A0A093GV63_STRCA Loading...

Parathyroid hormone

Parathyroid hormone elevates calcium level by dissolving the salts in bone and preventing their renal excretion. Acts by binding to its receptor, PTH1R, activating G protein-coupled receptor signaling. Stimulates [1-14C]-2-deoxy-D-glucose (2DG) transport and glycogen synthesis in osteoblastic cells.

AlphaFold DB , UniProt , Accession A0A093GV63, Species STRCA (Struthio camelus australis), Gene n/a, Length 119 aa.

						>A0A093GV63_STRCA|A0A093GV63
MTSIKNLAKTAIILYAVCFFTKSEGRPMMKRSVSEMQLMHNLGEHRHTVERQDWLQMKLQDVHSALEDARTQRPRNKDDIVLREIRSRRLLPEHLRATMQKKSIDLDKAYMDVLFKTKP
					

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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	55.2	Low	83.2	Confident	242 Å²	242	111.7 Å²	111.7	100%	1.192	61%	0.608	S	S	*	*				0	110.9	0	-73.2	147.8	85.7	0	0	108.2	S3	M1-S3 PolarHBondContact O-N 3.32Å
2	T	70.6	Confident	84	Confident	117 Å²	117	112.3 Å²	112.3	72%	0.718	61%	0.608	S	S	*	*			trans	-65.6	123.1	177.4	44.5	0	0	0	0	109.2	I4	T2-I4 PolarHBondContact O-N 3.13Å
3	S	82.8	Confident	84.5	Confident	59 Å²	59	112.2 Å²	112.2	41%	0.413	61%	0.605	S	S	.	*			trans	-53.2	137.8	177.7	-177.8	0	0	0	0	110.7	M1 K5 N6 L7	M1-S3 PolarHBondContact O-N 3.32Å; S3-K5 PolarHBondContact O-N 3.46Å; S3-N6 WeakPolarHBondContact O-CA 3.38Å; S3-N6 WeakPolarHBondContact O-CB 3.42Å; S3-N6 PolarHBondContact O-N 2.79Å; S3-L7 PolarHBondContact O-N 3.03Å; S3-L7 VanDerWaalsContact O-N 3.13Å
4	I	86.6	Confident	85	Confident	142 Å²	142	112.3 Å²	112.3	73%	0.728	60%	0.604	S	S	*	*	H	α-helix	trans	-51	-33.1	178.1	-65.6	165.5	0	0	0	111.4	T2 N6 L7 A8	T2-I4 PolarHBondContact O-N 3.13Å; I4-N6 VanDerWaalsContact C-N 3.33Å; I4-N6 PolarHBondContact O-N 2.78Å; I4-L7 PolarHBondContact O-N 2.96Å; I4-A8 PolarHBondContact O-N 3.06Å
5	K	83.9	Confident	85.2	Confident	159 Å²	159	116.1 Å²	116.1	69%	0.691	61%	0.608	S	S	*	*	H	α-helix	trans	-62.3	-38.6	175.4	-61.4	-178.7	-178	-179.4	0	112.5	S3 K9	S3-K5 PolarHBondContact O-N 3.46Å; K5-K9 WeakPolarHBondContact O-CG 3.47Å; K5-K9 PolarHBondContact O-N 3.39Å
6	N	87.6	Confident	85.2	Confident	86 Å²	86	111.3 Å²	111.3	46%	0.46	59%	0.591	S	S	.	*	H	α-helix	trans	-73.8	-37.1	177	-63.9	-30.3	0	0	0	110.8	S3 I4 K9 T10	S3-N6 WeakPolarHBondContact O-CA 3.38Å; S3-N6 WeakPolarHBondContact O-CB 3.42Å; S3-N6 PolarHBondContact O-N 2.79Å; I4-N6 VanDerWaalsContact C-N 3.33Å; I4-N6 PolarHBondContact O-N 2.78Å; N6-K9 PolarHBondContact O-N 3.36Å; N6-T10 WeakPolarHBondContact O-CG2 3.32Å; N6-T10 PolarHBondContact O-N 3.21Å; N6-T10 PolarHBondContact O-OG1 3.48Å; N6-T10 VanDerWaalsContact O-OG1 3.06Å
7	L	89.3	Confident	85.3	Confident	106 Å²	106	109.5 Å²	109.5	56%	0.555	58%	0.584	S	S	*	*	H	α-helix	trans	-62.9	-42.9	175.1	-174.2	64.1	0	0	0	112.1	S3 I4 T10 A11	S3-L7 PolarHBondContact O-N 3.03Å; S3-L7 VanDerWaalsContact O-N 3.13Å; I4-L7 PolarHBondContact O-N 2.96Å; L7-T10 VanDerWaalsContact CA-OG1 3.32Å; L7-T10 WeakPolarHBondContact CA-OG1 3.24Å; L7-T10 PolarHBondContact O-N 3.27Å; L7-T10 PolarHBondContact O-OG1 2.89Å; L7-A11 WeakPolarHBondContact O-CB 3.26Å; L7-A11 PolarHBondContact O-N 2.85Å
8	A	88.8	Confident	85.1	Confident	50 Å²	50	106.7 Å²	106.7	41%	0.413	57%	0.574	S	S	.	*	H	α-helix	trans	-63.2	-44.2	176	0	0	0	0	0	111.9	I4 T10 A11 I12	I4-A8 PolarHBondContact O-N 3.06Å; A8-T10 PolarHBondContact O-N 3.44Å; A8-A11 PolarHBondContact O-N 3.45Å; A8-I12 VanDerWaalsContact O-CG1 3.29Å; A8-I12 WeakPolarHBondContact O-CG1 3.32Å; A8-I12 PolarHBondContact O-N 3.48Å
9	K	89.3	Confident	84.8	Confident	133 Å²	133	106.4 Å²	106.4	58%	0.578	57%	0.567	S	S	*	*	H	α-helix	trans	-60	-45.9	175.5	-73.9	175.7	-178.5	-178.6	0	111.8	K5 N6 A11 I12 I13	K5-K9 WeakPolarHBondContact O-CG 3.47Å; K5-K9 PolarHBondContact O-N 3.39Å; N6-K9 PolarHBondContact O-N 3.36Å; K9-A11 VanDerWaalsContact C-N 3.32Å; K9-A11 PolarHBondContact O-N 3.25Å; K9-I12 PolarHBondContact O-N 3.47Å; K9-I13 WeakPolarHBondContact O-CD1 3.26Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.29Å; K9-I13 PolarHBondContact O-N 2.86Å
10	T	90.6	Very high	84.2	Confident	82 Å²	82	107.9 Å²	107.9	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-64.3	-37	177.2	47.9	0	0	0	0	112.3	N6 L7 A8 I13 L14	N6-T10 WeakPolarHBondContact O-CG2 3.32Å; N6-T10 PolarHBondContact O-N 3.21Å; N6-T10 PolarHBondContact O-OG1 3.48Å; N6-T10 VanDerWaalsContact O-OG1 3.06Å; L7-T10 VanDerWaalsContact CA-OG1 3.32Å; L7-T10 WeakPolarHBondContact CA-OG1 3.24Å; L7-T10 PolarHBondContact O-N 3.27Å; L7-T10 PolarHBondContact O-OG1 2.89Å; A8-T10 PolarHBondContact O-N 3.44Å; T10-I13 PolarHBondContact O-N 2.92Å; T10-L14 VanDerWaalsContact O-CB 3.24Å; T10-L14 WeakPolarHBondContact O-CB 3.48Å; T10-L14 PolarHBondContact O-N 3.4Å
11	A	91.1	Very high	83.8	Confident	53 Å²	53	106.8 Å²	106.8	44%	0.438	57%	0.567	S	S	.	*	H	α-helix	trans	-66.6	-40	177.1	0	0	0	0	0	112.3	L7 A8 K9 L14 Y15	L7-A11 WeakPolarHBondContact O-CB 3.26Å; L7-A11 PolarHBondContact O-N 2.85Å; A8-A11 PolarHBondContact O-N 3.45Å; K9-A11 VanDerWaalsContact C-N 3.32Å; K9-A11 PolarHBondContact O-N 3.25Å; A11-L14 PolarHBondContact O-N 3.26Å; A11-Y15 VanDerWaalsContact O-CB 3.26Å; A11-Y15 WeakPolarHBondContact O-CB 3.39Å; A11-Y15 PolarHBondContact O-N 2.93Å
12	I	91.8	Very high	84.5	Confident	118 Å²	118	103.5 Å²	103.5	61%	0.605	55%	0.546	S	S	*	.	H	α-helix	trans	-65.6	-44.7	176.4	-66.2	162.8	0	0	0	110.9	A8 K9 Y15 A16	A8-I12 VanDerWaalsContact O-CG1 3.29Å; A8-I12 WeakPolarHBondContact O-CG1 3.32Å; A8-I12 PolarHBondContact O-N 3.48Å; K9-I12 PolarHBondContact O-N 3.47Å; I12-Y15 PolarHBondContact O-N 2.98Å; I12-A16 WeakPolarHBondContact O-CB 3.27Å; I12-A16 PolarHBondContact O-N 3.2Å
13	I	91.4	Very high	84.1	Confident	112 Å²	112	99.7 Å²	99.7	57%	0.574	52%	0.524	S	S	*	.	H	α-helix	trans	-62.8	-46	177.6	-65.9	164.5	0	0	0	110.1	K9 T10 Y15 A16 V17	K9-I13 WeakPolarHBondContact O-CD1 3.26Å; K9-I13 VanDerWaalsContact O-CG1 3.27Å; K9-I13 WeakPolarHBondContact O-CG1 3.29Å; K9-I13 PolarHBondContact O-N 2.86Å; T10-I13 PolarHBondContact O-N 2.92Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.5Å; I13-A16 PolarHBondContact O-N 2.95Å; I13-V17 WeakPolarHBondContact O-CG2 3.48Å; I13-V17 PolarHBondContact O-N 3.31Å
14	L	91	Very high	82.9	Confident	113 Å²	113	105 Å²	105	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-61	-42.8	176.7	-175.8	64.1	0	0	0	111.3	T10 A11 A16 V17 C18	T10-L14 VanDerWaalsContact O-CB 3.24Å; T10-L14 WeakPolarHBondContact O-CB 3.48Å; T10-L14 PolarHBondContact O-N 3.4Å; A11-L14 PolarHBondContact O-N 3.26Å; L14-A16 PolarHBondContact O-N 3.44Å; L14-V17 PolarHBondContact O-N 2.89Å; L14-C18 VanDerWaalsContact O-CB 3.26Å; L14-C18 WeakPolarHBondContact O-CB 3.34Å; L14-C18 PolarHBondContact O-N 3.05Å; L14-C18 PolarHBondContact O-SG 2.91Å
15	Y	87.4	Confident	81.5	Confident	170 Å²	170	101.6 Å²	101.6	67%	0.667	54%	0.542	S	S	*	.	H	α-helix	trans	-62.2	-42.6	176.4	-175.1	-99	0	0	0	112	A11 I12 I13 C18 F19	A11-Y15 VanDerWaalsContact O-CB 3.26Å; A11-Y15 WeakPolarHBondContact O-CB 3.39Å; A11-Y15 PolarHBondContact O-N 2.93Å; I12-Y15 PolarHBondContact O-N 2.98Å; I13-Y15 VanDerWaalsContact C-N 3.32Å; I13-Y15 PolarHBondContact O-N 3.5Å; Y15-C18 PolarHBondContact O-N 2.8Å; Y15-F19 VanDerWaalsContact O-CB 3.31Å; Y15-F19 WeakPolarHBondContact O-CB 3.26Å; Y15-F19 PolarHBondContact O-N 3.41Å
16	A	86.3	Confident	80.1	Confident	39 Å²	39	103.8 Å²	103.8	32%	0.322	55%	0.546	S	S	.	.	H	α-helix	trans	-62.2	-49.4	175.7	0	0	0	0	0	111.5	I12 I13 L14 C18 F19 F20	I12-A16 WeakPolarHBondContact O-CB 3.27Å; I12-A16 PolarHBondContact O-N 3.2Å; I13-A16 PolarHBondContact O-N 2.95Å; L14-A16 PolarHBondContact O-N 3.44Å; A16-C18 PolarHBondContact O-N 3.07Å; A16-F19 WeakPolarHBondContact O-CB 3.41Å; A16-F19 PolarHBondContact O-N 2.88Å; A16-F19 VanDerWaalsContact O-N 3.14Å; A16-F20 WeakPolarHBondContact O-CD2 3.36Å; A16-F20 PolarHBondContact O-N 2.85Å
17	V	86.3	Confident	78.5	Confident	80 Å²	80	103.8 Å²	103.8	49%	0.485	55%	0.551	S	S	.	*	H	α-helix	trans	-61.5	-43	177.9	174.3	0	0	0	0	111.3	I13 L14 F19 F20 T21	I13-V17 WeakPolarHBondContact O-CG2 3.48Å; I13-V17 PolarHBondContact O-N 3.31Å; L14-V17 PolarHBondContact O-N 2.89Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.35Å; V17-F20 PolarHBondContact O-N 3.44Å; V17-T21 HydrophobicContact CG1-CG2 4.31Å; V17-T21 WeakPolarHBondContact O-CB 3.13Å; V17-T21 VanDerWaalsContact O-CG2 3.26Å; V17-T21 WeakPolarHBondContact O-CG2 3.07Å; V17-T21 PolarHBondContact O-N 2.95Å; V17-T21 PolarHBondContact O-OG1 2.67Å
18	C	82.1	Confident	76.8	Confident	59 Å²	59	105.9 Å²	105.9	40%	0.399	56%	0.559	S	S	.	*	H	α-helix	trans	-62.1	-38.8	174.2	-73.7	0	0	0	0	112.2	L14 Y15 A16 T21 K22	L14-C18 VanDerWaalsContact O-CB 3.26Å; L14-C18 WeakPolarHBondContact O-CB 3.34Å; L14-C18 PolarHBondContact O-N 3.05Å; L14-C18 PolarHBondContact O-SG 2.91Å; Y15-C18 PolarHBondContact O-N 2.8Å; A16-C18 PolarHBondContact O-N 3.07Å; C18-T21 WeakPolarHBondContact CA-OG1 3.24Å; C18-T21 PolarHBondContact O-OG1 3Å; C18-T21 VanDerWaalsContact O-OG1 3.07Å; C18-K22 VanDerWaalsContact O-CB 3.24Å; C18-K22 WeakPolarHBondContact O-CB 3.34Å; C18-K22 WeakPolarHBondContact O-CG 3.42Å; C18-K22 PolarHBondContact O-N 3.34Å
19	F	79.3	Confident	75.3	Confident	102 Å²	102	110.5 Å²	110.5	45%	0.447	57%	0.574	S	S	.	*	H	α-helix	trans	-67.1	-46.4	176.7	-175.4	-96.1	0	0	0	111.6	Y15 A16 V17 K22 S23 M28	Y15-F19 VanDerWaalsContact O-CB 3.31Å; Y15-F19 WeakPolarHBondContact O-CB 3.26Å; Y15-F19 PolarHBondContact O-N 3.41Å; A16-F19 WeakPolarHBondContact O-CB 3.41Å; A16-F19 PolarHBondContact O-N 2.88Å; A16-F19 VanDerWaalsContact O-N 3.14Å; V17-F19 VanDerWaalsContact C-N 3.33Å; V17-F19 PolarHBondContact O-N 3.35Å; F19-K22 PolarHBondContact O-N 3.34Å; F19-S23 WeakPolarHBondContact O-CB 3.48Å; F19-S23 PolarHBondContact O-N 3.46Å; F19-S23 PolarHBondContact O-OG 3.14Å; F19-M28 HydrophobicContact CE1-SD 3.9Å; F19-M28 HydrophobicContact CZ-SD 3.92Å
20	F	73.7	Confident	73.7	Confident	136 Å²	136	113.5 Å²	113.5	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-61	-48.8	176.7	-82.8	-71.6	0	0	0	111.7	A16 V17 K22 S23 E24	A16-F20 WeakPolarHBondContact O-CD2 3.36Å; A16-F20 PolarHBondContact O-N 2.85Å; V17-F20 PolarHBondContact O-N 3.44Å; F20-K22 VanDerWaalsContact C-N 3.3Å; F20-K22 PolarHBondContact O-N 3.46Å; F20-S23 WeakPolarHBondContact CA-OG 3.31Å; F20-S23 PolarHBondContact O-N 3.32Å; F20-S23 PolarHBondContact O-OG 3.01Å; F20-E24 PolarHBondContact O-N 3.44Å
21	T	75.4	Confident	71.9	Confident	85 Å²	85	118.7 Å²	118.7	52%	0.521	60%	0.598	S	S	.	*	H	α-helix	trans	-65.4	-29.6	178.5	53.2	0	0	0	0	113.5	V17 C18	V17-T21 HydrophobicContact CG1-CG2 4.31Å; V17-T21 WeakPolarHBondContact O-CB 3.13Å; V17-T21 VanDerWaalsContact O-CG2 3.26Å; V17-T21 WeakPolarHBondContact O-CG2 3.07Å; V17-T21 PolarHBondContact O-N 2.95Å; V17-T21 PolarHBondContact O-OG1 2.67Å; C18-T21 WeakPolarHBondContact CA-OG1 3.24Å; C18-T21 PolarHBondContact O-OG1 3Å; C18-T21 VanDerWaalsContact O-OG1 3.07Å
22	K	68.3	Low	70.3	Confident	173 Å²	173	119 Å²	119	75%	0.752	60%	0.597	S	S	*	*	H	α-helix	trans	-78.6	-19.3	172.1	-70.3	-75.2	-177.7	177.3	0	113.1	C18 F19 F20	C18-K22 VanDerWaalsContact O-CB 3.24Å; C18-K22 WeakPolarHBondContact O-CB 3.34Å; C18-K22 WeakPolarHBondContact O-CG 3.42Å; C18-K22 PolarHBondContact O-N 3.34Å; F19-K22 PolarHBondContact O-N 3.34Å; F20-K22 VanDerWaalsContact C-N 3.3Å; F20-K22 PolarHBondContact O-N 3.46Å
23	S	62.3	Low	68.5	Low	37 Å²	37	118.5 Å²	118.5	26%	0.259	60%	0.599	S	S	.	*	H	α-helix	trans	-85.4	-12.3	179.1	74.2	0	0	0	0	114.2	F19 F20 G25 R26	F19-S23 WeakPolarHBondContact O-CB 3.48Å; F19-S23 PolarHBondContact O-N 3.46Å; F19-S23 PolarHBondContact O-OG 3.14Å; F20-S23 WeakPolarHBondContact CA-OG 3.31Å; F20-S23 PolarHBondContact O-N 3.32Å; F20-S23 PolarHBondContact O-OG 3.01Å; S23-G25 PolarHBondContact O-N 3.04Å; S23-R26 PolarHBondContact O-N 2.84Å
24	E	59.3	Low	67.1	Low	169 Å²	169	116.3 Å²	116.3	79%	0.79	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.7	-9.4	177	-71.1	-82.1	146.4	0	0	115.1	F20	F20-E24 PolarHBondContact O-N 3.44Å
25	G	55.4	Low	66	Low	71 Å²	71	115.2 Å²	115.2	73%	0.732	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133	4	176.1	0	0	0	0	0	115.6	S23	S23-G25 PolarHBondContact O-N 3.04Å
26	R	56.3	Low	65	Low	205 Å²	205	114.6 Å²	114.6	77%	0.774	59%	0.591	S	S	*	*	S	Bend	trans	-119.7	112.3	177.6	-70.8	-171.5	-168.9	-111.7	1.2	109.1	S23 M28	S23-R26 PolarHBondContact O-N 2.84Å; R26-M28 PolarHBondContact O-N 3.2Å
27	P	52.8	Low	64	Low	87 Å²	87	118.1 Å²	118.1	57%	0.565	60%	0.601	S	S	*	*			trans	-62.9	111.7	174.8	28.4	-33.1	0	0	0	107.5	M29	P27-M29 CarbonylContact C-O 3.48Å; P27-M29 WeakPolarHBondContact CB-O 3.4Å; P27-M29 CarbonylContact O-C 3.33Å; P27-M29 PolarHBondContact O-N 2.95Å; P27-M29 VanDerWaalsContact O-O 3.09Å
28	M	54.5	Low	63.2	Low	149 Å²	149	119.2 Å²	119.2	73%	0.734	60%	0.603	S	S	*	*	S	Bend	trans	-67.8	-11.1	179.7	-167.2	152.9	68.2	0	0	112	F19 R26	F19-M28 HydrophobicContact CE1-SD 3.9Å; F19-M28 HydrophobicContact CZ-SD 3.92Å; R26-M28 PolarHBondContact O-N 3.2Å
29	M	56.2	Low	62.7	Low	148 Å²	148	122.7 Å²	122.7	73%	0.729	62%	0.615	S	S	*	*	S	Bend	trans	-91.7	118.2	154.6	-106.2	68.9	159.7	0	0	107.8	P27 R31	P27-M29 CarbonylContact C-O 3.48Å; P27-M29 WeakPolarHBondContact CB-O 3.4Å; P27-M29 CarbonylContact O-C 3.33Å; P27-M29 PolarHBondContact O-N 2.95Å; P27-M29 VanDerWaalsContact O-O 3.09Å; M29-R31 PolarHBondContact O-N 2.67Å
30	K	55.3	Low	62.3	Low	196 Å²	196	123.1 Å²	123.1	85%	0.852	62%	0.618	S	S	*	*			trans	-45.8	122.4	151.5	-64	179.1	179.5	178.7	0	105.4	S32	K30-S32 VanDerWaalsContact C-N 3.26Å; K30-S32 PolarHBondContact O-N 3.04Å
31	R	54.3	Low	61.8	Low	190 Å²	190	121.3 Å²	121.3	72%	0.717	62%	0.615	S	S	*	*			trans	-49.3	99	175.9	-71.3	-161.7	177.5	114.4	-0.4	107.2	M29	M29-R31 PolarHBondContact O-N 2.67Å
32	S	56.4	Low	61.1	Low	60 Å²	60	121.9 Å²	121.9	42%	0.42	61%	0.614	S	S	.	*			trans	-67.4	143.2	178.3	44.5	0	0	0	0	105	K30 S34 E35	K30-S32 VanDerWaalsContact C-N 3.26Å; K30-S32 PolarHBondContact O-N 3.04Å; S32-S34 WeakPolarHBondContact CB-OG 3.37Å; S32-S34 PolarHBondContact O-N 3.45Å; S32-S34 PolarHBondContact OG-OG 2.86Å; S32-E35 PolarHBondContact O-N 3.4Å
33	V	55.5	Low	60.8	Low	107 Å²	107	115 Å²	115	65%	0.648	59%	0.592	S	S	*	*	H	α-helix	trans	-48.7	-23	178.9	177.2	0	0	0	0	111.8	E35 M36 Q37	V33-E35 PolarHBondContact O-N 3.29Å; V33-M36 PolarHBondContact O-N 3.38Å; V33-Q37 HydrophobicContact CG1-CG 4.16Å; V33-Q37 WeakPolarHBondContact O-CB 3.45Å; V33-Q37 WeakPolarHBondContact O-CG 3.42Å; V33-Q37 PolarHBondContact O-N 2.69Å
34	S	61.8	Low	60.7	Low	67 Å²	67	118.8 Å²	118.8	47%	0.469	61%	0.606	S	S	.	*	H	α-helix	trans	-56.7	-32.5	170.7	67.9	0	0	0	0	115.8	S32 L38	S32-S34 WeakPolarHBondContact CB-OG 3.37Å; S32-S34 PolarHBondContact O-N 3.45Å; S32-S34 PolarHBondContact OG-OG 2.86Å; S34-L38 WeakPolarHBondContact O-CB 3.49Å; S34-L38 PolarHBondContact O-N 2.99Å
35	E	66.9	Low	60.6	Low	89 Å²	89	116.6 Å²	116.6	42%	0.416	60%	0.595	S	S	.	*	H	α-helix	trans	-74.5	-42.1	179.3	-170.8	-176.5	170	0	0	110.8	S32 V33 L38 M39	S32-E35 PolarHBondContact O-N 3.4Å; V33-E35 PolarHBondContact O-N 3.29Å; E35-L38 WeakPolarHBondContact O-CB 3.5Å; E35-L38 PolarHBondContact O-N 2.84Å; E35-M39 WeakPolarHBondContact O-CB 3.36Å; E35-M39 WeakPolarHBondContact O-CG 3.29Å; E35-M39 PolarHBondContact O-N 3.31Å
36	M	66.8	Low	60.7	Low	158 Å²	158	121.6 Å²	121.6	78%	0.778	59%	0.592	S	S	*	*	H	α-helix	trans	-68.7	-38.4	176.3	-169.4	162.9	-165.2	0	0	111.6	V33 M39 H40	V33-M36 PolarHBondContact O-N 3.38Å; M36-M39 PolarHBondContact O-N 3.35Å; M36-H40 WeakPolarHBondContact O-CB 3.5Å; M36-H40 PolarHBondContact O-N 3.38Å
37	Q	65.9	Low	60.6	Low	113 Å²	113	117.4 Å²	117.4	53%	0.528	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-37.6	171.6	-73.8	173.6	-28	0	0	112.2	V33 H40 N41	V33-Q37 HydrophobicContact CG1-CG 4.16Å; V33-Q37 WeakPolarHBondContact O-CB 3.45Å; V33-Q37 WeakPolarHBondContact O-CG 3.42Å; V33-Q37 PolarHBondContact O-N 2.69Å; Q37-H40 PolarHBondContact O-N 3.05Å; Q37-N41 WeakPolarHBondContact O-CB 3.41Å; Q37-N41 VanDerWaalsContact O-CG 3.25Å; Q37-N41 PolarHBondContact O-N 3.26Å; Q37-N41 PolarHBondContact O-ND2 2.82Å
38	L	68.6	Low	60.8	Low	103 Å²	103	116.2 Å²	116.2	54%	0.539	57%	0.572	S	S	.	*	H	α-helix	trans	-63.3	-44.6	174.1	178.8	65.7	0	0	0	111	S34 E35 H40 N41 L42	S34-L38 WeakPolarHBondContact O-CB 3.49Å; S34-L38 PolarHBondContact O-N 2.99Å; E35-L38 WeakPolarHBondContact O-CB 3.5Å; E35-L38 PolarHBondContact O-N 2.84Å; L38-H40 VanDerWaalsContact C-N 3.35Å; L38-N41 PolarHBondContact O-N 3.44Å; L38-L42 HydrophobicContact CD1-CD1 4.18Å; L38-L42 HydrophobicContact CG-CD1 3.91Å; L38-L42 VanDerWaalsContact O-CB 3.29Å; L38-L42 WeakPolarHBondContact O-CB 3.47Å; L38-L42 WeakPolarHBondContact O-CD1 3.35Å; L38-L42 WeakPolarHBondContact O-CG 3.07Å; L38-L42 PolarHBondContact O-N 2.99Å
39	M	72.3	Confident	61.1	Low	131 Å²	131	112.4 Å²	112.4	65%	0.645	56%	0.557	S	S	*	*	H	α-helix	trans	-65.8	-36.2	175.8	-72.6	-161	72.6	0	0	112.7	E35 M36 G43	E35-M39 WeakPolarHBondContact O-CB 3.36Å; E35-M39 WeakPolarHBondContact O-CG 3.29Å; E35-M39 PolarHBondContact O-N 3.31Å; M36-M39 PolarHBondContact O-N 3.35Å; M39-G43 PolarHBondContact O-N 2.94Å
40	H	69.7	Low	61.3	Low	111 Å²	111	111 Å²	111	51%	0.514	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-50.4	172.7	-176.3	-82.1	0	0	0	111.6	M36 Q37 L38 L42 G43 E44	M36-H40 WeakPolarHBondContact O-CB 3.5Å; M36-H40 PolarHBondContact O-N 3.38Å; Q37-H40 PolarHBondContact O-N 3.05Å; L38-H40 VanDerWaalsContact C-N 3.35Å; H40-L42 VanDerWaalsContact C-N 3.32Å; H40-L42 PolarHBondContact O-N 3.45Å; H40-G43 WeakPolarHBondContact O-CA 3.33Å; H40-G43 PolarHBondContact O-N 3.48Å; H40-E44 IonicContact CE1-OE1 3.54Å; H40-E44 IonicContact CE1-OE2 3.79Å; H40-E44 IonicContact ND1-OE2 3.93Å; H40-E44 PolarHBondContact O-N 2.85Å
41	N	63	Low	61.8	Low	98 Å²	98	109.9 Å²	109.9	52%	0.524	54%	0.539	S	S	.	.	H	α-helix	trans	-62	-37.7	177.9	-72.9	-29	0	0	0	112.1	Q37 L38 G43 H45	Q37-N41 WeakPolarHBondContact O-CB 3.41Å; Q37-N41 VanDerWaalsContact O-CG 3.25Å; Q37-N41 PolarHBondContact O-N 3.26Å; Q37-N41 PolarHBondContact O-ND2 2.82Å; L38-N41 PolarHBondContact O-N 3.44Å; N41-G43 VanDerWaalsContact C-N 3.35Å; N41-H45 WeakPolarHBondContact O-CB 3.42Å; N41-H45 PolarHBondContact O-N 3.42Å; N41-H45 VanDerWaalsContact O-N 3.12Å
42	L	61.9	Low	62.3	Low	97 Å²	97	107 Å²	107	51%	0.508	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-35.8	172.4	-83.4	162	0	0	0	112.3	L38 H40 H45 R46	L38-L42 HydrophobicContact CD1-CD1 4.18Å; L38-L42 HydrophobicContact CG-CD1 3.91Å; L38-L42 VanDerWaalsContact O-CB 3.29Å; L38-L42 WeakPolarHBondContact O-CB 3.47Å; L38-L42 WeakPolarHBondContact O-CD1 3.35Å; L38-L42 WeakPolarHBondContact O-CG 3.07Å; L38-L42 PolarHBondContact O-N 2.99Å; H40-L42 VanDerWaalsContact C-N 3.32Å; H40-L42 PolarHBondContact O-N 3.45Å; L42-H45 PolarHBondContact O-N 3.05Å; L42-R46 PolarHBondContact O-N 3.36Å
43	G	62.5	Low	63	Low	29 Å²	29	109.2 Å²	109.2	30%	0.299	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-45.8	176.3	0	0	0	0	0	112.5	M39 H40 N41 H45 R46 H47	M39-G43 PolarHBondContact O-N 2.94Å; H40-G43 WeakPolarHBondContact O-CA 3.33Å; H40-G43 PolarHBondContact O-N 3.48Å; N41-G43 VanDerWaalsContact C-N 3.35Å; G43-H45 VanDerWaalsContact C-N 3.32Å; G43-H45 PolarHBondContact O-N 3.39Å; G43-R46 PolarHBondContact O-N 2.84Å; G43-H47 PolarHBondContact O-CD2 2.92Å; G43-H47 VanDerWaalsContact O-CD2 3.26Å
44	E	59.7	Low	63.8	Low	116 Å²	116	111.4 Å²	111.4	54%	0.542	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-38.2	175.3	-69.5	-169.7	139.1	0	0	111.9	H40 H47	H40-E44 IonicContact CE1-OE1 3.54Å; H40-E44 IonicContact CE1-OE2 3.79Å; H40-E44 IonicContact ND1-OE2 3.93Å; H40-E44 PolarHBondContact O-N 2.85Å; E44-H47 PolarHBondContact O-N 2.85Å
45	H	58.1	Low	64.5	Low	123 Å²	123	113.7 Å²	113.7	57%	0.569	54%	0.544	S	S	*	.	H	α-helix	trans	-71.4	-29.8	-179.9	-154.1	65.3	0	0	0	113.4	N41 L42 G43 H47 T48 V49	N41-H45 WeakPolarHBondContact O-CB 3.42Å; N41-H45 PolarHBondContact O-N 3.42Å; N41-H45 VanDerWaalsContact O-N 3.12Å; L42-H45 PolarHBondContact O-N 3.05Å; G43-H45 VanDerWaalsContact C-N 3.32Å; G43-H45 PolarHBondContact O-N 3.39Å; H45-H47 PolarHBondContact O-N 2.87Å; H45-T48 WeakPolarHBondContact CA-OG1 3.39Å; H45-T48 PolarHBondContact O-N 2.91Å; H45-T48 PolarHBondContact O-OG1 3.3Å; H45-V49 VanDerWaalsContact O-CG2 3.29Å; H45-V49 WeakPolarHBondContact O-CG2 3.43Å; H45-V49 PolarHBondContact O-N 3.47Å
46	R	56.7	Low	64.9	Low	176 Å²	176	115 Å²	115	66%	0.664	55%	0.55	S	S	*	*	H	α-helix	trans	-62.3	-41.7	174.6	-88.3	178.8	166.9	-129.3	-0.3	112.1	L42 G43 T48 V49 E50	L42-R46 PolarHBondContact O-N 3.36Å; G43-R46 PolarHBondContact O-N 2.84Å; R46-T48 VanDerWaalsContact C-N 3.27Å; R46-T48 PolarHBondContact O-N 3.2Å; R46-V49 PolarHBondContact O-N 2.98Å; R46-E50 WeakPolarHBondContact O-CG 3.49Å; R46-E50 PolarHBondContact O-N 3.46Å
47	H	54.8	Low	65.2	Low	118 Å²	118	113.2 Å²	113.2	55%	0.546	54%	0.541	S	S	.	.	H	α-helix	trans	-70.4	-20.8	178.4	-68.1	-56.3	0	0	0	114.1	G43 E44 H45 R51	G43-H47 PolarHBondContact O-CD2 2.92Å; G43-H47 VanDerWaalsContact O-CD2 3.26Å; E44-H47 PolarHBondContact O-N 2.85Å; H45-H47 PolarHBondContact O-N 2.87Å; H47-R51 PolarHBondContact O-NE 3.21Å; H47-R51 VanDerWaalsContact O-NE 3.14Å
48	T	57.2	Low	65.8	Low	61 Å²	61	112.3 Å²	112.3	37%	0.374	54%	0.536	S	S	.	.	H	α-helix	trans	-84.5	-37	172	50.2	0	0	0	0	112.2	H45 R46 R51 Q52	H45-T48 WeakPolarHBondContact CA-OG1 3.39Å; H45-T48 PolarHBondContact O-N 2.91Å; H45-T48 PolarHBondContact O-OG1 3.3Å; R46-T48 VanDerWaalsContact C-N 3.27Å; R46-T48 PolarHBondContact O-N 3.2Å; T48-R51 PolarHBondContact O-N 2.89Å; T48-Q52 WeakPolarHBondContact O-CB 3.28Å; T48-Q52 PolarHBondContact O-N 3.07Å; T48-Q52 VanDerWaalsContact O-N 3.07Å
49	V	60.3	Low	66.2	Low	69 Å²	69	112.5 Å²	112.5	42%	0.418	54%	0.537	S	S	.	.	H	α-helix	trans	-67.9	-42.6	177.4	172	0	0	0	0	111.3	H45 R46 R51 Q52 D53	H45-V49 VanDerWaalsContact O-CG2 3.29Å; H45-V49 WeakPolarHBondContact O-CG2 3.43Å; H45-V49 PolarHBondContact O-N 3.47Å; R46-V49 PolarHBondContact O-N 2.98Å; V49-R51 VanDerWaalsContact C-N 3.31Å; V49-R51 PolarHBondContact O-N 3Å; V49-Q52 PolarHBondContact O-N 3.37Å; V49-D53 WeakPolarHBondContact O-CB 3.4Å; V49-D53 PolarHBondContact O-N 2.99Å
50	E	60.7	Low	66.4	Low	119 Å²	119	112 Å²	112	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-62	-37.7	177.4	-75.4	173.3	178.8	0	0	112.7	R46 W54	R46-E50 WeakPolarHBondContact O-CG 3.49Å; R46-E50 PolarHBondContact O-N 3.46Å; E50-W54 WeakPolarHBondContact O-CB 3.4Å; E50-W54 PolarHBondContact O-N 3.49Å
51	R	64.9	Low	66.6	Low	173 Å²	173	111.2 Å²	111.2	65%	0.653	53%	0.532	S	S	*	.	H	α-helix	trans	-70.8	-37.9	176.4	-77.4	-170.3	-78.4	179.7	-4.3	112.3	H47 T48 V49 L55	H47-R51 PolarHBondContact O-NE 3.21Å; H47-R51 VanDerWaalsContact O-NE 3.14Å; T48-R51 PolarHBondContact O-N 2.89Å; V49-R51 VanDerWaalsContact C-N 3.31Å; V49-R51 PolarHBondContact O-N 3Å; R51-L55 WeakPolarHBondContact O-CB 3.46Å; R51-L55 PolarHBondContact O-N 3.12Å
52	Q	64.9	Low	67	Low	130 Å²	130	111 Å²	111	61%	0.607	53%	0.534	S	S	*	.	H	α-helix	trans	-67.7	-39.9	177	-171.4	174.2	-10.4	0	0	111.3	T48 V49 L55 Q56	T48-Q52 WeakPolarHBondContact O-CB 3.28Å; T48-Q52 PolarHBondContact O-N 3.07Å; T48-Q52 VanDerWaalsContact O-N 3.07Å; V49-Q52 PolarHBondContact O-N 3.37Å; Q52-L55 PolarHBondContact O-N 3.47Å; Q52-Q56 WeakPolarHBondContact O-CB 3.44Å; Q52-Q56 PolarHBondContact O-N 2.75Å
53	D	70.1	Confident	67.4	Low	106 Å²	106	111.1 Å²	111.1	57%	0.567	53%	0.532	S	S	*	.	H	α-helix	trans	-69	-39.9	178	-154.5	28.8	0	0	0	111.4	V49 L55 Q56 M57	V49-D53 WeakPolarHBondContact O-CB 3.4Å; V49-D53 PolarHBondContact O-N 2.99Å; D53-L55 PolarHBondContact O-N 2.84Å; D53-Q56 PolarHBondContact O-N 3.28Å; D53-M57 WeakPolarHBondContact O-CB 3.3Å; D53-M57 PolarHBondContact O-N 3.34Å
54	W	74.1	Confident	67.6	Low	153 Å²	153	112.5 Å²	112.5	58%	0.58	54%	0.537	S	S	*	.	H	α-helix	trans	-62	-42	171.4	-176.6	86.3	0	0	0	112.6	E50 M57 K58	E50-W54 WeakPolarHBondContact O-CB 3.4Å; E50-W54 PolarHBondContact O-N 3.49Å; W54-M57 PolarHBondContact O-N 2.85Å; W54-K58 HydrophobicContact CD2-CG 4.15Å; W54-K58 HydrophobicContact CE3-CG 4.32Å; W54-K58 HydrophobicContact CH2-CG 4.05Å; W54-K58 HydrophobicContact CZ2-CD 4.38Å; W54-K58 HydrophobicContact CZ2-CG 3.85Å; W54-K58 HydrophobicContact CZ3-CG 4.27Å; W54-K58 WeakPolarHBondContact O-CB 3.29Å; W54-K58 WeakPolarHBondContact O-CG 3.42Å; W54-K58 PolarHBondContact O-N 3.14Å
55	L	75.3	Confident	67.8	Low	115 Å²	115	109.6 Å²	109.6	60%	0.602	53%	0.533	S	S	*	.	H	α-helix	trans	-65.3	-40.9	176.8	-159.9	88.5	0	0	0	111.2	R51 Q52 D53 K58 L59	R51-L55 WeakPolarHBondContact O-CB 3.46Å; R51-L55 PolarHBondContact O-N 3.12Å; Q52-L55 PolarHBondContact O-N 3.47Å; D53-L55 PolarHBondContact O-N 2.84Å; L55-K58 PolarHBondContact O-N 3.18Å; L55-L59 WeakPolarHBondContact O-CB 3.32Å; L55-L59 PolarHBondContact O-N 3.35Å
56	Q	76.4	Confident	67.9	Low	115 Å²	115	107.2 Å²	107.2	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-43.1	177.6	-175.9	172	-42.1	0	0	111.4	Q52 D53 L59 Q60	Q52-Q56 WeakPolarHBondContact O-CB 3.44Å; Q52-Q56 PolarHBondContact O-N 2.75Å; D53-Q56 PolarHBondContact O-N 3.28Å; Q56-L59 PolarHBondContact O-N 2.72Å; Q56-Q60 WeakPolarHBondContact O-CB 3.41Å; Q56-Q60 PolarHBondContact O-N 3.26Å
57	M	72.9	Confident	68.1	Low	121 Å²	121	103.2 Å²	103.2	60%	0.596	51%	0.513	S	S	*	.	H	α-helix	trans	-63.3	-41.4	174.7	-169.4	170.5	68.7	0	0	111.4	D53 W54 Q60 D61	D53-M57 WeakPolarHBondContact O-CB 3.3Å; D53-M57 PolarHBondContact O-N 3.34Å; W54-M57 PolarHBondContact O-N 2.85Å; M57-Q60 PolarHBondContact O-N 3.45Å; M57-D61 VanDerWaalsContact O-CB 3.28Å; M57-D61 WeakPolarHBondContact O-CB 3.38Å; M57-D61 PolarHBondContact O-N 2.8Å
58	K	78.1	Confident	68.2	Low	95 Å²	95	102.5 Å²	102.5	41%	0.413	51%	0.513	S	S	.	.	H	α-helix	trans	-64.5	-39.1	173.8	-82.1	-68	180	-166.9	0	113.1	W54 L55 D61 V62	W54-K58 HydrophobicContact CD2-CG 4.15Å; W54-K58 HydrophobicContact CE3-CG 4.32Å; W54-K58 HydrophobicContact CH2-CG 4.05Å; W54-K58 HydrophobicContact CZ2-CD 4.38Å; W54-K58 HydrophobicContact CZ2-CG 3.85Å; W54-K58 HydrophobicContact CZ3-CG 4.27Å; W54-K58 WeakPolarHBondContact O-CB 3.29Å; W54-K58 WeakPolarHBondContact O-CG 3.42Å; W54-K58 PolarHBondContact O-N 3.14Å; L55-K58 PolarHBondContact O-N 3.18Å; K58-D61 PolarHBondContact O-N 3.38Å; K58-V62 WeakPolarHBondContact O-CG2 3.32Å; K58-V62 PolarHBondContact O-N 2.86Å
59	L	76	Confident	68.2	Low	106 Å²	106	102.4 Å²	102.4	56%	0.555	52%	0.519	S	S	*	.	H	α-helix	trans	-66.5	-40.3	175.9	-166.2	78.9	0	0	0	111.1	L55 Q56 H63	L55-L59 WeakPolarHBondContact O-CB 3.32Å; L55-L59 PolarHBondContact O-N 3.35Å; Q56-L59 PolarHBondContact O-N 2.72Å; L59-H63 WeakPolarHBondContact O-CB 3.33Å; L59-H63 PolarHBondContact O-N 3.34Å; L59-H63 PolarHBondContact O-ND1 2.85Å
60	Q	76.1	Confident	67.8	Low	122 Å²	122	103.9 Å²	103.9	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-68.2	-38.7	176.8	-172.4	173	0.6	0	0	112.1	Q56 M57 H63 S64	Q56-Q60 WeakPolarHBondContact O-CB 3.41Å; Q56-Q60 PolarHBondContact O-N 3.26Å; M57-Q60 PolarHBondContact O-N 3.45Å; Q60-H63 PolarHBondContact O-N 2.86Å; Q60-S64 WeakPolarHBondContact O-CB 3.36Å; Q60-S64 PolarHBondContact O-N 3.01Å; Q60-S64 PolarHBondContact O-OG 3.38Å
61	D	73.9	Confident	67.5	Low	93 Å²	93	103.9 Å²	103.9	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-61.9	-47.4	174.1	-175.4	45.9	0	0	0	111.2	M57 K58 H63 S64 A65	M57-D61 VanDerWaalsContact O-CB 3.28Å; M57-D61 WeakPolarHBondContact O-CB 3.38Å; M57-D61 PolarHBondContact O-N 2.8Å; K58-D61 PolarHBondContact O-N 3.38Å; D61-H63 PolarHBondContact O-N 2.93Å; D61-S64 PolarHBondContact O-N 3.48Å; D61-A65 WeakPolarHBondContact O-CB 3.39Å; D61-A65 PolarHBondContact O-N 2.88Å
62	V	73.4	Confident	66.8	Low	93 Å²	93	104 Å²	104	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-39.8	175.3	172.2	0	0	0	0	111.9	K58 L66	K58-V62 WeakPolarHBondContact O-CG2 3.32Å; K58-V62 PolarHBondContact O-N 2.86Å; V62-L66 WeakPolarHBondContact O-CB 3.46Å; V62-L66 PolarHBondContact O-N 3.33Å
63	H	70	Confident	66.1	Low	101 Å²	101	106.6 Å²	106.6	47%	0.468	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-42.1	174.5	-78.1	129.2	0	0	0	111.9	L59 Q60 D61 L66 E67	L59-H63 WeakPolarHBondContact O-CB 3.33Å; L59-H63 PolarHBondContact O-N 3.34Å; L59-H63 PolarHBondContact O-ND1 2.85Å; Q60-H63 PolarHBondContact O-N 2.86Å; D61-H63 PolarHBondContact O-N 2.93Å; H63-L66 WeakPolarHBondContact O-CB 3.36Å; H63-L66 PolarHBondContact O-N 2.99Å; H63-E67 WeakPolarHBondContact O-CG 3.42Å; H63-E67 PolarHBondContact O-N 2.98Å
64	S	66.4	Low	64.9	Low	57 Å²	57	107 Å²	107	40%	0.399	55%	0.546	S	S	.	.	H	α-helix	trans	-66.3	-44	179.2	-54.8	0	0	0	0	110.9	Q60 D61 L66 E67 D68	Q60-S64 WeakPolarHBondContact O-CB 3.36Å; Q60-S64 PolarHBondContact O-N 3.01Å; Q60-S64 PolarHBondContact O-OG 3.38Å; D61-S64 PolarHBondContact O-N 3.48Å; S64-L66 VanDerWaalsContact C-N 3.28Å; S64-L66 PolarHBondContact O-N 3.27Å; S64-E67 PolarHBondContact O-N 2.86Å; S64-D68 PolarHBondContact O-N 2.9Å
65	A	63.3	Low	64	Low	56 Å²	56	110 Å²	110	46%	0.463	56%	0.557	S	S	.	*	H	α-helix	trans	-62.3	-34.3	173.4	0	0	0	0	0	112.7	D61 A69	D61-A65 WeakPolarHBondContact O-CB 3.39Å; D61-A65 PolarHBondContact O-N 2.88Å; A65-A69 VanDerWaalsContact O-CB 3.3Å; A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 3.17Å
66	L	61.1	Low	63.2	Low	73 Å²	73	109.2 Å²	109.2	38%	0.382	55%	0.554	S	S	.	*	H	α-helix	trans	-71.4	-36.5	175.1	-178.5	63.4	0	0	0	112.3	V62 H63 S64 R70	V62-L66 WeakPolarHBondContact O-CB 3.46Å; V62-L66 PolarHBondContact O-N 3.33Å; H63-L66 WeakPolarHBondContact O-CB 3.36Å; H63-L66 PolarHBondContact O-N 2.99Å; S64-L66 VanDerWaalsContact C-N 3.28Å; S64-L66 PolarHBondContact O-N 3.27Å; L66-R70 WeakPolarHBondContact O-CB 3.48Å; L66-R70 WeakPolarHBondContact O-CD 3.34Å; L66-R70 VanDerWaalsContact O-CG 3.25Å; L66-R70 WeakPolarHBondContact O-CG 3.3Å; L66-R70 PolarHBondContact O-N 3.09Å; L66-R70 VanDerWaalsContact O-N 3.09Å
67	E	59.7	Low	62.3	Low	91 Å²	91	111.7 Å²	111.7	43%	0.425	56%	0.563	S	S	.	*	H	α-helix	trans	-72.9	-35.8	174.6	-65.3	-58.8	105	0	0	111.4	H63 S64 R70 T71 R83	H63-E67 WeakPolarHBondContact O-CG 3.42Å; H63-E67 PolarHBondContact O-N 2.98Å; S64-E67 PolarHBondContact O-N 2.86Å; E67-R70 CarbonylContact O-C 3.59Å; E67-R70 WeakPolarHBondContact O-CB 3.21Å; E67-R70 PolarHBondContact O-N 2.97Å; E67-R70 VanDerWaalsContact OE1-CD 3.3Å; E67-R70 WeakPolarHBondContact OE1-CD 3.25Å; E67-R70 IonicContact OE1-CZ 2.69Å; E67-R70 IonicContact OE1-NE 3.43Å; E67-R70 IonicContact OE1-NH1 3.93Å; E67-R70 PolarHBondContact OE1-NH1 3.15Å; E67-R70 IonicContact OE2-NH1 3.97Å; E67-T71 PolarHBondContact O-N 2.69Å; E67-T71 PolarHBondContact O-OG1 3.24Å; E67-R83 IonicContact OE1-NH2 3.69Å
68	D	58	Low	61.7	Low	103 Å²	103	111.5 Å²	111.5	55%	0.551	56%	0.564	S	S	*	*	H	α-helix	trans	-66.3	-41.5	172.9	-78.6	-21.9	0	0	0	111.9	S64 R70 T71 Q72	S64-D68 PolarHBondContact O-N 2.9Å; D68-R70 PolarHBondContact O-N 3.18Å; D68-T71 PolarHBondContact O-N 2.9Å; D68-Q72 PolarHBondContact O-N 2.95Å; D68-Q72 VanDerWaalsContact O-N 3.15Å
69	A	56.8	Low	60.7	Low	60 Å²	60	111.1 Å²	111.1	50%	0.496	57%	0.567	S	S	.	*	H	α-helix	trans	-64	-28.5	172.5	0	0	0	0	0	112.8	A65	A65-A69 VanDerWaalsContact O-CB 3.3Å; A65-A69 WeakPolarHBondContact O-CB 3.4Å; A65-A69 PolarHBondContact O-N 3.17Å
70	R	51.3	Low	60	Low	100 Å²	100	109.6 Å²	109.6	38%	0.377	56%	0.558	S	S	.	*	H	α-helix	trans	-78.2	-29.4	173.7	-81	167.2	125.4	-155.6	-15.3	113.4	L66 E67 D68 Q72 R83	L66-R70 WeakPolarHBondContact O-CB 3.48Å; L66-R70 WeakPolarHBondContact O-CD 3.34Å; L66-R70 VanDerWaalsContact O-CG 3.25Å; L66-R70 WeakPolarHBondContact O-CG 3.3Å; L66-R70 PolarHBondContact O-N 3.09Å; L66-R70 VanDerWaalsContact O-N 3.09Å; E67-R70 CarbonylContact O-C 3.59Å; E67-R70 WeakPolarHBondContact O-CB 3.21Å; E67-R70 PolarHBondContact O-N 2.97Å; E67-R70 VanDerWaalsContact OE1-CD 3.3Å; E67-R70 WeakPolarHBondContact OE1-CD 3.25Å; E67-R70 IonicContact OE1-CZ 2.69Å; E67-R70 IonicContact OE1-NE 3.43Å; E67-R70 IonicContact OE1-NH1 3.93Å; E67-R70 PolarHBondContact OE1-NH1 3.15Å; E67-R70 IonicContact OE2-NH1 3.97Å; D68-R70 PolarHBondContact O-N 3.18Å; R70-Q72 VanDerWaalsContact C-N 3.33Å; R70-R83 VanDerWaalsContact CZ-NE 3.26Å; R70-R83 VanDerWaalsContact NH1-NH2 3.11Å
71	T	53.6	Low	59.2	Low	119 Å²	119	107.7 Å²	107.7	73%	0.73	56%	0.555	S	S	*	*	H	α-helix	trans	-75.2	-27.6	177.5	-46.7	0	0	0	0	111.2	E67 D68	E67-T71 PolarHBondContact O-N 2.69Å; E67-T71 PolarHBondContact O-OG1 3.24Å; D68-T71 PolarHBondContact O-N 2.9Å
72	Q	51.5	Low	58.7	Low	174 Å²	174	108.4 Å²	108.4	81%	0.813	56%	0.558	S	S	*	*	S	Bend	trans	-82.9	-15.8	175.1	-71.2	-173.6	31	0	0	114.9	D68 R70	D68-Q72 PolarHBondContact O-N 2.95Å; D68-Q72 VanDerWaalsContact O-N 3.15Å; R70-Q72 VanDerWaalsContact C-N 3.33Å
73	R	49.8	Very low	57.9	Low	185 Å²	185	109 Å²	109	70%	0.698	55%	0.55	S	S	*	*	S	Bend	trans	-100.3	127	-179.2	-154.6	173.3	-161.3	163.2	4	110.3	R75	R73-R75 PolarHBondContact O-N 2.85Å
74	P	45.6	Very low	57.4	Low	115 Å²	115	109 Å²	109	75%	0.747	55%	0.55	S	S	*	*			trans	-59.5	120.6	179.6	20.3	-26.1	0	0	0	108.8	N76	P74-N76 VanDerWaalsContact C-N 3.35Å; P74-N76 PolarHBondContact O-N 3.06Å
75	R	54.9	Low	57.2	Low	215 Å²	215	110 Å²	110	81%	0.811	55%	0.55	S	S	*	*			trans	-67	88	-171.8	-164.3	179.9	-171.7	-177.1	3.3	109.8	R73 I80	R73-R75 PolarHBondContact O-N 2.85Å; R75-I80 HydrophobicContact CG-CD1 4.27Å
76	N	58.1	Low	57.1	Low	100 Å²	100	115.9 Å²	115.9	54%	0.535	56%	0.561	S	S	.	*			trans	-81.6	140.1	174	-147	-23.9	0	0	0	109.7	P74 D78 D79	P74-N76 VanDerWaalsContact C-N 3.35Å; P74-N76 PolarHBondContact O-N 3.06Å; N76-D78 PolarHBondContact O-N 3.4Å; N76-D79 PolarHBondContact O-N 3.28Å
77	K	58.4	Low	57.2	Low	167 Å²	167	116 Å²	116	73%	0.726	57%	0.568	S	S	*	*	H	α-helix	trans	-64.6	-24.8	-167.5	-69.1	173	178.2	176.2	0	112.6	I80	K77-I80 PolarHBondContact O-N 3.18Å
78	D	58.7	Low	57.1	Low	116 Å²	116	118.3 Å²	118.3	62%	0.62	57%	0.572	S	S	*	*	H	α-helix	trans	-72.1	-29.6	-177.7	-52.3	-39.5	0	0	0	113	N76 I80 V81 L82	N76-D78 PolarHBondContact O-N 3.4Å; D78-I80 VanDerWaalsContact C-N 3.29Å; D78-I80 PolarHBondContact O-N 2.91Å; D78-V81 PolarHBondContact O-N 3.41Å; D78-L82 PolarHBondContact O-N 3.43Å; D78-L82 VanDerWaalsContact O-N 3.09Å
79	D	58.8	Low	57.2	Low	88 Å²	88	121.7 Å²	121.7	47%	0.471	58%	0.577	S	S	.	*	H	α-helix	trans	-71.5	-27.6	178.4	-67.2	-33.3	0	0	0	112.1	N76 R83	N76-D79 PolarHBondContact O-N 3.28Å; D79-R83 WeakPolarHBondContact O-CB 3.25Å; D79-R83 PolarHBondContact O-N 3.43Å
80	I	59.6	Low	57.4	Low	73 Å²	73	125.6 Å²	125.6	37%	0.374	59%	0.589	S	S	.	*	H	α-helix	trans	-68.6	-44.4	176.1	-56.8	175.6	0	0	0	109.4	R75 K77 D78 R83 E84	R75-I80 HydrophobicContact CG-CD1 4.27Å; K77-I80 PolarHBondContact O-N 3.18Å; D78-I80 VanDerWaalsContact C-N 3.29Å; D78-I80 PolarHBondContact O-N 2.91Å; I80-R83 PolarHBondContact O-N 3.35Å; I80-E84 PolarHBondContact O-N 3.04Å
81	V	60.7	Low	57.5	Low	83 Å²	83	124.4 Å²	124.4	50%	0.503	59%	0.59	S	S	.	*	H	α-helix	trans	-64.4	-44.6	178.1	179.5	0	0	0	0	110.6	D78 R83 E84 I85	D78-V81 PolarHBondContact O-N 3.41Å; V81-R83 VanDerWaalsContact C-N 3.33Å; V81-R83 PolarHBondContact O-N 2.98Å; V81-E84 PolarHBondContact O-N 2.97Å; V81-I85 HydrophobicContact CG1-CD1 3.84Å; V81-I85 HydrophobicContact CG1-CG1 4.48Å; V81-I85 WeakPolarHBondContact O-CD1 3.24Å; V81-I85 VanDerWaalsContact O-CG1 3.23Å; V81-I85 WeakPolarHBondContact O-CG1 3.38Å; V81-I85 PolarHBondContact O-N 2.77Å
82	L	62.5	Low	57.6	Low	108 Å²	108	121.8 Å²	121.8	57%	0.565	58%	0.575	S	S	*	*	H	α-helix	trans	-63.9	-38.3	178.3	-172.4	64.5	0	0	0	112.2	D78 I85 R86	D78-L82 PolarHBondContact O-N 3.43Å; D78-L82 VanDerWaalsContact O-N 3.09Å; L82-I85 PolarHBondContact O-N 3.29Å; L82-R86 WeakPolarHBondContact O-CB 3.3Å; L82-R86 PolarHBondContact O-N 3.36Å
83	R	56.8	Low	58	Low	105 Å²	105	121.3 Å²	121.3	40%	0.396	57%	0.573	S	S	.	*	H	α-helix	trans	-68.6	-38.8	175	-169.7	-178.1	-128	-125.1	15	112	E67 R70 D79 I80 V81 I85 R86 S87	E67-R83 IonicContact OE1-NH2 3.69Å; R70-R83 VanDerWaalsContact CZ-NE 3.26Å; R70-R83 VanDerWaalsContact NH1-NH2 3.11Å; D79-R83 WeakPolarHBondContact O-CB 3.25Å; D79-R83 PolarHBondContact O-N 3.43Å; I80-R83 PolarHBondContact O-N 3.35Å; V81-R83 VanDerWaalsContact C-N 3.33Å; V81-R83 PolarHBondContact O-N 2.98Å; R83-I85 VanDerWaalsContact C-N 3.33Å; R83-R86 PolarHBondContact O-N 2.98Å; R83-S87 VanDerWaalsContact O-CB 3.24Å; R83-S87 WeakPolarHBondContact O-CB 3.36Å; R83-S87 PolarHBondContact O-N 3.42Å
84	E	60.1	Low	58.5	Low	101 Å²	101	118.4 Å²	118.4	47%	0.472	57%	0.567	S	S	.	*	H	α-helix	trans	-64.6	-40.4	175.1	-167.5	177.7	152	0	0	111.1	I80 V81 R86 S87 R88	I80-E84 PolarHBondContact O-N 3.04Å; V81-E84 PolarHBondContact O-N 2.97Å; E84-R86 VanDerWaalsContact C-N 3.34Å; E84-R86 PolarHBondContact O-N 3.09Å; E84-S87 PolarHBondContact O-N 3.23Å; E84-R88 VanDerWaalsContact O-CB 3.32Å; E84-R88 WeakPolarHBondContact O-CB 3.47Å; E84-R88 WeakPolarHBondContact O-CG 3.5Å; E84-R88 PolarHBondContact O-N 3.37Å; E84-R88 IonicContact OE1-CZ 3.67Å; E84-R88 IonicContact OE1-NE 3.6Å; E84-R88 PolarHBondContact OE1-NE 3.03Å; E84-R88 IonicContact OE1-NH2 2.98Å; E84-R88 PolarHBondContact OE1-NH2 2.96Å
85	I	61.9	Low	59.1	Low	78 Å²	78	116.5 Å²	116.5	40%	0.4	55%	0.55	S	S	.	.	H	α-helix	trans	-63.6	-39.9	174.8	-65	163.8	0	0	0	111	V81 L82 R83 R89	V81-I85 HydrophobicContact CG1-CD1 3.84Å; V81-I85 HydrophobicContact CG1-CG1 4.48Å; V81-I85 WeakPolarHBondContact O-CD1 3.24Å; V81-I85 VanDerWaalsContact O-CG1 3.23Å; V81-I85 WeakPolarHBondContact O-CG1 3.38Å; V81-I85 PolarHBondContact O-N 2.77Å; L82-I85 PolarHBondContact O-N 3.29Å; R83-I85 VanDerWaalsContact C-N 3.33Å; I85-R89 WeakPolarHBondContact O-CG 3.23Å; I85-R89 PolarHBondContact O-N 3.44Å
86	R	61.5	Low	59.2	Low	180 Å²	180	110.4 Å²	110.4	68%	0.679	53%	0.527	S	S	*	.	H	α-helix	trans	-70.4	-40.7	176.3	-165.9	175.4	-173.2	166	1	112.3	L82 R83 E84 R89 L90	L82-R86 WeakPolarHBondContact O-CB 3.3Å; L82-R86 PolarHBondContact O-N 3.36Å; R83-R86 PolarHBondContact O-N 2.98Å; E84-R86 VanDerWaalsContact C-N 3.34Å; E84-R86 PolarHBondContact O-N 3.09Å; R86-R89 PolarHBondContact O-N 2.92Å; R86-L90 PolarHBondContact O-N 2.78Å
87	S	63.2	Low	59.3	Low	76 Å²	76	108.7 Å²	108.7	53%	0.531	53%	0.527	S	S	.	.	H	α-helix	trans	-66.1	-38.5	176	-170.1	0	0	0	0	111.6	R83 E84 R89 L90 L91	R83-S87 VanDerWaalsContact O-CB 3.24Å; R83-S87 WeakPolarHBondContact O-CB 3.36Å; R83-S87 PolarHBondContact O-N 3.42Å; E84-S87 PolarHBondContact O-N 3.23Å; S87-R89 VanDerWaalsContact C-N 3.34Å; S87-R89 PolarHBondContact O-N 3.23Å; S87-L90 PolarHBondContact O-N 3.36Å; S87-L91 PolarHBondContact O-N 3.27Å
88	R	58.1	Low	59.3	Low	139 Å²	139	104.6 Å²	104.6	53%	0.525	52%	0.516	S	S	.	.	H	α-helix	trans	-56	-51.8	171.3	-84.6	-176	-167.8	-131.7	2.1	109.2	E84 L90 L91 R96	E84-R88 VanDerWaalsContact O-CB 3.32Å; E84-R88 WeakPolarHBondContact O-CB 3.47Å; E84-R88 WeakPolarHBondContact O-CG 3.5Å; E84-R88 PolarHBondContact O-N 3.37Å; E84-R88 IonicContact OE1-CZ 3.67Å; E84-R88 IonicContact OE1-NE 3.6Å; E84-R88 PolarHBondContact OE1-NE 3.03Å; E84-R88 IonicContact OE1-NH2 2.98Å; E84-R88 PolarHBondContact OE1-NH2 2.96Å; R88-L90 PolarHBondContact O-N 3.05Å; R88-L90 VanDerWaalsContact O-N 3.15Å; R88-L91 PolarHBondContact O-N 3.34Å; R88-R96 PolarHBondContact O-NE 3.45Å; R88-R96 PolarHBondContact O-NH1 2.66Å; R88-R96 PolarHBondContact O-NH2 3.1Å
89	R	60	Low	59.3	Low	174 Å²	174	105.6 Å²	105.6	66%	0.657	52%	0.518	S	S	*	.	H	α-helix	trans	-59.1	-25.7	-177.6	-76.3	-174	-81.7	-151	1.6	115.6	I85 R86 S87	I85-R89 WeakPolarHBondContact O-CG 3.23Å; I85-R89 PolarHBondContact O-N 3.44Å; R86-R89 PolarHBondContact O-N 2.92Å; S87-R89 VanDerWaalsContact C-N 3.34Å; S87-R89 PolarHBondContact O-N 3.23Å
90	L	59.5	Low	59.4	Low	142 Å²	142	107.3 Å²	107.3	74%	0.743	52%	0.524	S	S	*	.	H	α-helix	trans	-87.9	-10.4	178.5	-66.6	171.3	0	0	0	113.6	R86 S87 R88	R86-L90 PolarHBondContact O-N 2.78Å; S87-L90 PolarHBondContact O-N 3.36Å; R88-L90 PolarHBondContact O-N 3.05Å; R88-L90 VanDerWaalsContact O-N 3.15Å
91	L	53.9	Low	59.5	Low	74 Å²	74	111.3 Å²	111.3	39%	0.387	54%	0.538	S	S	.	.	S	Bend	trans	-87.9	123.9	-177.6	-165.2	72.7	0	0	0	111	S87 R88 L95 R96	S87-L91 PolarHBondContact O-N 3.27Å; R88-L91 PolarHBondContact O-N 3.34Å; L91-L95 HydrophobicContact CD1-CD1 4.09Å; L91-L95 HydrophobicContact CD2-CB 4.36Å; L91-L95 HydrophobicContact CG-CB 4.27Å; L91-R96 HydrophobicContact CD2-CG 4.23Å; L91-R96 PolarHBondContact O-NE 3.25Å; L91-R96 VanDerWaalsContact O-NE 3.16Å; L91-R96 PolarHBondContact O-NH2 3.2Å
92	P	57.2	Low	59.5	Low	65 Å²	65	115.4 Å²	115.4	42%	0.422	55%	0.549	S	S	.	.			trans	-51.6	136.9	178.4	-27.6	34.2	0	0	0	113	H94 L95	P92-H94 WeakPolarHBondContact CB-ND1 3.32Å; P92-H94 PolarHBondContact O-N 3.04Å; P92-H94 VanDerWaalsContact O-N 3.15Å; P92-L95 HydrophobicContact CG-CD1 4.46Å; P92-L95 PolarHBondContact O-N 3.15Å
93	E	59.3	Low	59.4	Low	163 Å²	163	113.4 Å²	113.4	76%	0.762	54%	0.544	S	S	*	.	H	α-helix	trans	-59.3	-31.3	-172.5	-62.8	-169.5	160.8	0	0	113.8	L95 R96 A97	E93-L95 VanDerWaalsContact C-N 3.31Å; E93-L95 PolarHBondContact O-N 3.35Å; E93-R96 WeakPolarHBondContact O-CB 3.37Å; E93-R96 PolarHBondContact O-N 3.49Å; E93-R96 VanDerWaalsContact O-N 3.1Å; E93-A97 PolarHBondContact O-N 3.4Å; E93-A97 VanDerWaalsContact O-N 3.14Å
94	H	59.3	Low	60	Low	125 Å²	125	113.5 Å²	113.5	58%	0.579	55%	0.552	S	S	*	*	H	α-helix	trans	-63.8	-32.6	177.5	79.3	-83.5	0	0	0	113.3	P92 R96 T98	P92-H94 WeakPolarHBondContact CB-ND1 3.32Å; P92-H94 PolarHBondContact O-N 3.04Å; P92-H94 VanDerWaalsContact O-N 3.15Å; H94-R96 VanDerWaalsContact C-N 3.33Å; H94-T98 PolarHBondContact O-N 3.48Å; H94-T98 PolarHBondContact O-OG1 3.48Å
95	L	58.5	Low	60.3	Low	74 Å²	74	113.7 Å²	113.7	39%	0.387	56%	0.556	S	S	.	*	H	α-helix	trans	-74.7	-26.4	175.7	-76	167.8	0	0	0	111.9	L91 P92 E93 T98 M99	L91-L95 HydrophobicContact CD1-CD1 4.09Å; L91-L95 HydrophobicContact CD2-CB 4.36Å; L91-L95 HydrophobicContact CG-CB 4.27Å; P92-L95 HydrophobicContact CG-CD1 4.46Å; P92-L95 PolarHBondContact O-N 3.15Å; E93-L95 VanDerWaalsContact C-N 3.31Å; E93-L95 PolarHBondContact O-N 3.35Å; L95-T98 WeakPolarHBondContact CA-OG1 3.46Å; L95-T98 PolarHBondContact O-OG1 3.16Å; L95-M99 VanDerWaalsContact O-CB 3.25Å; L95-M99 WeakPolarHBondContact O-CB 3.38Å; L95-M99 PolarHBondContact O-N 2.8Å
96	R	58.2	Low	60.7	Low	87 Å²	87	116.2 Å²	116.2	33%	0.328	57%	0.57	S	S	.	*	H	α-helix	trans	-72.5	-41.3	175.4	-59.5	-174.5	-167.2	-159.9	34.1	111.5	R88 L91 E93 H94 T98 M99 Q100	R88-R96 PolarHBondContact O-NE 3.45Å; R88-R96 PolarHBondContact O-NH1 2.66Å; R88-R96 PolarHBondContact O-NH2 3.1Å; L91-R96 HydrophobicContact CD2-CG 4.23Å; L91-R96 PolarHBondContact O-NE 3.25Å; L91-R96 VanDerWaalsContact O-NE 3.16Å; L91-R96 PolarHBondContact O-NH2 3.2Å; E93-R96 WeakPolarHBondContact O-CB 3.37Å; E93-R96 PolarHBondContact O-N 3.49Å; E93-R96 VanDerWaalsContact O-N 3.1Å; H94-R96 VanDerWaalsContact C-N 3.33Å; R96-T98 VanDerWaalsContact C-N 3.34Å; R96-M99 PolarHBondContact O-N 3.2Å; R96-Q100 WeakPolarHBondContact O-CB 3.32Å; R96-Q100 PolarHBondContact O-N 3.02Å
97	A	59.3	Low	61.3	Low	65 Å²	65	112.2 Å²	112.2	54%	0.537	56%	0.562	S	S	.	*	H	α-helix	trans	-63.7	-40.3	176.4	0	0	0	0	0	111.6	E93 K101	E93-A97 PolarHBondContact O-N 3.4Å; E93-A97 VanDerWaalsContact O-N 3.14Å; A97-K101 WeakPolarHBondContact O-CB 3.39Å; A97-K101 PolarHBondContact O-N 3.29Å
98	T	59	Low	61.8	Low	81 Å²	81	114.9 Å²	114.9	50%	0.497	56%	0.564	S	S	.	*	H	α-helix	trans	-71.5	-38.8	176.3	52.5	0	0	0	0	112.5	H94 L95 R96 K102	H94-T98 PolarHBondContact O-N 3.48Å; H94-T98 PolarHBondContact O-OG1 3.48Å; L95-T98 WeakPolarHBondContact CA-OG1 3.46Å; L95-T98 PolarHBondContact O-OG1 3.16Å; R96-T98 VanDerWaalsContact C-N 3.34Å; T98-K102 VanDerWaalsContact O-CB 3.3Å; T98-K102 WeakPolarHBondContact O-CB 3.39Å; T98-K102 PolarHBondContact O-N 3.15Å
99	M	58.3	Low	62.6	Low	136 Å²	136	110.7 Å²	110.7	67%	0.67	56%	0.559	S	S	*	*	H	α-helix	trans	-66.2	-44.7	175.7	-172.2	-176.3	177.8	0	0	112	L95 R96 K102 S103	L95-M99 VanDerWaalsContact O-CB 3.25Å; L95-M99 WeakPolarHBondContact O-CB 3.38Å; L95-M99 PolarHBondContact O-N 2.8Å; R96-M99 PolarHBondContact O-N 3.2Å; M99-K102 PolarHBondContact O-N 3.26Å; M99-S103 PolarHBondContact O-N 3.16Å; M99-S103 PolarHBondContact O-OG 3.34Å
100	Q	60.1	Low	63.2	Low	125 Å²	125	109.4 Å²	109.4	58%	0.584	56%	0.555	S	S	*	*	H	α-helix	trans	-66.7	-41.6	175.6	-85.7	-140.4	-10.8	0	0	112.5	R96 K102 S103 I104	R96-Q100 WeakPolarHBondContact O-CB 3.32Å; R96-Q100 PolarHBondContact O-N 3.02Å; Q100-K102 VanDerWaalsContact C-N 3.26Å; Q100-K102 PolarHBondContact O-N 3.46Å; Q100-S103 WeakPolarHBondContact CA-OG 3.36Å; Q100-S103 PolarHBondContact O-N 3.47Å; Q100-S103 PolarHBondContact O-OG 2.87Å; Q100-I104 WeakPolarHBondContact O-CB 3.28Å; Q100-I104 WeakPolarHBondContact O-CD1 3.43Å; Q100-I104 WeakPolarHBondContact O-CG1 3.4Å; Q100-I104 PolarHBondContact O-N 3.48Å
101	K	62.2	Low	64	Low	157 Å²	157	106.6 Å²	106.6	68%	0.683	54%	0.539	S	S	*	.	H	α-helix	trans	-60.1	-41	175.8	-171.7	173.5	-179.3	177.2	0	110.8	A97 I104 D105	A97-K101 WeakPolarHBondContact O-CB 3.39Å; A97-K101 PolarHBondContact O-N 3.29Å; K101-I104 PolarHBondContact O-N 3.37Å; K101-D105 WeakPolarHBondContact O-CB 3.41Å; K101-D105 PolarHBondContact O-N 2.96Å
102	K	61.5	Low	64.9	Low	168 Å²	168	108 Å²	108	73%	0.73	55%	0.547	S	S	*	.	H	α-helix	trans	-67.9	-36.2	177.2	-161.2	177.1	-175.5	-178.3	0	112.7	T98 M99 Q100 L106	T98-K102 VanDerWaalsContact O-CB 3.3Å; T98-K102 WeakPolarHBondContact O-CB 3.39Å; T98-K102 PolarHBondContact O-N 3.15Å; M99-K102 PolarHBondContact O-N 3.26Å; Q100-K102 VanDerWaalsContact C-N 3.26Å; Q100-K102 PolarHBondContact O-N 3.46Å; K102-L106 WeakPolarHBondContact O-CB 3.19Å; K102-L106 PolarHBondContact O-N 3.47Å; K102-L106 VanDerWaalsContact O-N 3.13Å
103	S	60.7	Low	65.7	Low	66 Å²	66	109.3 Å²	109.3	46%	0.462	55%	0.554	S	S	.	*	H	α-helix	trans	-70.2	-38.7	175.2	61.9	0	0	0	0	112.5	M99 Q100 L106 D107	M99-S103 PolarHBondContact O-N 3.16Å; M99-S103 PolarHBondContact O-OG 3.34Å; Q100-S103 WeakPolarHBondContact CA-OG 3.36Å; Q100-S103 PolarHBondContact O-N 3.47Å; Q100-S103 PolarHBondContact O-OG 2.87Å; S103-L106 PolarHBondContact O-N 3.03Å; S103-D107 WeakPolarHBondContact O-CB 3.47Å; S103-D107 PolarHBondContact O-N 3.48Å
104	I	68.6	Low	66.1	Low	107 Å²	107	105.4 Å²	105.4	55%	0.549	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-41.2	177.2	-67.1	161	0	0	0	110.7	Q100 K101 D107 K108	Q100-I104 WeakPolarHBondContact O-CB 3.28Å; Q100-I104 WeakPolarHBondContact O-CD1 3.43Å; Q100-I104 WeakPolarHBondContact O-CG1 3.4Å; Q100-I104 PolarHBondContact O-N 3.48Å; K101-I104 PolarHBondContact O-N 3.37Å; I104-D107 PolarHBondContact O-N 3.13Å; I104-K108 WeakPolarHBondContact O-CB 3.42Å; I104-K108 PolarHBondContact O-N 3.45Å
105	D	67	Low	66.2	Low	106 Å²	106	107.2 Å²	107.2	57%	0.567	54%	0.544	S	S	*	.	H	α-helix	trans	-69.9	-35.2	-179.8	-144.2	25.8	0	0	0	112	K101 A109	K101-D105 WeakPolarHBondContact O-CB 3.41Å; K101-D105 PolarHBondContact O-N 2.96Å; D105-A109 WeakPolarHBondContact O-CB 3.41Å; D105-A109 PolarHBondContact O-N 2.86Å
106	L	69.8	Low	66.3	Low	130 Å²	130	112.4 Å²	112.4	68%	0.681	56%	0.564	S	S	*	*	H	α-helix	trans	-69.5	-41	175.5	-160.8	77	0	0	0	112	K102 S103 K108 A109 Y110	K102-L106 WeakPolarHBondContact O-CB 3.19Å; K102-L106 PolarHBondContact O-N 3.47Å; K102-L106 VanDerWaalsContact O-N 3.13Å; S103-L106 PolarHBondContact O-N 3.03Å; L106-K108 VanDerWaalsContact C-N 3.34Å; L106-A109 PolarHBondContact O-N 3Å; L106-Y110 VanDerWaalsContact O-CB 3.28Å; L106-Y110 WeakPolarHBondContact O-CB 3.13Å; L106-Y110 PolarHBondContact O-N 2.92Å
107	D	73.1	Confident	66.4	Low	97 Å²	97	113 Å²	113	52%	0.519	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-39.8	176.3	-167.5	46.3	0	0	0	111.1	S103 I104 Y110 M111	S103-D107 WeakPolarHBondContact O-CB 3.47Å; S103-D107 PolarHBondContact O-N 3.48Å; I104-D107 PolarHBondContact O-N 3.13Å; D107-Y110 PolarHBondContact O-N 3.22Å; D107-M111 WeakPolarHBondContact O-CB 3.28Å; D107-M111 VanDerWaalsContact O-CG 3.29Å; D107-M111 WeakPolarHBondContact O-CG 3.29Å; D107-M111 PolarHBondContact O-N 3.37Å
108	K	74.8	Confident	65.9	Low	132 Å²	132	118.5 Å²	118.5	57%	0.574	59%	0.589	S	S	*	*	H	α-helix	trans	-62.2	-46.4	173.1	-167.7	-173.1	177.9	-156.1	0	112.1	I104 L106 Y110 M111 D112	I104-K108 WeakPolarHBondContact O-CB 3.42Å; I104-K108 PolarHBondContact O-N 3.45Å; L106-K108 VanDerWaalsContact C-N 3.34Å; K108-Y110 VanDerWaalsContact C-N 3.32Å; K108-Y110 PolarHBondContact O-N 2.97Å; K108-M111 PolarHBondContact O-N 2.88Å; K108-D112 WeakPolarHBondContact O-CB 3.15Å; K108-D112 PolarHBondContact O-N 3.37Å
109	A	74.7	Confident	65.8	Low	51 Å²	51	124.4 Å²	124.4	42%	0.421	63%	0.628	S	S	.	*	H	α-helix	trans	-64.3	-37.5	177.2	0	0	0	0	0	112.2	D105 L106 D112 V113	D105-A109 WeakPolarHBondContact O-CB 3.41Å; D105-A109 PolarHBondContact O-N 2.86Å; L106-A109 PolarHBondContact O-N 3Å; A109-D112 PolarHBondContact O-N 3.44Å; A109-V113 WeakPolarHBondContact O-CG2 3.43Å; A109-V113 PolarHBondContact O-N 2.93Å; A109-V113 VanDerWaalsContact O-N 3.16Å
110	Y	72.8	Confident	66.2	Low	147 Å²	147	123.8 Å²	123.8	58%	0.576	63%	0.626	S	S	*	*	H	α-helix	trans	-66.6	-44.4	176.6	179	-106.7	0	0	0	111.8	L106 D107 K108 V113 L114	L106-Y110 VanDerWaalsContact O-CB 3.28Å; L106-Y110 WeakPolarHBondContact O-CB 3.13Å; L106-Y110 PolarHBondContact O-N 2.92Å; D107-Y110 PolarHBondContact O-N 3.22Å; K108-Y110 VanDerWaalsContact C-N 3.32Å; K108-Y110 PolarHBondContact O-N 2.97Å; Y110-V113 PolarHBondContact O-N 3.47Å; Y110-L114 HydrophobicContact CD1-CD1 3.78Å; Y110-L114 HydrophobicContact CE1-CD1 3.18Å; Y110-L114 HydrophobicContact CE2-CD1 4.09Å; Y110-L114 HydrophobicContact CG-CD1 4.44Å; Y110-L114 PolarHBondContact O-N 2.97Å
111	M	76.4	Confident	66.5	Low	83 Å²	83	123.7 Å²	123.7	41%	0.409	63%	0.628	S	S	.	*	H	α-helix	trans	-63.8	-41.3	174.6	-71.7	-61.1	-139.9	0	0	111.9	D107 K108 V113 L114 F115	D107-M111 WeakPolarHBondContact O-CB 3.28Å; D107-M111 VanDerWaalsContact O-CG 3.29Å; D107-M111 WeakPolarHBondContact O-CG 3.29Å; D107-M111 PolarHBondContact O-N 3.37Å; K108-M111 PolarHBondContact O-N 2.88Å; M111-V113 PolarHBondContact O-N 3.14Å; M111-L114 PolarHBondContact O-N 3.19Å; M111-F115 HydrophobicContact CB-CD2 4.32Å; M111-F115 HydrophobicContact CB-CE2 4.32Å; M111-F115 WeakPolarHBondContact O-CD2 3.47Å; M111-F115 PolarHBondContact O-N 2.92Å; M111-F115 HydrophobicContact SD-CE2 3.86Å
112	D	71.8	Confident	66.7	Low	102 Å²	102	121.9 Å²	121.9	55%	0.545	63%	0.625	S	S	.	*	H	α-helix	trans	-60	-34.7	175.7	-91.2	-3.3	0	0	0	112.3	K108 A109 K116	K108-D112 WeakPolarHBondContact O-CB 3.15Å; K108-D112 PolarHBondContact O-N 3.37Å; A109-D112 PolarHBondContact O-N 3.44Å; D112-K116 VanDerWaalsContact O-CB 3.28Å; D112-K116 WeakPolarHBondContact O-CB 3.4Å; D112-K116 PolarHBondContact O-N 3.41Å
113	V	73.9	Confident	67	Low	94 Å²	94	119.2 Å²	119.2	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-74.6	-39.9	176.3	172.5	0	0	0	0	111.7	A109 Y110 M111 K116 T117	A109-V113 WeakPolarHBondContact O-CG2 3.43Å; A109-V113 PolarHBondContact O-N 2.93Å; A109-V113 VanDerWaalsContact O-N 3.16Å; Y110-V113 PolarHBondContact O-N 3.47Å; M111-V113 PolarHBondContact O-N 3.14Å; V113-K116 PolarHBondContact O-N 3.41Å; V113-T117 PolarHBondContact O-N 2.88Å; V113-T117 PolarHBondContact O-OG1 2.98Å
114	L	67.4	Low	67.4	Low	80 Å²	80	122.5 Å²	122.5	42%	0.419	63%	0.629	S	S	.	*	H	α-helix	trans	-65.9	-37.5	178.9	-108.3	154.9	0	0	0	113	Y110 M111	Y110-L114 HydrophobicContact CD1-CD1 3.78Å; Y110-L114 HydrophobicContact CE1-CD1 3.18Å; Y110-L114 HydrophobicContact CE2-CD1 4.09Å; Y110-L114 HydrophobicContact CG-CD1 4.44Å; Y110-L114 PolarHBondContact O-N 2.97Å; M111-L114 PolarHBondContact O-N 3.19Å
115	F	62.3	Low	67.4	Low	164 Å²	164	123.5 Å²	123.5	72%	0.719	63%	0.634	S	S	*	*	H	α-helix	trans	-87.3	-17.1	178.8	-68.1	-68.5	0	0	0	113.6	M111	M111-F115 HydrophobicContact CB-CD2 4.32Å; M111-F115 HydrophobicContact CB-CE2 4.32Å; M111-F115 WeakPolarHBondContact O-CD2 3.47Å; M111-F115 PolarHBondContact O-N 2.92Å; M111-F115 HydrophobicContact SD-CE2 3.86Å
116	K	60.6	Low	67.4	Low	183 Å²	183	124.8 Å²	124.8	80%	0.796	64%	0.639	S	S	*	*	H	α-helix	trans	-81.6	-8.8	171	-102.2	174.7	167.8	172.2	0	114.8	D112 V113	D112-K116 VanDerWaalsContact O-CB 3.28Å; D112-K116 WeakPolarHBondContact O-CB 3.4Å; D112-K116 PolarHBondContact O-N 3.41Å; V113-K116 PolarHBondContact O-N 3.41Å
117	T	60.3	Low	67.2	Low	100 Å²	100	124.4 Å²	124.4	61%	0.613	64%	0.636	S	S	*	*	S	Bend	trans	-117.2	44.7	-174.6	52.3	0	0	0	0	112.9	V113	V113-T117 PolarHBondContact O-N 2.88Å; V113-T117 PolarHBondContact O-OG1 2.98Å
118	K	48.8	Very low	66.7	Low	180 Å²	180	126.7 Å²	126.7	78%	0.783	65%	0.646	S	S	*	*			trans	-123.7	131.9	154.4	-80.3	-177.7	177.9	176.4	0	109.4
119	P	56.7	Low	66	Low	204 Å²	204	126.2 Å²	126.2	100%	1.325	65%	0.652	S	S	*	*			trans	-64.3	0	179.4	29.8	-35.9	0	0	0	112.6

Retrieved 119 of 119 residues in 57 ms (Link to these results)

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