A0A077YZJ7_TRITR Loading...

Mediator of RNA polymerase II transcription subunit 8

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A077YZJ7, Species TRITR (Trichuris trichiura, Whipworm), Gene MED8, Length 225 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	62.3	Low	82.7	Confident	205 Å²	205	113.8 Å²	113.8	100%	1.01	55%	0.552	S	S	*	*				0	-50.8	0	-170.5	170.8	-83.2	0	0	109.3	E3 K4 E5	M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 3.38Å; M1-K4 PolarHBondContact O-N 2.92Å; M1-K4 VanDerWaalsContact O-N 3.12Å; M1-E5 PolarHBondContact O-N 3.09Å
2	E	80.6	Confident	83.3	Confident	165 Å²	165	108.7 Å²	108.7	77%	0.771	53%	0.528	S	S	*	.	H	α-helix	trans	-50.3	-41.9	174	-163.6	175.5	-176.6	0	0	114.9	K4 E5 K6	E2-K4 PolarHBondContact O-N 2.99Å; E2-E5 PolarHBondContact O-N 3.14Å; E2-K6 WeakPolarHBondContact O-CB 3.41Å; E2-K6 PolarHBondContact O-N 3.35Å
3	E	81.8	Confident	83.9	Confident	168 Å²	168	105.9 Å²	105.9	79%	0.785	52%	0.522	S	S	*	.	H	α-helix	trans	-62.9	-39.5	178.3	-170.9	-179.1	-174.7	0	0	113.2	M1 K6 A7	M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 3.38Å; E3-K6 PolarHBondContact O-N 2.65Å; E3-A7 WeakPolarHBondContact O-CB 3.34Å; E3-A7 PolarHBondContact O-N 2.96Å
4	K	81.6	Confident	84.4	Confident	169 Å²	169	103.9 Å²	103.9	74%	0.735	51%	0.514	S	S	*	.	H	α-helix	trans	-68.9	-39.5	178.6	-70.3	-174.4	176.4	-180	0	111.4	M1 E2 F8	M1-K4 PolarHBondContact O-N 2.92Å; M1-K4 VanDerWaalsContact O-N 3.12Å; E2-K4 PolarHBondContact O-N 2.99Å; K4-F8 WeakPolarHBondContact O-CB 3.38Å; K4-F8 PolarHBondContact O-N 2.88Å
5	E	83.6	Confident	84.8	Confident	120 Å²	120	99.2 Å²	99.2	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-66.6	-44.6	176.3	-175.7	173.4	-177.2	0	0	111.2	M1 E2 A7 F8 Q9	M1-E5 PolarHBondContact O-N 3.09Å; E2-E5 PolarHBondContact O-N 3.14Å; E5-A7 VanDerWaalsContact C-N 3.35Å; E5-A7 PolarHBondContact O-N 3.25Å; E5-F8 WeakPolarHBondContact O-CB 3.46Å; E5-F8 PolarHBondContact O-N 2.85Å; E5-F8 VanDerWaalsContact O-N 3.16Å; E5-Q9 WeakPolarHBondContact O-CG 3.26Å; E5-Q9 PolarHBondContact O-N 3.47Å
6	K	85.9	Confident	85.3	Confident	153 Å²	153	99.1 Å²	99.1	67%	0.665	49%	0.492	S	S	*	.	H	α-helix	trans	-61.1	-43	175.1	-172.1	177.4	-178.2	179.3	0	112	E2 E3 F8 Q9 T10	E2-K6 WeakPolarHBondContact O-CB 3.41Å; E2-K6 PolarHBondContact O-N 3.35Å; E3-K6 PolarHBondContact O-N 2.65Å; K6-F8 VanDerWaalsContact C-N 3.33Å; K6-F8 PolarHBondContact O-N 3.31Å; K6-Q9 PolarHBondContact O-N 3.42Å; K6-T10 WeakPolarHBondContact O-CB 3.5Å; K6-T10 PolarHBondContact O-N 2.96Å; K6-T10 PolarHBondContact O-OG1 3.29Å
7	A	84.1	Confident	85.7	Confident	44 Å²	44	97.6 Å²	97.6	36%	0.364	49%	0.486	S	S	.	.	H	α-helix	trans	-60.7	-43.5	174.3	0	0	0	0	0	111.3	E3 E5 T10 T11	E3-A7 WeakPolarHBondContact O-CB 3.34Å; E3-A7 PolarHBondContact O-N 2.96Å; E5-A7 VanDerWaalsContact C-N 3.35Å; E5-A7 PolarHBondContact O-N 3.25Å; A7-T10 PolarHBondContact O-N 3.13Å; A7-T11 PolarHBondContact O-N 3.41Å; A7-T11 PolarHBondContact O-OG1 2.88Å
8	F	85.7	Confident	86	Confident	43 Å²	43	95.4 Å²	95.4	19%	0.189	47%	0.474	C	S	.	.	H	α-helix	trans	-61.4	-49	177	175.9	-97.9	0	0	0	113.1	K4 E5 K6 T10 T11 I12 P68 L70 Q73	K4-F8 WeakPolarHBondContact O-CB 3.38Å; K4-F8 PolarHBondContact O-N 2.88Å; E5-F8 WeakPolarHBondContact O-CB 3.46Å; E5-F8 PolarHBondContact O-N 2.85Å; E5-F8 VanDerWaalsContact O-N 3.16Å; K6-F8 VanDerWaalsContact C-N 3.33Å; K6-F8 PolarHBondContact O-N 3.31Å; F8-T10 VanDerWaalsContact C-N 3.3Å; F8-T10 PolarHBondContact O-N 3.02Å; F8-T11 PolarHBondContact O-N 3.26Å; F8-I12 HydrophobicContact CD1-CD1 3.79Å; F8-I12 HydrophobicContact CD2-CD1 4.5Å; F8-I12 HydrophobicContact CE1-CD1 3.25Å; F8-I12 HydrophobicContact CE1-CG1 4.41Å; F8-I12 HydrophobicContact CE2-CD1 4.05Å; F8-I12 HydrophobicContact CG-CD1 4.4Å; F8-I12 HydrophobicContact CZ-CD1 3.41Å; F8-I12 VanDerWaalsContact CZ-CD1 3.41Å; F8-I12 HydrophobicContact CZ-CG1 4.4Å; F8-I12 WeakPolarHBondContact O-CG1 3.24Å; F8-I12 PolarHBondContact O-N 2.87Å; F8-P68 VanDerWaalsContact CA-CG 3.42Å; F8-P68 HydrophobicContact CB-CB 4.32Å; F8-P68 HydrophobicContact CB-CG 3.75Å; F8-P68 HydrophobicContact CD2-CB 4.4Å; F8-P68 HydrophobicContact CD2-CG 3.98Å; F8-P68 HydrophobicContact CG-CG 4.36Å; F8-L70 HydrophobicContact CD2-CD2 3.78Å; F8-L70 HydrophobicContact CE2-CD2 3.44Å; F8-L70 VanDerWaalsContact CE2-CD2 3.44Å; F8-Q73 HydrophobicContact CE2-CB 4.39Å; F8-Q73 HydrophobicContact CE2-CG 3.91Å; F8-Q73 HydrophobicContact CZ-CG 4.38Å
9	Q	87.7	Confident	86.4	Confident	98 Å²	98	94.1 Å²	94.1	46%	0.458	47%	0.472	S	S	.	.	H	α-helix	trans	-60.1	-42.6	175.8	-67.1	-63.3	-13.2	0	0	111.4	E5 K6 T11 I12 V13	E5-Q9 WeakPolarHBondContact O-CG 3.26Å; E5-Q9 PolarHBondContact O-N 3.47Å; K6-Q9 PolarHBondContact O-N 3.42Å; Q9-T11 VanDerWaalsContact C-N 3.35Å; Q9-T11 PolarHBondContact O-N 3.42Å; Q9-I12 PolarHBondContact O-N 3.23Å; Q9-V13 WeakPolarHBondContact O-CG2 3.4Å; Q9-V13 PolarHBondContact O-N 3.47Å
10	T	88.7	Confident	86.7	Confident	71 Å²	71	95.4 Å²	95.4	44%	0.436	47%	0.471	S	S	.	.	H	α-helix	trans	-61.4	-43.6	176.8	-54.5	0	0	0	0	111.3	K6 A7 F8 V13 N14	K6-T10 WeakPolarHBondContact O-CB 3.5Å; K6-T10 PolarHBondContact O-N 2.96Å; K6-T10 PolarHBondContact O-OG1 3.29Å; A7-T10 PolarHBondContact O-N 3.13Å; F8-T10 VanDerWaalsContact C-N 3.3Å; F8-T10 PolarHBondContact O-N 3.02Å; T10-V13 PolarHBondContact O-N 2.99Å; T10-N14 WeakPolarHBondContact O-CB 3.29Å; T10-N14 PolarHBondContact O-N 3.5Å; T10-N14 PolarHBondContact O-ND2 2.99Å; T10-N14 PolarHBondContact O-OD1 3.05Å
11	T	88	Confident	87	Confident	16 Å²	16	92.5 Å²	92.5	10%	0.098	46%	0.46	C	S	.	.	H	α-helix	trans	-63.8	-41.8	177	-57.9	0	0	0	0	112.1	A7 F8 Q9 N14 I15 I61 T67 P68	A7-T11 PolarHBondContact O-N 3.41Å; A7-T11 PolarHBondContact O-OG1 2.88Å; F8-T11 PolarHBondContact O-N 3.26Å; Q9-T11 VanDerWaalsContact C-N 3.35Å; Q9-T11 PolarHBondContact O-N 3.42Å; T11-N14 PolarHBondContact O-N 3.43Å; T11-I15 HydrophobicContact CG2-CD1 3.89Å; T11-I15 HydrophobicContact CG2-CG1 4.44Å; T11-I15 VanDerWaalsContact O-CG1 3.3Å; T11-I15 WeakPolarHBondContact O-CG1 3.42Å; T11-I15 PolarHBondContact O-N 3.49Å; T11-I61 HydrophobicContact CG2-CG2 4.49Å; T11-T67 HydrophobicContact CG2-CG2 3.78Å; T11-P68 VanDerWaalsContact OG1-CD 3.31Å; T11-P68 WeakPolarHBondContact OG1-CD 3.38Å
12	I	89.7	Confident	88.6	Confident	52 Å²	52	83.4 Å²	83.4	27%	0.267	42%	0.416	S	S	.	.	H	α-helix	trans	-61.1	-48.6	176.1	-71.7	175.3	0	0	0	110.9	F8 Q9 N14 I15 L16	F8-I12 HydrophobicContact CD1-CD1 3.79Å; F8-I12 HydrophobicContact CD2-CD1 4.5Å; F8-I12 HydrophobicContact CE1-CD1 3.25Å; F8-I12 HydrophobicContact CE1-CG1 4.41Å; F8-I12 HydrophobicContact CE2-CD1 4.05Å; F8-I12 HydrophobicContact CG-CD1 4.4Å; F8-I12 HydrophobicContact CZ-CD1 3.41Å; F8-I12 VanDerWaalsContact CZ-CD1 3.41Å; F8-I12 HydrophobicContact CZ-CG1 4.4Å; F8-I12 WeakPolarHBondContact O-CG1 3.24Å; F8-I12 PolarHBondContact O-N 2.87Å; Q9-I12 PolarHBondContact O-N 3.23Å; I12-N14 VanDerWaalsContact C-N 3.27Å; I12-N14 PolarHBondContact O-N 2.92Å; I12-I15 PolarHBondContact O-N 3.2Å; I12-L16 HydrophobicContact CG2-CD1 3.81Å; I12-L16 HydrophobicContact CG2-CG 4.25Å; I12-L16 WeakPolarHBondContact O-CB 3.44Å; I12-L16 WeakPolarHBondContact O-CG 3.39Å; I12-L16 PolarHBondContact O-N 2.83Å
13	V	91.3	Very high	89.2	Confident	73 Å²	73	77.9 Å²	77.9	44%	0.442	39%	0.39	S	S	.	.	H	α-helix	trans	-59.6	-41.1	178.7	172.5	0	0	0	0	111	Q9 T10 L16 N17	Q9-V13 WeakPolarHBondContact O-CG2 3.4Å; Q9-V13 PolarHBondContact O-N 3.47Å; T10-V13 PolarHBondContact O-N 2.99Å; V13-L16 PolarHBondContact O-N 3.31Å; V13-N17 WeakPolarHBondContact O-CB 3.46Å; V13-N17 VanDerWaalsContact O-CG 3.27Å; V13-N17 PolarHBondContact O-N 3.41Å; V13-N17 PolarHBondContact O-ND2 2.67Å
14	N	90.4	Very high	89.8	Confident	78 Å²	78	75 Å²	75	42%	0.417	38%	0.377	S	S	.	.	H	α-helix	trans	-63.3	-44.5	176	-69.9	-13.1	0	0	0	112.2	T10 T11 I12 N17 Q18	T10-N14 WeakPolarHBondContact O-CB 3.29Å; T10-N14 PolarHBondContact O-N 3.5Å; T10-N14 PolarHBondContact O-ND2 2.99Å; T10-N14 PolarHBondContact O-OD1 3.05Å; T11-N14 PolarHBondContact O-N 3.43Å; I12-N14 VanDerWaalsContact C-N 3.27Å; I12-N14 PolarHBondContact O-N 2.92Å; N14-N17 PolarHBondContact O-N 3.03Å; N14-Q18 WeakPolarHBondContact O-CG 3.15Å; N14-Q18 PolarHBondContact O-N 3.09Å; N14-Q18 VanDerWaalsContact O-N 3.1Å
15	I	91	Very high	90.3	Very high	33 Å²	33	67.5 Å²	67.5	17%	0.169	35%	0.345	C	S	.	.	H	α-helix	trans	-62	-46.2	176.2	-68.3	165.6	0	0	0	110.2	T11 I12 N17 Q18 V19 I61 L62 L70	T11-I15 HydrophobicContact CG2-CD1 3.89Å; T11-I15 HydrophobicContact CG2-CG1 4.44Å; T11-I15 VanDerWaalsContact O-CG1 3.3Å; T11-I15 WeakPolarHBondContact O-CG1 3.42Å; T11-I15 PolarHBondContact O-N 3.49Å; I12-I15 PolarHBondContact O-N 3.2Å; I15-N17 PolarHBondContact O-N 3.29Å; I15-Q18 PolarHBondContact O-N 2.69Å; I15-V19 HydrophobicContact CG2-CG2 4.28Å; I15-V19 WeakPolarHBondContact O-CG2 3.39Å; I15-V19 PolarHBondContact O-N 3.39Å; I15-I61 HydrophobicContact CD1-CG2 4.47Å; I15-I61 HydrophobicContact CG1-CG2 3.93Å; I15-L62 HydrophobicContact CD1-CD2 3.81Å; I15-L62 HydrophobicContact CG1-CD2 4.45Å; I15-L70 HydrophobicContact CD1-CD1 3.9Å
16	L	91.9	Very high	90.9	Very high	98 Å²	98	65 Å²	65	51%	0.513	34%	0.335	S	S	.	.	H	α-helix	trans	-59.5	-43.6	178.6	-74.5	172.1	0	0	0	112.2	I12 V13 Q18 V19 R20	I12-L16 HydrophobicContact CG2-CD1 3.81Å; I12-L16 HydrophobicContact CG2-CG 4.25Å; I12-L16 WeakPolarHBondContact O-CB 3.44Å; I12-L16 WeakPolarHBondContact O-CG 3.39Å; I12-L16 PolarHBondContact O-N 2.83Å; V13-L16 PolarHBondContact O-N 3.31Å; L16-Q18 PolarHBondContact O-N 2.86Å; L16-V19 PolarHBondContact O-N 3.06Å; L16-R20 WeakPolarHBondContact O-CB 3.38Å; L16-R20 PolarHBondContact O-N 3.46Å
17	N	92.2	Very high	91.2	Very high	73 Å²	73	62 Å²	62	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-63.9	-40.4	177.7	-72.3	-23.5	0	0	0	112	V13 N14 I15 R20 S21	V13-N17 WeakPolarHBondContact O-CB 3.46Å; V13-N17 VanDerWaalsContact O-CG 3.27Å; V13-N17 PolarHBondContact O-N 3.41Å; V13-N17 PolarHBondContact O-ND2 2.67Å; N14-N17 PolarHBondContact O-N 3.03Å; I15-N17 PolarHBondContact O-N 3.29Å; N17-R20 PolarHBondContact O-N 3.29Å; N17-R20 PolarHBondContact OD1-NH1 2.92Å; N17-R20 VanDerWaalsContact OD1-NH1 3.07Å; N17-S21 PolarHBondContact O-N 3.36Å
18	Q	92.5	Very high	91.4	Very high	58 Å²	58	63.2 Å²	63.2	27%	0.271	33%	0.329	S	S	.	.	H	α-helix	trans	-68.2	-39.4	176	-66.7	-64.6	67.4	0	0	112.5	N14 I15 L16 R20 S21 I22 S57 V58 I61	N14-Q18 WeakPolarHBondContact O-CG 3.15Å; N14-Q18 PolarHBondContact O-N 3.09Å; N14-Q18 VanDerWaalsContact O-N 3.1Å; I15-Q18 PolarHBondContact O-N 2.69Å; L16-Q18 PolarHBondContact O-N 2.86Å; Q18-R20 VanDerWaalsContact C-N 3.33Å; Q18-R20 PolarHBondContact O-N 2.99Å; Q18-S21 PolarHBondContact O-N 3.42Å; Q18-I22 WeakPolarHBondContact O-CG1 3.49Å; Q18-I22 PolarHBondContact O-N 3.47Å; Q18-S57 PolarHBondContact NE2-OG 2.97Å; Q18-V58 HydrophobicContact CB-CG2 3.58Å; Q18-V58 HydrophobicContact CG-CG2 4.43Å; Q18-I61 HydrophobicContact CG-CD1 3.88Å
19	V	93.5	Very high	91.6	Very high	70 Å²	70	62.1 Å²	62.1	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-63.7	-39.7	174.8	172.3	0	0	0	0	111	I15 L16 I22 Q23	I15-V19 HydrophobicContact CG2-CG2 4.28Å; I15-V19 WeakPolarHBondContact O-CG2 3.39Å; I15-V19 PolarHBondContact O-N 3.39Å; L16-V19 PolarHBondContact O-N 3.06Å; V19-I22 WeakPolarHBondContact O-CB 3.12Å; V19-I22 PolarHBondContact O-N 2.95Å; V19-Q23 PolarHBondContact O-N 3.3Å
20	R	92.3	Very high	91.8	Very high	120 Å²	120	62.9 Å²	62.9	45%	0.453	33%	0.33	S	S	.	.	H	α-helix	trans	-61.8	-44.2	174.8	-169.6	-176.9	-66.6	120.5	-0.6	111.7	L16 N17 Q18 I22 Q23 E24	L16-R20 WeakPolarHBondContact O-CB 3.38Å; L16-R20 PolarHBondContact O-N 3.46Å; N17-R20 PolarHBondContact O-N 3.29Å; N17-R20 PolarHBondContact OD1-NH1 2.92Å; N17-R20 VanDerWaalsContact OD1-NH1 3.07Å; Q18-R20 VanDerWaalsContact C-N 3.33Å; Q18-R20 PolarHBondContact O-N 2.99Å; R20-I22 VanDerWaalsContact C-N 3.31Å; R20-I22 PolarHBondContact O-N 2.82Å; R20-Q23 WeakPolarHBondContact O-CB 3.39Å; R20-Q23 PolarHBondContact O-N 3.01Å; R20-Q23 VanDerWaalsContact O-N 3.1Å; R20-E24 WeakPolarHBondContact O-CG 3.5Å; R20-E24 PolarHBondContact O-N 3.29Å
21	S	93	Very high	91.8	Very high	36 Å²	36	62.3 Å²	62.3	25%	0.252	33%	0.333	S	S	.	.	H	α-helix	trans	-61	-38.8	176.2	-172.2	0	0	0	0	112.7	N17 Q18 S25 Q54	N17-S21 PolarHBondContact O-N 3.36Å; Q18-S21 PolarHBondContact O-N 3.42Å; S21-S25 WeakPolarHBondContact O-CB 3.35Å; S21-S25 PolarHBondContact O-N 3.5Å; S21-S25 PolarHBondContact O-OG 3.28Å; S21-Q54 PolarHBondContact O-NE2 3.19Å; S21-Q54 PolarHBondContact OG-NE2 3.14Å
22	I	95.6	Very high	91.7	Very high	14 Å²	14	64.2 Å²	64.2	7%	0.072	34%	0.341	C	S	.	.	H	α-helix	trans	-63.5	-44.4	172.6	-69.8	169.2	0	0	0	110.7	Q18 V19 R20 S25 L26 L51 Q54 F55 V58	Q18-I22 WeakPolarHBondContact O-CG1 3.49Å; Q18-I22 PolarHBondContact O-N 3.47Å; V19-I22 WeakPolarHBondContact O-CB 3.12Å; V19-I22 PolarHBondContact O-N 2.95Å; R20-I22 VanDerWaalsContact C-N 3.31Å; R20-I22 PolarHBondContact O-N 2.82Å; I22-S25 PolarHBondContact O-N 3.04Å; I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.35Å; I22-L26 WeakPolarHBondContact O-CB 3.46Å; I22-L26 WeakPolarHBondContact O-CG 3.39Å; I22-L26 PolarHBondContact O-N 2.82Å; I22-L51 HydrophobicContact CG2-CD1 3.93Å; I22-Q54 HydrophobicContact CD1-CB 4.24Å; I22-Q54 HydrophobicContact CG1-CB 3.61Å; I22-Q54 HydrophobicContact CG1-CG 4.49Å; I22-F55 HydrophobicContact CD1-CD1 4.1Å; I22-F55 HydrophobicContact CD1-CE1 4.21Å; I22-F55 HydrophobicContact CD1-CG 4.36Å; I22-F55 HydrophobicContact CG2-CE1 4.38Å; I22-F55 HydrophobicContact CG2-CE2 4.06Å; I22-F55 HydrophobicContact CG2-CZ 3.81Å; I22-V58 HydrophobicContact CD1-CG2 3.72Å
23	Q	93.6	Very high	91.7	Very high	48 Å²	48	65.4 Å²	65.4	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-47.4	178.4	-177.6	-176.4	-30.5	0	0	111.6	V19 R20 S25 L26 Q27 E93	V19-Q23 PolarHBondContact O-N 3.3Å; R20-Q23 WeakPolarHBondContact O-CB 3.39Å; R20-Q23 PolarHBondContact O-N 3.01Å; R20-Q23 VanDerWaalsContact O-N 3.1Å; Q23-S25 VanDerWaalsContact C-N 3.31Å; Q23-S25 PolarHBondContact O-N 2.94Å; Q23-L26 PolarHBondContact O-N 3.38Å; Q23-Q27 WeakPolarHBondContact O-CG 3.37Å; Q23-Q27 PolarHBondContact O-N 3.12Å; Q23-E93 VanDerWaalsContact NE2-CD 3.25Å; Q23-E93 PolarHBondContact NE2-OE1 3.22Å; Q23-E93 PolarHBondContact NE2-OE2 2.95Å; Q23-E93 VanDerWaalsContact NE2-OE2 3.17Å
24	E	92.6	Very high	91.5	Very high	109 Å²	109	65.7 Å²	65.7	51%	0.509	36%	0.358	S	S	.	.	H	α-helix	trans	-59.3	-42.6	176.5	-70.5	166.9	-173	0	0	111.5	R20 Q27 C28	R20-E24 WeakPolarHBondContact O-CG 3.5Å; R20-E24 PolarHBondContact O-N 3.29Å; E24-Q27 PolarHBondContact O-N 3.22Å; E24-C28 WeakPolarHBondContact O-CB 3.33Å; E24-C28 PolarHBondContact O-N 3.01Å
25	S	93.6	Very high	91.2	Very high	11 Å²	11	67.1 Å²	67.1	8%	0.077	37%	0.365	C	S	.	.	H	α-helix	trans	-66.9	-39.5	178.8	-55.9	0	0	0	0	111.9	S21 I22 Q23 C28 M29 Q54	S21-S25 WeakPolarHBondContact O-CB 3.35Å; S21-S25 PolarHBondContact O-N 3.5Å; S21-S25 PolarHBondContact O-OG 3.28Å; I22-S25 PolarHBondContact O-N 3.04Å; Q23-S25 VanDerWaalsContact C-N 3.31Å; Q23-S25 PolarHBondContact O-N 2.94Å; S25-C28 PolarHBondContact O-N 3.33Å; S25-M29 WeakPolarHBondContact O-CG 3.39Å; S25-M29 PolarHBondContact O-N 3.42Å; S25-Q54 PolarHBondContact OG-NE2 3.44Å; S25-Q54 PolarHBondContact OG-OE1 2.71Å
26	L	94.9	Very high	90.4	Very high	67 Å²	67	71.4 Å²	71.4	35%	0.351	40%	0.395	S	S	.	.	H	α-helix	trans	-65.1	-43.2	173.5	-76.6	172.9	0	0	0	112	I22 Q23 C28 M29 I30 L51	I22-L26 HydrophobicContact CG2-CD1 3.95Å; I22-L26 HydrophobicContact CG2-CG 4.35Å; I22-L26 WeakPolarHBondContact O-CB 3.46Å; I22-L26 WeakPolarHBondContact O-CG 3.39Å; I22-L26 PolarHBondContact O-N 2.82Å; Q23-L26 PolarHBondContact O-N 3.38Å; L26-C28 VanDerWaalsContact C-N 3.33Å; L26-C28 PolarHBondContact O-N 2.69Å; L26-M29 PolarHBondContact O-N 3.36Å; L26-I30 WeakPolarHBondContact O-CB 3.28Å; L26-I30 VanDerWaalsContact O-CG1 3.23Å; L26-I30 WeakPolarHBondContact O-CG1 3.37Å; L26-I30 PolarHBondContact O-N 2.93Å; L26-L51 HydrophobicContact CD2-CD1 4.15Å; L26-L51 HydrophobicContact CD2-CD2 3.67Å; L26-L51 HydrophobicContact CG-CD1 4.07Å; L26-L51 HydrophobicContact CG-CD2 4.49Å
27	Q	92.1	Very high	89.6	Confident	91 Å²	91	72.8 Å²	72.8	43%	0.425	40%	0.403	S	S	.	.	H	α-helix	trans	-59.8	-44.7	176.1	-74.7	174.4	-9.3	0	0	110.9	Q23 E24 I30 A31 E93	Q23-Q27 WeakPolarHBondContact O-CG 3.37Å; Q23-Q27 PolarHBondContact O-N 3.12Å; E24-Q27 PolarHBondContact O-N 3.22Å; Q27-I30 PolarHBondContact O-N 3.28Å; Q27-A31 WeakPolarHBondContact O-CB 3.46Å; Q27-A31 PolarHBondContact O-N 3.43Å; Q27-E93 PolarHBondContact NE2-OE2 3.45Å
28	C	88.9	Confident	88.5	Confident	69 Å²	69	78.8 Å²	78.8	47%	0.466	43%	0.429	S	S	.	.	H	α-helix	trans	-60.5	-46.3	175	-174.3	0	0	0	0	112.1	E24 S25 L26 I30 A31 M32	E24-C28 WeakPolarHBondContact O-CB 3.33Å; E24-C28 PolarHBondContact O-N 3.01Å; S25-C28 PolarHBondContact O-N 3.33Å; L26-C28 VanDerWaalsContact C-N 3.33Å; L26-C28 PolarHBondContact O-N 2.69Å; C28-I30 PolarHBondContact O-N 3.19Å; C28-A31 PolarHBondContact O-N 3.47Å; C28-M32 WeakPolarHBondContact O-CB 3.35Å; C28-M32 PolarHBondContact O-N 2.83Å
29	M	90.1	Very high	87.6	Confident	20 Å²	20	81.1 Å²	81.1	10%	0.099	44%	0.438	C	S	.	.	H	α-helix	trans	-63.2	-41.9	177.1	-75.7	-177.6	69.6	0	0	112.8	S25 L26 M32 L33 L44 N47 F48 L51	S25-M29 WeakPolarHBondContact O-CG 3.39Å; S25-M29 PolarHBondContact O-N 3.42Å; L26-M29 PolarHBondContact O-N 3.36Å; M29-M32 PolarHBondContact O-N 3.11Å; M29-L33 WeakPolarHBondContact O-CB 3.2Å; M29-L33 VanDerWaalsContact O-CG 3.28Å; M29-L33 WeakPolarHBondContact O-CG 3.3Å; M29-L33 PolarHBondContact O-N 2.88Å; M29-L44 HydrophobicContact CE-CD1 4.33Å; M29-N47 HydrophobicContact CG-CB 3.82Å; M29-N47 HydrophobicContact SD-CB 4.13Å; M29-F48 HydrophobicContact CE-CB 4.4Å; M29-F48 HydrophobicContact CE-CD2 4.38Å; M29-L51 HydrophobicContact SD-CB 4.22Å; M29-L51 HydrophobicContact SD-CD2 3.81Å
30	I	91.2	Very high	87.1	Confident	114 Å²	114	82.1 Å²	82.1	59%	0.585	44%	0.441	S	S	*	.	H	α-helix	trans	-63.2	-44.4	176.9	-70.1	165.3	0	0	0	110.1	L26 Q27 C28 M32 L33 A34	L26-I30 WeakPolarHBondContact O-CB 3.28Å; L26-I30 VanDerWaalsContact O-CG1 3.23Å; L26-I30 WeakPolarHBondContact O-CG1 3.37Å; L26-I30 PolarHBondContact O-N 2.93Å; Q27-I30 PolarHBondContact O-N 3.28Å; C28-I30 PolarHBondContact O-N 3.19Å; I30-M32 VanDerWaalsContact C-N 3.35Å; I30-M32 PolarHBondContact O-N 2.54Å; I30-L33 PolarHBondContact O-N 3.42Å; I30-A34 WeakPolarHBondContact O-CB 3.48Å; I30-A34 PolarHBondContact O-N 3.2Å
31	A	88.8	Confident	87	Confident	59 Å²	59	84.2 Å²	84.2	49%	0.488	45%	0.449	S	S	.	.	H	α-helix	trans	-60.2	-44.2	176.1	0	0	0	0	0	111.7	Q27 C28 L33 A34 L35	Q27-A31 WeakPolarHBondContact O-CB 3.46Å; Q27-A31 PolarHBondContact O-N 3.43Å; C28-A31 PolarHBondContact O-N 3.47Å; A31-L33 PolarHBondContact O-N 2.91Å; A31-A34 PolarHBondContact O-N 3.39Å; A31-L35 PolarHBondContact O-N 2.84Å
32	M	87.1	Confident	86.8	Confident	56 Å²	56	86.8 Å²	86.8	28%	0.276	46%	0.464	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.6	-176.8	176	-70	0	0	112.6	C28 M29 I30 A34 L35 T43 N47	C28-M32 WeakPolarHBondContact O-CB 3.35Å; C28-M32 PolarHBondContact O-N 2.83Å; M29-M32 PolarHBondContact O-N 3.11Å; I30-M32 VanDerWaalsContact C-N 3.35Å; I30-M32 PolarHBondContact O-N 2.54Å; M32-A34 VanDerWaalsContact C-N 3.31Å; M32-A34 PolarHBondContact O-N 3.26Å; M32-L35 PolarHBondContact O-N 3.1Å; M32-T43 HydrophobicContact CE-CG2 3.6Å; M32-T43 HydrophobicContact SD-CG2 4.01Å; M32-N47 WeakPolarHBondContact CE-ND2 3.26Å; M32-N47 PolarHBondContact SD-ND2 3.43Å
33	L	88.2	Confident	86.5	Confident	77 Å²	77	89.1 Å²	89.1	40%	0.403	48%	0.48	S	S	.	.	H	α-helix	trans	-72.4	-24.5	178.8	-74.6	172.5	0	0	0	113.7	M29 I30 A31 K39 L44	M29-L33 WeakPolarHBondContact O-CB 3.2Å; M29-L33 VanDerWaalsContact O-CG 3.28Å; M29-L33 WeakPolarHBondContact O-CG 3.3Å; M29-L33 PolarHBondContact O-N 2.88Å; I30-L33 PolarHBondContact O-N 3.42Å; A31-L33 PolarHBondContact O-N 2.91Å; L33-K39 HydrophobicContact CD2-CD 4.21Å; L33-K39 WeakPolarHBondContact O-CE 3.35Å; L33-K39 PolarHBondContact O-NZ 3.29Å; L33-L44 HydrophobicContact CD2-CD1 4.04Å; L33-L44 HydrophobicContact CD2-CD2 4.04Å; L33-L44 HydrophobicContact CG-CD1 4.37Å
34	A	88.4	Confident	86.3	Confident	79 Å²	79	87.9 Å²	87.9	65%	0.653	47%	0.474	S	S	*	.	H	α-helix	trans	-80.3	-18.9	178.1	0	0	0	0	0	113.3	I30 A31 M32	I30-A34 WeakPolarHBondContact O-CB 3.48Å; I30-A34 PolarHBondContact O-N 3.2Å; A31-A34 PolarHBondContact O-N 3.39Å; M32-A34 VanDerWaalsContact C-N 3.31Å; M32-A34 PolarHBondContact O-N 3.26Å
35	L	83.9	Confident	86.2	Confident	107 Å²	107	87.1 Å²	87.1	56%	0.56	47%	0.473	S	S	*	.			trans	-66.9	133.4	173.9	-68.5	171.3	0	0	0	110.1	A31 M32 D37	A31-L35 PolarHBondContact O-N 2.84Å; M32-L35 PolarHBondContact O-N 3.1Å; L35-D37 VanDerWaalsContact C-N 3.3Å; L35-D37 PolarHBondContact O-N 3Å
36	P	73.3	Confident	86.2	Confident	123 Å²	123	88.7 Å²	88.7	80%	0.799	49%	0.491	S	S	*	.			trans	-76.8	-13.6	-175.5	29.4	-34.2	0	0	0	114.1
37	D	76	Confident	86	Confident	127 Å²	127	86.8 Å²	86.8	68%	0.679	48%	0.481	S	S	*	.	S	Bend	trans	-74.9	160.7	-175.4	-65.8	-33.7	0	0	0	112.9	L35 K39	L35-D37 VanDerWaalsContact C-N 3.3Å; L35-D37 PolarHBondContact O-N 3Å; D37-K39 PolarHBondContact O-N 2.85Å
38	E	67.6	Low	86	Confident	200 Å²	200	88.4 Å²	88.4	94%	0.935	49%	0.487	S	S	*	.			trans	-49.2	110.1	178	-169.1	172.1	-175.5	0	0	110.4	D40	E38-D40 PolarHBondContact O-N 3Å
39	K	74	Confident	86.2	Confident	107 Å²	107	87.2 Å²	87.2	47%	0.465	49%	0.486	S	S	.	.			trans	-68.1	117.5	-174.5	-68.8	172.9	179.4	172	0	108.8	L33 D37 W41	L33-K39 HydrophobicContact CD2-CD 4.21Å; L33-K39 WeakPolarHBondContact O-CE 3.35Å; L33-K39 PolarHBondContact O-NZ 3.29Å; D37-K39 PolarHBondContact O-N 2.85Å; K39-W41 VanDerWaalsContact C-N 3.32Å; K39-W41 PolarHBondContact O-N 3.21Å
40	D	84.6	Confident	86.4	Confident	90 Å²	90	90.7 Å²	90.7	48%	0.481	50%	0.504	S	S	.	.			trans	-64.9	95.1	170.5	-176.2	47.3	0	0	0	109.4	E38 P42 T43 L44	E38-D40 PolarHBondContact O-N 3Å; D40-P42 WeakPolarHBondContact OD1-CD 3.42Å; D40-T43 PolarHBondContact O-N 3.45Å; D40-T43 VanDerWaalsContact O-N 3.1Å; D40-T43 WeakPolarHBondContact OD2-CB 3.23Å; D40-T43 PolarHBondContact OD2-N 2.98Å; D40-T43 PolarHBondContact OD2-OG1 2.93Å; D40-L44 PolarHBondContact O-N 2.82Å
41	W	88.6	Confident	86.6	Confident	165 Å²	165	86 Å²	86	63%	0.625	48%	0.479	S	S	*	.	H	α-helix	trans	-56.5	-41.5	-175.8	179.9	-107	0	0	0	113.3	K39 T43 L44 L45	K39-W41 VanDerWaalsContact C-N 3.32Å; K39-W41 PolarHBondContact O-N 3.21Å; W41-T43 PolarHBondContact O-N 3.2Å; W41-L44 HydrophobicContact CE3-CD2 3.88Å; W41-L44 HydrophobicContact CZ3-CD2 3.78Å; W41-L44 PolarHBondContact O-N 2.89Å; W41-L45 VanDerWaalsContact O-CB 3.3Å; W41-L45 WeakPolarHBondContact O-CB 3.47Å; W41-L45 PolarHBondContact O-N 3.38Å
42	P	90.4	Very high	86.8	Confident	89 Å²	89	85.7 Å²	85.7	58%	0.578	47%	0.474	S	S	*	.	H	α-helix	trans	-52.7	-47.5	170.9	-27.8	34.4	0	0	0	113.6	D40 L45 G46	D40-P42 WeakPolarHBondContact OD1-CD 3.42Å; P42-L45 PolarHBondContact O-N 3.2Å; P42-G46 PolarHBondContact O-N 2.97Å
43	T	88.1	Confident	87.2	Confident	64 Å²	64	85 Å²	85	39%	0.393	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-43.9	178	-64.9	0	0	0	0	111.6	M32 D40 W41 L45 G46 N47	M32-T43 HydrophobicContact CE-CG2 3.6Å; M32-T43 HydrophobicContact SD-CG2 4.01Å; D40-T43 PolarHBondContact O-N 3.45Å; D40-T43 VanDerWaalsContact O-N 3.1Å; D40-T43 WeakPolarHBondContact OD2-CB 3.23Å; D40-T43 PolarHBondContact OD2-N 2.98Å; D40-T43 PolarHBondContact OD2-OG1 2.93Å; W41-T43 PolarHBondContact O-N 3.2Å; T43-L45 VanDerWaalsContact C-N 3.33Å; T43-L45 PolarHBondContact O-N 3.34Å; T43-G46 PolarHBondContact O-N 3.35Å; T43-N47 PolarHBondContact O-N 3.43Å; T43-N47 PolarHBondContact O-ND2 3.37Å
44	L	89.7	Confident	87.5	Confident	22 Å²	22	82.5 Å²	82.5	12%	0.115	47%	0.467	C	S	.	.	H	α-helix	trans	-61.3	-42.1	177.2	-179.2	61	0	0	0	111.9	M29 L33 D40 W41 N47 F48	M29-L44 HydrophobicContact CE-CD1 4.33Å; L33-L44 HydrophobicContact CD2-CD1 4.04Å; L33-L44 HydrophobicContact CD2-CD2 4.04Å; L33-L44 HydrophobicContact CG-CD1 4.37Å; D40-L44 PolarHBondContact O-N 2.82Å; W41-L44 HydrophobicContact CE3-CD2 3.88Å; W41-L44 HydrophobicContact CZ3-CD2 3.78Å; W41-L44 PolarHBondContact O-N 2.89Å; L44-N47 PolarHBondContact O-N 2.86Å; L44-F48 PolarHBondContact O-N 3.47Å
45	L	91.1	Very high	87.8	Confident	92 Å²	92	83.5 Å²	83.5	48%	0.482	46%	0.457	S	S	.	.	H	α-helix	trans	-67.6	-38.9	177.3	-174.2	62.9	0	0	0	111.6	W41 P42 T43 F48 G49	W41-L45 VanDerWaalsContact O-CB 3.3Å; W41-L45 WeakPolarHBondContact O-CB 3.47Å; W41-L45 PolarHBondContact O-N 3.38Å; P42-L45 PolarHBondContact O-N 3.2Å; T43-L45 VanDerWaalsContact C-N 3.33Å; T43-L45 PolarHBondContact O-N 3.34Å; L45-F48 PolarHBondContact O-N 3.26Å; L45-G49 PolarHBondContact O-N 3.5Å
46	G	92.4	Very high	88.3	Confident	44 Å²	44	82.4 Å²	82.4	45%	0.454	45%	0.451	S	S	.	.	H	α-helix	trans	-58.5	-45.9	172.1	0	0	0	0	0	112.1	P42 T43 F48 G49 M50	P42-G46 PolarHBondContact O-N 2.97Å; T43-G46 PolarHBondContact O-N 3.35Å; G46-F48 PolarHBondContact O-N 3.23Å; G46-G49 PolarHBondContact O-N 3.49Å; G46-M50 PolarHBondContact O-N 2.79Å
47	N	91.4	Very high	89.2	Confident	28 Å²	28	78.3 Å²	78.3	15%	0.15	43%	0.426	C	S	.	.	H	α-helix	trans	-62.4	-40.7	175.3	-71.8	-30.1	0	0	0	112.3	M29 M32 T43 L44 M50 L51	M29-N47 HydrophobicContact CG-CB 3.82Å; M29-N47 HydrophobicContact SD-CB 4.13Å; M32-N47 WeakPolarHBondContact CE-ND2 3.26Å; M32-N47 PolarHBondContact SD-ND2 3.43Å; T43-N47 PolarHBondContact O-N 3.43Å; T43-N47 PolarHBondContact O-ND2 3.37Å; L44-N47 PolarHBondContact O-N 2.86Å; N47-M50 PolarHBondContact O-N 3.15Å; N47-L51 WeakPolarHBondContact O-CB 3.48Å; N47-L51 PolarHBondContact O-N 3.44Å
48	F	92.7	Very high	89.9	Confident	125 Å²	125	73.1 Å²	73.1	55%	0.548	40%	0.399	S	S	.	.	H	α-helix	trans	-64.4	-40.4	174.7	-172.2	-93	0	0	0	112.3	M29 L44 L45 G46 L51 S52	M29-F48 HydrophobicContact CE-CB 4.4Å; M29-F48 HydrophobicContact CE-CD2 4.38Å; L44-F48 PolarHBondContact O-N 3.47Å; L45-F48 PolarHBondContact O-N 3.26Å; G46-F48 PolarHBondContact O-N 3.23Å; F48-L51 PolarHBondContact O-N 3.09Å; F48-S52 WeakPolarHBondContact O-CB 3.45Å; F48-S52 PolarHBondContact O-N 3.27Å
49	G	93.5	Very high	91.1	Very high	43 Å²	43	66.9 Å²	66.9	44%	0.443	37%	0.371	S	S	.	.	H	α-helix	trans	-60.7	-44.6	174.2	0	0	0	0	0	112.3	L45 G46 S52 G53	L45-G49 PolarHBondContact O-N 3.5Å; G46-G49 PolarHBondContact O-N 3.49Å; G49-S52 PolarHBondContact O-N 3.45Å; G49-G53 PolarHBondContact O-N 3.41Å
50	M	92.9	Very high	91.8	Very high	94 Å²	94	68.4 Å²	68.4	46%	0.463	38%	0.38	S	S	.	.	H	α-helix	trans	-60.9	-47.9	175	-176.8	177.9	68.1	0	0	111.8	G46 N47 S52 G53 Q54	G46-M50 PolarHBondContact O-N 2.79Å; N47-M50 PolarHBondContact O-N 3.15Å; M50-S52 VanDerWaalsContact C-N 3.34Å; M50-S52 PolarHBondContact O-N 3.39Å; M50-G53 WeakPolarHBondContact O-CA 3.41Å; M50-G53 PolarHBondContact O-N 2.96Å; M50-G53 VanDerWaalsContact O-N 3.09Å; M50-Q54 WeakPolarHBondContact O-CG 3.5Å; M50-Q54 PolarHBondContact O-N 2.94Å
51	L	95.1	Very high	91.9	Very high	15 Å²	15	66.1 Å²	66.1	8%	0.079	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-45.2	177.9	-176.6	66.1	0	0	0	111.4	I22 L26 M29 N47 F48 G53 Q54 F55	I22-L51 HydrophobicContact CG2-CD1 3.93Å; L26-L51 HydrophobicContact CD2-CD1 4.15Å; L26-L51 HydrophobicContact CD2-CD2 3.67Å; L26-L51 HydrophobicContact CG-CD1 4.07Å; L26-L51 HydrophobicContact CG-CD2 4.49Å; M29-L51 HydrophobicContact SD-CB 4.22Å; M29-L51 HydrophobicContact SD-CD2 3.81Å; N47-L51 WeakPolarHBondContact O-CB 3.48Å; N47-L51 PolarHBondContact O-N 3.44Å; F48-L51 PolarHBondContact O-N 3.09Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.4Å; L51-Q54 PolarHBondContact O-N 3.37Å; L51-F55 HydrophobicContact CD1-CD2 4.09Å; L51-F55 HydrophobicContact CD1-CE2 3.68Å; L51-F55 HydrophobicContact CD2-CE2 4.21Å; L51-F55 HydrophobicContact CG-CD2 3.93Å; L51-F55 HydrophobicContact CG-CE2 3.73Å; L51-F55 VanDerWaalsContact O-CD2 3.27Å; L51-F55 WeakPolarHBondContact O-CD2 3.46Å; L51-F55 PolarHBondContact O-N 2.94Å
52	S	94.9	Very high	91.8	Very high	53 Å²	53	62.4 Å²	62.4	37%	0.371	36%	0.359	S	S	.	.	H	α-helix	trans	-58.4	-41.7	174.1	-177.6	0	0	0	0	111.8	F48 G49 M50 F55 N56	F48-S52 WeakPolarHBondContact O-CB 3.45Å; F48-S52 PolarHBondContact O-N 3.27Å; G49-S52 PolarHBondContact O-N 3.45Å; M50-S52 VanDerWaalsContact C-N 3.34Å; M50-S52 PolarHBondContact O-N 3.39Å; S52-F55 PolarHBondContact O-N 2.9Å; S52-N56 WeakPolarHBondContact O-CB 3.38Å; S52-N56 PolarHBondContact O-N 3.26Å; S52-N56 PolarHBondContact O-ND2 2.95Å
53	G	94.8	Very high	91.5	Very high	41 Å²	41	67.3 Å²	67.3	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-60.5	-45	174.1	0	0	0	0	0	113.1	G49 M50 L51 N56 S57	G49-G53 PolarHBondContact O-N 3.41Å; M50-G53 WeakPolarHBondContact O-CA 3.41Å; M50-G53 PolarHBondContact O-N 2.96Å; M50-G53 VanDerWaalsContact O-N 3.09Å; L51-G53 VanDerWaalsContact C-N 3.3Å; L51-G53 PolarHBondContact O-N 3.4Å; G53-N56 PolarHBondContact O-N 3.32Å; G53-S57 PolarHBondContact O-N 2.96Å
54	Q	94.8	Very high	91.2	Very high	25 Å²	25	66.7 Å²	66.7	12%	0.117	37%	0.365	C	S	.	.	H	α-helix	trans	-62.6	-45.1	177.3	-69.1	168	-29	0	0	112.1	S21 I22 S25 M50 L51 N56 S57 V58	S21-Q54 PolarHBondContact O-NE2 3.19Å; S21-Q54 PolarHBondContact OG-NE2 3.14Å; I22-Q54 HydrophobicContact CD1-CB 4.24Å; I22-Q54 HydrophobicContact CG1-CB 3.61Å; I22-Q54 HydrophobicContact CG1-CG 4.49Å; S25-Q54 PolarHBondContact OG-NE2 3.44Å; S25-Q54 PolarHBondContact OG-OE1 2.71Å; M50-Q54 WeakPolarHBondContact O-CG 3.5Å; M50-Q54 PolarHBondContact O-N 2.94Å; L51-Q54 PolarHBondContact O-N 3.37Å; Q54-N56 VanDerWaalsContact C-N 3.34Å; Q54-N56 PolarHBondContact O-N 3.41Å; Q54-S57 WeakPolarHBondContact O-CB 3.43Å; Q54-S57 PolarHBondContact O-N 3.5Å; Q54-V58 PolarHBondContact O-N 2.9Å
55	F	94.9	Very high	90.1	Very high	100 Å²	100	74.9 Å²	74.9	44%	0.439	40%	0.403	S	S	.	.	H	α-helix	trans	-60.4	-42.7	174.8	-85	-70.2	0	0	0	112.1	I22 L51 S52 S57 V58 L59	I22-F55 HydrophobicContact CD1-CD1 4.1Å; I22-F55 HydrophobicContact CD1-CE1 4.21Å; I22-F55 HydrophobicContact CD1-CG 4.36Å; I22-F55 HydrophobicContact CG2-CE1 4.38Å; I22-F55 HydrophobicContact CG2-CE2 4.06Å; I22-F55 HydrophobicContact CG2-CZ 3.81Å; L51-F55 HydrophobicContact CD1-CD2 4.09Å; L51-F55 HydrophobicContact CD1-CE2 3.68Å; L51-F55 HydrophobicContact CD2-CE2 4.21Å; L51-F55 HydrophobicContact CG-CD2 3.93Å; L51-F55 HydrophobicContact CG-CE2 3.73Å; L51-F55 VanDerWaalsContact O-CD2 3.27Å; L51-F55 WeakPolarHBondContact O-CD2 3.46Å; L51-F55 PolarHBondContact O-N 2.94Å; S52-F55 PolarHBondContact O-N 2.9Å; F55-S57 VanDerWaalsContact C-N 3.31Å; F55-S57 PolarHBondContact O-N 2.93Å; F55-V58 PolarHBondContact O-N 3.06Å; F55-L59 WeakPolarHBondContact O-CG 3.38Å; F55-L59 PolarHBondContact O-N 3.47Å
56	N	94	Very high	88.8	Confident	83 Å²	83	81.3 Å²	81.3	44%	0.444	42%	0.42	S	S	.	.	H	α-helix	trans	-62.1	-38.8	175.5	-81.7	-62.1	0	0	0	112.1	S52 G53 Q54 L59 Q60	S52-N56 WeakPolarHBondContact O-CB 3.38Å; S52-N56 PolarHBondContact O-N 3.26Å; S52-N56 PolarHBondContact O-ND2 2.95Å; G53-N56 PolarHBondContact O-N 3.32Å; Q54-N56 VanDerWaalsContact C-N 3.34Å; Q54-N56 PolarHBondContact O-N 3.41Å; N56-L59 PolarHBondContact O-N 3.42Å; N56-Q60 WeakPolarHBondContact O-CG 3.37Å; N56-Q60 PolarHBondContact O-N 3.28Å
57	S	91.9	Very high	87.4	Confident	37 Å²	37	80.1 Å²	80.1	26%	0.259	40%	0.404	S	S	.	.	H	α-helix	trans	-62	-45.2	174.6	-174.4	0	0	0	0	112.1	Q18 G53 Q54 F55 L59 Q60 I61	Q18-S57 PolarHBondContact NE2-OG 2.97Å; G53-S57 PolarHBondContact O-N 2.96Å; Q54-S57 WeakPolarHBondContact O-CB 3.43Å; Q54-S57 PolarHBondContact O-N 3.5Å; F55-S57 VanDerWaalsContact C-N 3.31Å; F55-S57 PolarHBondContact O-N 2.93Å; S57-L59 VanDerWaalsContact C-N 3.34Å; S57-L59 PolarHBondContact O-N 3.33Å; S57-Q60 PolarHBondContact O-N 3.45Å; S57-I61 WeakPolarHBondContact O-CG1 3.45Å; S57-I61 PolarHBondContact O-N 2.91Å
58	V	91.7	Very high	86	Confident	18 Å²	18	80.3 Å²	80.3	11%	0.109	41%	0.407	C	S	.	.	H	α-helix	trans	-59.9	-45.3	174.5	174.3	0	0	0	0	110.8	Q18 I22 Q54 F55 Q60 I61 L62	Q18-V58 HydrophobicContact CB-CG2 3.58Å; Q18-V58 HydrophobicContact CG-CG2 4.43Å; I22-V58 HydrophobicContact CD1-CG2 3.72Å; Q54-V58 PolarHBondContact O-N 2.9Å; F55-V58 PolarHBondContact O-N 3.06Å; V58-Q60 VanDerWaalsContact C-N 3.3Å; V58-Q60 PolarHBondContact O-N 3.14Å; V58-I61 PolarHBondContact O-N 3.37Å; V58-L62 HydrophobicContact CG1-CD1 3.85Å; V58-L62 HydrophobicContact CG1-CG 4.27Å; V58-L62 WeakPolarHBondContact O-CG 3.46Å; V58-L62 PolarHBondContact O-N 3.29Å
59	L	91.3	Very high	84.9	Confident	69 Å²	69	78.2 Å²	78.2	36%	0.361	40%	0.401	S	S	.	.	H	α-helix	trans	-60.7	-38	176.9	-72.2	171.9	0	0	0	112.4	F55 N56 S57 L62 R63	F55-L59 WeakPolarHBondContact O-CG 3.38Å; F55-L59 PolarHBondContact O-N 3.47Å; N56-L59 PolarHBondContact O-N 3.42Å; S57-L59 VanDerWaalsContact C-N 3.34Å; S57-L59 PolarHBondContact O-N 3.33Å; L59-L62 PolarHBondContact O-N 3.47Å; L59-R63 VanDerWaalsContact O-CB 3.29Å; L59-R63 WeakPolarHBondContact O-CB 3.36Å; L59-R63 WeakPolarHBondContact O-CG 3.45Å; L59-R63 PolarHBondContact O-N 2.99Å
60	Q	89.7	Confident	84.2	Confident	139 Å²	139	78.8 Å²	78.8	65%	0.65	39%	0.394	S	S	*	.	H	α-helix	trans	-65.3	-42.2	175.6	-76.4	-178.6	-15.9	0	0	112.1	N56 S57 V58 R63 S64	N56-Q60 WeakPolarHBondContact O-CG 3.37Å; N56-Q60 PolarHBondContact O-N 3.28Å; S57-Q60 PolarHBondContact O-N 3.45Å; V58-Q60 VanDerWaalsContact C-N 3.3Å; V58-Q60 PolarHBondContact O-N 3.14Å; Q60-R63 PolarHBondContact O-N 3.24Å; Q60-S64 WeakPolarHBondContact O-CB 3.37Å; Q60-S64 PolarHBondContact O-N 3.35Å
61	I	86.3	Confident	83.6	Confident	42 Å²	42	84.5 Å²	84.5	22%	0.215	41%	0.41	C	S	.	.	H	α-helix	trans	-61.5	-47.4	174.8	-65.3	166.9	0	0	0	110	T11 I15 Q18 S57 V58 R63 S64 T67	T11-I61 HydrophobicContact CG2-CG2 4.49Å; I15-I61 HydrophobicContact CD1-CG2 4.47Å; I15-I61 HydrophobicContact CG1-CG2 3.93Å; Q18-I61 HydrophobicContact CG-CD1 3.88Å; S57-I61 WeakPolarHBondContact O-CG1 3.45Å; S57-I61 PolarHBondContact O-N 2.91Å; V58-I61 PolarHBondContact O-N 3.37Å; I61-R63 VanDerWaalsContact C-N 3.3Å; I61-R63 PolarHBondContact O-N 2.9Å; I61-S64 WeakPolarHBondContact O-CB 3.4Å; I61-S64 PolarHBondContact O-N 3.07Å; I61-T67 PolarHBondContact O-OG1 2.92Å
62	L	85.6	Confident	83	Confident	87 Å²	87	88.9 Å²	88.9	46%	0.455	43%	0.433	S	S	.	.	H	α-helix	trans	-66.7	-29.6	-179.3	-66.9	176	0	0	0	113.4	I15 V58 L59 L70	I15-L62 HydrophobicContact CD1-CD2 3.81Å; I15-L62 HydrophobicContact CG1-CD2 4.45Å; V58-L62 HydrophobicContact CG1-CD1 3.85Å; V58-L62 HydrophobicContact CG1-CG 4.27Å; V58-L62 WeakPolarHBondContact O-CG 3.46Å; V58-L62 PolarHBondContact O-N 3.29Å; L59-L62 PolarHBondContact O-N 3.47Å; L62-L70 HydrophobicContact CD2-CD1 4.27Å
63	R	84.6	Confident	82.5	Confident	192 Å²	192	92.2 Å²	92.2	73%	0.725	44%	0.443	S	S	*	.	H	α-helix	trans	-85.2	-17.5	176.3	-73	174.1	178.4	162	1.1	113.8	L59 Q60 I61 E65	L59-R63 VanDerWaalsContact O-CB 3.29Å; L59-R63 WeakPolarHBondContact O-CB 3.36Å; L59-R63 WeakPolarHBondContact O-CG 3.45Å; L59-R63 PolarHBondContact O-N 2.99Å; Q60-R63 PolarHBondContact O-N 3.24Å; I61-R63 VanDerWaalsContact C-N 3.3Å; I61-R63 PolarHBondContact O-N 2.9Å; R63-E65 PolarHBondContact O-N 3.01Å
64	S	81.1	Confident	82.1	Confident	51 Å²	51	97.2 Å²	97.2	36%	0.357	46%	0.459	S	S	.	.			trans	-63	130.6	-177.9	-171.7	0	0	0	0	110.8	Q60 I61 R66 T67	Q60-S64 WeakPolarHBondContact O-CB 3.37Å; Q60-S64 PolarHBondContact O-N 3.35Å; I61-S64 WeakPolarHBondContact O-CB 3.4Å; I61-S64 PolarHBondContact O-N 3.07Å; S64-R66 PolarHBondContact O-N 3.32Å; S64-R66 VanDerWaalsContact O-N 3.15Å; S64-R66 PolarHBondContact OG-N 3.46Å; S64-T67 VanDerWaalsContact O-CB 3.3Å; S64-T67 WeakPolarHBondContact O-CB 3.41Å; S64-T67 PolarHBondContact O-N 2.9Å
65	E	67.5	Low	81.8	Confident	195 Å²	195	103 Å²	103	91%	0.911	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19	174.2	-63.4	-171.2	163	0	0	113.1	R63 T67	R63-E65 PolarHBondContact O-N 3.01Å; E65-T67 PolarHBondContact O-N 3.05Å
66	R	63.8	Low	81.6	Confident	227 Å²	227	104 Å²	104	86%	0.857	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.3	175.5	-66.7	-172.9	177	172.8	0.2	113.1	S64 P68	S64-R66 PolarHBondContact O-N 3.32Å; S64-R66 VanDerWaalsContact O-N 3.15Å; S64-R66 PolarHBondContact OG-N 3.46Å; R66-P68 WeakPolarHBondContact O-CD 3.28Å
67	T	63.6	Low	81.4	Confident	18 Å²	18	102.4 Å²	102.4	11%	0.11	49%	0.493	C	S	.	.	S	Bend	trans	-68.6	114.6	172	-68.5	0	0	0	0	107	T11 I61 S64 E65 L69 L70	T11-T67 HydrophobicContact CG2-CG2 3.78Å; I61-T67 PolarHBondContact O-OG1 2.92Å; S64-T67 VanDerWaalsContact O-CB 3.3Å; S64-T67 WeakPolarHBondContact O-CB 3.41Å; S64-T67 PolarHBondContact O-N 2.9Å; E65-T67 PolarHBondContact O-N 3.05Å; T67-L69 PolarHBondContact O-N 3.44Å; T67-L70 HydrophobicContact CG2-CD1 3.66Å; T67-L70 HydrophobicContact CG2-CG 3.67Å
68	P	62	Low	81.3	Confident	32 Å²	32	107.4 Å²	107.4	21%	0.208	52%	0.522	C	S	.	.			trans	-52.2	131.7	176.6	18.1	-25.1	0	0	0	106.8	F8 T11 R66 L70	F8-P68 VanDerWaalsContact CA-CG 3.42Å; F8-P68 HydrophobicContact CB-CB 4.32Å; F8-P68 HydrophobicContact CB-CG 3.75Å; F8-P68 HydrophobicContact CD2-CB 4.4Å; F8-P68 HydrophobicContact CD2-CG 3.98Å; F8-P68 HydrophobicContact CG-CG 4.36Å; T11-P68 VanDerWaalsContact OG1-CD 3.31Å; T11-P68 WeakPolarHBondContact OG1-CD 3.38Å; R66-P68 WeakPolarHBondContact O-CD 3.28Å; P68-L70 WeakPolarHBondContact O-CG 3.4Å; P68-L70 PolarHBondContact O-N 2.91Å
69	L	68.1	Low	81.2	Confident	82 Å²	82	115.1 Å²	115.1	43%	0.429	55%	0.549	S	S	.	.			trans	-47.5	83.2	-168.8	-67.4	139.9	0	0	0	111.1	T67 R71 N72	T67-L69 PolarHBondContact O-N 3.44Å; L69-R71 HydrophobicContact CB-CG 4.04Å; L69-R71 HydrophobicContact CD2-CG 3.99Å; L69-R71 PolarHBondContact O-N 3.18Å; L69-R71 VanDerWaalsContact O-N 3.1Å; L69-N72 HydrophobicContact CB-CB 4.04Å; L69-N72 WeakPolarHBondContact O-CA 3.39Å; L69-N72 WeakPolarHBondContact O-CB 3.43Å; L69-N72 PolarHBondContact O-N 2.94Å
70	L	80.1	Confident	81.2	Confident	55 Å²	55	114.6 Å²	114.6	29%	0.288	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-59.3	-29.3	-179.9	-64.1	178.8	0	0	0	108.3	F8 I15 L62 T67 P68 N72 Q73	F8-L70 HydrophobicContact CD2-CD2 3.78Å; F8-L70 HydrophobicContact CE2-CD2 3.44Å; F8-L70 VanDerWaalsContact CE2-CD2 3.44Å; I15-L70 HydrophobicContact CD1-CD1 3.9Å; L62-L70 HydrophobicContact CD2-CD1 4.27Å; T67-L70 HydrophobicContact CG2-CD1 3.66Å; T67-L70 HydrophobicContact CG2-CG 3.67Å; P68-L70 WeakPolarHBondContact O-CG 3.4Å; P68-L70 PolarHBondContact O-N 2.91Å; L70-N72 PolarHBondContact O-N 3.31Å; L70-Q73 PolarHBondContact O-N 2.98Å
71	R	79.6	Confident	81.2	Confident	214 Å²	214	109.5 Å²	109.5	81%	0.808	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-56.1	-24.3	170.3	71.3	177.4	-166.8	-157.2	-6.1	115.2	L69	L69-R71 HydrophobicContact CB-CG 4.04Å; L69-R71 HydrophobicContact CD2-CG 3.99Å; L69-R71 PolarHBondContact O-N 3.18Å; L69-R71 VanDerWaalsContact O-N 3.1Å
72	N	82.9	Confident	81.5	Confident	106 Å²	106	114.2 Å²	114.2	57%	0.567	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-95.5	-0.6	178.2	-66.5	3.4	0	0	0	112.4	L69 L70	L69-N72 HydrophobicContact CB-CB 4.04Å; L69-N72 WeakPolarHBondContact O-CA 3.39Å; L69-N72 WeakPolarHBondContact O-CB 3.43Å; L69-N72 PolarHBondContact O-N 2.94Å; L70-N72 PolarHBondContact O-N 3.31Å
73	Q	83.6	Confident	81.8	Confident	124 Å²	124	115.4 Å²	115.4	58%	0.579	56%	0.556	S	S	*	*			trans	-110.3	142.6	179.8	-63.3	-65.1	-20.4	0	0	109.5	F8 L70	F8-Q73 HydrophobicContact CE2-CB 4.39Å; F8-Q73 HydrophobicContact CE2-CG 3.91Å; F8-Q73 HydrophobicContact CZ-CG 4.38Å; L70-Q73 PolarHBondContact O-N 2.98Å
74	I	87.4	Confident	82.1	Confident	145 Å²	145	112 Å²	112	74%	0.744	55%	0.551	S	S	*	*			trans	-115.5	131.8	177.7	-61.3	171.4	0	0	0	107.7
75	L	87.8	Confident	82.7	Confident	147 Å²	147	112.8 Å²	112.8	77%	0.77	55%	0.551	S	S	*	*			trans	-87.2	119.7	171.5	-66.4	172.7	0	0	0	108.8
76	L	90.4	Very high	83.9	Confident	122 Å²	122	108.1 Å²	108.1	64%	0.639	54%	0.537	S	S	*	.			trans	-129.5	140	175.2	64.6	94.7	0	0	0	109.7	T78	L76-T78 PolarHBondContact O-N 3.34Å
77	P	90.9	Very high	85.2	Confident	49 Å²	49	103.8 Å²	103.8	32%	0.318	53%	0.527	S	S	.	.			trans	-69.9	126.5	174.8	29.9	-32.9	0	0	0	109.3	L80 V104 L108	P77-L80 HydrophobicContact CB-CD2 3.84Å; P77-L80 HydrophobicContact CG-CD2 4.33Å; P77-V104 HydrophobicContact CB-CG1 4.47Å; P77-V104 HydrophobicContact CG-CG1 4.08Å; P77-L108 HydrophobicContact CG-CD1 4.29Å
78	T	89.5	Confident	86.5	Confident	141 Å²	141	104.4 Å²	104.4	87%	0.865	53%	0.53	S	S	*	.	S	Bend	trans	-79.1	-37.4	-179.8	51.6	0	0	0	0	112.5	L76	L76-T78 PolarHBondContact O-N 3.34Å
79	R	89.7	Confident	88	Confident	181 Å²	181	105.9 Å²	105.9	68%	0.683	53%	0.534	S	S	*	.			trans	-143.8	140.2	177.7	-177.4	176.6	175.3	-172.8	-4.2	109.3
80	L	91.2	Very high	89.1	Confident	58 Å²	58	108 Å²	108	30%	0.304	55%	0.545	S	S	.	.			trans	-108.8	134.8	169.9	-59.2	179.3	0	0	0	107.8	P77 W99 H101 V104	P77-L80 HydrophobicContact CB-CD2 3.84Å; P77-L80 HydrophobicContact CG-CD2 4.33Å; L80-W99 WeakPolarHBondContact CA-O 3.36Å; L80-H101 WeakPolarHBondContact CD1-CE1 3.39Å; L80-H101 VanDerWaalsContact CD1-ND1 3.34Å; L80-H101 WeakPolarHBondContact CD1-ND1 3.43Å; L80-V104 HydrophobicContact CD2-CB 4.44Å; L80-V104 HydrophobicContact CD2-CG2 3.34Å
81	S	90.6	Very high	89.5	Confident	32 Å²	32	111 Å²	111	22%	0.224	56%	0.561	C	S	.	*			trans	-137.9	144.7	-179.6	-164.4	0	0	0	0	110.6	D83 W99	S81-D83 WeakPolarHBondContact OG-CB 3.36Å; S81-D83 PolarHBondContact OG-N 3.27Å; S81-D83 PolarHBondContact OG-OD2 3.42Å; S81-W99 PolarHBondContact N-O 2.89Å; S81-W99 CarbonylContact O-C 3.46Å
82	M	91.1	Very high	89.9	Confident	141 Å²	141	101.6 Å²	101.6	70%	0.695	53%	0.527	S	S	*	.			trans	-88.7	-15.2	168.5	-64.5	-62.3	-67.5	0	0	111.7	N100	M82-N100 HydrophobicContact SD-CB 3.59Å; M82-N100 VanDerWaalsContact SD-CB 3.59Å
83	D	92.7	Very high	90.1	Very high	112 Å²	112	101.3 Å²	101.3	60%	0.599	52%	0.523	S	S	*	.	S	Bend	trans	-66.3	141.4	-179.9	-57.2	-34.1	0	0	0	110.4	S81 D85 S98	S81-D83 WeakPolarHBondContact OG-CB 3.36Å; S81-D83 PolarHBondContact OG-N 3.27Å; S81-D83 PolarHBondContact OG-OD2 3.42Å; D83-D85 PolarHBondContact O-N 3.29Å; D83-S98 WeakPolarHBondContact O-CB 3.45Å
84	I	91.7	Very high	90.5	Very high	121 Å²	121	101.1 Å²	101.1	62%	0.621	53%	0.526	S	S	*	.			trans	-65.3	125.7	177.2	-61.3	172.7	0	0	0	108.5	S97	I84-S97 WeakPolarHBondContact CA-O 3.27Å
85	D	91.7	Very high	90.6	Very high	67 Å²	67	101.4 Å²	101.4	36%	0.358	52%	0.517	S	S	.	.			trans	-105.3	103.8	175.5	-177.3	-16.5	0	0	0	108.8	D83 E87 L88 E89 S97	D83-D85 PolarHBondContact O-N 3.29Å; D85-E87 PolarHBondContact O-N 3Å; D85-E87 WeakPolarHBondContact OD1-CB 3.5Å; D85-E87 PolarHBondContact OD1-N 3.22Å; D85-L88 HydrophobicContact CB-CB 3.79Å; D85-L88 HydrophobicContact CB-CD2 4.48Å; D85-L88 PolarHBondContact O-N 3.44Å; D85-L88 PolarHBondContact OD1-N 2.87Å; D85-E89 WeakPolarHBondContact O-CB 3.47Å; D85-E89 PolarHBondContact O-N 3Å; D85-S97 PolarHBondContact N-O 3.06Å
86	P	92.7	Very high	90.8	Very high	96 Å²	96	94.7 Å²	94.7	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-67.3	-24.5	-176.7	28.2	-35	0	0	0	112.8	N90	P86-N90 WeakPolarHBondContact O-CB 3.36Å; P86-N90 PolarHBondContact O-N 3.29Å; P86-N90 VanDerWaalsContact O-N 3.1Å
87	E	92.1	Very high	90.8	Very high	137 Å²	137	91.7 Å²	91.7	64%	0.64	47%	0.471	S	S	*	.	H	α-helix	trans	-72.3	-45.5	175.9	-174.4	178.6	179.9	0	0	110.1	D85 E89 N90 L91	D85-E87 PolarHBondContact O-N 3Å; D85-E87 WeakPolarHBondContact OD1-CB 3.5Å; D85-E87 PolarHBondContact OD1-N 3.22Å; E87-E89 VanDerWaalsContact C-N 3.34Å; E87-E89 PolarHBondContact O-N 3.46Å; E87-N90 PolarHBondContact O-N 3.47Å; E87-L91 HydrophobicContact CG-CD1 4.12Å; E87-L91 WeakPolarHBondContact O-CB 3.44Å; E87-L91 VanDerWaalsContact O-CG 3.3Å; E87-L91 WeakPolarHBondContact O-CG 3.33Å; E87-L91 PolarHBondContact O-N 2.85Å
88	L	91	Very high	90.9	Very high	31 Å²	31	89.6 Å²	89.6	16%	0.162	46%	0.458	C	S	.	.	H	α-helix	trans	-61.7	-42.7	174.7	-177.8	64.5	0	0	0	111.8	D85 L91 T92 I96 W99	D85-L88 HydrophobicContact CB-CB 3.79Å; D85-L88 HydrophobicContact CB-CD2 4.48Å; D85-L88 PolarHBondContact O-N 3.44Å; D85-L88 PolarHBondContact OD1-N 2.87Å; L88-L91 PolarHBondContact O-N 2.87Å; L88-T92 HydrophobicContact CD1-CG2 3.9Å; L88-T92 HydrophobicContact CG-CG2 4.41Å; L88-T92 WeakPolarHBondContact O-CB 3.23Å; L88-T92 VanDerWaalsContact O-CG2 3.28Å; L88-T92 WeakPolarHBondContact O-CG2 3.43Å; L88-T92 PolarHBondContact O-N 3.25Å; L88-T92 PolarHBondContact O-OG1 3.29Å; L88-I96 HydrophobicContact CD2-CB 4.34Å; L88-I96 HydrophobicContact CD2-CG2 3.71Å; L88-I96 HydrophobicContact CG-CB 4.34Å; L88-I96 HydrophobicContact CG-CG2 4.25Å; L88-W99 HydrophobicContact CD2-CB 3.99Å
89	E	92.5	Very high	91.1	Very high	63 Å²	63	85.9 Å²	85.9	29%	0.294	43%	0.428	S	S	.	.	H	α-helix	trans	-61.6	-45.6	178.8	-168.2	172.9	-158.6	0	0	110.9	D85 E87 T92 E93 N94 I96	D85-E89 WeakPolarHBondContact O-CB 3.47Å; D85-E89 PolarHBondContact O-N 3Å; E87-E89 VanDerWaalsContact C-N 3.34Å; E87-E89 PolarHBondContact O-N 3.46Å; E89-T92 PolarHBondContact O-N 2.85Å; E89-T92 PolarHBondContact O-OG1 2.85Å; E89-E93 PolarHBondContact O-N 3.41Å; E89-N94 HydrophobicContact CG-CB 4.24Å; E89-N94 WeakPolarHBondContact CG-OD1 3.46Å; E89-N94 PolarHBondContact O-N 3.22Å; E89-I96 VanDerWaalsContact CA-O 3.3Å; E89-I96 WeakPolarHBondContact CA-O 3.34Å
90	N	92.6	Very high	91.2	Very high	126 Å²	126	78.3 Å²	78.3	67%	0.674	40%	0.401	S	S	*	.	H	α-helix	trans	-64.1	-46.4	176.1	-172.6	32.8	0	0	0	112.4	P86 E87 T92 E93	P86-N90 WeakPolarHBondContact O-CB 3.36Å; P86-N90 PolarHBondContact O-N 3.29Å; P86-N90 VanDerWaalsContact O-N 3.1Å; E87-N90 PolarHBondContact O-N 3.47Å; N90-T92 PolarHBondContact O-N 3.38Å; N90-E93 PolarHBondContact O-N 2.95Å
91	L	88.1	Confident	91.3	Very high	117 Å²	117	82.2 Å²	82.2	61%	0.613	42%	0.418	S	S	*	.	H	α-helix	trans	-64.6	-28.1	179.8	-74.9	173.5	0	0	0	113.4	E87 L88	E87-L91 HydrophobicContact CG-CD1 4.12Å; E87-L91 WeakPolarHBondContact O-CB 3.44Å; E87-L91 VanDerWaalsContact O-CG 3.3Å; E87-L91 WeakPolarHBondContact O-CG 3.33Å; E87-L91 PolarHBondContact O-N 2.85Å; L88-L91 PolarHBondContact O-N 2.87Å
92	T	87.7	Confident	91.3	Very high	17 Å²	17	84.2 Å²	84.2	10%	0.104	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	8.6	-177.9	62.6	0	0	0	0	113.4	L88 E89 N90 N94 R95 I96	L88-T92 HydrophobicContact CD1-CG2 3.9Å; L88-T92 HydrophobicContact CG-CG2 4.41Å; L88-T92 WeakPolarHBondContact O-CB 3.23Å; L88-T92 VanDerWaalsContact O-CG2 3.28Å; L88-T92 WeakPolarHBondContact O-CG2 3.43Å; L88-T92 PolarHBondContact O-N 3.25Å; L88-T92 PolarHBondContact O-OG1 3.29Å; E89-T92 PolarHBondContact O-N 2.85Å; E89-T92 PolarHBondContact O-OG1 2.85Å; N90-T92 PolarHBondContact O-N 3.38Å; T92-N94 VanDerWaalsContact C-N 3.31Å; T92-N94 PolarHBondContact O-N 3.39Å; T92-R95 VanDerWaalsContact O-CB 3.26Å; T92-R95 WeakPolarHBondContact O-CB 3.48Å; T92-R95 VanDerWaalsContact O-CG 3.24Å; T92-R95 WeakPolarHBondContact O-CG 3.4Å; T92-R95 PolarHBondContact O-N 3.43Å; T92-R95 PolarHBondContact O-NE 2.98Å; T92-I96 HydrophobicContact CG2-CB 4.23Å; T92-I96 HydrophobicContact CG2-CD1 3.77Å; T92-I96 HydrophobicContact CG2-CG1 4.09Å; T92-I96 PolarHBondContact OG1-N 3.07Å; T92-I96 VanDerWaalsContact OG1-N 3.12Å; T92-I96 PolarHBondContact OG1-O 3.45Å
93	E	88.2	Confident	91.4	Very high	100 Å²	100	78.9 Å²	78.9	47%	0.467	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	44.9	-176.3	-64.6	166.9	-150	0	0	111.9	Q23 Q27 E89 N90 R95	Q23-E93 VanDerWaalsContact NE2-CD 3.25Å; Q23-E93 PolarHBondContact NE2-OE1 3.22Å; Q23-E93 PolarHBondContact NE2-OE2 2.95Å; Q23-E93 VanDerWaalsContact NE2-OE2 3.17Å; Q27-E93 PolarHBondContact NE2-OE2 3.45Å; E89-E93 PolarHBondContact O-N 3.41Å; N90-E93 PolarHBondContact O-N 2.95Å; E93-R95 PolarHBondContact O-N 3.42Å
94	N	90.3	Very high	91.4	Very high	120 Å²	120	74.3 Å²	74.3	64%	0.642	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	20.4	-177.8	-44.9	-70	0	0	0	114.6	E89 T92	E89-N94 HydrophobicContact CG-CB 4.24Å; E89-N94 WeakPolarHBondContact CG-OD1 3.46Å; E89-N94 PolarHBondContact O-N 3.22Å; T92-N94 VanDerWaalsContact C-N 3.31Å; T92-N94 PolarHBondContact O-N 3.39Å
95	R	89.7	Confident	91.4	Very high	151 Å²	151	72.3 Å²	72.3	57%	0.57	38%	0.383	S	S	*	.	S	Bend	trans	-80.6	-27.9	176.4	-68	-178.5	-69.6	-170.6	-5.3	113.2	T92 E93	T92-R95 VanDerWaalsContact O-CB 3.26Å; T92-R95 WeakPolarHBondContact O-CB 3.48Å; T92-R95 VanDerWaalsContact O-CG 3.24Å; T92-R95 WeakPolarHBondContact O-CG 3.4Å; T92-R95 PolarHBondContact O-N 3.43Å; T92-R95 PolarHBondContact O-NE 2.98Å; E93-R95 PolarHBondContact O-N 3.42Å
96	I	92.1	Very high	91.4	Very high	7 Å²	7	74.4 Å²	74.4	4%	0.036	39%	0.394	C	S	.	.			trans	-132	118.8	-180	-49.7	173	0	0	0	109.1	L88 E89 T92 S98 W99 V103 Y107	L88-I96 HydrophobicContact CD2-CB 4.34Å; L88-I96 HydrophobicContact CD2-CG2 3.71Å; L88-I96 HydrophobicContact CG-CB 4.34Å; L88-I96 HydrophobicContact CG-CG2 4.25Å; E89-I96 VanDerWaalsContact CA-O 3.3Å; E89-I96 WeakPolarHBondContact CA-O 3.34Å; T92-I96 HydrophobicContact CG2-CB 4.23Å; T92-I96 HydrophobicContact CG2-CD1 3.77Å; T92-I96 HydrophobicContact CG2-CG1 4.09Å; T92-I96 PolarHBondContact OG1-N 3.07Å; T92-I96 VanDerWaalsContact OG1-N 3.12Å; T92-I96 PolarHBondContact OG1-O 3.45Å; I96-S98 VanDerWaalsContact CG2-O 3.22Å; I96-S98 WeakPolarHBondContact CG2-O 3.48Å; I96-W99 HydrophobicContact CD1-CZ3 4.36Å; I96-V103 HydrophobicContact CD1-CG1 3.96Å; I96-V103 HydrophobicContact CG1-CG1 4.23Å; I96-V103 HydrophobicContact CG2-CG1 3.99Å; I96-V103 HydrophobicContact CG2-CG2 4.46Å; I96-Y107 HydrophobicContact CD1-CD1 4.01Å; I96-Y107 HydrophobicContact CD1-CD2 4Å; I96-Y107 HydrophobicContact CD1-CE1 3.44Å; I96-Y107 VanDerWaalsContact CD1-CE1 3.44Å; I96-Y107 HydrophobicContact CD1-CE2 3.43Å; I96-Y107 VanDerWaalsContact CD1-CE2 3.43Å; I96-Y107 HydrophobicContact CD1-CG 4.26Å; I96-Y107 VanDerWaalsContact CD1-OH 3.3Å; I96-Y107 WeakPolarHBondContact CD1-OH 3.39Å; I96-Y107 HydrophobicContact CG1-CE1 4.35Å; I96-Y107 HydrophobicContact CG1-CE2 3.88Å; I96-Y107 VanDerWaalsContact CG1-OH 3.26Å; I96-Y107 WeakPolarHBondContact CG1-OH 3.44Å
97	S	91.9	Very high	91.2	Very high	58 Å²	58	75.4 Å²	75.4	41%	0.406	39%	0.386	S	S	.	.	S	Bend	trans	-87.7	-27.5	174.5	56.2	0	0	0	0	113.3	I84 D85	I84-S97 WeakPolarHBondContact CA-O 3.27Å; D85-S97 PolarHBondContact N-O 3.06Å
98	S	92.5	Very high	91.3	Very high	6 Å²	6	72 Å²	72	4%	0.042	37%	0.371	C	S	.	.			trans	-149.6	147	178.1	70.5	0	0	0	0	113.1	D83 I96 N100	D83-S98 WeakPolarHBondContact O-CB 3.45Å; I96-S98 VanDerWaalsContact CG2-O 3.22Å; I96-S98 WeakPolarHBondContact CG2-O 3.48Å; S98-N100 PolarHBondContact O-N 3.33Å; S98-N100 VanDerWaalsContact O-N 3.13Å; S98-N100 PolarHBondContact O-ND2 3.42Å; S98-N100 PolarHBondContact OG-ND2 2.94Å
99	W	92.3	Very high	91.4	Very high	62 Å²	62	76.2 Å²	76.2	24%	0.235	39%	0.386	C	S	.	.			trans	-84.6	81.8	176	-165.4	-114.5	0	0	0	110.9	L80 S81 L88 I96 V103 V104 Y107 L108	L80-W99 WeakPolarHBondContact CA-O 3.36Å; S81-W99 PolarHBondContact N-O 2.89Å; S81-W99 CarbonylContact O-C 3.46Å; L88-W99 HydrophobicContact CD2-CB 3.99Å; I96-W99 HydrophobicContact CD1-CZ3 4.36Å; W99-V103 HydrophobicContact CE3-CG1 4.3Å; W99-V103 HydrophobicContact CZ3-CG1 4.18Å; W99-V104 HydrophobicContact CD2-CG2 3.84Å; W99-V104 VanDerWaalsContact CE2-CG2 3.42Å; W99-V104 HydrophobicContact CG-CG2 4.14Å; W99-V104 HydrophobicContact CZ2-CB 4.33Å; W99-V104 HydrophobicContact CZ2-CG1 4.33Å; W99-V104 HydrophobicContact CZ2-CG2 3.79Å; W99-Y107 HydrophobicContact CH2-CG 4.23Å; W99-Y107 HydrophobicContact CZ3-CD2 4.4Å; W99-Y107 HydrophobicContact CZ3-CG 4.01Å; W99-L108 HydrophobicContact CZ2-CD1 4.46Å; W99-L108 HydrophobicContact CZ2-CD2 4.43Å; W99-L108 HydrophobicContact CZ2-CG 4.24Å
100	N	92.6	Very high	91.3	Very high	22 Å²	22	79.9 Å²	79.9	12%	0.118	41%	0.412	C	S	.	.			trans	-113.1	172.6	-172.1	66.4	50.6	0	0	0	113.6	M82 S98 A102 V103 V104	M82-N100 HydrophobicContact SD-CB 3.59Å; M82-N100 VanDerWaalsContact SD-CB 3.59Å; S98-N100 PolarHBondContact O-N 3.33Å; S98-N100 VanDerWaalsContact O-N 3.13Å; S98-N100 PolarHBondContact O-ND2 3.42Å; S98-N100 PolarHBondContact OG-ND2 2.94Å; N100-A102 PolarHBondContact O-N 3.43Å; N100-A102 VanDerWaalsContact O-N 3.13Å; N100-A102 WeakPolarHBondContact OD1-CA 3.33Å; N100-A102 WeakPolarHBondContact OD1-CB 3.32Å; N100-A102 PolarHBondContact OD1-N 2.96Å; N100-V103 PolarHBondContact O-N 3.1Å; N100-V103 VanDerWaalsContact O-N 3.15Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.22Å; N100-V103 PolarHBondContact OD1-N 2.93Å; N100-V103 VanDerWaalsContact OD1-N 3.1Å; N100-V104 WeakPolarHBondContact O-CG2 3.49Å; N100-V104 PolarHBondContact O-N 3.25Å; N100-V104 VanDerWaalsContact O-N 3.09Å
101	H	92.7	Very high	91.3	Very high	140 Å²	140	79.2 Å²	79.2	65%	0.648	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-20.7	-178.5	-65.5	-83	0	0	0	115.1	L80 P105	L80-H101 WeakPolarHBondContact CD1-CE1 3.39Å; L80-H101 VanDerWaalsContact CD1-ND1 3.34Å; L80-H101 WeakPolarHBondContact CD1-ND1 3.43Å; H101-P105 WeakPolarHBondContact O-CD 3.29Å
102	A	91.5	Very high	91.4	Very high	74 Å²	74	76.9 Å²	76.9	61%	0.612	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-32.5	178.1	0	0	0	0	0	112.2	N100 N106	N100-A102 PolarHBondContact O-N 3.43Å; N100-A102 VanDerWaalsContact O-N 3.13Å; N100-A102 WeakPolarHBondContact OD1-CA 3.33Å; N100-A102 WeakPolarHBondContact OD1-CB 3.32Å; N100-A102 PolarHBondContact OD1-N 2.96Å; A102-N106 PolarHBondContact O-ND2 3.1Å
103	V	92.5	Very high	91.7	Very high	29 Å²	29	81.1 Å²	81.1	18%	0.176	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-41.2	-175.6	177.6	0	0	0	0	111.6	I96 W99 N100 N106 Y107	I96-V103 HydrophobicContact CD1-CG1 3.96Å; I96-V103 HydrophobicContact CG1-CG1 4.23Å; I96-V103 HydrophobicContact CG2-CG1 3.99Å; I96-V103 HydrophobicContact CG2-CG2 4.46Å; W99-V103 HydrophobicContact CE3-CG1 4.3Å; W99-V103 HydrophobicContact CZ3-CG1 4.18Å; N100-V103 PolarHBondContact O-N 3.1Å; N100-V103 VanDerWaalsContact O-N 3.15Å; N100-V103 WeakPolarHBondContact OD1-CG2 3.22Å; N100-V103 PolarHBondContact OD1-N 2.93Å; N100-V103 VanDerWaalsContact OD1-N 3.1Å; V103-N106 WeakPolarHBondContact O-CB 3.49Å; V103-N106 PolarHBondContact O-N 3.39Å; V103-Y107 HydrophobicContact CG1-CD2 3.29Å; V103-Y107 HydrophobicContact CG1-CE2 3.44Å; V103-Y107 VanDerWaalsContact CG1-CE2 3.44Å; V103-Y107 HydrophobicContact CG1-CG 4.31Å; V103-Y107 PolarHBondContact O-N 2.91Å
104	V	92.2	Very high	91.9	Very high	16 Å²	16	79.2 Å²	79.2	10%	0.097	41%	0.41	C	S	.	.	H	α-helix	trans	-52.8	-46.5	-174.2	172.3	0	0	0	0	114	P77 L80 W99 N100 N106 Y107 L108	P77-V104 HydrophobicContact CB-CG1 4.47Å; P77-V104 HydrophobicContact CG-CG1 4.08Å; L80-V104 HydrophobicContact CD2-CB 4.44Å; L80-V104 HydrophobicContact CD2-CG2 3.34Å; W99-V104 HydrophobicContact CD2-CG2 3.84Å; W99-V104 VanDerWaalsContact CE2-CG2 3.42Å; W99-V104 HydrophobicContact CG-CG2 4.14Å; W99-V104 HydrophobicContact CZ2-CB 4.33Å; W99-V104 HydrophobicContact CZ2-CG1 4.33Å; W99-V104 HydrophobicContact CZ2-CG2 3.79Å; N100-V104 WeakPolarHBondContact O-CG2 3.49Å; N100-V104 PolarHBondContact O-N 3.25Å; N100-V104 VanDerWaalsContact O-N 3.09Å; V104-N106 PolarHBondContact O-N 3.39Å; V104-Y107 PolarHBondContact O-N 3.5Å; V104-L108 HydrophobicContact CG1-CD1 3.66Å; V104-L108 HydrophobicContact CG1-CG 4.2Å; V104-L108 WeakPolarHBondContact O-CB 3.4Å; V104-L108 PolarHBondContact O-N 3.35Å
105	P	91.9	Very high	92.1	Very high	80 Å²	80	79.1 Å²	79.1	52%	0.519	41%	0.406	S	S	.	.	H	α-helix	trans	-61.4	-29.9	-180	-23.9	35.5	0	0	0	113.4	H101 R109	H101-P105 WeakPolarHBondContact O-CD 3.29Å; P105-R109 WeakPolarHBondContact O-CB 3.48Å; P105-R109 PolarHBondContact O-N 2.91Å
106	N	91.4	Very high	92.3	Very high	110 Å²	110	76.7 Å²	76.7	59%	0.588	40%	0.403	S	S	*	.	H	α-helix	trans	-77.5	-42.6	-179.7	-66.1	-41.8	0	0	0	111.6	A102 V103 V104 R109	A102-N106 PolarHBondContact O-ND2 3.1Å; V103-N106 WeakPolarHBondContact O-CB 3.49Å; V103-N106 PolarHBondContact O-N 3.39Å; V104-N106 PolarHBondContact O-N 3.39Å; N106-R109 WeakPolarHBondContact O-CB 3.31Å
107	Y	90.4	Very high	92.4	Very high	117 Å²	117	80.4 Å²	80.4	46%	0.459	42%	0.421	S	S	.	.	H	α-helix	trans	-80.5	-25.2	-178.1	-80.1	-97.4	0	0	0	113.8	I96 W99 V103 V104	I96-Y107 HydrophobicContact CD1-CD1 4.01Å; I96-Y107 HydrophobicContact CD1-CD2 4Å; I96-Y107 HydrophobicContact CD1-CE1 3.44Å; I96-Y107 VanDerWaalsContact CD1-CE1 3.44Å; I96-Y107 HydrophobicContact CD1-CE2 3.43Å; I96-Y107 VanDerWaalsContact CD1-CE2 3.43Å; I96-Y107 HydrophobicContact CD1-CG 4.26Å; I96-Y107 VanDerWaalsContact CD1-OH 3.3Å; I96-Y107 WeakPolarHBondContact CD1-OH 3.39Å; I96-Y107 HydrophobicContact CG1-CE1 4.35Å; I96-Y107 HydrophobicContact CG1-CE2 3.88Å; I96-Y107 VanDerWaalsContact CG1-OH 3.26Å; I96-Y107 WeakPolarHBondContact CG1-OH 3.44Å; W99-Y107 HydrophobicContact CH2-CG 4.23Å; W99-Y107 HydrophobicContact CZ3-CD2 4.4Å; W99-Y107 HydrophobicContact CZ3-CG 4.01Å; V103-Y107 HydrophobicContact CG1-CD2 3.29Å; V103-Y107 HydrophobicContact CG1-CE2 3.44Å; V103-Y107 VanDerWaalsContact CG1-CE2 3.44Å; V103-Y107 HydrophobicContact CG1-CG 4.31Å; V103-Y107 PolarHBondContact O-N 2.91Å; V104-Y107 PolarHBondContact O-N 3.5Å
108	L	92.8	Very high	92.5	Very high	65 Å²	65	83.6 Å²	83.6	34%	0.34	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	9.4	172.9	-59.7	-175.3	0	0	0	112.9	P77 W99 V104 T110	P77-L108 HydrophobicContact CG-CD1 4.29Å; W99-L108 HydrophobicContact CZ2-CD1 4.46Å; W99-L108 HydrophobicContact CZ2-CD2 4.43Å; W99-L108 HydrophobicContact CZ2-CG 4.24Å; V104-L108 HydrophobicContact CG1-CD1 3.66Å; V104-L108 HydrophobicContact CG1-CG 4.2Å; V104-L108 WeakPolarHBondContact O-CB 3.4Å; V104-L108 PolarHBondContact O-N 3.35Å; L108-T110 PolarHBondContact O-N 3.49Å
109	R	92.8	Very high	92.7	Very high	121 Å²	121	90.1 Å²	90.1	46%	0.457	46%	0.457	S	S	.	.			trans	-64	123.1	-179.7	-177.5	173.8	169.8	156.6	-4.8	110.7	P105 N106 K111	P105-R109 WeakPolarHBondContact O-CB 3.48Å; P105-R109 PolarHBondContact O-N 2.91Å; N106-R109 WeakPolarHBondContact O-CB 3.31Å; R109-K111 HydrophobicContact CG-CB 4.23Å; R109-K111 PolarHBondContact NE-O 3.05Å
110	T	92	Very high	92.7	Very high	140 Å²	140	91.4 Å²	91.4	86%	0.859	47%	0.468	S	S	*	.			trans	-100.6	-10.7	172.5	57.1	0	0	0	0	113.2	L108 P112	L108-T110 PolarHBondContact O-N 3.49Å; T110-P112 WeakPolarHBondContact O-CD 3.44Å
111	K	92.1	Very high	92.8	Very high	111 Å²	111	96 Å²	96	48%	0.483	49%	0.489	S	S	.	.	S	Bend	trans	-72.3	122.7	179	-174.7	173.8	-179.7	172.7	0	110.3	R109 E117	R109-K111 HydrophobicContact CG-CB 4.23Å; R109-K111 PolarHBondContact NE-O 3.05Å; K111-E117 WeakPolarHBondContact CE-OE1 3.33Å; K111-E117 WeakPolarHBondContact CE-OE2 3.26Å; K111-E117 IonicContact NZ-OE1 3.91Å; K111-E117 PolarHBondContact NZ-OE1 3.24Å; K111-E117 IonicContact NZ-OE2 3.18Å; K111-E117 PolarHBondContact NZ-OE2 3.38Å
112	P	90.7	Very high	92.9	Very high	69 Å²	69	94.7 Å²	94.7	45%	0.448	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-56.1	165	175.5	-24.1	33.8	0	0	0	113.5	T110 I116	T110-P112 WeakPolarHBondContact O-CD 3.44Å; P112-I116 HydrophobicContact CB-CB 4.3Å; P112-I116 HydrophobicContact CB-CG2 4.27Å
113	E	92.6	Very high	93	Very high	105 Å²	105	95.2 Å²	95.2	49%	0.491	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-64.5	145.7	171.7	-71.4	-57.6	140.7	0	0	111.3	Q115 I116 E117	E113-Q115 PolarHBondContact O-N 3.28Å; E113-Q115 VanDerWaalsContact O-N 3.13Å; E113-I116 HydrophobicContact CB-CD1 4.01Å; E113-I116 HydrophobicContact CB-CG1 4.18Å; E113-I116 WeakPolarHBondContact O-CA 3.37Å; E113-I116 WeakPolarHBondContact O-CB 3.49Å; E113-I116 PolarHBondContact O-N 3.04Å; E113-E117 PolarHBondContact O-N 2.94Å
114	P	93.6	Very high	92.9	Very high	60 Å²	60	98.6 Å²	98.6	39%	0.39	49%	0.492	S	S	.	.	H	α-helix	trans	-54.6	-36.2	-175.9	-26.9	34.8	0	0	0	114.1	I116 E117 Q118	P114-I116 VanDerWaalsContact C-N 3.31Å; P114-I116 PolarHBondContact O-N 3.2Å; P114-E117 PolarHBondContact O-N 3.21Å; P114-Q118 WeakPolarHBondContact O-CB 3.45Å; P114-Q118 VanDerWaalsContact O-CG 3.31Å; P114-Q118 WeakPolarHBondContact O-CG 3.31Å; P114-Q118 PolarHBondContact O-N 3.37Å
115	Q	94.4	Very high	92.9	Very high	119 Å²	119	100.4 Å²	100.4	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-69.2	-30.4	178.4	-58.6	83	-5.4	0	0	111.9	E113 K119	E113-Q115 PolarHBondContact O-N 3.28Å; E113-Q115 VanDerWaalsContact O-N 3.13Å; Q115-K119 WeakPolarHBondContact O-CG 3.32Å; Q115-K119 PolarHBondContact O-N 3.02Å
116	I	93.5	Very high	92.7	Very high	99 Å²	99	101.6 Å²	101.6	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-76.5	-44.3	176	-57.5	173.5	0	0	0	109.3	P112 E113 P114 Q118 K119 D120	P112-I116 HydrophobicContact CB-CB 4.3Å; P112-I116 HydrophobicContact CB-CG2 4.27Å; E113-I116 HydrophobicContact CB-CD1 4.01Å; E113-I116 HydrophobicContact CB-CG1 4.18Å; E113-I116 WeakPolarHBondContact O-CA 3.37Å; E113-I116 WeakPolarHBondContact O-CB 3.49Å; E113-I116 PolarHBondContact O-N 3.04Å; P114-I116 VanDerWaalsContact C-N 3.31Å; P114-I116 PolarHBondContact O-N 3.2Å; I116-Q118 VanDerWaalsContact C-N 3.32Å; I116-Q118 PolarHBondContact O-N 3.45Å; I116-K119 PolarHBondContact O-N 2.94Å; I116-K119 VanDerWaalsContact O-N 3.14Å; I116-D120 WeakPolarHBondContact O-CB 3.3Å; I116-D120 PolarHBondContact O-N 3.17Å
117	E	93.7	Very high	92.5	Very high	86 Å²	86	99.5 Å²	99.5	40%	0.402	49%	0.493	S	S	.	.	H	α-helix	trans	-57.5	-43.3	175.6	-174.4	176.3	-164.4	0	0	111.5	K111 E113 P114 D120 Q121	K111-E117 WeakPolarHBondContact CE-OE1 3.33Å; K111-E117 WeakPolarHBondContact CE-OE2 3.26Å; K111-E117 IonicContact NZ-OE1 3.91Å; K111-E117 PolarHBondContact NZ-OE1 3.24Å; K111-E117 IonicContact NZ-OE2 3.18Å; K111-E117 PolarHBondContact NZ-OE2 3.38Å; E113-E117 PolarHBondContact O-N 2.94Å; P114-E117 PolarHBondContact O-N 3.21Å; E117-D120 PolarHBondContact O-N 2.69Å; E117-Q121 WeakPolarHBondContact O-CB 3.3Å; E117-Q121 PolarHBondContact O-N 3.44Å
118	Q	95.3	Very high	92.3	Very high	125 Å²	125	101.4 Å²	101.4	58%	0.584	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-42	174.9	-75.5	177.4	-0	0	0	113	P114 I116 Q121 Q122	P114-Q118 WeakPolarHBondContact O-CB 3.45Å; P114-Q118 VanDerWaalsContact O-CG 3.31Å; P114-Q118 WeakPolarHBondContact O-CG 3.31Å; P114-Q118 PolarHBondContact O-N 3.37Å; I116-Q118 VanDerWaalsContact C-N 3.32Å; I116-Q118 PolarHBondContact O-N 3.45Å; Q118-Q121 PolarHBondContact O-N 3.45Å; Q118-Q122 VanDerWaalsContact O-CG 3.32Å; Q118-Q122 WeakPolarHBondContact O-CG 3.24Å; Q118-Q122 PolarHBondContact O-N 2.92Å
119	K	94.9	Very high	91.9	Very high	143 Å²	143	105 Å²	105	62%	0.622	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-42.5	176.6	-76.4	176.1	-179	176.9	0	111.3	Q115 I116 Q122 V123	Q115-K119 WeakPolarHBondContact O-CG 3.32Å; Q115-K119 PolarHBondContact O-N 3.02Å; I116-K119 PolarHBondContact O-N 2.94Å; I116-K119 VanDerWaalsContact O-N 3.14Å; K119-Q122 WeakPolarHBondContact O-CB 3.46Å; K119-Q122 PolarHBondContact O-N 3.34Å; K119-V123 WeakPolarHBondContact O-CG2 3.46Å; K119-V123 PolarHBondContact O-N 3.45Å
120	D	93.8	Very high	91.3	Very high	89 Å²	89	108.8 Å²	108.8	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-44.5	177.4	-166.3	52.6	0	0	0	111.1	I116 E117 Q122 V123 H124	I116-D120 WeakPolarHBondContact O-CB 3.3Å; I116-D120 PolarHBondContact O-N 3.17Å; E117-D120 PolarHBondContact O-N 2.69Å; D120-Q122 VanDerWaalsContact C-N 3.34Å; D120-Q122 PolarHBondContact O-N 2.92Å; D120-V123 PolarHBondContact O-N 3.06Å; D120-V123 VanDerWaalsContact O-N 3.16Å; D120-H124 PolarHBondContact O-CD2 3.35Å; D120-H124 PolarHBondContact O-N 3.39Å; D120-H124 IonicContact OD1-CD2 3.48Å; D120-H124 IonicContact OD1-NE2 3.37Å; D120-H124 IonicContact OD2-CD2 2.99Å; D120-H124 PolarHBondContact OD2-CD2 2.89Å; D120-H124 IonicContact OD2-NE2 3.79Å; D120-H124 PolarHBondContact OD2-NE2 2.98Å
121	Q	94	Very high	90.5	Very high	117 Å²	117	106.5 Å²	106.5	55%	0.547	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-40.9	174.4	-172.1	62.1	35	0	0	112.5	E117 Q118 H124 V125	E117-Q121 WeakPolarHBondContact O-CB 3.3Å; E117-Q121 PolarHBondContact O-N 3.44Å; Q118-Q121 PolarHBondContact O-N 3.45Å; Q121-H124 PolarHBondContact O-N 3.36Å; Q121-V125 WeakPolarHBondContact O-CG2 3.42Å; Q121-V125 PolarHBondContact O-N 3.12Å
122	Q	94.4	Very high	89.5	Confident	114 Å²	114	106.8 Å²	106.8	53%	0.533	53%	0.531	S	S	.	.	H	α-helix	trans	-61.8	-45	174.8	-72.9	171.6	35	0	0	111.4	Q118 K119 D120 V125 H126	Q118-Q122 VanDerWaalsContact O-CG 3.32Å; Q118-Q122 WeakPolarHBondContact O-CG 3.24Å; Q118-Q122 PolarHBondContact O-N 2.92Å; K119-Q122 WeakPolarHBondContact O-CB 3.46Å; K119-Q122 PolarHBondContact O-N 3.34Å; D120-Q122 VanDerWaalsContact C-N 3.34Å; D120-Q122 PolarHBondContact O-N 2.92Å; Q122-V125 PolarHBondContact O-N 3.31Å; Q122-H126 PolarHBondContact O-CD2 3.41Å; Q122-H126 PolarHBondContact O-N 3.42Å
123	V	92.8	Very high	89	Confident	84 Å²	84	107 Å²	107	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-60.7	-46	175.8	173	0	0	0	0	110.6	K119 D120 V125 H126 V127	K119-V123 WeakPolarHBondContact O-CG2 3.46Å; K119-V123 PolarHBondContact O-N 3.45Å; D120-V123 PolarHBondContact O-N 3.06Å; D120-V123 VanDerWaalsContact O-N 3.16Å; V123-V125 PolarHBondContact O-N 3.2Å; V123-H126 PolarHBondContact O-N 2.94Å; V123-V127 HydrophobicContact CG1-CG2 4.27Å; V123-V127 VanDerWaalsContact O-CG2 3.29Å; V123-V127 WeakPolarHBondContact O-CG2 3.39Å; V123-V127 PolarHBondContact O-N 3.42Å
124	H	91.1	Very high	88.6	Confident	101 Å²	101	105.9 Å²	105.9	47%	0.468	53%	0.531	S	S	.	.	H	α-helix	trans	-58.3	-45	177	-82.2	-61.9	0	0	0	112.9	D120 Q121 V127 Q128	D120-H124 PolarHBondContact O-CD2 3.35Å; D120-H124 PolarHBondContact O-N 3.39Å; D120-H124 IonicContact OD1-CD2 3.48Å; D120-H124 IonicContact OD1-NE2 3.37Å; D120-H124 IonicContact OD2-CD2 2.99Å; D120-H124 PolarHBondContact OD2-CD2 2.89Å; D120-H124 IonicContact OD2-NE2 3.79Å; D120-H124 PolarHBondContact OD2-NE2 2.98Å; Q121-H124 PolarHBondContact O-N 3.36Å; H124-V127 PolarHBondContact O-N 3.33Å; H124-Q128 WeakPolarHBondContact O-CB 3.45Å; H124-Q128 PolarHBondContact O-N 2.73Å
125	V	91.8	Very high	88.2	Confident	54 Å²	54	108.5 Å²	108.5	33%	0.327	54%	0.541	S	S	.	.	H	α-helix	trans	-62.7	-45	176.1	171	0	0	0	0	111.1	Q121 Q122 V123 V127 Q128 Q129	Q121-V125 WeakPolarHBondContact O-CG2 3.42Å; Q121-V125 PolarHBondContact O-N 3.12Å; Q122-V125 PolarHBondContact O-N 3.31Å; V123-V125 PolarHBondContact O-N 3.2Å; V125-V127 VanDerWaalsContact C-N 3.35Å; V125-V127 PolarHBondContact O-N 2.97Å; V125-Q128 PolarHBondContact O-N 2.9Å; V125-Q129 HydrophobicContact CG1-CG 4.48Å; V125-Q129 VanDerWaalsContact O-CG 3.31Å; V125-Q129 WeakPolarHBondContact O-CG 3.47Å; V125-Q129 PolarHBondContact O-N 3.21Å
126	H	88.9	Confident	87.8	Confident	104 Å²	104	104.9 Å²	104.9	48%	0.481	53%	0.529	S	S	.	.	H	α-helix	trans	-62.5	-40.3	177.3	-78.1	-56.1	0	0	0	112.8	Q122 V123 R130	Q122-H126 PolarHBondContact O-CD2 3.41Å; Q122-H126 PolarHBondContact O-N 3.42Å; V123-H126 PolarHBondContact O-N 2.94Å; H126-R130 WeakPolarHBondContact O-CG 3.29Å; H126-R130 PolarHBondContact O-N 3.15Å
127	V	86.1	Confident	87.4	Confident	67 Å²	67	101.5 Å²	101.5	41%	0.406	51%	0.513	S	S	.	.	H	α-helix	trans	-63.5	-48.2	175.1	170.4	0	0	0	0	109.9	V123 H124 V125 Q129 R130 M131	V123-V127 HydrophobicContact CG1-CG2 4.27Å; V123-V127 VanDerWaalsContact O-CG2 3.29Å; V123-V127 WeakPolarHBondContact O-CG2 3.39Å; V123-V127 PolarHBondContact O-N 3.42Å; H124-V127 PolarHBondContact O-N 3.33Å; V125-V127 VanDerWaalsContact C-N 3.35Å; V125-V127 PolarHBondContact O-N 2.97Å; V127-Q129 VanDerWaalsContact C-N 3.32Å; V127-Q129 PolarHBondContact O-N 3.27Å; V127-R130 PolarHBondContact O-N 3.44Å; V127-R130 VanDerWaalsContact O-N 3.1Å; V127-M131 HydrophobicContact CG1-CE 4.41Å; V127-M131 HydrophobicContact CG1-CG 3.89Å; V127-M131 HydrophobicContact CG1-SD 3.66Å; V127-M131 WeakPolarHBondContact O-CB 3.34Å; V127-M131 VanDerWaalsContact O-CG 3.31Å; V127-M131 WeakPolarHBondContact O-CG 3.46Å; V127-M131 PolarHBondContact O-N 3.02Å
128	Q	85.8	Confident	87.2	Confident	156 Å²	156	102.3 Å²	102.3	73%	0.729	52%	0.517	S	S	*	.	H	α-helix	trans	-62	-37.7	-178.8	-169.4	173.8	17.8	0	0	112.9	H124 V125 R130	H124-Q128 WeakPolarHBondContact O-CB 3.45Å; H124-Q128 PolarHBondContact O-N 2.73Å; V125-Q128 PolarHBondContact O-N 2.9Å; Q128-R130 VanDerWaalsContact C-N 3.3Å; Q128-R130 PolarHBondContact O-N 3.44Å
129	Q	84.8	Confident	87	Confident	141 Å²	141	103.9 Å²	103.9	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-66.1	-30.3	176	-73.7	173.2	-8.9	0	0	113.3	V125 V127	V125-Q129 HydrophobicContact CG1-CG 4.48Å; V125-Q129 VanDerWaalsContact O-CG 3.31Å; V125-Q129 WeakPolarHBondContact O-CG 3.47Å; V125-Q129 PolarHBondContact O-N 3.21Å; V127-Q129 VanDerWaalsContact C-N 3.32Å; V127-Q129 PolarHBondContact O-N 3.27Å
130	R	81.7	Confident	86.8	Confident	200 Å²	200	103.2 Å²	103.2	76%	0.755	52%	0.521	S	S	*	.	H	α-helix	trans	-94.3	-21.5	-177.9	-67	-172.1	-176.3	-163.3	3.3	113.6	H126 V127 Q128 S132	H126-R130 WeakPolarHBondContact O-CG 3.29Å; H126-R130 PolarHBondContact O-N 3.15Å; V127-R130 PolarHBondContact O-N 3.44Å; V127-R130 VanDerWaalsContact O-N 3.1Å; Q128-R130 VanDerWaalsContact C-N 3.3Å; Q128-R130 PolarHBondContact O-N 3.44Å; R130-S132 PolarHBondContact O-N 3.47Å
131	M	75.3	Confident	86.7	Confident	92 Å²	92	102.3 Å²	102.3	45%	0.453	52%	0.515	S	S	.	.			trans	-78.1	66.3	178.6	-76.3	-160.7	139.8	0	0	111.8	V127 V137	V127-M131 HydrophobicContact CG1-CE 4.41Å; V127-M131 HydrophobicContact CG1-CG 3.89Å; V127-M131 HydrophobicContact CG1-SD 3.66Å; V127-M131 WeakPolarHBondContact O-CB 3.34Å; V127-M131 VanDerWaalsContact O-CG 3.31Å; V127-M131 WeakPolarHBondContact O-CG 3.46Å; V127-M131 PolarHBondContact O-N 3.02Å; M131-V137 HydrophobicContact CE-CB 4.49Å; M131-V137 HydrophobicContact CE-CG1 3.99Å
132	S	70.1	Confident	86.7	Confident	117 Å²	117	100.8 Å²	100.8	82%	0.818	51%	0.511	S	S	*	.	S	Bend	trans	-76.6	-23.2	171	59.5	0	0	0	0	112.8	R130	R130-S132 PolarHBondContact O-N 3.47Å
133	N	80.9	Confident	86.7	Confident	73 Å²	73	98.6 Å²	98.6	39%	0.39	51%	0.509	S	S	.	.			trans	-151.7	114.8	174.3	-177.5	-19.2	0	0	0	111	D135 S136 V137	N133-D135 VanDerWaalsContact C-N 3.3Å; N133-D135 PolarHBondContact O-N 2.85Å; N133-D135 PolarHBondContact OD1-N 3.17Å; N133-S136 PolarHBondContact O-N 2.94Å; N133-S136 PolarHBondContact O-OG 3.37Å; N133-V137 WeakPolarHBondContact O-CG2 3.31Å; N133-V137 PolarHBondContact O-N 3.36Å
134	P	83.4	Confident	86.8	Confident	82 Å²	82	101.2 Å²	101.2	53%	0.532	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-32.4	-177	25.8	-34.3	0	0	0	113.4	V137 Q138	P134-V137 PolarHBondContact O-N 3.34Å; P134-Q138 WeakPolarHBondContact O-CG 3.41Å; P134-Q138 PolarHBondContact O-N 3.03Å
135	D	85.3	Confident	87.1	Confident	115 Å²	115	100 Å²	100	62%	0.615	51%	0.51	S	S	*	.	H	α-helix	trans	-71	-36.3	-178	-67.8	-30.7	0	0	0	112	N133 K139	N133-D135 VanDerWaalsContact C-N 3.3Å; N133-D135 PolarHBondContact O-N 2.85Å; N133-D135 PolarHBondContact OD1-N 3.17Å; D135-K139 WeakPolarHBondContact O-CG 3.32Å; D135-K139 PolarHBondContact O-N 3.41Å; D135-K139 VanDerWaalsContact O-N 3.12Å
136	S	85.8	Confident	87.3	Confident	43 Å²	43	105.6 Å²	105.6	30%	0.301	53%	0.525	S	S	.	.	H	α-helix	trans	-68.6	-39.6	176.4	69.2	0	0	0	0	111.1	N133 K139 Q140	N133-S136 PolarHBondContact O-N 2.94Å; N133-S136 PolarHBondContact O-OG 3.37Å; S136-K139 PolarHBondContact O-N 3.3Å; S136-Q140 WeakPolarHBondContact O-CG 3.39Å; S136-Q140 PolarHBondContact O-N 3.48Å
137	V	86.1	Confident	87.7	Confident	28 Å²	28	104.3 Å²	104.3	17%	0.17	53%	0.527	C	S	.	.	H	α-helix	trans	-62.1	-45.1	176.4	175.1	0	0	0	0	110.9	M131 N133 P134 K139 Q140 I141	M131-V137 HydrophobicContact CE-CB 4.49Å; M131-V137 HydrophobicContact CE-CG1 3.99Å; N133-V137 WeakPolarHBondContact O-CG2 3.31Å; N133-V137 PolarHBondContact O-N 3.36Å; P134-V137 PolarHBondContact O-N 3.34Å; V137-K139 PolarHBondContact O-N 3.29Å; V137-Q140 WeakPolarHBondContact O-CB 3.31Å; V137-Q140 PolarHBondContact O-N 2.68Å; V137-I141 HydrophobicContact CG1-CD1 3.9Å; V137-I141 HydrophobicContact CG1-CG1 4.44Å; V137-I141 VanDerWaalsContact O-CG1 3.31Å; V137-I141 WeakPolarHBondContact O-CG1 3.36Å; V137-I141 PolarHBondContact O-N 3.21Å
138	Q	89.1	Confident	88.2	Confident	104 Å²	104	103.8 Å²	103.8	49%	0.486	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-42	176.1	-73.8	-64.8	-27.1	0	0	112.5	P134 Q140 I141 N142	P134-Q138 WeakPolarHBondContact O-CG 3.41Å; P134-Q138 PolarHBondContact O-N 3.03Å; Q138-Q140 VanDerWaalsContact C-N 3.33Å; Q138-Q140 PolarHBondContact O-N 3.37Å; Q138-I141 PolarHBondContact O-N 2.87Å; Q138-N142 PolarHBondContact O-N 3.03Å; Q138-N142 PolarHBondContact O-ND2 3.48Å
139	K	91.1	Very high	88.7	Confident	157 Å²	157	100.6 Å²	100.6	68%	0.683	51%	0.512	S	S	*	.	H	α-helix	trans	-61.5	-41	174.2	-73.8	177.1	-177.3	177.9	0	112.1	D135 S136 V137 N142 S143	D135-K139 WeakPolarHBondContact O-CG 3.32Å; D135-K139 PolarHBondContact O-N 3.41Å; D135-K139 VanDerWaalsContact O-N 3.12Å; S136-K139 PolarHBondContact O-N 3.3Å; V137-K139 PolarHBondContact O-N 3.29Å; K139-N142 PolarHBondContact O-N 3.34Å; K139-S143 WeakPolarHBondContact O-CB 3.41Å; K139-S143 PolarHBondContact O-N 2.89Å
140	Q	90	Very high	89.2	Confident	129 Å²	129	96.9 Å²	96.9	60%	0.603	50%	0.502	S	S	*	.	H	α-helix	trans	-64.3	-45.4	176.1	-73.9	175	-5.3	0	0	111.7	S136 V137 Q138 N142 S143 F144	S136-Q140 WeakPolarHBondContact O-CG 3.39Å; S136-Q140 PolarHBondContact O-N 3.48Å; V137-Q140 WeakPolarHBondContact O-CB 3.31Å; V137-Q140 PolarHBondContact O-N 2.68Å; Q138-Q140 VanDerWaalsContact C-N 3.33Å; Q138-Q140 PolarHBondContact O-N 3.37Å; Q140-N142 VanDerWaalsContact C-N 3.34Å; Q140-N142 PolarHBondContact O-N 2.93Å; Q140-S143 PolarHBondContact O-N 3.26Å; Q140-F144 WeakPolarHBondContact O-CB 3.38Å; Q140-F144 PolarHBondContact O-N 3.3Å
141	I	91.6	Very high	89.9	Confident	70 Å²	70	91.5 Å²	91.5	36%	0.359	49%	0.491	S	S	.	.	H	α-helix	trans	-56.8	-48.2	175.1	-69.2	165.9	0	0	0	110.4	V137 Q138 S143 F144 N145	V137-I141 HydrophobicContact CG1-CD1 3.9Å; V137-I141 HydrophobicContact CG1-CG1 4.44Å; V137-I141 VanDerWaalsContact O-CG1 3.31Å; V137-I141 WeakPolarHBondContact O-CG1 3.36Å; V137-I141 PolarHBondContact O-N 3.21Å; Q138-I141 PolarHBondContact O-N 2.87Å; I141-S143 VanDerWaalsContact C-N 3.34Å; I141-S143 PolarHBondContact O-N 3.4Å; I141-F144 PolarHBondContact O-N 2.88Å; I141-N145 WeakPolarHBondContact O-CB 3.35Å; I141-N145 VanDerWaalsContact O-CG 3.25Å; I141-N145 PolarHBondContact O-N 3.38Å; I141-N145 PolarHBondContact O-ND2 3.4Å
142	N	94.5	Very high	90.8	Very high	86 Å²	86	91.6 Å²	91.6	46%	0.46	49%	0.492	S	S	.	.	H	α-helix	trans	-66.2	-34.2	179.6	-70.1	-22	0	0	0	113.2	Q138 K139 Q140 R146	Q138-N142 PolarHBondContact O-N 3.03Å; Q138-N142 PolarHBondContact O-ND2 3.48Å; K139-N142 PolarHBondContact O-N 3.34Å; Q140-N142 VanDerWaalsContact C-N 3.34Å; Q140-N142 PolarHBondContact O-N 2.93Å; N142-R146 WeakPolarHBondContact O-CG 3.35Å; N142-R146 PolarHBondContact O-N 3.16Å; N142-R146 PolarHBondContact O-NE 3.38Å
143	S	94.6	Very high	92	Very high	68 Å²	68	90.9 Å²	90.9	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-68.9	-42.2	173.4	-167.9	0	0	0	0	111.6	K139 Q140 I141 R146 C147	K139-S143 WeakPolarHBondContact O-CB 3.41Å; K139-S143 PolarHBondContact O-N 2.89Å; Q140-S143 PolarHBondContact O-N 3.26Å; I141-S143 VanDerWaalsContact C-N 3.34Å; I141-S143 PolarHBondContact O-N 3.4Å; S143-R146 PolarHBondContact O-N 2.98Å; S143-C147 PolarHBondContact O-N 2.84Å; S143-C147 VanDerWaalsContact O-N 3.14Å
144	F	95.8	Very high	92.7	Very high	139 Å²	139	92.1 Å²	92.1	61%	0.61	49%	0.485	S	S	*	.	H	α-helix	trans	-64.9	-47.1	178.9	-177.9	-103.5	0	0	0	111.4	Q140 I141 R146 C147 V148	Q140-F144 WeakPolarHBondContact O-CB 3.38Å; Q140-F144 PolarHBondContact O-N 3.3Å; I141-F144 PolarHBondContact O-N 2.88Å; F144-R146 VanDerWaalsContact C-N 3.28Å; F144-R146 PolarHBondContact O-N 3.19Å; F144-C147 WeakPolarHBondContact O-CB 3.47Å; F144-C147 PolarHBondContact O-N 3.25Å; F144-V148 HydrophobicContact CD1-CG2 4.08Å; F144-V148 HydrophobicContact CE1-CG2 3.67Å; F144-V148 HydrophobicContact CE2-CG2 4.25Å; F144-V148 HydrophobicContact CZ-CG2 3.77Å; F144-V148 WeakPolarHBondContact O-CG2 3.3Å; F144-V148 PolarHBondContact O-N 3.37Å
145	N	96.6	Very high	93.2	Very high	74 Å²	74	92.8 Å²	92.8	40%	0.396	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-38.3	176.7	-70.7	-18.3	0	0	0	112.1	I141 V148 N149	I141-N145 WeakPolarHBondContact O-CB 3.35Å; I141-N145 VanDerWaalsContact O-CG 3.25Å; I141-N145 PolarHBondContact O-N 3.38Å; I141-N145 PolarHBondContact O-ND2 3.4Å; N145-V148 PolarHBondContact O-N 3.14Å; N145-N149 WeakPolarHBondContact O-CB 3.4Å; N145-N149 PolarHBondContact O-N 3.24Å; N145-N149 PolarHBondContact O-ND2 3.1Å
146	R	96.2	Very high	93.5	Very high	172 Å²	172	90.2 Å²	90.2	65%	0.649	48%	0.475	S	S	*	.	H	α-helix	trans	-62.4	-42.2	173.7	-79.9	-176.4	-75.6	168.1	-3.3	112.5	N142 S143 F144 S150	N142-R146 WeakPolarHBondContact O-CG 3.35Å; N142-R146 PolarHBondContact O-N 3.16Å; N142-R146 PolarHBondContact O-NE 3.38Å; S143-R146 PolarHBondContact O-N 2.98Å; F144-R146 VanDerWaalsContact C-N 3.28Å; F144-R146 PolarHBondContact O-N 3.19Å; R146-S150 WeakPolarHBondContact O-CB 3.46Å; R146-S150 PolarHBondContact O-N 3.35Å
147	C	96.2	Very high	93.8	Very high	78 Å²	78	90.4 Å²	90.4	53%	0.527	47%	0.474	S	S	.	.	H	α-helix	trans	-63.1	-48.5	175.5	-174.1	0	0	0	0	111.4	S143 F144 N149 S150 V151	S143-C147 PolarHBondContact O-N 2.84Å; S143-C147 VanDerWaalsContact O-N 3.14Å; F144-C147 WeakPolarHBondContact O-CB 3.47Å; F144-C147 PolarHBondContact O-N 3.25Å; C147-N149 PolarHBondContact O-N 2.87Å; C147-S150 WeakPolarHBondContact O-CB 3.35Å; C147-S150 PolarHBondContact O-N 2.9Å; C147-V151 WeakPolarHBondContact O-CG2 3.3Å; C147-V151 PolarHBondContact O-N 3.46Å
148	V	96.8	Very high	94.1	Very high	55 Å²	55	92.5 Å²	92.5	33%	0.333	49%	0.487	S	S	.	.	H	α-helix	trans	-59.1	-46.8	178.2	173	0	0	0	0	111.1	F144 N145 S150 V151 L152	F144-V148 HydrophobicContact CD1-CG2 4.08Å; F144-V148 HydrophobicContact CE1-CG2 3.67Å; F144-V148 HydrophobicContact CE2-CG2 4.25Å; F144-V148 HydrophobicContact CZ-CG2 3.77Å; F144-V148 WeakPolarHBondContact O-CG2 3.3Å; F144-V148 PolarHBondContact O-N 3.37Å; N145-V148 PolarHBondContact O-N 3.14Å; V148-S150 VanDerWaalsContact C-N 3.34Å; V148-S150 PolarHBondContact O-N 3.44Å; V148-V151 PolarHBondContact O-N 3.37Å; V148-L152 HydrophobicContact CG1-CD1 4.03Å; V148-L152 HydrophobicContact CG1-CG 4.37Å; V148-L152 WeakPolarHBondContact O-CG 3.28Å; V148-L152 PolarHBondContact O-N 3.03Å
149	N	96	Very high	94.1	Very high	90 Å²	90	92 Å²	92	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-62.8	-41.1	177.6	-69.6	-25.5	0	0	0	111.7	N145 C147 V151 L152 D153	N145-N149 WeakPolarHBondContact O-CB 3.4Å; N145-N149 PolarHBondContact O-N 3.24Å; N145-N149 PolarHBondContact O-ND2 3.1Å; C147-N149 PolarHBondContact O-N 2.87Å; N149-V151 VanDerWaalsContact C-N 3.31Å; N149-V151 PolarHBondContact O-N 2.93Å; N149-L152 PolarHBondContact O-N 3.06Å; N149-D153 WeakPolarHBondContact O-CB 3.36Å; N149-D153 PolarHBondContact O-N 2.98Å
150	S	95.7	Very high	93.9	Very high	63 Å²	63	91.1 Å²	91.1	44%	0.441	48%	0.479	S	S	.	.	H	α-helix	trans	-61.4	-38.5	175.1	-175.7	0	0	0	0	112.6	R146 C147 V148 I154	R146-S150 WeakPolarHBondContact O-CB 3.46Å; R146-S150 PolarHBondContact O-N 3.35Å; C147-S150 WeakPolarHBondContact O-CB 3.35Å; C147-S150 PolarHBondContact O-N 2.9Å; V148-S150 VanDerWaalsContact C-N 3.34Å; V148-S150 PolarHBondContact O-N 3.44Å; S150-I154 WeakPolarHBondContact O-CD1 3.49Å; S150-I154 VanDerWaalsContact O-CG1 3.26Å; S150-I154 WeakPolarHBondContact O-CG1 3.41Å; S150-I154 PolarHBondContact O-N 3.32Å; S150-I154 VanDerWaalsContact O-N 3.11Å
151	V	96.2	Very high	93.7	Very high	86 Å²	86	90.3 Å²	90.3	52%	0.521	48%	0.475	S	S	.	.	H	α-helix	trans	-69.1	-41.2	175.5	172.6	0	0	0	0	110.9	C147 V148 N149 D153 I154 L155	C147-V151 WeakPolarHBondContact O-CG2 3.3Å; C147-V151 PolarHBondContact O-N 3.46Å; V148-V151 PolarHBondContact O-N 3.37Å; N149-V151 VanDerWaalsContact C-N 3.31Å; N149-V151 PolarHBondContact O-N 2.93Å; V151-D153 VanDerWaalsContact C-N 3.32Å; V151-I154 PolarHBondContact O-N 3.43Å; V151-L155 WeakPolarHBondContact O-CB 3.31Å; V151-L155 PolarHBondContact O-N 2.98Å
152	L	95.6	Very high	93.1	Very high	94 Å²	94	93.3 Å²	93.3	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-39.3	175.4	-71.6	174.6	0	0	0	111.8	V148 N149 L155 S156	V148-L152 HydrophobicContact CG1-CD1 4.03Å; V148-L152 HydrophobicContact CG1-CG 4.37Å; V148-L152 WeakPolarHBondContact O-CG 3.28Å; V148-L152 PolarHBondContact O-N 3.03Å; N149-L152 PolarHBondContact O-N 3.06Å; L152-L155 PolarHBondContact O-N 3.28Å; L152-S156 WeakPolarHBondContact O-CB 3.5Å; L152-S156 PolarHBondContact O-N 3.44Å
153	D	95.1	Very high	92.1	Very high	103 Å²	103	92.1 Å²	92.1	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-63.2	-48.1	176.3	-70.1	-24.3	0	0	0	110.5	N149 V151 L155 S156 T157	N149-D153 WeakPolarHBondContact O-CB 3.36Å; N149-D153 PolarHBondContact O-N 2.98Å; V151-D153 VanDerWaalsContact C-N 3.32Å; D153-L155 VanDerWaalsContact C-N 3.33Å; D153-L155 PolarHBondContact O-N 3.36Å; D153-S156 PolarHBondContact O-N 2.92Å; D153-S156 PolarHBondContact O-OG 3.5Å; D153-T157 PolarHBondContact O-N 2.97Å; D153-T157 PolarHBondContact O-OG1 2.88Å
154	I	94.9	Very high	90.5	Very high	99 Å²	99	94.6 Å²	94.6	51%	0.508	49%	0.49	S	S	.	.	H	α-helix	trans	-59.1	-44.7	175.6	-66.9	163.9	0	0	0	111	S150 V151 S156 T157 V158	S150-I154 WeakPolarHBondContact O-CD1 3.49Å; S150-I154 VanDerWaalsContact O-CG1 3.26Å; S150-I154 WeakPolarHBondContact O-CG1 3.41Å; S150-I154 PolarHBondContact O-N 3.32Å; S150-I154 VanDerWaalsContact O-N 3.11Å; V151-I154 PolarHBondContact O-N 3.43Å; I154-S156 VanDerWaalsContact C-N 3.33Å; I154-S156 PolarHBondContact O-N 3.49Å; I154-T157 WeakPolarHBondContact CA-OG1 3.44Å; I154-T157 PolarHBondContact O-N 2.87Å; I154-T157 PolarHBondContact O-OG1 3.16Å; I154-V158 WeakPolarHBondContact O-CG2 3.42Å; I154-V158 PolarHBondContact O-N 2.96Å
155	L	93.8	Very high	88.7	Confident	95 Å²	95	94.6 Å²	94.6	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-42.5	177.9	-179.5	61.6	0	0	0	111.2	V151 L152 D153 T157 V158 I159	V151-L155 WeakPolarHBondContact O-CB 3.31Å; V151-L155 PolarHBondContact O-N 2.98Å; L152-L155 PolarHBondContact O-N 3.28Å; D153-L155 VanDerWaalsContact C-N 3.33Å; D153-L155 PolarHBondContact O-N 3.36Å; L155-T157 VanDerWaalsContact C-N 3.31Å; L155-T157 PolarHBondContact O-N 3.49Å; L155-V158 PolarHBondContact O-N 3.33Å; L155-I159 HydrophobicContact CD1-CD1 4.05Å; L155-I159 HydrophobicContact CD1-CG1 4.34Å; L155-I159 HydrophobicContact CG-CD1 3.87Å; L155-I159 VanDerWaalsContact O-CG1 3.28Å; L155-I159 WeakPolarHBondContact O-CG1 3.33Å; L155-I159 PolarHBondContact O-N 3.41Å
156	S	92.8	Very high	86.8	Confident	61 Å²	61	95.7 Å²	95.7	43%	0.427	51%	0.51	S	S	.	.	H	α-helix	trans	-63.9	-35.4	177.6	78.1	0	0	0	0	112.4	L152 D153 I154 R160	L152-S156 WeakPolarHBondContact O-CB 3.5Å; L152-S156 PolarHBondContact O-N 3.44Å; D153-S156 PolarHBondContact O-N 2.92Å; D153-S156 PolarHBondContact O-OG 3.5Å; I154-S156 VanDerWaalsContact C-N 3.33Å; I154-S156 PolarHBondContact O-N 3.49Å; S156-R160 WeakPolarHBondContact O-CB 3.45Å; S156-R160 PolarHBondContact O-N 2.95Å; S156-R160 VanDerWaalsContact O-N 3.12Å
157	T	92.2	Very high	84.8	Confident	48 Å²	48	96.3 Å²	96.3	29%	0.294	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-43.1	175.6	48.5	0	0	0	0	111.8	D153 I154 L155 I159 R160 E161	D153-T157 PolarHBondContact O-N 2.97Å; D153-T157 PolarHBondContact O-OG1 2.88Å; I154-T157 WeakPolarHBondContact CA-OG1 3.44Å; I154-T157 PolarHBondContact O-N 2.87Å; I154-T157 PolarHBondContact O-OG1 3.16Å; L155-T157 VanDerWaalsContact C-N 3.31Å; L155-T157 PolarHBondContact O-N 3.49Å; T157-I159 PolarHBondContact O-N 3.12Å; T157-R160 PolarHBondContact O-N 2.57Å; T157-E161 WeakPolarHBondContact O-CG 3.48Å; T157-E161 PolarHBondContact O-N 2.96Å
158	V	91	Very high	82.5	Confident	71 Å²	71	97 Å²	97	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-63.2	-43.9	178	171.9	0	0	0	0	111.1	I154 L155 R160 E161 E162	I154-V158 WeakPolarHBondContact O-CG2 3.42Å; I154-V158 PolarHBondContact O-N 2.96Å; L155-V158 PolarHBondContact O-N 3.33Å; V158-R160 VanDerWaalsContact C-N 3.28Å; V158-R160 PolarHBondContact O-N 3.18Å; V158-E161 PolarHBondContact O-N 3.39Å; V158-E162 WeakPolarHBondContact O-CB 3.39Å; V158-E162 PolarHBondContact O-N 2.93Å
159	I	89	Confident	80	Confident	94 Å²	94	98.3 Å²	98.3	48%	0.482	54%	0.543	S	S	.	.	H	α-helix	trans	-62.3	-37.6	177.2	-67.5	166.9	0	0	0	111.1	L155 T157 S163	L155-I159 HydrophobicContact CD1-CD1 4.05Å; L155-I159 HydrophobicContact CD1-CG1 4.34Å; L155-I159 HydrophobicContact CG-CD1 3.87Å; L155-I159 VanDerWaalsContact O-CG1 3.28Å; L155-I159 WeakPolarHBondContact O-CG1 3.33Å; L155-I159 PolarHBondContact O-N 3.41Å; T157-I159 PolarHBondContact O-N 3.12Å; I159-S163 PolarHBondContact O-N 3.38Å; I159-S163 VanDerWaalsContact O-N 3.14Å; I159-S163 PolarHBondContact O-OG 2.82Å
160	R	86.9	Confident	77.8	Confident	138 Å²	138	101.6 Å²	101.6	52%	0.521	55%	0.553	S	S	.	*	H	α-helix	trans	-68.9	-43	176.9	-169.6	177.7	66.5	-140.6	-5.1	111.9	S156 T157 V158 S163 E164	S156-R160 WeakPolarHBondContact O-CB 3.45Å; S156-R160 PolarHBondContact O-N 2.95Å; S156-R160 VanDerWaalsContact O-N 3.12Å; T157-R160 PolarHBondContact O-N 2.57Å; V158-R160 VanDerWaalsContact C-N 3.28Å; V158-R160 PolarHBondContact O-N 3.18Å; R160-S163 WeakPolarHBondContact CA-OG 3.22Å; R160-S163 PolarHBondContact O-N 3.1Å; R160-S163 PolarHBondContact O-OG 3.4Å; R160-E164 WeakPolarHBondContact O-CG 3.3Å; R160-E164 PolarHBondContact O-N 3.28Å
161	E	86.5	Confident	75.8	Confident	112 Å²	112	104.5 Å²	104.5	52%	0.523	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-41.5	176.7	-71.4	172.2	-177.7	0	0	111.8	T157 V158 S163 E164 D165	T157-E161 WeakPolarHBondContact O-CG 3.48Å; T157-E161 PolarHBondContact O-N 2.96Å; V158-E161 PolarHBondContact O-N 3.39Å; E161-S163 VanDerWaalsContact C-N 3.32Å; E161-S163 PolarHBondContact O-N 3.44Å; E161-E164 PolarHBondContact O-N 3.49Å; E161-D165 PolarHBondContact O-N 2.94Å
162	E	79.4	Confident	73.8	Confident	134 Å²	134	105.9 Å²	105.9	63%	0.626	58%	0.579	S	S	*	*	H	α-helix	trans	-67.2	-31.8	177.9	-169.6	175.7	-170.3	0	0	112.8	V158 S166	V158-E162 WeakPolarHBondContact O-CB 3.39Å; V158-E162 PolarHBondContact O-N 2.93Å; E162-S166 PolarHBondContact O-N 2.77Å; E162-S166 PolarHBondContact O-OG 3.37Å
163	S	72.9	Confident	72	Confident	60 Å²	60	106.6 Å²	106.6	42%	0.42	59%	0.592	S	S	.	*	H	α-helix	trans	-76	-33.9	174.7	45.6	0	0	0	0	112.7	I159 R160 E161 S166	I159-S163 PolarHBondContact O-N 3.38Å; I159-S163 VanDerWaalsContact O-N 3.14Å; I159-S163 PolarHBondContact O-OG 2.82Å; R160-S163 WeakPolarHBondContact CA-OG 3.22Å; R160-S163 PolarHBondContact O-N 3.1Å; R160-S163 PolarHBondContact O-OG 3.4Å; E161-S163 VanDerWaalsContact C-N 3.32Å; E161-S163 PolarHBondContact O-N 3.44Å; S163-S166 PolarHBondContact O-N 3.12Å
164	E	61.6	Low	70.2	Confident	120 Å²	120	105.8 Å²	105.8	56%	0.561	59%	0.591	S	S	*	*	H	α-helix	trans	-70.5	-37.3	174.6	-73.2	176.6	-170.3	0	0	112.2	R160 E161 S166 E167	R160-E164 WeakPolarHBondContact O-CG 3.3Å; R160-E164 PolarHBondContact O-N 3.28Å; E161-E164 PolarHBondContact O-N 3.49Å; E164-S166 PolarHBondContact O-N 3.37Å; E164-E167 PolarHBondContact O-N 3.48Å
165	D	58.1	Low	68.7	Low	139 Å²	139	107.9 Å²	107.9	74%	0.743	61%	0.613	S	S	*	*	H	α-helix	trans	-69.3	-15.9	175	-86.1	-16.9	0	0	0	113.4	E161	E161-D165 PolarHBondContact O-N 2.94Å
166	S	57.2	Low	68	Low	98 Å²	98	110.5 Å²	110.5	69%	0.685	62%	0.617	S	S	*	*	H	α-helix	trans	-91.5	-18.6	-179.3	-61.7	0	0	0	0	114	E162 S163 E164	E162-S166 PolarHBondContact O-N 2.77Å; E162-S166 PolarHBondContact O-OG 3.37Å; S163-S166 PolarHBondContact O-N 3.12Å; E164-S166 PolarHBondContact O-N 3.37Å
167	E	53.4	Low	67.4	Low	184 Å²	184	111.4 Å²	111.4	86%	0.86	62%	0.617	S	S	*	*	H	α-helix	trans	-99.9	-14.8	-177.4	-72.3	-154.5	142.4	0	0	114.7	E164	E164-E167 PolarHBondContact O-N 3.48Å
168	D	47.2	Very low	66.9	Low	92 Å²	92	112.4 Å²	112.4	49%	0.492	63%	0.625	S	S	.	*	S	Bend	trans	-111.8	106.7	176.6	-145.9	-0.5	0	0	0	109.6	K170	D168-K170 PolarHBondContact O-N 3.13Å; D168-K170 WeakPolarHBondContact OD2-CD 3.26Å; D168-K170 WeakPolarHBondContact OD2-CE 3.48Å; D168-K170 IonicContact OD2-NZ 2.67Å; D168-K170 PolarHBondContact OD2-NZ 2.97Å
169	G	45.3	Very low	66.6	Low	83 Å²	83	113.1 Å²	113.1	86%	0.856	62%	0.623	S	S	*	*			trans	-65.5	49.4	178.4	0	0	0	0	0	114.5	V171	G169-V171 PolarHBondContact O-N 3.45Å
170	K	49.1	Very low	66.3	Low	159 Å²	159	112.2 Å²	112.2	69%	0.691	62%	0.619	S	S	*	*			trans	-89.5	104.2	-178.3	-82.3	174.7	178.2	154.5	0	110.4	D168	D168-K170 PolarHBondContact O-N 3.13Å; D168-K170 WeakPolarHBondContact OD2-CD 3.26Å; D168-K170 WeakPolarHBondContact OD2-CE 3.48Å; D168-K170 IonicContact OD2-NZ 2.67Å; D168-K170 PolarHBondContact OD2-NZ 2.97Å
171	V	53.3	Low	66.3	Low	124 Å²	124	108.9 Å²	108.9	75%	0.752	61%	0.614	S	S	*	*			trans	-14.4	127.3	154.7	-175.3	0	0	0	0	112.5	G169 S173	G169-V171 PolarHBondContact O-N 3.45Å; V171-S173 PolarHBondContact O-N 2.97Å
172	P	54.7	Low	66.5	Low	115 Å²	115	111.2 Å²	111.2	75%	0.747	62%	0.618	S	S	*	*			trans	-52.7	120.8	-178.6	19.5	-30.6	0	0	0	110.1	T174	P172-T174 PolarHBondContact O-N 3.48Å
173	S	57.3	Low	66.8	Low	110 Å²	110	109.4 Å²	109.4	77%	0.769	61%	0.608	S	S	*	*			trans	-46	114	174.2	144.8	0	0	0	0	109.3	V171 C175	V171-S173 PolarHBondContact O-N 2.97Å; S173-C175 PolarHBondContact O-N 2.92Å
174	T	58.3	Low	67.5	Low	85 Å²	85	111.8 Å²	111.8	52%	0.521	62%	0.616	S	S	.	*			trans	-58.7	123.7	-178.5	52.4	0	0	0	0	110.8	P172 Y176	P172-T174 PolarHBondContact O-N 3.48Å; T174-Y176 VanDerWaalsContact CB-CE1 3.41Å; T174-Y176 HydrophobicContact CG2-CD1 4.49Å; T174-Y176 HydrophobicContact CG2-CE1 3.93Å; T174-Y176 PolarHBondContact O-N 2.92Å; T174-Y176 WeakPolarHBondContact OG1-CE1 3.33Å
175	C	63.1	Low	68.8	Low	144 Å²	144	110 Å²	110	97%	0.973	61%	0.613	S	S	*	*	S	Bend	trans	-69.8	35	-178.9	-63.8	0	0	0	0	115.2	S173	S173-C175 PolarHBondContact O-N 2.92Å
176	Y	78.5	Confident	70.3	Confident	150 Å²	150	104.6 Å²	104.6	59%	0.588	59%	0.587	S	S	*	*			trans	-128.5	137.2	174.7	74	-88.8	0	0	0	111.2	T174	T174-Y176 VanDerWaalsContact CB-CE1 3.41Å; T174-Y176 HydrophobicContact CG2-CD1 4.49Å; T174-Y176 HydrophobicContact CG2-CE1 3.93Å; T174-Y176 PolarHBondContact O-N 2.92Å; T174-Y176 WeakPolarHBondContact OG1-CE1 3.33Å
177	N	80.3	Confident	71.8	Confident	80 Å²	80	100.8 Å²	100.8	43%	0.428	56%	0.562	S	S	.	*			trans	-87.4	116.3	171.1	-177.6	-5.9	0	0	0	108.5	E179 D180 T181	N177-E179 PolarHBondContact O-N 3.02Å; N177-E179 WeakPolarHBondContact OD1-CB 3.37Å; N177-E179 PolarHBondContact OD1-N 2.97Å; N177-D180 HydrophobicContact CB-CB 4.17Å; N177-D180 WeakPolarHBondContact CB-OD2 3.46Å; N177-D180 PolarHBondContact ND2-OD2 3.19Å; N177-D180 PolarHBondContact O-N 3.3Å; N177-T181 PolarHBondContact O-N 3Å; N177-T181 VanDerWaalsContact O-N 3.09Å; N177-T181 PolarHBondContact O-OG1 2.78Å
178	P	82.1	Confident	73.4	Confident	69 Å²	69	98.7 Å²	98.7	45%	0.448	56%	0.555	S	S	.	*	H	α-helix	trans	-61.4	-27	-179.5	24.4	-33.9	0	0	0	112.5	R182	P178-R182 WeakPolarHBondContact O-CG 3.44Å; P178-R182 PolarHBondContact O-N 3.25Å
179	E	84.3	Confident	75.4	Confident	86 Å²	86	99.5 Å²	99.5	40%	0.402	56%	0.564	S	S	.	*	H	α-helix	trans	-76.2	-39.5	-179.2	-164.2	57.3	-157.2	0	0	112.5	N177 T181 R182 K183	N177-E179 PolarHBondContact O-N 3.02Å; N177-E179 WeakPolarHBondContact OD1-CB 3.37Å; N177-E179 PolarHBondContact OD1-N 2.97Å; E179-T181 VanDerWaalsContact C-N 3.28Å; E179-T181 PolarHBondContact O-N 3.32Å; E179-R182 PolarHBondContact O-N 3.1Å; E179-R182 IonicContact OE2-NH1 2.99Å; E179-R182 PolarHBondContact OE2-NH1 2.89Å; E179-K183 WeakPolarHBondContact O-CG 2.95Å; E179-K183 PolarHBondContact O-N 3.29Å
180	D	84	Confident	77.4	Confident	75 Å²	75	99.7 Å²	99.7	40%	0.401	55%	0.549	S	S	.	.	H	α-helix	trans	-69.2	-34.4	174.6	-64.6	-28.6	0	0	0	110.8	N177 K183 L184	N177-D180 HydrophobicContact CB-CB 4.17Å; N177-D180 WeakPolarHBondContact CB-OD2 3.46Å; N177-D180 PolarHBondContact ND2-OD2 3.19Å; N177-D180 PolarHBondContact O-N 3.3Å; D180-K183 PolarHBondContact O-N 3.19Å; D180-K183 IonicContact OD1-NZ 3.72Å; D180-L184 WeakPolarHBondContact O-CB 3.42Å; D180-L184 PolarHBondContact O-N 3.21Å
181	T	86.6	Confident	79	Confident	67 Å²	67	93.9 Å²	93.9	41%	0.411	53%	0.534	S	S	.	.	H	α-helix	trans	-61.2	-44.7	172.4	-51.7	0	0	0	0	110.5	N177 E179 K183 L184 V185	N177-T181 PolarHBondContact O-N 3Å; N177-T181 VanDerWaalsContact O-N 3.09Å; N177-T181 PolarHBondContact O-OG1 2.78Å; E179-T181 VanDerWaalsContact C-N 3.28Å; E179-T181 PolarHBondContact O-N 3.32Å; T181-K183 PolarHBondContact O-N 2.95Å; T181-L184 PolarHBondContact O-N 3.33Å; T181-V185 VanDerWaalsContact O-CG2 3.24Å; T181-V185 WeakPolarHBondContact O-CG2 3.17Å; T181-V185 PolarHBondContact O-N 3.32Å
182	R	89.1	Confident	80.1	Confident	162 Å²	162	94.3 Å²	94.3	61%	0.611	53%	0.526	S	S	*	.	H	α-helix	trans	-62.8	-41.6	174.8	-76.2	179.7	-172.1	132.3	0.9	113	P178 E179 V185 A186	P178-R182 WeakPolarHBondContact O-CG 3.44Å; P178-R182 PolarHBondContact O-N 3.25Å; E179-R182 PolarHBondContact O-N 3.1Å; E179-R182 IonicContact OE2-NH1 2.99Å; E179-R182 PolarHBondContact OE2-NH1 2.89Å; R182-V185 PolarHBondContact O-N 3.32Å; R182-A186 WeakPolarHBondContact O-CB 3.1Å; R182-A186 PolarHBondContact O-N 2.99Å
183	K	87.5	Confident	81.3	Confident	95 Å²	95	97.4 Å²	97.4	41%	0.413	52%	0.523	S	S	.	.	H	α-helix	trans	-64.5	-42.9	178.1	-71.7	172.1	-170.6	161.2	0	111.8	E179 D180 T181 A186 A187	E179-K183 WeakPolarHBondContact O-CG 2.95Å; E179-K183 PolarHBondContact O-N 3.29Å; D180-K183 PolarHBondContact O-N 3.19Å; D180-K183 IonicContact OD1-NZ 3.72Å; T181-K183 PolarHBondContact O-N 2.95Å; K183-A186 PolarHBondContact O-N 3.18Å; K183-A187 WeakPolarHBondContact O-CB 3.35Å; K183-A187 PolarHBondContact O-N 3.04Å
184	L	86.9	Confident	82.3	Confident	110 Å²	110	97.9 Å²	97.9	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-47	174.4	-95.8	152.1	0	0	0	111.5	D180 T181 A186 A187 I188	D180-L184 WeakPolarHBondContact O-CB 3.42Å; D180-L184 PolarHBondContact O-N 3.21Å; T181-L184 PolarHBondContact O-N 3.33Å; L184-A186 PolarHBondContact O-N 3.41Å; L184-A187 PolarHBondContact O-N 3.01Å; L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.34Å; L184-I188 PolarHBondContact O-N 3.22Å
185	V	89.3	Confident	83.1	Confident	83 Å²	83	105.1 Å²	105.1	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-60.4	-45.2	175.7	172.4	0	0	0	0	110.7	T181 R182 A187 I188 T189	T181-V185 VanDerWaalsContact O-CG2 3.24Å; T181-V185 WeakPolarHBondContact O-CG2 3.17Å; T181-V185 PolarHBondContact O-N 3.32Å; R182-V185 PolarHBondContact O-N 3.32Å; V185-A187 VanDerWaalsContact C-N 3.35Å; V185-A187 PolarHBondContact O-N 3.28Å; V185-I188 PolarHBondContact O-N 3.03Å; V185-T189 WeakPolarHBondContact O-CB 3.21Å; V185-T189 PolarHBondContact O-N 3.44Å; V185-T189 PolarHBondContact O-OG1 3.13Å
186	A	89.5	Confident	83.4	Confident	25 Å²	25	103.8 Å²	103.8	21%	0.207	52%	0.524	C	S	.	.	H	α-helix	trans	-62.7	-39.2	177	0	0	0	0	0	112.7	R182 K183 L184 T190 G191 Y193	R182-A186 WeakPolarHBondContact O-CB 3.1Å; R182-A186 PolarHBondContact O-N 2.99Å; K183-A186 PolarHBondContact O-N 3.18Å; L184-A186 PolarHBondContact O-N 3.41Å; A186-T190 WeakPolarHBondContact O-CA 3.46Å; A186-T190 PolarHBondContact O-N 3.15Å; A186-T190 PolarHBondContact O-OG1 3.09Å; A186-G191 PolarHBondContact O-N 3.1Å; A186-Y193 HydrophobicContact CB-CD2 4.37Å; A186-Y193 HydrophobicContact CB-CE2 4.01Å
187	A	88	Confident	82.5	Confident	19 Å²	19	100.8 Å²	100.8	16%	0.157	53%	0.53	C	S	.	.	H	α-helix	trans	-66	-40.6	176.5	0	0	0	0	0	112.5	K183 L184 V185 G191 K192 L194	K183-A187 WeakPolarHBondContact O-CB 3.35Å; K183-A187 PolarHBondContact O-N 3.04Å; L184-A187 PolarHBondContact O-N 3.01Å; V185-A187 VanDerWaalsContact C-N 3.35Å; V185-A187 PolarHBondContact O-N 3.28Å; A187-G191 VanDerWaalsContact O-CA 3.26Å; A187-G191 WeakPolarHBondContact O-CA 3.34Å; A187-G191 PolarHBondContact O-N 3.28Å; A187-G191 VanDerWaalsContact O-N 3.14Å; A187-K192 WeakPolarHBondContact CA-O 3.44Å; A187-K192 WeakPolarHBondContact CB-O 3.47Å; A187-L194 HydrophobicContact CB-CD2 4.47Å; A187-L194 HydrophobicContact CB-CG 4.39Å
188	I	87.8	Confident	81.3	Confident	139 Å²	139	107.8 Å²	107.8	71%	0.713	55%	0.552	S	S	*	*	H	α-helix	trans	-73.4	-44.3	179.4	-66.2	166.2	0	0	0	111.4	L184 V185	L184-I188 VanDerWaalsContact O-CG1 3.29Å; L184-I188 WeakPolarHBondContact O-CG1 3.34Å; L184-I188 PolarHBondContact O-N 3.22Å; V185-I188 PolarHBondContact O-N 3.03Å
189	T	89	Confident	79.7	Confident	109 Å²	109	111 Å²	111	67%	0.669	57%	0.571	S	S	*	*	H	α-helix	trans	-84.3	-35.2	-173	-48	0	0	0	0	113.1	V185	V185-T189 WeakPolarHBondContact O-CB 3.21Å; V185-T189 PolarHBondContact O-N 3.44Å; V185-T189 PolarHBondContact O-OG1 3.13Å
190	T	85.7	Confident	77.8	Confident	88 Å²	88	110.3 Å²	110.3	54%	0.54	59%	0.587	S	S	.	*	H	α-helix	trans	-120.2	-4.3	-172.3	66.8	0	0	0	0	114.2	A186 K192	A186-T190 WeakPolarHBondContact O-CA 3.46Å; A186-T190 PolarHBondContact O-N 3.15Å; A186-T190 PolarHBondContact O-OG1 3.09Å; T190-K192 PolarHBondContact O-N 3.13Å; T190-K192 VanDerWaalsContact O-N 3.09Å; T190-K192 WeakPolarHBondContact OG1-CB 3.37Å; T190-K192 WeakPolarHBondContact OG1-CG 3.21Å
191	G	82.7	Confident	75.7	Confident	37 Å²	37	114.1 Å²	114.1	38%	0.381	61%	0.608	S	S	.	*			trans	66.7	3.5	-174	0	0	0	0	0	114.1	A186 A187 Y193 L194	A186-G191 PolarHBondContact O-N 3.1Å; A187-G191 VanDerWaalsContact O-CA 3.26Å; A187-G191 WeakPolarHBondContact O-CA 3.34Å; A187-G191 PolarHBondContact O-N 3.28Å; A187-G191 VanDerWaalsContact O-N 3.14Å; G191-Y193 PolarHBondContact O-N 2.93Å; G191-L194 PolarHBondContact O-N 3.29Å
192	K	78	Confident	73.8	Confident	133 Å²	133	120.3 Å²	120.3	58%	0.578	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	138.9	173.8	-79.3	-176.6	175.3	-179.6	0	108.8	A187 T190 L194	A187-K192 WeakPolarHBondContact CA-O 3.44Å; A187-K192 WeakPolarHBondContact CB-O 3.47Å; T190-K192 PolarHBondContact O-N 3.13Å; T190-K192 VanDerWaalsContact O-N 3.09Å; T190-K192 WeakPolarHBondContact OG1-CB 3.37Å; T190-K192 WeakPolarHBondContact OG1-CG 3.21Å; K192-L194 VanDerWaalsContact C-N 3.3Å; K192-L194 PolarHBondContact O-N 3.18Å
193	Y	78.5	Confident	71.7	Confident	179 Å²	179	118.2 Å²	118.2	70%	0.702	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.8	2.6	-177.9	-40.5	-73.4	0	0	0	116.4	A186 G191	A186-Y193 HydrophobicContact CB-CD2 4.37Å; A186-Y193 HydrophobicContact CB-CE2 4.01Å; G191-Y193 PolarHBondContact O-N 2.93Å
194	L	79.9	Confident	69.6	Low	121 Å²	121	120.3 Å²	120.3	63%	0.634	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-93.2	129.6	168.1	-60.3	178.3	0	0	0	110.5	A187 G191 K192	A187-L194 HydrophobicContact CB-CD2 4.47Å; A187-L194 HydrophobicContact CB-CG 4.39Å; G191-L194 PolarHBondContact O-N 3.29Å; K192-L194 VanDerWaalsContact C-N 3.3Å; K192-L194 PolarHBondContact O-N 3.18Å
195	R	75.3	Confident	67.4	Low	237 Å²	237	126 Å²	126	89%	0.894	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-78.8	135.9	170.9	-71	-176.3	-179.5	-176.7	0.7	109.2	A197	R195-A197 PolarHBondContact O-N 2.96Å; R195-A197 VanDerWaalsContact O-N 3.13Å
196	P	69.3	Low	65.3	Low	116 Å²	116	127.4 Å²	127.4	75%	0.753	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-58.5	117.6	175.9	-21.6	31.8	0	0	0	110.8
197	A	58.7	Low	63.2	Low	87 Å²	87	132 Å²	132	72%	0.719	71%	0.711	S	S	*	*	S	Bend	trans	-76.2	125.6	167.8	0	0	0	0	0	107.7	R195	R195-A197 PolarHBondContact O-N 2.96Å; R195-A197 VanDerWaalsContact O-N 3.13Å
198	Y	54.5	Low	61	Low	226 Å²	226	135.1 Å²	135.1	89%	0.886	75%	0.745	S	S	*	*			trans	83.3	89.6	-176.9	-66.7	-93.4	0	0	0	117.2
199	T	48.9	Very low	58.7	Low	136 Å²	136	134.7 Å²	134.7	83%	0.834	75%	0.754	S	S	*	*			trans	-128.8	90.1	141	60.2	0	0	0	0	108.5
200	G	45.5	Very low	56.4	Low	73 Å²	73	133.1 Å²	133.1	75%	0.753	76%	0.759	S	S	*	*			trans	-68.2	135.1	160.6	0	0	0	0	0	109.4
201	N	39.7	Very low	54.3	Low	154 Å²	154	135.1 Å²	135.1	82%	0.824	78%	0.777	S	S	*	*			trans	16.3	114.5	163.7	-74.6	-10.8	0	0	0	118.1
202	Q	46.4	Very low	52.3	Low	198 Å²	198	137.8 Å²	137.8	93%	0.925	80%	0.796	S	S	*	*				-161.5	139.7	122.8	-106.2	169.6	92.8	0	0	112.8
203	T	45.2	Very low	50.7	Low	118 Å²	118	142 Å²	142	72%	0.724	81%	0.814	S	S	*	*			trans	-74	138.1	-172.4	50.4	0	0	0	0	113.5
204	N	42.7	Very low	48.9	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	82%	0.817	S	S	*	*				168.6	119.9	115.4	-101.4	-21.7	0	0	0	114
205	R	40.8	Very low	47.3	Very low	229 Å²	229	137.5 Å²	137.5	86%	0.864	83%	0.825	S	S	*	*				33.2	120.1	127.1	-64.8	179.4	171.7	-176	-1.5	120.6
206	S	46	Very low	45.8	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	82%	0.817	S	S	*	*				-177.8	103.1	123.1	36.6	0	0	0	0	108.7
207	S	43.9	Very low	44.4	Very low	123 Å²	123	132.2 Å²	132.2	86%	0.86	82%	0.816	S	S	*	*				71.2	103.7	100.3	67.5	0	0	0	0	115.2
208	G	42.6	Very low	43.7	Very low	83 Å²	83	137.9 Å²	137.9	86%	0.856	83%	0.825	S	S	*	*			trans	-160.3	100.8	164.2	0	0	0	0	0	109.3
209	S	39.5	Very low	43	Very low	130 Å²	130	135.4 Å²	135.4	91%	0.909	82%	0.821	S	S	*	*			trans	-80.5	154.1	-176.3	57.5	0	0	0	0	112.4
210	G	41.4	Very low	42.8	Very low	76 Å²	76	138.4 Å²	138.4	78%	0.784	83%	0.826	S	S	*	*			trans	175.2	63.9	173.6	0	0	0	0	0	116.9
211	S	41.3	Very low	42.7	Very low	131 Å²	131	140.2 Å²	140.2	92%	0.916	82%	0.822	S	S	*	*			trans	54	117.3	151.6	-104.7	0	0	0	0	122.5
212	A	40.2	Very low	43.2	Very low	93 Å²	93	142.7 Å²	142.7	77%	0.769	83%	0.826	S	S	*	*			trans	-78.5	155.1	168.9	0	0	0	0	0	113.5
213	K	45.1	Very low	43.5	Very low	221 Å²	221	139.9 Å²	139.9	96%	0.961	82%	0.817	S	S	*	*			trans	-144	130.6	137.3	-91.2	-178.5	-174.3	177.4	0	110.1
214	S	40.5	Very low	43.6	Very low	111 Å²	111	140 Å²	140	78%	0.776	82%	0.818	S	S	*	*			trans	-100.8	151.4	-170.4	-177.8	0	0	0	0	110.9
215	A	45.2	Very low	44.6	Very low	95 Å²	95	142.7 Å²	142.7	79%	0.785	84%	0.842	S	S	*	*			trans	-177.2	93.5	141.2	0	0	0	0	0	112.6
216	T	43.7	Very low	44.8	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	84%	0.841	S	S	*	*				40.6	108.5	122.9	-47.7	0	0	0	0	121.8
217	V	39.8	Very low	44.8	Very low	122 Å²	122	139.7 Å²	139.7	74%	0.739	84%	0.844	S	S	*	*				40.6	121.6	118.8	-174.5	0	0	0	0	119
218	K	43.8	Very low	44.8	Very low	207 Å²	207	140.7 Å²	140.7	90%	0.9	84%	0.843	S	S	*	*				-166.2	135	118.7	-104.7	174.5	-173.7	-175	0	113.1
219	Q	41.8	Very low	45	Very low	173 Å²	173	144.1 Å²	144.1	81%	0.808	84%	0.843	S	S	*	*			trans	-92.7	136.2	-177.4	-177.4	171.8	2.7	0	0	108.8
220	Q	43.9	Very low	45.3	Very low	199 Å²	199	144.9 Å²	144.9	93%	0.93	84%	0.839	S	S	*	*			trans	-160.7	124.4	147.4	-117.8	176.6	6.1	0	0	112.9
221	V	44.3	Very low	45.6	Very low	111 Å²	111	149.5 Å²	149.5	67%	0.673	84%	0.842	S	S	*	*			trans	-70.1	142	169.8	171.5	0	0	0	0	109.8
222	K	50	Low	45.9	Very low	207 Å²	207	150.9 Å²	150.9	90%	0.9	84%	0.837	S	S	*	*			trans	-161.8	122.3	136.5	-126.2	176.8	179.6	-177.3	0	113.5
223	D	51.4	Low	46.3	Very low	139 Å²	139	155.3 Å²	155.3	74%	0.743	84%	0.842	S	S	*	*			trans	-61.8	161	166.3	-67.5	-64.6	0	0	0	113.6
224	T	48.1	Very low	46.4	Very low	121 Å²	121	149.8 Å²	149.8	74%	0.742	83%	0.832	S	S	*	*			trans	-53.4	174.6	179.1	-10.9	0	0	0	0	116.4
225	P	64.3	Low	46.9	Very low	194 Å²	194	153.4 Å²	153.4	100%	1.26	84%	0.837	S	S	*	*				-96.9	0	121.5	30.3	-30.5	0	0	0	112

Retrieved 225 of 225 residues in 174.7 ms (Link to these results)

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