confident	77.3	Confident	50 Å²	50	89.9 Å²	89.9	35%	0.35	48%	0.478	S	S	.	.			trans	-57.9	134.9	177.7	178.6	0	0	0	0	110.3	A407 Y411 Q412 Q413	A407-S409 PolarHBondContact O-N 3.07Å; S409-Y411 PolarHBondContact O-N 3.5Å; S409-Y411 VanDerWaalsContact O-N 3.12Å; S409-Y411 WeakPolarHBondContact OG-CD2 3.4Å; S409-Y411 PolarHBondContact OG-N 3.32Å; S409-Q412 WeakPolarHBondContact O-CB 3.38Å; S409-Q412 PolarHBondContact O-N 2.91Å; S409-Q413 PolarHBondContact O-N 3.29Å
410	P	84.3	Confident	78.1	Confident	94 Å²	94	91.9 Å²	91.9	61%	0.61	49%	0.488	S	S	*	.	H	α-helix	trans	-53.1	-33.5	174.9	-27.2	34.7	0	0	0	112.8	Q412 Q413 V414	P410-Q412 VanDerWaalsContact C-N 3.29Å; P410-Q412 PolarHBondContact O-N 3.28Å; P410-Q413 PolarHBondContact O-N 3.04Å; P410-V414 WeakPolarHBondContact O-CG2 3.48Å; P410-V414 PolarHBondContact O-N 2.88Å
411	Y	84.8	Confident	78.7	Confident	185 Å²	185	93.7 Å²	93.7	73%	0.725	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-37.7	175.2	-64.3	-71.4	0	0	0	112.4	S409 V414 I415	S409-Y411 PolarHBondContact O-N 3.5Å; S409-Y411 VanDerWaalsContact O-N 3.12Å; S409-Y411 WeakPolarHBondContact OG-CD2 3.4Å; S409-Y411 PolarHBondContact OG-N 3.32Å; Y411-V414 PolarHBondContact O-N 3.12Å; Y411-I415 WeakPolarHBondContact O-CD1 3.22Å; Y411-I415 WeakPolarHBondContact O-CG1 3.45Å; Y411-I415 PolarHBondContact O-N 3.5Å
412	Q	81.9	Confident	79.4	Confident	112 Å²	112	96.5 Å²	96.5	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-70.2	-37.3	178.8	-166.5	147.7	-13	0	0	111.8	I408 S409 P410 V414 I415 E416	I408-Q412 HydrophobicContact CG2-CB 4.44Å; S409-Q412 WeakPolarHBondContact O-CB 3.38Å; S409-Q412 PolarHBondContact O-N 2.91Å; P410-Q412 VanDerWaalsContact C-N 3.29Å; P410-Q412 PolarHBondContact O-N 3.28Å; Q412-V414 VanDerWaalsContact C-N 3.35Å; Q412-V414 PolarHBondContact O-N 3.39Å; Q412-I415 PolarHBondContact O-N 2.93Å; Q412-E416 PolarHBondContact O-N 3.34Å
413	Q	82.1	Confident	80.2	Confident	95 Å²	95	100.5 Å²	100.5	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-64.1	-39.3	172.4	-64.9	-175.9	0.5	0	0	112.3	I408 S409 P410 E416 K417	I408-Q413 HydrophobicContact CG2-CG 3.83Å; S409-Q413 PolarHBondContact O-N 3.29Å; P410-Q413 PolarHBondContact O-N 3.04Å; Q413-E416 PolarHBondContact O-N 3.1Å; Q413-K417 WeakPolarHBondContact O-CG 3.43Å; Q413-K417 PolarHBondContact O-N 3.49Å; Q413-K417 VanDerWaalsContact O-N 3.1Å
414	V	87.8	Confident	81	Confident	87 Å²	87	108.2 Å²	108.2	53%	0.527	56%	0.561	S	S	.	*	H	α-helix	trans	-65.2	-41.4	175.2	173.3	0	0	0	0	110.6	P410 Y411 Q412 T418	P410-V414 WeakPolarHBondContact O-CG2 3.48Å; P410-V414 PolarHBondContact O-N 2.88Å; Y411-V414 PolarHBondContact O-N 3.12Å; Q412-V414 VanDerWaalsContact C-N 3.35Å; Q412-V414 PolarHBondContact O-N 3.39Å; V414-T418 WeakPolarHBondContact O-CB 3.33Å; V414-T418 PolarHBondContact O-N 3.4Å; V414-T418 PolarHBondContact O-OG1 3.31Å
415	I	86.7	Confident	82.1	Confident	108 Å²	108	109.9 Å²	109.9	55%	0.554	57%	0.568	S	S	*	*	H	α-helix	trans	-63.9	-45.8	176.7	-69.6	163.1	0	0	0	110.8	Y411 Q412 K417 T418 K419	Y411-I415 WeakPolarHBondContact O-CD1 3.22Å; Y411-I415 WeakPolarHBondContact O-CG1 3.45Å; Y411-I415 PolarHBondContact O-N 3.5Å; Q412-I415 PolarHBondContact O-N 2.93Å; I415-K417 PolarHBondContact O-N 3.47Å; I415-T418 PolarHBondContact O-N 3.46Å; I415-K419 VanDerWaalsContact O-CB 3.26Å; I415-K419 WeakPolarHBondContact O-CB 3.18Å; I415-K419 PolarHBondContact O-N 2.88Å
416	E	84.5	Confident	83.4	Confident	129 Å²	129	110 Å²	110	60%	0.603	57%	0.565	S	S	*	*	H	α-helix	trans	-60	-47	178.6	-78.7	-177.5	170.9	0	0	112.2	Q412 Q413	Q412-E416 PolarHBondContact O-N 3.34Å; Q413-E416 PolarHBondContact O-N 3.1Å
417	K	84.6	Confident	84.8	Confident	146 Å²	146	108.4 Å²	108.4	64%	0.635	55%	0.554	S	S	*	*	H	α-helix	trans	-63.1	-46.1	176.4	-71.4	179.9	179.7	178.4	0	111.3	Q413 I415 K419 S420 L421	Q413-K417 WeakPolarHBondContact O-CG 3.43Å; Q413-K417 PolarHBondContact O-N 3.49Å; Q413-K417 VanDerWaalsContact O-N 3.1Å; I415-K417 PolarHBondContact O-N 3.47Å; K417-K419 PolarHBondContact O-N 2.82Å; K417-S420 PolarHBondContact O-N 2.7Å; K417-S420 PolarHBondContact O-OG 3.45Å; K417-L421 WeakPolarHBondContact O-CD1 3.26Å; K417-L421 PolarHBondContact O-N 2.81Å
418	T	88.4	Confident	86.1	Confident	78 Å²	78	109.8 Å²	109.8	48%	0.479	55%	0.55	S	S	.	*	H	α-helix	trans	-67.7	-34.3	-177.9	-56.5	0	0	0	0	112.6	V414 I415 S420 L421 S422	V414-T418 WeakPolarHBondContact O-CB 3.33Å; V414-T418 PolarHBondContact O-N 3.4Å; V414-T418 PolarHBondContact O-OG1 3.31Å; I415-T418 PolarHBondContact O-N 3.46Å; T418-S420 VanDerWaalsContact C-N 3.34Å; T418-S420 PolarHBondContact O-N 3.47Å; T418-L421 PolarHBondContact O-N 2.8Å; T418-S422 WeakPolarHBondContact O-CB 3.32Å; T418-S422 PolarHBondContact O-N 3.23Å
419	K	88.6	Confident	87.2	Confident	159 Å²	159	108 Å²	108	69%	0.691	54%	0.544	S	S	*	.	H	α-helix	trans	-61.8	-41.9	179.2	-166.8	173.1	-174.3	177.8	0	111.8	I415 K417 F423	I415-K419 VanDerWaalsContact O-CB 3.26Å; I415-K419 WeakPolarHBondContact O-CB 3.18Å; I415-K419 PolarHBondContact O-N 2.88Å; K417-K419 PolarHBondContact O-N 2.82Å; K419-F423 PolarHBondContact O-N 3.42Å; K419-F423 VanDerWaalsContact O-N 3.09Å
420	S	87.4	Confident	87.7	Confident	66 Å²	66	110.8 Å²	110.8	46%	0.462	55%	0.553	S	S	.	*	H	α-helix	trans	-64.9	-41.6	175.4	75.7	0	0	0	0	112.4	K417 T418 R424	K417-S420 PolarHBondContact O-N 2.7Å; K417-S420 PolarHBondContact O-OG 3.45Å; T418-S420 VanDerWaalsContact C-N 3.34Å; T418-S420 PolarHBondContact O-N 3.47Å; S420-R424 VanDerWaalsContact O-CG 3.32Å; S420-R424 WeakPolarHBondContact O-CG 3.32Å; S420-R424 PolarHBondContact O-N 3.26Å
421	L	90.2	Very high	88	Confident	117 Å²	117	110.2 Å²	110.2	61%	0.613	55%	0.545	S	S	*	.	H	α-helix	trans	-66.7	-44.4	176.6	-94	93.4	0	0	0	111.9	K417 T418 F423 R424 S425	K417-L421 WeakPolarHBondContact O-CD1 3.26Å; K417-L421 PolarHBondContact O-N 2.81Å; T418-L421 PolarHBondContact O-N 2.8Å; L421-F423 VanDerWaalsContact C-N 3.34Å; L421-F423 PolarHBondContact O-N 2.82Å; L421-R424 PolarHBondContact O-N 3.07Å; L421-S425 VanDerWaalsContact O-CB 3.31Å; L421-S425 WeakPolarHBondContact O-CB 3.31Å; L421-S425 PolarHBondContact O-N 3.09Å
422	S	89.8	Confident	88.2	Confident	61 Å²	61	105.8 Å²	105.8	43%	0.427	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-45.4	179.5	-179.4	0	0	0	0	111	T418 S425 Q426	T418-S422 WeakPolarHBondContact O-CB 3.32Å; T418-S422 PolarHBondContact O-N 3.23Å; S422-S425 PolarHBondContact O-N 3.36Å; S422-Q426 WeakPolarHBondContact O-CG 3.44Å; S422-Q426 PolarHBondContact O-N 3.44Å
423	F	90.6	Very high	88.5	Confident	134 Å²	134	106 Å²	106	59%	0.588	53%	0.534	S	S	*	.	H	α-helix	trans	-63.7	-45.2	175.6	-174.2	-100.7	0	0	0	112.5	K419 L421 S425 Q426 M427	K419-F423 PolarHBondContact O-N 3.42Å; K419-F423 VanDerWaalsContact O-N 3.09Å; L421-F423 VanDerWaalsContact C-N 3.34Å; L421-F423 PolarHBondContact O-N 2.82Å; F423-S425 VanDerWaalsContact C-N 3.3Å; F423-S425 PolarHBondContact O-N 2.94Å; F423-Q426 PolarHBondContact O-N 2.96Å; F423-M427 WeakPolarHBondContact O-CB 3.47Å; F423-M427 PolarHBondContact O-N 2.94Å
424	R	89.7	Confident	88.6	Confident	186 Å²	186	108.3 Å²	108.3	70%	0.702	54%	0.542	S	S	*	.	H	α-helix	trans	-63.1	-37.3	176.8	-71.3	179.3	92.5	172.8	7.3	112.1	S420 L421 M427 L428	S420-R424 VanDerWaalsContact O-CG 3.32Å; S420-R424 WeakPolarHBondContact O-CG 3.32Å; S420-R424 PolarHBondContact O-N 3.26Å; L421-R424 PolarHBondContact O-N 3.07Å; R424-M427 PolarHBondContact O-N 3.41Å; R424-L428 WeakPolarHBondContact O-CB 3.35Å; R424-L428 WeakPolarHBondContact O-CG 3.39Å; R424-L428 PolarHBondContact O-N 3.34Å
425	S	90.4	Very high	88.4	Confident	70 Å²	70	111.9 Å²	111.9	49%	0.49	55%	0.551	S	S	.	*	H	α-helix	trans	-66.3	-46.4	176.7	-176.6	0	0	0	0	111.4	L421 S422 F423 M427 L428 V429	L421-S425 VanDerWaalsContact O-CB 3.31Å; L421-S425 WeakPolarHBondContact O-CB 3.31Å; L421-S425 PolarHBondContact O-N 3.09Å; S422-S425 PolarHBondContact O-N 3.36Å; F423-S425 VanDerWaalsContact C-N 3.3Å; F423-S425 PolarHBondContact O-N 2.94Å; S425-M427 VanDerWaalsContact C-N 3.32Å; S425-M427 PolarHBondContact O-N 3.32Å; S425-L428 WeakPolarHBondContact O-CB 3.36Å; S425-L428 PolarHBondContact O-N 3.24Å; S425-V429 WeakPolarHBondContact O-CG2 3.37Å; S425-V429 PolarHBondContact O-N 2.9Å
426	Q	89.4	Confident	88.1	Confident	123 Å²	123	112.5 Å²	112.5	58%	0.575	55%	0.552	S	S	*	*	H	α-helix	trans	-59.6	-41.7	173.5	-75.8	178.6	-18.7	0	0	112.2	S422 F423 V429 M430	S422-Q426 WeakPolarHBondContact O-CG 3.44Å; S422-Q426 PolarHBondContact O-N 3.44Å; F423-Q426 PolarHBondContact O-N 2.96Å; Q426-V429 PolarHBondContact O-N 3.24Å; Q426-M430 PolarHBondContact O-N 3.3Å
427	M	90.1	Very high	87.7	Confident	90 Å²	90	109 Å²	109	44%	0.443	54%	0.544	S	S	.	.	H	α-helix	trans	-68.4	-36	178.7	-153.4	63.3	171.6	0	0	112.4	F423 R424 S425 N431	F423-M427 WeakPolarHBondContact O-CB 3.47Å; F423-M427 PolarHBondContact O-N 2.94Å; R424-M427 PolarHBondContact O-N 3.41Å; S425-M427 VanDerWaalsContact C-N 3.32Å; S425-M427 PolarHBondContact O-N 3.32Å; M427-N431 WeakPolarHBondContact O-CB 3.35Å; M427-N431 PolarHBondContact O-N 2.94Å; M427-N431 PolarHBondContact O-ND2 2.97Å
428	L	90.7	Very high	87.1	Confident	105 Å²	105	104.6 Å²	104.6	55%	0.55	54%	0.535	S	S	.	.	H	α-helix	trans	-64.1	-43.7	171.9	-82.6	162.2	0	0	0	111.5	R424 S425 N431 I432	R424-L428 WeakPolarHBondContact O-CB 3.35Å; R424-L428 WeakPolarHBondContact O-CG 3.39Å; R424-L428 PolarHBondContact O-N 3.34Å; S425-L428 WeakPolarHBondContact O-CB 3.36Å; S425-L428 PolarHBondContact O-N 3.24Å; L428-N431 PolarHBondContact O-N 2.92Å; L428-I432 WeakPolarHBondContact O-CB 3.44Å; L428-I432 VanDerWaalsContact O-CG1 3.22Å; L428-I432 WeakPolarHBondContact O-CG1 3.29Å; L428-I432 PolarHBondContact O-N 3.27Å
429	V	90.6	Very high	86.1	Confident	73 Å²	73	103.7 Å²	103.7	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-58.4	-50.7	175.2	170.9	0	0	0	0	110.4	S425 Q426 N431 I432 E433	S425-V429 WeakPolarHBondContact O-CG2 3.37Å; S425-V429 PolarHBondContact O-N 2.9Å; Q426-V429 PolarHBondContact O-N 3.24Å; V429-N431 VanDerWaalsContact C-N 3.31Å; V429-N431 PolarHBondContact O-N 3.19Å; V429-I432 PolarHBondContact O-N 3.4Å; V429-I432 VanDerWaalsContact O-N 3.17Å; V429-E433 WeakPolarHBondContact O-CG 3.45Å; V429-E433 PolarHBondContact O-N 3.47Å
430	M	89.8	Confident	84.8	Confident	108 Å²	108	101.2 Å²	101.2	53%	0.532	53%	0.527	S	S	.	.	H	α-helix	trans	-58.5	-39.9	176.1	-84.9	-169.3	155.6	0	0	113.2	Q426 K434	Q426-M430 PolarHBondContact O-N 3.3Å; M430-K434 WeakPolarHBondContact O-CB 3.27Å; M430-K434 WeakPolarHBondContact O-CG 3.29Å; M430-K434 PolarHBondContact O-N 2.92Å
431	N	90.6	Very high	83.4	Confident	83 Å²	83	107.8 Å²	107.8	44%	0.444	54%	0.541	S	S	.	.	H	α-helix	trans	-70.2	-35.8	178.6	-75.2	-22.4	0	0	0	112.1	M427 L428 V429 K435	M427-N431 WeakPolarHBondContact O-CB 3.35Å; M427-N431 PolarHBondContact O-N 2.94Å; M427-N431 PolarHBondContact O-ND2 2.97Å; L428-N431 PolarHBondContact O-N 2.92Å; V429-N431 VanDerWaalsContact C-N 3.31Å; V429-N431 PolarHBondContact O-N 3.19Å; N431-K435 VanDerWaalsContact O-CB 3.29Å; N431-K435 WeakPolarHBondContact O-CB 3.48Å; N431-K435 PolarHBondContact O-N 2.81Å
432	I	88.8	Confident	81.7	Confident	91 Å²	91	109.3 Å²	109.3	47%	0.467	55%	0.55	S	S	.	.	H	α-helix	trans	-67.3	-45.1	174.2	-69.7	165.7	0	0	0	110	L428 V429 K434 K435 Q436	L428-I432 WeakPolarHBondContact O-CB 3.44Å; L428-I432 VanDerWaalsContact O-CG1 3.22Å; L428-I432 WeakPolarHBondContact O-CG1 3.29Å; L428-I432 PolarHBondContact O-N 3.27Å; V429-I432 PolarHBondContact O-N 3.4Å; V429-I432 VanDerWaalsContact O-N 3.17Å; I432-K434 PolarHBondContact O-N 3.43Å; I432-K435 PolarHBondContact O-N 3.38Å; I432-Q436 HydrophobicContact CG2-CG 4.43Å; I432-Q436 WeakPolarHBondContact O-CB 3.49Å; I432-Q436 WeakPolarHBondContact O-CG 3.5Å; I432-Q436 PolarHBondContact O-N 3.49Å
433	E	87.6	Confident	79.9	Confident	116 Å²	116	113.2 Å²	113.2	54%	0.542	56%	0.561	S	S	.	*	H	α-helix	trans	-59.9	-44.5	175.4	-75	178.8	165	0	0	111.7	V429 K435 Q436 A437	V429-E433 WeakPolarHBondContact O-CG 3.45Å; V429-E433 PolarHBondContact O-N 3.47Å; E433-K435 PolarHBondContact O-N 3.02Å; E433-Q436 PolarHBondContact O-N 2.88Å; E433-A437 VanDerWaalsContact O-CB 3.27Å; E433-A437 WeakPolarHBondContact O-CB 3.44Å; E433-A437 PolarHBondContact O-N 3.45Å
434	K	85.3	Confident	78	Confident	144 Å²	144	111.6 Å²	111.6	63%	0.626	56%	0.563	S	S	*	*	H	α-helix	trans	-62.9	-41.2	174.5	-77.6	179.7	-179.9	178.8	0	112.3	M430 I432 A437 A438	M430-K434 WeakPolarHBondContact O-CB 3.27Å; M430-K434 WeakPolarHBondContact O-CG 3.29Å; M430-K434 PolarHBondContact O-N 2.92Å; I432-K434 PolarHBondContact O-N 3.43Å; K434-A437 PolarHBondContact O-N 3.47Å; K434-A438 VanDerWaalsContact O-CB 3.29Å; K434-A438 WeakPolarHBondContact O-CB 3.22Å; K434-A438 PolarHBondContact O-N 3.17Å
435	K	83.6	Confident	75.9	Confident	163 Å²	163	107.2 Å²	107.2	71%	0.709	56%	0.558	S	S	*	*	H	α-helix	trans	-66.2	-41.3	177.6	-172.6	-179.3	178.5	-176.2	0	111.3	N431 I432 E433 A438 S439	N431-K435 VanDerWaalsContact O-CB 3.29Å; N431-K435 WeakPolarHBondContact O-CB 3.48Å; N431-K435 PolarHBondContact O-N 2.81Å; I432-K435 PolarHBondContact O-N 3.38Å; E433-K435 PolarHBondContact O-N 3.02Å; K435-A438 PolarHBondContact O-N 2.81Å; K435-S439 WeakPolarHBondContact O-CB 3.46Å; K435-S439 PolarHBondContact O-N 3.24Å
436	Q	79.3	Confident	73.8	Confident	121 Å²	121	112.2 Å²	112.2	57%	0.565	58%	0.579	S	S	*	*	H	α-helix	trans	-67.3	-42.2	175.2	-76.9	-178.8	-21	0	0	111.7	I432 E433 A438 S439 N440	I432-Q436 HydrophobicContact CG2-CG 4.43Å; I432-Q436 WeakPolarHBondContact O-CB 3.49Å; I432-Q436 WeakPolarHBondContact O-CG 3.5Å; I432-Q436 PolarHBondContact O-N 3.49Å; E433-Q436 PolarHBondContact O-N 2.88Å; Q436-A438 VanDerWaalsContact C-N 3.33Å; Q436-A438 PolarHBondContact O-N 2.84Å; Q436-S439 PolarHBondContact O-N 3.14Å; Q436-N440 WeakPolarHBondContact O-CB 3.45Å; Q436-N440 PolarHBondContact O-N 2.86Å
437	A	75.6	Confident	71.9	Confident	55 Å²	55	117.5 Å²	117.5	46%	0.455	59%	0.594	S	S	.	*	H	α-helix	trans	-64.1	-36.3	174.6	0	0	0	0	0	112.6	E433 K434 R441	E433-A437 VanDerWaalsContact O-CB 3.27Å; E433-A437 WeakPolarHBondContact O-CB 3.44Å; E433-A437 PolarHBondContact O-N 3.45Å; K434-A437 PolarHBondContact O-N 3.47Å; A437-R441 WeakPolarHBondContact O-CB 3.43Å; A437-R441 WeakPolarHBondContact O-CG 3.41Å; A437-R441 PolarHBondContact O-N 2.87Å
438	A	72.1	Confident	69.8	Low	53 Å²	53	118.3 Å²	118.3	44%	0.438	62%	0.615	S	S	.	*	H	α-helix	trans	-70.1	-37.9	173.2	0	0	0	0	0	112.3	K434 K435 Q436 R441 N442	K434-A438 VanDerWaalsContact O-CB 3.29Å; K434-A438 WeakPolarHBondContact O-CB 3.22Å; K434-A438 PolarHBondContact O-N 3.17Å; K435-A438 PolarHBondContact O-N 2.81Å; Q436-A438 VanDerWaalsContact C-N 3.33Å; Q436-A438 PolarHBondContact O-N 2.84Å; A438-R441 PolarHBondContact O-N 3.44Å; A438-N442 PolarHBondContact O-N 3.09Å; A438-N442 VanDerWaalsContact O-N 3.09Å
439	S	67.4	Low	67.8	Low	60 Å²	60	116.5 Å²	116.5	42%	0.42	62%	0.622	S	S	.	*	H	α-helix	trans	-63.4	-46	173.1	-156.2	0	0	0	0	111.1	K435 Q436 R441 N442 E443	K435-S439 WeakPolarHBondContact O-CB 3.46Å; K435-S439 PolarHBondContact O-N 3.24Å; Q436-S439 PolarHBondContact O-N 3.14Å; S439-R441 VanDerWaalsContact C-N 3.32Å; S439-R441 PolarHBondContact O-N 2.98Å; S439-N442 PolarHBondContact O-N 3.39Å; S439-N442 VanDerWaalsContact O-N 3.12Å; S439-E443 PolarHBondContact O-N 3.39Å
440	N	61.6	Low	65.8	Low	107 Å²	107	121.8 Å²	121.8	57%	0.572	64%	0.642	S	S	*	*	H	α-helix	trans	-65.2	-31.9	176.8	-78.5	7.9	0	0	0	112.9	Q436 E443 T444	Q436-N440 WeakPolarHBondContact O-CB 3.45Å; Q436-N440 PolarHBondContact O-N 2.86Å; N440-E443 PolarHBondContact O-N 3.43Å; N440-T444 PolarHBondContact O-N 2.87Å
441	R	58.3	Low	63.3	Low	204 Å²	204	126.1 Å²	126.1	77%	0.77	66%	0.661	S	S	*	*	H	α-helix	trans	-70.6	-30.1	172.4	-84.5	-177.4	173.4	-176.5	-1.8	113.3	A437 A438 S439 T444	A437-R441 WeakPolarHBondContact O-CB 3.43Å; A437-R441 WeakPolarHBondContact O-CG 3.41Å; A437-R441 PolarHBondContact O-N 2.87Å; A438-R441 PolarHBondContact O-N 3.44Å; S439-R441 VanDerWaalsContact C-N 3.32Å; S439-R441 PolarHBondContact O-N 2.98Å; R441-T444 PolarHBondContact O-OG1 3.12Å
442	N	55.3	Low	60.8	Low	148 Å²	148	126.2 Å²	126.2	79%	0.791	68%	0.681	S	S	*	*	H	α-helix	trans	-79.9	-21.9	173.7	-89.9	2.3	0	0	0	112.9	A438 S439	A438-N442 PolarHBondContact O-N 3.09Å; A438-N442 VanDerWaalsContact O-N 3.09Å; S439-N442 PolarHBondContact O-N 3.39Å; S439-N442 VanDerWaalsContact O-N 3.12Å
443	E	52.3	Low	58.2	Low	143 Å²	143	125.4 Å²	125.4	67%	0.668	70%	0.696	S	S	*	*	H	α-helix	trans	-83.8	-10.5	176.4	-77.5	-175.1	177.9	0	0	114.2	S439 N440 P445	S439-E443 PolarHBondContact O-N 3.39Å; N440-E443 PolarHBondContact O-N 3.43Å; E443-P445 VanDerWaalsContact O-CD 3.23Å; E443-P445 WeakPolarHBondContact O-CD 3.23Å
444	T	50.7	Low	55.8	Low	101 Å²	101	133.7 Å²	133.7	62%	0.62	73%	0.731	S	S	*	*	S	Bend	trans	-89.2	103	166.1	48.4	0	0	0	0	109.8	N440 R441 N446	N440-T444 PolarHBondContact O-N 2.87Å; R441-T444 PolarHBondContact O-OG1 3.12Å; T444-N446 PolarHBondContact O-N 3.47Å
445	P	44.4	Very low	54.4	Low	93 Å²	93	133.2 Å²	133.2	60%	0.604	74%	0.736	S	S	*	*			trans	-69	134.3	175.2	-8.2	26.5	0	0	0	108.4	E443 W447	E443-P445 VanDerWaalsContact O-CD 3.23Å; E443-P445 WeakPolarHBondContact O-CD 3.23Å; P445-W447 PolarHBondContact O-N 2.76Å
446	N	47.2	Very low	52.8	Low	175 Å²	175	131.6 Å²	131.6	94%	0.936	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	29.2	177.4	-147.7	25	0	0	0	113.5	T444	T444-N446 PolarHBondContact O-N 3.47Å
447	W	49.4	Very low	51.3	Low	234 Å²	234	132.2 Å²	132.2	89%	0.886	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.3	-10.3	-176.6	-79.6	93	0	0	0	113.6	P445 G449	P445-W447 PolarHBondContact O-N 2.76Å; W447-G449 PolarHBondContact O-N 3.07Å
448	A	46.1	Very low	49.9	Very low	107 Å²	107	136.7 Å²	136.7	88%	0.884	76%	0.764	S	S	*	*	S	Bend	trans	-84.6	35.4	179	0	0	0	0	0	113.3
449	G	48.7	Very low	48.5	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	78%	0.784	S	S	*	*	S	Bend	trans	-141.6	32.9	-174.5	0	0	0	0	0	113.4	W447	W447-G449 PolarHBondContact O-N 3.07Å
450	Q	48	Very low	47.3	Very low	183 Å²	183	147.4 Å²	147.4	86%	0.855	81%	0.809	S	S	*	*			trans	-160	137.1	162.1	-114.4	165.2	22	0	0	110.2
451	E	36.7	Very low	46.3	Very low	200 Å²	200	150.3 Å²	150.3	94%	0.935	83%	0.825	S	S	*	*			trans	81.3	115.5	178.8	-51.7	-172.3	165	0	0	115.3
452	G	37.7	Very low	45.3	Very low	84 Å²	84	146.2 Å²	146.2	87%	0.866	83%	0.83	S	S	*	*			cis	172.4	151.5	4.5	0	0	0	0	0	108.1
453	G	34	Very low	44.5	Very low	75 Å²	75	146 Å²	146	77%	0.773	83%	0.833	S	S	*	*			trans	179.1	88.2	177.2	0	0	0	0	0	112.5
454	F	38.7	Very low	43.8	Very low	289 Å²	289	146.3 Å²	146.3	100%	1.268	85%	0.848	S	S	*	*			trans	-3.7	0	160.8	-73.3	-90.7	0	0	0	119.9

Retrieved 454 of 454 residues in 304.2 ms (Link to these results)

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