A0A077Z6P6_TRITR Loading...

Saposin B-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A077Z6P6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 223 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	Very low	65	Low	243 Å²	243	119.9 Å²	119.9	100%	1.197	61%	0.61	S	S	*	*				0	126.7	0	-96.4	166.7	167.7	0	0	106.8	S3	M1-S3 PolarHBondContact O-N 2.81Å
2	F	42.5	Very low	65.7	Low	211 Å²	211	115.1 Å²	115.1	93%	0.925	58%	0.583	S	S	*	*			trans	-51.8	112.4	-172.6	-66.4	-86.5	0	0	0	110.8	K4	F2-K4 PolarHBondContact O-N 2.95Å
3	S	46	Very low	66	Low	119 Å²	119	107.2 Å²	107.2	83%	0.832	55%	0.546	S	S	*	.			trans	-67	103.2	167.1	-178.2	0	0	0	0	105.8	M1 Q5	M1-S3 PolarHBondContact O-N 2.81Å; S3-Q5 PolarHBondContact O-N 3.19Å
4	K	66.7	Low	66.3	Low	191 Å²	191	109.4 Å²	109.4	83%	0.83	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-60.7	131.6	172.9	-83.1	-179.3	173.2	-178.6	0	107.1	F2	F2-K4 PolarHBondContact O-N 2.95Å
5	Q	68.7	Low	66.8	Low	181 Å²	181	111 Å²	111	85%	0.846	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-61.3	138.5	168.7	-74.3	-178.2	-47.5	0	0	108.6	S3 T7	S3-Q5 PolarHBondContact O-N 3.19Å; Q5-T7 PolarHBondContact O-N 3.48Å
6	P	71.1	Confident	66.8	Low	75 Å²	75	107.1 Å²	107.1	49%	0.487	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-60.9	132.2	176.1	24.7	-31.8	0	0	0	109.4	E10 I11	P6-E10 VanDerWaalsContact CA-OE2 3.29Å; P6-E10 WeakPolarHBondContact CA-OE2 3.41Å; P6-E10 HydrophobicContact CB-CB 4.06Å; P6-I11 HydrophobicContact CB-CG1 4.13Å; P6-I11 HydrophobicContact CG-CD1 4.45Å; P6-I11 HydrophobicContact CG-CG1 4.23Å
7	T	78.9	Confident	66.8	Low	61 Å²	61	103.4 Å²	103.4	37%	0.374	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-63.5	160.5	173.1	61.2	0	0	0	0	110.5	Q5 C9 E10 I11	Q5-T7 PolarHBondContact O-N 3.48Å; T7-C9 PolarHBondContact O-N 3.35Å; T7-E10 WeakPolarHBondContact CB-OE2 3.38Å; T7-E10 WeakPolarHBondContact CG2-OE2 3.23Å; T7-E10 PolarHBondContact N-OE2 3.45Å; T7-E10 PolarHBondContact O-N 3.4Å; T7-E10 VanDerWaalsContact O-N 3.08Å; T7-E10 WeakPolarHBondContact OG1-CG 3.33Å; T7-E10 PolarHBondContact OG1-N 3.3Å; T7-E10 PolarHBondContact OG1-OE2 3.2Å; T7-I11 WeakPolarHBondContact O-CG1 3.43Å; T7-I11 PolarHBondContact O-N 2.97Å
8	L	76.7	Confident	66.8	Low	103 Å²	103	101.4 Å²	101.4	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-55.2	-36.8	173.2	-177.6	63.6	0	0	0	111.6	I11 Q12	L8-I11 PolarHBondContact O-N 3.22Å; L8-Q12 HydrophobicContact CD1-CG 4.29Å; L8-Q12 HydrophobicContact CG-CG 4.42Å; L8-Q12 WeakPolarHBondContact O-CB 3.46Å; L8-Q12 VanDerWaalsContact O-CG 3.26Å; L8-Q12 WeakPolarHBondContact O-CG 3.49Å; L8-Q12 PolarHBondContact O-N 2.94Å
9	C	76.3	Confident	66.6	Low	9 Å²	9	101.9 Å²	101.9	6%	0.061	52%	0.522	C	S	.	.	H	α-helix	trans	-63.8	-43.6	175.9	178.3	0	0	0	0	112.3	T7 Q12 S13 C149 Q153	T7-C9 PolarHBondContact O-N 3.35Å; C9-Q12 PolarHBondContact O-N 3Å; C9-S13 VanDerWaalsContact O-CB 3.27Å; C9-S13 WeakPolarHBondContact O-CB 3.37Å; C9-S13 PolarHBondContact O-N 3.05Å; C9-S13 PolarHBondContact O-OG 3.25Å; C9-C149 HydrophobicContact CB-CB 4.03Å; C9-C149 WeakPolarHBondContact CB-SG 3.36Å; C9-C149 WeakPolarHBondContact SG-CB 3.34Å; C9-C149 CovalentContact SG-SG 2.03Å; C9-C149 PolarHBondContact SG-SG 3.17Å; C9-Q153 PolarHBondContact O-OE1 2.84Å; C9-Q153 PolarHBondContact SG-OE1 2.8Å
10	E	74.8	Confident	66.7	Low	59 Å²	59	98.4 Å²	98.4	28%	0.276	50%	0.504	S	S	.	.	H	α-helix	trans	-64	-42.6	176.8	-73.5	161.3	142.5	0	0	111.4	P6 T7 S13 E14	P6-E10 VanDerWaalsContact CA-OE2 3.29Å; P6-E10 WeakPolarHBondContact CA-OE2 3.41Å; P6-E10 HydrophobicContact CB-CB 4.06Å; T7-E10 WeakPolarHBondContact CB-OE2 3.38Å; T7-E10 WeakPolarHBondContact CG2-OE2 3.23Å; T7-E10 PolarHBondContact N-OE2 3.45Å; T7-E10 PolarHBondContact O-N 3.4Å; T7-E10 VanDerWaalsContact O-N 3.08Å; T7-E10 WeakPolarHBondContact OG1-CG 3.33Å; T7-E10 PolarHBondContact OG1-N 3.3Å; T7-E10 PolarHBondContact OG1-OE2 3.2Å; E10-S13 WeakPolarHBondContact CA-OG 3.49Å; E10-S13 PolarHBondContact O-N 3.08Å; E10-S13 PolarHBondContact O-OG 2.95Å; E10-E14 WeakPolarHBondContact O-CB 3.5Å; E10-E14 WeakPolarHBondContact O-CG 3.28Å; E10-E14 PolarHBondContact O-N 2.97Å
11	I	76.5	Confident	66.4	Low	67 Å²	67	95 Å²	95	34%	0.344	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-45	177.2	-63.4	169.2	0	0	0	111	P6 T7 L8 Q15	P6-I11 HydrophobicContact CB-CG1 4.13Å; P6-I11 HydrophobicContact CG-CD1 4.45Å; P6-I11 HydrophobicContact CG-CG1 4.23Å; T7-I11 WeakPolarHBondContact O-CG1 3.43Å; T7-I11 PolarHBondContact O-N 2.97Å; L8-I11 PolarHBondContact O-N 3.22Å; I11-Q15 VanDerWaalsContact O-CG 3.3Å; I11-Q15 WeakPolarHBondContact O-CG 3.31Å; I11-Q15 PolarHBondContact O-N 3.11Å; I11-Q15 VanDerWaalsContact O-N 3.08Å
12	Q	72.9	Confident	67.2	Low	62 Å²	62	87.3 Å²	87.3	29%	0.29	45%	0.447	S	S	.	.	H	α-helix	trans	-67.5	-37.4	179.4	-75	178.7	-35.7	0	0	112.1	L8 C9 Q15 T16 T150	L8-Q12 HydrophobicContact CD1-CG 4.29Å; L8-Q12 HydrophobicContact CG-CG 4.42Å; L8-Q12 WeakPolarHBondContact O-CB 3.46Å; L8-Q12 VanDerWaalsContact O-CG 3.26Å; L8-Q12 WeakPolarHBondContact O-CG 3.49Å; L8-Q12 PolarHBondContact O-N 2.94Å; C9-Q12 PolarHBondContact O-N 3Å; Q12-Q15 PolarHBondContact O-N 3.05Å; Q12-T16 VanDerWaalsContact O-CB 3.29Å; Q12-T16 WeakPolarHBondContact O-CB 3.18Å; Q12-T16 PolarHBondContact O-N 2.97Å; Q12-T16 PolarHBondContact O-OG1 3.1Å; Q12-T150 HydrophobicContact CB-CG2 4.02Å; Q12-T150 PolarHBondContact OE1-OG1 2.98Å
13	S	70.1	Confident	68	Low	13 Å²	13	78.1 Å²	78.1	9%	0.091	41%	0.41	C	S	.	.	H	α-helix	trans	-68.4	-39.9	178.6	69.5	0	0	0	0	111.6	C9 E10 T16 L17 Q153 S154	C9-S13 VanDerWaalsContact O-CB 3.27Å; C9-S13 WeakPolarHBondContact O-CB 3.37Å; C9-S13 PolarHBondContact O-N 3.05Å; C9-S13 PolarHBondContact O-OG 3.25Å; E10-S13 WeakPolarHBondContact CA-OG 3.49Å; E10-S13 PolarHBondContact O-N 3.08Å; E10-S13 PolarHBondContact O-OG 2.95Å; S13-T16 PolarHBondContact O-N 3.12Å; S13-L17 WeakPolarHBondContact O-CB 3.41Å; S13-L17 PolarHBondContact O-N 2.98Å; S13-Q153 PolarHBondContact OG-OE1 3.03Å; S13-Q153 VanDerWaalsContact OG-OE1 3.12Å; S13-S154 VanDerWaalsContact CA-OG 3.27Å; S13-S154 WeakPolarHBondContact CA-OG 3.45Å; S13-S154 WeakPolarHBondContact CB-OG 3.38Å; S13-S154 PolarHBondContact O-OG 3.08Å
14	E	70.7	Confident	68.6	Low	137 Å²	137	73.3 Å²	73.3	64%	0.64	38%	0.375	S	S	*	.	H	α-helix	trans	-61.5	-42.7	172.1	-76.3	-177.9	176.5	0	0	112.3	E10 T16 P18	E10-E14 WeakPolarHBondContact O-CB 3.5Å; E10-E14 WeakPolarHBondContact O-CG 3.28Å; E10-E14 PolarHBondContact O-N 2.97Å; E14-T16 VanDerWaalsContact C-N 3.33Å; E14-T16 PolarHBondContact O-N 3.41Å; E14-P18 WeakPolarHBondContact O-CD 3.35Å
15	Q	73.4	Confident	67.9	Low	134 Å²	134	64.2 Å²	64.2	63%	0.626	34%	0.336	S	S	*	.	H	α-helix	trans	-68.3	-32	176.4	-72.4	176.4	-8.3	0	0	112.9	I11 Q12	I11-Q15 VanDerWaalsContact O-CG 3.3Å; I11-Q15 WeakPolarHBondContact O-CG 3.31Å; I11-Q15 PolarHBondContact O-N 3.11Å; I11-Q15 VanDerWaalsContact O-N 3.08Å; Q12-Q15 PolarHBondContact O-N 3.05Å
16	T	66.1	Low	67.1	Low	49 Å²	49	56.8 Å²	56.8	30%	0.301	30%	0.302	S	S	.	.	H	α-helix	trans	-81.3	-27.5	-179.3	-57.1	0	0	0	0	111.9	Q12 S13 E14 L19 L20 T150	Q12-T16 VanDerWaalsContact O-CB 3.29Å; Q12-T16 WeakPolarHBondContact O-CB 3.18Å; Q12-T16 PolarHBondContact O-N 2.97Å; Q12-T16 PolarHBondContact O-OG1 3.1Å; S13-T16 PolarHBondContact O-N 3.12Å; E14-T16 VanDerWaalsContact C-N 3.33Å; E14-T16 PolarHBondContact O-N 3.41Å; T16-L19 WeakPolarHBondContact O-CB 3.31Å; T16-L19 PolarHBondContact O-N 3.24Å; T16-L19 VanDerWaalsContact O-N 3.08Å; T16-L20 PolarHBondContact O-N 3.29Å; T16-T150 HydrophobicContact CG2-CG2 4.48Å
17	L	68	Low	66.3	Low	43 Å²	43	55.2 Å²	55.2	23%	0.225	30%	0.296	C	S	.	.	H	α-helix	trans	-56.5	-45.9	-174.6	-177.5	65	0	0	0	113.3	S13 L19 L20 M21 A157	S13-L17 WeakPolarHBondContact O-CB 3.41Å; S13-L17 PolarHBondContact O-N 2.98Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 2.93Å; L17-L20 WeakPolarHBondContact O-CB 3.47Å; L17-L20 PolarHBondContact O-N 3.36Å; L17-M21 HydrophobicContact CD1-CG 4.31Å; L17-M21 HydrophobicContact CG-CG 4.48Å; L17-M21 HydrophobicContact CG-SD 4.48Å; L17-M21 VanDerWaalsContact O-CG 3.3Å; L17-M21 WeakPolarHBondContact O-CG 3.07Å; L17-M21 PolarHBondContact O-N 2.95Å; L17-A157 HydrophobicContact CD1-CB 4.42Å; L17-A157 HydrophobicContact CD2-CB 4.28Å
18	P	65.4	Low	65.4	Low	69 Å²	69	55.8 Å²	55.8	45%	0.448	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-41.5	174.4	-25.6	34.9	0	0	0	113.7	E14 M21 E22	E14-P18 WeakPolarHBondContact O-CD 3.35Å; P18-M21 PolarHBondContact O-N 3.34Å; P18-E22 WeakPolarHBondContact O-CB 3.05Å; P18-E22 PolarHBondContact O-N 2.04Å
19	L	64.6	Low	64.6	Low	111 Å²	111	58.2 Å²	58.2	58%	0.581	31%	0.308	S	S	*	.	H	α-helix	trans	-65.8	-41	177.2	-65	171.1	0	0	0	111.1	T16 L17 E22 A23	T16-L19 WeakPolarHBondContact O-CB 3.31Å; T16-L19 PolarHBondContact O-N 3.24Å; T16-L19 VanDerWaalsContact O-N 3.08Å; L17-L19 VanDerWaalsContact C-N 3.34Å; L17-L19 PolarHBondContact O-N 2.93Å; L19-E22 PolarHBondContact O-N 2.89Å; L19-A23 VanDerWaalsContact O-CB 3.3Å; L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.14Å
20	L	66.9	Low	64	Low	30 Å²	30	60.9 Å²	60.9	16%	0.157	32%	0.322	C	S	.	.	H	α-helix	trans	-62.7	-45.2	175	179.4	64.7	0	0	0	110.8	T16 L17 A23 I24 M54	T16-L20 PolarHBondContact O-N 3.29Å; L17-L20 WeakPolarHBondContact O-CB 3.47Å; L17-L20 PolarHBondContact O-N 3.36Å; L20-A23 PolarHBondContact O-N 2.96Å; L20-I24 HydrophobicContact CD1-CD1 4.05Å; L20-I24 HydrophobicContact CD1-CG1 4.29Å; L20-I24 HydrophobicContact CD2-CD1 4.46Å; L20-I24 HydrophobicContact CG-CD1 3.83Å; L20-I24 HydrophobicContact CG-CG1 4.44Å; L20-I24 WeakPolarHBondContact O-CB 3.12Å; L20-I24 VanDerWaalsContact O-CG1 3.24Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.22Å; L20-M54 HydrophobicContact CD1-CE 3.61Å; L20-M54 HydrophobicContact CD1-SD 3.94Å
21	M	60.6	Low	63.5	Low	27 Å²	27	61.1 Å²	61.1	13%	0.133	32%	0.323	C	S	.	.	H	α-helix	trans	-64.8	-40	177.3	-69.4	-169.5	-30.6	0	0	112.1	L17 P18 A23 I24 S25 L37 Y158	L17-M21 HydrophobicContact CD1-CG 4.31Å; L17-M21 HydrophobicContact CG-CG 4.48Å; L17-M21 HydrophobicContact CG-SD 4.48Å; L17-M21 VanDerWaalsContact O-CG 3.3Å; L17-M21 WeakPolarHBondContact O-CG 3.07Å; L17-M21 PolarHBondContact O-N 2.95Å; P18-M21 PolarHBondContact O-N 3.34Å; M21-A23 VanDerWaalsContact C-N 3.34Å; M21-I24 PolarHBondContact O-N 3.23Å; M21-S25 WeakPolarHBondContact O-CB 3.47Å; M21-S25 PolarHBondContact O-N 3.31Å; M21-L37 HydrophobicContact CB-CD1 4.29Å; M21-L37 HydrophobicContact CE-CB 3.94Å; M21-L37 HydrophobicContact CE-CD1 3.8Å; M21-L37 HydrophobicContact CE-CD2 3.76Å; M21-L37 HydrophobicContact CE-CG 4.05Å; M21-L37 HydrophobicContact CG-CD1 4.32Å; M21-L37 HydrophobicContact SD-CD1 3.6Å; M21-L37 VanDerWaalsContact SD-CD1 3.6Å; M21-L37 HydrophobicContact SD-CD2 3.82Å; M21-L37 HydrophobicContact SD-CG 4.24Å; M21-Y158 HydrophobicContact CG-CD2 4.4Å
22	E	54.7	Low	63	Low	82 Å²	82	64.7 Å²	64.7	38%	0.383	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-41.9	173.8	-173.6	-179.7	174.4	0	0	111.2	P18 L19 S25 T26	P18-E22 WeakPolarHBondContact O-CB 3.05Å; P18-E22 PolarHBondContact O-N 2.04Å; L19-E22 PolarHBondContact O-N 2.89Å; E22-S25 WeakPolarHBondContact O-CB 3.37Å; E22-T26 WeakPolarHBondContact O-CB 3.09Å; E22-T26 PolarHBondContact O-N 3.06Å; E22-T26 PolarHBondContact O-OG1 3.21Å
23	A	58.2	Low	62.5	Low	18 Å²	18	63.9 Å²	63.9	15%	0.149	33%	0.333	C	S	.	.	H	α-helix	trans	-66.2	-44.4	176.5	0	0	0	0	0	112.3	L19 L20 M21 T26 A27 L51 M54	L19-A23 VanDerWaalsContact O-CB 3.3Å; L19-A23 WeakPolarHBondContact O-CB 3.44Å; L19-A23 PolarHBondContact O-N 3.14Å; L20-A23 PolarHBondContact O-N 2.96Å; M21-A23 VanDerWaalsContact C-N 3.34Å; A23-T26 WeakPolarHBondContact O-CB 3.4Å; A23-T26 PolarHBondContact O-N 3.4Å; A23-A27 WeakPolarHBondContact O-CB 3.42Å; A23-A27 PolarHBondContact O-N 3.16Å; A23-L51 HydrophobicContact CB-CD2 4.11Å; A23-M54 HydrophobicContact CB-CE 3.69Å; A23-M54 HydrophobicContact CB-SD 3.84Å
24	I	60.1	Low	61.7	Low	18 Å²	18	63.5 Å²	63.5	9%	0.092	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-45.2	175.8	-69.8	169.5	0	0	0	110.8	L20 M21 T26 A27 T28 M54 Y158	L20-I24 HydrophobicContact CD1-CD1 4.05Å; L20-I24 HydrophobicContact CD1-CG1 4.29Å; L20-I24 HydrophobicContact CD2-CD1 4.46Å; L20-I24 HydrophobicContact CG-CD1 3.83Å; L20-I24 HydrophobicContact CG-CG1 4.44Å; L20-I24 WeakPolarHBondContact O-CB 3.12Å; L20-I24 VanDerWaalsContact O-CG1 3.24Å; L20-I24 WeakPolarHBondContact O-CG1 3.46Å; L20-I24 PolarHBondContact O-N 3.22Å; M21-I24 PolarHBondContact O-N 3.23Å; I24-T26 VanDerWaalsContact C-N 3.3Å; I24-T26 PolarHBondContact O-N 3.32Å; I24-A27 PolarHBondContact O-N 3.24Å; I24-T28 HydrophobicContact CG2-CG2 4.15Å; I24-T28 WeakPolarHBondContact O-CG2 3.48Å; I24-T28 PolarHBondContact O-N 3.2Å; I24-T28 PolarHBondContact O-OG1 2.94Å; I24-T28 VanDerWaalsContact O-OG1 3.09Å; I24-M54 HydrophobicContact CG1-CE 3.67Å; I24-Y158 HydrophobicContact CD1-CD1 3.91Å; I24-Y158 HydrophobicContact CD1-CD2 3.76Å; I24-Y158 HydrophobicContact CD1-CE1 3.84Å; I24-Y158 HydrophobicContact CD1-CE2 3.68Å; I24-Y158 HydrophobicContact CD1-CG 3.87Å; I24-Y158 HydrophobicContact CG2-CE2 4.21Å
25	S	51.6	Low	61.5	Low	1 Å²	1	59.4 Å²	59.4	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-51.7	-54.6	173.4	158.2	0	0	0	0	109.4	M21 E22 A27 T28 Q29 C34 F46	M21-S25 WeakPolarHBondContact O-CB 3.47Å; M21-S25 PolarHBondContact O-N 3.31Å; E22-S25 WeakPolarHBondContact O-CB 3.37Å; S25-A27 VanDerWaalsContact C-N 3.34Å; S25-A27 PolarHBondContact O-N 3.41Å; S25-T28 PolarHBondContact O-N 3.49Å; S25-T28 PolarHBondContact O-OG1 3.44Å; S25-Q29 PolarHBondContact O-N 3.48Å; S25-C34 WeakPolarHBondContact OG-CB 3.27Å; S25-C34 PolarHBondContact OG-SG 2.88Å; S25-F46 WeakPolarHBondContact O-CE1 3.41Å; S25-F46 WeakPolarHBondContact O-CZ 3.37Å; S25-F46 WeakPolarHBondContact OG-CZ 3.49Å
26	T	52.7	Low	61.1	Low	24 Å²	24	57.8 Å²	57.8	15%	0.147	32%	0.316	C	S	.	.	H	α-helix	trans	-56.9	-43.6	177.7	-58.5	0	0	0	0	112.1	E22 A23 I24 Q29	E22-T26 WeakPolarHBondContact O-CB 3.09Å; E22-T26 PolarHBondContact O-N 3.06Å; E22-T26 PolarHBondContact O-OG1 3.21Å; A23-T26 WeakPolarHBondContact O-CB 3.4Å; A23-T26 PolarHBondContact O-N 3.4Å; I24-T26 VanDerWaalsContact C-N 3.3Å; I24-T26 PolarHBondContact O-N 3.32Å; T26-Q29 PolarHBondContact O-N 2.95Å
27	A	53.3	Low	60.3	Low	43 Å²	43	57.8 Å²	57.8	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-67.7	-41.7	-178.5	0	0	0	0	0	113.3	A23 I24 S25 Q29	A23-A27 WeakPolarHBondContact O-CB 3.42Å; A23-A27 PolarHBondContact O-N 3.16Å; I24-A27 PolarHBondContact O-N 3.24Å; S25-A27 VanDerWaalsContact C-N 3.34Å; S25-A27 PolarHBondContact O-N 3.41Å; A27-Q29 PolarHBondContact O-N 3.37Å
28	T	59.4	Low	59.8	Low	72 Å²	72	58.3 Å²	58.3	44%	0.442	32%	0.319	S	S	.	.	H	α-helix	trans	-75	-10.1	-179	59.5	0	0	0	0	113.7	I24 S25 N30	I24-T28 HydrophobicContact CG2-CG2 4.15Å; I24-T28 WeakPolarHBondContact O-CG2 3.48Å; I24-T28 PolarHBondContact O-N 3.2Å; I24-T28 PolarHBondContact O-OG1 2.94Å; I24-T28 VanDerWaalsContact O-OG1 3.09Å; S25-T28 PolarHBondContact O-N 3.49Å; S25-T28 PolarHBondContact O-OG1 3.44Å; T28-N30 PolarHBondContact O-N 3.25Å; T28-N30 PolarHBondContact OG1-N 3.46Å
29	Q	61	Low	59.5	Low	154 Å²	154	59.8 Å²	59.8	72%	0.72	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	17.3	-169.1	-59	-173.4	-2.2	0	0	113.7	S25 T26 A27 H31 F46	S25-Q29 PolarHBondContact O-N 3.48Å; T26-Q29 PolarHBondContact O-N 2.95Å; A27-Q29 PolarHBondContact O-N 3.37Å; Q29-H31 PolarHBondContact O-N 2.91Å; Q29-F46 VanDerWaalsContact CA-CE1 3.5Å; Q29-F46 HydrophobicContact CB-CD1 4.41Å
30	N	63.8	Low	59.3	Low	66 Å²	66	58 Å²	58	35%	0.353	33%	0.331	S	S	.	.			trans	-101.6	81	-176.7	-169.9	-4.8	0	0	0	110.3	T28 K32 I33	T28-N30 PolarHBondContact O-N 3.25Å; T28-N30 PolarHBondContact OG1-N 3.46Å; N30-K32 PolarHBondContact O-N 3.05Å; N30-K32 PolarHBondContact OD1-N 3.22Å; N30-I33 HydrophobicContact CB-CD1 4.07Å; N30-I33 HydrophobicContact CB-CG1 4.37Å; N30-I33 PolarHBondContact O-N 3.34Å; N30-I33 VanDerWaalsContact O-N 3.09Å
31	H	63.4	Low	59.4	Low	64 Å²	64	61.8 Å²	61.8	30%	0.296	35%	0.351	S	S	.	.	H	α-helix	trans	-50.7	-30.3	178.7	62.9	-73.8	0	0	0	114.4	Q29 I33 C34 D35 F46	Q29-H31 PolarHBondContact O-N 2.91Å; H31-I33 PolarHBondContact O-N 3.06Å; H31-C34 WeakPolarHBondContact O-CA 3.36Å; H31-C34 WeakPolarHBondContact O-CB 3.11Å; H31-C34 PolarHBondContact O-N 2.79Å; H31-C34 VanDerWaalsContact O-N 3.09Å; H31-D35 IonicContact CD2-OD2 2.75Å; H31-D35 PolarHBondContact CD2-OD2 2.78Å; H31-D35 PolarHBondContact O-N 3.47Å; H31-F46 HydrophobicContact CB-CD2 3.77Å; H31-F46 HydrophobicContact CB-CE2 3.26Å; H31-F46 HydrophobicContact CB-CZ 4.01Å
32	K	65.6	Low	59.6	Low	142 Å²	142	60.5 Å²	60.5	62%	0.617	35%	0.345	S	S	*	.	H	α-helix	trans	-61.1	-33.2	-179.6	-65.8	-175	174.8	-176.2	0	113.3	N30 S36	N30-K32 PolarHBondContact O-N 3.05Å; N30-K32 PolarHBondContact OD1-N 3.22Å; K32-S36 WeakPolarHBondContact O-CB 3.49Å; K32-S36 PolarHBondContact O-N 3.5Å; K32-S36 PolarHBondContact O-OG 3.29Å
33	I	62.5	Low	60.1	Low	45 Å²	45	63 Å²	63	23%	0.231	35%	0.354	C	S	.	.	H	α-helix	trans	-65.7	-46	177	-65.2	176.2	0	0	0	109.3	N30 H31 L37 W161	N30-I33 HydrophobicContact CB-CD1 4.07Å; N30-I33 HydrophobicContact CB-CG1 4.37Å; N30-I33 PolarHBondContact O-N 3.34Å; N30-I33 VanDerWaalsContact O-N 3.09Å; H31-I33 PolarHBondContact O-N 3.06Å; I33-L37 HydrophobicContact CG2-CD1 3.94Å; I33-L37 WeakPolarHBondContact O-CB 3.38Å; I33-L37 WeakPolarHBondContact O-CD1 3.15Å; I33-L37 WeakPolarHBondContact O-CG 3.47Å; I33-L37 PolarHBondContact O-N 3.36Å; I33-W161 HydrophobicContact CG2-CH2 4.31Å
34	C	54.7	Low	60.4	Low	5 Å²	5	66.8 Å²	66.8	3%	0.034	37%	0.372	C	S	.	.	H	α-helix	trans	-60.5	-52.4	174.8	-154.9	0	0	0	0	112.8	S25 H31 S36 L37 T38 C42	S25-C34 WeakPolarHBondContact OG-CB 3.27Å; S25-C34 PolarHBondContact OG-SG 2.88Å; H31-C34 WeakPolarHBondContact O-CA 3.36Å; H31-C34 WeakPolarHBondContact O-CB 3.11Å; H31-C34 PolarHBondContact O-N 2.79Å; H31-C34 VanDerWaalsContact O-N 3.09Å; C34-S36 PolarHBondContact O-N 3.05Å; C34-S36 VanDerWaalsContact O-N 3.15Å; C34-L37 PolarHBondContact O-N 2.87Å; C34-T38 PolarHBondContact O-N 2.86Å; C34-T38 PolarHBondContact O-OG1 3.43Å; C34-C42 HydrophobicContact CB-CB 3.28Å; C34-C42 WeakPolarHBondContact CB-SG 3.25Å; C34-C42 WeakPolarHBondContact SG-CB 3.26Å; C34-C42 CovalentContact SG-SG 2.02Å; C34-C42 PolarHBondContact SG-SG 3.46Å
35	D	65.3	Low	60.1	Low	50 Å²	50	69.7 Å²	69.7	27%	0.267	39%	0.388	S	S	.	.	H	α-helix	trans	-58.9	-35.2	-174.6	-61.6	-17.7	0	0	0	110.6	H31 L37 A39 T40 C42	H31-D35 IonicContact CD2-OD2 2.75Å; H31-D35 PolarHBondContact CD2-OD2 2.78Å; H31-D35 PolarHBondContact O-N 3.47Å; D35-L37 VanDerWaalsContact C-N 3.34Å; D35-A39 PolarHBondContact O-N 2.99Å; D35-T40 WeakPolarHBondContact CA-O 3.44Å; D35-T40 VanDerWaalsContact OD1-O 3.07Å; D35-C42 WeakPolarHBondContact OD1-CB 3.39Å; D35-C42 PolarHBondContact OD1-N 3.03Å
36	S	64.4	Low	60.2	Low	101 Å²	101	71.9 Å²	71.9	71%	0.706	40%	0.397	S	S	*	.	H	α-helix	trans	-75	-19.5	178.3	-56.6	0	0	0	0	114.1	K32 C34	K32-S36 WeakPolarHBondContact O-CB 3.49Å; K32-S36 PolarHBondContact O-N 3.5Å; K32-S36 PolarHBondContact O-OG 3.29Å; C34-S36 PolarHBondContact O-N 3.05Å; C34-S36 VanDerWaalsContact O-N 3.15Å
37	L	50.6	Low	60.1	Low	48 Å²	48	78.7 Å²	78.7	25%	0.251	43%	0.425	S	S	.	.	H	α-helix	trans	-106.1	-42.5	-170.5	-83.8	171.7	0	0	0	113	M21 I33 C34 D35 W161	M21-L37 HydrophobicContact CB-CD1 4.29Å; M21-L37 HydrophobicContact CE-CB 3.94Å; M21-L37 HydrophobicContact CE-CD1 3.8Å; M21-L37 HydrophobicContact CE-CD2 3.76Å; M21-L37 HydrophobicContact CE-CG 4.05Å; M21-L37 HydrophobicContact CG-CD1 4.32Å; M21-L37 HydrophobicContact SD-CD1 3.6Å; M21-L37 VanDerWaalsContact SD-CD1 3.6Å; M21-L37 HydrophobicContact SD-CD2 3.82Å; M21-L37 HydrophobicContact SD-CG 4.24Å; I33-L37 HydrophobicContact CG2-CD1 3.94Å; I33-L37 WeakPolarHBondContact O-CB 3.38Å; I33-L37 WeakPolarHBondContact O-CD1 3.15Å; I33-L37 WeakPolarHBondContact O-CG 3.47Å; I33-L37 PolarHBondContact O-N 3.36Å; C34-L37 PolarHBondContact O-N 2.87Å; D35-L37 VanDerWaalsContact C-N 3.34Å; L37-W161 HydrophobicContact CD1-CH2 3.62Å; L37-W161 HydrophobicContact CD1-CZ2 3.71Å; L37-W161 HydrophobicContact CD1-CZ3 4.3Å; L37-W161 HydrophobicContact CD2-CH2 4.14Å; L37-W161 HydrophobicContact CD2-CZ2 3.31Å; L37-W161 HydrophobicContact CG-CH2 4.05Å; L37-W161 HydrophobicContact CG-CZ2 3.66Å
38	T	57.6	Low	59.9	Low	55 Å²	55	80.1 Å²	80.1	34%	0.337	44%	0.443	S	S	.	.	H	α-helix	trans	-99.6	-5.8	-175.6	59.5	0	0	0	0	112.6	C34 T40	C34-T38 PolarHBondContact O-N 2.86Å; C34-T38 PolarHBondContact O-OG1 3.43Å; T38-T40 PolarHBondContact O-N 3.48Å; T38-T40 PolarHBondContact OG1-OG1 3.34Å
39	A	58.1	Low	59.1	Low	99 Å²	99	85.2 Å²	85.2	82%	0.818	46%	0.459	S	S	*	.	S	Bend	trans	54.3	26.8	-171.6	0	0	0	0	0	113.4	D35	D35-A39 PolarHBondContact O-N 2.99Å
40	T	60.2	Low	58.3	Low	75 Å²	75	86 Å²	86	46%	0.46	46%	0.46	S	S	.	.	S	Bend	trans	-118.7	149.4	177.6	58.2	0	0	0	0	110.7	D35 T38 C42	D35-T40 WeakPolarHBondContact CA-O 3.44Å; D35-T40 VanDerWaalsContact OD1-O 3.07Å; T38-T40 PolarHBondContact O-N 3.48Å; T38-T40 PolarHBondContact OG1-OG1 3.34Å; T40-C42 PolarHBondContact O-N 2.98Å; T40-C42 PolarHBondContact OG1-SG 3.18Å
41	N	69.1	Low	57.7	Low	108 Å²	108	86.3 Å²	86.3	58%	0.578	46%	0.462	S	S	*	.			trans	-74.6	95	172.6	-178.2	-6.2	0	0	0	110.1	K43	N41-K43 PolarHBondContact O-N 3.12Å; N41-K43 WeakPolarHBondContact OD1-CB 3.29Å; N41-K43 PolarHBondContact OD1-N 3.18Å
42	C	65.7	Low	57.1	Low	0 Å²	0	87 Å²	87	0%	0	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-80	-4.3	-176.8	-62	0	0	0	0	113.3	C34 D35 T40 D44 L45 F46	C34-C42 HydrophobicContact CB-CB 3.28Å; C34-C42 WeakPolarHBondContact CB-SG 3.25Å; C34-C42 WeakPolarHBondContact SG-CB 3.26Å; C34-C42 CovalentContact SG-SG 2.02Å; C34-C42 PolarHBondContact SG-SG 3.46Å; D35-C42 WeakPolarHBondContact OD1-CB 3.39Å; D35-C42 PolarHBondContact OD1-N 3.03Å; T40-C42 PolarHBondContact O-N 2.98Å; T40-C42 PolarHBondContact OG1-SG 3.18Å; C42-D44 PolarHBondContact O-N 3.3Å; C42-L45 HydrophobicContact CB-CD1 4.15Å; C42-L45 WeakPolarHBondContact O-CB 3.16Å; C42-L45 PolarHBondContact O-N 3.47Å; C42-F46 HydrophobicContact CB-CE2 3.88Å; C42-F46 WeakPolarHBondContact O-CD2 3.36Å; C42-F46 WeakPolarHBondContact O-CE2 3.36Å
43	K	64.7	Low	56.9	Low	134 Å²	134	82.2 Å²	82.2	58%	0.583	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-51.9	-31.9	-178.9	-167.8	177.2	-179.9	178.6	0	113.3	N41	N41-K43 PolarHBondContact O-N 3.12Å; N41-K43 WeakPolarHBondContact OD1-CB 3.29Å; N41-K43 PolarHBondContact OD1-N 3.18Å
44	D	64.7	Low	57	Low	98 Å²	98	81.9 Å²	81.9	52%	0.524	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-82.7	-21.9	179.2	-72.5	-46.4	0	0	0	114.2	C42 F46 K47	C42-D44 PolarHBondContact O-N 3.3Å; D44-F46 PolarHBondContact O-N 3.42Å; D44-K47 PolarHBondContact O-N 2.91Å; D44-K47 IonicContact OD1-NZ 3.82Å; D44-K47 PolarHBondContact OD1-NZ 3.31Å
45	L	52.6	Low	57.6	Low	79 Å²	79	84.7 Å²	84.7	41%	0.414	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-26.3	173.8	-84.4	113.9	0	0	0	112.5	C42 K47	C42-L45 HydrophobicContact CB-CD1 4.15Å; C42-L45 WeakPolarHBondContact O-CB 3.16Å; C42-L45 PolarHBondContact O-N 3.47Å; L45-K47 VanDerWaalsContact C-N 3.27Å; L45-K47 PolarHBondContact O-N 2.74Å
46	F	53.8	Low	58	Low	47 Å²	47	83.2 Å²	83.2	21%	0.206	46%	0.458	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-7	-178.3	-65.3	-76.3	0	0	0	114.9	S25 Q29 H31 C42 D44 G48	S25-F46 WeakPolarHBondContact O-CE1 3.41Å; S25-F46 WeakPolarHBondContact O-CZ 3.37Å; S25-F46 WeakPolarHBondContact OG-CZ 3.49Å; Q29-F46 VanDerWaalsContact CA-CE1 3.5Å; Q29-F46 HydrophobicContact CB-CD1 4.41Å; H31-F46 HydrophobicContact CB-CD2 3.77Å; H31-F46 HydrophobicContact CB-CE2 3.26Å; H31-F46 HydrophobicContact CB-CZ 4.01Å; C42-F46 HydrophobicContact CB-CE2 3.88Å; C42-F46 WeakPolarHBondContact O-CD2 3.36Å; C42-F46 WeakPolarHBondContact O-CE2 3.36Å; D44-F46 PolarHBondContact O-N 3.42Å; F46-G48 PolarHBondContact O-N 3.39Å
47	K	50.7	Low	58.4	Low	168 Å²	168	82 Å²	82	73%	0.73	44%	0.443	S	S	*	.	S	Bend	trans	-76.5	70.7	178.6	-72.5	175.1	178.5	155.8	0	111.1	D44 L45	D44-K47 PolarHBondContact O-N 2.91Å; D44-K47 IonicContact OD1-NZ 3.82Å; D44-K47 PolarHBondContact OD1-NZ 3.31Å; L45-K47 VanDerWaalsContact C-N 3.27Å; L45-K47 PolarHBondContact O-N 2.74Å
48	G	49.8	Very low	59.5	Low	72 Å²	72	82.9 Å²	82.9	74%	0.742	45%	0.447	S	S	*	.	S	Bend	trans	110.5	22.4	153.7	0	0	0	0	0	119.1	F46	F46-G48 PolarHBondContact O-N 3.39Å
49	K	42	Very low	60.7	Low	179 Å²	179	80.9 Å²	80.9	78%	0.778	44%	0.435	S	S	*	.			trans	-114.4	119.2	169.3	-79.8	-177.4	176.5	-179.4	0	111.4
50	K	45.8	Very low	61.8	Low	170 Å²	170	80.4 Å²	80.4	74%	0.739	42%	0.415	S	S	*	.			trans	-101.5	115.9	171	-159	-173.8	-178.1	-155.8	0	107.7	E52	K50-E52 HydrophobicContact CD-CG 4.33Å; K50-E52 IonicContact NZ-OE1 2.71Å; K50-E52 PolarHBondContact NZ-OE1 2.9Å; K50-E52 PolarHBondContact O-N 3.38Å
51	L	50.5	Low	62.7	Low	74 Å²	74	80.4 Å²	80.4	39%	0.387	41%	0.412	S	S	.	.			trans	-94.2	73.1	-175.1	-156.8	83.7	0	0	0	110.4	A23 A53 M54	A23-L51 HydrophobicContact CB-CD2 4.11Å; L51-A53 PolarHBondContact O-N 2.99Å; L51-M54 HydrophobicContact CD2-CB 4.13Å
52	E	51.3	Low	63.5	Low	78 Å²	78	81.7 Å²	81.7	36%	0.364	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	7.4	-172.6	-103.1	175.6	-174.8	0	0	116.1	K50	K50-E52 HydrophobicContact CD-CG 4.33Å; K50-E52 IonicContact NZ-OE1 2.71Å; K50-E52 PolarHBondContact NZ-OE1 2.9Å; K50-E52 PolarHBondContact O-N 3.38Å
53	A	61.3	Low	64.4	Low	42 Å²	42	81.9 Å²	81.9	35%	0.347	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-37.8	-177.3	0	0	0	0	0	114.1	L51 C56 I57 I136	L51-A53 PolarHBondContact O-N 2.99Å; A53-C56 PolarHBondContact O-N 3.17Å; A53-I57 WeakPolarHBondContact O-CG1 3.25Å; A53-I57 PolarHBondContact O-N 2.83Å; A53-I136 HydrophobicContact CB-CD1 4.27Å
54	M	64.1	Low	65.3	Low	37 Å²	37	82.7 Å²	82.7	18%	0.182	41%	0.413	C	S	.	.	H	α-helix	trans	-74.4	-37.4	-171.2	-160.4	163.5	96.1	0	0	112	L20 A23 I24 L51 C56 I57 I58	L20-M54 HydrophobicContact CD1-CE 3.61Å; L20-M54 HydrophobicContact CD1-SD 3.94Å; A23-M54 HydrophobicContact CB-CE 3.69Å; A23-M54 HydrophobicContact CB-SD 3.84Å; I24-M54 HydrophobicContact CG1-CE 3.67Å; L51-M54 HydrophobicContact CD2-CB 4.13Å; M54-C56 VanDerWaalsContact C-N 3.25Å; M54-C56 PolarHBondContact O-N 2.84Å; M54-I57 PolarHBondContact O-N 3.43Å; M54-I57 VanDerWaalsContact O-N 3.14Å; M54-I58 HydrophobicContact CE-CD1 4.09Å; M54-I58 HydrophobicContact CG-CD1 3.94Å; M54-I58 HydrophobicContact CG-CG1 4.35Å; M54-I58 VanDerWaalsContact O-CG1 3.32Å; M54-I58 WeakPolarHBondContact O-CG1 3.43Å; M54-I58 PolarHBondContact O-N 3.32Å
55	D	67.4	Low	66.2	Low	65 Å²	65	82 Å²	82	35%	0.348	41%	0.409	S	S	.	.	H	α-helix	trans	-56.1	-41.6	175.7	-66.3	-23.6	0	0	0	111.7	C59 F128	D55-C59 WeakPolarHBondContact O-CB 3.39Å; D55-C59 PolarHBondContact O-N 3.32Å; D55-F128 HydrophobicContact CB-CB 4.48Å; D55-F128 HydrophobicContact CB-CD1 4.26Å
56	C	74.1	Confident	67.7	Low	18 Å²	18	80 Å²	80	12%	0.122	40%	0.4	C	S	.	.	H	α-helix	trans	-65.6	-44	178.2	-175	0	0	0	0	111.9	A53 M54 C59 K60 F128 C129	A53-C56 PolarHBondContact O-N 3.17Å; M54-C56 VanDerWaalsContact C-N 3.25Å; M54-C56 PolarHBondContact O-N 2.84Å; C56-C59 PolarHBondContact O-N 2.97Å; C56-K60 WeakPolarHBondContact O-CB 3.37Å; C56-K60 VanDerWaalsContact O-CG 3.3Å; C56-K60 WeakPolarHBondContact O-CG 3.34Å; C56-K60 PolarHBondContact O-N 3.41Å; C56-K60 VanDerWaalsContact SG-CE 3.59Å; C56-F128 VanDerWaalsContact CA-O 3.23Å; C56-F128 WeakPolarHBondContact CA-O 3.44Å; C56-F128 VanDerWaalsContact CB-O 3.25Å; C56-F128 WeakPolarHBondContact CB-O 3.42Å; C56-F128 PolarHBondContact N-O 2.7Å; C56-C129 WeakPolarHBondContact CA-SG 3.22Å; C56-C129 HydrophobicContact CB-CB 3.9Å; C56-C129 WeakPolarHBondContact CB-SG 3.45Å; C56-C129 WeakPolarHBondContact SG-CB 3.32Å; C56-C129 CovalentContact SG-SG 2.04Å; C56-C129 PolarHBondContact SG-SG 2.88Å
57	I	71.6	Confident	69.4	Low	77 Å²	77	78 Å²	78	40%	0.395	39%	0.392	S	S	.	.	H	α-helix	trans	-64.3	-48.6	179	-65.6	169.5	0	0	0	109.9	A53 M54 C59 K60 L61	A53-I57 WeakPolarHBondContact O-CG1 3.25Å; A53-I57 PolarHBondContact O-N 2.83Å; M54-I57 PolarHBondContact O-N 3.43Å; M54-I57 VanDerWaalsContact O-N 3.14Å; I57-C59 VanDerWaalsContact C-N 3.34Å; I57-C59 PolarHBondContact O-N 2.94Å; I57-K60 PolarHBondContact O-N 2.63Å; I57-L61 HydrophobicContact CG2-CD1 4.02Å; I57-L61 HydrophobicContact CG2-CG 4.5Å; I57-L61 WeakPolarHBondContact O-CG 3.31Å; I57-L61 PolarHBondContact O-N 2.88Å
58	I	74.3	Confident	71.2	Confident	65 Å²	65	77.4 Å²	77.4	33%	0.333	39%	0.39	S	S	.	.	H	α-helix	trans	-58.2	-48.1	178.4	-69	168.7	0	0	0	110.1	M54 K60 L61 W62	M54-I58 HydrophobicContact CE-CD1 4.09Å; M54-I58 HydrophobicContact CG-CD1 3.94Å; M54-I58 HydrophobicContact CG-CG1 4.35Å; M54-I58 VanDerWaalsContact O-CG1 3.32Å; M54-I58 WeakPolarHBondContact O-CG1 3.43Å; M54-I58 PolarHBondContact O-N 3.32Å; I58-K60 PolarHBondContact O-N 2.92Å; I58-L61 PolarHBondContact O-N 3.31Å; I58-W62 VanDerWaalsContact O-CB 3.28Å; I58-W62 WeakPolarHBondContact O-CB 3.28Å; I58-W62 PolarHBondContact O-N 3.36Å
59	C	82.6	Confident	73.1	Confident	13 Å²	13	79.6 Å²	79.6	9%	0.088	38%	0.379	C	S	.	.	H	α-helix	trans	-63.2	-42.4	179	179.2	0	0	0	0	112.1	D55 C56 I57 L61 W62 T63 C123 F128	D55-C59 WeakPolarHBondContact O-CB 3.39Å; D55-C59 PolarHBondContact O-N 3.32Å; C56-C59 PolarHBondContact O-N 2.97Å; I57-C59 VanDerWaalsContact C-N 3.34Å; I57-C59 PolarHBondContact O-N 2.94Å; C59-L61 VanDerWaalsContact C-N 3.32Å; C59-L61 PolarHBondContact O-N 2.88Å; C59-W62 PolarHBondContact O-N 3.18Å; C59-T63 WeakPolarHBondContact O-CG2 3.31Å; C59-T63 PolarHBondContact O-N 2.9Å; C59-T63 PolarHBondContact O-OG1 2.88Å; C59-C123 HydrophobicContact CB-CB 3.67Å; C59-C123 WeakPolarHBondContact CB-SG 3.37Å; C59-C123 PolarHBondContact O-SG 3.14Å; C59-C123 VanDerWaalsContact O-SG 3.39Å; C59-C123 WeakPolarHBondContact SG-CA 3.48Å; C59-C123 WeakPolarHBondContact SG-CB 3.44Å; C59-C123 CovalentContact SG-SG 2.03Å; C59-C123 PolarHBondContact SG-SG 3.46Å; C59-F128 HydrophobicContact CB-CB 3.84Å; C59-F128 HydrophobicContact CB-CD2 4.25Å; C59-F128 HydrophobicContact CB-CG 3.99Å
60	K	82.2	Confident	75.3	Confident	89 Å²	89	74.1 Å²	74.1	39%	0.387	36%	0.357	S	S	.	.	H	α-helix	trans	-63.5	-36.9	177.4	-77.7	176.2	176.5	172	0	112.4	C56 I57 I58 T63 K64 A120 C123	C56-K60 WeakPolarHBondContact O-CB 3.37Å; C56-K60 VanDerWaalsContact O-CG 3.3Å; C56-K60 WeakPolarHBondContact O-CG 3.34Å; C56-K60 PolarHBondContact O-N 3.41Å; C56-K60 VanDerWaalsContact SG-CE 3.59Å; I57-K60 PolarHBondContact O-N 2.63Å; I58-K60 PolarHBondContact O-N 2.92Å; K60-T63 WeakPolarHBondContact CA-OG1 3.19Å; K60-T63 PolarHBondContact O-OG1 3.42Å; K60-K64 WeakPolarHBondContact O-CG 3.11Å; K60-K64 PolarHBondContact O-N 3.04Å; K60-A120 HydrophobicContact CG-CB 4.19Å; K60-C123 PolarHBondContact N-SG 3.16Å; K60-C123 VanDerWaalsContact N-SG 3.45Å
61	L	78.1	Confident	77.5	Confident	76 Å²	76	68.1 Å²	68.1	40%	0.398	33%	0.333	S	S	.	.	H	α-helix	trans	-68.7	-46.8	173.3	-71.4	172.3	0	0	0	111.1	I57 I58 C59 T63 K64 L65 V151	I57-L61 HydrophobicContact CG2-CD1 4.02Å; I57-L61 HydrophobicContact CG2-CG 4.5Å; I57-L61 WeakPolarHBondContact O-CG 3.31Å; I57-L61 PolarHBondContact O-N 2.88Å; I58-L61 PolarHBondContact O-N 3.31Å; C59-L61 VanDerWaalsContact C-N 3.32Å; C59-L61 PolarHBondContact O-N 2.88Å; L61-T63 PolarHBondContact O-N 2.9Å; L61-K64 PolarHBondContact O-N 3.11Å; L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 2.95Å; L61-V151 HydrophobicContact CD1-CG1 3.97Å
62	W	87	Confident	79.5	Confident	135 Å²	135	68.1 Å²	68.1	51%	0.511	34%	0.339	S	S	.	.	H	α-helix	trans	-57.5	-50	178.8	176.8	87.1	0	0	0	111.9	I58 C59 K64 L65 V66 L122	I58-W62 VanDerWaalsContact O-CB 3.28Å; I58-W62 WeakPolarHBondContact O-CB 3.28Å; I58-W62 PolarHBondContact O-N 3.36Å; C59-W62 PolarHBondContact O-N 3.18Å; W62-K64 VanDerWaalsContact C-N 3.31Å; W62-K64 PolarHBondContact O-N 2.8Å; W62-L65 PolarHBondContact O-N 3.15Å; W62-L65 VanDerWaalsContact O-N 3.15Å; W62-V66 HydrophobicContact CD2-CG2 3.95Å; W62-V66 VanDerWaalsContact CE2-CG2 3.49Å; W62-V66 HydrophobicContact CG-CG2 4.3Å; W62-V66 HydrophobicContact CH2-CG2 4.4Å; W62-V66 HydrophobicContact CZ2-CG2 3.75Å; W62-V66 WeakPolarHBondContact O-CB 3.3Å; W62-V66 WeakPolarHBondContact O-CG2 3.1Å; W62-V66 PolarHBondContact O-N 2.86Å; W62-L122 HydrophobicContact CZ3-CD1 4.36Å
63	T	83.3	Confident	81.3	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.018	34%	0.339	C	S	.	.	H	α-helix	trans	-57.6	-43.1	178.3	49.5	0	0	0	0	111.5	C59 K60 L61 A67 V118 N119 L122	C59-T63 WeakPolarHBondContact O-CG2 3.31Å; C59-T63 PolarHBondContact O-N 2.9Å; C59-T63 PolarHBondContact O-OG1 2.88Å; K60-T63 WeakPolarHBondContact CA-OG1 3.19Å; K60-T63 PolarHBondContact O-OG1 3.42Å; L61-T63 PolarHBondContact O-N 2.9Å; T63-A67 WeakPolarHBondContact O-CB 3.27Å; T63-A67 PolarHBondContact O-N 3.24Å; T63-V118 VanDerWaalsContact O-CG1 3.31Å; T63-V118 WeakPolarHBondContact O-CG1 3.44Å; T63-N119 WeakPolarHBondContact CG2-O 3.15Å; T63-L122 HydrophobicContact CG2-CB 4.2Å; T63-L122 HydrophobicContact CG2-CD1 4.15Å
64	K	83.7	Confident	82.7	Confident	151 Å²	151	67.5 Å²	67.5	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-62.6	-45.3	175.3	-73.6	177.7	179.4	-176.9	0	112.8	K60 L61 W62 K68	K60-K64 WeakPolarHBondContact O-CG 3.11Å; K60-K64 PolarHBondContact O-N 3.04Å; L61-K64 PolarHBondContact O-N 3.11Å; W62-K64 VanDerWaalsContact C-N 3.31Å; W62-K64 PolarHBondContact O-N 2.8Å; K64-K68 WeakPolarHBondContact O-CB 3.41Å; K64-K68 PolarHBondContact O-N 3.37Å
65	L	83.4	Confident	83.9	Confident	83 Å²	83	69.6 Å²	69.6	44%	0.435	35%	0.349	S	S	.	.	H	α-helix	trans	-65.9	-45.3	-179.2	-71.8	173.3	0	0	0	111.6	L61 W62 K68 K69 F215	L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 2.95Å; W62-L65 PolarHBondContact O-N 3.15Å; W62-L65 VanDerWaalsContact O-N 3.15Å; L65-K68 PolarHBondContact O-N 3.33Å; L65-K69 WeakPolarHBondContact O-CB 3.38Å; L65-K69 PolarHBondContact O-N 2.84Å; L65-F215 HydrophobicContact CD1-CE1 4.21Å; L65-F215 HydrophobicContact CD1-CZ 3.75Å
66	V	85.2	Confident	85	Confident	38 Å²	38	71.4 Å²	71.4	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-46.5	177.4	172.6	0	0	0	0	110.7	W62 K68 K69 I70 V118	W62-V66 HydrophobicContact CD2-CG2 3.95Å; W62-V66 VanDerWaalsContact CE2-CG2 3.49Å; W62-V66 HydrophobicContact CG-CG2 4.3Å; W62-V66 HydrophobicContact CH2-CG2 4.4Å; W62-V66 HydrophobicContact CZ2-CG2 3.75Å; W62-V66 WeakPolarHBondContact O-CB 3.3Å; W62-V66 WeakPolarHBondContact O-CG2 3.1Å; W62-V66 PolarHBondContact O-N 2.86Å; V66-K68 PolarHBondContact O-N 3.47Å; V66-K69 PolarHBondContact O-N 3Å; V66-I70 HydrophobicContact CG1-CD1 3.6Å; V66-I70 HydrophobicContact CG1-CG1 4.22Å; V66-I70 VanDerWaalsContact O-CG1 3.31Å; V66-I70 WeakPolarHBondContact O-CG1 3.42Å; V66-I70 PolarHBondContact O-N 3.39Å; V66-V118 HydrophobicContact CB-CG1 4.03Å; V66-V118 HydrophobicContact CG1-CG1 3.89Å
67	A	89.1	Confident	85.7	Confident	6 Å²	6	72.5 Å²	72.5	5%	0.05	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-49.9	176	0	0	0	0	0	111	T63 K69 I70 I71 V114 V118	T63-A67 WeakPolarHBondContact O-CB 3.27Å; T63-A67 PolarHBondContact O-N 3.24Å; A67-K69 VanDerWaalsContact C-N 3.32Å; A67-K69 PolarHBondContact O-N 3.45Å; A67-I70 PolarHBondContact O-N 2.03Å; A67-I71 WeakPolarHBondContact O-CB 3.45Å; A67-I71 WeakPolarHBondContact O-CD1 3.3Å; A67-I71 WeakPolarHBondContact O-CG1 3.05Å; A67-I71 PolarHBondContact O-N 2.99Å; A67-V114 HydrophobicContact CB-CG1 3.97Å; A67-V118 HydrophobicContact CB-CB 4.21Å; A67-V118 HydrophobicContact CB-CG1 4.11Å
68	K	88.8	Confident	86.5	Confident	154 Å²	154	71.4 Å²	71.4	67%	0.67	35%	0.354	S	S	*	.	H	α-helix	trans	-58	-43.1	176.9	-174.6	179.9	179.8	-176.9	0	112	K64 L65 V66 S72	K64-K68 WeakPolarHBondContact O-CB 3.41Å; K64-K68 PolarHBondContact O-N 3.37Å; L65-K68 PolarHBondContact O-N 3.33Å; V66-K68 PolarHBondContact O-N 3.47Å; K68-S72 WeakPolarHBondContact O-CB 3.38Å; K68-S72 PolarHBondContact O-N 3.31Å
69	K	88.5	Confident	87.2	Confident	119 Å²	119	73 Å²	73	52%	0.517	36%	0.359	S	S	.	.	H	α-helix	trans	-67	-44.1	179.9	-171	67.3	170.9	-165.4	0	111.8	L65 V66 A67 S72 K73	L65-K69 WeakPolarHBondContact O-CB 3.38Å; L65-K69 PolarHBondContact O-N 2.84Å; V66-K69 PolarHBondContact O-N 3Å; A67-K69 VanDerWaalsContact C-N 3.32Å; A67-K69 PolarHBondContact O-N 3.45Å; K69-S72 PolarHBondContact O-N 2.8Å; K69-S72 PolarHBondContact O-OG 3.26Å; K69-K73 WeakPolarHBondContact O-CG 3.33Å; K69-K73 PolarHBondContact O-N 2.9Å
70	I	90.1	Very high	87.4	Confident	64 Å²	64	79.7 Å²	79.7	33%	0.328	38%	0.384	S	S	.	.	H	α-helix	trans	-65.3	-46.2	177.9	-63.1	169.7	0	0	0	110	V66 A67 S72 K73 F110 V114 V118	V66-I70 HydrophobicContact CG1-CD1 3.6Å; V66-I70 HydrophobicContact CG1-CG1 4.22Å; V66-I70 VanDerWaalsContact O-CG1 3.31Å; V66-I70 WeakPolarHBondContact O-CG1 3.42Å; V66-I70 PolarHBondContact O-N 3.39Å; A67-I70 PolarHBondContact O-N 2.03Å; I70-S72 VanDerWaalsContact C-N 3.27Å; I70-S72 PolarHBondContact O-N 3.42Å; I70-K73 WeakPolarHBondContact O-CA 3.01Å; I70-K73 WeakPolarHBondContact O-CB 3.48Å; I70-K73 PolarHBondContact O-N 3.2Å; I70-F110 HydrophobicContact CG2-CE1 4.27Å; I70-F110 HydrophobicContact CG2-CE2 4.5Å; I70-F110 HydrophobicContact CG2-CZ 3.68Å; I70-F110 WeakPolarHBondContact O-CE1 3.38Å; I70-V114 HydrophobicContact CB-CG1 4.12Å; I70-V114 HydrophobicContact CB-CG2 4.25Å; I70-V114 HydrophobicContact CG2-CG1 4.24Å; I70-V114 HydrophobicContact CG2-CG2 3.49Å; I70-V114 VanDerWaalsContact CG2-CG2 3.49Å; I70-V118 HydrophobicContact CD1-CG2 4.24Å
71	I	91.5	Very high	87.6	Confident	43 Å²	43	78.8 Å²	78.8	22%	0.221	38%	0.38	C	S	.	.	H	α-helix	trans	-57.1	-41.7	175.6	-67.5	163.6	0	0	0	110.6	A67 K73 S74 Q111 V114	A67-I71 WeakPolarHBondContact O-CB 3.45Å; A67-I71 WeakPolarHBondContact O-CD1 3.3Å; A67-I71 WeakPolarHBondContact O-CG1 3.05Å; A67-I71 PolarHBondContact O-N 2.99Å; I71-K73 PolarHBondContact O-N 3.22Å; I71-S74 WeakPolarHBondContact O-CB 3.34Å; I71-S74 PolarHBondContact O-N 2.93Å; I71-Q111 HydrophobicContact CD1-CG 4.16Å; I71-V114 HydrophobicContact CD1-CB 4.47Å; I71-V114 HydrophobicContact CD1-CG1 4.18Å; I71-V114 HydrophobicContact CG1-CB 3.98Å; I71-V114 HydrophobicContact CG1-CG1 3.85Å; I71-V114 HydrophobicContact CG1-CG2 4.31Å
72	S	91.1	Very high	88.1	Confident	74 Å²	74	78.3 Å²	78.3	52%	0.517	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-14.6	177	79.5	0	0	0	0	114.4	K68 K69 I70	K68-S72 WeakPolarHBondContact O-CB 3.38Å; K68-S72 PolarHBondContact O-N 3.31Å; K69-S72 PolarHBondContact O-N 2.8Å; K69-S72 PolarHBondContact O-OG 3.26Å; I70-S72 VanDerWaalsContact C-N 3.27Å; I70-S72 PolarHBondContact O-N 3.42Å
73	K	90.7	Very high	88.2	Confident	82 Å²	82	76.3 Å²	76.3	36%	0.357	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	10.6	177	-62.9	-67.1	-175.4	179.4	0	112.9	K69 I70 I71 S75 Q76 V77	K69-K73 WeakPolarHBondContact O-CG 3.33Å; K69-K73 PolarHBondContact O-N 2.9Å; I70-K73 WeakPolarHBondContact O-CA 3.01Å; I70-K73 WeakPolarHBondContact O-CB 3.48Å; I70-K73 PolarHBondContact O-N 3.2Å; I71-K73 PolarHBondContact O-N 3.22Å; K73-S75 VanDerWaalsContact C-N 3.25Å; K73-S75 PolarHBondContact O-N 3.16Å; K73-Q76 HydrophobicContact CD-CG 4.49Å; K73-Q76 WeakPolarHBondContact O-CB 3.17Å; K73-Q76 PolarHBondContact O-N 2.81Å; K73-V77 PolarHBondContact O-N 3.1Å
74	S	90.6	Very high	88.4	Confident	26 Å²	26	81.7 Å²	81.7	18%	0.182	40%	0.403	C	S	.	.	H	α-helix	trans	-52.1	-42.4	-177.2	77.1	0	0	0	0	112.7	I71 Q76 V77 K78 F106 D107 F110	I71-S74 WeakPolarHBondContact O-CB 3.34Å; I71-S74 PolarHBondContact O-N 2.93Å; S74-Q76 VanDerWaalsContact C-N 3.33Å; S74-Q76 PolarHBondContact O-N 3.12Å; S74-V77 PolarHBondContact O-N 3.3Å; S74-V77 VanDerWaalsContact O-N 3.12Å; S74-K78 WeakPolarHBondContact O-CB 3.43Å; S74-K78 PolarHBondContact O-N 3.22Å; S74-F106 WeakPolarHBondContact O-CE1 3.48Å; S74-D107 WeakPolarHBondContact CB-OD1 3.34Å; S74-D107 PolarHBondContact OG-OD1 3.42Å; S74-F110 VanDerWaalsContact CB-CD1 3.45Å
75	S	88.7	Confident	88.7	Confident	81 Å²	81	74.6 Å²	74.6	57%	0.566	37%	0.372	S	S	*	.	H	α-helix	trans	-60.7	-37.8	178.6	59.6	0	0	0	0	113.6	K73 K78 H79	K73-S75 VanDerWaalsContact C-N 3.25Å; K73-S75 PolarHBondContact O-N 3.16Å; S75-K78 PolarHBondContact O-N 2.89Å; S75-H79 PolarHBondContact O-N 2.03Å
76	Q	89.8	Confident	89.1	Confident	102 Å²	102	75.1 Å²	75.1	48%	0.477	38%	0.375	S	S	.	.	H	α-helix	trans	-69.3	-39.1	176.2	-59.9	-172.6	12.1	0	0	110.8	K73 S74 H79 Y80	K73-Q76 HydrophobicContact CD-CG 4.49Å; K73-Q76 WeakPolarHBondContact O-CB 3.17Å; K73-Q76 PolarHBondContact O-N 2.81Å; S74-Q76 VanDerWaalsContact C-N 3.33Å; S74-Q76 PolarHBondContact O-N 3.12Å; Q76-H79 WeakPolarHBondContact O-CB 3.32Å; Q76-H79 PolarHBondContact O-N 3.39Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.32Å; Q76-Y80 PolarHBondContact O-N 3.32Å
77	V	88.8	Confident	89.3	Confident	41 Å²	41	75.3 Å²	75.3	25%	0.248	38%	0.378	C	S	.	.	H	α-helix	trans	-67.3	-42.9	176	-172.5	0	0	0	0	110.5	K73 S74 H79 Y80 F81 F106 F110	K73-V77 PolarHBondContact O-N 3.1Å; S74-V77 PolarHBondContact O-N 3.3Å; S74-V77 VanDerWaalsContact O-N 3.12Å; V77-H79 VanDerWaalsContact C-N 3.26Å; V77-H79 PolarHBondContact O-N 3Å; V77-Y80 WeakPolarHBondContact O-CB 3.43Å; V77-Y80 PolarHBondContact O-N 2.95Å; V77-F81 HydrophobicContact CG1-CD2 4.13Å; V77-F81 HydrophobicContact CG1-CE2 3.87Å; V77-F81 WeakPolarHBondContact O-CD2 3.5Å; V77-F81 PolarHBondContact O-N 3.37Å; V77-F106 HydrophobicContact CB-CE1 4.47Å; V77-F106 HydrophobicContact CB-CZ 4.08Å; V77-F106 HydrophobicContact CG1-CZ 3.84Å; V77-F110 HydrophobicContact CB-CE2 4.03Å; V77-F110 HydrophobicContact CB-CZ 4.19Å; V77-F110 HydrophobicContact CG1-CD2 4.25Å; V77-F110 HydrophobicContact CG1-CE2 3.85Å; V77-F110 HydrophobicContact CG1-CZ 4.49Å; V77-F110 HydrophobicContact CG2-CE2 3.83Å; V77-F110 HydrophobicContact CG2-CZ 3.67Å
78	K	89.2	Confident	89.5	Confident	55 Å²	55	80.6 Å²	80.6	24%	0.239	42%	0.415	C	S	.	.	H	α-helix	trans	-54	-44.5	174.5	-169.1	174	-178.8	169.4	0	111.1	S74 S75 Y80 F81 E82 F106	S74-K78 WeakPolarHBondContact O-CB 3.43Å; S74-K78 PolarHBondContact O-N 3.22Å; S75-K78 PolarHBondContact O-N 2.89Å; K78-Y80 VanDerWaalsContact C-N 3.33Å; K78-Y80 PolarHBondContact O-N 3.5Å; K78-F81 WeakPolarHBondContact O-CB 3.44Å; K78-F81 PolarHBondContact O-N 3.03Å; K78-E82 WeakPolarHBondContact O-CG 3.4Å; K78-E82 PolarHBondContact O-N 3.15Å; K78-F106 HydrophobicContact CB-CD1 3.67Å; K78-F106 HydrophobicContact CB-CE1 3.53Å; K78-F106 HydrophobicContact CB-CG 4.36Å; K78-F106 HydrophobicContact CB-CZ 4.13Å; K78-F106 HydrophobicContact CD-CD1 4.07Å; K78-F106 HydrophobicContact CD-CG 4.43Å; K78-F106 HydrophobicContact CG-CD1 3.83Å; K78-F106 HydrophobicContact CG-CE1 4.18Å; K78-F106 HydrophobicContact CG-CG 4.1Å
79	H	89.3	Confident	89.6	Confident	97 Å²	97	82.2 Å²	82.2	45%	0.449	42%	0.422	S	S	.	.	H	α-helix	trans	-58.3	-40.3	176.7	-176.7	61.7	0	0	0	113.4	S75 Q76 V77 F81 E82 L83	S75-H79 PolarHBondContact O-N 2.03Å; Q76-H79 WeakPolarHBondContact O-CB 3.32Å; Q76-H79 PolarHBondContact O-N 3.39Å; V77-H79 VanDerWaalsContact C-N 3.26Å; V77-H79 PolarHBondContact O-N 3Å; H79-F81 VanDerWaalsContact C-N 3.33Å; H79-F81 PolarHBondContact O-N 3.34Å; H79-E82 IonicContact ND1-OE2 2.74Å; H79-E82 WeakPolarHBondContact O-CB 3.49Å; H79-E82 PolarHBondContact O-N 3.46Å; H79-L83 WeakPolarHBondContact O-CG 3.02Å; H79-L83 PolarHBondContact O-N 3.4Å
80	Y	86.6	Confident	89.8	Confident	154 Å²	154	79.5 Å²	79.5	60%	0.604	41%	0.413	S	S	*	.	H	α-helix	trans	-64.1	-37.6	174.7	-72.2	-67.7	0	0	0	112.5	Q76 V77 K78 L83 L84	Q76-Y80 WeakPolarHBondContact O-CD2 3.32Å; Q76-Y80 PolarHBondContact O-N 3.32Å; V77-Y80 WeakPolarHBondContact O-CB 3.43Å; V77-Y80 PolarHBondContact O-N 2.95Å; K78-Y80 VanDerWaalsContact C-N 3.33Å; K78-Y80 PolarHBondContact O-N 3.5Å; Y80-L83 HydrophobicContact CD1-CD1 4.29Å; Y80-L83 PolarHBondContact O-N 3.14Å; Y80-L84 WeakPolarHBondContact O-CG 3.43Å; Y80-L84 PolarHBondContact O-N 3.48Å
81	F	85.9	Confident	89.9	Confident	70 Å²	70	81.7 Å²	81.7	31%	0.307	43%	0.425	S	S	.	.	H	α-helix	trans	-64.4	-41.6	173.2	-81.1	-83.3	0	0	0	111.9	V77 K78 H79 L83 L84 C85 F102 F106	V77-F81 HydrophobicContact CG1-CD2 4.13Å; V77-F81 HydrophobicContact CG1-CE2 3.87Å; V77-F81 WeakPolarHBondContact O-CD2 3.5Å; V77-F81 PolarHBondContact O-N 3.37Å; K78-F81 WeakPolarHBondContact O-CB 3.44Å; K78-F81 PolarHBondContact O-N 3.03Å; H79-F81 VanDerWaalsContact C-N 3.33Å; H79-F81 PolarHBondContact O-N 3.34Å; F81-L83 VanDerWaalsContact C-N 3.33Å; F81-L83 PolarHBondContact O-N 3.49Å; F81-L84 WeakPolarHBondContact O-CB 3.22Å; F81-L84 PolarHBondContact O-N 3.05Å; F81-C85 PolarHBondContact O-N 3.01Å; F81-C85 PolarHBondContact O-SG 2.05Å; F81-F102 HydrophobicContact CD1-CD2 4.24Å; F81-F102 HydrophobicContact CD1-CE1 4.11Å; F81-F102 AromaticContact CD1-CE2 3.78Å; F81-F102 HydrophobicContact CD1-CE2 3.78Å; F81-F102 AromaticContact CD1-CZ 3.7Å; F81-F102 HydrophobicContact CD1-CZ 3.7Å; F81-F102 AromaticContact CE1-CE1 3.98Å; F81-F102 HydrophobicContact CE1-CE1 3.98Å; F81-F102 HydrophobicContact CE1-CE2 4.22Å; F81-F102 AromaticContact CE1-CZ 3.67Å; F81-F102 HydrophobicContact CE1-CZ 3.67Å; F81-F106 HydrophobicContact CB-CE2 4.46Å; F81-F106 HydrophobicContact CD2-CD2 4.28Å; F81-F106 AromaticContact CD2-CE2 3.23Å; F81-F106 HydrophobicContact CD2-CE2 3.23Å; F81-F106 AromaticContact CD2-CZ 3.69Å; F81-F106 HydrophobicContact CD2-CZ 3.69Å; F81-F106 AromaticContact CE2-CE2 3.49Å; F81-F106 HydrophobicContact CE2-CE2 3.49Å; F81-F106 VanDerWaalsContact CE2-CE2 3.49Å; F81-F106 AromaticContact CE2-CZ 3.93Å; F81-F106 HydrophobicContact CE2-CZ 3.93Å; F81-F106 AromaticContact CG-CE2 3.9Å; F81-F106 HydrophobicContact CG-CE2 3.9Å; F81-F106 HydrophobicContact CZ-CE2 4.32Å
82	E	88.2	Confident	90	Very high	66 Å²	66	83.8 Å²	83.8	31%	0.308	45%	0.449	S	S	.	.	H	α-helix	trans	-61.9	-39.4	175.3	-66.4	169.7	172.6	0	0	111.9	K78 H79 C85 N86 M99	K78-E82 WeakPolarHBondContact O-CG 3.4Å; K78-E82 PolarHBondContact O-N 3.15Å; H79-E82 IonicContact ND1-OE2 2.74Å; H79-E82 WeakPolarHBondContact O-CB 3.49Å; H79-E82 PolarHBondContact O-N 3.46Å; E82-C85 PolarHBondContact O-N 2.87Å; E82-N86 WeakPolarHBondContact O-CB 3.47Å; E82-N86 PolarHBondContact O-N 2.75Å; E82-N86 PolarHBondContact O-ND2 3.44Å; E82-N86 VanDerWaalsContact O-ND2 3.1Å; E82-M99 HydrophobicContact CG-CE 4.17Å
83	L	88.8	Confident	90.1	Very high	93 Å²	93	89.3 Å²	89.3	49%	0.487	46%	0.459	S	S	.	.	H	α-helix	trans	-62.6	-43.3	173.9	-72.4	173.8	0	0	0	111.9	H79 Y80 F81 N86 S87	H79-L83 WeakPolarHBondContact O-CG 3.02Å; H79-L83 PolarHBondContact O-N 3.4Å; Y80-L83 HydrophobicContact CD1-CD1 4.29Å; Y80-L83 PolarHBondContact O-N 3.14Å; F81-L83 VanDerWaalsContact C-N 3.33Å; F81-L83 PolarHBondContact O-N 3.49Å; L83-N86 PolarHBondContact O-N 3.35Å; L83-S87 PolarHBondContact O-N 3.09Å
84	L	88.4	Confident	90.1	Very high	116 Å²	116	86 Å²	86	61%	0.607	45%	0.448	S	S	*	.	H	α-helix	trans	-62	-44.8	175.3	-70.1	172.1	0	0	0	111.3	Y80 F81 N86 S87	Y80-L84 WeakPolarHBondContact O-CG 3.43Å; Y80-L84 PolarHBondContact O-N 3.48Å; F81-L84 WeakPolarHBondContact O-CB 3.22Å; F81-L84 PolarHBondContact O-N 3.05Å; L84-N86 PolarHBondContact O-N 3.42Å; L84-S87 WeakPolarHBondContact O-CB 3.44Å; L84-S87 PolarHBondContact O-N 3.39Å; L84-S87 VanDerWaalsContact O-N 3.16Å
85	C	90.4	Very high	90.1	Very high	2 Å²	2	87.9 Å²	87.9	1%	0.014	45%	0.453	C	S	.	.	H	α-helix	trans	-65.8	-26.2	177	-66.6	0	0	0	0	113	F81 E82 S87 L90 K95 C98 M99	F81-C85 PolarHBondContact O-N 3.01Å; F81-C85 PolarHBondContact O-SG 2.05Å; E82-C85 PolarHBondContact O-N 2.87Å; C85-S87 VanDerWaalsContact C-N 3.35Å; C85-L90 WeakPolarHBondContact O-CD1 3.41Å; C85-K95 VanDerWaalsContact O-CG 3.31Å; C85-K95 WeakPolarHBondContact O-CG 3.09Å; C85-C98 WeakPolarHBondContact CA-SG 3.27Å; C85-C98 HydrophobicContact CB-CB 3.6Å; C85-C98 WeakPolarHBondContact CB-SG 3.45Å; C85-C98 WeakPolarHBondContact SG-CB 3.36Å; C85-C98 CovalentContact SG-SG 2.04Å; C85-C98 PolarHBondContact SG-SG 3.46Å; C85-M99 HydrophobicContact CB-CG 4.07Å; C85-M99 HydrophobicContact CB-SD 3.49Å; C85-M99 WeakPolarHBondContact CB-SD 3.34Å
86	N	90.4	Very high	90.2	Very high	94 Å²	94	89.3 Å²	89.3	50%	0.503	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-0.1	176	-79.9	-44.2	0	0	0	114.7	E82 L83 L84 K95	E82-N86 WeakPolarHBondContact O-CB 3.47Å; E82-N86 PolarHBondContact O-N 2.75Å; E82-N86 PolarHBondContact O-ND2 3.44Å; E82-N86 VanDerWaalsContact O-ND2 3.1Å; L83-N86 PolarHBondContact O-N 3.35Å; L84-N86 PolarHBondContact O-N 3.42Å; N86-K95 PolarHBondContact O-NZ 3.13Å
87	S	91.1	Very high	90.1	Very high	42 Å²	42	90.5 Å²	90.5	29%	0.294	46%	0.456	S	S	.	.			trans	-47.8	139.6	177.9	177.9	0	0	0	0	113	L83 L84 C85 K89 L90 K95	L83-S87 PolarHBondContact O-N 3.09Å; L84-S87 WeakPolarHBondContact O-CB 3.44Å; L84-S87 PolarHBondContact O-N 3.39Å; L84-S87 VanDerWaalsContact O-N 3.16Å; C85-S87 VanDerWaalsContact C-N 3.35Å; S87-K89 PolarHBondContact O-N 2.82Å; S87-K89 VanDerWaalsContact O-N 3.14Å; S87-K89 WeakPolarHBondContact OG-CB 3.31Å; S87-K89 PolarHBondContact OG-N 3.06Å; S87-L90 PolarHBondContact O-N 3.33Å; S87-L90 VanDerWaalsContact O-N 3.12Å; S87-K95 VanDerWaalsContact O-CE 3.23Å; S87-K95 WeakPolarHBondContact O-CE 3.46Å
88	S	92	Very high	90.1	Very high	117 Å²	117	90.1 Å²	90.1	82%	0.818	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-11.7	173.5	58.8	0	0	0	0	113.3	L90	S88-L90 VanDerWaalsContact C-N 3.3Å
89	K	92.1	Very high	90	Very high	189 Å²	189	89.9 Å²	89.9	82%	0.822	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-16.7	174	-60.8	-65.7	-176.2	179.7	0	113.2	S87	S87-K89 PolarHBondContact O-N 2.82Å; S87-K89 VanDerWaalsContact O-N 3.14Å; S87-K89 WeakPolarHBondContact OG-CB 3.31Å; S87-K89 PolarHBondContact OG-N 3.06Å
90	L	91.4	Very high	89.8	Confident	61 Å²	61	89.7 Å²	89.7	32%	0.319	46%	0.457	S	S	.	.	S	Bend	trans	-99.1	131	178.7	-66.8	172.5	0	0	0	110.6	C85 S87 S88 K95 C98	C85-L90 WeakPolarHBondContact O-CD1 3.41Å; S87-L90 PolarHBondContact O-N 3.33Å; S87-L90 VanDerWaalsContact O-N 3.12Å; S88-L90 VanDerWaalsContact C-N 3.3Å; L90-K95 HydrophobicContact CB-CG 3.71Å; L90-K95 WeakPolarHBondContact O-CE 3.47Å; L90-C98 HydrophobicContact CD1-CB 4.26Å
91	N	93.8	Very high	89.3	Confident	110 Å²	110	87.6 Å²	87.6	59%	0.588	46%	0.456	S	S	*	.			trans	-71.8	170.4	168.1	68.3	21.6	0	0	0	110.5	R93 G94 K95	N91-R93 PolarHBondContact O-N 3.28Å; N91-R93 VanDerWaalsContact O-N 3.11Å; N91-R93 PolarHBondContact OD1-N 3.29Å; N91-G94 PolarHBondContact O-N 3.42Å; N91-G94 PolarHBondContact OD1-N 2.92Å; N91-K95 WeakPolarHBondContact O-CG 3.22Å; N91-K95 PolarHBondContact O-N 2.82Å
92	A	92.5	Very high	88.8	Confident	88 Å²	88	87 Å²	87	73%	0.727	45%	0.453	S	S	*	.	H	α-helix	trans	-51.9	-39.3	-177.8	0	0	0	0	0	113.4	Q96	A92-Q96 PolarHBondContact O-N 2.83Å
93	R	92.4	Very high	88	Confident	190 Å²	190	89 Å²	89	72%	0.717	46%	0.462	S	S	*	.	H	α-helix	trans	-66.4	-45.4	176.3	-178.2	-179.7	-71.7	-164.6	-2.3	112.1	N91 K95 Q96 Q97	N91-R93 PolarHBondContact O-N 3.28Å; N91-R93 VanDerWaalsContact O-N 3.11Å; N91-R93 PolarHBondContact OD1-N 3.29Å; R93-K95 VanDerWaalsContact C-N 3.35Å; R93-Q96 PolarHBondContact O-N 3.04Å; R93-Q97 HydrophobicContact CG-CG 4.48Å; R93-Q97 WeakPolarHBondContact O-CG 3.38Å; R93-Q97 PolarHBondContact O-N 3.14Å
94	G	91	Very high	87.3	Confident	12 Å²	12	91.2 Å²	91.2	12%	0.124	48%	0.475	C	S	.	.	H	α-helix	trans	-64.3	-38.7	179.6	0	0	0	0	0	112.5	N91 Q97 C98	N91-G94 PolarHBondContact O-N 3.42Å; N91-G94 PolarHBondContact OD1-N 2.92Å; G94-Q97 PolarHBondContact O-N 3.37Å; G94-C98 VanDerWaalsContact O-CB 3.28Å; G94-C98 WeakPolarHBondContact O-CB 3.03Å; G94-C98 PolarHBondContact O-N 3.45Å
95	K	92.2	Very high	87	Confident	66 Å²	66	94 Å²	94	29%	0.287	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-49.3	173.2	-62.8	-165.2	175	-167.4	0	111.1	C85 N86 S87 L90 N91 R93 Q97 C98 M99	C85-K95 VanDerWaalsContact O-CG 3.31Å; C85-K95 WeakPolarHBondContact O-CG 3.09Å; N86-K95 PolarHBondContact O-NZ 3.13Å; S87-K95 VanDerWaalsContact O-CE 3.23Å; S87-K95 WeakPolarHBondContact O-CE 3.46Å; L90-K95 HydrophobicContact CB-CG 3.71Å; L90-K95 WeakPolarHBondContact O-CE 3.47Å; N91-K95 WeakPolarHBondContact O-CG 3.22Å; N91-K95 PolarHBondContact O-N 2.82Å; R93-K95 VanDerWaalsContact C-N 3.35Å; K95-Q97 PolarHBondContact O-N 2.95Å; K95-C98 WeakPolarHBondContact O-CB 3.31Å; K95-C98 PolarHBondContact O-N 3.28Å; K95-M99 WeakPolarHBondContact O-CG 3.28Å; K95-M99 PolarHBondContact O-N 3.49Å
96	Q	90.1	Very high	86.9	Confident	110 Å²	110	94.4 Å²	94.4	51%	0.514	48%	0.479	S	S	.	.	H	α-helix	trans	-61.3	-45.8	178.3	-170.1	65.6	48	0	0	112.3	A92 R93 C98 M99 N100	A92-Q96 PolarHBondContact O-N 2.83Å; R93-Q96 PolarHBondContact O-N 3.04Å; Q96-C98 VanDerWaalsContact C-N 3.28Å; Q96-C98 PolarHBondContact O-N 3.12Å; Q96-M99 PolarHBondContact O-N 3.23Å; Q96-N100 PolarHBondContact NE2-OD1 3.05Å; Q96-N100 WeakPolarHBondContact O-CB 3.44Å; Q96-N100 PolarHBondContact O-N 3.43Å; Q96-N100 PolarHBondContact O-OD1 2.04Å
97	Q	87.6	Confident	86.8	Confident	128 Å²	128	93.1 Å²	93.1	60%	0.598	47%	0.472	S	S	*	.	H	α-helix	trans	-62.4	-37.1	178.3	-72.9	-179.7	-55.9	0	0	112.2	R93 G94 K95 L101	R93-Q97 HydrophobicContact CG-CG 4.48Å; R93-Q97 WeakPolarHBondContact O-CG 3.38Å; R93-Q97 PolarHBondContact O-N 3.14Å; G94-Q97 PolarHBondContact O-N 3.37Å; K95-Q97 PolarHBondContact O-N 2.95Å; Q97-L101 PolarHBondContact O-N 3.49Å
98	C	89.5	Confident	86.6	Confident	32 Å²	32	96.9 Å²	96.9	22%	0.216	49%	0.485	C	S	.	.	H	α-helix	trans	-66.3	-47.4	176.6	-171	0	0	0	0	111.6	C85 L90 G94 K95 Q96 L101 F102	C85-C98 WeakPolarHBondContact CA-SG 3.27Å; C85-C98 HydrophobicContact CB-CB 3.6Å; C85-C98 WeakPolarHBondContact CB-SG 3.45Å; C85-C98 WeakPolarHBondContact SG-CB 3.36Å; C85-C98 CovalentContact SG-SG 2.04Å; C85-C98 PolarHBondContact SG-SG 3.46Å; L90-C98 HydrophobicContact CD1-CB 4.26Å; G94-C98 VanDerWaalsContact O-CB 3.28Å; G94-C98 WeakPolarHBondContact O-CB 3.03Å; G94-C98 PolarHBondContact O-N 3.45Å; K95-C98 WeakPolarHBondContact O-CB 3.31Å; K95-C98 PolarHBondContact O-N 3.28Å; Q96-C98 VanDerWaalsContact C-N 3.28Å; Q96-C98 PolarHBondContact O-N 3.12Å; C98-L101 WeakPolarHBondContact O-CB 3.26Å; C98-L101 PolarHBondContact O-N 3.06Å; C98-F102 WeakPolarHBondContact O-CD2 3.4Å
99	M	87.2	Confident	86.3	Confident	50 Å²	50	94.2 Å²	94.2	25%	0.246	47%	0.47	C	S	.	.	H	α-helix	trans	-61.2	-47.9	178	-65.2	-61.5	-71.4	0	0	111.2	E82 C85 K95 Q96 L101 F102 E103	E82-M99 HydrophobicContact CG-CE 4.17Å; C85-M99 HydrophobicContact CB-CG 4.07Å; C85-M99 HydrophobicContact CB-SD 3.49Å; C85-M99 WeakPolarHBondContact CB-SD 3.34Å; K95-M99 WeakPolarHBondContact O-CG 3.28Å; K95-M99 PolarHBondContact O-N 3.49Å; Q96-M99 PolarHBondContact O-N 3.23Å; M99-L101 PolarHBondContact O-N 2.93Å; M99-L101 VanDerWaalsContact O-N 3.08Å; M99-F102 PolarHBondContact O-N 2.88Å; M99-E103 WeakPolarHBondContact O-CB 3.49Å; M99-E103 PolarHBondContact O-N 2.92Å
100	N	85	Confident	86.2	Confident	94 Å²	94	86.2 Å²	86.2	50%	0.503	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-24.8	178.8	-70.5	6.9	0	0	0	113.8	Q96 F102	Q96-N100 PolarHBondContact NE2-OD1 3.05Å; Q96-N100 WeakPolarHBondContact O-CB 3.44Å; Q96-N100 PolarHBondContact O-N 3.43Å; Q96-N100 PolarHBondContact O-OD1 2.04Å; N100-F102 PolarHBondContact O-N 3.49Å
101	L	76.2	Confident	86.1	Confident	110 Å²	110	88 Å²	88	58%	0.576	44%	0.442	S	S	*	.	H	α-helix	trans	-67	-29.1	179.7	-172.1	62.2	0	0	0	111.8	Q97 C98 M99	Q97-L101 PolarHBondContact O-N 3.49Å; C98-L101 WeakPolarHBondContact O-CB 3.26Å; C98-L101 PolarHBondContact O-N 3.06Å; M99-L101 PolarHBondContact O-N 2.93Å; M99-L101 VanDerWaalsContact O-N 3.08Å
102	F	74	Confident	85.7	Confident	58 Å²	58	85.5 Å²	85.5	25%	0.254	44%	0.437	S	S	.	.	H	α-helix	trans	-118.6	-23.3	-170.1	-61.6	-69.9	0	0	0	114	F81 C98 M99 N100 D104 R105 F106	F81-F102 HydrophobicContact CD1-CD2 4.24Å; F81-F102 HydrophobicContact CD1-CE1 4.11Å; F81-F102 AromaticContact CD1-CE2 3.78Å; F81-F102 HydrophobicContact CD1-CE2 3.78Å; F81-F102 AromaticContact CD1-CZ 3.7Å; F81-F102 HydrophobicContact CD1-CZ 3.7Å; F81-F102 AromaticContact CE1-CE1 3.98Å; F81-F102 HydrophobicContact CE1-CE1 3.98Å; F81-F102 HydrophobicContact CE1-CE2 4.22Å; F81-F102 AromaticContact CE1-CZ 3.67Å; F81-F102 HydrophobicContact CE1-CZ 3.67Å; C98-F102 WeakPolarHBondContact O-CD2 3.4Å; M99-F102 PolarHBondContact O-N 2.88Å; N100-F102 PolarHBondContact O-N 3.49Å; F102-D104 VanDerWaalsContact C-N 3.27Å; F102-D104 PolarHBondContact O-N 3.16Å; F102-R105 PolarHBondContact O-N 2.86Å; F102-F106 HydrophobicContact CB-CB 4.27Å; F102-F106 HydrophobicContact CB-CD2 4.13Å; F102-F106 AromaticContact CD1-CD2 3.9Å; F102-F106 HydrophobicContact CD1-CD2 3.9Å; F102-F106 HydrophobicContact CG-CD2 4.29Å; F102-F106 WeakPolarHBondContact O-CB 3.42Å; F102-F106 PolarHBondContact O-N 3.11Å
103	E	72.3	Confident	85.5	Confident	106 Å²	106	85.6 Å²	85.6	50%	0.495	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-38.7	-165	-157.2	161.9	-175.3	0	0	114.6	M99	M99-E103 WeakPolarHBondContact O-CB 3.49Å; M99-E103 PolarHBondContact O-N 2.92Å
104	D	74.9	Confident	85.4	Confident	140 Å²	140	77 Å²	77	75%	0.749	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-7.9	-175.7	-60.9	-33.3	0	0	0	115.4	F102	F102-D104 VanDerWaalsContact C-N 3.27Å; F102-D104 PolarHBondContact O-N 3.16Å
105	R	81.9	Confident	85.1	Confident	176 Å²	176	79.9 Å²	79.9	66%	0.664	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.7	3	-172.6	-66.6	-168.5	-67	-149.3	-3.1	114.1	F102 D107 E108 A109	F102-R105 PolarHBondContact O-N 2.86Å; R105-D107 PolarHBondContact O-N 3.06Å; R105-E108 WeakPolarHBondContact CA-OE2 2.94Å; R105-A109 WeakPolarHBondContact O-CB 3.5Å; R105-A109 PolarHBondContact O-N 2.94Å
106	F	87.4	Confident	84.5	Confident	9 Å²	9	83.4 Å²	83.4	4%	0.039	43%	0.425	C	S	.	.	H	α-helix	trans	-59.4	-49.7	-175.5	-176.9	-93.8	0	0	0	111.4	S74 V77 K78 F81 F102 A109 F110	S74-F106 WeakPolarHBondContact O-CE1 3.48Å; V77-F106 HydrophobicContact CB-CE1 4.47Å; V77-F106 HydrophobicContact CB-CZ 4.08Å; V77-F106 HydrophobicContact CG1-CZ 3.84Å; K78-F106 HydrophobicContact CB-CD1 3.67Å; K78-F106 HydrophobicContact CB-CE1 3.53Å; K78-F106 HydrophobicContact CB-CG 4.36Å; K78-F106 HydrophobicContact CB-CZ 4.13Å; K78-F106 HydrophobicContact CD-CD1 4.07Å; K78-F106 HydrophobicContact CD-CG 4.43Å; K78-F106 HydrophobicContact CG-CD1 3.83Å; K78-F106 HydrophobicContact CG-CE1 4.18Å; K78-F106 HydrophobicContact CG-CG 4.1Å; F81-F106 HydrophobicContact CB-CE2 4.46Å; F81-F106 HydrophobicContact CD2-CD2 4.28Å; F81-F106 AromaticContact CD2-CE2 3.23Å; F81-F106 HydrophobicContact CD2-CE2 3.23Å; F81-F106 AromaticContact CD2-CZ 3.69Å; F81-F106 HydrophobicContact CD2-CZ 3.69Å; F81-F106 AromaticContact CE2-CE2 3.49Å; F81-F106 HydrophobicContact CE2-CE2 3.49Å; F81-F106 VanDerWaalsContact CE2-CE2 3.49Å; F81-F106 AromaticContact CE2-CZ 3.93Å; F81-F106 HydrophobicContact CE2-CZ 3.93Å; F81-F106 AromaticContact CG-CE2 3.9Å; F81-F106 HydrophobicContact CG-CE2 3.9Å; F81-F106 HydrophobicContact CZ-CE2 4.32Å; F102-F106 HydrophobicContact CB-CB 4.27Å; F102-F106 HydrophobicContact CB-CD2 4.13Å; F102-F106 AromaticContact CD1-CD2 3.9Å; F102-F106 HydrophobicContact CD1-CD2 3.9Å; F102-F106 HydrophobicContact CG-CD2 4.29Å; F102-F106 WeakPolarHBondContact O-CB 3.42Å; F102-F106 PolarHBondContact O-N 3.11Å; F106-A109 PolarHBondContact O-N 3.08Å; F106-F110 HydrophobicContact CD1-CB 4.45Å; F106-F110 HydrophobicContact CE1-CB 4.08Å; F106-F110 HydrophobicContact CE1-CG 4.26Å; F106-F110 HydrophobicContact CZ-CB 4.32Å; F106-F110 HydrophobicContact CZ-CD2 4.32Å; F106-F110 HydrophobicContact CZ-CG 4.41Å; F106-F110 WeakPolarHBondContact O-CB 3.27Å; F106-F110 PolarHBondContact O-N 3.08Å
107	D	88.6	Confident	84.2	Confident	68 Å²	68	84.2 Å²	84.2	36%	0.364	43%	0.427	S	S	.	.	H	α-helix	trans	-68.6	-42.2	-173	-70.4	-57	0	0	0	111.5	S74 R105 F110 Q111	S74-D107 WeakPolarHBondContact CB-OD1 3.34Å; S74-D107 PolarHBondContact OG-OD1 3.42Å; R105-D107 PolarHBondContact O-N 3.06Å; D107-F110 PolarHBondContact O-N 2.91Å; D107-Q111 VanDerWaalsContact O-CB 3.27Å; D107-Q111 WeakPolarHBondContact O-CB 3.07Å; D107-Q111 PolarHBondContact O-N 2.91Å
108	E	86.1	Confident	84.2	Confident	121 Å²	121	79.1 Å²	79.1	57%	0.565	40%	0.404	S	S	*	.	H	α-helix	trans	-66.6	-42.8	175.1	-60.1	86.3	173.8	0	0	111.9	R105 Q111 A112	R105-E108 WeakPolarHBondContact CA-OE2 2.94Å; E108-Q111 PolarHBondContact O-N 3.27Å; E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.05Å; E108-A112 PolarHBondContact O-N 3.34Å
109	A	86.1	Confident	84	Confident	60 Å²	60	80.2 Å²	80.2	50%	0.496	41%	0.408	S	S	.	.	H	α-helix	trans	-65.1	-41.1	177.9	0	0	0	0	0	111.4	R105 F106 A112 L113	R105-A109 WeakPolarHBondContact O-CB 3.5Å; R105-A109 PolarHBondContact O-N 2.94Å; F106-A109 PolarHBondContact O-N 3.08Å; A109-A112 PolarHBondContact O-N 2.81Å; A109-L113 VanDerWaalsContact O-CB 3.26Å; A109-L113 WeakPolarHBondContact O-CB 3.34Å; A109-L113 PolarHBondContact O-N 2.71Å
110	F	89.7	Confident	83.6	Confident	21 Å²	21	79.9 Å²	79.9	9%	0.092	41%	0.413	C	S	.	.	H	α-helix	trans	-65.7	-45.7	177.1	-177.6	-108.5	0	0	0	111	I70 S74 V77 F106 D107 A112 L113 V114	I70-F110 HydrophobicContact CG2-CE1 4.27Å; I70-F110 HydrophobicContact CG2-CE2 4.5Å; I70-F110 HydrophobicContact CG2-CZ 3.68Å; I70-F110 WeakPolarHBondContact O-CE1 3.38Å; S74-F110 VanDerWaalsContact CB-CD1 3.45Å; V77-F110 HydrophobicContact CB-CE2 4.03Å; V77-F110 HydrophobicContact CB-CZ 4.19Å; V77-F110 HydrophobicContact CG1-CD2 4.25Å; V77-F110 HydrophobicContact CG1-CE2 3.85Å; V77-F110 HydrophobicContact CG1-CZ 4.49Å; V77-F110 HydrophobicContact CG2-CE2 3.83Å; V77-F110 HydrophobicContact CG2-CZ 3.67Å; F106-F110 HydrophobicContact CD1-CB 4.45Å; F106-F110 HydrophobicContact CE1-CB 4.08Å; F106-F110 HydrophobicContact CE1-CG 4.26Å; F106-F110 HydrophobicContact CZ-CB 4.32Å; F106-F110 HydrophobicContact CZ-CD2 4.32Å; F106-F110 HydrophobicContact CZ-CG 4.41Å; F106-F110 WeakPolarHBondContact O-CB 3.27Å; F106-F110 PolarHBondContact O-N 3.08Å; D107-F110 PolarHBondContact O-N 2.91Å; F110-A112 PolarHBondContact O-N 3.26Å; F110-L113 WeakPolarHBondContact O-CB 2.98Å; F110-L113 PolarHBondContact O-N 3.37Å; F110-V114 HydrophobicContact CD1-CG2 4.42Å; F110-V114 HydrophobicContact CE1-CG2 4.12Å; F110-V114 HydrophobicContact CE2-CG2 4.24Å; F110-V114 HydrophobicContact CZ-CG2 4.02Å; F110-V114 VanDerWaalsContact O-CG2 3.29Å; F110-V114 WeakPolarHBondContact O-CG2 3.35Å; F110-V114 PolarHBondContact O-N 3.49Å
111	Q	89.7	Confident	83.4	Confident	99 Å²	99	78.1 Å²	78.1	46%	0.463	41%	0.411	S	S	.	.	H	α-helix	trans	-61.5	-44	174.9	176.5	170.5	-22.4	0	0	111.9	I71 D107 E108 L113 V114 N115	I71-Q111 HydrophobicContact CD1-CG 4.16Å; D107-Q111 VanDerWaalsContact O-CB 3.27Å; D107-Q111 WeakPolarHBondContact O-CB 3.07Å; D107-Q111 PolarHBondContact O-N 2.91Å; E108-Q111 PolarHBondContact O-N 3.27Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; Q111-L113 PolarHBondContact O-N 2.91Å; Q111-V114 PolarHBondContact O-N 3.31Å; Q111-N115 WeakPolarHBondContact O-CB 3.24Å; Q111-N115 VanDerWaalsContact O-CG 3.27Å; Q111-N115 PolarHBondContact O-N 2.78Å; Q111-N115 PolarHBondContact O-ND2 3.1Å
112	A	85.7	Confident	83.7	Confident	58 Å²	58	75.9 Å²	75.9	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-42.7	176.3	0	0	0	0	0	111.5	E108 A109 F110 N115 M116	E108-A112 VanDerWaalsContact O-CB 3.25Å; E108-A112 WeakPolarHBondContact O-CB 3.05Å; E108-A112 PolarHBondContact O-N 3.34Å; A109-A112 PolarHBondContact O-N 2.81Å; F110-A112 PolarHBondContact O-N 3.26Å; A112-N115 PolarHBondContact O-N 3.43Å; A112-M116 VanDerWaalsContact O-CB 3.25Å; A112-M116 WeakPolarHBondContact O-CB 3.25Å; A112-M116 PolarHBondContact O-N 3.41Å
113	L	87.1	Confident	84.1	Confident	90 Å²	90	73.1 Å²	73.1	47%	0.471	39%	0.388	S	S	.	.	H	α-helix	trans	-60.1	-49.4	175.5	-172.1	73.3	0	0	0	111.3	A109 F110 Q111 N115 M116 F117	A109-L113 VanDerWaalsContact O-CB 3.26Å; A109-L113 WeakPolarHBondContact O-CB 3.34Å; A109-L113 PolarHBondContact O-N 2.71Å; F110-L113 WeakPolarHBondContact O-CB 2.98Å; F110-L113 PolarHBondContact O-N 3.37Å; Q111-L113 VanDerWaalsContact C-N 3.34Å; Q111-L113 PolarHBondContact O-N 2.91Å; L113-N115 PolarHBondContact O-N 3.36Å; L113-M116 WeakPolarHBondContact O-CB 3.23Å; L113-M116 PolarHBondContact O-N 3.37Å; L113-F117 HydrophobicContact CD1-CD2 3.87Å; L113-F117 HydrophobicContact CD1-CE2 3.53Å; L113-F117 HydrophobicContact CG-CD2 4.03Å; L113-F117 HydrophobicContact CG-CE2 4.17Å; L113-F117 WeakPolarHBondContact O-CD2 3.4Å; L113-F117 PolarHBondContact O-N 3.05Å
114	V	90.5	Very high	84.5	Confident	9 Å²	9	71.9 Å²	71.9	6%	0.055	38%	0.384	C	S	.	.	H	α-helix	trans	-62.5	-44.6	179.1	175.8	0	0	0	0	110.9	A67 I70 I71 F110 Q111 M116 F117 V118	A67-V114 HydrophobicContact CB-CG1 3.97Å; I70-V114 HydrophobicContact CB-CG1 4.12Å; I70-V114 HydrophobicContact CB-CG2 4.25Å; I70-V114 HydrophobicContact CG2-CG1 4.24Å; I70-V114 HydrophobicContact CG2-CG2 3.49Å; I70-V114 VanDerWaalsContact CG2-CG2 3.49Å; I71-V114 HydrophobicContact CD1-CB 4.47Å; I71-V114 HydrophobicContact CD1-CG1 4.18Å; I71-V114 HydrophobicContact CG1-CB 3.98Å; I71-V114 HydrophobicContact CG1-CG1 3.85Å; I71-V114 HydrophobicContact CG1-CG2 4.31Å; F110-V114 HydrophobicContact CD1-CG2 4.42Å; F110-V114 HydrophobicContact CE1-CG2 4.12Å; F110-V114 HydrophobicContact CE2-CG2 4.24Å; F110-V114 HydrophobicContact CZ-CG2 4.02Å; F110-V114 VanDerWaalsContact O-CG2 3.29Å; F110-V114 WeakPolarHBondContact O-CG2 3.35Å; F110-V114 PolarHBondContact O-N 3.49Å; Q111-V114 PolarHBondContact O-N 3.31Å; V114-M116 VanDerWaalsContact C-N 3.26Å; V114-M116 PolarHBondContact O-N 2.82Å; V114-F117 PolarHBondContact O-N 3.48Å; V114-V118 HydrophobicContact CG1-CB 4.47Å; V114-V118 WeakPolarHBondContact O-CA 3.43Å; V114-V118 WeakPolarHBondContact O-CB 3.49Å; V114-V118 PolarHBondContact O-N 3.23Å
115	N	84.5	Confident	84.6	Confident	72 Å²	72	74.5 Å²	74.5	39%	0.385	39%	0.385	S	S	.	.	H	α-helix	trans	-68.5	-26.5	177.6	-70.7	-24.3	0	0	0	112.5	Q111 A112 L113 N119	Q111-N115 WeakPolarHBondContact O-CB 3.24Å; Q111-N115 VanDerWaalsContact O-CG 3.27Å; Q111-N115 PolarHBondContact O-N 2.78Å; Q111-N115 PolarHBondContact O-ND2 3.1Å; A112-N115 PolarHBondContact O-N 3.43Å; L113-N115 PolarHBondContact O-N 3.36Å; N115-N119 VanDerWaalsContact O-CB 3.28Å; N115-N119 WeakPolarHBondContact O-CB 2.85Å; N115-N119 PolarHBondContact O-ND2 3.26Å
116	M	80.5	Confident	84.1	Confident	141 Å²	141	67.6 Å²	67.6	70%	0.695	37%	0.369	S	S	*	.	H	α-helix	trans	-71.9	-41.2	173.9	-179.4	179	177.6	0	0	111.6	A112 L113 V114 N119	A112-M116 VanDerWaalsContact O-CB 3.25Å; A112-M116 WeakPolarHBondContact O-CB 3.25Å; A112-M116 PolarHBondContact O-N 3.41Å; L113-M116 WeakPolarHBondContact O-CB 3.23Å; L113-M116 PolarHBondContact O-N 3.37Å; V114-M116 VanDerWaalsContact C-N 3.26Å; V114-M116 PolarHBondContact O-N 2.82Å; M116-N119 PolarHBondContact O-ND2 3.32Å
117	F	84.4	Confident	83.5	Confident	127 Å²	127	73.5 Å²	73.5	56%	0.557	40%	0.397	S	S	*	.	H	α-helix	trans	-86.7	-36.2	-177.7	-80.4	-73.2	0	0	0	113.9	L113 V114 L122	L113-F117 HydrophobicContact CD1-CD2 3.87Å; L113-F117 HydrophobicContact CD1-CE2 3.53Å; L113-F117 HydrophobicContact CG-CD2 4.03Å; L113-F117 HydrophobicContact CG-CE2 4.17Å; L113-F117 WeakPolarHBondContact O-CD2 3.4Å; L113-F117 PolarHBondContact O-N 3.05Å; V114-F117 PolarHBondContact O-N 3.48Å; F117-L122 WeakPolarHBondContact O-CD1 3.29Å; F117-L122 VanDerWaalsContact O-CG 3.27Å; F117-L122 WeakPolarHBondContact O-CG 3.38Å
118	V	86.8	Confident	82.6	Confident	21 Å²	21	75.1 Å²	75.1	13%	0.127	40%	0.401	C	S	.	.	S	Bend	trans	-116.9	73.4	-173.4	-167.2	0	0	0	0	109.5	T63 V66 A67 I70 V114 L122	T63-V118 VanDerWaalsContact O-CG1 3.31Å; T63-V118 WeakPolarHBondContact O-CG1 3.44Å; V66-V118 HydrophobicContact CB-CG1 4.03Å; V66-V118 HydrophobicContact CG1-CG1 3.89Å; A67-V118 HydrophobicContact CB-CB 4.21Å; A67-V118 HydrophobicContact CB-CG1 4.11Å; I70-V118 HydrophobicContact CD1-CG2 4.24Å; V114-V118 HydrophobicContact CG1-CB 4.47Å; V114-V118 WeakPolarHBondContact O-CA 3.43Å; V114-V118 WeakPolarHBondContact O-CB 3.49Å; V114-V118 PolarHBondContact O-N 3.23Å; V118-L122 HydrophobicContact CG1-CD1 4.47Å
119	N	85.5	Confident	81.8	Confident	55 Å²	55	69.8 Å²	69.8	29%	0.294	38%	0.376	S	S	.	.	S	Bend	trans	-129.7	175.4	175.3	59.3	53.9	0	0	0	111.3	T63 N115 M116 A121 L122	T63-N119 WeakPolarHBondContact CG2-O 3.15Å; N115-N119 VanDerWaalsContact O-CB 3.28Å; N115-N119 WeakPolarHBondContact O-CB 2.85Å; N115-N119 PolarHBondContact O-ND2 3.26Å; M116-N119 PolarHBondContact O-ND2 3.32Å; N119-A121 PolarHBondContact O-N 2.84Å; N119-A121 VanDerWaalsContact O-N 3.11Å; N119-A121 WeakPolarHBondContact OD1-CA 3.35Å; N119-A121 WeakPolarHBondContact OD1-CB 3.46Å; N119-A121 PolarHBondContact OD1-N 3.16Å; N119-L122 VanDerWaalsContact O-CB 3.3Å; N119-L122 WeakPolarHBondContact O-CB 3.48Å; N119-L122 PolarHBondContact O-N 2.97Å
120	A	78.4	Confident	81	Confident	43 Å²	43	72.2 Å²	72.2	36%	0.355	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.7	-179.2	0	0	0	0	0	114.1	K60 L122 C123	K60-A120 HydrophobicContact CG-CB 4.19Å; A120-L122 PolarHBondContact O-N 3.39Å; A120-C123 WeakPolarHBondContact O-CA 3.42Å; A120-C123 WeakPolarHBondContact O-CB 3.28Å; A120-C123 PolarHBondContact O-N 3.46Å
121	A	80.1	Confident	79.3	Confident	56 Å²	56	78 Å²	78	46%	0.463	41%	0.413	S	S	.	.	H	α-helix	trans	-67.3	-23	177.1	0	0	0	0	0	112.3	N119 C123 D124 Y125	N119-A121 PolarHBondContact O-N 2.84Å; N119-A121 VanDerWaalsContact O-N 3.11Å; N119-A121 WeakPolarHBondContact OD1-CA 3.35Å; N119-A121 WeakPolarHBondContact OD1-CB 3.46Å; N119-A121 PolarHBondContact OD1-N 3.16Å; A121-C123 PolarHBondContact O-N 3.44Å; A121-D124 PolarHBondContact O-N 3.41Å; A121-Y125 WeakPolarHBondContact O-CB 3.19Å; A121-Y125 PolarHBondContact O-N 2.03Å
122	L	84	Confident	77.1	Confident	63 Å²	63	84 Å²	84	33%	0.33	43%	0.432	S	S	.	.	H	α-helix	trans	-57.6	-31.1	167.5	-76	-179.3	0	0	0	112	W62 T63 F117 V118 N119 A120 G126	W62-L122 HydrophobicContact CZ3-CD1 4.36Å; T63-L122 HydrophobicContact CG2-CB 4.2Å; T63-L122 HydrophobicContact CG2-CD1 4.15Å; F117-L122 WeakPolarHBondContact O-CD1 3.29Å; F117-L122 VanDerWaalsContact O-CG 3.27Å; F117-L122 WeakPolarHBondContact O-CG 3.38Å; V118-L122 HydrophobicContact CG1-CD1 4.47Å; N119-L122 VanDerWaalsContact O-CB 3.3Å; N119-L122 WeakPolarHBondContact O-CB 3.48Å; N119-L122 PolarHBondContact O-N 2.97Å; A120-L122 PolarHBondContact O-N 3.39Å; L122-G126 PolarHBondContact O-N 2.96Å
123	C	82.6	Confident	74.8	Confident	0 Å²	0	84.7 Å²	84.7	0%	0	44%	0.444	C	S	.	.	H	α-helix	trans	-74.7	-35.3	-179.7	-54.6	0	0	0	0	111.8	C59 K60 A120 A121 H127 F128 C129	C59-C123 HydrophobicContact CB-CB 3.67Å; C59-C123 WeakPolarHBondContact CB-SG 3.37Å; C59-C123 PolarHBondContact O-SG 3.14Å; C59-C123 VanDerWaalsContact O-SG 3.39Å; C59-C123 WeakPolarHBondContact SG-CA 3.48Å; C59-C123 WeakPolarHBondContact SG-CB 3.44Å; C59-C123 CovalentContact SG-SG 2.03Å; C59-C123 PolarHBondContact SG-SG 3.46Å; K60-C123 PolarHBondContact N-SG 3.16Å; K60-C123 VanDerWaalsContact N-SG 3.45Å; A120-C123 WeakPolarHBondContact O-CA 3.42Å; A120-C123 WeakPolarHBondContact O-CB 3.28Å; A120-C123 PolarHBondContact O-N 3.46Å; A121-C123 PolarHBondContact O-N 3.44Å; C123-H127 PolarHBondContact O-N 3.17Å; C123-F128 HydrophobicContact CB-CB 4.3Å; C123-F128 WeakPolarHBondContact O-CA 3.39Å; C123-F128 WeakPolarHBondContact O-CB 2.96Å; C123-F128 PolarHBondContact O-N 2.83Å; C123-C129 HydrophobicContact CB-CB 4.28Å; C123-C129 WeakPolarHBondContact CB-SG 3.39Å; C123-C129 PolarHBondContact O-N 3.43Å
124	D	79.3	Confident	72.6	Confident	80 Å²	80	89.6 Å²	89.6	43%	0.428	46%	0.461	S	S	.	.	H	α-helix	trans	-68.5	-46.7	171.4	-59.9	-45.1	0	0	0	110.1	A121 G126 H127 C129 F130	A121-D124 PolarHBondContact O-N 3.41Å; D124-G126 VanDerWaalsContact C-N 3.34Å; D124-G126 PolarHBondContact O-N 3.4Å; D124-H127 PolarHBondContact O-N 2.75Å; D124-H127 VanDerWaalsContact O-N 3.1Å; D124-C129 WeakPolarHBondContact OD1-CB 3.03Å; D124-F130 WeakPolarHBondContact O-CE2 3.48Å
125	Y	77.2	Confident	69.9	Low	195 Å²	195	96.4 Å²	96.4	77%	0.765	50%	0.498	S	S	*	.	H	α-helix	trans	-61.7	-40.5	178.6	-173.5	-95.6	0	0	0	112.6	A121 H127	A121-Y125 WeakPolarHBondContact O-CB 3.19Å; A121-Y125 PolarHBondContact O-N 2.03Å; Y125-H127 PolarHBondContact O-N 2.8Å
126	G	71.8	Confident	67.8	Low	32 Å²	32	99.1 Å²	99.1	33%	0.33	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	8.5	177	0	0	0	0	0	114.4	L122 D124 F128	L122-G126 PolarHBondContact O-N 2.96Å; D124-G126 VanDerWaalsContact C-N 3.34Å; D124-G126 PolarHBondContact O-N 3.4Å; G126-F128 WeakPolarHBondContact O-CD2 3.08Å; G126-F128 WeakPolarHBondContact O-CE2 3.5Å; G126-F128 PolarHBondContact O-N 2.8Å; G126-F128 VanDerWaalsContact O-N 3.11Å
127	H	74	Confident	65.4	Low	133 Å²	133	98.3 Å²	98.3	62%	0.616	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	9.6	-176	-62	-81.6	0	0	0	116.1	C123 D124 Y125 C129 F130	C123-H127 PolarHBondContact O-N 3.17Å; D124-H127 PolarHBondContact O-N 2.75Å; D124-H127 VanDerWaalsContact O-N 3.1Å; Y125-H127 PolarHBondContact O-N 2.8Å; H127-C129 VanDerWaalsContact C-N 3.33Å; H127-C129 PolarHBondContact O-N 2.83Å; H127-F130 HydrophobicContact CB-CD2 3.98Å; H127-F130 HydrophobicContact CB-CE2 4.31Å; H127-F130 AromaticContact CE1-CE2 3.38Å; H127-F130 WeakPolarHBondContact CE1-CE2 3.4Å; H127-F130 AromaticContact CE1-CZ 3.44Å; H127-F130 VanDerWaalsContact CE1-CZ 3.44Å; H127-F130 WeakPolarHBondContact CE1-CZ 3.25Å; H127-F130 AromaticContact CG-CD2 3.91Å; H127-F130 AromaticContact CG-CE2 3.75Å; H127-F130 AromaticContact ND1-CD2 3.24Å; H127-F130 WeakPolarHBondContact ND1-CD2 3.03Å; H127-F130 AromaticContact ND1-CE2 2.85Å; H127-F130 WeakPolarHBondContact ND1-CE2 3.4Å; H127-F130 AromaticContact ND1-CG 3.9Å; H127-F130 AromaticContact ND1-CZ 3.29Å; H127-F130 VanDerWaalsContact ND1-CZ 3.29Å; H127-F130 WeakPolarHBondContact ND1-CZ 3.41Å
128	F	71.3	Confident	63.4	Low	102 Å²	102	100.3 Å²	100.3	45%	0.447	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-26.8	178.4	-61.1	-76.5	0	0	0	112.9	D55 C56 C59 C123 G126	D55-F128 HydrophobicContact CB-CB 4.48Å; D55-F128 HydrophobicContact CB-CD1 4.26Å; C56-F128 VanDerWaalsContact CA-O 3.23Å; C56-F128 WeakPolarHBondContact CA-O 3.44Å; C56-F128 VanDerWaalsContact CB-O 3.25Å; C56-F128 WeakPolarHBondContact CB-O 3.42Å; C56-F128 PolarHBondContact N-O 2.7Å; C59-F128 HydrophobicContact CB-CB 3.84Å; C59-F128 HydrophobicContact CB-CD2 4.25Å; C59-F128 HydrophobicContact CB-CG 3.99Å; C123-F128 HydrophobicContact CB-CB 4.3Å; C123-F128 WeakPolarHBondContact O-CA 3.39Å; C123-F128 WeakPolarHBondContact O-CB 2.96Å; C123-F128 PolarHBondContact O-N 2.83Å; G126-F128 WeakPolarHBondContact O-CD2 3.08Å; G126-F128 WeakPolarHBondContact O-CE2 3.5Å; G126-F128 PolarHBondContact O-N 2.8Å; G126-F128 VanDerWaalsContact O-N 3.11Å
129	C	69.1	Low	61	Low	8 Å²	8	107 Å²	107	5%	0.054	56%	0.56	C	S	.	*	T	Hydrogen-bonded Turn	trans	-114	22.1	-177.6	-72.6	0	0	0	0	113.8	C56 C123 D124 H127 T131	C56-C129 WeakPolarHBondContact CA-SG 3.22Å; C56-C129 HydrophobicContact CB-CB 3.9Å; C56-C129 WeakPolarHBondContact CB-SG 3.45Å; C56-C129 WeakPolarHBondContact SG-CB 3.32Å; C56-C129 CovalentContact SG-SG 2.04Å; C56-C129 PolarHBondContact SG-SG 2.88Å; C123-C129 HydrophobicContact CB-CB 4.28Å; C123-C129 WeakPolarHBondContact CB-SG 3.39Å; C123-C129 PolarHBondContact O-N 3.43Å; D124-C129 WeakPolarHBondContact OD1-CB 3.03Å; H127-C129 VanDerWaalsContact C-N 3.33Å; H127-C129 PolarHBondContact O-N 2.83Å; C129-T131 PolarHBondContact O-N 3.04Å
130	F	68.9	Low	59	Low	111 Å²	111	108.9 Å²	108.9	49%	0.487	57%	0.569	S	S	.	*			trans	-64.1	105.7	177.8	-100.9	-105.7	0	0	0	111.6	D124 H127 R132	D124-F130 WeakPolarHBondContact O-CE2 3.48Å; H127-F130 HydrophobicContact CB-CD2 3.98Å; H127-F130 HydrophobicContact CB-CE2 4.31Å; H127-F130 AromaticContact CE1-CE2 3.38Å; H127-F130 WeakPolarHBondContact CE1-CE2 3.4Å; H127-F130 AromaticContact CE1-CZ 3.44Å; H127-F130 VanDerWaalsContact CE1-CZ 3.44Å; H127-F130 WeakPolarHBondContact CE1-CZ 3.25Å; H127-F130 AromaticContact CG-CD2 3.91Å; H127-F130 AromaticContact CG-CE2 3.75Å; H127-F130 AromaticContact ND1-CD2 3.24Å; H127-F130 WeakPolarHBondContact ND1-CD2 3.03Å; H127-F130 AromaticContact ND1-CE2 2.85Å; H127-F130 WeakPolarHBondContact ND1-CE2 3.4Å; H127-F130 AromaticContact ND1-CG 3.9Å; H127-F130 AromaticContact ND1-CZ 3.29Å; H127-F130 VanDerWaalsContact ND1-CZ 3.29Å; H127-F130 WeakPolarHBondContact ND1-CZ 3.41Å; F130-R132 PolarHBondContact O-N 2.91Å; F130-R132 VanDerWaalsContact O-N 3.16Å
131	T	53.8	Low	57.3	Low	142 Å²	142	112.1 Å²	112.1	87%	0.871	59%	0.586	S	S	*	*			trans	-77.7	95	173.4	49.6	0	0	0	0	109.9	C129	C129-T131 PolarHBondContact O-N 3.04Å
132	R	44.1	Very low	55.5	Low	227 Å²	227	114.3 Å²	114.3	86%	0.857	59%	0.594	S	S	*	*			trans	-103.8	82.5	157.7	-151.4	176.8	-163.4	174.2	4.7	109.7	F130	F130-R132 PolarHBondContact O-N 2.91Å; F130-R132 VanDerWaalsContact O-N 3.16Å
133	G	36.6	Very low	53.9	Low	71 Å²	71	115 Å²	115	73%	0.732	60%	0.601	S	S	*	*	S	Bend	trans	40.6	85.7	156.6	0	0	0	0	0	117.4
134	K	40.7	Very low	52.9	Low	194 Å²	194	121.6 Å²	121.6	84%	0.843	64%	0.636	S	S	*	*			trans	-162	123.4	139.9	-112.7	173	-176.4	-176.4	0	109.9	I136	K134-I136 PolarHBondContact O-N 2.89Å; K134-I136 VanDerWaalsContact O-N 3.12Å
135	N	33.8	Very low	52	Low	152 Å²	152	126.1 Å²	126.1	81%	0.813	65%	0.652	S	S	*	*			trans	-59.9	108.5	166.5	-64.9	-30.2	0	0	0	107.8	T137	N135-T137 VanDerWaalsContact C-N 3.34Å; N135-T137 PolarHBondContact O-N 3.41Å
136	I	40.5	Very low	51.4	Low	128 Å²	128	119.6 Å²	119.6	66%	0.656	63%	0.631	S	S	*	*			trans	-91.5	85.9	161.7	-56.7	177.4	0	0	0	105.1	A53 K134	A53-I136 HydrophobicContact CB-CD1 4.27Å; K134-I136 PolarHBondContact O-N 2.89Å; K134-I136 VanDerWaalsContact O-N 3.12Å
137	T	31	Very low	51.2	Low	124 Å²	124	121.6 Å²	121.6	76%	0.761	63%	0.629	S	S	*	*			trans	-90.9	87.6	161.9	45.7	0	0	0	0	106.6	N135	N135-T137 VanDerWaalsContact C-N 3.34Å; N135-T137 PolarHBondContact O-N 3.41Å
138	E	41	Very low	50.9	Low	169 Å²	169	118.4 Å²	118.4	79%	0.79	62%	0.621	S	S	*	*			trans	-134.4	114.9	157.7	-101.6	178.3	172.6	0	0	106.6	I140	E138-I140 PolarHBondContact O-N 3.35Å
139	D	38	Very low	51.2	Low	163 Å²	163	114.8 Å²	114.8	87%	0.872	61%	0.608	S	S	*	*			trans	-63.2	101	-175.6	-66.6	-51.7	0	0	0	110.2
140	I	43.9	Very low	51.3	Low	94 Å²	94	114.9 Å²	114.9	48%	0.482	61%	0.609	S	S	.	*			trans	-70.8	126.2	152.9	-56.5	175.7	0	0	0	105.5	E138 T142 Y147	E138-I140 PolarHBondContact O-N 3.35Å; I140-T142 PolarHBondContact O-N 3.21Å; I140-Y147 HydrophobicContact CB-CE2 4.38Å; I140-Y147 HydrophobicContact CD1-CE2 3.98Å; I140-Y147 HydrophobicContact CG2-CD2 3.7Å; I140-Y147 HydrophobicContact CG2-CE2 3.64Å
141	P	41.1	Very low	51.6	Low	111 Å²	111	111.5 Å²	111.5	72%	0.721	60%	0.597	S	S	*	*			trans	-57	102.6	177.1	-20.6	31.2	0	0	0	109.5	T143	P141-T143 PolarHBondContact O-N 3.49Å
142	T	43.3	Very low	52.9	Low	101 Å²	101	106.4 Å²	106.4	62%	0.62	57%	0.567	S	S	*	*			trans	-96	74	-176.8	36	0	0	0	0	108.7	I140 D144 Y147	I140-T142 PolarHBondContact O-N 3.21Å; T142-D144 PolarHBondContact O-N 2.98Å; T142-Y147 HydrophobicContact CG2-CD1 4.3Å; T142-Y147 HydrophobicContact CG2-CG 4.31Å
143	T	50.3	Low	54.6	Low	79 Å²	79	96 Å²	96	49%	0.485	53%	0.528	S	S	.	.			trans	-75.6	109.9	149.6	52.2	0	0	0	0	105.8	P141 K145 D146 Y147	P141-T143 PolarHBondContact O-N 3.49Å; T143-K145 PolarHBondContact O-N 3.22Å; T143-D146 PolarHBondContact O-N 2.87Å; T143-D146 WeakPolarHBondContact OG1-CB 3.22Å; T143-D146 PolarHBondContact OG1-OD2 3.18Å; T143-Y147 PolarHBondContact O-N 2.83Å; T143-Y147 VanDerWaalsContact O-N 3.14Å
144	D	60.7	Low	56.3	Low	137 Å²	137	92.7 Å²	92.7	73%	0.733	49%	0.494	S	S	*	.	H	α-helix	trans	-55.2	-21.6	-161.9	-139.6	-1.3	0	0	0	114.4	T142 S148	T142-D144 PolarHBondContact O-N 2.98Å; D144-S148 WeakPolarHBondContact O-CB 3.13Å; D144-S148 PolarHBondContact O-OG 3.1Å
145	K	60	Low	58.2	Low	175 Å²	175	86.6 Å²	86.6	76%	0.761	47%	0.467	S	S	*	.	H	α-helix	trans	-89.9	-40.9	177.6	-68.7	-175	-179.8	179.1	0	113.9	T143 S148 C149	T143-K145 PolarHBondContact O-N 3.22Å; K145-S148 PolarHBondContact O-OG 3.41Å; K145-C149 VanDerWaalsContact O-CB 3.22Å; K145-C149 WeakPolarHBondContact O-CB 3.29Å; K145-C149 PolarHBondContact O-N 3.18Å
146	D	65.4	Low	60.4	Low	59 Å²	59	79.3 Å²	79.3	32%	0.316	43%	0.428	S	S	.	.	H	α-helix	trans	-74.9	-38.6	-177.4	-56.5	-40.7	0	0	0	110.4	T143 C149 T150	T143-D146 PolarHBondContact O-N 2.87Å; T143-D146 WeakPolarHBondContact OG1-CB 3.22Å; T143-D146 PolarHBondContact OG1-OD2 3.18Å; D146-C149 PolarHBondContact O-N 2.97Å; D146-T150 WeakPolarHBondContact O-CB 3.23Å; D146-T150 PolarHBondContact O-N 2.99Å; D146-T150 PolarHBondContact O-OG1 3.41Å
147	Y	67.7	Low	62.1	Low	74 Å²	74	74.4 Å²	74.4	29%	0.29	41%	0.407	S	S	.	.	H	α-helix	trans	-64.7	-46.4	176.1	-178.9	-106.7	0	0	0	112.1	I140 T142 T143 C149 T150 V151	I140-Y147 HydrophobicContact CB-CE2 4.38Å; I140-Y147 HydrophobicContact CD1-CE2 3.98Å; I140-Y147 HydrophobicContact CG2-CD2 3.7Å; I140-Y147 HydrophobicContact CG2-CE2 3.64Å; T142-Y147 HydrophobicContact CG2-CD1 4.3Å; T142-Y147 HydrophobicContact CG2-CG 4.31Å; T143-Y147 PolarHBondContact O-N 2.83Å; T143-Y147 VanDerWaalsContact O-N 3.14Å; Y147-C149 PolarHBondContact O-N 2.84Å; Y147-T150 PolarHBondContact O-N 3.46Å; Y147-V151 HydrophobicContact CD1-CG2 4.37Å; Y147-V151 HydrophobicContact CD2-CG2 4.22Å; Y147-V151 HydrophobicContact CE1-CG2 3.97Å; Y147-V151 HydrophobicContact CE2-CG2 3.78Å; Y147-V151 HydrophobicContact CG-CG2 4.49Å; Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 VanDerWaalsContact O-CG2 3.29Å; Y147-V151 WeakPolarHBondContact O-CG2 3.48Å; Y147-V151 PolarHBondContact O-N 3.02Å
148	S	68.1	Low	64.1	Low	65 Å²	65	70.7 Å²	70.7	46%	0.455	38%	0.379	S	S	.	.	H	α-helix	trans	-66.5	-37.6	178.9	56.8	0	0	0	0	112.4	D144 K145 C152	D144-S148 WeakPolarHBondContact O-CB 3.13Å; D144-S148 PolarHBondContact O-OG 3.1Å; K145-S148 PolarHBondContact O-OG 3.41Å; S148-C152 VanDerWaalsContact O-CB 3.22Å; S148-C152 WeakPolarHBondContact O-CB 3.22Å; S148-C152 PolarHBondContact O-N 3.46Å
149	C	77.5	Confident	65.8	Low	26 Å²	26	63.6 Å²	63.6	18%	0.176	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-49.6	172.6	-174.3	0	0	0	0	111.2	C9 K145 D146 Y147 V151 C152 Q153	C9-C149 HydrophobicContact CB-CB 4.03Å; C9-C149 WeakPolarHBondContact CB-SG 3.36Å; C9-C149 WeakPolarHBondContact SG-CB 3.34Å; C9-C149 CovalentContact SG-SG 2.03Å; C9-C149 PolarHBondContact SG-SG 3.17Å; K145-C149 VanDerWaalsContact O-CB 3.22Å; K145-C149 WeakPolarHBondContact O-CB 3.29Å; K145-C149 PolarHBondContact O-N 3.18Å; D146-C149 PolarHBondContact O-N 2.97Å; Y147-C149 PolarHBondContact O-N 2.84Å; C149-V151 PolarHBondContact O-N 2.8Å; C149-C152 PolarHBondContact O-N 2.9Å; C149-C152 VanDerWaalsContact O-N 3.17Å; C149-Q153 WeakPolarHBondContact O-CB 3.46Å; C149-Q153 PolarHBondContact O-N 3.3Å
150	T	71.5	Confident	67.5	Low	10 Å²	10	58.6 Å²	58.6	6%	0.061	32%	0.319	C	S	.	.	H	α-helix	trans	-57.3	-50.7	179.7	-62.5	0	0	0	0	110.9	Q12 T16 D146 Y147 C152 Q153 S154	Q12-T150 HydrophobicContact CB-CG2 4.02Å; Q12-T150 PolarHBondContact OE1-OG1 2.98Å; T16-T150 HydrophobicContact CG2-CG2 4.48Å; D146-T150 WeakPolarHBondContact O-CB 3.23Å; D146-T150 PolarHBondContact O-N 2.99Å; D146-T150 PolarHBondContact O-OG1 3.41Å; Y147-T150 PolarHBondContact O-N 3.46Å; T150-C152 VanDerWaalsContact C-N 3.33Å; T150-C152 PolarHBondContact O-N 2.62Å; T150-Q153 PolarHBondContact O-N 2.74Å; T150-S154 WeakPolarHBondContact O-CB 3.23Å; T150-S154 PolarHBondContact O-N 3.19Å; T150-S154 PolarHBondContact O-OG 2.85Å
151	V	75.3	Confident	69	Low	40 Å²	40	57.2 Å²	57.2	24%	0.242	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-42.9	178.1	171.2	0	0	0	0	111.2	L61 Y147 C149 F155	L61-V151 HydrophobicContact CD1-CG1 3.97Å; Y147-V151 HydrophobicContact CD1-CG2 4.37Å; Y147-V151 HydrophobicContact CD2-CG2 4.22Å; Y147-V151 HydrophobicContact CE1-CG2 3.97Å; Y147-V151 HydrophobicContact CE2-CG2 3.78Å; Y147-V151 HydrophobicContact CG-CG2 4.49Å; Y147-V151 WeakPolarHBondContact O-CB 3.38Å; Y147-V151 VanDerWaalsContact O-CG2 3.29Å; Y147-V151 WeakPolarHBondContact O-CG2 3.48Å; Y147-V151 PolarHBondContact O-N 3.02Å; C149-V151 PolarHBondContact O-N 2.8Å; V151-F155 VanDerWaalsContact O-CB 3.23Å; V151-F155 WeakPolarHBondContact O-CB 3.38Å; V151-F155 PolarHBondContact O-N 3.3Å
152	C	80.7	Confident	70.4	Confident	36 Å²	36	52.7 Å²	52.7	24%	0.243	28%	0.28	C	S	.	.	H	α-helix	trans	-62.3	-53.6	178.7	-169.9	0	0	0	0	110.9	S148 C149 T150 S154 F155 A156 C216	S148-C152 VanDerWaalsContact O-CB 3.22Å; S148-C152 WeakPolarHBondContact O-CB 3.22Å; S148-C152 PolarHBondContact O-N 3.46Å; C149-C152 PolarHBondContact O-N 2.9Å; C149-C152 VanDerWaalsContact O-N 3.17Å; T150-C152 VanDerWaalsContact C-N 3.33Å; T150-C152 PolarHBondContact O-N 2.62Å; C152-S154 PolarHBondContact O-N 3.47Å; C152-F155 PolarHBondContact O-N 3.01Å; C152-A156 WeakPolarHBondContact O-CB 3.34Å; C152-A156 PolarHBondContact O-N 3.4Å; C152-C216 VanDerWaalsContact CA-SG 3.52Å; C152-C216 HydrophobicContact CB-CB 3.84Å; C152-C216 WeakPolarHBondContact CB-SG 3.43Å; C152-C216 PolarHBondContact O-SG 2.92Å; C152-C216 WeakPolarHBondContact SG-CB 3.46Å; C152-C216 CovalentContact SG-SG 2.03Å; C152-C216 PolarHBondContact SG-SG 3.12Å
153	Q	79.3	Confident	71.6	Confident	7 Å²	7	49 Å²	49	3%	0.033	26%	0.256	C	S	.	.	H	α-helix	trans	-63.7	-42.8	-177.4	-75.5	-167	-19.5	0	0	111.7	C9 S13 C149 T150 F155 A156 A157 C216	C9-Q153 PolarHBondContact O-OE1 2.84Å; C9-Q153 PolarHBondContact SG-OE1 2.8Å; S13-Q153 PolarHBondContact OG-OE1 3.03Å; S13-Q153 VanDerWaalsContact OG-OE1 3.12Å; C149-Q153 WeakPolarHBondContact O-CB 3.46Å; C149-Q153 PolarHBondContact O-N 3.3Å; T150-Q153 PolarHBondContact O-N 2.74Å; Q153-F155 VanDerWaalsContact C-N 3.31Å; Q153-F155 PolarHBondContact O-N 3.04Å; Q153-A156 PolarHBondContact O-N 3.36Å; Q153-A157 VanDerWaalsContact O-CB 3.31Å; Q153-A157 WeakPolarHBondContact O-CB 3.47Å; Q153-A157 PolarHBondContact O-N 3.19Å; Q153-C216 HydrophobicContact CG-CB 3.98Å; Q153-C216 PolarHBondContact N-SG 3.02Å
154	S	73.1	Confident	72.5	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.014	27%	0.266	C	S	.	.	H	α-helix	trans	-62.6	-38.9	175.4	-62.5	0	0	0	0	111.9	S13 T150 C152 Y158	S13-S154 VanDerWaalsContact CA-OG 3.27Å; S13-S154 WeakPolarHBondContact CA-OG 3.45Å; S13-S154 WeakPolarHBondContact CB-OG 3.38Å; S13-S154 PolarHBondContact O-OG 3.08Å; T150-S154 WeakPolarHBondContact O-CB 3.23Å; T150-S154 PolarHBondContact O-N 3.19Å; T150-S154 PolarHBondContact O-OG 2.85Å; C152-S154 PolarHBondContact O-N 3.47Å; S154-Y158 WeakPolarHBondContact O-CB 3.49Å; S154-Y158 PolarHBondContact O-N 3.22Å
155	F	79.2	Confident	72.9	Confident	66 Å²	66	50.5 Å²	50.5	29%	0.289	25%	0.251	S	S	.	.	H	α-helix	trans	-66.9	-45.9	175.2	175.2	-97.3	0	0	0	111.9	V151 C152 Q153 Y158 V159 F215	V151-F155 VanDerWaalsContact O-CB 3.23Å; V151-F155 WeakPolarHBondContact O-CB 3.38Å; V151-F155 PolarHBondContact O-N 3.3Å; C152-F155 PolarHBondContact O-N 3.01Å; Q153-F155 VanDerWaalsContact C-N 3.31Å; Q153-F155 PolarHBondContact O-N 3.04Å; F155-Y158 WeakPolarHBondContact O-CB 3.42Å; F155-Y158 PolarHBondContact O-N 3.12Å; F155-V159 HydrophobicContact CD1-CG2 4.2Å; F155-V159 HydrophobicContact CD2-CG2 4.41Å; F155-V159 HydrophobicContact CE1-CG2 3.71Å; F155-V159 HydrophobicContact CE2-CG2 3.94Å; F155-V159 HydrophobicContact CZ-CG2 3.57Å; F155-V159 WeakPolarHBondContact O-CG2 3.18Å; F155-V159 PolarHBondContact O-N 2.98Å; F155-F215 AromaticContact CD1-CE1 3.73Å; F155-F215 HydrophobicContact CD1-CE1 3.73Å; F155-F215 HydrophobicContact CD1-CZ 4.27Å; F155-F215 AromaticContact CE1-CE1 3.91Å; F155-F215 HydrophobicContact CE1-CE1 3.91Å; F155-F215 AromaticContact CE1-CZ 3.96Å; F155-F215 HydrophobicContact CE1-CZ 3.96Å
156	A	80.1	Confident	73	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-48.1	178.1	0	0	0	0	0	111	C152 Q153 Y158 V159 E160 P212 F215	C152-A156 WeakPolarHBondContact O-CB 3.34Å; C152-A156 PolarHBondContact O-N 3.4Å; Q153-A156 PolarHBondContact O-N 3.36Å; A156-Y158 VanDerWaalsContact C-N 3.31Å; A156-Y158 PolarHBondContact O-N 2.67Å; A156-V159 PolarHBondContact O-N 2.93Å; A156-V159 VanDerWaalsContact O-N 3.11Å; A156-E160 WeakPolarHBondContact O-CB 3.42Å; A156-E160 PolarHBondContact O-N 3.4Å; A156-P212 HydrophobicContact CB-CB 4.16Å; A156-P212 HydrophobicContact CB-CG 4.06Å; A156-F215 HydrophobicContact CB-CB 4Å; A156-F215 HydrophobicContact CB-CD1 3.87Å; A156-F215 HydrophobicContact CB-CG 4.25Å
157	A	76.8	Confident	73.3	Confident	25 Å²	25	52.9 Å²	52.9	21%	0.207	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-39.1	176.6	0	0	0	0	0	112.2	L17 Q153 W161 P212	L17-A157 HydrophobicContact CD1-CB 4.42Å; L17-A157 HydrophobicContact CD2-CB 4.28Å; Q153-A157 VanDerWaalsContact O-CB 3.31Å; Q153-A157 WeakPolarHBondContact O-CB 3.47Å; Q153-A157 PolarHBondContact O-N 3.19Å; A157-W161 VanDerWaalsContact O-CB 3.28Å; A157-W161 WeakPolarHBondContact O-CB 3.45Å; A157-W161 PolarHBondContact O-N 3.44Å; A157-P212 HydrophobicContact CB-CG 4.14Å
158	Y	74.2	Confident	73.4	Confident	46 Å²	46	52.4 Å²	52.4	18%	0.18	26%	0.264	C	S	.	.	H	α-helix	trans	-63.1	-44.7	173.5	169.6	-98.5	0	0	0	112.1	M21 I24 S154 F155 A156 W161 A162	M21-Y158 HydrophobicContact CG-CD2 4.4Å; I24-Y158 HydrophobicContact CD1-CD1 3.91Å; I24-Y158 HydrophobicContact CD1-CD2 3.76Å; I24-Y158 HydrophobicContact CD1-CE1 3.84Å; I24-Y158 HydrophobicContact CD1-CE2 3.68Å; I24-Y158 HydrophobicContact CD1-CG 3.87Å; I24-Y158 HydrophobicContact CG2-CE2 4.21Å; S154-Y158 WeakPolarHBondContact O-CB 3.49Å; S154-Y158 PolarHBondContact O-N 3.22Å; F155-Y158 WeakPolarHBondContact O-CB 3.42Å; F155-Y158 PolarHBondContact O-N 3.12Å; A156-Y158 VanDerWaalsContact C-N 3.31Å; A156-Y158 PolarHBondContact O-N 2.67Å; Y158-W161 HydrophobicContact CD2-CE3 4.25Å; Y158-W161 HydrophobicContact CE2-CE3 4.17Å; Y158-W161 HydrophobicContact CE2-CZ3 4.09Å; Y158-W161 PolarHBondContact O-N 3.03Å; Y158-A162 VanDerWaalsContact O-CB 3.28Å; Y158-A162 WeakPolarHBondContact O-CB 3.29Å; Y158-A162 PolarHBondContact O-N 3.32Å
159	V	75.3	Confident	73.6	Confident	20 Å²	20	54 Å²	54	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-65.7	-45	179.5	174.9	0	0	0	0	110.7	F155 A156 A162 M163 F210	F155-V159 HydrophobicContact CD1-CG2 4.2Å; F155-V159 HydrophobicContact CD2-CG2 4.41Å; F155-V159 HydrophobicContact CE1-CG2 3.71Å; F155-V159 HydrophobicContact CE2-CG2 3.94Å; F155-V159 HydrophobicContact CZ-CG2 3.57Å; F155-V159 WeakPolarHBondContact O-CG2 3.18Å; F155-V159 PolarHBondContact O-N 2.98Å; A156-V159 PolarHBondContact O-N 2.93Å; A156-V159 VanDerWaalsContact O-N 3.11Å; V159-A162 PolarHBondContact O-N 3.16Å; V159-M163 HydrophobicContact CG1-CE 3.62Å; V159-M163 HydrophobicContact CG1-CG 4.38Å; V159-M163 HydrophobicContact CG1-SD 4.02Å; V159-M163 WeakPolarHBondContact O-CB 3.21Å; V159-M163 VanDerWaalsContact O-CG 3.25Å; V159-M163 WeakPolarHBondContact O-CG 3.32Å; V159-M163 PolarHBondContact O-N 2.88Å; V159-F210 HydrophobicContact CB-CB 4.33Å; V159-F210 HydrophobicContact CB-CD1 4.17Å; V159-F210 HydrophobicContact CB-CG 4.29Å; V159-F210 HydrophobicContact CG1-CB 3.79Å; V159-F210 HydrophobicContact CG1-CD1 3.57Å; V159-F210 HydrophobicContact CG1-CD2 3.82Å; V159-F210 HydrophobicContact CG1-CE1 4.05Å; V159-F210 HydrophobicContact CG1-CE2 4.29Å; V159-F210 HydrophobicContact CG1-CG 3.44Å; V159-F210 VanDerWaalsContact CG1-CG 3.44Å; V159-F210 HydrophobicContact CG1-CZ 4.38Å
160	E	73.5	Confident	73.4	Confident	58 Å²	58	56.2 Å²	56.2	27%	0.271	28%	0.275	S	S	.	.	H	α-helix	trans	-56.6	-52.1	174.8	-175.3	174.7	-139.5	0	0	110.8	A156 A162 M163 E164 P212	A156-E160 WeakPolarHBondContact O-CB 3.42Å; A156-E160 PolarHBondContact O-N 3.4Å; E160-A162 VanDerWaalsContact C-N 3.31Å; E160-A162 PolarHBondContact O-N 3.41Å; E160-M163 WeakPolarHBondContact O-CB 3.35Å; E160-M163 PolarHBondContact O-N 2.93Å; E160-M163 VanDerWaalsContact O-N 3.12Å; E160-E164 WeakPolarHBondContact O-CG 3.49Å; E160-E164 PolarHBondContact O-N 2.83Å; E160-P212 WeakPolarHBondContact OE2-CD 3.41Å
161	W	75.2	Confident	73.5	Confident	64 Å²	64	62.6 Å²	62.6	24%	0.242	30%	0.299	C	S	.	.	H	α-helix	trans	-57	-42.9	175.3	170.9	88.4	0	0	0	112.9	I33 L37 A157 Y158 M163 E164 K165	I33-W161 HydrophobicContact CG2-CH2 4.31Å; L37-W161 HydrophobicContact CD1-CH2 3.62Å; L37-W161 HydrophobicContact CD1-CZ2 3.71Å; L37-W161 HydrophobicContact CD1-CZ3 4.3Å; L37-W161 HydrophobicContact CD2-CH2 4.14Å; L37-W161 HydrophobicContact CD2-CZ2 3.31Å; L37-W161 HydrophobicContact CG-CH2 4.05Å; L37-W161 HydrophobicContact CG-CZ2 3.66Å; A157-W161 VanDerWaalsContact O-CB 3.28Å; A157-W161 WeakPolarHBondContact O-CB 3.45Å; A157-W161 PolarHBondContact O-N 3.44Å; Y158-W161 HydrophobicContact CD2-CE3 4.25Å; Y158-W161 HydrophobicContact CE2-CE3 4.17Å; Y158-W161 HydrophobicContact CE2-CZ3 4.09Å; Y158-W161 PolarHBondContact O-N 3.03Å; W161-M163 VanDerWaalsContact C-N 3.3Å; W161-M163 PolarHBondContact O-N 3.11Å; W161-E164 PolarHBondContact O-N 3.42Å; W161-K165 HydrophobicContact CH2-CG 4.3Å; W161-K165 HydrophobicContact CZ2-CD 4.28Å; W161-K165 HydrophobicContact CZ2-CG 4.15Å; W161-K165 PolarHBondContact O-N 3.31Å
162	A	70.6	Confident	73.5	Confident	17 Å²	17	62.6 Å²	62.6	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-37.4	179.8	0	0	0	0	0	111.1	Y158 V159 E160 E164 K165 F168	Y158-A162 VanDerWaalsContact O-CB 3.28Å; Y158-A162 WeakPolarHBondContact O-CB 3.29Å; Y158-A162 PolarHBondContact O-N 3.32Å; V159-A162 PolarHBondContact O-N 3.16Å; E160-A162 VanDerWaalsContact C-N 3.31Å; E160-A162 PolarHBondContact O-N 3.41Å; A162-E164 VanDerWaalsContact C-N 3.34Å; A162-K165 PolarHBondContact O-N 2.85Å; A162-F168 WeakPolarHBondContact O-CB 3.42Å
163	M	70.2	Confident	73.3	Confident	23 Å²	23	62.6 Å²	62.6	11%	0.113	29%	0.292	C	S	.	.	H	α-helix	trans	-68.2	-31.4	176.8	-73.4	-178.2	173.4	0	0	112.9	V159 E160 W161 K165 F168 A206 F210	V159-M163 HydrophobicContact CG1-CE 3.62Å; V159-M163 HydrophobicContact CG1-CG 4.38Å; V159-M163 HydrophobicContact CG1-SD 4.02Å; V159-M163 WeakPolarHBondContact O-CB 3.21Å; V159-M163 VanDerWaalsContact O-CG 3.25Å; V159-M163 WeakPolarHBondContact O-CG 3.32Å; V159-M163 PolarHBondContact O-N 2.88Å; E160-M163 WeakPolarHBondContact O-CB 3.35Å; E160-M163 PolarHBondContact O-N 2.93Å; E160-M163 VanDerWaalsContact O-N 3.12Å; W161-M163 VanDerWaalsContact C-N 3.3Å; W161-M163 PolarHBondContact O-N 3.11Å; M163-K165 PolarHBondContact O-N 3.12Å; M163-F168 HydrophobicContact CB-CD1 4.47Å; M163-F168 HydrophobicContact CE-CE1 4.21Å; M163-F168 HydrophobicContact CE-CZ 4.05Å; M163-F168 HydrophobicContact CG-CD1 4.07Å; M163-F168 HydrophobicContact CG-CE1 3.84Å; M163-F168 HydrophobicContact CG-CZ 4.22Å; M163-A206 HydrophobicContact CE-CB 3.85Å; M163-A206 HydrophobicContact SD-CB 3.72Å; M163-F210 HydrophobicContact CE-CD2 3.31Å; M163-F210 HydrophobicContact CE-CE2 3.42Å; M163-F210 VanDerWaalsContact CE-CE2 3.42Å; M163-F210 HydrophobicContact CE-CG 4.23Å; M163-F210 HydrophobicContact CE-CZ 4.38Å; M163-F210 HydrophobicContact SD-CB 4.43Å; M163-F210 HydrophobicContact SD-CD2 3.65Å; M163-F210 HydrophobicContact SD-CE2 4.35Å; M163-F210 HydrophobicContact SD-CG 4.36Å
164	E	68.9	Low	73.3	Confident	150 Å²	150	69 Å²	69	70%	0.701	32%	0.319	S	S	*	.	H	α-helix	trans	-71.8	-16.7	174.8	-69.4	-177.4	166	0	0	113.4	E160 W161 A162 K166	E160-E164 WeakPolarHBondContact O-CG 3.49Å; E160-E164 PolarHBondContact O-N 2.83Å; W161-E164 PolarHBondContact O-N 3.42Å; A162-E164 VanDerWaalsContact C-N 3.34Å; E164-K166 PolarHBondContact O-N 3.37Å
165	K	68.8	Low	73.5	Confident	97 Å²	97	73.1 Å²	73.1	42%	0.422	34%	0.341	S	S	.	.	S	Bend	trans	-76	125.3	174.5	-63.9	-57.7	-176.3	-174.4	0	110	W161 A162 M163 D167 F168	W161-K165 HydrophobicContact CH2-CG 4.3Å; W161-K165 HydrophobicContact CZ2-CD 4.28Å; W161-K165 HydrophobicContact CZ2-CG 4.15Å; W161-K165 PolarHBondContact O-N 3.31Å; A162-K165 PolarHBondContact O-N 2.85Å; M163-K165 PolarHBondContact O-N 3.12Å; K165-D167 PolarHBondContact O-N 2.9Å; K165-F168 WeakPolarHBondContact O-CB 3.26Å; K165-F168 PolarHBondContact O-N 3.47Å
166	K	61.6	Low	73.6	Confident	158 Å²	158	71.1 Å²	71.1	69%	0.687	33%	0.333	S	S	*	.	H	α-helix	trans	-47.8	-32.4	175.2	-169.5	178.9	179	-179.2	0	113.6	E164 F168 D170	E164-K166 PolarHBondContact O-N 3.37Å; K166-F168 VanDerWaalsContact C-N 3.29Å; K166-F168 PolarHBondContact O-N 3.32Å; K166-D170 PolarHBondContact O-N 2.91Å
167	D	71.5	Confident	73.7	Confident	127 Å²	127	74.6 Å²	74.6	68%	0.679	35%	0.349	S	S	*	.	H	α-helix	trans	-66.7	-27.3	179	-67.3	-14.7	0	0	0	113.3	K165 Y171	K165-D167 PolarHBondContact O-N 2.9Å; D167-Y171 WeakPolarHBondContact O-CB 3.09Å; D167-Y171 PolarHBondContact O-N 3.4Å
168	F	70.9	Confident	73.8	Confident	63 Å²	63	79.4 Å²	79.4	28%	0.276	37%	0.365	S	S	.	.	H	α-helix	trans	-71.1	-47.1	178.3	-178.9	-91.6	0	0	0	111.4	A162 M163 K165 K166 D170 Y171 Y172 M203	A162-F168 WeakPolarHBondContact O-CB 3.42Å; M163-F168 HydrophobicContact CB-CD1 4.47Å; M163-F168 HydrophobicContact CE-CE1 4.21Å; M163-F168 HydrophobicContact CE-CZ 4.05Å; M163-F168 HydrophobicContact CG-CD1 4.07Å; M163-F168 HydrophobicContact CG-CE1 3.84Å; M163-F168 HydrophobicContact CG-CZ 4.22Å; K165-F168 WeakPolarHBondContact O-CB 3.26Å; K165-F168 PolarHBondContact O-N 3.47Å; K166-F168 VanDerWaalsContact C-N 3.29Å; K166-F168 PolarHBondContact O-N 3.32Å; F168-D170 PolarHBondContact O-N 3.06Å; F168-Y171 PolarHBondContact O-N 3.23Å; F168-Y172 VanDerWaalsContact O-CB 3.23Å; F168-Y172 WeakPolarHBondContact O-CB 3.38Å; F168-Y172 PolarHBondContact O-N 2.97Å; F168-M203 HydrophobicContact CD1-CE 3.8Å; F168-M203 HydrophobicContact CD1-SD 3.88Å; F168-M203 HydrophobicContact CE1-CE 4.15Å; F168-M203 HydrophobicContact CE1-SD 3.65Å
169	E	70.9	Confident	73.8	Confident	100 Å²	100	81.8 Å²	81.8	47%	0.467	38%	0.377	S	S	.	.	H	α-helix	trans	-57.5	-50.5	175.2	-170.6	-178.9	172.8	0	0	110.2	Y171 Y172 M173 M203	E169-Y171 VanDerWaalsContact C-N 3.34Å; E169-Y171 PolarHBondContact O-N 2.71Å; E169-Y172 PolarHBondContact O-N 3.02Å; E169-M173 HydrophobicContact CG-CG 4.47Å; E169-M173 WeakPolarHBondContact O-CB 3.35Å; E169-M173 VanDerWaalsContact O-CG 3.25Å; E169-M173 WeakPolarHBondContact O-CG 3.28Å; E169-M173 PolarHBondContact O-N 2.72Å; E169-M203 HydrophobicContact CB-CE 4.06Å; E169-M203 HydrophobicContact CG-CE 4.36Å
170	D	74.8	Confident	73.9	Confident	71 Å²	71	80.9 Å²	80.9	38%	0.38	37%	0.371	S	S	.	.	H	α-helix	trans	-60	-42.1	178.6	-80.7	-9.3	0	0	0	112.5	K166 F168 K174	K166-D170 PolarHBondContact O-N 2.91Å; F168-D170 PolarHBondContact O-N 3.06Å; D170-K174 WeakPolarHBondContact O-CB 3.5Å; D170-K174 WeakPolarHBondContact O-CD 3.46Å; D170-K174 VanDerWaalsContact O-CG 3.22Å; D170-K174 WeakPolarHBondContact O-CG 3.27Å; D170-K174 PolarHBondContact O-N 3.25Å
171	Y	71.7	Confident	74.4	Confident	145 Å²	145	80.5 Å²	80.5	57%	0.569	38%	0.375	S	S	*	.	H	α-helix	trans	-65.8	-45	177.6	176.2	-100.7	0	0	0	111.7	D167 F168 E169 K174 L175	D167-Y171 WeakPolarHBondContact O-CB 3.09Å; D167-Y171 PolarHBondContact O-N 3.4Å; F168-Y171 PolarHBondContact O-N 3.23Å; E169-Y171 VanDerWaalsContact C-N 3.34Å; E169-Y171 PolarHBondContact O-N 2.71Å; Y171-K174 PolarHBondContact O-N 2.84Å; Y171-L175 HydrophobicContact CD1-CD1 4Å; Y171-L175 HydrophobicContact CE1-CD1 3.36Å; Y171-L175 HydrophobicContact CE1-CG 4.16Å; Y171-L175 PolarHBondContact O-N 3.36Å
172	Y	75.5	Confident	74.6	Confident	39 Å²	39	84.7 Å²	84.7	15%	0.153	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-46.4	179.1	-173.9	-108.3	0	0	0	111.3	F168 E169 K174 L175 L176 Y198 A199 F202	F168-Y172 VanDerWaalsContact O-CB 3.23Å; F168-Y172 WeakPolarHBondContact O-CB 3.38Å; F168-Y172 PolarHBondContact O-N 2.97Å; E169-Y172 PolarHBondContact O-N 3.02Å; Y172-K174 VanDerWaalsContact C-N 3.34Å; Y172-K174 PolarHBondContact O-N 2.92Å; Y172-L175 WeakPolarHBondContact O-CB 3.5Å; Y172-L175 PolarHBondContact O-N 3.23Å; Y172-L176 HydrophobicContact CD1-CD1 3.92Å; Y172-L176 HydrophobicContact CE1-CD1 3.48Å; Y172-L176 VanDerWaalsContact CE1-CD1 3.48Å; Y172-L176 HydrophobicContact CE1-CG 4.3Å; Y172-L176 WeakPolarHBondContact O-CG 3.25Å; Y172-L176 PolarHBondContact O-N 3.49Å; Y172-L176 VanDerWaalsContact O-N 3.1Å; Y172-Y198 WeakPolarHBondContact OH-CE1 3.45Å; Y172-A199 HydrophobicContact CD1-CB 4.07Å; Y172-A199 HydrophobicContact CE1-CB 3.81Å; Y172-F202 AromaticContact CE1-CD1 3.81Å; Y172-F202 HydrophobicContact CE1-CD1 3.81Å; Y172-F202 HydrophobicContact CE1-CE1 4.46Å; Y172-F202 HydrophobicContact CE2-CD1 4.34Å; Y172-F202 HydrophobicContact CE2-CE1 4.22Å; Y172-F202 AromaticContact CZ-CD1 3.61Å; Y172-F202 AromaticContact CZ-CE1 3.93Å; Y172-F202 WeakPolarHBondContact OH-CD1 3.45Å
173	M	78.2	Confident	74.6	Confident	37 Å²	37	88 Å²	88	18%	0.182	41%	0.406	C	S	.	.	H	α-helix	trans	-57.6	-45.5	174.3	-72	-49.8	-65.1	0	0	111.9	E169 L175 L176 H177 D196 A199	E169-M173 HydrophobicContact CG-CG 4.47Å; E169-M173 WeakPolarHBondContact O-CB 3.35Å; E169-M173 VanDerWaalsContact O-CG 3.25Å; E169-M173 WeakPolarHBondContact O-CG 3.28Å; E169-M173 PolarHBondContact O-N 2.72Å; M173-L175 VanDerWaalsContact C-N 3.32Å; M173-L175 PolarHBondContact O-N 2.87Å; M173-L176 PolarHBondContact O-N 3.05Å; M173-H177 WeakPolarHBondContact O-CB 3.31Å; M173-H177 VanDerWaalsContact O-CG 3.28Å; M173-H177 PolarHBondContact O-N 3.31Å; M173-D196 HydrophobicContact CE-CB 4.32Å; M173-D196 WeakPolarHBondContact CE-OD1 3.43Å; M173-A199 HydrophobicContact CE-CB 4.23Å; M173-A199 HydrophobicContact SD-CB 3.23Å; M173-A199 WeakPolarHBondContact SD-CB 3.3Å
174	K	79.1	Confident	75	Confident	141 Å²	141	90.7 Å²	90.7	61%	0.613	43%	0.426	S	S	*	.	H	α-helix	trans	-59.8	-40.1	176.9	-78	168.7	-174.4	164.7	0	112.7	D170 Y171 Y172 K178	D170-K174 WeakPolarHBondContact O-CB 3.5Å; D170-K174 WeakPolarHBondContact O-CD 3.46Å; D170-K174 VanDerWaalsContact O-CG 3.22Å; D170-K174 WeakPolarHBondContact O-CG 3.27Å; D170-K174 PolarHBondContact O-N 3.25Å; Y171-K174 PolarHBondContact O-N 2.84Å; Y172-K174 VanDerWaalsContact C-N 3.34Å; Y172-K174 PolarHBondContact O-N 2.92Å; K174-K178 WeakPolarHBondContact O-CB 3.48Å; K174-K178 PolarHBondContact O-N 3.04Å
175	L	76.6	Confident	75.7	Confident	88 Å²	88	92.3 Å²	92.3	46%	0.461	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-44.4	176.9	-77.8	175	0	0	0	111.6	Y171 Y172 M173 K178 F179	Y171-L175 HydrophobicContact CD1-CD1 4Å; Y171-L175 HydrophobicContact CE1-CD1 3.36Å; Y171-L175 HydrophobicContact CE1-CG 4.16Å; Y171-L175 PolarHBondContact O-N 3.36Å; Y172-L175 WeakPolarHBondContact O-CB 3.5Å; Y172-L175 PolarHBondContact O-N 3.23Å; M173-L175 VanDerWaalsContact C-N 3.32Å; M173-L175 PolarHBondContact O-N 2.87Å; L175-K178 WeakPolarHBondContact O-CB 3.49Å; L175-K178 PolarHBondContact O-N 2.86Å; L175-F179 PolarHBondContact O-N 3.3Å
176	L	81.4	Confident	76.3	Confident	24 Å²	24	93.9 Å²	93.9	13%	0.126	44%	0.444	C	S	.	.	H	α-helix	trans	-67.9	-41.1	179	-63.1	177.4	0	0	0	112.2	Y172 M173 K178 F179 C180 M195 A199	Y172-L176 HydrophobicContact CD1-CD1 3.92Å; Y172-L176 HydrophobicContact CE1-CD1 3.48Å; Y172-L176 VanDerWaalsContact CE1-CD1 3.48Å; Y172-L176 HydrophobicContact CE1-CG 4.3Å; Y172-L176 WeakPolarHBondContact O-CG 3.25Å; Y172-L176 PolarHBondContact O-N 3.49Å; Y172-L176 VanDerWaalsContact O-N 3.1Å; M173-L176 PolarHBondContact O-N 3.05Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 3.32Å; L176-F179 WeakPolarHBondContact O-CB 3.46Å; L176-F179 PolarHBondContact O-N 3.36Å; L176-C180 PolarHBondContact O-N 3.06Å; L176-C180 PolarHBondContact O-SG 3.26Å; L176-M195 HydrophobicContact CB-CB 3.89Å; L176-M195 HydrophobicContact CB-CG 4.03Å; L176-M195 HydrophobicContact CB-SD 4.33Å; L176-M195 HydrophobicContact CD1-CB 4.39Å; L176-M195 HydrophobicContact CD2-SD 3.88Å; L176-M195 HydrophobicContact CG-SD 4.48Å; L176-A199 HydrophobicContact CD1-CB 3.52Å
177	H	82.8	Confident	77.3	Confident	74 Å²	74	87.7 Å²	87.7	34%	0.343	42%	0.422	S	S	.	.	H	α-helix	trans	-63.2	-38.8	172.6	-67.9	174.4	0	0	0	111.7	M173 F179 C180 S181 D196	M173-H177 WeakPolarHBondContact O-CB 3.31Å; M173-H177 VanDerWaalsContact O-CG 3.28Å; M173-H177 PolarHBondContact O-N 3.31Å; H177-F179 VanDerWaalsContact C-N 3.3Å; H177-F179 PolarHBondContact O-N 3.43Å; H177-C180 PolarHBondContact O-N 3.41Å; H177-S181 PolarHBondContact O-N 3.33Å; H177-D196 IonicContact CD2-OD1 3.33Å; H177-D196 IonicContact CE1-OD1 3.67Å; H177-D196 IonicContact NE2-OD1 3.69Å; H177-D196 PolarHBondContact NE2-OD1 2.85Å
178	K	78	Confident	77.8	Confident	125 Å²	125	84.7 Å²	84.7	54%	0.543	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-40	174.3	-176	63.9	-177.7	171.1	0	111.1	K174 L175 L176 C180 S181 F182	K174-K178 WeakPolarHBondContact O-CB 3.48Å; K174-K178 PolarHBondContact O-N 3.04Å; L175-K178 WeakPolarHBondContact O-CB 3.49Å; L175-K178 PolarHBondContact O-N 2.86Å; L176-K178 VanDerWaalsContact C-N 3.31Å; L176-K178 PolarHBondContact O-N 3.32Å; K178-C180 VanDerWaalsContact C-N 3.33Å; K178-S181 WeakPolarHBondContact O-CB 2.96Å; K178-S181 PolarHBondContact O-N 3.42Å; K178-S181 PolarHBondContact O-OG 3.08Å; K178-F182 WeakPolarHBondContact O-CD2 3.25Å
179	F	73.7	Confident	78.6	Confident	97 Å²	97	89.4 Å²	89.4	43%	0.425	43%	0.427	S	S	.	.	H	α-helix	trans	-59.1	-45.5	172.7	173.6	-96.5	0	0	0	111.4	L175 L176 H177 S181 F182 F183 M195	L175-F179 PolarHBondContact O-N 3.3Å; L176-F179 WeakPolarHBondContact O-CB 3.46Å; L176-F179 PolarHBondContact O-N 3.36Å; H177-F179 VanDerWaalsContact C-N 3.3Å; H177-F179 PolarHBondContact O-N 3.43Å; F179-S181 PolarHBondContact O-N 3.31Å; F179-F182 WeakPolarHBondContact O-CB 3.29Å; F179-F182 WeakPolarHBondContact O-CD2 3.27Å; F179-F182 PolarHBondContact O-N 3.49Å; F179-F182 VanDerWaalsContact O-N 3.13Å; F179-F183 HydrophobicContact CD1-CE2 4.27Å; F179-F183 AromaticContact CE1-CE2 3.62Å; F179-F183 HydrophobicContact CE1-CE2 3.62Å; F179-F183 HydrophobicContact CE1-CZ 4.24Å; F179-F183 AromaticContact CZ-CE2 3.8Å; F179-F183 HydrophobicContact CZ-CE2 3.8Å; F179-F183 HydrophobicContact CZ-CZ 4.25Å; F179-M195 HydrophobicContact CD1-CE 3.68Å; F179-M195 HydrophobicContact CE1-CE 3.63Å
180	C	78.5	Confident	79	Confident	1 Å²	1	91.8 Å²	91.8	1%	0.007	44%	0.438	C	S	.	.	H	α-helix	trans	-63.8	-28.1	176.8	-66.1	0	0	0	0	113.7	L176 H177 K178 F182 F183 Q188 C191 T192 M195	L176-C180 PolarHBondContact O-N 3.06Å; L176-C180 PolarHBondContact O-SG 3.26Å; H177-C180 PolarHBondContact O-N 3.41Å; K178-C180 VanDerWaalsContact C-N 3.33Å; C180-F182 PolarHBondContact O-N 3.5Å; C180-F182 VanDerWaalsContact O-N 3.12Å; C180-F183 WeakPolarHBondContact O-CB 3.28Å; C180-F183 PolarHBondContact O-N 3.28Å; C180-Q188 WeakPolarHBondContact O-CG 3.39Å; C180-C191 WeakPolarHBondContact CA-SG 3.41Å; C180-C191 HydrophobicContact CB-CB 3.64Å; C180-C191 WeakPolarHBondContact CB-SG 3.41Å; C180-C191 WeakPolarHBondContact SG-CB 3.47Å; C180-C191 PolarHBondContact SG-O 2.82Å; C180-C191 VanDerWaalsContact SG-O 3.34Å; C180-C191 CovalentContact SG-SG 2.05Å; C180-C191 PolarHBondContact SG-SG 3.4Å; C180-T192 PolarHBondContact SG-N 3.45Å; C180-T192 VanDerWaalsContact SG-N 3.35Å; C180-M195 WeakPolarHBondContact SG-CG 3.44Å
181	S	82.7	Confident	79.6	Confident	50 Å²	50	89.1 Å²	89.1	35%	0.35	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-15.4	175.4	80.1	0	0	0	0	114.5	H177 K178 F179 F183 Q188	H177-S181 PolarHBondContact O-N 3.33Å; K178-S181 WeakPolarHBondContact O-CB 2.96Å; K178-S181 PolarHBondContact O-N 3.42Å; K178-S181 PolarHBondContact O-OG 3.08Å; F179-S181 PolarHBondContact O-N 3.31Å; S181-F183 VanDerWaalsContact C-N 3.31Å; S181-Q188 PolarHBondContact O-NE2 3.08Å
182	F	80.9	Confident	80.2	Confident	152 Å²	152	84.2 Å²	84.2	67%	0.667	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-13.1	174.1	-64.4	-64.4	0	0	0	113.6	K178 F179 C180	K178-F182 WeakPolarHBondContact O-CD2 3.25Å; F179-F182 WeakPolarHBondContact O-CB 3.29Å; F179-F182 WeakPolarHBondContact O-CD2 3.27Å; F179-F182 PolarHBondContact O-N 3.49Å; F179-F182 VanDerWaalsContact O-N 3.13Å; C180-F182 PolarHBondContact O-N 3.5Å; C180-F182 VanDerWaalsContact O-N 3.12Å
183	F	69.4	Low	80.7	Confident	85 Å²	85	85.8 Å²	85.8	37%	0.373	43%	0.426	S	S	.	.	S	Bend	trans	-82.7	155.1	178.3	-76	-102.2	0	0	0	111.9	F179 C180 S181 A187 Q188	F179-F183 HydrophobicContact CD1-CE2 4.27Å; F179-F183 AromaticContact CE1-CE2 3.62Å; F179-F183 HydrophobicContact CE1-CE2 3.62Å; F179-F183 HydrophobicContact CE1-CZ 4.24Å; F179-F183 AromaticContact CZ-CE2 3.8Å; F179-F183 HydrophobicContact CZ-CE2 3.8Å; F179-F183 HydrophobicContact CZ-CZ 4.25Å; C180-F183 WeakPolarHBondContact O-CB 3.28Å; C180-F183 PolarHBondContact O-N 3.28Å; S181-F183 VanDerWaalsContact C-N 3.31Å; F183-A187 HydrophobicContact CB-CB 4.14Å; F183-A187 HydrophobicContact CD1-CB 4.21Å; F183-Q188 HydrophobicContact CB-CG 4.31Å; F183-Q188 VanDerWaalsContact O-CG 3.26Å; F183-Q188 WeakPolarHBondContact O-CG 3.23Å; F183-Q188 PolarHBondContact O-NE2 2.91Å
184	P	80.1	Confident	80.9	Confident	81 Å²	81	90.1 Å²	90.1	53%	0.526	44%	0.444	S	S	.	.			trans	-52.9	146.2	166.8	-27.5	37.5	0	0	0	111.9	D186 A187 Q188	P184-D186 WeakPolarHBondContact CB-OD1 3.4Å; P184-D186 PolarHBondContact O-N 2.86Å; P184-A187 WeakPolarHBondContact O-CA 3.49Å; P184-A187 PolarHBondContact O-N 2.97Å; P184-Q188 WeakPolarHBondContact O-CG 3.47Å; P184-Q188 PolarHBondContact O-N 3.38Å; P184-Q188 VanDerWaalsContact O-N 3.09Å
185	K	82.2	Confident	81.2	Confident	184 Å²	184	84.4 Å²	84.4	80%	0.8	42%	0.42	S	S	*	.	H	α-helix	trans	-50.8	-37.6	-172.8	-76.2	-175.2	173.6	-178.2	0	113.7	A187 Q188	K185-A187 VanDerWaalsContact C-N 3.26Å; K185-A187 PolarHBondContact O-N 2.93Å; K185-Q188 PolarHBondContact O-N 2.87Å
186	D	82.5	Confident	81.6	Confident	130 Å²	130	83.2 Å²	83.2	70%	0.695	41%	0.414	S	S	*	.	H	α-helix	trans	-66.5	-21	177.6	55	-52.3	0	0	0	114.2	P184	P184-D186 WeakPolarHBondContact CB-OD1 3.4Å; P184-D186 PolarHBondContact O-N 2.86Å
187	A	81.8	Confident	81.6	Confident	27 Å²	27	85.8 Å²	85.8	22%	0.223	43%	0.434	C	S	.	.	H	α-helix	trans	-105.9	-14.1	177	0	0	0	0	0	113.7	F183 P184 K185 E189 Q190 C191	F183-A187 HydrophobicContact CB-CB 4.14Å; F183-A187 HydrophobicContact CD1-CB 4.21Å; P184-A187 WeakPolarHBondContact O-CA 3.49Å; P184-A187 PolarHBondContact O-N 2.97Å; K185-A187 VanDerWaalsContact C-N 3.26Å; K185-A187 PolarHBondContact O-N 2.93Å; A187-E189 PolarHBondContact O-N 3.23Å; A187-Q190 PolarHBondContact O-N 3.41Å; A187-C191 WeakPolarHBondContact O-CB 3.24Å; A187-C191 PolarHBondContact O-N 3.35Å
188	Q	82.3	Confident	81.3	Confident	65 Å²	65	87.5 Å²	87.5	30%	0.304	44%	0.438	S	S	.	.	H	α-helix	trans	-60.3	-43.9	-178.2	-68.2	-173.1	-1.8	0	0	112.1	C180 S181 F183 P184 K185 Q190 C191 T192	C180-Q188 WeakPolarHBondContact O-CG 3.39Å; S181-Q188 PolarHBondContact O-NE2 3.08Å; F183-Q188 HydrophobicContact CB-CG 4.31Å; F183-Q188 VanDerWaalsContact O-CG 3.26Å; F183-Q188 WeakPolarHBondContact O-CG 3.23Å; F183-Q188 PolarHBondContact O-NE2 2.91Å; P184-Q188 WeakPolarHBondContact O-CG 3.47Å; P184-Q188 PolarHBondContact O-N 3.38Å; P184-Q188 VanDerWaalsContact O-N 3.09Å; K185-Q188 PolarHBondContact O-N 2.87Å; Q188-Q190 PolarHBondContact O-N 2.86Å; Q188-C191 PolarHBondContact O-N 3.28Å; Q188-T192 WeakPolarHBondContact O-CB 3.15Å; Q188-T192 PolarHBondContact O-N 2.81Å; Q188-T192 PolarHBondContact O-OG1 3.46Å
189	E	87.7	Confident	81.1	Confident	161 Å²	161	81.5 Å²	81.5	75%	0.752	41%	0.413	S	S	*	.	H	α-helix	trans	-63.9	-43.1	-179.1	-172.6	176	-175.3	0	0	111.9	A187 T192 S193	A187-E189 PolarHBondContact O-N 3.23Å; E189-T192 PolarHBondContact O-N 2.88Å; E189-S193 WeakPolarHBondContact O-CB 3.13Å; E189-S193 PolarHBondContact O-N 2.89Å
190	Q	79	Confident	81.2	Confident	150 Å²	150	83.4 Å²	83.4	70%	0.701	42%	0.421	S	S	*	.	H	α-helix	trans	-64.9	-42.7	176.3	-65.8	177.6	34.5	0	0	111.5	A187 Q188 F194	A187-Q190 PolarHBondContact O-N 3.41Å; Q188-Q190 PolarHBondContact O-N 2.86Å; Q190-F194 WeakPolarHBondContact O-CB 3.47Å; Q190-F194 PolarHBondContact O-N 3.42Å
191	C	87.1	Confident	81.1	Confident	15 Å²	15	89.4 Å²	89.4	10%	0.101	45%	0.447	C	S	.	.	H	α-helix	trans	-61.1	-49.3	174.9	179.9	0	0	0	0	111.2	C180 A187 Q188 S193 F194 M195	C180-C191 WeakPolarHBondContact CA-SG 3.41Å; C180-C191 HydrophobicContact CB-CB 3.64Å; C180-C191 WeakPolarHBondContact CB-SG 3.41Å; C180-C191 WeakPolarHBondContact SG-CB 3.47Å; C180-C191 PolarHBondContact SG-O 2.82Å; C180-C191 VanDerWaalsContact SG-O 3.34Å; C180-C191 CovalentContact SG-SG 2.05Å; C180-C191 PolarHBondContact SG-SG 3.4Å; A187-C191 WeakPolarHBondContact O-CB 3.24Å; A187-C191 PolarHBondContact O-N 3.35Å; Q188-C191 PolarHBondContact O-N 3.28Å; C191-S193 PolarHBondContact O-N 3.23Å; C191-F194 WeakPolarHBondContact O-CB 3.22Å; C191-F194 PolarHBondContact O-N 3.34Å; C191-M195 WeakPolarHBondContact O-CB 3.3Å; C191-M195 VanDerWaalsContact O-CG 3.31Å; C191-M195 WeakPolarHBondContact O-CG 3.17Å; C191-M195 PolarHBondContact O-N 3.18Å
192	T	85.2	Confident	80.8	Confident	42 Å²	42	90 Å²	90	26%	0.258	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-46.8	-178.5	-61.9	0	0	0	0	110.8	C180 Q188 E189 F194 M195 D196	C180-T192 PolarHBondContact SG-N 3.45Å; C180-T192 VanDerWaalsContact SG-N 3.35Å; Q188-T192 WeakPolarHBondContact O-CB 3.15Å; Q188-T192 PolarHBondContact O-N 2.81Å; Q188-T192 PolarHBondContact O-OG1 3.46Å; E189-T192 PolarHBondContact O-N 2.88Å; T192-F194 VanDerWaalsContact C-N 3.33Å; T192-F194 PolarHBondContact O-N 2.92Å; T192-M195 CarbonylContact O-C 3.59Å; T192-M195 PolarHBondContact O-N 2.88Å; T192-M195 VanDerWaalsContact O-N 3.12Å; T192-D196 PolarHBondContact O-N 3.09Å
193	S	86.6	Confident	80.4	Confident	72 Å²	72	84.4 Å²	84.4	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-60.4	-40.7	176.5	179.7	0	0	0	0	112.9	E189 C191 S197	E189-S193 WeakPolarHBondContact O-CB 3.13Å; E189-S193 PolarHBondContact O-N 2.89Å; C191-S193 PolarHBondContact O-N 3.23Å; S193-S197 PolarHBondContact O-N 2.77Å; S193-S197 VanDerWaalsContact O-N 3.16Å; S193-S197 PolarHBondContact O-OG 3.36Å
194	F	80.9	Confident	80.6	Confident	128 Å²	128	86 Å²	86	56%	0.561	43%	0.428	S	S	*	.	H	α-helix	trans	-63.1	-45.2	173.2	176.2	-96.3	0	0	0	111.6	Q190 C191 T192 S197 Y198	Q190-F194 WeakPolarHBondContact O-CB 3.47Å; Q190-F194 PolarHBondContact O-N 3.42Å; C191-F194 WeakPolarHBondContact O-CB 3.22Å; C191-F194 PolarHBondContact O-N 3.34Å; T192-F194 VanDerWaalsContact C-N 3.33Å; T192-F194 PolarHBondContact O-N 2.92Å; F194-S197 PolarHBondContact O-N 3.04Å; F194-Y198 VanDerWaalsContact O-CB 3.27Å; F194-Y198 WeakPolarHBondContact O-CB 3.43Å; F194-Y198 PolarHBondContact O-N 3.36Å
195	M	85.5	Confident	80.4	Confident	22 Å²	22	85.6 Å²	85.6	11%	0.108	42%	0.421	C	S	.	.	H	α-helix	trans	-66.4	-39.8	179.4	-72.8	-51.8	160.1	0	0	112.5	L176 F179 C180 C191 T192 S197 Y198 A199	L176-M195 HydrophobicContact CB-CB 3.89Å; L176-M195 HydrophobicContact CB-CG 4.03Å; L176-M195 HydrophobicContact CB-SD 4.33Å; L176-M195 HydrophobicContact CD1-CB 4.39Å; L176-M195 HydrophobicContact CD2-SD 3.88Å; L176-M195 HydrophobicContact CG-SD 4.48Å; F179-M195 HydrophobicContact CD1-CE 3.68Å; F179-M195 HydrophobicContact CE1-CE 3.63Å; C180-M195 WeakPolarHBondContact SG-CG 3.44Å; C191-M195 WeakPolarHBondContact O-CB 3.3Å; C191-M195 VanDerWaalsContact O-CG 3.31Å; C191-M195 WeakPolarHBondContact O-CG 3.17Å; C191-M195 PolarHBondContact O-N 3.18Å; T192-M195 CarbonylContact O-C 3.59Å; T192-M195 PolarHBondContact O-N 2.88Å; T192-M195 VanDerWaalsContact O-N 3.12Å; M195-S197 VanDerWaalsContact C-N 3.32Å; M195-S197 PolarHBondContact O-N 3.38Å; M195-Y198 PolarHBondContact O-N 3.37Å; M195-A199 WeakPolarHBondContact O-CB 3.08Å; M195-A199 PolarHBondContact O-N 3.47Å
196	D	86.1	Confident	80	Confident	62 Å²	62	76.9 Å²	76.9	33%	0.332	38%	0.384	S	S	.	.	H	α-helix	trans	-59.8	-45.5	175.4	-67.6	-17.3	0	0	0	111	M173 H177 T192 K200	M173-D196 HydrophobicContact CE-CB 4.32Å; M173-D196 WeakPolarHBondContact CE-OD1 3.43Å; H177-D196 IonicContact CD2-OD1 3.33Å; H177-D196 IonicContact CE1-OD1 3.67Å; H177-D196 IonicContact NE2-OD1 3.69Å; H177-D196 PolarHBondContact NE2-OD1 2.85Å; T192-D196 PolarHBondContact O-N 3.09Å; D196-K200 WeakPolarHBondContact O-CB 3.33Å; D196-K200 PolarHBondContact O-N 3.03Å; D196-K200 VanDerWaalsContact O-N 3.1Å
197	S	80.1	Confident	79.4	Confident	78 Å²	78	73 Å²	73	55%	0.545	37%	0.37	S	S	.	.	H	α-helix	trans	-66.8	-43	177.6	-58.3	0	0	0	0	112	S193 F194 M195 K201	S193-S197 PolarHBondContact O-N 2.77Å; S193-S197 VanDerWaalsContact O-N 3.16Å; S193-S197 PolarHBondContact O-OG 3.36Å; F194-S197 PolarHBondContact O-N 3.04Å; M195-S197 VanDerWaalsContact C-N 3.32Å; M195-S197 PolarHBondContact O-N 3.38Å; S197-K201 PolarHBondContact O-N 3.09Å
198	Y	77.5	Confident	78.9	Confident	110 Å²	110	76.9 Å²	76.9	43%	0.431	39%	0.386	S	S	.	.	H	α-helix	trans	-64	-45.7	177.2	176.4	-95.3	0	0	0	111.3	Y172 F194 M195 K201 F202	Y172-Y198 WeakPolarHBondContact OH-CE1 3.45Å; F194-Y198 VanDerWaalsContact O-CB 3.27Å; F194-Y198 WeakPolarHBondContact O-CB 3.43Å; F194-Y198 PolarHBondContact O-N 3.36Å; M195-Y198 PolarHBondContact O-N 3.37Å; Y198-K201 PolarHBondContact O-N 3.4Å; Y198-F202 HydrophobicContact CE1-CB 4.22Å; Y198-F202 VanDerWaalsContact O-CB 3.25Å; Y198-F202 WeakPolarHBondContact O-CB 3.48Å; Y198-F202 PolarHBondContact O-N 3.09Å
199	A	73.9	Confident	78.5	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-64.6	-46.2	-176.6	0	0	0	0	0	111.7	Y172 M173 L176 M195 K201 F202 M203	Y172-A199 HydrophobicContact CD1-CB 4.07Å; Y172-A199 HydrophobicContact CE1-CB 3.81Å; M173-A199 HydrophobicContact CE-CB 4.23Å; M173-A199 HydrophobicContact SD-CB 3.23Å; M173-A199 WeakPolarHBondContact SD-CB 3.3Å; L176-A199 HydrophobicContact CD1-CB 3.52Å; M195-A199 WeakPolarHBondContact O-CB 3.08Å; M195-A199 PolarHBondContact O-N 3.47Å; A199-K201 VanDerWaalsContact C-N 3.34Å; A199-K201 PolarHBondContact O-N 3.24Å; A199-F202 PolarHBondContact O-N 3.25Å; A199-M203 WeakPolarHBondContact O-CB 3.33Å; A199-M203 VanDerWaalsContact O-CG 3.22Å; A199-M203 WeakPolarHBondContact O-CG 3.3Å; A199-M203 PolarHBondContact O-N 3.04Å
200	K	74.8	Confident	77.7	Confident	137 Å²	137	71.6 Å²	71.6	60%	0.596	36%	0.362	S	S	*	.	H	α-helix	trans	-55.8	-50.8	175.7	-177.7	179.2	176.7	-177	0	111.2	D196 F202 M203 E204	D196-K200 WeakPolarHBondContact O-CB 3.33Å; D196-K200 PolarHBondContact O-N 3.03Å; D196-K200 VanDerWaalsContact O-N 3.1Å; K200-F202 PolarHBondContact O-N 2.02Å; K200-M203 PolarHBondContact O-N 3.43Å; K200-E204 WeakPolarHBondContact CE-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.45Å; K200-E204 PolarHBondContact O-N 3.34Å
201	K	77.1	Confident	77.5	Confident	127 Å²	127	65.7 Å²	65.7	55%	0.552	34%	0.338	S	S	*	.	H	α-helix	trans	-63.7	-41.9	178.5	-174.5	176.7	-178.8	179.3	0	112.1	S197 Y198 A199 M203 E204 D205	S197-K201 PolarHBondContact O-N 3.09Å; Y198-K201 PolarHBondContact O-N 3.4Å; A199-K201 VanDerWaalsContact C-N 3.34Å; A199-K201 PolarHBondContact O-N 3.24Å; K201-M203 VanDerWaalsContact C-N 3.33Å; K201-M203 PolarHBondContact O-N 3.44Å; K201-E204 PolarHBondContact O-N 2.85Å; K201-D205 WeakPolarHBondContact O-CB 3.36Å; K201-D205 PolarHBondContact O-N 3.33Å
202	F	76.4	Confident	76.8	Confident	62 Å²	62	66.1 Å²	66.1	27%	0.272	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-43.5	177.3	177.3	-96.4	0	0	0	111	Y172 Y198 A199 K200 D205 A206	Y172-F202 AromaticContact CE1-CD1 3.81Å; Y172-F202 HydrophobicContact CE1-CD1 3.81Å; Y172-F202 HydrophobicContact CE1-CE1 4.46Å; Y172-F202 HydrophobicContact CE2-CD1 4.34Å; Y172-F202 HydrophobicContact CE2-CE1 4.22Å; Y172-F202 AromaticContact CZ-CD1 3.61Å; Y172-F202 AromaticContact CZ-CE1 3.93Å; Y172-F202 WeakPolarHBondContact OH-CD1 3.45Å; Y198-F202 HydrophobicContact CE1-CB 4.22Å; Y198-F202 VanDerWaalsContact O-CB 3.25Å; Y198-F202 WeakPolarHBondContact O-CB 3.48Å; Y198-F202 PolarHBondContact O-N 3.09Å; A199-F202 PolarHBondContact O-N 3.25Å; K200-F202 PolarHBondContact O-N 2.02Å; F202-D205 PolarHBondContact O-N 3.41Å; F202-A206 HydrophobicContact CD1-CB 4.33Å; F202-A206 HydrophobicContact CE1-CB 4.06Å; F202-A206 HydrophobicContact CZ-CB 4.24Å; F202-A206 WeakPolarHBondContact O-CA 3.42Å; F202-A206 WeakPolarHBondContact O-CB 3.34Å; F202-A206 PolarHBondContact O-N 3.18Å
203	M	72.3	Confident	76.1	Confident	35 Å²	35	69.6 Å²	69.6	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-63.4	-43.6	177.7	-71.6	-64.4	-67.8	0	0	111.8	F168 E169 A199 K200 K201 A206 A207	F168-M203 HydrophobicContact CD1-CE 3.8Å; F168-M203 HydrophobicContact CD1-SD 3.88Å; F168-M203 HydrophobicContact CE1-CE 4.15Å; F168-M203 HydrophobicContact CE1-SD 3.65Å; E169-M203 HydrophobicContact CB-CE 4.06Å; E169-M203 HydrophobicContact CG-CE 4.36Å; A199-M203 WeakPolarHBondContact O-CB 3.33Å; A199-M203 VanDerWaalsContact O-CG 3.22Å; A199-M203 WeakPolarHBondContact O-CG 3.3Å; A199-M203 PolarHBondContact O-N 3.04Å; K200-M203 PolarHBondContact O-N 3.43Å; K201-M203 VanDerWaalsContact C-N 3.33Å; K201-M203 PolarHBondContact O-N 3.44Å; M203-A206 PolarHBondContact O-N 3.5Å; M203-A207 PolarHBondContact O-N 2.67Å
204	E	73.1	Confident	75.6	Confident	117 Å²	117	70.3 Å²	70.3	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-60	-46.4	174.6	-71	168.9	-178.5	0	0	111.6	K200 K201	K200-E204 WeakPolarHBondContact CE-OE1 3.1Å; K200-E204 WeakPolarHBondContact O-CG 3.45Å; K200-E204 PolarHBondContact O-N 3.34Å; K201-E204 PolarHBondContact O-N 2.85Å
205	D	77.2	Confident	75.5	Confident	73 Å²	73	66.5 Å²	66.5	39%	0.39	34%	0.338	S	S	.	.	H	α-helix	trans	-73.4	-33.2	179.5	-72	-21.4	0	0	0	112.2	K201 F202 L208 I209	K201-D205 WeakPolarHBondContact O-CB 3.36Å; K201-D205 PolarHBondContact O-N 3.33Å; F202-D205 PolarHBondContact O-N 3.41Å; D205-L208 WeakPolarHBondContact O-CB 3.49Å; D205-L208 PolarHBondContact O-N 2.93Å; D205-I209 HydrophobicContact CB-CD1 4.35Å; D205-I209 WeakPolarHBondContact O-CB 2.94Å; D205-I209 WeakPolarHBondContact O-CD1 3.42Å; D205-I209 WeakPolarHBondContact O-CG1 3.18Å; D205-I209 PolarHBondContact O-N 3.15Å
206	A	72.3	Confident	75.3	Confident	2 Å²	2	65.9 Å²	65.9	2%	0.017	34%	0.336	C	S	.	.	H	α-helix	trans	-69.2	-43.3	-174.8	0	0	0	0	0	111.4	M163 F202 M203 L208 I209 F210	M163-A206 HydrophobicContact CE-CB 3.85Å; M163-A206 HydrophobicContact SD-CB 3.72Å; F202-A206 HydrophobicContact CD1-CB 4.33Å; F202-A206 HydrophobicContact CE1-CB 4.06Å; F202-A206 HydrophobicContact CZ-CB 4.24Å; F202-A206 WeakPolarHBondContact O-CA 3.42Å; F202-A206 WeakPolarHBondContact O-CB 3.34Å; F202-A206 PolarHBondContact O-N 3.18Å; M203-A206 PolarHBondContact O-N 3.5Å; A206-L208 PolarHBondContact O-N 2.9Å; A206-I209 PolarHBondContact O-N 2.73Å; A206-I209 VanDerWaalsContact O-N 3.08Å; A206-F210 HydrophobicContact CB-CD2 4.01Å; A206-F210 HydrophobicContact CB-CE2 4.18Å; A206-F210 WeakPolarHBondContact O-CB 3.4Å; A206-F210 WeakPolarHBondContact O-CD2 3.45Å; A206-F210 PolarHBondContact O-N 3.02Å
207	A	70.1	Confident	74.5	Confident	48 Å²	48	67.4 Å²	67.4	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-54.8	-42.2	174.4	0	0	0	0	0	111.2	M203 S211	M203-A207 PolarHBondContact O-N 2.67Å; A207-S211 PolarHBondContact O-N 3.18Å; A207-S211 VanDerWaalsContact O-N 3.08Å
208	L	71.2	Confident	73.7	Confident	108 Å²	108	68.2 Å²	68.2	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-66.8	-45.2	175.3	-175.1	70.6	0	0	0	112.2	D205 A206 I214	D205-L208 WeakPolarHBondContact O-CB 3.49Å; D205-L208 PolarHBondContact O-N 2.93Å; A206-L208 PolarHBondContact O-N 2.9Å; L208-I214 HydrophobicContact CD1-CD1 3.39Å; L208-I214 HydrophobicContact CG-CD1 3.72Å; L208-I214 WeakPolarHBondContact O-CB 3.38Å; L208-I214 WeakPolarHBondContact O-CD1 3.43Å
209	I	73.5	Confident	72.7	Confident	73 Å²	73	67.8 Å²	67.8	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-67.9	-36.7	-177	-70.9	164.6	0	0	0	112	D205 A206 F215	D205-I209 HydrophobicContact CB-CD1 4.35Å; D205-I209 WeakPolarHBondContact O-CB 2.94Å; D205-I209 WeakPolarHBondContact O-CD1 3.42Å; D205-I209 WeakPolarHBondContact O-CG1 3.18Å; D205-I209 PolarHBondContact O-N 3.15Å; A206-I209 PolarHBondContact O-N 2.73Å; A206-I209 VanDerWaalsContact O-N 3.08Å; I209-F215 WeakPolarHBondContact O-CB 3.02Å; I209-F215 WeakPolarHBondContact O-CD2 2.94Å
210	F	72	Confident	71.3	Confident	42 Å²	42	74.3 Å²	74.3	18%	0.184	41%	0.406	C	S	.	.	H	α-helix	trans	-92.5	-3.5	-177	-69.5	-68.9	0	0	0	113.9	V159 M163 A206 F215	V159-F210 HydrophobicContact CB-CB 4.33Å; V159-F210 HydrophobicContact CB-CD1 4.17Å; V159-F210 HydrophobicContact CB-CG 4.29Å; V159-F210 HydrophobicContact CG1-CB 3.79Å; V159-F210 HydrophobicContact CG1-CD1 3.57Å; V159-F210 HydrophobicContact CG1-CD2 3.82Å; V159-F210 HydrophobicContact CG1-CE1 4.05Å; V159-F210 HydrophobicContact CG1-CE2 4.29Å; V159-F210 HydrophobicContact CG1-CG 3.44Å; V159-F210 VanDerWaalsContact CG1-CG 3.44Å; V159-F210 HydrophobicContact CG1-CZ 4.38Å; M163-F210 HydrophobicContact CE-CD2 3.31Å; M163-F210 HydrophobicContact CE-CE2 3.42Å; M163-F210 VanDerWaalsContact CE-CE2 3.42Å; M163-F210 HydrophobicContact CE-CG 4.23Å; M163-F210 HydrophobicContact CE-CZ 4.38Å; M163-F210 HydrophobicContact SD-CB 4.43Å; M163-F210 HydrophobicContact SD-CD2 3.65Å; M163-F210 HydrophobicContact SD-CE2 4.35Å; M163-F210 HydrophobicContact SD-CG 4.36Å; A206-F210 HydrophobicContact CB-CD2 4.01Å; A206-F210 HydrophobicContact CB-CE2 4.18Å; A206-F210 WeakPolarHBondContact O-CB 3.4Å; A206-F210 WeakPolarHBondContact O-CD2 3.45Å; A206-F210 PolarHBondContact O-N 3.02Å; F210-F215 AromaticContact CD1-CD2 3.73Å; F210-F215 HydrophobicContact CD1-CD2 3.73Å; F210-F215 AromaticContact CD1-CE2 3.67Å; F210-F215 HydrophobicContact CD1-CE2 3.67Å; F210-F215 HydrophobicContact CD1-CG 4.38Å; F210-F215 HydrophobicContact CD1-CZ 4.28Å; F210-F215 HydrophobicContact CE1-CD2 4.08Å; F210-F215 AromaticContact CE1-CE2 3.55Å; F210-F215 HydrophobicContact CE1-CE2 3.55Å; F210-F215 HydrophobicContact CE1-CZ 4.11Å
211	S	73.8	Confident	69.9	Low	26 Å²	26	71.2 Å²	71.2	18%	0.182	41%	0.412	C	S	.	.	S	Bend	trans	-52.3	128.3	165.9	179.9	0	0	0	0	109.5	A207 D213 I214 F215	A207-S211 PolarHBondContact O-N 3.18Å; A207-S211 VanDerWaalsContact O-N 3.08Å; S211-D213 PolarHBondContact O-N 3.04Å; S211-I214 PolarHBondContact O-N 2.76Å; S211-F215 PolarHBondContact O-N 3.33Å
212	P	72.6	Confident	68	Low	25 Å²	25	70 Å²	70	16%	0.162	43%	0.426	C	S	.	.	H	α-helix	trans	-49.3	-37.3	-176.1	-31.1	34.5	0	0	0	114.3	A156 A157 E160 I214 C216	A156-P212 HydrophobicContact CB-CB 4.16Å; A156-P212 HydrophobicContact CB-CG 4.06Å; A157-P212 HydrophobicContact CB-CG 4.14Å; E160-P212 WeakPolarHBondContact OE2-CD 3.41Å; P212-I214 VanDerWaalsContact C-N 3.33Å; P212-I214 PolarHBondContact O-N 2.85Å; P212-C216 CarbonylContact O-C 3.57Å; P212-C216 WeakPolarHBondContact O-CA 3.14Å; P212-C216 VanDerWaalsContact O-CB 3.28Å; P212-C216 WeakPolarHBondContact O-CB 2.95Å; P212-C216 PolarHBondContact O-N 3.44Å
213	D	71.8	Confident	65.9	Low	114 Å²	114	79.9 Å²	79.9	61%	0.61	47%	0.473	S	S	*	.	H	α-helix	trans	-66.5	-32.4	180	-71.6	-24.1	0	0	0	113.7	S211	S211-D213 PolarHBondContact O-N 3.04Å
214	I	76.2	Confident	65.6	Low	88 Å²	88	82.1 Å²	82.1	45%	0.451	49%	0.488	S	S	.	.	H	α-helix	trans	-92.4	-40.8	-177.4	-67.9	173.3	0	0	0	110.5	L208 S211 P212	L208-I214 HydrophobicContact CD1-CD1 3.39Å; L208-I214 HydrophobicContact CG-CD1 3.72Å; L208-I214 WeakPolarHBondContact O-CB 3.38Å; L208-I214 WeakPolarHBondContact O-CD1 3.43Å; S211-I214 PolarHBondContact O-N 2.76Å; P212-I214 VanDerWaalsContact C-N 3.33Å; P212-I214 PolarHBondContact O-N 2.85Å
215	F	78.6	Confident	65.2	Low	48 Å²	48	80.3 Å²	80.3	21%	0.211	49%	0.485	C	S	.	.	H	α-helix	trans	-72.3	-38.1	-179.2	-163.2	-104.5	0	0	0	111.8	L65 F155 A156 I209 F210 S211 P217	L65-F215 HydrophobicContact CD1-CE1 4.21Å; L65-F215 HydrophobicContact CD1-CZ 3.75Å; F155-F215 AromaticContact CD1-CE1 3.73Å; F155-F215 HydrophobicContact CD1-CE1 3.73Å; F155-F215 HydrophobicContact CD1-CZ 4.27Å; F155-F215 AromaticContact CE1-CE1 3.91Å; F155-F215 HydrophobicContact CE1-CE1 3.91Å; F155-F215 AromaticContact CE1-CZ 3.96Å; F155-F215 HydrophobicContact CE1-CZ 3.96Å; A156-F215 HydrophobicContact CB-CB 4Å; A156-F215 HydrophobicContact CB-CD1 3.87Å; A156-F215 HydrophobicContact CB-CG 4.25Å; I209-F215 WeakPolarHBondContact O-CB 3.02Å; I209-F215 WeakPolarHBondContact O-CD2 2.94Å; F210-F215 AromaticContact CD1-CD2 3.73Å; F210-F215 HydrophobicContact CD1-CD2 3.73Å; F210-F215 AromaticContact CD1-CE2 3.67Å; F210-F215 HydrophobicContact CD1-CE2 3.67Å; F210-F215 HydrophobicContact CD1-CG 4.38Å; F210-F215 HydrophobicContact CD1-CZ 4.28Å; F210-F215 HydrophobicContact CE1-CD2 4.08Å; F210-F215 AromaticContact CE1-CE2 3.55Å; F210-F215 HydrophobicContact CE1-CE2 3.55Å; F210-F215 HydrophobicContact CE1-CZ 4.11Å; S211-F215 PolarHBondContact O-N 3.33Å; F215-P217 VanDerWaalsContact O-CD 3.32Å; F215-P217 WeakPolarHBondContact O-CD 3.06Å
216	C	81.2	Confident	64.5	Low	9 Å²	9	80.7 Å²	80.7	6%	0.061	49%	0.49	C	S	.	.	S	Bend	trans	-122.4	62.4	-175.7	-54.2	0	0	0	0	111.3	C152 Q153 P212 V218	C152-C216 VanDerWaalsContact CA-SG 3.52Å; C152-C216 HydrophobicContact CB-CB 3.84Å; C152-C216 WeakPolarHBondContact CB-SG 3.43Å; C152-C216 PolarHBondContact O-SG 2.92Å; C152-C216 WeakPolarHBondContact SG-CB 3.46Å; C152-C216 CovalentContact SG-SG 2.03Å; C152-C216 PolarHBondContact SG-SG 3.12Å; Q153-C216 HydrophobicContact CG-CB 3.98Å; Q153-C216 PolarHBondContact N-SG 3.02Å; P212-C216 CarbonylContact O-C 3.57Å; P212-C216 WeakPolarHBondContact O-CA 3.14Å; P212-C216 VanDerWaalsContact O-CB 3.28Å; P212-C216 WeakPolarHBondContact O-CB 2.95Å; P212-C216 PolarHBondContact O-N 3.44Å; C216-V218 PolarHBondContact O-N 3.36Å; C216-V218 VanDerWaalsContact O-N 3.16Å
217	P	69.7	Low	64.1	Low	94 Å²	94	85.3 Å²	85.3	61%	0.61	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-63.1	123.8	-176.9	27	-33.6	0	0	0	109.9	F215 S219	F215-P217 VanDerWaalsContact O-CD 3.32Å; F215-P217 WeakPolarHBondContact O-CD 3.06Å; P217-S219 PolarHBondContact O-N 3.17Å
218	V	63.3	Low	63.7	Low	95 Å²	95	87.6 Å²	87.6	58%	0.576	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-61.3	125.7	171	-68.7	0	0	0	0	109	C216	C216-V218 PolarHBondContact O-N 3.36Å; C216-V218 VanDerWaalsContact O-N 3.16Å
219	S	55.3	Low	63.2	Low	100 Å²	100	86.3 Å²	86.3	70%	0.699	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-62.1	129.5	175.1	-175.6	0	0	0	0	109	P217 G221	P217-S219 PolarHBondContact O-N 3.17Å; S219-G221 VanDerWaalsContact C-N 3.26Å; S219-G221 PolarHBondContact O-N 2.75Å
220	P	45.7	Very low	62.5	Low	138 Å²	138	87.2 Å²	87.2	90%	0.896	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	86.5	175.3	27.8	-31.2	0	0	0	109.1
221	G	44.4	Very low	61.7	Low	71 Å²	71	90.7 Å²	90.7	73%	0.732	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	179.7	15.4	-178	0	0	0	0	0	116.2	S219	S219-G221 VanDerWaalsContact C-N 3.26Å; S219-G221 PolarHBondContact O-N 2.75Å
222	A	37.3	Very low	60.7	Low	101 Å²	101	96.1 Å²	96.1	84%	0.835	59%	0.592	S	S	*	*			trans	-116.1	82.9	173.4	0	0	0	0	0	109.5
223	Q	32.6	Very low	59.6	Low	270 Å²	270	102.5 Å²	102.5	100%	1.262	63%	0.631	S	S	*	*			trans	-109	0	148.5	-76	-176.8	-1.5	0	0	106.9

Retrieved 223 of 223 residues in 463.1 ms (Link to these results)

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