A0A087X4L7_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087X4L7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 467 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	43.8	Very low	49.7	Very low	250 Å²	250	133.3 Å²	133.3	100%	1.232	84%	0.839	S	S	*	*				0	97.7	0	-78.3	175.1	170.7	0	0	108.1
2	A	38.7	Very low	51.9	Low	94 Å²	94	131.1 Å²	131.1	78%	0.777	81%	0.813	S	S	*	*			trans	-112.4	107.7	170.4	0	0	0	0	0	106.6	T4	A2-T4 PolarHBondContact O-N 3.39Å
3	M	44.5	Very low	54.3	Low	192 Å²	192	125.4 Å²	125.4	95%	0.946	78%	0.781	S	S	*	*			trans	-77	103.2	176.3	-74	-89.5	-112.3	0	0	108.1	G5	M3-G5 PolarHBondContact O-N 2.83Å; M3-G5 VanDerWaalsContact O-N 3.11Å
4	T	45.7	Very low	55.8	Low	132 Å²	132	124.7 Å²	124.7	81%	0.81	77%	0.769	S	S	*	*			trans	-75.2	91.3	167.4	41.7	0	0	0	0	108.7	A2 Q6	A2-T4 PolarHBondContact O-N 3.39Å; T4-Q6 PolarHBondContact O-N 2.62Å
5	G	44.6	Very low	57.2	Low	73 Å²	73	123.6 Å²	123.6	75%	0.753	75%	0.752	S	S	*	*			trans	-64.1	104.7	167.8	0	0	0	0	0	109.5	M3 S7	M3-G5 PolarHBondContact O-N 2.83Å; M3-G5 VanDerWaalsContact O-N 3.11Å; G5-S7 PolarHBondContact O-N 3.15Å
6	Q	47.3	Very low	58.9	Low	191 Å²	191	119.5 Å²	119.5	89%	0.893	73%	0.727	S	S	*	*			trans	-60.8	107.2	162.8	-78.6	178.2	-16	0	0	107.4	T4 S8	T4-Q6 PolarHBondContact O-N 2.62Å; Q6-S8 PolarHBondContact O-N 3.16Å
7	S	49.2	Very low	60	Low	111 Å²	111	118.4 Å²	118.4	78%	0.776	71%	0.71	S	S	*	*			trans	-58.4	103.3	164.7	166.8	0	0	0	0	107.6	G5 C9	G5-S7 PolarHBondContact O-N 3.15Å; S7-C9 PolarHBondContact O-N 3.44Å
8	S	50.5	Low	60.9	Low	109 Å²	109	116.9 Å²	116.9	76%	0.762	69%	0.694	S	S	*	*			trans	-61.6	102.2	165.8	52.2	0	0	0	0	107.2	Q6 A10	Q6-S8 PolarHBondContact O-N 3.16Å; S8-A10 PolarHBondContact O-N 3.36Å
9	C	52.3	Low	62	Low	121 Å²	121	119.1 Å²	119.1	82%	0.818	69%	0.689	S	S	*	*			trans	-58.5	108	169.8	-158.4	0	0	0	0	106	S7 S11	S7-C9 PolarHBondContact O-N 3.44Å; C9-S11 PolarHBondContact O-N 3.04Å
10	A	61.3	Low	63.1	Low	88 Å²	88	117.4 Å²	117.4	73%	0.727	68%	0.681	S	S	*	*			trans	-55.8	109.8	-177.4	0	0	0	0	0	108	S8 M12	S8-A10 PolarHBondContact O-N 3.36Å; A10-M12 PolarHBondContact O-N 3.34Å
11	S	68.6	Low	63.9	Low	105 Å²	105	115.6 Å²	115.6	73%	0.734	67%	0.671	S	S	*	*			trans	-52.1	113.2	177.2	155.6	0	0	0	0	108.3	C9 S13	C9-S11 PolarHBondContact O-N 3.04Å; S11-S13 PolarHBondContact O-N 2.97Å
12	M	76.3	Confident	65.5	Low	107 Å²	107	108 Å²	108	53%	0.527	63%	0.634	S	S	.	*			trans	-51.4	130.7	178.8	-70.1	-172.4	71.7	0	0	110.1	A10 T16 K17	A10-M12 PolarHBondContact O-N 3.34Å; M12-T16 HydrophobicContact CE-CG2 3.46Å; M12-T16 VanDerWaalsContact CE-CG2 3.46Å; M12-K17 HydrophobicContact CB-CG 4.35Å; M12-K17 WeakPolarHBondContact O-CE 3.37Å
13	S	82.9	Confident	67.6	Low	57 Å²	57	105.7 Å²	105.7	40%	0.399	62%	0.615	S	S	.	*			trans	-59.3	147	-179.8	82.4	0	0	0	0	110.8	S11 H15 T16 K17	S11-S13 PolarHBondContact O-N 2.97Å; S13-H15 PolarHBondContact O-N 3.23Å; S13-T16 PolarHBondContact O-N 3.18Å; S13-T16 PolarHBondContact OG-N 2.87Å; S13-T16 VanDerWaalsContact OG-N 3.09Å; S13-T16 PolarHBondContact OG-OG1 3.37Å; S13-K17 PolarHBondContact O-N 3.25Å; S13-K17 VanDerWaalsContact O-N 3.09Å
14	N	76.1	Confident	69.6	Low	116 Å²	116	102.5 Å²	102.5	62%	0.62	60%	0.596	S	S	*	*	H	α-helix	trans	-57.5	-36	175.9	-71.9	-15	0	0	0	111.5	T16 K17 E18	N14-T16 PolarHBondContact O-N 3.27Å; N14-K17 PolarHBondContact O-N 3.36Å; N14-E18 WeakPolarHBondContact O-CG 3.21Å; N14-E18 PolarHBondContact O-N 2.97Å
15	H	77.1	Confident	71.1	Confident	108 Å²	108	98.2 Å²	98.2	50%	0.5	57%	0.569	S	S	.	*	H	α-helix	trans	-58.2	-43.9	173.4	179.9	70.1	0	0	0	112.8	S13 E18 R19	S13-H15 PolarHBondContact O-N 3.23Å; H15-E18 PolarHBondContact O-N 2.97Å; H15-R19 WeakPolarHBondContact NE2-CD 3.28Å; H15-R19 WeakPolarHBondContact O-CG 3.28Å; H15-R19 PolarHBondContact O-N 3.48Å
16	T	83.1	Confident	72.7	Confident	58 Å²	58	97.9 Å²	97.9	36%	0.356	55%	0.553	S	S	.	*	H	α-helix	trans	-66.4	-41.1	177.4	-48	0	0	0	0	111.1	M12 S13 N14 R19 V20	M12-T16 HydrophobicContact CE-CG2 3.46Å; M12-T16 VanDerWaalsContact CE-CG2 3.46Å; S13-T16 PolarHBondContact O-N 3.18Å; S13-T16 PolarHBondContact OG-N 2.87Å; S13-T16 VanDerWaalsContact OG-N 3.09Å; S13-T16 PolarHBondContact OG-OG1 3.37Å; N14-T16 PolarHBondContact O-N 3.27Å; T16-R19 PolarHBondContact O-N 3.07Å; T16-V20 WeakPolarHBondContact O-CG2 3.37Å; T16-V20 PolarHBondContact O-N 3.18Å
17	K	78.4	Confident	74.5	Confident	100 Å²	100	93.7 Å²	93.7	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-45.2	176.5	-67	176.1	-176.4	168.7	0	111.5	M12 S13 N14 R19 V20 T21	M12-K17 HydrophobicContact CB-CG 4.35Å; M12-K17 WeakPolarHBondContact O-CE 3.37Å; S13-K17 PolarHBondContact O-N 3.25Å; S13-K17 VanDerWaalsContact O-N 3.09Å; N14-K17 PolarHBondContact O-N 3.36Å; K17-R19 PolarHBondContact O-N 3.14Å; K17-V20 PolarHBondContact O-N 3.2Å; K17-T21 PolarHBondContact O-N 2.95Å; K17-T21 PolarHBondContact O-OG1 3.43Å; K17-T21 VanDerWaalsContact O-OG1 3.07Å
18	E	75.3	Confident	76.2	Confident	92 Å²	92	93.1 Å²	93.1	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-45.1	176.2	-75.4	169.9	-175.9	0	0	112	N14 H15 V20 T21 M22 N436	N14-E18 WeakPolarHBondContact O-CG 3.21Å; N14-E18 PolarHBondContact O-N 2.97Å; H15-E18 PolarHBondContact O-N 2.97Å; E18-V20 PolarHBondContact O-N 3.32Å; E18-T21 PolarHBondContact O-N 3.15Å; E18-M22 WeakPolarHBondContact O-CB 3.38Å; E18-M22 PolarHBondContact O-N 2.82Å; E18-N436 PolarHBondContact OE2-ND2 3.01Å
19	R	81.6	Confident	77.5	Confident	158 Å²	158	89.9 Å²	89.9	60%	0.596	50%	0.495	S	S	*	.	H	α-helix	trans	-63.5	-38.8	177.1	-74.6	-169.9	66.2	-174.2	-0.1	113.2	H15 T16 K17 M22 A23	H15-R19 WeakPolarHBondContact NE2-CD 3.28Å; H15-R19 WeakPolarHBondContact O-CG 3.28Å; H15-R19 PolarHBondContact O-N 3.48Å; T16-R19 PolarHBondContact O-N 3.07Å; K17-R19 PolarHBondContact O-N 3.14Å; R19-M22 PolarHBondContact O-N 3.23Å; R19-A23 WeakPolarHBondContact O-CB 3.41Å; R19-A23 PolarHBondContact O-N 2.86Å
20	V	85.9	Confident	78.9	Confident	86 Å²	86	89.8 Å²	89.8	52%	0.521	48%	0.481	S	S	.	.	H	α-helix	trans	-65.4	-44.9	175.6	170.7	0	0	0	0	110.4	T16 K17 E18 M22 A23 K24	T16-V20 WeakPolarHBondContact O-CG2 3.37Å; T16-V20 PolarHBondContact O-N 3.18Å; K17-V20 PolarHBondContact O-N 3.2Å; E18-V20 PolarHBondContact O-N 3.32Å; V20-M22 PolarHBondContact O-N 2.8Å; V20-A23 PolarHBondContact O-N 2.82Å; V20-K24 WeakPolarHBondContact O-CB 3.28Å; V20-K24 PolarHBondContact O-N 2.74Å
21	T	79	Confident	80.2	Confident	79 Å²	79	92.2 Å²	92.2	49%	0.485	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-47	175.2	-59.1	0	0	0	0	111.2	K17 E18 A23 K24 V25	K17-T21 PolarHBondContact O-N 2.95Å; K17-T21 PolarHBondContact O-OG1 3.43Å; K17-T21 VanDerWaalsContact O-OG1 3.07Å; E18-T21 PolarHBondContact O-N 3.15Å; T21-A23 PolarHBondContact O-N 3.3Å; T21-K24 PolarHBondContact O-N 3.19Å; T21-V25 HydrophobicContact CG2-CG2 4.48Å; T21-V25 WeakPolarHBondContact O-CG2 3.49Å; T21-V25 PolarHBondContact O-N 2.88Å
22	M	76.8	Confident	80.8	Confident	90 Å²	90	90.7 Å²	90.7	44%	0.443	46%	0.462	S	S	.	.	H	α-helix	trans	-60.3	-45.1	177.1	-173.9	-173	75.2	0	0	111.8	E18 R19 V20 T26 I442	E18-M22 WeakPolarHBondContact O-CB 3.38Å; E18-M22 PolarHBondContact O-N 2.82Å; R19-M22 PolarHBondContact O-N 3.23Å; V20-M22 PolarHBondContact O-N 2.8Å; M22-T26 VanDerWaalsContact O-CB 3.29Å; M22-T26 WeakPolarHBondContact O-CB 3.16Å; M22-T26 PolarHBondContact O-N 3.17Å; M22-T26 PolarHBondContact O-OG1 2.95Å; M22-I442 HydrophobicContact CG-CD1 4.48Å
23	A	83.9	Confident	81	Confident	46 Å²	46	88.7 Å²	88.7	38%	0.38	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-44.2	178.7	0	0	0	0	0	111.7	R19 V20 T21 T26 L27	R19-A23 WeakPolarHBondContact O-CB 3.41Å; R19-A23 PolarHBondContact O-N 2.86Å; V20-A23 PolarHBondContact O-N 2.82Å; T21-A23 PolarHBondContact O-N 3.3Å; A23-T26 PolarHBondContact O-N 3.19Å; A23-L27 WeakPolarHBondContact O-CG 3.33Å; A23-L27 PolarHBondContact O-N 3.05Å
24	K	85.4	Confident	81.1	Confident	125 Å²	125	90.4 Å²	90.4	54%	0.543	46%	0.457	S	S	.	.	H	α-helix	trans	-58	-55	176	179.4	-179.7	173.3	-177.8	0	111.2	V20 T21 T26 L27 E28	V20-K24 WeakPolarHBondContact O-CB 3.28Å; V20-K24 PolarHBondContact O-N 2.74Å; T21-K24 PolarHBondContact O-N 3.19Å; K24-T26 VanDerWaalsContact C-N 3.26Å; K24-T26 PolarHBondContact O-N 3.38Å; K24-L27 PolarHBondContact O-N 3.41Å; K24-L27 VanDerWaalsContact O-N 3.17Å; K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 HydrophobicContact CG-CG 4.44Å; K24-E28 IonicContact NZ-OE1 3.81Å; K24-E28 WeakPolarHBondContact O-CG 3.49Å; K24-E28 PolarHBondContact O-N 2.78Å
25	V	76.6	Confident	81.7	Confident	42 Å²	42	89.6 Å²	89.6	26%	0.255	45%	0.452	S	S	.	.	H	α-helix	trans	-59.3	-39.4	179.4	170.8	0	0	0	0	111	T21 N29	T21-V25 HydrophobicContact CG2-CG2 4.48Å; T21-V25 WeakPolarHBondContact O-CG2 3.49Å; T21-V25 PolarHBondContact O-N 2.88Å; V25-N29 VanDerWaalsContact CG1-ND2 3.34Å; V25-N29 WeakPolarHBondContact CG1-ND2 3.39Å; V25-N29 VanDerWaalsContact O-CB 3.22Å; V25-N29 WeakPolarHBondContact O-CB 3.22Å; V25-N29 PolarHBondContact O-N 2.76Å; V25-N29 PolarHBondContact O-ND2 3.43Å
26	T	78.3	Confident	82	Confident	66 Å²	66	86.1 Å²	86.1	41%	0.405	44%	0.442	S	S	.	.	H	α-helix	trans	-64	-44.1	178.1	-57.7	0	0	0	0	111.9	M22 A23 K24 F30	M22-T26 VanDerWaalsContact O-CB 3.29Å; M22-T26 WeakPolarHBondContact O-CB 3.16Å; M22-T26 PolarHBondContact O-N 3.17Å; M22-T26 PolarHBondContact O-OG1 2.95Å; A23-T26 PolarHBondContact O-N 3.19Å; K24-T26 VanDerWaalsContact C-N 3.26Å; K24-T26 PolarHBondContact O-N 3.38Å; T26-F30 WeakPolarHBondContact O-CB 3.29Å; T26-F30 PolarHBondContact O-N 3.43Å
27	L	86.7	Confident	82	Confident	104 Å²	104	86.8 Å²	86.8	55%	0.545	44%	0.441	S	S	.	.	H	α-helix	trans	-69.9	-44.3	-179.8	-73.6	170.8	0	0	0	112.3	A23 K24 N29 F30 Y31	A23-L27 WeakPolarHBondContact O-CG 3.33Å; A23-L27 PolarHBondContact O-N 3.05Å; K24-L27 PolarHBondContact O-N 3.41Å; K24-L27 VanDerWaalsContact O-N 3.17Å; L27-N29 VanDerWaalsContact C-N 3.34Å; L27-N29 PolarHBondContact O-N 2.94Å; L27-F30 PolarHBondContact O-N 3.42Å; L27-Y31 WeakPolarHBondContact O-CD2 3.47Å; L27-Y31 PolarHBondContact O-N 2.96Å; L27-Y31 VanDerWaalsContact O-N 3.11Å
28	E	84.6	Confident	82.4	Confident	98 Å²	98	87.4 Å²	87.4	46%	0.458	45%	0.445	S	S	.	.	H	α-helix	trans	-57.5	-50.3	175.7	-72.8	173.5	165.6	0	0	109.9	K24 F30 Y31 S32	K24-E28 WeakPolarHBondContact CE-OE1 3.48Å; K24-E28 HydrophobicContact CG-CG 4.44Å; K24-E28 IonicContact NZ-OE1 3.81Å; K24-E28 WeakPolarHBondContact O-CG 3.49Å; K24-E28 PolarHBondContact O-N 2.78Å; E28-F30 VanDerWaalsContact C-N 3.33Å; E28-F30 PolarHBondContact O-N 2.88Å; E28-Y31 PolarHBondContact O-N 2.82Å; E28-S32 WeakPolarHBondContact O-CB 3.35Å; E28-S32 PolarHBondContact O-N 2.83Å; E28-S32 PolarHBondContact O-OG 2.69Å; E28-S32 VanDerWaalsContact O-OG 3.12Å
29	N	76.5	Confident	83	Confident	41 Å²	41	88.3 Å²	88.3	22%	0.219	45%	0.449	C	S	.	.	H	α-helix	trans	-60.4	-39.9	176.4	-74.8	-35.9	0	0	0	113.1	V25 L27 N33 N443	V25-N29 VanDerWaalsContact CG1-ND2 3.34Å; V25-N29 WeakPolarHBondContact CG1-ND2 3.39Å; V25-N29 VanDerWaalsContact O-CB 3.22Å; V25-N29 WeakPolarHBondContact O-CB 3.22Å; V25-N29 PolarHBondContact O-N 2.76Å; V25-N29 PolarHBondContact O-ND2 3.43Å; L27-N29 VanDerWaalsContact C-N 3.34Å; L27-N29 PolarHBondContact O-N 2.94Å; N29-N33 WeakPolarHBondContact O-CB 3.46Å; N29-N33 PolarHBondContact O-N 3.18Å; N29-N33 PolarHBondContact O-ND2 3.45Å; N29-N443 PolarHBondContact ND2-ND2 3.45Å; N29-N443 PolarHBondContact OD1-ND2 3.3Å; N29-N443 VanDerWaalsContact OD1-ND2 3.1Å
30	F	83.3	Confident	83.2	Confident	119 Å²	119	84.6 Å²	84.6	52%	0.522	44%	0.439	S	S	.	.	H	α-helix	trans	-60	-50.8	179.3	175.9	-95.5	0	0	0	111.5	T26 L27 E28 L34	T26-F30 WeakPolarHBondContact O-CB 3.29Å; T26-F30 PolarHBondContact O-N 3.43Å; L27-F30 PolarHBondContact O-N 3.42Å; E28-F30 VanDerWaalsContact C-N 3.33Å; E28-F30 PolarHBondContact O-N 2.88Å; F30-L34 HydrophobicContact CE1-CD2 4.42Å; F30-L34 WeakPolarHBondContact O-CB 3.46Å; F30-L34 PolarHBondContact O-N 3.13Å
31	Y	87.1	Confident	83.3	Confident	140 Å²	140	85.2 Å²	85.2	55%	0.549	43%	0.432	S	S	.	.	H	α-helix	trans	-72.3	-39.6	-178.4	-77.4	-71.1	0	0	0	112.7	L27 E28 N33 L34 I35	L27-Y31 WeakPolarHBondContact O-CD2 3.47Å; L27-Y31 PolarHBondContact O-N 2.96Å; L27-Y31 VanDerWaalsContact O-N 3.11Å; E28-Y31 PolarHBondContact O-N 2.82Å; Y31-N33 VanDerWaalsContact C-N 3.34Å; Y31-N33 PolarHBondContact O-N 2.82Å; Y31-L34 HydrophobicContact CD1-CD2 4.38Å; Y31-L34 PolarHBondContact O-N 2.97Å; Y31-I35 WeakPolarHBondContact O-CG1 3.33Å; Y31-I35 PolarHBondContact O-N 3.5Å
32	S	82.3	Confident	83.9	Confident	73 Å²	73	85 Å²	85	51%	0.51	43%	0.425	S	S	.	.	H	α-helix	trans	-58.8	-46.1	173.5	-66.3	0	0	0	0	111.6	E28 L34 I35 A36	E28-S32 WeakPolarHBondContact O-CB 3.35Å; E28-S32 PolarHBondContact O-N 2.83Å; E28-S32 PolarHBondContact O-OG 2.69Å; E28-S32 VanDerWaalsContact O-OG 3.12Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 3.5Å; S32-I35 PolarHBondContact O-N 2.81Å; S32-A36 WeakPolarHBondContact O-CB 3.23Å; S32-A36 PolarHBondContact O-N 3.12Å
33	N	79.9	Confident	84.5	Confident	65 Å²	65	86 Å²	86	35%	0.348	43%	0.43	S	S	.	.	H	α-helix	trans	-64.5	-38.3	175.9	-73.9	-28.8	0	0	0	111.9	N29 Y31 I35 Q37	N29-N33 WeakPolarHBondContact O-CB 3.46Å; N29-N33 PolarHBondContact O-N 3.18Å; N29-N33 PolarHBondContact O-ND2 3.45Å; Y31-N33 VanDerWaalsContact C-N 3.34Å; Y31-N33 PolarHBondContact O-N 2.82Å; N33-I35 VanDerWaalsContact C-N 3.35Å; N33-Q37 VanDerWaalsContact O-CB 3.29Å; N33-Q37 WeakPolarHBondContact O-CB 3.27Å; N33-Q37 WeakPolarHBondContact O-CG 3.32Å; N33-Q37 PolarHBondContact O-N 3.31Å
34	L	85.2	Confident	84.8	Confident	93 Å²	93	86 Å²	86	49%	0.487	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-43.2	178.9	-175.1	66.5	0	0	0	111.6	F30 Y31 S32 H38	F30-L34 HydrophobicContact CE1-CD2 4.42Å; F30-L34 WeakPolarHBondContact O-CB 3.46Å; F30-L34 PolarHBondContact O-N 3.13Å; Y31-L34 HydrophobicContact CD1-CD2 4.38Å; Y31-L34 PolarHBondContact O-N 2.97Å; S32-L34 VanDerWaalsContact C-N 3.34Å; S32-L34 PolarHBondContact O-N 3.5Å; L34-H38 PolarHBondContact O-N 3.4Å
35	I	87.9	Confident	85	Confident	99 Å²	99	84.1 Å²	84.1	51%	0.508	41%	0.414	S	S	.	.	H	α-helix	trans	-65.5	-53.3	177.6	-66.5	166.1	0	0	0	110.3	Y31 S32 N33 Q37 H38 E39	Y31-I35 WeakPolarHBondContact O-CG1 3.33Å; Y31-I35 PolarHBondContact O-N 3.5Å; S32-I35 PolarHBondContact O-N 2.81Å; N33-I35 VanDerWaalsContact C-N 3.35Å; I35-Q37 PolarHBondContact O-N 3.43Å; I35-H38 WeakPolarHBondContact O-CB 3.42Å; I35-H38 PolarHBondContact O-N 2.86Å; I35-E39 HydrophobicContact CG2-CG 4.44Å; I35-E39 PolarHBondContact O-N 2.85Å
36	A	83.4	Confident	85.7	Confident	35 Å²	35	88.1 Å²	88.1	29%	0.289	43%	0.43	S	S	.	.	H	α-helix	trans	-56.2	-40.6	179.9	0	0	0	0	0	111.9	S32 H38 E39 E40	S32-A36 WeakPolarHBondContact O-CB 3.23Å; S32-A36 PolarHBondContact O-N 3.12Å; A36-H38 VanDerWaalsContact C-N 3.32Å; A36-H38 PolarHBondContact O-N 3.49Å; A36-E39 PolarHBondContact O-N 3.17Å; A36-E40 WeakPolarHBondContact O-CB 3.46Å; A36-E40 VanDerWaalsContact O-CG 3.31Å; A36-E40 WeakPolarHBondContact O-CG 3.2Å; A36-E40 PolarHBondContact O-N 3.11Å
37	Q	83.3	Confident	86.3	Confident	71 Å²	71	92 Å²	92	33%	0.332	44%	0.441	S	S	.	.	H	α-helix	trans	-66	-32.9	177.6	-72.9	177.9	40.9	0	0	113.7	N33 I35 R41 K80	N33-Q37 VanDerWaalsContact O-CB 3.29Å; N33-Q37 WeakPolarHBondContact O-CB 3.27Å; N33-Q37 WeakPolarHBondContact O-CG 3.32Å; N33-Q37 PolarHBondContact O-N 3.31Å; I35-Q37 PolarHBondContact O-N 3.43Å; Q37-R41 WeakPolarHBondContact O-CB 3.43Å; Q37-R41 PolarHBondContact O-N 3.02Å; Q37-K80 VanDerWaalsContact CG-NZ 3.27Å
38	H	86.9	Confident	86.4	Confident	113 Å²	113	88.6 Å²	88.6	52%	0.523	42%	0.423	S	S	.	.	H	α-helix	trans	-69.5	-47.4	174.2	179.2	49.1	0	0	0	110.5	L34 I35 A36 E40 R41 E42	L34-H38 PolarHBondContact O-N 3.4Å; I35-H38 WeakPolarHBondContact O-CB 3.42Å; I35-H38 PolarHBondContact O-N 2.86Å; A36-H38 VanDerWaalsContact C-N 3.32Å; A36-H38 PolarHBondContact O-N 3.49Å; H38-E40 PolarHBondContact O-N 3.42Å; H38-R41 WeakPolarHBondContact O-CB 3.19Å; H38-R41 PolarHBondContact O-N 3.33Å; H38-R41 VanDerWaalsContact O-N 3.15Å; H38-E42 IonicContact CE1-OE1 3.11Å; H38-E42 PolarHBondContact O-N 3.49Å
39	E	88.4	Confident	86.8	Confident	111 Å²	111	86.1 Å²	86.1	52%	0.519	41%	0.411	S	S	.	.	H	α-helix	trans	-59.2	-46.6	177.3	-68.5	175.5	166.6	0	0	112	I35 A36 R41 E42 M43	I35-E39 HydrophobicContact CG2-CG 4.44Å; I35-E39 PolarHBondContact O-N 2.85Å; A36-E39 PolarHBondContact O-N 3.17Å; E39-R41 VanDerWaalsContact C-N 3.26Å; E39-R41 PolarHBondContact O-N 2.89Å; E39-E42 PolarHBondContact O-N 3.31Å; E39-M43 WeakPolarHBondContact O-CB 3.26Å; E39-M43 WeakPolarHBondContact O-CG 3.46Å; E39-M43 PolarHBondContact O-N 3.32Å
40	E	86.1	Confident	87.6	Confident	80 Å²	80	90.7 Å²	90.7	37%	0.374	43%	0.429	S	S	.	.	H	α-helix	trans	-57.4	-39.2	175.6	-78.7	178.6	-166.9	0	0	112.8	A36 H38 M43 R44	A36-E40 WeakPolarHBondContact O-CB 3.46Å; A36-E40 VanDerWaalsContact O-CG 3.31Å; A36-E40 WeakPolarHBondContact O-CG 3.2Å; A36-E40 PolarHBondContact O-N 3.11Å; H38-E40 PolarHBondContact O-N 3.42Å; E40-M43 HydrophobicContact CG-CE 4.45Å; E40-R44 WeakPolarHBondContact O-CG 3.33Å; E40-R44 PolarHBondContact O-N 3.48Å; E40-R44 IonicContact OE2-NH1 3.84Å; E40-R44 PolarHBondContact OE2-NH1 3Å
41	R	87.4	Confident	87.9	Confident	100 Å²	100	87.3 Å²	87.3	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-68	-44.4	179.1	-179.7	176.4	177.8	-161.5	-2.2	111.4	Q37 H38 E39 R44 Q45 E73	Q37-R41 WeakPolarHBondContact O-CB 3.43Å; Q37-R41 PolarHBondContact O-N 3.02Å; H38-R41 WeakPolarHBondContact O-CB 3.19Å; H38-R41 PolarHBondContact O-N 3.33Å; H38-R41 VanDerWaalsContact O-N 3.15Å; E39-R41 VanDerWaalsContact C-N 3.26Å; E39-R41 PolarHBondContact O-N 2.89Å; R41-R44 PolarHBondContact O-N 3.08Å; R41-Q45 PolarHBondContact O-N 2.57Å; R41-Q45 VanDerWaalsContact O-N 3.07Å; R41-E73 IonicContact NE-OE2 3.26Å
42	E	91	Very high	88.1	Confident	74 Å²	74	80.6 Å²	80.6	35%	0.346	39%	0.392	S	S	.	.	H	α-helix	trans	-61.7	-44.7	174.7	-69.2	-62.3	129.6	0	0	110.9	H38 E39 R44 Q45 Q46	H38-E42 IonicContact CE1-OE1 3.11Å; H38-E42 PolarHBondContact O-N 3.49Å; E39-E42 PolarHBondContact O-N 3.31Å; E42-R44 PolarHBondContact O-N 3.49Å; E42-Q45 PolarHBondContact O-N 3.44Å; E42-Q46 WeakPolarHBondContact O-CG 3.3Å; E42-Q46 PolarHBondContact O-N 3.36Å
43	M	89.3	Confident	88.5	Confident	111 Å²	111	81.5 Å²	81.5	55%	0.547	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-42.4	176.7	-74.8	-168.7	-71.2	0	0	112.5	E39 E40 Q45 Q46 K47	E39-M43 WeakPolarHBondContact O-CB 3.26Å; E39-M43 WeakPolarHBondContact O-CG 3.46Å; E39-M43 PolarHBondContact O-N 3.32Å; E40-M43 HydrophobicContact CG-CE 4.45Å; M43-Q45 VanDerWaalsContact C-N 3.34Å; M43-Q45 PolarHBondContact O-N 3.27Å; M43-Q46 PolarHBondContact O-N 3.04Å; M43-K47 WeakPolarHBondContact O-CB 3.22Å; M43-K47 PolarHBondContact O-N 3.43Å
44	R	90.5	Very high	89	Confident	47 Å²	47	85.2 Å²	85.2	18%	0.177	41%	0.406	C	S	.	.	H	α-helix	trans	-62.1	-41.8	175.5	-77.5	-170.3	-61.4	-86.1	-3.5	111.9	E40 R41 E42 K47 L48 E73	E40-R44 WeakPolarHBondContact O-CG 3.33Å; E40-R44 PolarHBondContact O-N 3.48Å; E40-R44 IonicContact OE2-NH1 3.84Å; E40-R44 PolarHBondContact OE2-NH1 3Å; R41-R44 PolarHBondContact O-N 3.08Å; E42-R44 PolarHBondContact O-N 3.49Å; R44-K47 PolarHBondContact O-N 3.34Å; R44-L48 PolarHBondContact O-N 3.16Å; R44-E73 IonicContact CZ-OE1 2.71Å; R44-E73 IonicContact NE-OE1 3.74Å; R44-E73 PolarHBondContact NE-OE1 3.41Å; R44-E73 IonicContact NH2-OE1 3.73Å; R44-E73 PolarHBondContact NH2-OE1 2.85Å; R44-E73 VanDerWaalsContact NH2-OE1 3.11Å; R44-E73 IonicContact NH2-OE2 2.78Å; R44-E73 PolarHBondContact NH2-OE2 3.1Å
45	Q	90.1	Very high	89.3	Confident	85 Å²	85	85.8 Å²	85.8	40%	0.397	41%	0.406	S	S	.	.	H	α-helix	trans	-63.5	-46.4	175.5	-178.5	171.3	-10.8	0	0	111.6	R41 E42 M43 K47 L48 E49	R41-Q45 PolarHBondContact O-N 2.57Å; R41-Q45 VanDerWaalsContact O-N 3.07Å; E42-Q45 PolarHBondContact O-N 3.44Å; M43-Q45 VanDerWaalsContact C-N 3.34Å; M43-Q45 PolarHBondContact O-N 3.27Å; Q45-K47 VanDerWaalsContact C-N 3.33Å; Q45-K47 PolarHBondContact O-N 2.61Å; Q45-L48 WeakPolarHBondContact O-CB 3.27Å; Q45-L48 PolarHBondContact O-N 3.22Å; Q45-E49 WeakPolarHBondContact O-CG 3.49Å; Q45-E49 PolarHBondContact O-N 3.47Å
46	Q	92	Very high	89.4	Confident	126 Å²	126	84 Å²	84	59%	0.589	41%	0.413	S	S	*	.	H	α-helix	trans	-61	-41.1	176.8	-70.2	173.3	17.1	0	0	112.2	E42 M43 L48 E49 K50	E42-Q46 WeakPolarHBondContact O-CG 3.3Å; E42-Q46 PolarHBondContact O-N 3.36Å; M43-Q46 PolarHBondContact O-N 3.04Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 2.76Å; Q46-E49 PolarHBondContact O-N 3.04Å; Q46-K50 WeakPolarHBondContact O-CB 3.25Å; Q46-K50 PolarHBondContact O-N 3.32Å
47	K	90.1	Very high	89.6	Confident	148 Å²	148	83.5 Å²	83.5	64%	0.643	41%	0.405	S	S	*	.	H	α-helix	trans	-61.6	-42.1	175.8	-172.6	175.7	-178.7	177.6	0	111.4	M43 R44 Q45 K50 V51	M43-K47 WeakPolarHBondContact O-CB 3.22Å; M43-K47 PolarHBondContact O-N 3.43Å; R44-K47 PolarHBondContact O-N 3.34Å; Q45-K47 VanDerWaalsContact C-N 3.33Å; Q45-K47 PolarHBondContact O-N 2.61Å; K47-K50 PolarHBondContact O-N 2.92Å; K47-V51 VanDerWaalsContact O-CG2 3.31Å; K47-V51 WeakPolarHBondContact O-CG2 2.94Å; K47-V51 PolarHBondContact O-N 3.15Å
48	L	90.1	Very high	90.1	Very high	32 Å²	32	83.3 Å²	83.3	17%	0.168	42%	0.415	C	S	.	.	H	α-helix	trans	-59.5	-49.8	175.2	177.2	69.8	0	0	0	111.4	R44 Q45 Q46 K50 V51 M52 H69	R44-L48 PolarHBondContact O-N 3.16Å; Q45-L48 WeakPolarHBondContact O-CB 3.27Å; Q45-L48 PolarHBondContact O-N 3.22Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 2.76Å; L48-K50 VanDerWaalsContact C-N 3.34Å; L48-K50 PolarHBondContact O-N 3.35Å; L48-V51 PolarHBondContact O-N 2.92Å; L48-M52 HydrophobicContact CD1-CG 4.27Å; L48-M52 HydrophobicContact CD1-SD 4.27Å; L48-M52 HydrophobicContact CD2-CE 4.35Å; L48-M52 HydrophobicContact CG-CE 3.96Å; L48-M52 HydrophobicContact CG-CG 4.44Å; L48-M52 HydrophobicContact CG-SD 4.16Å; L48-M52 VanDerWaalsContact O-CG 3.3Å; L48-M52 WeakPolarHBondContact O-CG 3.09Å; L48-M52 PolarHBondContact O-N 3.25Å; L48-H69 HydrophobicContact CD2-CB 3.47Å; L48-H69 VanDerWaalsContact CD2-CB 3.47Å
49	E	92.1	Very high	90.2	Very high	45 Å²	45	84.4 Å²	84.4	21%	0.21	43%	0.425	C	S	.	.	H	α-helix	trans	-59.1	-46.4	179.3	-64	-59.4	151.1	0	0	111.2	Q45 Q46 V51 M52 D53 R66	Q45-E49 WeakPolarHBondContact O-CG 3.49Å; Q45-E49 PolarHBondContact O-N 3.47Å; Q46-E49 PolarHBondContact O-N 3.04Å; E49-V51 PolarHBondContact O-N 3.41Å; E49-M52 HydrophobicContact CG-CE 4.4Å; E49-M52 PolarHBondContact O-N 3.43Å; E49-M52 WeakPolarHBondContact OE1-CE 3.16Å; E49-M52 WeakPolarHBondContact OE2-CE 3.32Å; E49-D53 PolarHBondContact O-N 3.01Å; E49-R66 IonicContact OE1-CZ 3.13Å; E49-R66 IonicContact OE1-NE 2.67Å; E49-R66 PolarHBondContact OE1-NE 2.99Å; E49-R66 IonicContact OE1-NH2 3.36Å; E49-R66 IonicContact OE2-CZ 2.9Å; E49-R66 IonicContact OE2-NE 3.87Å; E49-R66 PolarHBondContact OE2-NE 3.29Å; E49-R66 IonicContact OE2-NH2 2.77Å; E49-R66 PolarHBondContact OE2-NH2 2.98Å
50	K	92.3	Very high	90.4	Very high	137 Å²	137	83.5 Å²	83.5	60%	0.596	42%	0.421	S	S	*	.	H	α-helix	trans	-59.3	-43.4	177.7	-171.7	177.1	-179.8	-179.6	0	112.7	Q46 K47 L48 D53 Q54	Q46-K50 WeakPolarHBondContact O-CB 3.25Å; Q46-K50 PolarHBondContact O-N 3.32Å; K47-K50 PolarHBondContact O-N 2.92Å; L48-K50 VanDerWaalsContact C-N 3.34Å; L48-K50 PolarHBondContact O-N 3.35Å; K50-D53 PolarHBondContact O-N 2.81Å; K50-Q54 WeakPolarHBondContact O-CB 3.25Å; K50-Q54 VanDerWaalsContact O-CG 3.24Å; K50-Q54 WeakPolarHBondContact O-CG 3.43Å; K50-Q54 PolarHBondContact O-N 3.2Å
51	V	90.3	Very high	90.6	Very high	48 Å²	48	84.1 Å²	84.1	29%	0.291	42%	0.424	S	S	.	.	H	α-helix	trans	-65.5	-43.8	177.2	170	0	0	0	0	111	K47 L48 E49 D53 Q54 E55	K47-V51 VanDerWaalsContact O-CG2 3.31Å; K47-V51 WeakPolarHBondContact O-CG2 2.94Å; K47-V51 PolarHBondContact O-N 3.15Å; L48-V51 PolarHBondContact O-N 2.92Å; E49-V51 PolarHBondContact O-N 3.41Å; V51-D53 VanDerWaalsContact C-N 3.28Å; V51-D53 PolarHBondContact O-N 3.23Å; V51-Q54 PolarHBondContact O-N 3.43Å; V51-E55 WeakPolarHBondContact CG1-OE1 3.5Å; V51-E55 WeakPolarHBondContact O-CG 3.26Å; V51-E55 PolarHBondContact O-N 2.77Å
52	M	91.8	Very high	90.7	Very high	0 Å²	0	80.8 Å²	80.8	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-63.6	-34.4	177.9	-70.6	-171.1	-54	0	0	112.9	L48 E49 G56 L57 K62 R65 R66	L48-M52 HydrophobicContact CD1-CG 4.27Å; L48-M52 HydrophobicContact CD1-SD 4.27Å; L48-M52 HydrophobicContact CD2-CE 4.35Å; L48-M52 HydrophobicContact CG-CE 3.96Å; L48-M52 HydrophobicContact CG-CG 4.44Å; L48-M52 HydrophobicContact CG-SD 4.16Å; L48-M52 VanDerWaalsContact O-CG 3.3Å; L48-M52 WeakPolarHBondContact O-CG 3.09Å; L48-M52 PolarHBondContact O-N 3.25Å; E49-M52 HydrophobicContact CG-CE 4.4Å; E49-M52 PolarHBondContact O-N 3.43Å; E49-M52 WeakPolarHBondContact OE1-CE 3.16Å; E49-M52 WeakPolarHBondContact OE2-CE 3.32Å; M52-G56 PolarHBondContact O-N 3.11Å; M52-L57 HydrophobicContact CB-CD1 3.99Å; M52-L57 HydrophobicContact CG-CD1 3.87Å; M52-L57 PolarHBondContact O-N 2.91Å; M52-K62 HydrophobicContact CB-CG 4.27Å; M52-K62 HydrophobicContact SD-CB 4.13Å; M52-K62 HydrophobicContact SD-CG 4.23Å; M52-R65 HydrophobicContact SD-CB 3.61Å; M52-R65 HydrophobicContact SD-CG 4.44Å; M52-R66 HydrophobicContact CE-CG 3.9Å; M52-R66 HydrophobicContact SD-CG 4.49Å
53	D	89.9	Confident	90.7	Very high	92 Å²	92	84.5 Å²	84.5	49%	0.492	42%	0.423	S	S	.	.	H	α-helix	trans	-73.3	-41.2	175.9	-71.4	-20.8	0	0	0	112	E49 K50 V51 E55 G56 K62	E49-D53 PolarHBondContact O-N 3.01Å; K50-D53 PolarHBondContact O-N 2.81Å; V51-D53 VanDerWaalsContact C-N 3.28Å; V51-D53 PolarHBondContact O-N 3.23Å; D53-E55 VanDerWaalsContact C-N 3.32Å; D53-E55 PolarHBondContact O-N 3.19Å; D53-G56 PolarHBondContact O-N 3.33Å; D53-G56 VanDerWaalsContact O-N 3.12Å; D53-K62 IonicContact OD1-NZ 3.32Å; D53-K62 PolarHBondContact OD1-NZ 2.97Å
54	Q	91.6	Very high	90.8	Very high	142 Å²	142	83.1 Å²	83.1	66%	0.664	42%	0.417	S	S	*	.	H	α-helix	trans	-63	-37.3	175.9	-76.4	175	-15.4	0	0	112.8	K50 V51 G56	K50-Q54 WeakPolarHBondContact O-CB 3.25Å; K50-Q54 VanDerWaalsContact O-CG 3.24Å; K50-Q54 WeakPolarHBondContact O-CG 3.43Å; K50-Q54 PolarHBondContact O-N 3.2Å; V51-Q54 PolarHBondContact O-N 3.43Å; Q54-G56 PolarHBondContact O-N 3.25Å
55	E	90.6	Very high	90.7	Very high	105 Å²	105	83.8 Å²	83.8	49%	0.491	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-6.9	176.3	-71.2	178.5	-164.5	0	0	113.3	V51 D53 L57 R65	V51-E55 WeakPolarHBondContact CG1-OE1 3.5Å; V51-E55 WeakPolarHBondContact O-CG 3.26Å; V51-E55 PolarHBondContact O-N 2.77Å; D53-E55 VanDerWaalsContact C-N 3.32Å; D53-E55 PolarHBondContact O-N 3.19Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 HydrophobicContact CB-CD1 4.43Å; E55-L57 HydrophobicContact CB-CD2 3.97Å; E55-L57 HydrophobicContact CB-CG 3.87Å; E55-L57 PolarHBondContact O-N 3.07Å; E55-R65 IonicContact OE1-NH1 2.56Å; E55-R65 IonicContact OE2-CZ 3.54Å; E55-R65 IonicContact OE2-NH1 2.72Å; E55-R65 PolarHBondContact OE2-NH1 3.25Å; E55-R65 IonicContact OE2-NH2 3.81Å; E55-R65 PolarHBondContact OE2-NH2 3.27Å
56	G	89.4	Confident	90.8	Very high	62 Å²	62	84.7 Å²	84.7	64%	0.639	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	32.4	177.1	0	0	0	0	0	114.1	M52 D53 Q54	M52-G56 PolarHBondContact O-N 3.11Å; D53-G56 PolarHBondContact O-N 3.33Å; D53-G56 VanDerWaalsContact O-N 3.12Å; Q54-G56 PolarHBondContact O-N 3.25Å
57	L	89.4	Confident	90.7	Very high	25 Å²	25	82.6 Å²	82.6	13%	0.131	42%	0.418	C	S	.	.			trans	-66.2	149.4	-172.9	-57.8	172.8	0	0	0	112.7	M52 E55 E61 K62 R65	M52-L57 HydrophobicContact CB-CD1 3.99Å; M52-L57 HydrophobicContact CG-CD1 3.87Å; M52-L57 PolarHBondContact O-N 2.91Å; E55-L57 VanDerWaalsContact C-N 3.29Å; E55-L57 HydrophobicContact CB-CD1 4.43Å; E55-L57 HydrophobicContact CB-CD2 3.97Å; E55-L57 HydrophobicContact CB-CG 3.87Å; E55-L57 PolarHBondContact O-N 3.07Å; L57-E61 HydrophobicContact CB-CB 4.47Å; L57-K62 HydrophobicContact CB-CG 3.96Å; L57-K62 WeakPolarHBondContact O-CE 3.31Å; L57-R65 VanDerWaalsContact CD1-NH1 3.33Å
58	A	91.8	Very high	90.6	Very high	66 Å²	66	79.9 Å²	79.9	55%	0.545	41%	0.408	S	S	.	.			trans	-67.4	154	171.6	0	0	0	0	0	111.9	E60 E61 K62	A58-E60 PolarHBondContact O-N 3.19Å; A58-E60 VanDerWaalsContact O-N 3.16Å; A58-E61 PolarHBondContact O-N 3.12Å; A58-K62 PolarHBondContact O-N 3.42Å
59	D	90.7	Very high	90.5	Very high	136 Å²	136	79.7 Å²	79.7	73%	0.727	41%	0.406	S	S	*	.	H	α-helix	trans	-56.8	-34.8	-176.2	-72	-28	0	0	0	113.8	R63	D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 PolarHBondContact O-N 3.36Å
60	E	91.6	Very high	90.3	Very high	93 Å²	93	80 Å²	80	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-62.9	-45.6	175.8	-177.1	56.7	-143.4	0	0	111.5	A58 R63 I64	A58-E60 PolarHBondContact O-N 3.19Å; A58-E60 VanDerWaalsContact O-N 3.16Å; E60-R63 VanDerWaalsContact CD-CZ 3.47Å; E60-R63 WeakPolarHBondContact O-CB 3.42Å; E60-R63 PolarHBondContact O-N 3.42Å; E60-R63 IonicContact OE1-CZ 3.67Å; E60-R63 VanDerWaalsContact OE1-CZ 3.26Å; E60-R63 IonicContact OE1-NE 3.69Å; E60-R63 IonicContact OE1-NH1 3.57Å; E60-R63 IonicContact OE1-NH2 3.66Å; E60-R63 PolarHBondContact OE1-NH2 3.28Å; E60-R63 IonicContact OE2-CZ 2.79Å; E60-R63 IonicContact OE2-NE 3.41Å; E60-R63 IonicContact OE2-NH1 2.71Å; E60-R63 PolarHBondContact OE2-NH1 3.47Å; E60-R63 IonicContact OE2-NH2 3.76Å; E60-R63 PolarHBondContact OE2-NH2 3.13Å; E60-I64 HydrophobicContact CG-CD1 4.41Å; E60-I64 WeakPolarHBondContact O-CG1 3.12Å; E60-I64 PolarHBondContact O-N 2.85Å
61	E	89.7	Confident	90.1	Very high	93 Å²	93	81.2 Å²	81.2	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-71.7	-35.9	-179.4	-166.8	161.5	177.3	0	0	111.7	L57 A58 R63 I64 R65	L57-E61 HydrophobicContact CB-CB 4.47Å; A58-E61 PolarHBondContact O-N 3.12Å; E61-R63 VanDerWaalsContact C-N 3.32Å; E61-R63 PolarHBondContact O-N 2.98Å; E61-I64 PolarHBondContact O-N 3.42Å; E61-R65 PolarHBondContact O-N 2.65Å; E61-R65 IonicContact OE1-NH2 3.85Å
62	K	90.3	Very high	89.8	Confident	30 Å²	30	82.8 Å²	82.8	13%	0.13	42%	0.42	C	S	.	.	H	α-helix	trans	-58.4	-43.9	168.9	-66.3	-169.2	-179.1	-174.5	0	111.3	M52 D53 L57 A58 I64 R65 R66	M52-K62 HydrophobicContact CB-CG 4.27Å; M52-K62 HydrophobicContact SD-CB 4.13Å; M52-K62 HydrophobicContact SD-CG 4.23Å; D53-K62 IonicContact OD1-NZ 3.32Å; D53-K62 PolarHBondContact OD1-NZ 2.97Å; L57-K62 HydrophobicContact CB-CG 3.96Å; L57-K62 WeakPolarHBondContact O-CE 3.31Å; A58-K62 PolarHBondContact O-N 3.42Å; K62-I64 PolarHBondContact O-N 3.06Å; K62-R65 PolarHBondContact O-N 3.4Å; K62-R66 VanDerWaalsContact O-CG 3.31Å; K62-R66 WeakPolarHBondContact O-CG 3.3Å; K62-R66 PolarHBondContact O-N 3.4Å
63	R	91.6	Very high	89.6	Confident	151 Å²	151	83 Å²	83	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-61.7	-43.9	177.5	-169.3	179.4	74.9	-138.2	6.7	111.9	D59 E60 E61 R66 S67	D59-R63 WeakPolarHBondContact O-CB 3.48Å; D59-R63 PolarHBondContact O-N 3.36Å; E60-R63 VanDerWaalsContact CD-CZ 3.47Å; E60-R63 WeakPolarHBondContact O-CB 3.42Å; E60-R63 PolarHBondContact O-N 3.42Å; E60-R63 IonicContact OE1-CZ 3.67Å; E60-R63 VanDerWaalsContact OE1-CZ 3.26Å; E60-R63 IonicContact OE1-NE 3.69Å; E60-R63 IonicContact OE1-NH1 3.57Å; E60-R63 IonicContact OE1-NH2 3.66Å; E60-R63 PolarHBondContact OE1-NH2 3.28Å; E60-R63 IonicContact OE2-CZ 2.79Å; E60-R63 IonicContact OE2-NE 3.41Å; E60-R63 IonicContact OE2-NH1 2.71Å; E60-R63 PolarHBondContact OE2-NH1 3.47Å; E60-R63 IonicContact OE2-NH2 3.76Å; E60-R63 PolarHBondContact OE2-NH2 3.13Å; E61-R63 VanDerWaalsContact C-N 3.32Å; E61-R63 PolarHBondContact O-N 2.98Å; R63-R66 PolarHBondContact O-N 2.49Å; R63-S67 PolarHBondContact O-N 2.84Å
64	I	90.7	Very high	89.4	Confident	82 Å²	82	82.7 Å²	82.7	42%	0.421	42%	0.423	S	S	.	.	H	α-helix	trans	-61.2	-50.9	177.3	-67.2	167.6	0	0	0	110.4	E60 E61 K62 R66 S67 E68	E60-I64 HydrophobicContact CG-CD1 4.41Å; E60-I64 WeakPolarHBondContact O-CG1 3.12Å; E60-I64 PolarHBondContact O-N 2.85Å; E61-I64 PolarHBondContact O-N 3.42Å; K62-I64 PolarHBondContact O-N 3.06Å; I64-R66 PolarHBondContact O-N 2.72Å; I64-S67 WeakPolarHBondContact O-CB 3.09Å; I64-S67 PolarHBondContact O-N 3.05Å; I64-S67 VanDerWaalsContact O-N 3.12Å; I64-E68 PolarHBondContact O-N 3.31Å
65	R	88.1	Confident	89	Confident	62 Å²	62	78.6 Å²	78.6	23%	0.234	40%	0.403	C	S	.	.	H	α-helix	trans	-61.1	-40.1	179.9	-73.8	-167.4	-173	-177	11.4	113.2	M52 E55 L57 E61 K62 E68 H69	M52-R65 HydrophobicContact SD-CB 3.61Å; M52-R65 HydrophobicContact SD-CG 4.44Å; E55-R65 IonicContact OE1-NH1 2.56Å; E55-R65 IonicContact OE2-CZ 3.54Å; E55-R65 IonicContact OE2-NH1 2.72Å; E55-R65 PolarHBondContact OE2-NH1 3.25Å; E55-R65 IonicContact OE2-NH2 3.81Å; E55-R65 PolarHBondContact OE2-NH2 3.27Å; L57-R65 VanDerWaalsContact CD1-NH1 3.33Å; E61-R65 PolarHBondContact O-N 2.65Å; E61-R65 IonicContact OE1-NH2 3.85Å; K62-R65 PolarHBondContact O-N 3.4Å; R65-E68 PolarHBondContact O-N 3.39Å; R65-H69 WeakPolarHBondContact O-CB 3.46Å; R65-H69 PolarHBondContact O-N 3.06Å
66	R	92	Very high	88.6	Confident	104 Å²	104	73.8 Å²	73.8	39%	0.392	38%	0.381	S	S	.	.	H	α-helix	trans	-61.7	-43	173.3	-72.4	176.3	-173.5	136.4	2.3	112	E49 M52 K62 R63 I64 H69 A70	E49-R66 IonicContact OE1-CZ 3.13Å; E49-R66 IonicContact OE1-NE 2.67Å; E49-R66 PolarHBondContact OE1-NE 2.99Å; E49-R66 IonicContact OE1-NH2 3.36Å; E49-R66 IonicContact OE2-CZ 2.9Å; E49-R66 IonicContact OE2-NE 3.87Å; E49-R66 PolarHBondContact OE2-NE 3.29Å; E49-R66 IonicContact OE2-NH2 2.77Å; E49-R66 PolarHBondContact OE2-NH2 2.98Å; M52-R66 HydrophobicContact CE-CG 3.9Å; M52-R66 HydrophobicContact SD-CG 4.49Å; K62-R66 VanDerWaalsContact O-CG 3.31Å; K62-R66 WeakPolarHBondContact O-CG 3.3Å; K62-R66 PolarHBondContact O-N 3.4Å; R63-R66 PolarHBondContact O-N 2.49Å; I64-R66 PolarHBondContact O-N 2.72Å; R66-H69 PolarHBondContact O-N 3.38Å; R66-A70 WeakPolarHBondContact O-CB 3.29Å; R66-A70 PolarHBondContact O-N 3.24Å
67	S	91.2	Very high	88.4	Confident	81 Å²	81	74 Å²	74	57%	0.566	37%	0.367	S	S	*	.	H	α-helix	trans	-62.4	-45.1	177.1	-172.5	0	0	0	0	111.7	R63 I64 H69 A70 R71	R63-S67 PolarHBondContact O-N 2.84Å; I64-S67 WeakPolarHBondContact O-CB 3.09Å; I64-S67 PolarHBondContact O-N 3.05Å; I64-S67 VanDerWaalsContact O-N 3.12Å; S67-H69 VanDerWaalsContact C-N 3.34Å; S67-H69 PolarHBondContact O-N 2.79Å; S67-A70 PolarHBondContact O-N 3.43Å; S67-R71 WeakPolarHBondContact O-CB 3.43Å; S67-R71 PolarHBondContact O-N 3.27Å
68	E	88.1	Confident	88	Confident	91 Å²	91	78.5 Å²	78.5	43%	0.425	38%	0.382	S	S	.	.	H	α-helix	trans	-62.1	-40.9	175.2	-70.4	-172.1	159	0	0	112.5	I64 R65 R71 K72	I64-E68 PolarHBondContact O-N 3.31Å; R65-E68 PolarHBondContact O-N 3.39Å; E68-R71 PolarHBondContact O-N 3.49Å; E68-K72 WeakPolarHBondContact O-CG 3.47Å; E68-K72 PolarHBondContact O-N 2.64Å
69	H	87.8	Confident	87.5	Confident	29 Å²	29	76.4 Å²	76.4	13%	0.134	36%	0.362	C	S	.	.	H	α-helix	trans	-63.2	-46.5	175.3	-175.9	-90.4	0	0	0	111.9	L48 R65 R66 S67 R71 K72 E73	L48-H69 HydrophobicContact CD2-CB 3.47Å; L48-H69 VanDerWaalsContact CD2-CB 3.47Å; R65-H69 WeakPolarHBondContact O-CB 3.46Å; R65-H69 PolarHBondContact O-N 3.06Å; R66-H69 PolarHBondContact O-N 3.38Å; S67-H69 VanDerWaalsContact C-N 3.34Å; S67-H69 PolarHBondContact O-N 2.79Å; H69-R71 VanDerWaalsContact C-N 3.28Å; H69-R71 PolarHBondContact O-N 3.33Å; H69-K72 WeakPolarHBondContact O-CB 3.39Å; H69-K72 PolarHBondContact O-N 3.33Å; H69-K72 VanDerWaalsContact O-N 3.12Å; H69-E73 IonicContact CE1-OE1 2.67Å; H69-E73 PolarHBondContact O-N 2.96Å
70	A	88.4	Confident	86.9	Confident	52 Å²	52	72.9 Å²	72.9	43%	0.43	34%	0.34	S	S	.	.	H	α-helix	trans	-60.9	-37.9	176.6	0	0	0	0	0	112.2	R66 S67 E73 T74	R66-A70 WeakPolarHBondContact O-CB 3.29Å; R66-A70 PolarHBondContact O-N 3.24Å; S67-A70 PolarHBondContact O-N 3.43Å; A70-E73 PolarHBondContact O-N 3.4Å; A70-T74 PolarHBondContact O-N 2.83Å; A70-T74 PolarHBondContact O-OG1 3.43Å
71	R	86.8	Confident	86.3	Confident	161 Å²	161	77.9 Å²	77.9	61%	0.608	36%	0.355	S	S	*	.	H	α-helix	trans	-62.8	-46.5	172.8	-173.9	177.1	66.8	110.7	-3.6	111.3	S67 E68 H69 T74 E75	S67-R71 WeakPolarHBondContact O-CB 3.43Å; S67-R71 PolarHBondContact O-N 3.27Å; E68-R71 PolarHBondContact O-N 3.49Å; H69-R71 VanDerWaalsContact C-N 3.28Å; H69-R71 PolarHBondContact O-N 3.33Å; R71-T74 PolarHBondContact O-N 3.39Å; R71-E75 WeakPolarHBondContact O-CB 3.46Å; R71-E75 WeakPolarHBondContact O-CG 3.43Å; R71-E75 PolarHBondContact O-N 2.95Å
72	K	84.8	Confident	85.9	Confident	82 Å²	82	76.8 Å²	76.8	36%	0.357	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-43.8	176.3	-73.7	174.5	-179.2	174.1	0	112	E68 H69 T74 E75 F76 F449	E68-K72 WeakPolarHBondContact O-CG 3.47Å; E68-K72 PolarHBondContact O-N 2.64Å; H69-K72 WeakPolarHBondContact O-CB 3.39Å; H69-K72 PolarHBondContact O-N 3.33Å; H69-K72 VanDerWaalsContact O-N 3.12Å; K72-T74 PolarHBondContact O-N 3.26Å; K72-E75 PolarHBondContact O-N 2.63Å; K72-F76 WeakPolarHBondContact O-CB 3.2Å; K72-F76 PolarHBondContact O-N 3.02Å; K72-F449 HydrophobicContact CB-CZ 3.93Å
73	E	87.3	Confident	85.5	Confident	4 Å²	4	85.7 Å²	85.7	2%	0.019	39%	0.388	C	S	.	.	H	α-helix	trans	-61.6	-43.4	176	-77.2	-67.7	165.4	0	0	112.3	R41 R44 H69 A70 E75 F76 L77 F449	R41-E73 IonicContact NE-OE2 3.26Å; R44-E73 IonicContact CZ-OE1 2.71Å; R44-E73 IonicContact NE-OE1 3.74Å; R44-E73 PolarHBondContact NE-OE1 3.41Å; R44-E73 IonicContact NH2-OE1 3.73Å; R44-E73 PolarHBondContact NH2-OE1 2.85Å; R44-E73 VanDerWaalsContact NH2-OE1 3.11Å; R44-E73 IonicContact NH2-OE2 2.78Å; R44-E73 PolarHBondContact NH2-OE2 3.1Å; H69-E73 IonicContact CE1-OE1 2.67Å; H69-E73 PolarHBondContact O-N 2.96Å; A70-E73 PolarHBondContact O-N 3.4Å; E73-E75 PolarHBondContact O-N 3.3Å; E73-F76 WeakPolarHBondContact O-CB 3.35Å; E73-F76 PolarHBondContact O-N 3.24Å; E73-L77 WeakPolarHBondContact O-CG 3.32Å; E73-L77 PolarHBondContact O-N 2.84Å; E73-F449 HydrophobicContact CG-CE2 4.23Å; E73-F449 HydrophobicContact CG-CZ 4.25Å; E73-F449 WeakPolarHBondContact OE1-CE2 3.38Å
74	T	86.6	Confident	85.2	Confident	86 Å²	86	79.2 Å²	79.2	53%	0.528	36%	0.364	S	S	.	.	H	α-helix	trans	-63.2	-43.7	177.7	-57.5	0	0	0	0	111.6	A70 R71 K72 F76 L77 R78	A70-T74 PolarHBondContact O-N 2.83Å; A70-T74 PolarHBondContact O-OG1 3.43Å; R71-T74 PolarHBondContact O-N 3.39Å; K72-T74 PolarHBondContact O-N 3.26Å; T74-F76 VanDerWaalsContact C-N 3.33Å; T74-F76 PolarHBondContact O-N 3.49Å; T74-L77 PolarHBondContact O-N 3.49Å; T74-R78 PolarHBondContact O-N 3.22Å; T74-R78 VanDerWaalsContact O-N 3.07Å
75	E	83	Confident	85.1	Confident	55 Å²	55	75.8 Å²	75.8	26%	0.257	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-37.9	174.9	-74.5	-67.9	136	0	0	112.2	R71 K72 E73 R78 L79 L452 R455	R71-E75 WeakPolarHBondContact O-CB 3.46Å; R71-E75 WeakPolarHBondContact O-CG 3.43Å; R71-E75 PolarHBondContact O-N 2.95Å; K72-E75 PolarHBondContact O-N 2.63Å; E73-E75 PolarHBondContact O-N 3.3Å; E75-R78 WeakPolarHBondContact O-CB 3.31Å; E75-R78 PolarHBondContact O-N 3.1Å; E75-R78 IonicContact OE1-CZ 3.47Å; E75-R78 VanDerWaalsContact OE1-CZ 3.27Å; E75-R78 IonicContact OE1-NE 2.82Å; E75-R78 IonicContact OE1-NH1 3.11Å; E75-R78 IonicContact OE1-NH2 3.41Å; E75-R78 PolarHBondContact OE1-NH2 3.12Å; E75-R78 IonicContact OE2-CZ 3.96Å; E75-R78 IonicContact OE2-NE 3.85Å; E75-R78 IonicContact OE2-NH2 3.86Å; E75-R78 PolarHBondContact OE2-NH2 3.24Å; E75-L79 PolarHBondContact O-N 2.89Å; E75-L452 HydrophobicContact CB-CD2 4.07Å; E75-R455 IonicContact OE2-NH1 3.89Å
76	F	82.5	Confident	85.2	Confident	5 Å²	5	75 Å²	75	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-46	175	-170.3	-131.6	0	0	0	112.9	K72 E73 T74 R78 L79 K80 K447 F449 L452	K72-F76 WeakPolarHBondContact O-CB 3.2Å; K72-F76 PolarHBondContact O-N 3.02Å; E73-F76 WeakPolarHBondContact O-CB 3.35Å; E73-F76 PolarHBondContact O-N 3.24Å; T74-F76 VanDerWaalsContact C-N 3.33Å; T74-F76 PolarHBondContact O-N 3.49Å; F76-R78 PolarHBondContact O-N 3.05Å; F76-L79 WeakPolarHBondContact O-CB 3.17Å; F76-L79 PolarHBondContact O-N 2.68Å; F76-L79 VanDerWaalsContact O-N 3.13Å; F76-K80 HydrophobicContact CD1-CD 4.23Å; F76-K80 HydrophobicContact CE1-CD 3.92Å; F76-K80 HydrophobicContact CE1-CG 4.48Å; F76-K80 HydrophobicContact CE2-CG 4.4Å; F76-K80 HydrophobicContact CZ-CD 4.16Å; F76-K80 HydrophobicContact CZ-CG 4.34Å; F76-K80 PolarHBondContact O-N 3.05Å; F76-K447 WeakPolarHBondContact CE2-O 3.34Å; F76-K447 WeakPolarHBondContact CZ-O 3.47Å; F76-F449 HydrophobicContact CB-CD2 3.8Å; F76-F449 HydrophobicContact CB-CE2 3.78Å; F76-F449 AromaticContact CD1-CD2 3.51Å; F76-F449 HydrophobicContact CD1-CD2 3.51Å; F76-F449 HydrophobicContact CD1-CE2 4.06Å; F76-F449 AromaticContact CD2-CD2 3.92Å; F76-F449 HydrophobicContact CD2-CD2 3.92Å; F76-F449 HydrophobicContact CE1-CB 4.45Å; F76-F449 AromaticContact CE1-CD2 3.89Å; F76-F449 HydrophobicContact CE1-CD2 3.89Å; F76-F449 HydrophobicContact CE2-CB 4.21Å; F76-F449 HydrophobicContact CE2-CD2 4.32Å; F76-F449 AromaticContact CG-CD2 3.48Å; F76-F449 HydrophobicContact CG-CD2 3.48Å; F76-F449 VanDerWaalsContact CG-CD2 3.48Å; F76-F449 AromaticContact CG-CE2 3.98Å; F76-F449 HydrophobicContact CG-CE2 3.98Å; F76-F449 HydrophobicContact CZ-CB 4.14Å; F76-F449 HydrophobicContact CZ-CD2 4.28Å; F76-L452 HydrophobicContact CB-CD1 3.46Å; F76-L452 VanDerWaalsContact CB-CD1 3.46Å; F76-L452 HydrophobicContact CD2-CD1 3.78Å; F76-L452 HydrophobicContact CD2-CG 4.43Å; F76-L452 HydrophobicContact CG-CD1 4.02Å
77	L	83.6	Confident	85.2	Confident	67 Å²	67	76.2 Å²	76.2	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-63.3	-31.1	176.4	-67.7	173.4	0	0	0	111.6	E73 T74 R81	E73-L77 WeakPolarHBondContact O-CG 3.32Å; E73-L77 PolarHBondContact O-N 2.84Å; T74-L77 PolarHBondContact O-N 3.49Å; L77-R81 WeakPolarHBondContact O-CG 3.3Å; L77-R81 PolarHBondContact O-N 3.38Å; L77-R81 PolarHBondContact O-NE 2.89Å; L77-R81 VanDerWaalsContact O-NE 3.13Å
78	R	82.5	Confident	85.2	Confident	118 Å²	118	74.5 Å²	74.5	45%	0.445	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-49.4	169.9	-172.5	173.2	70.1	178.3	2.7	111.2	T74 E75 F76 K80 R81 T82	T74-R78 PolarHBondContact O-N 3.22Å; T74-R78 VanDerWaalsContact O-N 3.07Å; E75-R78 WeakPolarHBondContact O-CB 3.31Å; E75-R78 PolarHBondContact O-N 3.1Å; E75-R78 IonicContact OE1-CZ 3.47Å; E75-R78 VanDerWaalsContact OE1-CZ 3.27Å; E75-R78 IonicContact OE1-NE 2.82Å; E75-R78 IonicContact OE1-NH1 3.11Å; E75-R78 IonicContact OE1-NH2 3.41Å; E75-R78 PolarHBondContact OE1-NH2 3.12Å; E75-R78 IonicContact OE2-CZ 3.96Å; E75-R78 IonicContact OE2-NE 3.85Å; E75-R78 IonicContact OE2-NH2 3.86Å; E75-R78 PolarHBondContact OE2-NH2 3.24Å; F76-R78 PolarHBondContact O-N 3.05Å; R78-K80 VanDerWaalsContact C-N 3.3Å; R78-K80 PolarHBondContact O-N 2.62Å; R78-R81 WeakPolarHBondContact O-CB 3.38Å; R78-R81 PolarHBondContact O-N 3.06Å; R78-T82 PolarHBondContact O-N 3.48Å; R78-T82 VanDerWaalsContact O-N 3.14Å; R78-T82 PolarHBondContact O-OG1 2.85Å
79	L	80.1	Confident	85.5	Confident	23 Å²	23	70.7 Å²	70.7	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-57.6	-41.4	178.2	178.2	64.9	0	0	0	111.8	E75 F76 R81 T82 Y154 K447 L452	E75-L79 PolarHBondContact O-N 2.89Å; F76-L79 WeakPolarHBondContact O-CB 3.17Å; F76-L79 PolarHBondContact O-N 2.68Å; F76-L79 VanDerWaalsContact O-N 3.13Å; L79-R81 VanDerWaalsContact C-N 3.27Å; L79-R81 PolarHBondContact O-N 3.38Å; L79-T82 WeakPolarHBondContact O-CB 3.48Å; L79-T82 PolarHBondContact O-N 2.73Å; L79-Y154 HydrophobicContact CD2-CE1 4.26Å; L79-K447 HydrophobicContact CD1-CD 4.35Å; L79-K447 HydrophobicContact CD2-CD 4.45Å; L79-K447 HydrophobicContact CG-CD 3.89Å; L79-K447 PolarHBondContact O-NZ 3.37Å; L79-L452 HydrophobicContact CB-CD2 4.12Å; L79-L452 HydrophobicContact CD2-CD2 3.86Å; L79-L452 HydrophobicContact CD2-CG 4.16Å
80	K	77.9	Confident	85.9	Confident	61 Å²	61	74.1 Å²	74.1	27%	0.265	34%	0.342	S	S	.	.	H	α-helix	trans	-60.6	-33.6	175.9	-83.6	-176.4	163.4	174	0	113.3	Q37 F76 R78	Q37-K80 VanDerWaalsContact CG-NZ 3.27Å; F76-K80 HydrophobicContact CD1-CD 4.23Å; F76-K80 HydrophobicContact CE1-CD 3.92Å; F76-K80 HydrophobicContact CE1-CG 4.48Å; F76-K80 HydrophobicContact CE2-CG 4.4Å; F76-K80 HydrophobicContact CZ-CD 4.16Å; F76-K80 HydrophobicContact CZ-CG 4.34Å; F76-K80 PolarHBondContact O-N 3.05Å; R78-K80 VanDerWaalsContact C-N 3.3Å; R78-K80 PolarHBondContact O-N 2.62Å
81	R	80.4	Confident	86.1	Confident	199 Å²	199	74 Å²	74	75%	0.751	34%	0.338	S	S	*	.	H	α-helix	trans	-76.7	-28.4	176.9	-72	-179.7	-73.3	169.8	-2.1	113.1	L77 R78 L79	L77-R81 WeakPolarHBondContact O-CG 3.3Å; L77-R81 PolarHBondContact O-N 3.38Å; L77-R81 PolarHBondContact O-NE 2.89Å; L77-R81 VanDerWaalsContact O-NE 3.13Å; R78-R81 WeakPolarHBondContact O-CB 3.38Å; R78-R81 PolarHBondContact O-N 3.06Å; L79-R81 VanDerWaalsContact C-N 3.27Å; L79-R81 PolarHBondContact O-N 3.38Å
82	T	80.4	Confident	86.4	Confident	69 Å²	69	69.7 Å²	69.7	42%	0.423	33%	0.326	S	S	.	.	S	Bend	trans	-65.6	138.8	173.6	-52.7	0	0	0	0	109.6	R78 L79 K447	R78-T82 PolarHBondContact O-N 3.48Å; R78-T82 VanDerWaalsContact O-N 3.14Å; R78-T82 PolarHBondContact O-OG1 2.85Å; L79-T82 WeakPolarHBondContact O-CB 3.48Å; L79-T82 PolarHBondContact O-N 2.73Å; T82-K447 PolarHBondContact O-NZ 2.98Å
83	R	81.9	Confident	86.7	Confident	218 Å²	218	68.8 Å²	68.8	82%	0.823	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-87.9	117	167.8	-171.3	174.7	178.1	176.6	-1.1	107.4
84	L	84.4	Confident	87	Confident	15 Å²	15	68.6 Å²	68.6	8%	0.079	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-81.8	137	171.9	-77.8	170	0	0	0	108.4	D88 Y154 F156 K447	L84-D88 VanDerWaalsContact CA-OD2 3.31Å; L84-D88 WeakPolarHBondContact CA-OD2 3.36Å; L84-D88 HydrophobicContact CD2-CB 4.32Å; L84-D88 WeakPolarHBondContact CD2-OD2 3.43Å; L84-Y154 HydrophobicContact CD1-CD1 3.75Å; L84-Y154 HydrophobicContact CD1-CD2 4.36Å; L84-Y154 HydrophobicContact CD1-CE1 4.26Å; L84-Y154 HydrophobicContact CD1-CG 3.82Å; L84-F156 HydrophobicContact CB-CD1 4.45Å; L84-K447 HydrophobicContact CD1-CD 4.01Å; L84-K447 HydrophobicContact CD1-CG 4.38Å
85	G	89.2	Confident	87.1	Confident	9 Å²	9	65.1 Å²	65.1	9%	0.093	30%	0.3	C	S	.	.			trans	-136.8	177.5	176.8	0	0	0	0	0	112	E87 D88 F89	G85-E87 VanDerWaalsContact C-OE2 3.32Å; G85-E87 WeakPolarHBondContact CA-OE2 3.17Å; G85-E87 PolarHBondContact O-N 3.02Å; G85-D88 PolarHBondContact N-OD2 3.05Å; G85-D88 WeakPolarHBondContact O-CB 3.21Å; G85-D88 PolarHBondContact O-N 2.97Å; G85-F89 WeakPolarHBondContact O-CD2 3.39Å
86	L	90.9	Very high	87.2	Confident	47 Å²	47	63.3 Å²	63.3	25%	0.246	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-62.9	-31.3	178.1	-178.6	64.5	0	0	0	111.4	D88 F89 M117 F156 Y163 L419	L86-D88 PolarHBondContact O-N 3.03Å; L86-F89 PolarHBondContact O-N 2.79Å; L86-F89 VanDerWaalsContact O-N 3.08Å; L86-F89 VanDerWaalsContact O-O 3.13Å; L86-M117 HydrophobicContact CD1-CE 3.65Å; L86-M117 HydrophobicContact CD1-SD 3.97Å; L86-F156 HydrophobicContact CB-CE2 4.49Å; L86-Y163 HydrophobicContact CD1-CD1 4.43Å; L86-Y163 HydrophobicContact CD1-CE1 3.88Å; L86-L419 HydrophobicContact CD1-CD2 4.19Å; L86-L419 HydrophobicContact CD2-CD2 3.88Å
87	E	91.6	Very high	87	Confident	129 Å²	129	67.2 Å²	67.2	60%	0.603	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-61.8	-21.9	178.4	65	-84.7	-161.6	0	0	114.2	G85 F89 K109	G85-E87 VanDerWaalsContact C-OE2 3.32Å; G85-E87 WeakPolarHBondContact CA-OE2 3.17Å; G85-E87 PolarHBondContact O-N 3.02Å; E87-F89 PolarHBondContact O-N 2.94Å; E87-K109 WeakPolarHBondContact O-CD 3.5Å; E87-K109 WeakPolarHBondContact O-CE 2.92Å; E87-K109 PolarHBondContact O-NZ 3.47Å
88	D	91.4	Very high	86.4	Confident	45 Å²	45	66.3 Å²	66.3	24%	0.241	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-77	-10.3	177.1	-65.1	-52.5	0	0	0	112.8	L84 G85 L86 K109	L84-D88 VanDerWaalsContact CA-OD2 3.31Å; L84-D88 WeakPolarHBondContact CA-OD2 3.36Å; L84-D88 HydrophobicContact CD2-CB 4.32Å; L84-D88 WeakPolarHBondContact CD2-OD2 3.43Å; G85-D88 PolarHBondContact N-OD2 3.05Å; G85-D88 WeakPolarHBondContact O-CB 3.21Å; G85-D88 PolarHBondContact O-N 2.97Å; L86-D88 PolarHBondContact O-N 3.03Å; D88-K109 PolarHBondContact O-N 3.3Å
89	F	94.4	Very high	85.7	Confident	10 Å²	10	62.2 Å²	62.2	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	141.6	-176.3	-60.5	-89.9	0	0	0	110.9	G85 L86 E87 V106 Q107 K108 Y115 Y154 F156 I165	G85-F89 WeakPolarHBondContact O-CD2 3.39Å; L86-F89 PolarHBondContact O-N 2.79Å; L86-F89 VanDerWaalsContact O-N 3.08Å; L86-F89 VanDerWaalsContact O-O 3.13Å; E87-F89 PolarHBondContact O-N 2.94Å; F89-V106 HydrophobicContact CB-CB 4.33Å; F89-V106 HydrophobicContact CB-CG2 4.47Å; F89-V106 HydrophobicContact CD1-CG2 3.89Å; F89-V106 HydrophobicContact CG-CG2 4.48Å; F89-Q107 CarbonylContact C-O 3.59Å; F89-Q107 WeakPolarHBondContact CA-O 3.35Å; F89-K108 HydrophobicContact CD1-CB 3.98Å; F89-K108 HydrophobicContact CD1-CG 4.14Å; F89-K108 HydrophobicContact CE1-CB 3.87Å; F89-K108 HydrophobicContact CE1-CD 4.27Å; F89-K108 HydrophobicContact CE1-CG 3.79Å; F89-K108 HydrophobicContact CZ-CD 4.49Å; F89-K108 HydrophobicContact CZ-CG 4.25Å; F89-Y115 HydrophobicContact CE1-CD2 4.21Å; F89-Y154 HydrophobicContact CZ-CD2 4.16Å; F89-Y154 HydrophobicContact CZ-CE2 4.49Å; F89-F156 HydrophobicContact CD2-CE1 4.32Å; F89-F156 HydrophobicContact CD2-CZ 4.18Å; F89-F156 AromaticContact CE2-CE1 3.74Å; F89-F156 HydrophobicContact CE2-CE1 3.74Å; F89-F156 HydrophobicContact CE2-CZ 4.04Å; F89-F156 HydrophobicContact CZ-CE1 4.44Å; F89-I165 HydrophobicContact CE1-CD1 4.17Å; F89-I165 HydrophobicContact CE1-CG1 4.32Å; F89-I165 HydrophobicContact CE1-CG2 4.18Å; F89-I165 HydrophobicContact CE2-CD1 4.35Å; F89-I165 HydrophobicContact CE2-CG1 4.42Å; F89-I165 HydrophobicContact CZ-CD1 4.09Å; F89-I165 HydrophobicContact CZ-CG1 3.94Å; F89-I165 HydrophobicContact CZ-CG2 4.45Å
90	E	94.8	Very high	85.2	Confident	102 Å²	102	62.4 Å²	62.4	48%	0.477	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128.5	169.9	-176.9	170.5	-178.1	0	0	109	L92 V106 Q107 K109	E90-L92 HydrophobicContact CG-CD2 4.4Å; E90-V106 CarbonylContact O-C 3.57Å; E90-V106 WeakPolarHBondContact O-CA 3.46Å; E90-V106 WeakPolarHBondContact O-CB 3.33Å; E90-Q107 PolarHBondContact N-O 2.83Å; E90-Q107 PolarHBondContact O-N 2.79Å; E90-K109 HydrophobicContact CB-CG 4.42Å
91	S	94.1	Very high	85.2	Confident	49 Å²	49	60.1 Å²	60.1	34%	0.343	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	119.2	-179.9	-153.5	0	0	0	0	109.2	R104	S91-R104 WeakPolarHBondContact OG-CD 3.38Å; S91-R104 PolarHBondContact OG-NH1 3.49Å; S91-R104 VanDerWaalsContact OG-NH1 3.08Å
92	L	92.4	Very high	85.5	Confident	70 Å²	70	50.9 Å²	50.9	37%	0.366	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-53.1	-178.2	-59	-177.3	0	0	0	111.8	E90 L105 Q107	E90-L92 HydrophobicContact CG-CD2 4.4Å; L92-L105 HydrophobicContact CB-CB 4.41Å; L92-L105 HydrophobicContact CB-CD2 4.37Å; L92-L105 HydrophobicContact CB-CG 4.4Å; L92-L105 WeakPolarHBondContact CB-O 2.92Å; L92-L105 HydrophobicContact CD1-CD2 4.11Å; L92-L105 HydrophobicContact CD1-CG 4.2Å; L92-L105 PolarHBondContact N-O 2.86Å; L92-Q107 HydrophobicContact CD1-CB 4.12Å; L92-Q107 HydrophobicContact CD2-CB 4.38Å; L92-Q107 HydrophobicContact CG-CB 4.32Å
93	K	92.1	Very high	86	Confident	63 Å²	63	49.3 Å²	49.3	27%	0.274	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	146.7	-176.1	-170.6	173.5	172	-177.8	0	111.7	R104 L105 T407	K93-R104 CarbonylContact O-C 3.53Å; K93-R104 VanDerWaalsContact O-CA 3.29Å; K93-R104 WeakPolarHBondContact O-CA 3.44Å; K93-L105 PolarHBondContact N-O 2.86Å; K93-L105 PolarHBondContact O-N 3.04Å; K93-T407 HydrophobicContact CD-CG2 4.15Å; K93-T407 VanDerWaalsContact CD-OG1 3.31Å; K93-T407 WeakPolarHBondContact CD-OG1 3.33Å; K93-T407 PolarHBondContact NZ-OG1 2.95Å
94	V	91.8	Very high	86.6	Confident	1 Å²	1	40 Å²	40	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	121.3	167.1	-176.4	0	0	0	0	108.9	R97 R104 F413	V94-R97 HydrophobicContact CG1-CG 4.29Å; V94-R104 HydrophobicContact CG2-CG 4.24Å; V94-F413 HydrophobicContact CB-CB 4.17Å; V94-F413 HydrophobicContact CG1-CB 3.89Å; V94-F413 HydrophobicContact CG1-CD2 4.48Å; V94-F413 HydrophobicContact CG1-CG 4.27Å
95	I	89.8	Confident	87.1	Confident	13 Å²	13	39.5 Å²	39.5	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-10.6	-176.7	59.2	173.2	0	0	0	113.2	V103 L105 A116 F168 T407 F410 F413	I95-V103 HydrophobicContact CD1-CG1 3.97Å; I95-V103 HydrophobicContact CG1-CB 4.21Å; I95-V103 HydrophobicContact CG1-CG1 3.86Å; I95-V103 WeakPolarHBondContact CG1-O 3.3Å; I95-V103 PolarHBondContact N-O 3.11Å; I95-L105 HydrophobicContact CG2-CB 3.95Å; I95-A116 HydrophobicContact CD1-CB 4.3Å; I95-F168 HydrophobicContact CD1-CD2 3.95Å; I95-F168 HydrophobicContact CD1-CE2 3.84Å; I95-T407 HydrophobicContact CG2-CG2 3.7Å; I95-F410 HydrophobicContact CB-CD1 3.91Å; I95-F410 HydrophobicContact CB-CE1 4.3Å; I95-F410 HydrophobicContact CB-CG 4.14Å; I95-F410 HydrophobicContact CD1-CE1 4.36Å; I95-F410 HydrophobicContact CG2-CG 4.44Å; I95-F410 WeakPolarHBondContact O-CD1 3.34Å; I95-F413 WeakPolarHBondContact O-CE2 3.36Å
96	G	84.8	Confident	87.4	Confident	16 Å²	16	39 Å²	39	17%	0.165	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	154	175.2	0	0	0	0	0	112.3	E102 V103	G96-E102 WeakPolarHBondContact O-CA 3.48Å; G96-E102 WeakPolarHBondContact O-CB 3.41Å; G96-V103 PolarHBondContact N-O 3.38Å; G96-V103 VanDerWaalsContact N-O 3.14Å; G96-V103 PolarHBondContact O-N 2.7Å
97	R	79.1	Confident	87.6	Confident	87 Å²	87	39.9 Å²	39.9	33%	0.328	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131	172	-70.1	-173.4	-179.6	-170.6	0.5	109.5	V94 E102 F280 F413 P414	V94-R97 HydrophobicContact CG1-CG 4.29Å; R97-E102 HydrophobicContact CG-CB 4.24Å; R97-F280 HydrophobicContact CB-CD1 4.37Å; R97-F280 HydrophobicContact CB-CE1 4.46Å; R97-F280 VanDerWaalsContact O-CD1 3.3Å; R97-F280 WeakPolarHBondContact O-CD1 3.42Å; R97-F413 HydrophobicContact CB-CD1 4.31Å; R97-F413 HydrophobicContact CB-CE1 4.19Å; R97-F413 HydrophobicContact CG-CD1 3.8Å; R97-F413 HydrophobicContact CG-CE1 4.17Å; R97-F413 HydrophobicContact CG-CG 4.33Å; R97-P414 PolarHBondContact NH2-O 2.98Å
98	G	70.8	Confident	87.6	Confident	49 Å²	49	34.3 Å²	34.3	51%	0.505	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	176.4	174.7	0	0	0	0	0	111.5	F100 G101	G98-F100 PolarHBondContact O-N 3.34Å; G98-F100 VanDerWaalsContact O-N 3.15Å; G98-G101 PolarHBondContact N-O 2.98Å; G98-G101 VanDerWaalsContact O-O 3.06Å
99	A	67.1	Low	87.6	Confident	32 Å²	32	38.3 Å²	38.3	26%	0.264	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.4	178.2	0	0	0	0	0	114.6	T282	A99-T282 HydrophobicContact CB-CG2 4.06Å
100	F	69.1	Low	87.2	Confident	26 Å²	26	41.8 Å²	41.8	11%	0.114	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	6.2	-169.3	-55.5	-78.5	0	0	0	113.6	G98 L120 R121 D124 M125 K128 L237	G98-F100 PolarHBondContact O-N 3.34Å; G98-F100 VanDerWaalsContact O-N 3.15Å; F100-L120 HydrophobicContact CB-CD2 4.28Å; F100-R121 PolarHBondContact O-N 3.27Å; F100-D124 HydrophobicContact CD1-CB 4.35Å; F100-M125 HydrophobicContact CB-CE 3.44Å; F100-M125 VanDerWaalsContact CB-CE 3.44Å; F100-M125 HydrophobicContact CD1-CE 3.19Å; F100-M125 HydrophobicContact CD2-CE 4.36Å; F100-M125 HydrophobicContact CE1-CE 3.96Å; F100-M125 HydrophobicContact CG-CE 3.42Å; F100-M125 VanDerWaalsContact CG-CE 3.42Å; F100-K128 HydrophobicContact CD1-CD 4.13Å; F100-K128 HydrophobicContact CE1-CD 3.45Å; F100-K128 VanDerWaalsContact CE1-CD 3.45Å; F100-K128 HydrophobicContact CZ-CD 4.45Å; F100-L237 HydrophobicContact CD2-CD1 4.4Å; F100-L237 HydrophobicContact CE2-CB 4.07Å; F100-L237 HydrophobicContact CE2-CD1 3.56Å; F100-L237 HydrophobicContact CE2-CG 4.47Å; F100-L237 HydrophobicContact CZ-CB 4.09Å; F100-L237 HydrophobicContact CZ-CD1 3.8Å
101	G	79.1	Confident	86.8	Confident	13 Å²	13	38.9 Å²	38.9	13%	0.134	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-161.3	-167.8	0	0	0	0	0	113.3	G98 I119	G98-G101 PolarHBondContact N-O 2.98Å; G98-G101 VanDerWaalsContact O-O 3.06Å; G101-I119 WeakPolarHBondContact CA-O 3.28Å
102	E	86.9	Confident	86.5	Confident	6 Å²	6	38 Å²	38	3%	0.028	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.8	-176.9	64.9	-173.7	-140.2	0	0	111.3	G96 R97 R104 I119 S416 I418	G96-E102 WeakPolarHBondContact O-CA 3.48Å; G96-E102 WeakPolarHBondContact O-CB 3.41Å; R97-E102 HydrophobicContact CG-CB 4.24Å; E102-R104 IonicContact OE1-CZ 2.63Å; E102-R104 IonicContact OE1-NE 3.65Å; E102-R104 PolarHBondContact OE1-NE 2.7Å; E102-R104 IonicContact OE1-NH2 3.84Å; E102-R104 PolarHBondContact OE1-NH2 3.19Å; E102-I119 HydrophobicContact CG-CD1 4.08Å; E102-I119 PolarHBondContact N-O 3.31Å; E102-I119 PolarHBondContact O-N 2.92Å; E102-S416 WeakPolarHBondContact OE2-CB 3.47Å; E102-S416 PolarHBondContact OE2-OG 2.89Å; E102-I418 HydrophobicContact CG-CB 4.38Å; E102-I418 HydrophobicContact CG-CD1 3.97Å; E102-I418 HydrophobicContact CG-CG2 3.73Å; E102-I418 WeakPolarHBondContact OE1-CG2 3.27Å
103	V	90.9	Very high	86.3	Confident	36 Å²	36	37.4 Å²	37.4	22%	0.218	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.2	177.9	-172	0	0	0	0	108	I95 G96 A116 M117 K118	I95-V103 HydrophobicContact CD1-CG1 3.97Å; I95-V103 HydrophobicContact CG1-CB 4.21Å; I95-V103 HydrophobicContact CG1-CG1 3.86Å; I95-V103 WeakPolarHBondContact CG1-O 3.3Å; I95-V103 PolarHBondContact N-O 3.11Å; G96-V103 PolarHBondContact N-O 3.38Å; G96-V103 VanDerWaalsContact N-O 3.14Å; G96-V103 PolarHBondContact O-N 2.7Å; V103-A116 HydrophobicContact CG1-CB 4.25Å; V103-M117 CarbonylContact C-O 3.11Å; V103-M117 WeakPolarHBondContact CA-O 3.32Å; V103-K118 HydrophobicContact CG2-CB 4.29Å; V103-K118 HydrophobicContact CG2-CG 4.15Å
104	R	93.9	Very high	86.3	Confident	22 Å²	22	35 Å²	35	8%	0.083	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	142	178.5	-59.3	-161.9	-176.2	-154.2	-7.3	111.3	S91 K93 V94 E102 V106 A116 M117 I119 S416 L419	S91-R104 WeakPolarHBondContact OG-CD 3.38Å; S91-R104 PolarHBondContact OG-NH1 3.49Å; S91-R104 VanDerWaalsContact OG-NH1 3.08Å; K93-R104 CarbonylContact O-C 3.53Å; K93-R104 VanDerWaalsContact O-CA 3.29Å; K93-R104 WeakPolarHBondContact O-CA 3.44Å; V94-R104 HydrophobicContact CG2-CG 4.24Å; E102-R104 IonicContact OE1-CZ 2.63Å; E102-R104 IonicContact OE1-NE 3.65Å; E102-R104 PolarHBondContact OE1-NE 2.7Å; E102-R104 IonicContact OE1-NH2 3.84Å; E102-R104 PolarHBondContact OE1-NH2 3.19Å; R104-V106 HydrophobicContact CB-CG1 4.06Å; R104-A116 CarbonylContact O-C 3.56Å; R104-A116 WeakPolarHBondContact O-CA 3.45Å; R104-M117 PolarHBondContact N-O 3.31Å; R104-M117 PolarHBondContact O-N 2.88Å; R104-I119 HydrophobicContact CG-CD1 4.02Å; R104-S416 PolarHBondContact NH2-O 2.93Å; R104-L419 VanDerWaalsContact CZ-CD1 3.41Å
105	L	95.1	Very high	86.5	Confident	4 Å²	4	35 Å²	35	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.5	159.3	-169.5	68.5	0	0	0	108.3	L92 K93 I95 V114 F168 D405 T407	L92-L105 HydrophobicContact CB-CB 4.41Å; L92-L105 HydrophobicContact CB-CD2 4.37Å; L92-L105 HydrophobicContact CB-CG 4.4Å; L92-L105 WeakPolarHBondContact CB-O 2.92Å; L92-L105 HydrophobicContact CD1-CD2 4.11Å; L92-L105 HydrophobicContact CD1-CG 4.2Å; L92-L105 PolarHBondContact N-O 2.86Å; K93-L105 PolarHBondContact N-O 2.86Å; K93-L105 PolarHBondContact O-N 3.04Å; I95-L105 HydrophobicContact CG2-CB 3.95Å; L105-V114 HydrophobicContact CD1-CG1 3.24Å; L105-V114 HydrophobicContact CD2-CG1 4.31Å; L105-V114 HydrophobicContact CG-CG1 3.81Å; L105-F168 HydrophobicContact CD1-CB 4.01Å; L105-F168 HydrophobicContact CD1-CD1 3.56Å; L105-F168 HydrophobicContact CD1-CD2 3.47Å; L105-F168 VanDerWaalsContact CD1-CD2 3.47Å; L105-F168 HydrophobicContact CD1-CE1 3.79Å; L105-F168 HydrophobicContact CD1-CE2 3.72Å; L105-F168 HydrophobicContact CD1-CG 3.38Å; L105-F168 HydrophobicContact CD1-CZ 3.87Å; L105-D405 HydrophobicContact CD2-CB 3.98Å; L105-T407 HydrophobicContact CD2-CG2 3.75Å
106	V	95.5	Very high	86.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	151.8	-179.3	-57.6	0	0	0	0	111.4	F89 E90 R104 V114 Y115 M117	F89-V106 HydrophobicContact CB-CB 4.33Å; F89-V106 HydrophobicContact CB-CG2 4.47Å; F89-V106 HydrophobicContact CD1-CG2 3.89Å; F89-V106 HydrophobicContact CG-CG2 4.48Å; E90-V106 CarbonylContact O-C 3.57Å; E90-V106 WeakPolarHBondContact O-CA 3.46Å; E90-V106 WeakPolarHBondContact O-CB 3.33Å; R104-V106 HydrophobicContact CB-CG1 4.06Å; V106-V114 CarbonylContact O-C 3.57Å; V106-V114 WeakPolarHBondContact O-CA 3.36Å; V106-Y115 PolarHBondContact N-O 3.35Å; V106-Y115 PolarHBondContact O-N 3.34Å; V106-M117 HydrophobicContact CB-CB 4.42Å; V106-M117 HydrophobicContact CG1-CB 3.67Å; V106-M117 HydrophobicContact CG1-CE 3.62Å; V106-M117 HydrophobicContact CG1-CG 4.48Å; V106-M117 HydrophobicContact CG1-SD 4.12Å; V106-M117 HydrophobicContact CG2-CB 3.79Å
107	Q	94.5	Very high	87.2	Confident	65 Å²	65	34.1 Å²	34.1	30%	0.304	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.7	172.5	-168.7	174.2	39.4	0	0	110	F89 E90 L92 K109 G112 H113	F89-Q107 CarbonylContact C-O 3.59Å; F89-Q107 WeakPolarHBondContact CA-O 3.35Å; E90-Q107 PolarHBondContact N-O 2.83Å; E90-Q107 PolarHBondContact O-N 2.79Å; L92-Q107 HydrophobicContact CD1-CB 4.12Å; L92-Q107 HydrophobicContact CD2-CB 4.38Å; L92-Q107 HydrophobicContact CG-CB 4.32Å; Q107-K109 PolarHBondContact O-N 3.05Å; Q107-G112 WeakPolarHBondContact CG-O 3.4Å; Q107-G112 PolarHBondContact NE2-O 2.89Å; Q107-H113 WeakPolarHBondContact CA-O 3.38Å
108	K	92.5	Very high	87.8	Confident	12 Å²	12	31.1 Å²	31.1	5%	0.052	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.2	175	-164.8	-173.4	-170.8	-68.6	0	109.6	F89 D110 T111 G112 H113 Y115	F89-K108 HydrophobicContact CD1-CB 3.98Å; F89-K108 HydrophobicContact CD1-CG 4.14Å; F89-K108 HydrophobicContact CE1-CB 3.87Å; F89-K108 HydrophobicContact CE1-CD 4.27Å; F89-K108 HydrophobicContact CE1-CG 3.79Å; F89-K108 HydrophobicContact CZ-CD 4.49Å; F89-K108 HydrophobicContact CZ-CG 4.25Å; K108-D110 WeakPolarHBondContact CD-OD1 3.1Å; K108-D110 WeakPolarHBondContact CE-OD1 3.35Å; K108-D110 VanDerWaalsContact CG-OD1 3.27Å; K108-D110 WeakPolarHBondContact CG-OD1 3.37Å; K108-D110 IonicContact NZ-OD1 3.65Å; K108-D110 PolarHBondContact NZ-OD1 3.44Å; K108-D110 IonicContact NZ-OD2 3.26Å; K108-D110 PolarHBondContact NZ-OD2 2.94Å; K108-D110 PolarHBondContact O-N 3.48Å; K108-T111 HydrophobicContact CD-CG2 4.46Å; K108-T111 PolarHBondContact O-N 3.3Å; K108-G112 WeakPolarHBondContact O-CA 3.45Å; K108-G112 PolarHBondContact O-N 2.95Å; K108-H113 PolarHBondContact N-O 3.19Å; K108-Y115 HydrophobicContact CB-CD2 4.22Å; K108-Y115 HydrophobicContact CB-CE2 3.77Å; K108-Y115 HydrophobicContact CD-CE2 4.32Å
109	K	91.8	Very high	88.7	Confident	128 Å²	128	28.8 Å²	28.8	56%	0.557	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-35.6	-166.8	-68.3	178.5	-178.8	168.2	0	114.9	E87 D88 E90 Q107	E87-K109 WeakPolarHBondContact O-CD 3.5Å; E87-K109 WeakPolarHBondContact O-CE 2.92Å; E87-K109 PolarHBondContact O-NZ 3.47Å; D88-K109 PolarHBondContact O-N 3.3Å; E90-K109 HydrophobicContact CB-CG 4.42Å; Q107-K109 PolarHBondContact O-N 3.05Å
110	D	85.7	Confident	89.6	Confident	84 Å²	84	27.9 Å²	27.9	45%	0.449	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-23.8	-177.7	69.1	-33.5	0	0	0	113.6	K108 R455	K108-D110 WeakPolarHBondContact CD-OD1 3.1Å; K108-D110 WeakPolarHBondContact CE-OD1 3.35Å; K108-D110 VanDerWaalsContact CG-OD1 3.27Å; K108-D110 WeakPolarHBondContact CG-OD1 3.37Å; K108-D110 IonicContact NZ-OD1 3.65Å; K108-D110 PolarHBondContact NZ-OD1 3.44Å; K108-D110 IonicContact NZ-OD2 3.26Å; K108-D110 PolarHBondContact NZ-OD2 2.94Å; K108-D110 PolarHBondContact O-N 3.48Å; D110-R455 IonicContact OD2-NH2 3.58Å; D110-R455 PolarHBondContact OD2-NH2 3.28Å; D110-R455 VanDerWaalsContact OD2-NH2 3.11Å
111	T	85.9	Confident	90.4	Very high	41 Å²	41	31.5 Å²	31.5	25%	0.252	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-19.7	-177	64.9	0	0	0	0	113.9	K108 H113 R455	K108-T111 HydrophobicContact CD-CG2 4.46Å; K108-T111 PolarHBondContact O-N 3.3Å; T111-H113 PolarHBondContact O-N 3.39Å; T111-H113 WeakPolarHBondContact OG1-CB 3.39Å; T111-H113 PolarHBondContact OG1-N 2.78Å; T111-R455 HydrophobicContact CG2-CG 3.55Å
112	G	87.1	Confident	90.7	Very high	29 Å²	29	31 Å²	31	30%	0.299	16%	0.156	S	C	.	.			trans	69	6.7	-170.3	0	0	0	0	0	113.8	Q107 K108	Q107-G112 WeakPolarHBondContact CG-O 3.4Å; Q107-G112 PolarHBondContact NE2-O 2.89Å; K108-G112 WeakPolarHBondContact O-CA 3.45Å; K108-G112 PolarHBondContact O-N 2.95Å
113	H	89.1	Confident	90.5	Very high	58 Å²	58	32.5 Å²	32.5	27%	0.269	17%	0.169	S	C	.	.			trans	-76.6	142	-177.9	-162.9	87.6	0	0	0	111.3	Q107 K108 T111 Y115 A454	Q107-H113 WeakPolarHBondContact CA-O 3.38Å; K108-H113 PolarHBondContact N-O 3.19Å; T111-H113 PolarHBondContact O-N 3.39Å; T111-H113 WeakPolarHBondContact OG1-CB 3.39Å; T111-H113 PolarHBondContact OG1-N 2.78Å; H113-Y115 HydrophobicContact CB-CE2 3.78Å; H113-Y115 AromaticContact CD2-CE1 3.51Å; H113-Y115 AromaticContact CD2-CE2 3.6Å; H113-Y115 AromaticContact CD2-CZ 3.26Å; H113-Y115 PolarHBondContact CD2-OH 3.24Å; H113-Y115 AromaticContact CG-CZ 3.91Å; H113-Y115 WeakPolarHBondContact O-CD2 3.35Å; H113-Y115 WeakPolarHBondContact O-CE2 3.26Å; H113-A454 HydrophobicContact CB-CB 4.35Å
114	V	93	Very high	89.8	Confident	13 Å²	13	32.4 Å²	32.4	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	137.1	-175.9	179.8	0	0	0	0	110.3	L105 V106 F168 I404 D405	L105-V114 HydrophobicContact CD1-CG1 3.24Å; L105-V114 HydrophobicContact CD2-CG1 4.31Å; L105-V114 HydrophobicContact CG-CG1 3.81Å; V106-V114 CarbonylContact O-C 3.57Å; V106-V114 WeakPolarHBondContact O-CA 3.36Å; V114-F168 HydrophobicContact CG1-CB 4.39Å; V114-F168 HydrophobicContact CG1-CD1 4.19Å; V114-F168 HydrophobicContact CG1-CG 4.49Å; V114-I404 HydrophobicContact CG2-CD1 4.08Å; V114-I404 HydrophobicContact CG2-CG1 4.43Å; V114-D405 HydrophobicContact CG2-CB 4.41Å
115	Y	95	Very high	89.1	Confident	1 Å²	1	31.6 Å²	31.6	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	160.5	-179.2	-60.4	-84.2	0	0	0	111	F89 V106 K108 H113 F153 Y154 I165 M166	F89-Y115 HydrophobicContact CE1-CD2 4.21Å; V106-Y115 PolarHBondContact N-O 3.35Å; V106-Y115 PolarHBondContact O-N 3.34Å; K108-Y115 HydrophobicContact CB-CD2 4.22Å; K108-Y115 HydrophobicContact CB-CE2 3.77Å; K108-Y115 HydrophobicContact CD-CE2 4.32Å; H113-Y115 HydrophobicContact CB-CE2 3.78Å; H113-Y115 AromaticContact CD2-CE1 3.51Å; H113-Y115 AromaticContact CD2-CE2 3.6Å; H113-Y115 AromaticContact CD2-CZ 3.26Å; H113-Y115 PolarHBondContact CD2-OH 3.24Å; H113-Y115 AromaticContact CG-CZ 3.91Å; H113-Y115 WeakPolarHBondContact O-CD2 3.35Å; H113-Y115 WeakPolarHBondContact O-CE2 3.26Å; Y115-F153 AromaticContact CD1-CD2 3.69Å; Y115-F153 HydrophobicContact CD1-CD2 3.69Å; Y115-F153 HydrophobicContact CD1-CE2 4.09Å; Y115-F153 HydrophobicContact CD1-CG 4.46Å; Y115-F153 HydrophobicContact CE1-CB 4.38Å; Y115-F153 AromaticContact CE1-CD2 3.52Å; Y115-F153 HydrophobicContact CE1-CD2 3.52Å; Y115-F153 AromaticContact CE1-CE2 3.86Å; Y115-F153 HydrophobicContact CE1-CE2 3.86Å; Y115-F153 AromaticContact CE1-CG 3.95Å; Y115-F153 HydrophobicContact CE1-CG 3.95Å; Y115-Y154 HydrophobicContact CE1-CE2 4.37Å; Y115-I165 HydrophobicContact CD1-CG2 3.67Å; Y115-I165 HydrophobicContact CD2-CG2 4.22Å; Y115-I165 HydrophobicContact CE1-CG2 4.4Å; Y115-I165 HydrophobicContact CG-CG2 3.56Å; Y115-M166 WeakPolarHBondContact CA-O 3.43Å; Y115-M166 WeakPolarHBondContact CB-O 3.37Å
116	A	95	Very high	88.1	Confident	9 Å²	9	33.4 Å²	33.4	7%	0.074	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	126.2	161.7	0	0	0	0	0	109.2	I95 V103 R104 M166	I95-A116 HydrophobicContact CD1-CB 4.3Å; V103-A116 HydrophobicContact CG1-CB 4.25Å; R104-A116 CarbonylContact O-C 3.56Å; R104-A116 WeakPolarHBondContact O-CA 3.45Å; A116-M166 PolarHBondContact N-O 3.47Å; A116-M166 PolarHBondContact O-N 2.8Å
117	M	94.2	Very high	87	Confident	1 Å²	1	40 Å²	40	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.2	177.3	178.9	169.3	77.2	0	0	110	L86 V103 R104 V106 I119 Y163 L164 I165	L86-M117 HydrophobicContact CD1-CE 3.65Å; L86-M117 HydrophobicContact CD1-SD 3.97Å; V103-M117 CarbonylContact C-O 3.11Å; V103-M117 WeakPolarHBondContact CA-O 3.32Å; R104-M117 PolarHBondContact N-O 3.31Å; R104-M117 PolarHBondContact O-N 2.88Å; V106-M117 HydrophobicContact CB-CB 4.42Å; V106-M117 HydrophobicContact CG1-CB 3.67Å; V106-M117 HydrophobicContact CG1-CE 3.62Å; V106-M117 HydrophobicContact CG1-CG 4.48Å; V106-M117 HydrophobicContact CG1-SD 4.12Å; V106-M117 HydrophobicContact CG2-CB 3.79Å; M117-I119 HydrophobicContact CE-CD1 3.86Å; M117-I119 HydrophobicContact CE-CG1 4.01Å; M117-I119 HydrophobicContact CG-CG1 4.08Å; M117-Y163 HydrophobicContact CG-CD1 4.28Å; M117-Y163 HydrophobicContact SD-CD1 3.89Å; M117-L164 CarbonylContact C-O 3.49Å; M117-L164 WeakPolarHBondContact CA-O 3.47Å; M117-I165 HydrophobicContact CB-CD1 3.79Å; M117-I165 HydrophobicContact CG-CD1 3.59Å; M117-I165 HydrophobicContact SD-CD1 3.81Å
118	K	91.5	Very high	85.8	Confident	24 Å²	24	40.5 Å²	40.5	10%	0.104	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	123.9	171.2	-172.9	173.4	-176.2	-177.4	0	108.8	V103 L120 E137 Y163 L164 M166 D230	V103-K118 HydrophobicContact CG2-CB 4.29Å; V103-K118 HydrophobicContact CG2-CG 4.15Å; K118-L120 HydrophobicContact CG-CD2 4.35Å; K118-L120 HydrophobicContact CG-CG 4.41Å; K118-E137 IonicContact NZ-OE1 2.69Å; K118-E137 PolarHBondContact NZ-OE1 3.34Å; K118-E137 IonicContact NZ-OE2 2.64Å; K118-Y163 WeakPolarHBondContact O-CA 3.34Å; K118-L164 HydrophobicContact CB-CB 4.31Å; K118-L164 HydrophobicContact CB-CD1 4.3Å; K118-L164 HydrophobicContact CD-CD1 4.42Å; K118-L164 HydrophobicContact CG-CD1 4.41Å; K118-L164 PolarHBondContact N-O 3.23Å; K118-L164 PolarHBondContact O-N 3.28Å; K118-M166 HydrophobicContact CB-CE 3.75Å; K118-M166 HydrophobicContact CD-CE 4.4Å; K118-D230 IonicContact NZ-OD1 3.21Å; K118-D230 PolarHBondContact NZ-OD1 3.28Å
119	I	90.4	Very high	84.7	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	124.4	-178.2	-52	158.9	0	0	0	107.5	G101 E102 R104 M117 N161 L162 Y163 I418 L419	G101-I119 WeakPolarHBondContact CA-O 3.28Å; E102-I119 HydrophobicContact CG-CD1 4.08Å; E102-I119 PolarHBondContact N-O 3.31Å; E102-I119 PolarHBondContact O-N 2.92Å; R104-I119 HydrophobicContact CG-CD1 4.02Å; M117-I119 HydrophobicContact CE-CD1 3.86Å; M117-I119 HydrophobicContact CE-CG1 4.01Å; M117-I119 HydrophobicContact CG-CG1 4.08Å; I119-N161 HydrophobicContact CG2-CB 4.01Å; I119-L162 WeakPolarHBondContact CA-O 3.49Å; I119-Y163 HydrophobicContact CG1-CD1 4.03Å; I119-Y163 HydrophobicContact CG1-CE1 4.07Å; I119-Y163 HydrophobicContact CG2-CD1 4.3Å; I119-Y163 HydrophobicContact CG2-CE1 3.89Å; I119-I418 HydrophobicContact CD1-CG2 3.87Å; I119-I418 HydrophobicContact CG2-CG2 4.36Å; I119-L419 HydrophobicContact CD1-CD2 3.63Å; I119-L419 HydrophobicContact CD1-CG 4.16Å; I119-L419 HydrophobicContact CG1-CD2 4.48Å
120	L	86.4	Confident	83.7	Confident	13 Å²	13	42 Å²	42	7%	0.068	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	129.6	-179.4	-59.3	169.4	0	0	0	110.3	F100 K118 N161 L162 L164	F100-L120 HydrophobicContact CB-CD2 4.28Å; K118-L120 HydrophobicContact CG-CD2 4.35Å; K118-L120 HydrophobicContact CG-CG 4.41Å; L120-N161 CarbonylContact O-C 3.55Å; L120-N161 VanDerWaalsContact O-CA 3.25Å; L120-N161 WeakPolarHBondContact O-CA 3.26Å; L120-L162 HydrophobicContact CB-CB 4.27Å; L120-L162 PolarHBondContact N-O 3.06Å; L120-L162 PolarHBondContact O-N 2.98Å; L120-L164 HydrophobicContact CD1-CD1 3.78Å; L120-L164 HydrophobicContact CG-CD1 4.46Å
121	R	84.8	Confident	83	Confident	103 Å²	103	39.2 Å²	39.2	39%	0.389	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.8	-179.3	-65.2	179.1	-177.6	-174.4	0.3	111.3	F100 A123 D124 M125 I418	F100-R121 PolarHBondContact O-N 3.27Å; R121-A123 VanDerWaalsContact C-N 3.29Å; R121-A123 PolarHBondContact O-N 2.89Å; R121-D124 HydrophobicContact CB-CB 4.24Å; R121-D124 PolarHBondContact O-N 3.01Å; R121-M125 VanDerWaalsContact O-CG 3.28Å; R121-M125 WeakPolarHBondContact O-CG 3.2Å; R121-M125 PolarHBondContact O-N 2.84Å; R121-I418 HydrophobicContact CG-CD1 4.24Å; R121-I418 HydrophobicContact CG-CG1 4.41Å
122	K	85.2	Confident	82.1	Confident	3 Å²	3	39.7 Å²	39.7	1%	0.013	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-38.4	-179.5	-74	-179.2	169.9	-175.5	0	113.1	M125 L126 Q157 D158 M160 L162 D438 F441	K122-M125 WeakPolarHBondContact O-CB 3.29Å; K122-M125 PolarHBondContact O-N 3.08Å; K122-L126 WeakPolarHBondContact O-CG 3.29Å; K122-L126 PolarHBondContact O-N 3.14Å; K122-Q157 VanDerWaalsContact CE-OE1 3.3Å; K122-D158 WeakPolarHBondContact CE-O 3.48Å; K122-D158 PolarHBondContact NZ-O 3.12Å; K122-M160 WeakPolarHBondContact CB-O 3.46Å; K122-M160 PolarHBondContact N-O 3.12Å; K122-L162 HydrophobicContact CD-CD2 4.42Å; K122-L162 VanDerWaalsContact CE-CD2 3.47Å; K122-L162 HydrophobicContact CG-CD2 4.1Å; K122-L162 HydrophobicContact CG-CG 4Å; K122-D438 IonicContact NZ-OD1 2.7Å; K122-D438 PolarHBondContact NZ-OD1 3.34Å; K122-D438 IonicContact NZ-OD2 3.5Å; K122-F441 HydrophobicContact CB-CE2 4.13Å; K122-F441 HydrophobicContact CB-CZ 4.43Å; K122-F441 HydrophobicContact CD-CD2 4.06Å; K122-F441 HydrophobicContact CD-CE2 4.04Å; K122-F441 HydrophobicContact CG-CD2 4.29Å; K122-F441 HydrophobicContact CG-CE2 3.89Å; K122-F441 HydrophobicContact CG-CZ 4.26Å
123	A	82.2	Confident	81.3	Confident	37 Å²	37	40.2 Å²	40.2	31%	0.306	21%	0.208	S	C	.	.	H	α-helix	trans	-58.1	-50	178.5	0	0	0	0	0	111.3	R121 M125 L126 E127	R121-A123 VanDerWaalsContact C-N 3.29Å; R121-A123 PolarHBondContact O-N 2.89Å; A123-M125 PolarHBondContact O-N 2.77Å; A123-L126 PolarHBondContact O-N 2.87Å; A123-E127 WeakPolarHBondContact O-CB 3.41Å; A123-E127 PolarHBondContact O-N 3.31Å
124	D	77.6	Confident	80.5	Confident	33 Å²	33	37.8 Å²	37.8	18%	0.176	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-32.6	179	-60	-1.1	0	0	0	111.8	F100 R121 K128	F100-D124 HydrophobicContact CD1-CB 4.35Å; R121-D124 HydrophobicContact CB-CB 4.24Å; R121-D124 PolarHBondContact O-N 3.01Å; D124-K128 WeakPolarHBondContact O-CB 3.48Å; D124-K128 WeakPolarHBondContact O-CG 3.39Å; D124-K128 PolarHBondContact O-N 2.82Å
125	M	77.7	Confident	79.5	Confident	5 Å²	5	42 Å²	42	3%	0.025	21%	0.211	C	C	.	.	H	α-helix	trans	-71.2	-37.6	177.4	-60.7	-63.7	89	0	0	112.8	F100 R121 K122 A123 E129 Q130 I134 F441	F100-M125 HydrophobicContact CB-CE 3.44Å; F100-M125 VanDerWaalsContact CB-CE 3.44Å; F100-M125 HydrophobicContact CD1-CE 3.19Å; F100-M125 HydrophobicContact CD2-CE 4.36Å; F100-M125 HydrophobicContact CE1-CE 3.96Å; F100-M125 HydrophobicContact CG-CE 3.42Å; F100-M125 VanDerWaalsContact CG-CE 3.42Å; R121-M125 VanDerWaalsContact O-CG 3.28Å; R121-M125 WeakPolarHBondContact O-CG 3.2Å; R121-M125 PolarHBondContact O-N 2.84Å; K122-M125 WeakPolarHBondContact O-CB 3.29Å; K122-M125 PolarHBondContact O-N 3.08Å; A123-M125 PolarHBondContact O-N 2.77Å; M125-E129 PolarHBondContact O-N 2.7Å; M125-Q130 HydrophobicContact CB-CB 4.43Å; M125-Q130 HydrophobicContact CE-CB 4.17Å; M125-Q130 HydrophobicContact CE-CG 4.39Å; M125-Q130 PolarHBondContact O-N 3.2Å; M125-Q130 HydrophobicContact SD-CB 3.87Å; M125-I134 HydrophobicContact CB-CD1 3.76Å; M125-I134 HydrophobicContact CG-CD1 3.33Å; M125-I134 HydrophobicContact CG-CG1 4.49Å; M125-I134 HydrophobicContact SD-CD1 3.2Å; M125-I134 WeakPolarHBondContact SD-CD1 3.47Å; M125-I134 HydrophobicContact SD-CG1 3.77Å; M125-F441 HydrophobicContact CB-CZ 4.32Å
126	L	75.1	Confident	78.3	Confident	42 Å²	42	43.6 Å²	43.6	22%	0.22	23%	0.225	C	C	.	.	H	α-helix	trans	-75.4	-48.1	177.7	-71.5	171.9	0	0	0	111.5	K122 A123 K128 E129 V131 K437 V440 F441	K122-L126 WeakPolarHBondContact O-CG 3.29Å; K122-L126 PolarHBondContact O-N 3.14Å; A123-L126 PolarHBondContact O-N 2.87Å; L126-K128 PolarHBondContact O-N 3.17Å; L126-E129 PolarHBondContact O-N 2.77Å; L126-V131 HydrophobicContact CD2-CG2 3.97Å; L126-K437 HydrophobicContact CD1-CB 4.11Å; L126-K437 HydrophobicContact CD1-CD 4.49Å; L126-K437 HydrophobicContact CD2-CB 4.34Å; L126-K437 HydrophobicContact CD2-CD 4.49Å; L126-V440 HydrophobicContact CD2-CG2 3.9Å; L126-F441 HydrophobicContact CD1-CE2 4.49Å; L126-F441 HydrophobicContact CD2-CE2 4.37Å; L126-F441 HydrophobicContact CD2-CZ 4.31Å; L126-F441 HydrophobicContact CG-CE2 4.34Å; L126-F441 HydrophobicContact CG-CZ 4.29Å
127	E	73.1	Confident	77.4	Confident	138 Å²	138	43.4 Å²	43.4	65%	0.645	22%	0.223	S	C	*	.	H	α-helix	trans	-58.1	-35.4	-178.1	-174.7	-176.7	176.6	0	0	111.8	A123	A123-E127 WeakPolarHBondContact O-CB 3.41Å; A123-E127 PolarHBondContact O-N 3.31Å
128	K	68.6	Low	76.5	Confident	76 Å²	76	44.8 Å²	44.8	33%	0.33	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	9	-175.8	-59.9	171.7	-178.1	171.8	0	113.4	F100 D124 L126 Q130	F100-K128 HydrophobicContact CD1-CD 4.13Å; F100-K128 HydrophobicContact CE1-CD 3.45Å; F100-K128 VanDerWaalsContact CE1-CD 3.45Å; F100-K128 HydrophobicContact CZ-CD 4.45Å; D124-K128 WeakPolarHBondContact O-CB 3.48Å; D124-K128 WeakPolarHBondContact O-CG 3.39Å; D124-K128 PolarHBondContact O-N 2.82Å; L126-K128 PolarHBondContact O-N 3.17Å; K128-Q130 HydrophobicContact CB-CG 3.83Å; K128-Q130 WeakPolarHBondContact O-CG 3.32Å; K128-Q130 PolarHBondContact O-N 3.15Å; K128-Q130 PolarHBondContact O-NE2 2.68Å
129	E	70.2	Confident	75.7	Confident	169 Å²	169	46.4 Å²	46.4	79%	0.79	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.3	44.3	178.4	-57.9	-178.8	170.7	0	0	114.2	M125 L126	M125-E129 PolarHBondContact O-N 2.7Å; L126-E129 PolarHBondContact O-N 2.77Å
130	Q	70.1	Confident	75	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.019	24%	0.238	C	C	.	.			trans	-100.3	2.2	-170.9	-60.3	-55.4	-36	0	0	115.5	M125 K128 G132 H133 I134	M125-Q130 HydrophobicContact CB-CB 4.43Å; M125-Q130 HydrophobicContact CE-CB 4.17Å; M125-Q130 HydrophobicContact CE-CG 4.39Å; M125-Q130 PolarHBondContact O-N 3.2Å; M125-Q130 HydrophobicContact SD-CB 3.87Å; K128-Q130 HydrophobicContact CB-CG 3.83Å; K128-Q130 WeakPolarHBondContact O-CG 3.32Å; K128-Q130 PolarHBondContact O-N 3.15Å; K128-Q130 PolarHBondContact O-NE2 2.68Å; Q130-G132 VanDerWaalsContact C-N 3.33Å; Q130-G132 PolarHBondContact O-N 2.66Å; Q130-H133 PolarHBondContact O-N 2.64Å; Q130-H133 VanDerWaalsContact O-N 3.15Å; Q130-H133 PolarHBondContact OE1-CE1 3.37Å; Q130-H133 PolarHBondContact OE1-ND1 2.99Å; Q130-I134 WeakPolarHBondContact O-CG1 3.43Å; Q130-I134 PolarHBondContact O-N 2.54Å
131	V	71.5	Confident	74.7	Confident	24 Å²	24	46 Å²	46	15%	0.145	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-39.4	-174.3	-177.9	0	0	0	0	112.6	L126 H133 I134 R135 V440 F441	L126-V131 HydrophobicContact CD2-CG2 3.97Å; V131-H133 VanDerWaalsContact C-N 3.3Å; V131-H133 PolarHBondContact O-N 3.49Å; V131-I134 PolarHBondContact O-N 2.99Å; V131-R135 WeakPolarHBondContact O-CG 3.31Å; V131-R135 PolarHBondContact O-N 3.22Å; V131-V440 HydrophobicContact CG1-CB 4.03Å; V131-V440 HydrophobicContact CG1-CG2 3.9Å; V131-V440 HydrophobicContact CG2-CG2 3.89Å; V131-F441 HydrophobicContact CB-CE1 4.44Å; V131-F441 HydrophobicContact CG1-CD1 4.32Å; V131-F441 HydrophobicContact CG1-CE1 4.02Å; V131-F441 HydrophobicContact CG2-CE1 3.89Å; V131-F441 HydrophobicContact CG2-CZ 3.92Å
132	G	66.9	Low	74.3	Confident	51 Å²	51	43.1 Å²	43.1	53%	0.526	23%	0.23	S	C	.	.	H	α-helix	trans	-61.4	-39.4	177.4	0	0	0	0	0	112.6	Q130 R135 A136	Q130-G132 VanDerWaalsContact C-N 3.33Å; Q130-G132 PolarHBondContact O-N 2.66Å; G132-R135 PolarHBondContact O-N 3.34Å; G132-A136 PolarHBondContact O-N 2.88Å
133	H	69.7	Low	73.5	Confident	40 Å²	40	48.9 Å²	48.9	19%	0.185	26%	0.256	C	S	.	.	H	α-helix	trans	-69.5	-40.2	-178.8	-54.3	102.8	0	0	0	112.6	Q130 V131 R135 A136 E137 G232 T235	Q130-H133 PolarHBondContact O-N 2.64Å; Q130-H133 VanDerWaalsContact O-N 3.15Å; Q130-H133 PolarHBondContact OE1-CE1 3.37Å; Q130-H133 PolarHBondContact OE1-ND1 2.99Å; V131-H133 VanDerWaalsContact C-N 3.3Å; V131-H133 PolarHBondContact O-N 3.49Å; H133-R135 VanDerWaalsContact C-N 3.27Å; H133-R135 PolarHBondContact O-N 3.5Å; H133-A136 WeakPolarHBondContact O-CB 3.36Å; H133-A136 PolarHBondContact O-N 3.01Å; H133-E137 PolarHBondContact O-N 2.8Å; H133-G232 WeakPolarHBondContact CB-O 3.45Å; H133-T235 PolarHBondContact NE2-OG1 2.8Å
134	I	72.1	Confident	72.9	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.036	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-38.6	175	-61.2	165.1	0	0	0	111.3	M125 Q130 V131 E137 R138 L162 F441 Y444	M125-I134 HydrophobicContact CB-CD1 3.76Å; M125-I134 HydrophobicContact CG-CD1 3.33Å; M125-I134 HydrophobicContact CG-CG1 4.49Å; M125-I134 HydrophobicContact SD-CD1 3.2Å; M125-I134 WeakPolarHBondContact SD-CD1 3.47Å; M125-I134 HydrophobicContact SD-CG1 3.77Å; Q130-I134 WeakPolarHBondContact O-CG1 3.43Å; Q130-I134 PolarHBondContact O-N 2.54Å; V131-I134 PolarHBondContact O-N 2.99Å; I134-E137 PolarHBondContact O-N 3.01Å; I134-R138 WeakPolarHBondContact O-CB 3.42Å; I134-R138 PolarHBondContact O-N 3.04Å; I134-L162 HydrophobicContact CD1-CD1 3.68Å; I134-L162 HydrophobicContact CG2-CD1 3.96Å; I134-F441 HydrophobicContact CD1-CE1 4.26Å; I134-Y444 HydrophobicContact CG2-CD2 4.21Å; I134-Y444 HydrophobicContact CG2-CE2 3.54Å
135	R	72.5	Confident	72.6	Confident	101 Å²	101	50.8 Å²	50.8	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-63.4	-46.6	175.7	-71.7	176.4	175.2	-161.9	-1.6	110.2	V131 G132 H133 E137 R138 D139 V440	V131-R135 WeakPolarHBondContact O-CG 3.31Å; V131-R135 PolarHBondContact O-N 3.22Å; G132-R135 PolarHBondContact O-N 3.34Å; H133-R135 VanDerWaalsContact C-N 3.27Å; H133-R135 PolarHBondContact O-N 3.5Å; R135-E137 PolarHBondContact O-N 3.04Å; R135-R138 PolarHBondContact O-N 3.15Å; R135-D139 WeakPolarHBondContact O-CB 3.41Å; R135-D139 PolarHBondContact O-N 3Å; R135-V440 PolarHBondContact NE-O 2.89Å; R135-V440 PolarHBondContact NH2-O 3.34Å
136	A	69.4	Low	72.7	Confident	35 Å²	35	52 Å²	52	29%	0.289	27%	0.271	S	S	.	.	H	α-helix	trans	-58.9	-45.3	175.1	0	0	0	0	0	112.5	G132 H133 R138 D139 I140	G132-A136 PolarHBondContact O-N 2.88Å; H133-A136 WeakPolarHBondContact O-CB 3.36Å; H133-A136 PolarHBondContact O-N 3.01Å; A136-R138 VanDerWaalsContact C-N 3.35Å; A136-R138 PolarHBondContact O-N 2.95Å; A136-D139 PolarHBondContact O-N 3.27Å; A136-I140 VanDerWaalsContact O-CG1 3.29Å; A136-I140 WeakPolarHBondContact O-CG1 3.35Å; A136-I140 PolarHBondContact O-N 3.41Å
137	E	75.3	Confident	73.4	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.028	29%	0.289	C	S	.	.	H	α-helix	trans	-55.9	-50.6	175.8	-166.9	174.4	-180	0	0	111.4	K118 H133 I134 R135 L141 F231 G232	K118-E137 IonicContact NZ-OE1 2.69Å; K118-E137 PolarHBondContact NZ-OE1 3.34Å; K118-E137 IonicContact NZ-OE2 2.64Å; H133-E137 PolarHBondContact O-N 2.8Å; I134-E137 PolarHBondContact O-N 3.01Å; R135-E137 PolarHBondContact O-N 3.04Å; E137-L141 HydrophobicContact CG-CD1 3.95Å; E137-L141 WeakPolarHBondContact O-CB 3.39Å; E137-L141 WeakPolarHBondContact O-CG 3.49Å; E137-L141 PolarHBondContact O-N 3.28Å; E137-F231 HydrophobicContact CG-CB 4.35Å; E137-G232 VanDerWaalsContact CB-CA 3.46Å; E137-G232 VanDerWaalsContact CG-N 3.34Å; E137-G232 WeakPolarHBondContact OE2-CA 3.49Å
138	R	76.6	Confident	74.4	Confident	29 Å²	29	50.4 Å²	50.4	11%	0.109	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-47.5	-179.8	-176.5	-158.1	65.4	-164.4	-9.1	110.2	I134 R135 A136 L141 V142 M152 N443 Y444	I134-R138 WeakPolarHBondContact O-CB 3.42Å; I134-R138 PolarHBondContact O-N 3.04Å; R135-R138 PolarHBondContact O-N 3.15Å; A136-R138 VanDerWaalsContact C-N 3.35Å; A136-R138 PolarHBondContact O-N 2.95Å; R138-L141 CarbonylContact O-C 3.58Å; R138-L141 PolarHBondContact O-N 3.11Å; R138-V142 HydrophobicContact CG-CG2 4.23Å; R138-V142 WeakPolarHBondContact O-CB 3.39Å; R138-V142 VanDerWaalsContact O-CG2 3.24Å; R138-V142 WeakPolarHBondContact O-CG2 3.01Å; R138-V142 PolarHBondContact O-N 2.88Å; R138-M152 HydrophobicContact CG-CE 4.23Å; R138-M152 HydrophobicContact CG-SD 4.47Å; R138-N443 PolarHBondContact NH1-O 3.04Å; R138-Y444 VanDerWaalsContact NH1-CA 3.34Å
139	D	75	Confident	75.5	Confident	59 Å²	59	46.8 Å²	46.8	32%	0.316	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-43.4	-174.7	-64.6	-13.2	0	0	0	110.6	R135 A136 L141 V142 E143	R135-D139 WeakPolarHBondContact O-CB 3.41Å; R135-D139 PolarHBondContact O-N 3Å; A136-D139 PolarHBondContact O-N 3.27Å; D139-L141 PolarHBondContact O-N 3.41Å; D139-V142 PolarHBondContact O-N 3.47Å; D139-E143 WeakPolarHBondContact O-CB 3.29Å; D139-E143 WeakPolarHBondContact O-CG 3.44Å; D139-E143 PolarHBondContact O-N 3.19Å
140	I	75.2	Confident	76.5	Confident	2 Å²	2	39 Å²	39	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-50.3	171	-67.7	167	0	0	0	110.6	A136 V142 E143 A144 F208 F231	A136-I140 VanDerWaalsContact O-CG1 3.29Å; A136-I140 WeakPolarHBondContact O-CG1 3.35Å; A136-I140 PolarHBondContact O-N 3.41Å; I140-V142 VanDerWaalsContact C-N 3.26Å; I140-V142 PolarHBondContact O-N 3.21Å; I140-E143 PolarHBondContact O-N 3.13Å; I140-A144 HydrophobicContact CG2-CB 4.46Å; I140-A144 WeakPolarHBondContact O-CA 3.44Å; I140-A144 WeakPolarHBondContact O-CB 2.86Å; I140-A144 PolarHBondContact O-N 3.18Å; I140-F208 HydrophobicContact CD1-CB 4.12Å; I140-F208 HydrophobicContact CD1-CD1 3.51Å; I140-F208 HydrophobicContact CD1-CE1 4.02Å; I140-F208 HydrophobicContact CD1-CG 3.82Å; I140-F208 HydrophobicContact CG1-CB 4.34Å; I140-F208 HydrophobicContact CG1-CD1 3.29Å; I140-F208 HydrophobicContact CG1-CD2 3.88Å; I140-F208 HydrophobicContact CG1-CE1 3.35Å; I140-F208 HydrophobicContact CG1-CE2 3.94Å; I140-F208 HydrophobicContact CG1-CG 3.57Å; I140-F208 HydrophobicContact CG1-CZ 3.68Å; I140-F231 HydrophobicContact CB-CB 4.35Å; I140-F231 HydrophobicContact CB-CG 4.43Å; I140-F231 HydrophobicContact CD1-CB 3.79Å; I140-F231 HydrophobicContact CD1-CG 4.37Å; I140-F231 HydrophobicContact CG2-CB 4.19Å; I140-F231 HydrophobicContact CG2-CD1 3.9Å; I140-F231 HydrophobicContact CG2-CD2 4.08Å; I140-F231 HydrophobicContact CG2-CE1 4.33Å; I140-F231 HydrophobicContact CG2-CG 3.76Å
141	L	80.1	Confident	77.4	Confident	3 Å²	3	40.9 Å²	40.9	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-29.7	-178.1	-72.9	172.7	0	0	0	112.5	E137 R138 D139 V149 V150 M152 L164 M166 F231 R448	E137-L141 HydrophobicContact CG-CD1 3.95Å; E137-L141 WeakPolarHBondContact O-CB 3.39Å; E137-L141 WeakPolarHBondContact O-CG 3.49Å; E137-L141 PolarHBondContact O-N 3.28Å; R138-L141 CarbonylContact O-C 3.58Å; R138-L141 PolarHBondContact O-N 3.11Å; D139-L141 PolarHBondContact O-N 3.41Å; L141-V149 HydrophobicContact CD2-CG1 3.97Å; L141-V150 WeakPolarHBondContact CD2-O 3.29Å; L141-M152 HydrophobicContact CB-CB 3.77Å; L141-M152 HydrophobicContact CB-CE 4.14Å; L141-M152 HydrophobicContact CB-SD 4.11Å; L141-M152 HydrophobicContact CD1-CB 4.28Å; L141-M152 HydrophobicContact CD1-SD 4.3Å; L141-M152 HydrophobicContact CG-CB 4.45Å; L141-L164 HydrophobicContact CD1-CD2 3.97Å; L141-M166 HydrophobicContact CD1-SD 4.46Å; L141-F231 HydrophobicContact CD2-CD2 3.78Å; L141-F231 HydrophobicContact CD2-CE2 3.76Å; L141-F231 HydrophobicContact CG-CD2 4.11Å; L141-R448 PolarHBondContact O-NH2 3.39Å
142	V	75.4	Confident	78.2	Confident	42 Å²	42	39.8 Å²	39.8	26%	0.255	21%	0.213	S	C	.	.	H	α-helix	trans	-71.8	-48	174.7	169.2	0	0	0	0	110.8	R138 D139 I140 M152 Y446	R138-V142 HydrophobicContact CG-CG2 4.23Å; R138-V142 WeakPolarHBondContact O-CB 3.39Å; R138-V142 VanDerWaalsContact O-CG2 3.24Å; R138-V142 WeakPolarHBondContact O-CG2 3.01Å; R138-V142 PolarHBondContact O-N 2.88Å; D139-V142 PolarHBondContact O-N 3.47Å; I140-V142 VanDerWaalsContact C-N 3.26Å; I140-V142 PolarHBondContact O-N 3.21Å; V142-M152 HydrophobicContact CB-CE 4.38Å; V142-M152 HydrophobicContact CG2-CE 3.29Å; V142-Y446 HydrophobicContact CB-CE2 4.28Å; V142-Y446 HydrophobicContact CG1-CD2 4.14Å; V142-Y446 HydrophobicContact CG1-CE2 3.54Å; V142-Y446 HydrophobicContact CG2-CD1 3.91Å; V142-Y446 HydrophobicContact CG2-CD2 3.71Å; V142-Y446 HydrophobicContact CG2-CE1 3.94Å; V142-Y446 HydrophobicContact CG2-CE2 3.76Å; V142-Y446 HydrophobicContact CG2-CG 3.77Å
143	E	70.3	Confident	79.2	Confident	124 Å²	124	38.4 Å²	38.4	58%	0.579	19%	0.193	S	C	*	.	H	α-helix	trans	-79.1	-34.2	-173.6	-70	-178.8	-175.2	0	0	112.9	D139 I140 D145	D139-E143 WeakPolarHBondContact O-CB 3.29Å; D139-E143 WeakPolarHBondContact O-CG 3.44Å; D139-E143 PolarHBondContact O-N 3.19Å; I140-E143 PolarHBondContact O-N 3.13Å; E143-D145 PolarHBondContact O-N 2.96Å
144	A	68	Low	80.1	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.033	19%	0.186	C	C	.	.			trans	-74.1	89.3	178.2	0	0	0	0	0	110.3	I140 S146 V149 L206	I140-A144 HydrophobicContact CG2-CB 4.46Å; I140-A144 WeakPolarHBondContact O-CA 3.44Å; I140-A144 WeakPolarHBondContact O-CB 2.86Å; I140-A144 PolarHBondContact O-N 3.18Å; A144-S146 PolarHBondContact O-N 3.42Å; A144-V149 HydrophobicContact CB-CB 4.1Å; A144-V149 HydrophobicContact CB-CG1 3.94Å; A144-V149 HydrophobicContact CB-CG2 4.13Å; A144-L206 HydrophobicContact CB-CD1 4.26Å
145	D	71	Confident	81	Confident	106 Å²	106	36.5 Å²	36.5	57%	0.567	18%	0.184	S	C	*	.			trans	-87.7	54.6	156.6	-160.2	40.8	0	0	0	109.6	E143 K151 R448	E143-D145 PolarHBondContact O-N 2.96Å; D145-K151 IonicContact OD1-NZ 2.89Å; D145-K151 PolarHBondContact OD1-NZ 2.85Å; D145-R448 IonicContact OD1-NH1 3.72Å
146	S	81.8	Confident	81.8	Confident	29 Å²	29	32 Å²	32	20%	0.203	17%	0.167	C	C	.	.			trans	-100.1	141.4	179.4	177.8	0	0	0	0	110.4	A144 W148 V149 S202	A144-S146 PolarHBondContact O-N 3.42Å; S146-W148 PolarHBondContact O-N 3.44Å; S146-W148 VanDerWaalsContact O-N 3.16Å; S146-W148 PolarHBondContact OG-N 3.22Å; S146-V149 PolarHBondContact O-N 3.07Å; S146-S202 PolarHBondContact OG-OG 3.31Å
147	L	89.7	Confident	82.7	Confident	115 Å²	115	32.4 Å²	32.4	60%	0.602	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-22.9	171.5	-68.7	173.4	0	0	0	112.2	K227 R391	L147-K227 VanDerWaalsContact O-CE 3.24Å; L147-K227 WeakPolarHBondContact O-CE 3.47Å; L147-R391 VanDerWaalsContact O-CZ 3.28Å; L147-R391 PolarHBondContact O-NH1 3.15Å; L147-R391 PolarHBondContact O-NH2 3.4Å
148	W	92.8	Very high	83.3	Confident	32 Å²	32	35 Å²	35	12%	0.121	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-4.1	-172.9	-57.2	109.2	0	0	0	114.7	S146 E195 L198 A199 K227 L228 I390 R391	S146-W148 PolarHBondContact O-N 3.44Å; S146-W148 VanDerWaalsContact O-N 3.16Å; S146-W148 PolarHBondContact OG-N 3.22Å; W148-E195 HydrophobicContact CH2-CB 4.29Å; W148-E195 HydrophobicContact CH2-CG 4.11Å; W148-E195 HydrophobicContact CZ3-CB 3.75Å; W148-E195 HydrophobicContact CZ3-CG 3.93Å; W148-L198 HydrophobicContact CD2-CB 4.21Å; W148-L198 HydrophobicContact CH2-CB 4.1Å; W148-L198 HydrophobicContact CH2-CD1 3.8Å; W148-L198 HydrophobicContact CZ2-CB 3.64Å; W148-L198 HydrophobicContact CZ2-CD1 3.47Å; W148-L198 VanDerWaalsContact CZ2-CD1 3.47Å; W148-L198 HydrophobicContact CZ2-CG 4.22Å; W148-A199 HydrophobicContact CB-CB 3.65Å; W148-A199 HydrophobicContact CD2-CB 4.19Å; W148-A199 HydrophobicContact CE3-CB 4Å; W148-A199 HydrophobicContact CG-CB 4.07Å; W148-K227 CarbonylContact O-C 3.55Å; W148-K227 WeakPolarHBondContact O-CA 3.44Å; W148-L228 PolarHBondContact O-N 2.76Å; W148-I390 HydrophobicContact CH2-CG2 4.17Å; W148-R391 HydrophobicContact CH2-CB 4.16Å; W148-R391 HydrophobicContact CH2-CG 4.29Å
149	V	91.6	Very high	83.8	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-117.5	141.9	-177.5	173.3	0	0	0	0	109.1	L141 A144 S146 K151 I203 K227 F231	L141-V149 HydrophobicContact CD2-CG1 3.97Å; A144-V149 HydrophobicContact CB-CB 4.1Å; A144-V149 HydrophobicContact CB-CG1 3.94Å; A144-V149 HydrophobicContact CB-CG2 4.13Å; S146-V149 PolarHBondContact O-N 3.07Å; V149-K151 PolarHBondContact O-N 3.43Å; V149-I203 HydrophobicContact CG2-CG2 3.7Å; V149-K227 PolarHBondContact O-NZ 3.45Å; V149-F231 HydrophobicContact CB-CE2 4.47Å; V149-F231 HydrophobicContact CB-CZ 4.07Å; V149-F231 HydrophobicContact CG1-CD2 4.45Å; V149-F231 HydrophobicContact CG1-CE2 3.39Å; V149-F231 HydrophobicContact CG1-CZ 3.43Å; V149-F231 VanDerWaalsContact CG1-CZ 3.43Å; V149-F231 HydrophobicContact CG2-CE1 4.34Å; V149-F231 HydrophobicContact CG2-CZ 3.75Å
150	V	91.4	Very high	84.3	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.024	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-57.8	127	172.1	171.7	0	0	0	0	109.8	L141 M152 M166 E167 L169 L219 K227 L228	L141-V150 WeakPolarHBondContact CD2-O 3.29Å; V150-M152 PolarHBondContact O-N 3.43Å; V150-M166 HydrophobicContact CG1-CB 3.82Å; V150-M166 HydrophobicContact CG1-CG 4.26Å; V150-M166 HydrophobicContact CG1-SD 4.13Å; V150-E167 HydrophobicContact CG1-CG 4.1Å; V150-L169 HydrophobicContact CG2-CD1 3.77Å; V150-L219 HydrophobicContact CG2-CD1 3.93Å; V150-K227 HydrophobicContact CG2-CB 4.28Å; V150-L228 VanDerWaalsContact CG2-O 3.32Å; V150-L228 WeakPolarHBondContact CG2-O 3.13Å; V150-L228 PolarHBondContact N-O 3.41Å
151	K	89.2	Confident	84.9	Confident	45 Å²	45	44.2 Å²	44.2	20%	0.196	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-77.8	122.1	-179.3	-165	159.6	-173.8	135.9	0	111.1	D145 V149 F153 M166 E167 R448	D145-K151 IonicContact OD1-NZ 2.89Å; D145-K151 PolarHBondContact OD1-NZ 2.85Å; V149-K151 PolarHBondContact O-N 3.43Å; K151-F153 HydrophobicContact CD-CE1 4.47Å; K151-F153 HydrophobicContact CD-CZ 4.44Å; K151-F153 HydrophobicContact CG-CZ 4.42Å; K151-M166 CarbonylContact O-C 3.59Å; K151-M166 VanDerWaalsContact O-CA 3.31Å; K151-M166 WeakPolarHBondContact O-CA 3.45Å; K151-E167 HydrophobicContact CB-CG 4.13Å; K151-E167 VanDerWaalsContact CB-OE1 3.24Å; K151-E167 WeakPolarHBondContact CB-OE1 3.4Å; K151-E167 PolarHBondContact N-OE1 3.16Å; K151-E167 PolarHBondContact O-N 3.44Å; K151-R448 VanDerWaalsContact CE-CD 3.44Å
152	M	88.6	Confident	85.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	123.3	172.4	-176.1	-167.7	63.4	0	0	111.5	R138 L141 V142 V150 L164 I165 M166 Y446 R448	R138-M152 HydrophobicContact CG-CE 4.23Å; R138-M152 HydrophobicContact CG-SD 4.47Å; L141-M152 HydrophobicContact CB-CB 3.77Å; L141-M152 HydrophobicContact CB-CE 4.14Å; L141-M152 HydrophobicContact CB-SD 4.11Å; L141-M152 HydrophobicContact CD1-CB 4.28Å; L141-M152 HydrophobicContact CD1-SD 4.3Å; L141-M152 HydrophobicContact CG-CB 4.45Å; V142-M152 HydrophobicContact CB-CE 4.38Å; V142-M152 HydrophobicContact CG2-CE 3.29Å; V150-M152 PolarHBondContact O-N 3.43Å; M152-L164 HydrophobicContact SD-CD2 4.02Å; M152-I165 CarbonylContact C-O 3.58Å; M152-M166 HydrophobicContact CB-CG 4.35Å; M152-M166 HydrophobicContact CG-CG 4.38Å; M152-Y446 HydrophobicContact CE-CD1 3.42Å; M152-Y446 VanDerWaalsContact CE-CD1 3.42Å; M152-Y446 HydrophobicContact CE-CE1 3.75Å; M152-Y446 HydrophobicContact CE-CG 4.17Å; M152-R448 PolarHBondContact O-NE 3.03Å; M152-R448 PolarHBondContact O-NH2 2.92Å
153	F	88.1	Confident	86.1	Confident	23 Å²	23	42.1 Å²	42.1	10%	0.101	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-45.5	179.8	-67.2	-76.5	0	0	0	113.6	Y115 K151 I165 E167 R448	Y115-F153 AromaticContact CD1-CD2 3.69Å; Y115-F153 HydrophobicContact CD1-CD2 3.69Å; Y115-F153 HydrophobicContact CD1-CE2 4.09Å; Y115-F153 HydrophobicContact CD1-CG 4.46Å; Y115-F153 HydrophobicContact CE1-CB 4.38Å; Y115-F153 AromaticContact CE1-CD2 3.52Å; Y115-F153 HydrophobicContact CE1-CD2 3.52Å; Y115-F153 AromaticContact CE1-CE2 3.86Å; Y115-F153 HydrophobicContact CE1-CE2 3.86Å; Y115-F153 AromaticContact CE1-CG 3.95Å; Y115-F153 HydrophobicContact CE1-CG 3.95Å; K151-F153 HydrophobicContact CD-CE1 4.47Å; K151-F153 HydrophobicContact CD-CZ 4.44Å; K151-F153 HydrophobicContact CG-CZ 4.42Å; F153-I165 PolarHBondContact N-O 3.21Å; F153-E167 HydrophobicContact CE2-CB 3.87Å; F153-R448 WeakPolarHBondContact O-CB 3.14Å; F153-R448 PolarHBondContact O-N 2.86Å
154	Y	89.1	Confident	87.1	Confident	6 Å²	6	36.2 Å²	36.2	2%	0.024	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	153	-175.5	-39.1	-68.2	0	0	0	110.2	L79 L84 F89 Y115 I165 Y446 K447 G451	L79-Y154 HydrophobicContact CD2-CE1 4.26Å; L84-Y154 HydrophobicContact CD1-CD1 3.75Å; L84-Y154 HydrophobicContact CD1-CD2 4.36Å; L84-Y154 HydrophobicContact CD1-CE1 4.26Å; L84-Y154 HydrophobicContact CD1-CG 3.82Å; F89-Y154 HydrophobicContact CZ-CD2 4.16Å; F89-Y154 HydrophobicContact CZ-CE2 4.49Å; Y115-Y154 HydrophobicContact CE1-CE2 4.37Å; Y154-I165 HydrophobicContact CD2-CB 3.76Å; Y154-I165 HydrophobicContact CD2-CG1 4.08Å; Y154-I165 HydrophobicContact CD2-CG2 3.71Å; Y154-I165 HydrophobicContact CE2-CG2 4.3Å; Y154-I165 HydrophobicContact CG-CB 4.37Å; Y154-I165 PolarHBondContact N-O 3.04Å; Y154-I165 PolarHBondContact O-N 2.85Å; Y154-Y446 VanDerWaalsContact CA-O 3.31Å; Y154-Y446 WeakPolarHBondContact CA-O 3.29Å; Y154-K447 HydrophobicContact CD1-CB 4.24Å; Y154-K447 HydrophobicContact CD1-CG 4.27Å; Y154-G451 PolarHBondContact OH-O 2.89Å
155	S	89.7	Confident	88.2	Confident	1 Å²	1	36 Å²	36	1%	0.007	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.9	160.6	58.3	0	0	0	0	109.1	Y163 Y444 T445 Y446	S155-Y163 CarbonylContact C-O 3.54Å; S155-Y163 WeakPolarHBondContact CA-O 3.12Å; S155-Y163 WeakPolarHBondContact CB-O 3.13Å; S155-Y444 WeakPolarHBondContact CB-O 3.02Å; S155-Y444 PolarHBondContact OG-O 3.06Å; S155-T445 CarbonylContact O-C 3.57Å; S155-T445 VanDerWaalsContact O-CA 3.23Å; S155-T445 WeakPolarHBondContact O-CA 3.3Å; S155-T445 WeakPolarHBondContact O-CG2 3.29Å; S155-Y446 PolarHBondContact N-O 3.46Å; S155-Y446 PolarHBondContact O-N 3.07Å; S155-Y446 VanDerWaalsContact OG-CB 3.29Å; S155-Y446 WeakPolarHBondContact OG-CB 3.34Å; S155-Y446 PolarHBondContact OG-N 3.07Å
156	F	89.8	Confident	89.3	Confident	6 Å²	6	32 Å²	32	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	171.5	177.9	60	-91.3	0	0	0	110	L84 L86 F89 Y163 I165 Y444	L84-F156 HydrophobicContact CB-CD1 4.45Å; L86-F156 HydrophobicContact CB-CE2 4.49Å; F89-F156 HydrophobicContact CD2-CE1 4.32Å; F89-F156 HydrophobicContact CD2-CZ 4.18Å; F89-F156 AromaticContact CE2-CE1 3.74Å; F89-F156 HydrophobicContact CE2-CE1 3.74Å; F89-F156 HydrophobicContact CE2-CZ 4.04Å; F89-F156 HydrophobicContact CZ-CE1 4.44Å; F156-Y163 AromaticContact CD2-CD2 3.55Å; F156-Y163 HydrophobicContact CD2-CD2 3.55Å; F156-Y163 HydrophobicContact CD2-CE2 4.36Å; F156-Y163 AromaticContact CD2-CG 3.86Å; F156-Y163 HydrophobicContact CD2-CG 3.86Å; F156-Y163 HydrophobicContact CE2-CD1 4.02Å; F156-Y163 AromaticContact CE2-CD2 3.39Å; F156-Y163 HydrophobicContact CE2-CD2 3.39Å; F156-Y163 HydrophobicContact CE2-CE2 4.06Å; F156-Y163 AromaticContact CE2-CG 3.38Å; F156-Y163 HydrophobicContact CE2-CG 3.38Å; F156-Y163 HydrophobicContact CZ-CD1 4.21Å; F156-Y163 HydrophobicContact CZ-CD2 4.26Å; F156-Y163 AromaticContact CZ-CG 3.78Å; F156-Y163 HydrophobicContact CZ-CG 3.78Å; F156-Y163 PolarHBondContact N-O 3.33Å; F156-Y163 WeakPolarHBondContact O-CB 3.25Å; F156-Y163 PolarHBondContact O-N 3.4Å; F156-I165 HydrophobicContact CD1-CG1 4.43Å; F156-I165 HydrophobicContact CE1-CD1 3.9Å; F156-I165 HydrophobicContact CE1-CG1 3.74Å; F156-I165 HydrophobicContact CZ-CD1 4.38Å; F156-Y444 WeakPolarHBondContact O-CD1 2.98Å; F156-Y444 WeakPolarHBondContact O-CE1 3.15Å
157	Q	89.1	Confident	89.7	Confident	44 Å²	44	32.7 Å²	32.7	21%	0.206	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	153.7	-177	64.1	-175.8	-59.7	0	0	110.7	K122 N161 L162 F441 Y444	K122-Q157 VanDerWaalsContact CE-OE1 3.3Å; Q157-N161 WeakPolarHBondContact CA-O 3.47Å; Q157-L162 HydrophobicContact CB-CD2 3.65Å; Q157-F441 PolarHBondContact NE2-O 2.99Å; Q157-F441 VanDerWaalsContact OE1-CB 3.27Å; Q157-Y444 HydrophobicContact CB-CD1 4.16Å
158	D	87.7	Confident	90	Very high	60 Å²	60	28.3 Å²	28.3	32%	0.321	13%	0.131	S	C	.	.			trans	-119	-159.4	166.5	72.8	11.7	0	0	0	110.2	K122 M160 N161 Y163	K122-D158 WeakPolarHBondContact CE-O 3.48Å; K122-D158 PolarHBondContact NZ-O 3.12Å; D158-M160 VanDerWaalsContact C-N 3.3Å; D158-M160 PolarHBondContact O-N 2.92Å; D158-M160 PolarHBondContact OD1-N 3.12Å; D158-N161 PolarHBondContact N-O 3.36Å; D158-N161 PolarHBondContact OD1-N 3.43Å; D158-Y163 HydrophobicContact CB-CE2 4.24Å; D158-Y163 PolarHBondContact OD2-OH 3.5Å
159	K	86	Confident	90.1	Very high	159 Å²	159	27.3 Å²	27.3	69%	0.691	13%	0.128	S	C	*	.	S	Bend	trans	-68.7	-28.7	179.7	-66.3	-177.7	-179.4	177.8	0	113.2
160	M	85.9	Confident	90.2	Very high	113 Å²	113	27.7 Å²	27.7	56%	0.557	13%	0.13	S	C	*	.	S	Bend	trans	-109.9	-33.5	-168.5	-61.5	-59	-67.5	0	0	112.4	K122 D158	K122-M160 WeakPolarHBondContact CB-O 3.46Å; K122-M160 PolarHBondContact N-O 3.12Å; D158-M160 VanDerWaalsContact C-N 3.3Å; D158-M160 PolarHBondContact O-N 2.92Å; D158-M160 PolarHBondContact OD1-N 3.12Å
161	N	88.4	Confident	90.4	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.059	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	157	-164	-59.8	-51.3	0	0	0	112.8	I119 L120 Q157 D158 Y163	I119-N161 HydrophobicContact CG2-CB 4.01Å; L120-N161 CarbonylContact O-C 3.55Å; L120-N161 VanDerWaalsContact O-CA 3.25Å; L120-N161 WeakPolarHBondContact O-CA 3.26Å; Q157-N161 WeakPolarHBondContact CA-O 3.47Å; D158-N161 PolarHBondContact N-O 3.36Å; D158-N161 PolarHBondContact OD1-N 3.43Å; N161-Y163 HydrophobicContact CB-CD2 4.45Å; N161-Y163 HydrophobicContact CB-CE1 4.33Å; N161-Y163 HydrophobicContact CB-CE2 3.66Å; N161-Y163 WeakPolarHBondContact CB-OH 3.47Å; N161-Y163 PolarHBondContact ND2-OH 3.1Å
162	L	89	Confident	90.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142.8	165.2	-55.3	177.6	0	0	0	108.9	I119 L120 K122 I134 Q157 F441 Y444	I119-L162 WeakPolarHBondContact CA-O 3.49Å; L120-L162 HydrophobicContact CB-CB 4.27Å; L120-L162 PolarHBondContact N-O 3.06Å; L120-L162 PolarHBondContact O-N 2.98Å; K122-L162 HydrophobicContact CD-CD2 4.42Å; K122-L162 VanDerWaalsContact CE-CD2 3.47Å; K122-L162 HydrophobicContact CG-CD2 4.1Å; K122-L162 HydrophobicContact CG-CG 4Å; I134-L162 HydrophobicContact CD1-CD1 3.68Å; I134-L162 HydrophobicContact CG2-CD1 3.96Å; Q157-L162 HydrophobicContact CB-CD2 3.65Å; L162-F441 HydrophobicContact CD1-CD1 3.73Å; L162-F441 HydrophobicContact CD1-CE1 3.66Å; L162-F441 HydrophobicContact CD1-CZ 4.44Å; L162-F441 HydrophobicContact CD2-CB 4.24Å; L162-F441 HydrophobicContact CD2-CD1 3.97Å; L162-F441 HydrophobicContact CD2-CG 4.02Å; L162-F441 HydrophobicContact CG-CD1 4.42Å; L162-Y444 HydrophobicContact CB-CD1 4.49Å; L162-Y444 HydrophobicContact CB-CE1 3.78Å; L162-Y444 HydrophobicContact CB-CE2 4.26Å; L162-Y444 HydrophobicContact CD1-CD2 4.37Å; L162-Y444 HydrophobicContact CD1-CE2 4.05Å; L162-Y444 HydrophobicContact CD2-CD1 3.96Å; L162-Y444 HydrophobicContact CD2-CD2 4.33Å; L162-Y444 HydrophobicContact CD2-CE1 4.09Å; L162-Y444 HydrophobicContact CD2-CE2 4.47Å; L162-Y444 HydrophobicContact CD2-CG 4.07Å; L162-Y444 HydrophobicContact CG-CE1 4.44Å
163	Y	90.8	Very high	90.8	Very high	1 Å²	1	26.9 Å²	26.9	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.3	-175.8	-58.2	-91.4	0	0	0	110.2	L86 M117 K118 I119 S155 F156 D158 N161 L419 Y444	L86-Y163 HydrophobicContact CD1-CD1 4.43Å; L86-Y163 HydrophobicContact CD1-CE1 3.88Å; M117-Y163 HydrophobicContact CG-CD1 4.28Å; M117-Y163 HydrophobicContact SD-CD1 3.89Å; K118-Y163 WeakPolarHBondContact O-CA 3.34Å; I119-Y163 HydrophobicContact CG1-CD1 4.03Å; I119-Y163 HydrophobicContact CG1-CE1 4.07Å; I119-Y163 HydrophobicContact CG2-CD1 4.3Å; I119-Y163 HydrophobicContact CG2-CE1 3.89Å; S155-Y163 CarbonylContact C-O 3.54Å; S155-Y163 WeakPolarHBondContact CA-O 3.12Å; S155-Y163 WeakPolarHBondContact CB-O 3.13Å; F156-Y163 AromaticContact CD2-CD2 3.55Å; F156-Y163 HydrophobicContact CD2-CD2 3.55Å; F156-Y163 HydrophobicContact CD2-CE2 4.36Å; F156-Y163 AromaticContact CD2-CG 3.86Å; F156-Y163 HydrophobicContact CD2-CG 3.86Å; F156-Y163 HydrophobicContact CE2-CD1 4.02Å; F156-Y163 AromaticContact CE2-CD2 3.39Å; F156-Y163 HydrophobicContact CE2-CD2 3.39Å; F156-Y163 HydrophobicContact CE2-CE2 4.06Å; F156-Y163 AromaticContact CE2-CG 3.38Å; F156-Y163 HydrophobicContact CE2-CG 3.38Å; F156-Y163 HydrophobicContact CZ-CD1 4.21Å; F156-Y163 HydrophobicContact CZ-CD2 4.26Å; F156-Y163 AromaticContact CZ-CG 3.78Å; F156-Y163 HydrophobicContact CZ-CG 3.78Å; F156-Y163 PolarHBondContact N-O 3.33Å; F156-Y163 WeakPolarHBondContact O-CB 3.25Å; F156-Y163 PolarHBondContact O-N 3.4Å; D158-Y163 HydrophobicContact CB-CE2 4.24Å; D158-Y163 PolarHBondContact OD2-OH 3.5Å; N161-Y163 HydrophobicContact CB-CD2 4.45Å; N161-Y163 HydrophobicContact CB-CE1 4.33Å; N161-Y163 HydrophobicContact CB-CE2 3.66Å; N161-Y163 WeakPolarHBondContact CB-OH 3.47Å; N161-Y163 PolarHBondContact ND2-OH 3.1Å; Y163-L419 HydrophobicContact CE1-CD2 4.31Å; Y163-Y444 WeakPolarHBondContact O-CE1 3.36Å
164	L	90.9	Very high	91.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	125.8	167.2	-57.3	93	0	0	0	109.3	M117 K118 L120 L141 M152 M166 Y444	M117-L164 CarbonylContact C-O 3.49Å; M117-L164 WeakPolarHBondContact CA-O 3.47Å; K118-L164 HydrophobicContact CB-CB 4.31Å; K118-L164 HydrophobicContact CB-CD1 4.3Å; K118-L164 HydrophobicContact CD-CD1 4.42Å; K118-L164 HydrophobicContact CG-CD1 4.41Å; K118-L164 PolarHBondContact N-O 3.23Å; K118-L164 PolarHBondContact O-N 3.28Å; L120-L164 HydrophobicContact CD1-CD1 3.78Å; L120-L164 HydrophobicContact CG-CD1 4.46Å; L141-L164 HydrophobicContact CD1-CD2 3.97Å; M152-L164 HydrophobicContact SD-CD2 4.02Å; L164-M166 HydrophobicContact CB-CG 4.49Å; L164-Y444 WeakPolarHBondContact CD1-OH 3.36Å; L164-Y444 VanDerWaalsContact CG-OH 3.22Å; L164-Y444 WeakPolarHBondContact CG-OH 3.39Å
165	I	92.7	Very high	91.2	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	117.7	175.3	-51.2	-61.1	0	0	0	108.6	F89 Y115 M117 M152 F153 Y154 F156	F89-I165 HydrophobicContact CE1-CD1 4.17Å; F89-I165 HydrophobicContact CE1-CG1 4.32Å; F89-I165 HydrophobicContact CE1-CG2 4.18Å; F89-I165 HydrophobicContact CE2-CD1 4.35Å; F89-I165 HydrophobicContact CE2-CG1 4.42Å; F89-I165 HydrophobicContact CZ-CD1 4.09Å; F89-I165 HydrophobicContact CZ-CG1 3.94Å; F89-I165 HydrophobicContact CZ-CG2 4.45Å; Y115-I165 HydrophobicContact CD1-CG2 3.67Å; Y115-I165 HydrophobicContact CD2-CG2 4.22Å; Y115-I165 HydrophobicContact CE1-CG2 4.4Å; Y115-I165 HydrophobicContact CG-CG2 3.56Å; M117-I165 HydrophobicContact CB-CD1 3.79Å; M117-I165 HydrophobicContact CG-CD1 3.59Å; M117-I165 HydrophobicContact SD-CD1 3.81Å; M152-I165 CarbonylContact C-O 3.58Å; F153-I165 PolarHBondContact N-O 3.21Å; Y154-I165 HydrophobicContact CD2-CB 3.76Å; Y154-I165 HydrophobicContact CD2-CG1 4.08Å; Y154-I165 HydrophobicContact CD2-CG2 3.71Å; Y154-I165 HydrophobicContact CE2-CG2 4.3Å; Y154-I165 HydrophobicContact CG-CB 4.37Å; Y154-I165 PolarHBondContact N-O 3.04Å; Y154-I165 PolarHBondContact O-N 2.85Å; F156-I165 HydrophobicContact CD1-CG1 4.43Å; F156-I165 HydrophobicContact CE1-CD1 3.9Å; F156-I165 HydrophobicContact CE1-CG1 3.74Å; F156-I165 HydrophobicContact CZ-CD1 4.38Å
166	M	92.3	Very high	91.2	Very high	21 Å²	21	26.4 Å²	26.4	10%	0.103	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	162.5	-172.8	-59.6	174.7	-63.2	0	0	110.7	Y115 A116 K118 L141 V150 K151 M152 L164	Y115-M166 WeakPolarHBondContact CA-O 3.43Å; Y115-M166 WeakPolarHBondContact CB-O 3.37Å; A116-M166 PolarHBondContact N-O 3.47Å; A116-M166 PolarHBondContact O-N 2.8Å; K118-M166 HydrophobicContact CB-CE 3.75Å; K118-M166 HydrophobicContact CD-CE 4.4Å; L141-M166 HydrophobicContact CD1-SD 4.46Å; V150-M166 HydrophobicContact CG1-CB 3.82Å; V150-M166 HydrophobicContact CG1-CG 4.26Å; V150-M166 HydrophobicContact CG1-SD 4.13Å; K151-M166 CarbonylContact O-C 3.59Å; K151-M166 VanDerWaalsContact O-CA 3.31Å; K151-M166 WeakPolarHBondContact O-CA 3.45Å; M152-M166 HydrophobicContact CB-CG 4.35Å; M152-M166 HydrophobicContact CG-CG 4.38Å; L164-M166 HydrophobicContact CB-CG 4.49Å
167	E	91.9	Very high	91.4	Very high	45 Å²	45	27.2 Å²	27.2	21%	0.21	13%	0.133	C	C	.	.			trans	-58.5	138.9	167.7	66.9	-177.3	139.3	0	0	110.7	V150 K151 F153 L169 K227	V150-E167 HydrophobicContact CG1-CG 4.1Å; K151-E167 HydrophobicContact CB-CG 4.13Å; K151-E167 VanDerWaalsContact CB-OE1 3.24Å; K151-E167 WeakPolarHBondContact CB-OE1 3.4Å; K151-E167 PolarHBondContact N-OE1 3.16Å; K151-E167 PolarHBondContact O-N 3.44Å; F153-E167 HydrophobicContact CE2-CB 3.87Å; E167-L169 HydrophobicContact CG-CD2 3.93Å; E167-L169 HydrophobicContact CG-CG 4.31Å; E167-K227 IonicContact OE1-NZ 2.77Å; E167-K227 PolarHBondContact OE1-NZ 3.44Å; E167-K227 IonicContact OE2-NZ 3.27Å
168	F	94.4	Very high	91.5	Very high	23 Å²	23	25.5 Å²	25.5	10%	0.101	13%	0.126	C	C	.	.			trans	-83.9	126	172.4	173.5	-122.6	0	0	0	109.6	I95 L105 V114 P170 I404 D406 T407 F410	I95-F168 HydrophobicContact CD1-CD2 3.95Å; I95-F168 HydrophobicContact CD1-CE2 3.84Å; L105-F168 HydrophobicContact CD1-CB 4.01Å; L105-F168 HydrophobicContact CD1-CD1 3.56Å; L105-F168 HydrophobicContact CD1-CD2 3.47Å; L105-F168 VanDerWaalsContact CD1-CD2 3.47Å; L105-F168 HydrophobicContact CD1-CE1 3.79Å; L105-F168 HydrophobicContact CD1-CE2 3.72Å; L105-F168 HydrophobicContact CD1-CG 3.38Å; L105-F168 HydrophobicContact CD1-CZ 3.87Å; V114-F168 HydrophobicContact CG1-CB 4.39Å; V114-F168 HydrophobicContact CG1-CD1 4.19Å; V114-F168 HydrophobicContact CG1-CG 4.49Å; F168-P170 HydrophobicContact CD1-CB 4.35Å; F168-P170 HydrophobicContact CE1-CB 3.7Å; F168-P170 HydrophobicContact CZ-CB 4.05Å; F168-P170 WeakPolarHBondContact O-CD 3.46Å; F168-I404 WeakPolarHBondContact CD1-O 3.48Å; F168-I404 WeakPolarHBondContact CE1-O 3.38Å; F168-D406 WeakPolarHBondContact CZ-O 3.31Å; F168-T407 HydrophobicContact CZ-CG2 4.23Å; F168-F410 HydrophobicContact CD2-CZ 4.45Å; F168-F410 HydrophobicContact CE2-CD2 4.42Å; F168-F410 AromaticContact CE2-CE2 3.48Å; F168-F410 HydrophobicContact CE2-CE2 3.48Å; F168-F410 VanDerWaalsContact CE2-CE2 3.48Å; F168-F410 AromaticContact CE2-CZ 3.55Å; F168-F410 HydrophobicContact CE2-CZ 3.55Å; F168-F410 HydrophobicContact CZ-CD2 4.46Å; F168-F410 AromaticContact CZ-CE2 3.65Å; F168-F410 HydrophobicContact CZ-CE2 3.65Å; F168-F410 HydrophobicContact CZ-CZ 4.19Å
169	L	95.1	Very high	91.6	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.052	12%	0.121	C	C	.	.			trans	-107.6	99.4	178.9	-62.7	-174.2	0	0	0	109.7	V150 E167 G171 G172 L219 L220 D221 K227 F410	V150-L169 HydrophobicContact CG2-CD1 3.77Å; E167-L169 HydrophobicContact CG-CD2 3.93Å; E167-L169 HydrophobicContact CG-CG 4.31Å; L169-G171 PolarHBondContact O-N 3.44Å; L169-G172 PolarHBondContact O-N 3.32Å; L169-L219 HydrophobicContact CB-CB 4.45Å; L169-L219 HydrophobicContact CD1-CB 3.57Å; L169-L219 HydrophobicContact CD1-CD1 4Å; L169-L219 HydrophobicContact CD1-CG 4.44Å; L169-L220 WeakPolarHBondContact CB-O 3.36Å; L169-D221 HydrophobicContact CD2-CB 3.97Å; L169-K227 HydrophobicContact CD1-CB 3.85Å; L169-K227 HydrophobicContact CD1-CD 3.86Å; L169-K227 HydrophobicContact CD1-CG 4.3Å; L169-K227 HydrophobicContact CD2-CD 4.1Å; L169-F410 VanDerWaalsContact O-CZ 3.29Å; L169-F410 WeakPolarHBondContact O-CZ 3.46Å
170	P	94.5	Very high	91.7	Very high	9 Å²	9	22.3 Å²	22.3	6%	0.058	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-5.1	-168.3	32.5	-38.5	0	0	0	114.1	F168 G172 A222 I401 N409	F168-P170 HydrophobicContact CD1-CB 4.35Å; F168-P170 HydrophobicContact CE1-CB 3.7Å; F168-P170 HydrophobicContact CZ-CB 4.05Å; F168-P170 WeakPolarHBondContact O-CD 3.46Å; P170-G172 PolarHBondContact O-N 2.74Å; P170-A222 HydrophobicContact CG-CB 3.8Å; P170-I401 HydrophobicContact CB-CD1 4.31Å; P170-I401 HydrophobicContact CB-CG2 3.93Å; P170-I401 HydrophobicContact CG-CD1 3.77Å; P170-I401 HydrophobicContact CG-CG2 4.38Å; P170-N409 WeakPolarHBondContact O-CB 3.36Å; P170-N409 PolarHBondContact O-ND2 3.4Å
171	G	94.3	Very high	92	Very high	7 Å²	7	21.7 Å²	21.7	7%	0.072	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-10.9	174.1	0	0	0	0	0	113.9	L169 L220	L169-G171 PolarHBondContact O-N 3.44Å; G171-L220 WeakPolarHBondContact CA-O 3.38Å; G171-L220 PolarHBondContact N-O 3.48Å
172	G	93.9	Very high	92	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.			trans	74.6	-153.9	-176.2	0	0	0	0	0	111.7	L169 P170 L219 L220	L169-G172 PolarHBondContact O-N 3.32Å; P170-G172 PolarHBondContact O-N 2.74Å; G172-L219 CarbonylContact O-C 3.57Å; G172-L219 WeakPolarHBondContact O-CA 3.23Å; G172-L220 PolarHBondContact O-N 2.98Å
173	D	93	Very high	92.3	Very high	26 Å²	26	28.3 Å²	28.3	14%	0.139	15%	0.145	C	C	.	.	B	Isolated β-bridge	trans	-112.1	157.9	-179.1	64.4	87.3	0	0	0	112.5	M175 T176 L177 L218 L219	D173-M175 VanDerWaalsContact C-N 3.25Å; D173-M175 PolarHBondContact O-N 2.84Å; D173-M175 WeakPolarHBondContact OD1-CA 3.49Å; D173-M175 WeakPolarHBondContact OD1-CB 3.49Å; D173-M175 PolarHBondContact OD1-N 3.19Å; D173-T176 PolarHBondContact O-N 3.25Å; D173-T176 PolarHBondContact OD1-N 3.44Å; D173-T176 PolarHBondContact OD1-OG1 3.42Å; D173-T176 PolarHBondContact OD2-OG1 2.89Å; D173-L177 PolarHBondContact O-N 3.49Å; D173-L177 VanDerWaalsContact O-N 3.11Å; D173-L218 CarbonylContact C-O 3.5Å; D173-L218 WeakPolarHBondContact CA-O 3.48Å; D173-L219 HydrophobicContact CB-CD2 3.64Å
174	M	95.1	Very high	92.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-29.7	-179.5	-177.2	60.4	68.7	0	0	112.1	L177 L178 L184 Y192 P215 L218 L220 M315	M174-L177 HydrophobicContact CE-CD2 4.23Å; M174-L177 PolarHBondContact O-N 3.33Å; M174-L177 HydrophobicContact SD-CB 4.35Å; M174-L177 HydrophobicContact SD-CD2 3.81Å; M174-L177 HydrophobicContact SD-CG 4.41Å; M174-L178 HydrophobicContact CG-CD1 4.19Å; M174-L178 HydrophobicContact CG-CG 4.38Å; M174-L178 WeakPolarHBondContact O-CB 3.43Å; M174-L178 VanDerWaalsContact O-CG 3.3Å; M174-L178 WeakPolarHBondContact O-CG 3.31Å; M174-L178 PolarHBondContact O-N 3.45Å; M174-L178 HydrophobicContact SD-CG 4.35Å; M174-L184 HydrophobicContact SD-CD1 4.37Å; M174-Y192 HydrophobicContact CE-CD1 3.53Å; M174-Y192 HydrophobicContact CE-CD2 3.84Å; M174-Y192 HydrophobicContact CE-CE1 3.9Å; M174-Y192 HydrophobicContact CE-CE2 4.19Å; M174-Y192 HydrophobicContact CE-CG 3.5Å; M174-P215 HydrophobicContact CB-CB 4.11Å; M174-P215 VanDerWaalsContact CB-O 3.32Å; M174-P215 WeakPolarHBondContact CB-O 3.47Å; M174-P215 HydrophobicContact CG-CB 4.12Å; M174-P215 PolarHBondContact N-O 2.99Å; M174-L218 HydrophobicContact CB-CB 3.84Å; M174-L218 PolarHBondContact N-O 2.93Å; M174-L220 HydrophobicContact CE-CD2 4.23Å; M174-M315 HydrophobicContact CE-CE 3.83Å; M174-M315 HydrophobicContact CG-CE 3.79Å; M174-M315 HydrophobicContact SD-CE 3.66Å
175	M	90.5	Very high	93	Very high	10 Å²	10	32.2 Å²	32.2	5%	0.049	17%	0.171	C	C	.	.	H	α-helix	trans	-62.1	-47.5	173.8	161.2	170.8	157.8	0	0	110.7	D173 L177 L178 M179 P215 D216 R275 R276 A279	D173-M175 VanDerWaalsContact C-N 3.25Å; D173-M175 PolarHBondContact O-N 2.84Å; D173-M175 WeakPolarHBondContact OD1-CA 3.49Å; D173-M175 WeakPolarHBondContact OD1-CB 3.49Å; D173-M175 PolarHBondContact OD1-N 3.19Å; M175-L177 VanDerWaalsContact C-N 3.29Å; M175-L177 PolarHBondContact O-N 2.82Å; M175-L178 PolarHBondContact O-N 2.95Å; M175-M179 HydrophobicContact CE-SD 4.2Å; M175-M179 WeakPolarHBondContact O-CG 3.41Å; M175-M179 PolarHBondContact O-N 3.27Å; M175-P215 HydrophobicContact CB-CB 3.89Å; M175-P215 PolarHBondContact N-O 2.93Å; M175-D216 HydrophobicContact CB-CB 4.27Å; M175-D216 HydrophobicContact SD-CB 4.27Å; M175-R275 HydrophobicContact CE-CB 4.35Å; M175-R275 HydrophobicContact CE-CG 3.63Å; M175-R275 HydrophobicContact CG-CG 4.31Å; M175-R275 HydrophobicContact SD-CG 3.84Å; M175-R276 HydrophobicContact CE-CG 4.32Å; M175-A279 HydrophobicContact CE-CB 3.81Å; M175-A279 HydrophobicContact SD-CB 4.03Å
176	T	90.8	Very high	93.2	Very high	10 Å²	10	35.3 Å²	35.3	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-37.2	177.6	-60.8	0	0	0	0	111.4	D173 M179 K180 N409	D173-T176 PolarHBondContact O-N 3.25Å; D173-T176 PolarHBondContact OD1-N 3.44Å; D173-T176 PolarHBondContact OD1-OG1 3.42Å; D173-T176 PolarHBondContact OD2-OG1 2.89Å; T176-M179 PolarHBondContact O-N 3.21Å; T176-K180 WeakPolarHBondContact O-CG 3.27Å; T176-K180 PolarHBondContact O-N 2.82Å; T176-N409 WeakPolarHBondContact CG2-O 3.47Å
177	L	92.9	Very high	93.5	Very high	22 Å²	22	41.6 Å²	41.6	12%	0.115	22%	0.215	C	C	.	.	H	α-helix	trans	-62.8	-47.8	173.3	-179.6	59.4	0	0	0	111.9	D173 M174 M175 M179 K180 M181 Y192 L220 I397	D173-L177 PolarHBondContact O-N 3.49Å; D173-L177 VanDerWaalsContact O-N 3.11Å; M174-L177 HydrophobicContact CE-CD2 4.23Å; M174-L177 PolarHBondContact O-N 3.33Å; M174-L177 HydrophobicContact SD-CB 4.35Å; M174-L177 HydrophobicContact SD-CD2 3.81Å; M174-L177 HydrophobicContact SD-CG 4.41Å; M175-L177 VanDerWaalsContact C-N 3.29Å; M175-L177 PolarHBondContact O-N 2.82Å; L177-M179 VanDerWaalsContact C-N 3.3Å; L177-M179 PolarHBondContact O-N 2.85Å; L177-K180 PolarHBondContact O-N 2.77Å; L177-M181 HydrophobicContact CD1-CG 3.9Å; L177-M181 PolarHBondContact O-N 3.4Å; L177-Y192 HydrophobicContact CD2-CE2 4.26Å; L177-L220 HydrophobicContact CD2-CD1 3.73Å; L177-I397 HydrophobicContact CD1-CD1 4.33Å; L177-I397 HydrophobicContact CD2-CD1 4.19Å
178	L	92.3	Very high	93.7	Very high	9 Å²	9	39.8 Å²	39.8	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-34.1	177.1	-71.6	172.9	0	0	0	112.6	M174 M175 K180 D182 L184 P215 E314 M315	M174-L178 HydrophobicContact CG-CD1 4.19Å; M174-L178 HydrophobicContact CG-CG 4.38Å; M174-L178 WeakPolarHBondContact O-CB 3.43Å; M174-L178 VanDerWaalsContact O-CG 3.3Å; M174-L178 WeakPolarHBondContact O-CG 3.31Å; M174-L178 PolarHBondContact O-N 3.45Å; M174-L178 HydrophobicContact SD-CG 4.35Å; M175-L178 PolarHBondContact O-N 2.95Å; L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 3.1Å; L178-D182 WeakPolarHBondContact O-CA 3.42Å; L178-D182 PolarHBondContact O-N 3.25Å; L178-L184 HydrophobicContact CD2-CD1 4.08Å; L178-L184 HydrophobicContact CD2-CD2 4.34Å; L178-L184 HydrophobicContact CD2-CG 3.82Å; L178-P215 HydrophobicContact CD1-CB 4.13Å; L178-P215 HydrophobicContact CD1-CG 4.15Å; L178-E314 HydrophobicContact CD1-CG 4.25Å; L178-M315 HydrophobicContact CD1-CG 4.4Å; L178-M315 HydrophobicContact CD2-CB 4.45Å; L178-M315 HydrophobicContact CD2-CG 4.06Å
179	M	88.4	Confident	93.9	Very high	45 Å²	45	38.7 Å²	38.7	22%	0.222	20%	0.203	C	C	.	.	H	α-helix	trans	-63.7	-32.1	172.2	-76	-160.7	66.1	0	0	112.9	M175 T176 L177 R276	M175-M179 HydrophobicContact CE-SD 4.2Å; M175-M179 WeakPolarHBondContact O-CG 3.41Å; M175-M179 PolarHBondContact O-N 3.27Å; T176-M179 PolarHBondContact O-N 3.21Å; L177-M179 VanDerWaalsContact C-N 3.3Å; L177-M179 PolarHBondContact O-N 2.85Å; M179-R276 HydrophobicContact CE-CG 4.06Å; M179-R276 HydrophobicContact SD-CG 3.8Å
180	K	89.2	Confident	94.1	Very high	107 Å²	107	40.3 Å²	40.3	47%	0.465	21%	0.21	S	C	.	.	H	α-helix	trans	-83.3	-35.6	179.3	-72.7	175.2	178.2	177.9	0	112.9	T176 L177 L178 S408 N409	T176-K180 WeakPolarHBondContact O-CG 3.27Å; T176-K180 PolarHBondContact O-N 2.82Å; L177-K180 PolarHBondContact O-N 2.77Å; L178-K180 VanDerWaalsContact C-N 3.27Å; L178-K180 PolarHBondContact O-N 3.1Å; K180-S408 PolarHBondContact NZ-O 2.86Å; K180-N409 PolarHBondContact NZ-OD1 2.98Å
181	M	90.9	Very high	94.3	Very high	99 Å²	99	41 Å²	41	49%	0.488	21%	0.212	S	C	.	.	H	α-helix	trans	-96.8	-12.3	-173.1	-67.4	-77.5	90.5	0	0	114.3	L177 T183 L184	L177-M181 HydrophobicContact CD1-CG 3.9Å; L177-M181 PolarHBondContact O-N 3.4Å; M181-T183 PolarHBondContact O-N 3.43Å; M181-T183 VanDerWaalsContact O-O 3.14Å; M181-L184 HydrophobicContact CB-CD2 4.02Å; M181-L184 HydrophobicContact CG-CD2 4.33Å
182	D	89.9	Confident	94.5	Very high	88 Å²	88	40.7 Å²	40.7	47%	0.471	21%	0.209	S	C	.	.	S	Bend	trans	66.4	-55.1	-172.5	-64.3	-33.2	0	0	0	114.7	L178 K272	L178-D182 WeakPolarHBondContact O-CA 3.42Å; L178-D182 PolarHBondContact O-N 3.25Å; D182-K272 VanDerWaalsContact OD1-CE 3.28Å; D182-K272 WeakPolarHBondContact OD1-CE 3.5Å; D182-K272 IonicContact OD1-NZ 2.62Å; D182-K272 PolarHBondContact OD1-NZ 3.33Å; D182-K272 IonicContact OD2-NZ 3.99Å
183	T	95.1	Very high	94.7	Very high	63 Å²	63	40.7 Å²	40.7	39%	0.387	21%	0.209	S	C	.	.	S	Bend	trans	-142.6	164	173.1	57.6	0	0	0	0	109.4	M181 M315	M181-T183 PolarHBondContact O-N 3.43Å; M181-T183 VanDerWaalsContact O-O 3.14Å; T183-M315 CarbonylContact C-O 3.48Å; T183-M315 VanDerWaalsContact CA-O 3.32Å; T183-M315 WeakPolarHBondContact CA-O 3.41Å; T183-M315 WeakPolarHBondContact CB-O 3.22Å
184	L	97.4	Very high	95	Very high	12 Å²	12	39.5 Å²	39.5	6%	0.063	20%	0.202	C	C	.	.			trans	-108.6	153.2	174	-57.3	-174.8	0	0	0	110.1	M174 L178 M181 A188 Y192 M315 I397	M174-L184 HydrophobicContact SD-CD1 4.37Å; L178-L184 HydrophobicContact CD2-CD1 4.08Å; L178-L184 HydrophobicContact CD2-CD2 4.34Å; L178-L184 HydrophobicContact CD2-CG 3.82Å; M181-L184 HydrophobicContact CB-CD2 4.02Å; M181-L184 HydrophobicContact CG-CD2 4.33Å; L184-A188 HydrophobicContact CB-CB 4.28Å; L184-Y192 HydrophobicContact CD1-CD2 3.84Å; L184-Y192 HydrophobicContact CD1-CE2 4.2Å; L184-M315 HydrophobicContact CB-CB 4.41Å; L184-M315 HydrophobicContact CD1-CB 4.23Å; L184-M315 HydrophobicContact CD1-CE 4.34Å; L184-M315 HydrophobicContact CD1-CG 3.9Å; L184-M315 HydrophobicContact CD1-SD 4.13Å; L184-M315 HydrophobicContact CG-CB 4.41Å; L184-M315 PolarHBondContact N-O 2.77Å; L184-I397 HydrophobicContact CD2-CD1 3.9Å
185	S	97.8	Very high	95.1	Very high	70 Å²	70	39.5 Å²	39.5	49%	0.49	20%	0.202	S	C	.	.			trans	-66	160.6	168.2	65.2	0	0	0	0	110.6	E187 A188 T189	S185-E187 PolarHBondContact O-N 3.4Å; S185-A188 PolarHBondContact O-N 2.78Å; S185-A188 WeakPolarHBondContact OG-CB 3.05Å; S185-A188 PolarHBondContact OG-N 2.76Å; S185-A188 VanDerWaalsContact OG-N 3.17Å; S185-T189 WeakPolarHBondContact O-CB 3.38Å; S185-T189 PolarHBondContact O-N 2.84Å; S185-T189 PolarHBondContact O-OG1 2.86Å
186	E	97.9	Very high	95.5	Very high	65 Å²	65	39 Å²	39	30%	0.304	20%	0.2	S	C	.	.	H	α-helix	trans	-61	-34.1	174.3	-72.4	-168.5	-161.1	0	0	112.5	T189 Q190 L316 S350 F381	E186-T189 PolarHBondContact O-N 3.35Å; E186-Q190 VanDerWaalsContact O-CB 3.26Å; E186-Q190 WeakPolarHBondContact O-CB 3.4Å; E186-Q190 PolarHBondContact O-N 3.39Å; E186-L316 HydrophobicContact CG-CD2 3.77Å; E186-S350 VanDerWaalsContact CD-OG 3.25Å; E186-S350 VanDerWaalsContact OE1-CB 3.23Å; E186-S350 WeakPolarHBondContact OE1-CB 3.18Å; E186-S350 PolarHBondContact OE1-N 2.91Å; E186-S350 PolarHBondContact OE1-OG 2.98Å; E186-S350 WeakPolarHBondContact OE2-CB 3.36Å; E186-S350 PolarHBondContact OE2-OG 3.02Å; E186-F381 HydrophobicContact CB-CE2 4.45Å
187	E	97.3	Very high	95.9	Very high	154 Å²	154	38.5 Å²	38.5	72%	0.72	20%	0.197	S	C	*	.	H	α-helix	trans	-64.9	-47.5	175.6	-176.1	-178.9	-177.8	0	0	111.9	S185 T189 Q190 F191	S185-E187 PolarHBondContact O-N 3.4Å; E187-T189 VanDerWaalsContact C-N 3.33Å; E187-T189 PolarHBondContact O-N 3.03Å; E187-Q190 WeakPolarHBondContact O-CB 3.12Å; E187-Q190 PolarHBondContact O-N 3.08Å; E187-F191 PolarHBondContact O-N 3.29Å; E187-F191 VanDerWaalsContact O-N 3.08Å
188	A	97.9	Very high	96.1	Very high	7 Å²	7	38.5 Å²	38.5	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-66	-38.8	176.4	0	0	0	0	0	111.4	L184 S185 F191 Y192 A396	L184-A188 HydrophobicContact CB-CB 4.28Å; S185-A188 PolarHBondContact O-N 2.78Å; S185-A188 WeakPolarHBondContact OG-CB 3.05Å; S185-A188 PolarHBondContact OG-N 2.76Å; S185-A188 VanDerWaalsContact OG-N 3.17Å; A188-F191 PolarHBondContact O-N 3.26Å; A188-Y192 WeakPolarHBondContact O-CD2 3.24Å; A188-Y192 PolarHBondContact O-N 3.02Å; A188-A396 HydrophobicContact CB-CB 4.05Å
189	T	98.5	Very high	96.2	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-63	-44.5	174.7	-58.2	0	0	0	0	110.9	S185 E186 E187 F191 Y192 I193 M312 M315 L316 F381	S185-T189 WeakPolarHBondContact O-CB 3.38Å; S185-T189 PolarHBondContact O-N 2.84Å; S185-T189 PolarHBondContact O-OG1 2.86Å; E186-T189 PolarHBondContact O-N 3.35Å; E187-T189 VanDerWaalsContact C-N 3.33Å; E187-T189 PolarHBondContact O-N 3.03Å; T189-F191 VanDerWaalsContact C-N 3.3Å; T189-F191 PolarHBondContact O-N 3.33Å; T189-Y192 PolarHBondContact O-N 3.38Å; T189-I193 HydrophobicContact CG2-CG1 3.8Å; T189-I193 VanDerWaalsContact O-CB 3.26Å; T189-I193 WeakPolarHBondContact O-CB 3.36Å; T189-I193 WeakPolarHBondContact O-CG1 3.41Å; T189-I193 PolarHBondContact O-N 2.64Å; T189-M312 HydrophobicContact CG2-CG 3.94Å; T189-M315 HydrophobicContact CG2-CB 4.08Å; T189-M315 HydrophobicContact CG2-SD 3.98Å; T189-L316 HydrophobicContact CG2-CD1 4.33Å; T189-L316 HydrophobicContact CG2-CD2 4.07Å; T189-L316 HydrophobicContact CG2-CG 4.03Å; T189-L316 WeakPolarHBondContact OG1-CD2 3.08Å; T189-F381 HydrophobicContact CG2-CZ 4.28Å
190	Q	98.6	Very high	96.5	Very high	44 Å²	44	36 Å²	36	21%	0.206	18%	0.184	C	C	.	.	H	α-helix	trans	-56.2	-46.5	176.7	-173.1	-164.2	64.6	0	0	110.7	E186 E187 A194 F381 F382 E383 V385	E186-Q190 VanDerWaalsContact O-CB 3.26Å; E186-Q190 WeakPolarHBondContact O-CB 3.4Å; E186-Q190 PolarHBondContact O-N 3.39Å; E187-Q190 WeakPolarHBondContact O-CB 3.12Å; E187-Q190 PolarHBondContact O-N 3.08Å; Q190-A194 WeakPolarHBondContact O-CB 3.45Å; Q190-A194 PolarHBondContact O-N 3.24Å; Q190-F381 HydrophobicContact CB-CE1 3.94Å; Q190-F381 HydrophobicContact CB-CZ 4.05Å; Q190-F381 HydrophobicContact CG-CE1 4.22Å; Q190-F381 PolarHBondContact NE2-O 3.11Å; Q190-F382 HydrophobicContact CG-CD1 4.05Å; Q190-E383 PolarHBondContact NE2-O 3.4Å; Q190-V385 VanDerWaalsContact CD-CG2 3.5Å; Q190-V385 HydrophobicContact CG-CG2 3.68Å
191	F	98.4	Very high	96.8	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.105	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-56	176.8	177.7	-92.9	0	0	0	112.3	E187 A188 T189 I193 A194 E195 H225 I390 A395 A396	E187-F191 PolarHBondContact O-N 3.29Å; E187-F191 VanDerWaalsContact O-N 3.08Å; A188-F191 PolarHBondContact O-N 3.26Å; T189-F191 VanDerWaalsContact C-N 3.3Å; T189-F191 PolarHBondContact O-N 3.33Å; F191-I193 PolarHBondContact O-N 3.25Å; F191-A194 PolarHBondContact O-N 2.85Å; F191-E195 HydrophobicContact CE1-CG 4.24Å; F191-E195 HydrophobicContact CE2-CG 4.44Å; F191-E195 HydrophobicContact CZ-CG 4.1Å; F191-E195 PolarHBondContact O-N 2.85Å; F191-H225 AromaticContact CZ-CE1 3.84Å; F191-H225 AromaticContact CZ-ND1 3.57Å; F191-I390 HydrophobicContact CD2-CD1 4.14Å; F191-I390 HydrophobicContact CD2-CG1 4.02Å; F191-I390 HydrophobicContact CE2-CD1 4.28Å; F191-I390 HydrophobicContact CE2-CG1 3.74Å; F191-A395 HydrophobicContact CE1-CB 3.8Å; F191-A395 VanDerWaalsContact CZ-CA 3.47Å; F191-A395 HydrophobicContact CZ-CB 3.73Å; F191-A396 HydrophobicContact CB-CB 3.72Å; F191-A396 HydrophobicContact CD1-CB 3.74Å; F191-A396 HydrophobicContact CG-CB 3.74Å
192	Y	98.5	Very high	96.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-67.9	-38.4	-175.3	-70.8	-56.5	0	0	0	113.3	M174 L177 L184 A188 T189 T196 L220 V226 A396 I397	M174-Y192 HydrophobicContact CE-CD1 3.53Å; M174-Y192 HydrophobicContact CE-CD2 3.84Å; M174-Y192 HydrophobicContact CE-CE1 3.9Å; M174-Y192 HydrophobicContact CE-CE2 4.19Å; M174-Y192 HydrophobicContact CE-CG 3.5Å; L177-Y192 HydrophobicContact CD2-CE2 4.26Å; L184-Y192 HydrophobicContact CD1-CD2 3.84Å; L184-Y192 HydrophobicContact CD1-CE2 4.2Å; A188-Y192 WeakPolarHBondContact O-CD2 3.24Å; A188-Y192 PolarHBondContact O-N 3.02Å; T189-Y192 PolarHBondContact O-N 3.38Å; Y192-T196 WeakPolarHBondContact O-CB 3.38Å; Y192-T196 PolarHBondContact O-N 2.79Å; Y192-T196 PolarHBondContact O-OG1 2.89Å; Y192-L220 HydrophobicContact CD1-CD2 4.42Å; Y192-L220 HydrophobicContact CE1-CD2 3.86Å; Y192-V226 HydrophobicContact CD1-CG2 3.73Å; Y192-V226 HydrophobicContact CE1-CG2 4.43Å; Y192-A396 HydrophobicContact CE2-CB 4.49Å; Y192-I397 HydrophobicContact CE2-CD1 4.06Å; Y192-I397 HydrophobicContact CE2-CG1 4.23Å; Y192-I397 VanDerWaalsContact OH-CB 3.31Å; Y192-I397 WeakPolarHBondContact OH-CB 3.44Å; Y192-I397 PolarHBondContact OH-N 3.2Å
193	I	98.6	Very high	96.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-44.1	174.9	-63.2	-61.2	0	0	0	110	T189 F191 E195 T196 V197 L308 I311 M312 M315 F360 F382	T189-I193 HydrophobicContact CG2-CG1 3.8Å; T189-I193 VanDerWaalsContact O-CB 3.26Å; T189-I193 WeakPolarHBondContact O-CB 3.36Å; T189-I193 WeakPolarHBondContact O-CG1 3.41Å; T189-I193 PolarHBondContact O-N 2.64Å; F191-I193 PolarHBondContact O-N 3.25Å; I193-E195 PolarHBondContact O-N 3.38Å; I193-T196 PolarHBondContact O-N 3.15Å; I193-V197 HydrophobicContact CG2-CG2 4.45Å; I193-V197 WeakPolarHBondContact O-CG2 3.14Å; I193-V197 PolarHBondContact O-N 3.38Å; I193-L308 HydrophobicContact CD1-CD1 3.59Å; I193-L308 HydrophobicContact CD1-CG 4.25Å; I193-L308 HydrophobicContact CG2-CD1 4.4Å; I193-L308 HydrophobicContact CG2-CD2 4.22Å; I193-L308 HydrophobicContact CG2-CG 4.29Å; I193-I311 HydrophobicContact CD1-CG2 4.34Å; I193-M312 HydrophobicContact CD1-CB 3.74Å; I193-M312 HydrophobicContact CD1-CG 4.35Å; I193-M312 HydrophobicContact CG1-CB 4.06Å; I193-M312 HydrophobicContact CG1-CG 4.11Å; I193-M315 HydrophobicContact CD1-CE 4.47Å; I193-M315 HydrophobicContact CD1-SD 3.84Å; I193-M315 HydrophobicContact CG1-SD 4.08Å; I193-F360 HydrophobicContact CG2-CE2 4.47Å; I193-F382 HydrophobicContact CB-CE1 4.32Å; I193-F382 HydrophobicContact CG2-CE1 3.89Å; I193-F382 HydrophobicContact CG2-CZ 3.72Å
194	A	98.5	Very high	96.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-60.3	-43.9	176.8	0	0	0	0	0	112.4	Q190 F191 T196 V197 L198 F382 V385 Y387 I390	Q190-A194 WeakPolarHBondContact O-CB 3.45Å; Q190-A194 PolarHBondContact O-N 3.24Å; F191-A194 PolarHBondContact O-N 2.85Å; A194-T196 VanDerWaalsContact C-N 3.34Å; A194-T196 PolarHBondContact O-N 3.07Å; A194-V197 WeakPolarHBondContact O-CB 3.47Å; A194-V197 PolarHBondContact O-N 3.1Å; A194-L198 PolarHBondContact O-N 3.13Å; A194-F382 HydrophobicContact CB-CD1 4.05Å; A194-F382 HydrophobicContact CB-CE1 4.06Å; A194-V385 HydrophobicContact CB-CG1 3.88Å; A194-V385 HydrophobicContact CB-CG2 4.44Å; A194-Y387 HydrophobicContact CB-CE1 3.98Å; A194-I390 HydrophobicContact CB-CD1 3.75Å
195	E	98.3	Very high	96	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.6	-41	174.5	-75.7	-150	143.2	0	0	112.5	W148 F191 I193 V197 L198 A199 H225 V226 I390	W148-E195 HydrophobicContact CH2-CB 4.29Å; W148-E195 HydrophobicContact CH2-CG 4.11Å; W148-E195 HydrophobicContact CZ3-CB 3.75Å; W148-E195 HydrophobicContact CZ3-CG 3.93Å; F191-E195 HydrophobicContact CE1-CG 4.24Å; F191-E195 HydrophobicContact CE2-CG 4.44Å; F191-E195 HydrophobicContact CZ-CG 4.1Å; F191-E195 PolarHBondContact O-N 2.85Å; I193-E195 PolarHBondContact O-N 3.38Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 2.93Å; E195-L198 PolarHBondContact O-N 3.05Å; E195-A199 WeakPolarHBondContact O-CB 3.32Å; E195-A199 PolarHBondContact O-N 3.17Å; E195-H225 IonicContact OE1-CE1 3.72Å; E195-H225 IonicContact OE1-CG 3.96Å; E195-H225 IonicContact OE1-ND1 2.64Å; E195-H225 PolarHBondContact OE1-ND1 2.88Å; E195-H225 VanDerWaalsContact OE2-CA 3.32Å; E195-H225 WeakPolarHBondContact OE2-CA 3.45Å; E195-H225 IonicContact OE2-ND1 3.39Å; E195-V226 HydrophobicContact CB-CB 4.14Å; E195-V226 HydrophobicContact CB-CG2 4.09Å; E195-V226 PolarHBondContact OE2-N 2.87Å; E195-I390 HydrophobicContact CG-CD1 3.7Å; E195-I390 HydrophobicContact CG-CG1 4Å; E195-I390 HydrophobicContact CG-CG2 4.49Å
196	T	98.3	Very high	95.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.1	-32	179.1	-52.8	0	0	0	0	111.5	Y192 I193 A194 A199 I200 L218 L308	Y192-T196 WeakPolarHBondContact O-CB 3.38Å; Y192-T196 PolarHBondContact O-N 2.79Å; Y192-T196 PolarHBondContact O-OG1 2.89Å; I193-T196 PolarHBondContact O-N 3.15Å; A194-T196 VanDerWaalsContact C-N 3.34Å; A194-T196 PolarHBondContact O-N 3.07Å; T196-A199 PolarHBondContact O-N 3.21Å; T196-I200 HydrophobicContact CG2-CD1 3.84Å; T196-I200 HydrophobicContact CG2-CG1 4.21Å; T196-I200 WeakPolarHBondContact O-CB 3.31Å; T196-I200 VanDerWaalsContact O-CG1 3.32Å; T196-I200 WeakPolarHBondContact O-CG1 3.41Å; T196-I200 PolarHBondContact O-N 2.81Å; T196-L218 HydrophobicContact CG2-CD1 4.19Å; T196-L218 HydrophobicContact CG2-CD2 3.94Å; T196-L308 HydrophobicContact CG2-CD1 3.57Å
197	V	98.4	Very high	94.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-58.4	-49.9	169.8	170.6	0	0	0	0	110.8	I193 A194 E195 A199 I200 D201 W305 L308 V373 I376 F382	I193-V197 HydrophobicContact CG2-CG2 4.45Å; I193-V197 WeakPolarHBondContact O-CG2 3.14Å; I193-V197 PolarHBondContact O-N 3.38Å; A194-V197 WeakPolarHBondContact O-CB 3.47Å; A194-V197 PolarHBondContact O-N 3.1Å; E195-V197 VanDerWaalsContact C-N 3.32Å; E195-V197 PolarHBondContact O-N 2.93Å; V197-A199 VanDerWaalsContact C-N 3.27Å; V197-A199 PolarHBondContact O-N 3.35Å; V197-I200 PolarHBondContact O-N 2.74Å; V197-D201 VanDerWaalsContact O-CB 3.32Å; V197-D201 WeakPolarHBondContact O-CB 3.28Å; V197-D201 PolarHBondContact O-N 2.86Å; V197-W305 HydrophobicContact CB-CZ3 4.43Å; V197-W305 HydrophobicContact CG1-CH2 4.26Å; V197-W305 HydrophobicContact CG1-CZ3 4.39Å; V197-W305 HydrophobicContact CG2-CZ3 4.3Å; V197-L308 HydrophobicContact CG2-CD2 3.58Å; V197-V373 HydrophobicContact CG1-CG2 3.57Å; V197-I376 HydrophobicContact CG1-CB 4.46Å; V197-I376 HydrophobicContact CG1-CG2 4.05Å; V197-I376 HydrophobicContact CG2-CG2 3.68Å; V197-F382 HydrophobicContact CG2-CZ 4.44Å
198	L	97.3	Very high	93.8	Very high	22 Å²	22	24.6 Å²	24.6	12%	0.115	13%	0.132	C	C	.	.	H	α-helix	trans	-62.8	-37.4	177.5	-64.4	179	0	0	0	111.9	W148 A194 E195 S202 Y387 I390	W148-L198 HydrophobicContact CD2-CB 4.21Å; W148-L198 HydrophobicContact CH2-CB 4.1Å; W148-L198 HydrophobicContact CH2-CD1 3.8Å; W148-L198 HydrophobicContact CZ2-CB 3.64Å; W148-L198 HydrophobicContact CZ2-CD1 3.47Å; W148-L198 VanDerWaalsContact CZ2-CD1 3.47Å; W148-L198 HydrophobicContact CZ2-CG 4.22Å; A194-L198 PolarHBondContact O-N 3.13Å; E195-L198 PolarHBondContact O-N 3.05Å; L198-S202 WeakPolarHBondContact O-CB 3.24Å; L198-S202 PolarHBondContact O-N 2.83Å; L198-Y387 HydrophobicContact CD1-CD1 4.14Å; L198-Y387 HydrophobicContact CD2-CD1 3.91Å; L198-Y387 HydrophobicContact CG-CD1 4.08Å; L198-I390 HydrophobicContact CD1-CG2 3.65Å
199	A	95.8	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.1	-49	179.5	0	0	0	0	0	112.8	W148 E195 T196 V197 S202 I203 L228	W148-A199 HydrophobicContact CB-CB 3.65Å; W148-A199 HydrophobicContact CD2-CB 4.19Å; W148-A199 HydrophobicContact CE3-CB 4Å; W148-A199 HydrophobicContact CG-CB 4.07Å; E195-A199 WeakPolarHBondContact O-CB 3.32Å; E195-A199 PolarHBondContact O-N 3.17Å; T196-A199 PolarHBondContact O-N 3.21Å; V197-A199 VanDerWaalsContact C-N 3.27Å; V197-A199 PolarHBondContact O-N 3.35Å; A199-S202 PolarHBondContact O-N 3.07Å; A199-S202 PolarHBondContact O-OG 3.11Å; A199-I203 PolarHBondContact O-N 2.89Å; A199-L228 HydrophobicContact CB-CD1 3.74Å; A199-L228 HydrophobicContact CB-CD2 4.4Å; A199-L228 HydrophobicContact CB-CG 3.77Å
200	I	94.8	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.5	-44.1	178.1	-68.1	171.4	0	0	0	110.4	T196 V197 S202 I203 H204 I213 L228 D304 W305 L308	T196-I200 HydrophobicContact CG2-CD1 3.84Å; T196-I200 HydrophobicContact CG2-CG1 4.21Å; T196-I200 WeakPolarHBondContact O-CB 3.31Å; T196-I200 VanDerWaalsContact O-CG1 3.32Å; T196-I200 WeakPolarHBondContact O-CG1 3.41Å; T196-I200 PolarHBondContact O-N 2.81Å; V197-I200 PolarHBondContact O-N 2.74Å; I200-S202 VanDerWaalsContact C-N 3.28Å; I200-S202 PolarHBondContact O-N 3.05Å; I200-I203 WeakPolarHBondContact O-CG1 3.49Å; I200-I203 PolarHBondContact O-N 3.36Å; I200-H204 WeakPolarHBondContact CG2-CE1 3.49Å; I200-H204 WeakPolarHBondContact CG2-NE2 3.4Å; I200-H204 PolarHBondContact O-CD2 2.94Å; I200-H204 PolarHBondContact O-N 3.32Å; I200-I213 HydrophobicContact CD1-CD1 4.06Å; I200-I213 HydrophobicContact CD1-CG1 4.11Å; I200-I213 HydrophobicContact CD1-CG2 4.19Å; I200-I213 HydrophobicContact CG1-CD1 3.95Å; I200-I213 HydrophobicContact CG1-CG1 4.43Å; I200-L228 HydrophobicContact CG1-CD1 4.45Å; I200-D304 HydrophobicContact CG2-CB 3.9Å; I200-W305 HydrophobicContact CB-CE3 4.46Å; I200-W305 HydrophobicContact CB-CH2 3.63Å; I200-W305 HydrophobicContact CB-CZ3 3.59Å; I200-W305 HydrophobicContact CD1-CE3 4.2Å; I200-W305 HydrophobicContact CD1-CZ3 3.89Å; I200-W305 HydrophobicContact CG1-CZ3 4.33Å; I200-W305 HydrophobicContact CG2-CD2 4.43Å; I200-W305 HydrophobicContact CG2-CE3 4.03Å; I200-W305 HydrophobicContact CG2-CH2 3.42Å; I200-W305 VanDerWaalsContact CG2-CH2 3.42Å; I200-W305 HydrophobicContact CG2-CZ2 3.87Å; I200-W305 HydrophobicContact CG2-CZ3 3.51Å; I200-L308 HydrophobicContact CD1-CB 4.38Å; I200-L308 HydrophobicContact CD1-CD2 4.3Å
201	D	94.6	Very high	91.8	Very high	18 Å²	18	28.1 Å²	28.1	10%	0.096	15%	0.145	C	C	.	.	H	α-helix	trans	-61.3	-38.6	177.4	-175.1	53.6	0	0	0	111.7	V197 I203 H204 Q205 W305 V373	V197-D201 VanDerWaalsContact O-CB 3.32Å; V197-D201 WeakPolarHBondContact O-CB 3.28Å; V197-D201 PolarHBondContact O-N 2.86Å; D201-I203 VanDerWaalsContact C-N 3.3Å; D201-I203 PolarHBondContact O-N 3.22Å; D201-H204 PolarHBondContact O-N 2.74Å; D201-H204 VanDerWaalsContact O-N 3.15Å; D201-Q205 VanDerWaalsContact O-CG 3.32Å; D201-Q205 WeakPolarHBondContact O-CG 3.45Å; D201-Q205 PolarHBondContact O-N 3.11Å; D201-Q205 PolarHBondContact OD2-NE2 2.73Å; D201-W305 HydrophobicContact CB-CH2 4.36Å; D201-V373 HydrophobicContact CB-CB 4.38Å; D201-V373 HydrophobicContact CB-CG2 3.91Å
202	S	91.7	Very high	91.2	Very high	17 Å²	17	27.3 Å²	27.3	12%	0.119	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-36.3	178.7	79.9	0	0	0	0	113.5	S146 L198 A199 I200	S146-S202 PolarHBondContact OG-OG 3.31Å; L198-S202 WeakPolarHBondContact O-CB 3.24Å; L198-S202 PolarHBondContact O-N 2.83Å; A199-S202 PolarHBondContact O-N 3.07Å; A199-S202 PolarHBondContact O-OG 3.11Å; I200-S202 VanDerWaalsContact C-N 3.28Å; I200-S202 PolarHBondContact O-N 3.05Å
203	I	88.1	Confident	90.9	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-80.7	-31.5	176.1	59.4	168.2	0	0	0	111.8	V149 A199 I200 D201 Q205 L206 S207 F208 H210 L228 F231	V149-I203 HydrophobicContact CG2-CG2 3.7Å; A199-I203 PolarHBondContact O-N 2.89Å; I200-I203 WeakPolarHBondContact O-CG1 3.49Å; I200-I203 PolarHBondContact O-N 3.36Å; D201-I203 VanDerWaalsContact C-N 3.3Å; D201-I203 PolarHBondContact O-N 3.22Å; I203-Q205 VanDerWaalsContact C-N 3.34Å; I203-L206 CarbonylContact O-C 3.6Å; I203-L206 WeakPolarHBondContact O-CB 3.37Å; I203-L206 PolarHBondContact O-N 3.25Å; I203-L206 VanDerWaalsContact O-N 3.17Å; I203-S207 PolarHBondContact O-N 3.49Å; I203-F208 CarbonylContact C-O 3.57Å; I203-F208 HydrophobicContact CB-CB 4.46Å; I203-F208 PolarHBondContact O-N 3.2Å; I203-H210 HydrophobicContact CD1-CB 3.74Å; I203-L228 HydrophobicContact CD1-CD1 3.9Å; I203-L228 HydrophobicContact CG1-CD1 4.36Å; I203-L228 HydrophobicContact CG2-CD1 4.42Å; I203-F231 HydrophobicContact CD1-CE1 4.29Å; I203-F231 HydrophobicContact CG2-CE1 4.05Å
204	H	89.1	Confident	90.6	Very high	11 Å²	11	27.9 Å²	27.9	5%	0.051	14%	0.144	C	C	.	.	H	α-helix	trans	-65.9	-36.3	174.1	-73.6	-171.5	0	0	0	112.1	I200 D201 L206 S207 F208 K301 D304	I200-H204 WeakPolarHBondContact CG2-CE1 3.49Å; I200-H204 WeakPolarHBondContact CG2-NE2 3.4Å; I200-H204 PolarHBondContact O-CD2 2.94Å; I200-H204 PolarHBondContact O-N 3.32Å; D201-H204 PolarHBondContact O-N 2.74Å; D201-H204 VanDerWaalsContact O-N 3.15Å; H204-L206 PolarHBondContact O-N 3.34Å; H204-S207 WeakPolarHBondContact O-CA 3.32Å; H204-S207 PolarHBondContact O-N 2.79Å; H204-F208 WeakPolarHBondContact CA-O 3.35Å; H204-F208 PolarHBondContact CD2-O 3.22Å; H204-K301 HydrophobicContact CB-CD 4.19Å; H204-K301 PolarHBondContact CE1-O 3.38Å; H204-D304 IonicContact CD2-OD2 3.73Å; H204-D304 IonicContact CE1-OD2 3.67Å; H204-D304 IonicContact NE2-OD2 2.82Å; H204-D304 PolarHBondContact NE2-OD2 2.76Å
205	Q	88.1	Confident	90.3	Very high	140 Å²	140	27.9 Å²	27.9	65%	0.654	14%	0.144	S	C	*	.	H	α-helix	trans	-64	-27.6	173.6	-72.1	178.5	20.9	0	0	112.5	D201 I203 S207	D201-Q205 VanDerWaalsContact O-CG 3.32Å; D201-Q205 WeakPolarHBondContact O-CG 3.45Å; D201-Q205 PolarHBondContact O-N 3.11Å; D201-Q205 PolarHBondContact OD2-NE2 2.73Å; I203-Q205 VanDerWaalsContact C-N 3.34Å; Q205-S207 PolarHBondContact O-N 3.47Å
206	L	82	Confident	89.9	Confident	75 Å²	75	29.6 Å²	29.6	39%	0.393	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	9.8	171.6	-63.2	174.3	0	0	0	112.7	A144 I203 H204 F208	A144-L206 HydrophobicContact CB-CD1 4.26Å; I203-L206 CarbonylContact O-C 3.6Å; I203-L206 WeakPolarHBondContact O-CB 3.37Å; I203-L206 PolarHBondContact O-N 3.25Å; I203-L206 VanDerWaalsContact O-N 3.17Å; H204-L206 PolarHBondContact O-N 3.34Å; L206-F208 HydrophobicContact CB-CD2 3.54Å; L206-F208 HydrophobicContact CB-CE2 3.86Å; L206-F208 VanDerWaalsContact O-CD2 3.28Å; L206-F208 WeakPolarHBondContact O-CD2 3.36Å; L206-F208 WeakPolarHBondContact O-CE2 3.36Å; L206-F208 PolarHBondContact O-N 2.72Å
207	S	82.8	Confident	89.5	Confident	110 Å²	110	29.8 Å²	29.8	77%	0.769	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.7	23.7	-178.2	-54.7	0	0	0	0	114.8	I203 H204 Q205	I203-S207 PolarHBondContact O-N 3.49Å; H204-S207 WeakPolarHBondContact O-CA 3.32Å; H204-S207 PolarHBondContact O-N 2.79Å; Q205-S207 PolarHBondContact O-N 3.47Å
208	F	81.2	Confident	89.4	Confident	47 Å²	47	29.8 Å²	29.8	21%	0.206	15%	0.154	C	C	.	.			trans	-100.2	147.3	172.7	-62.6	-71.1	0	0	0	111.2	I140 I203 H204 L206	I140-F208 HydrophobicContact CD1-CB 4.12Å; I140-F208 HydrophobicContact CD1-CD1 3.51Å; I140-F208 HydrophobicContact CD1-CE1 4.02Å; I140-F208 HydrophobicContact CD1-CG 3.82Å; I140-F208 HydrophobicContact CG1-CB 4.34Å; I140-F208 HydrophobicContact CG1-CD1 3.29Å; I140-F208 HydrophobicContact CG1-CD2 3.88Å; I140-F208 HydrophobicContact CG1-CE1 3.35Å; I140-F208 HydrophobicContact CG1-CE2 3.94Å; I140-F208 HydrophobicContact CG1-CG 3.57Å; I140-F208 HydrophobicContact CG1-CZ 3.68Å; I203-F208 CarbonylContact C-O 3.57Å; I203-F208 HydrophobicContact CB-CB 4.46Å; I203-F208 PolarHBondContact O-N 3.2Å; H204-F208 WeakPolarHBondContact CA-O 3.35Å; H204-F208 PolarHBondContact CD2-O 3.22Å; L206-F208 HydrophobicContact CB-CD2 3.54Å; L206-F208 HydrophobicContact CB-CE2 3.86Å; L206-F208 VanDerWaalsContact O-CD2 3.28Å; L206-F208 WeakPolarHBondContact O-CD2 3.36Å; L206-F208 WeakPolarHBondContact O-CE2 3.36Å; L206-F208 PolarHBondContact O-N 2.72Å
209	I	83.9	Confident	89.4	Confident	38 Å²	38	30.5 Å²	30.5	20%	0.195	16%	0.158	C	C	.	.			trans	-121.1	129.3	173.3	-51.8	173.4	0	0	0	106.8	R211 C234 K301 D304	I209-R211 HydrophobicContact CB-CG 4.09Å; I209-R211 HydrophobicContact CG2-CG 3.56Å; I209-C234 PolarHBondContact O-SG 3.28Å; I209-K301 HydrophobicContact CD1-CB 4.08Å; I209-K301 HydrophobicContact CG1-CB 3.87Å; I209-D304 WeakPolarHBondContact CG2-OD2 3.44Å
210	H	86.4	Confident	89.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.158	C	C	.	.			trans	-75.6	-46.3	-173	-167.4	-50.4	0	0	0	112.4	I203 D212 I213 S229 F231 D304	I203-H210 HydrophobicContact CD1-CB 3.74Å; H210-D212 PolarHBondContact CE1-O 3.16Å; H210-D212 PolarHBondContact ND1-N 3.36Å; H210-D212 PolarHBondContact O-N 3.31Å; H210-I213 HydrophobicContact CB-CD1 3.68Å; H210-I213 HydrophobicContact CB-CG1 3.84Å; H210-I213 WeakPolarHBondContact CD2-CD1 3.38Å; H210-I213 VanDerWaalsContact CG-CD1 3.41Å; H210-S229 PolarHBondContact NE2-O 3.08Å; H210-F231 AromaticContact CD2-CD1 3.9Å; H210-F231 AromaticContact CD2-CE1 3.88Å; H210-D304 PolarHBondContact N-OD2 3.15Å
211	R	83.4	Confident	89.4	Confident	86 Å²	86	31.6 Å²	31.6	33%	0.325	16%	0.164	S	C	.	.	S	Bend	trans	64.6	2.2	175.3	-51.5	169	175.5	-174.7	-11.3	116.7	I209 C234 Y299 D304	I209-R211 HydrophobicContact CB-CG 4.09Å; I209-R211 HydrophobicContact CG2-CG 3.56Å; R211-C234 WeakPolarHBondContact CD-O 3.33Å; R211-C234 PolarHBondContact NH1-O 3.4Å; R211-Y299 WeakPolarHBondContact CD-OH 3.39Å; R211-Y299 HydrophobicContact CG-CE2 4.08Å; R211-Y299 PolarHBondContact NE-OH 3.2Å; R211-Y299 VanDerWaalsContact NE-OH 3.1Å; R211-Y299 PolarHBondContact NH1-OH 3.28Å; R211-Y299 PolarHBondContact NH2-OH 2.99Å; R211-D304 WeakPolarHBondContact CA-OD1 3.49Å; R211-D304 PolarHBondContact N-OD1 3.48Å
212	D	85.6	Confident	89.3	Confident	8 Å²	8	32 Å²	32	4%	0.043	17%	0.169	C	C	.	.			trans	-144.3	46	176.5	-163.4	33.5	0	0	0	109.4	H210 K214 N217 L233 H241	H210-D212 PolarHBondContact CE1-O 3.16Å; H210-D212 PolarHBondContact ND1-N 3.36Å; H210-D212 PolarHBondContact O-N 3.31Å; D212-K214 PolarHBondContact O-N 2.97Å; D212-K214 WeakPolarHBondContact OD1-CD 3.38Å; D212-K214 WeakPolarHBondContact OD1-CE 3.17Å; D212-K214 IonicContact OD1-NZ 3.22Å; D212-K214 WeakPolarHBondContact OD2-CE 3.32Å; D212-K214 IonicContact OD2-NZ 3.76Å; D212-K214 PolarHBondContact OD2-NZ 3.48Å; D212-N217 PolarHBondContact O-ND2 3.48Å; D212-N217 PolarHBondContact OD2-ND2 2.9Å; D212-L233 HydrophobicContact CB-CB 4.04Å; D212-L233 WeakPolarHBondContact OD2-CD1 3.42Å; D212-H241 IonicContact OD1-CE1 3.02Å
213	I	92.4	Very high	89.4	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.183	C	C	.	.			trans	-72.7	120	173.7	-66	-65.4	0	0	0	108.4	I200 H210 L228 Y288 D304 S307 I311	I200-I213 HydrophobicContact CD1-CD1 4.06Å; I200-I213 HydrophobicContact CD1-CG1 4.11Å; I200-I213 HydrophobicContact CD1-CG2 4.19Å; I200-I213 HydrophobicContact CG1-CD1 3.95Å; I200-I213 HydrophobicContact CG1-CG1 4.43Å; H210-I213 HydrophobicContact CB-CD1 3.68Å; H210-I213 HydrophobicContact CB-CG1 3.84Å; H210-I213 WeakPolarHBondContact CD2-CD1 3.38Å; H210-I213 VanDerWaalsContact CG-CD1 3.41Å; I213-L228 HydrophobicContact CD1-CD2 3.99Å; I213-Y288 WeakPolarHBondContact O-CB 3.15Å; I213-D304 HydrophobicContact CG1-CB 4.08Å; I213-S307 WeakPolarHBondContact O-CB 3.47Å; I213-I311 HydrophobicContact CG2-CD1 3.6Å
214	K	91.9	Very high	89.8	Confident	12 Å²	12	36.1 Å²	36.1	5%	0.052	18%	0.182	C	C	.	.	S	Bend	trans	-165.2	161.4	-177	56	-174.8	175.3	165.7	0	109	D212 D216 N217 Y288	D212-K214 PolarHBondContact O-N 2.97Å; D212-K214 WeakPolarHBondContact OD1-CD 3.38Å; D212-K214 WeakPolarHBondContact OD1-CE 3.17Å; D212-K214 IonicContact OD1-NZ 3.22Å; D212-K214 WeakPolarHBondContact OD2-CE 3.32Å; D212-K214 IonicContact OD2-NZ 3.76Å; D212-K214 PolarHBondContact OD2-NZ 3.48Å; K214-D216 VanDerWaalsContact C-N 3.29Å; K214-D216 WeakPolarHBondContact CD-OD1 3.48Å; K214-D216 VanDerWaalsContact CD-OD2 3.29Å; K214-D216 WeakPolarHBondContact CD-OD2 3.47Å; K214-D216 VanDerWaalsContact CE-CG 3.5Å; K214-D216 WeakPolarHBondContact CE-OD2 3.37Å; K214-D216 WeakPolarHBondContact CG-OD1 3.45Å; K214-D216 IonicContact NZ-OD2 2.68Å; K214-D216 PolarHBondContact NZ-OD2 2.82Å; K214-D216 PolarHBondContact O-N 3.21Å; K214-N217 WeakPolarHBondContact CE-ND2 3.39Å; K214-N217 WeakPolarHBondContact CE-OD1 3.47Å; K214-N217 HydrophobicContact CG-CB 4.26Å; K214-N217 PolarHBondContact O-N 2.56Å; K214-Y288 HydrophobicContact CB-CD1 4.3Å; K214-Y288 HydrophobicContact CB-CD2 3.79Å; K214-Y288 HydrophobicContact CB-CE2 4.15Å; K214-Y288 HydrophobicContact CB-CG 3.91Å
215	P	93.3	Very high	90.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.7	-30.3	-172.7	-24.7	34.8	0	0	0	115	M174 M175 L178 N217 L218 Y288 I311 E314	M174-P215 HydrophobicContact CB-CB 4.11Å; M174-P215 VanDerWaalsContact CB-O 3.32Å; M174-P215 WeakPolarHBondContact CB-O 3.47Å; M174-P215 HydrophobicContact CG-CB 4.12Å; M174-P215 PolarHBondContact N-O 2.99Å; M175-P215 HydrophobicContact CB-CB 3.89Å; M175-P215 PolarHBondContact N-O 2.93Å; L178-P215 HydrophobicContact CD1-CB 4.13Å; L178-P215 HydrophobicContact CD1-CG 4.15Å; P215-N217 PolarHBondContact O-N 2.97Å; P215-L218 PolarHBondContact O-N 3.26Å; P215-Y288 HydrophobicContact CG-CE1 4.24Å; P215-I311 HydrophobicContact CG-CG1 4.15Å; P215-I311 HydrophobicContact CG-CG2 4.48Å; P215-E314 WeakPolarHBondContact CG-OE2 3.49Å
216	D	88.3	Confident	90.6	Very high	35 Å²	35	29 Å²	29	19%	0.187	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-67.9	-21.5	176.2	45.9	-61.5	0	0	0	114	M175 K214	M175-D216 HydrophobicContact CB-CB 4.27Å; M175-D216 HydrophobicContact SD-CB 4.27Å; K214-D216 VanDerWaalsContact C-N 3.29Å; K214-D216 WeakPolarHBondContact CD-OD1 3.48Å; K214-D216 VanDerWaalsContact CD-OD2 3.29Å; K214-D216 WeakPolarHBondContact CD-OD2 3.47Å; K214-D216 VanDerWaalsContact CE-CG 3.5Å; K214-D216 WeakPolarHBondContact CE-OD2 3.37Å; K214-D216 WeakPolarHBondContact CG-OD1 3.45Å; K214-D216 IonicContact NZ-OD2 2.68Å; K214-D216 PolarHBondContact NZ-OD2 2.82Å; K214-D216 PolarHBondContact O-N 3.21Å
217	N	91.6	Very high	91.3	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.027	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-94.6	-5.6	178.7	-73.4	-4.3	0	0	0	113.3	D212 K214 P215 S229	D212-N217 PolarHBondContact O-ND2 3.48Å; D212-N217 PolarHBondContact OD2-ND2 2.9Å; K214-N217 WeakPolarHBondContact CE-ND2 3.39Å; K214-N217 WeakPolarHBondContact CE-OD1 3.47Å; K214-N217 HydrophobicContact CG-CB 4.26Å; K214-N217 PolarHBondContact O-N 2.56Å; P215-N217 PolarHBondContact O-N 2.97Å; N217-S229 PolarHBondContact O-N 2.92Å; N217-S229 PolarHBondContact O-OG 3.29Å
218	L	95.7	Very high	91.8	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	102.2	174.4	-55.2	-175.1	0	0	0	109.3	D173 M174 T196 P215 V226 L228 I311	D173-L218 CarbonylContact C-O 3.5Å; D173-L218 WeakPolarHBondContact CA-O 3.48Å; M174-L218 HydrophobicContact CB-CB 3.84Å; M174-L218 PolarHBondContact N-O 2.93Å; T196-L218 HydrophobicContact CG2-CD1 4.19Å; T196-L218 HydrophobicContact CG2-CD2 3.94Å; P215-L218 PolarHBondContact O-N 3.26Å; L218-V226 HydrophobicContact CB-CG1 4.42Å; L218-V226 HydrophobicContact CD2-CG1 4.41Å; L218-L228 HydrophobicContact CD2-CD2 3.38Å; L218-I311 HydrophobicContact CD1-CD1 4Å; L218-I311 HydrophobicContact CD1-CG2 4.49Å
219	L	95.9	Very high	92.1	Very high	37 Å²	37	19.6 Å²	19.6	19%	0.194	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	155.2	179.8	-57.8	-172.7	0	0	0	111.8	V150 L169 G172 D173 V226 K227 S229	V150-L219 HydrophobicContact CG2-CD1 3.93Å; L169-L219 HydrophobicContact CB-CB 4.45Å; L169-L219 HydrophobicContact CD1-CB 3.57Å; L169-L219 HydrophobicContact CD1-CD1 4Å; L169-L219 HydrophobicContact CD1-CG 4.44Å; G172-L219 CarbonylContact O-C 3.57Å; G172-L219 WeakPolarHBondContact O-CA 3.23Å; D173-L219 HydrophobicContact CB-CD2 3.64Å; L219-V226 CarbonylContact O-C 3.48Å; L219-V226 WeakPolarHBondContact O-CA 2.97Å; L219-K227 PolarHBondContact N-O 3.23Å; L219-K227 PolarHBondContact O-N 3.46Å; L219-S229 WeakPolarHBondContact CG-OG 3.39Å
220	L	96.4	Very high	91.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	126.1	179.3	-60.5	175.7	0	0	0	110.5	L169 G171 G172 M174 L177 Y192 H225 V226 I399	L169-L220 WeakPolarHBondContact CB-O 3.36Å; G171-L220 WeakPolarHBondContact CA-O 3.38Å; G171-L220 PolarHBondContact N-O 3.48Å; G172-L220 PolarHBondContact O-N 2.98Å; M174-L220 HydrophobicContact CE-CD2 4.23Å; L177-L220 HydrophobicContact CD2-CD1 3.73Å; Y192-L220 HydrophobicContact CD1-CD2 4.42Å; Y192-L220 HydrophobicContact CE1-CD2 3.86Å; L220-H225 WeakPolarHBondContact CA-O 3.01Å; L220-V226 HydrophobicContact CD2-CG2 4.14Å; L220-I399 HydrophobicContact CB-CD1 4.49Å; L220-I399 HydrophobicContact CD1-CD1 4.16Å
221	D	94.6	Very high	91	Very high	22 Å²	22	19.7 Å²	19.7	12%	0.118	9%	0.094	C	C	.	.			trans	-72.4	176.9	173.6	71.6	25.3	0	0	0	112.4	L169 R223 G224 H225 R391	L169-D221 HydrophobicContact CD2-CB 3.97Å; D221-R223 PolarHBondContact O-N 3.39Å; D221-R223 WeakPolarHBondContact OD1-CA 3.34Å; D221-R223 WeakPolarHBondContact OD1-CB 3.4Å; D221-R223 PolarHBondContact OD1-N 3.09Å; D221-G224 PolarHBondContact O-N 2.9Å; D221-G224 PolarHBondContact OD1-N 3.08Å; D221-H225 PolarHBondContact N-O 2.78Å; D221-H225 IonicContact OD1-CD2 3.79Å; D221-H225 PolarHBondContact OD1-N 2.82Å; D221-R391 IonicContact OD2-NH2 3.96Å; D221-R391 PolarHBondContact OD2-NH2 3.4Å
222	A	93.4	Very high	89.7	Confident	26 Å²	26	15.9 Å²	15.9	22%	0.215	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.5	-178.9	0	0	0	0	0	114.2	P170 I401	P170-A222 HydrophobicContact CG-CB 3.8Å; A222-I401 HydrophobicContact CB-CD1 3.79Å
223	R	94.2	Very high	88	Confident	106 Å²	106	16.5 Å²	16.5	40%	0.4	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-6.8	176.7	-70.6	174	60	-144.8	-8.7	112.3	D221 H225 R391 E392 R393 A395	D221-R223 PolarHBondContact O-N 3.39Å; D221-R223 WeakPolarHBondContact OD1-CA 3.34Å; D221-R223 WeakPolarHBondContact OD1-CB 3.4Å; D221-R223 PolarHBondContact OD1-N 3.09Å; R223-H225 PolarHBondContact NH2-NE2 3.26Å; R223-H225 VanDerWaalsContact NH2-NE2 3.1Å; R223-R391 PolarHBondContact NH1-O 3.14Å; R223-R391 PolarHBondContact NH2-O 3.21Å; R223-E392 PolarHBondContact NH2-O 3.26Å; R223-R393 PolarHBondContact NH2-O 3.43Å; R223-A395 VanDerWaalsContact O-CB 3.26Å; R223-A395 WeakPolarHBondContact O-CB 3.38Å
224	G	95.3	Very high	85.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	90.1	13.3	-179.7	0	0	0	0	0	115.1	D221 A395 I399	D221-G224 PolarHBondContact O-N 2.9Å; D221-G224 PolarHBondContact OD1-N 3.08Å; G224-A395 WeakPolarHBondContact O-CB 3.49Å; G224-I399 VanDerWaalsContact CA-CG1 3.47Å
225	H	97.3	Very high	83.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.103	C	C	.	.			trans	-88.5	149.4	176.4	-62.4	-85.6	0	0	0	111.9	F191 E195 L220 D221 R223 I390 R391 R393	F191-H225 AromaticContact CZ-CE1 3.84Å; F191-H225 AromaticContact CZ-ND1 3.57Å; E195-H225 IonicContact OE1-CE1 3.72Å; E195-H225 IonicContact OE1-CG 3.96Å; E195-H225 IonicContact OE1-ND1 2.64Å; E195-H225 PolarHBondContact OE1-ND1 2.88Å; E195-H225 VanDerWaalsContact OE2-CA 3.32Å; E195-H225 WeakPolarHBondContact OE2-CA 3.45Å; E195-H225 IonicContact OE2-ND1 3.39Å; L220-H225 WeakPolarHBondContact CA-O 3.01Å; D221-H225 PolarHBondContact N-O 2.78Å; D221-H225 IonicContact OD1-CD2 3.79Å; D221-H225 PolarHBondContact OD1-N 2.82Å; R223-H225 PolarHBondContact NH2-NE2 3.26Å; R223-H225 VanDerWaalsContact NH2-NE2 3.1Å; H225-I390 PolarHBondContact CE1-O 2.72Å; H225-R391 HydrophobicContact CB-CG 4.18Å; H225-R391 PolarHBondContact CE1-O 3.08Å; H225-R391 PolarHBondContact NE2-O 3.08Å; H225-R393 PolarHBondContact CE1-O 3.48Å; H225-R393 PolarHBondContact NE2-O 2.88Å; H225-R393 VanDerWaalsContact NE2-O 3.12Å
226	V	97.1	Very high	81.5	Confident	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	140.4	-176	178.7	0	0	0	0	111.6	Y192 E195 L218 L219 L220 R391	Y192-V226 HydrophobicContact CD1-CG2 3.73Å; Y192-V226 HydrophobicContact CE1-CG2 4.43Å; E195-V226 HydrophobicContact CB-CB 4.14Å; E195-V226 HydrophobicContact CB-CG2 4.09Å; E195-V226 PolarHBondContact OE2-N 2.87Å; L218-V226 HydrophobicContact CB-CG1 4.42Å; L218-V226 HydrophobicContact CD2-CG1 4.41Å; L219-V226 CarbonylContact O-C 3.48Å; L219-V226 WeakPolarHBondContact O-CA 2.97Å; L220-V226 HydrophobicContact CD2-CG2 4.14Å; V226-R391 PolarHBondContact O-NH1 2.94Å; V226-R391 PolarHBondContact O-NH2 3.28Å; V226-R391 VanDerWaalsContact O-NH2 3.16Å
227	K	95.7	Very high	79.7	Confident	19 Å²	19	19.3 Å²	19.3	8%	0.083	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.8	161.6	-70.1	-170.9	168.2	-135.8	0	110.1	L147 W148 V149 V150 E167 L169 L219	L147-K227 VanDerWaalsContact O-CE 3.24Å; L147-K227 WeakPolarHBondContact O-CE 3.47Å; W148-K227 CarbonylContact O-C 3.55Å; W148-K227 WeakPolarHBondContact O-CA 3.44Å; V149-K227 PolarHBondContact O-NZ 3.45Å; V150-K227 HydrophobicContact CG2-CB 4.28Å; E167-K227 IonicContact OE1-NZ 2.77Å; E167-K227 PolarHBondContact OE1-NZ 3.44Å; E167-K227 IonicContact OE2-NZ 3.27Å; L169-K227 HydrophobicContact CD1-CB 3.85Å; L169-K227 HydrophobicContact CD1-CD 3.86Å; L169-K227 HydrophobicContact CD1-CG 4.3Å; L169-K227 HydrophobicContact CD2-CD 4.1Å; L219-K227 PolarHBondContact N-O 3.23Å; L219-K227 PolarHBondContact O-N 3.46Å
228	L	93.3	Very high	78.1	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	137.3	173.4	-65.5	176.9	0	0	0	110.6	W148 V150 A199 I200 I203 I213 L218 F231	W148-L228 PolarHBondContact O-N 2.76Å; V150-L228 VanDerWaalsContact CG2-O 3.32Å; V150-L228 WeakPolarHBondContact CG2-O 3.13Å; V150-L228 PolarHBondContact N-O 3.41Å; A199-L228 HydrophobicContact CB-CD1 3.74Å; A199-L228 HydrophobicContact CB-CD2 4.4Å; A199-L228 HydrophobicContact CB-CG 3.77Å; I200-L228 HydrophobicContact CG1-CD1 4.45Å; I203-L228 HydrophobicContact CD1-CD1 3.9Å; I203-L228 HydrophobicContact CG1-CD1 4.36Å; I203-L228 HydrophobicContact CG2-CD1 4.42Å; I213-L228 HydrophobicContact CD1-CD2 3.99Å; L218-L228 HydrophobicContact CD2-CD2 3.38Å; L228-F231 HydrophobicContact CB-CE1 3.87Å; L228-F231 HydrophobicContact CB-CZ 3.52Å; L228-F231 HydrophobicContact CD1-CE1 4.38Å; L228-F231 WeakPolarHBondContact O-CZ 3.07Å
229	S	88.6	Confident	76.2	Confident	16 Å²	16	26.5 Å²	26.5	11%	0.112	14%	0.138	C	C	.	.			trans	-130.5	167.3	175.9	71.4	0	0	0	0	110.8	H210 N217 L219	H210-S229 PolarHBondContact NE2-O 3.08Å; N217-S229 PolarHBondContact O-N 2.92Å; N217-S229 PolarHBondContact O-OG 3.29Å; L219-S229 WeakPolarHBondContact CG-OG 3.39Å
230	D	76.8	Confident	74.2	Confident	41 Å²	41	24.8 Å²	24.8	22%	0.219	13%	0.129	C	C	.	.			trans	59.2	58	172.6	-154.2	13.4	0	0	0	115.2	K118 G232 L233	K118-D230 IonicContact NZ-OD1 3.21Å; K118-D230 PolarHBondContact NZ-OD1 3.28Å; D230-G232 PolarHBondContact O-N 3.3Å; D230-L233 WeakPolarHBondContact OD2-CD1 3.44Å
231	F	70.1	Confident	72.5	Confident	1 Å²	1	25.6 Å²	25.6	0%	0.004	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-73.6	-1.5	171.6	-50.3	-85.4	0	0	0	113.2	E137 I140 L141 V149 I203 H210 L228 L233 C234	E137-F231 HydrophobicContact CG-CB 4.35Å; I140-F231 HydrophobicContact CB-CB 4.35Å; I140-F231 HydrophobicContact CB-CG 4.43Å; I140-F231 HydrophobicContact CD1-CB 3.79Å; I140-F231 HydrophobicContact CD1-CG 4.37Å; I140-F231 HydrophobicContact CG2-CB 4.19Å; I140-F231 HydrophobicContact CG2-CD1 3.9Å; I140-F231 HydrophobicContact CG2-CD2 4.08Å; I140-F231 HydrophobicContact CG2-CE1 4.33Å; I140-F231 HydrophobicContact CG2-CG 3.76Å; L141-F231 HydrophobicContact CD2-CD2 3.78Å; L141-F231 HydrophobicContact CD2-CE2 3.76Å; L141-F231 HydrophobicContact CG-CD2 4.11Å; V149-F231 HydrophobicContact CB-CE2 4.47Å; V149-F231 HydrophobicContact CB-CZ 4.07Å; V149-F231 HydrophobicContact CG1-CD2 4.45Å; V149-F231 HydrophobicContact CG1-CE2 3.39Å; V149-F231 HydrophobicContact CG1-CZ 3.43Å; V149-F231 VanDerWaalsContact CG1-CZ 3.43Å; V149-F231 HydrophobicContact CG2-CE1 4.34Å; V149-F231 HydrophobicContact CG2-CZ 3.75Å; I203-F231 HydrophobicContact CD1-CE1 4.29Å; I203-F231 HydrophobicContact CG2-CE1 4.05Å; H210-F231 AromaticContact CD2-CD1 3.9Å; H210-F231 AromaticContact CD2-CE1 3.88Å; L228-F231 HydrophobicContact CB-CE1 3.87Å; L228-F231 HydrophobicContact CB-CZ 3.52Å; L228-F231 HydrophobicContact CD1-CE1 4.38Å; L228-F231 WeakPolarHBondContact O-CZ 3.07Å; F231-L233 PolarHBondContact O-N 3.22Å; F231-C234 PolarHBondContact O-SG 3.37Å
232	G	56.4	Low	71.2	Confident	5 Å²	5	29.8 Å²	29.8	5%	0.052	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-78.2	0.9	-177.5	0	0	0	0	0	114.7	H133 E137 D230	H133-G232 WeakPolarHBondContact CB-O 3.45Å; E137-G232 VanDerWaalsContact CB-CA 3.46Å; E137-G232 VanDerWaalsContact CG-N 3.34Å; E137-G232 WeakPolarHBondContact OE2-CA 3.49Å; D230-G232 PolarHBondContact O-N 3.3Å
233	L	49.1	Very low	69.8	Low	21 Å²	21	30.8 Å²	30.8	11%	0.11	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-111.1	24.2	179.8	-49	-178	0	0	0	112.1	D212 D230 F231 T235 L237	D212-L233 HydrophobicContact CB-CB 4.04Å; D212-L233 WeakPolarHBondContact OD2-CD1 3.42Å; D230-L233 WeakPolarHBondContact OD2-CD1 3.44Å; F231-L233 PolarHBondContact O-N 3.22Å; L233-T235 CarbonylContact O-C 3.54Å; L233-T235 WeakPolarHBondContact O-CA 3.39Å; L233-T235 PolarHBondContact O-N 3.42Å; L233-L237 HydrophobicContact CB-CG 4.4Å; L233-L237 HydrophobicContact CD2-CB 3.87Å; L233-L237 HydrophobicContact CD2-CD1 3.06Å; L233-L237 HydrophobicContact CD2-CG 3.31Å; L233-L237 HydrophobicContact CG-CD1 4.46Å; L233-L237 HydrophobicContact CG-CG 4.42Å
234	C	45.5	Very low	68.6	Low	16 Å²	16	30.7 Å²	30.7	11%	0.108	16%	0.157	C	C	.	.	S	Bend	trans	-55.5	18.8	172.6	-73	0	0	0	0	115	I209 R211 F231	I209-C234 PolarHBondContact O-SG 3.28Å; R211-C234 WeakPolarHBondContact CD-O 3.33Å; R211-C234 PolarHBondContact NH1-O 3.4Å; F231-C234 PolarHBondContact O-SG 3.37Å
235	T	46.3	Very low	67.3	Low	54 Å²	54	34 Å²	34	33%	0.331	17%	0.172	S	C	.	.	S	Bend	trans	-169.9	102.1	143.6	19.4	0	0	0	0	110.6	H133 L233 L237 Y299	H133-T235 PolarHBondContact NE2-OG1 2.8Å; L233-T235 CarbonylContact O-C 3.54Å; L233-T235 WeakPolarHBondContact O-CA 3.39Å; L233-T235 PolarHBondContact O-N 3.42Å; T235-L237 WeakPolarHBondContact O-CD2 3.3Å; T235-L237 PolarHBondContact O-N 3.31Å; T235-Y299 WeakPolarHBondContact CG2-OH 3.47Å
236	G	50.4	Low	66.1	Low	15 Å²	15	34.2 Å²	34.2	16%	0.155	17%	0.173	C	C	.	.			trans	47.5	60.3	151.4	0	0	0	0	0	117.8	R242	G236-R242 VanDerWaalsContact O-CG 3.3Å; G236-R242 WeakPolarHBondContact O-CG 3.35Å; G236-R242 PolarHBondContact O-NE 2.93Å
237	L	49.6	Very low	64.9	Low	21 Å²	21	40.7 Å²	40.7	11%	0.11	20%	0.201	C	C	.	.			trans	-73.9	-28.1	-179.2	-63.1	-150.8	0	0	0	113.9	F100 L233 T235	F100-L237 HydrophobicContact CD2-CD1 4.4Å; F100-L237 HydrophobicContact CE2-CB 4.07Å; F100-L237 HydrophobicContact CE2-CD1 3.56Å; F100-L237 HydrophobicContact CE2-CG 4.47Å; F100-L237 HydrophobicContact CZ-CB 4.09Å; F100-L237 HydrophobicContact CZ-CD1 3.8Å; L233-L237 HydrophobicContact CB-CG 4.4Å; L233-L237 HydrophobicContact CD2-CB 3.87Å; L233-L237 HydrophobicContact CD2-CD1 3.06Å; L233-L237 HydrophobicContact CD2-CG 3.31Å; L233-L237 HydrophobicContact CG-CD1 4.46Å; L233-L237 HydrophobicContact CG-CG 4.42Å; T235-L237 WeakPolarHBondContact O-CD2 3.3Å; T235-L237 PolarHBondContact O-N 3.31Å
238	K	57.6	Low	63.9	Low	26 Å²	26	47.3 Å²	47.3	11%	0.113	24%	0.237	C	C	.	.	S	Bend	trans	-74.1	138.6	175.4	-55.1	-163.3	176.7	-173.5	0	108.6	A240 H241 L278 A279 S281 T282 V283	K238-A240 PolarHBondContact O-N 3.49Å; K238-A240 VanDerWaalsContact O-N 3.11Å; K238-H241 WeakPolarHBondContact O-CA 3.41Å; K238-H241 VanDerWaalsContact O-CB 3.28Å; K238-H241 WeakPolarHBondContact O-CB 3.49Å; K238-H241 PolarHBondContact O-N 3.22Å; K238-L278 PolarHBondContact NZ-O 3Å; K238-A279 PolarHBondContact NZ-O 3.12Å; K238-S281 WeakPolarHBondContact CE-O 3.48Å; K238-T282 VanDerWaalsContact CA-O 3.32Å; K238-T282 WeakPolarHBondContact CA-O 3.35Å; K238-V283 VanDerWaalsContact CB-O 3.28Å; K238-V283 WeakPolarHBondContact CB-O 3.16Å
239	K	57.3	Low	62.9	Low	131 Å²	131	49.4 Å²	49.4	57%	0.57	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-53.2	-38.8	-175.7	-74.3	-173.4	177.9	-179.3	0	112.1	H241 R242 F245 T282 V283	K239-H241 PolarHBondContact O-N 2.79Å; K239-R242 PolarHBondContact O-N 3.34Å; K239-F245 HydrophobicContact CB-CD2 4.12Å; K239-F245 HydrophobicContact CB-CE2 4.42Å; K239-F245 WeakPolarHBondContact O-CB 3.46Å; K239-T282 PolarHBondContact N-O 3.46Å; K239-V283 PolarHBondContact N-O 3.11Å
240	A	54	Low	62.1	Low	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-70.1	-6.5	177.7	0	0	0	0	0	114.4	K238 Y246 V283 G284 P327	K238-A240 PolarHBondContact O-N 3.49Å; K238-A240 VanDerWaalsContact O-N 3.11Å; A240-Y246 WeakPolarHBondContact CA-OH 3.25Å; A240-Y246 WeakPolarHBondContact CB-OH 3.48Å; A240-Y246 WeakPolarHBondContact O-CE2 3.35Å; A240-Y246 PolarHBondContact O-OH 3.26Å; A240-V283 HydrophobicContact CB-CG1 4.22Å; A240-V283 WeakPolarHBondContact CB-O 3.46Å; A240-V283 PolarHBondContact N-O 3.19Å; A240-G284 WeakPolarHBondContact CB-O 3.44Å; A240-P327 HydrophobicContact CB-CB 3.93Å; A240-P327 HydrophobicContact CB-CG 4.47Å
241	H	60.6	Low	62	Low	17 Å²	17	57.4 Å²	57.4	8%	0.079	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-95.4	-6.3	176.2	-59.5	-175.5	0	0	0	112.3	D212 K238 K239 T285 I289	D212-H241 IonicContact OD1-CE1 3.02Å; K238-H241 WeakPolarHBondContact O-CA 3.41Å; K238-H241 VanDerWaalsContact O-CB 3.28Å; K238-H241 WeakPolarHBondContact O-CB 3.49Å; K238-H241 PolarHBondContact O-N 3.22Å; K239-H241 PolarHBondContact O-N 2.79Å; H241-T285 PolarHBondContact NE2-O 2.79Å; H241-I289 HydrophobicContact CB-CD1 3.56Å; H241-I289 WeakPolarHBondContact CD2-CD1 3.47Å; H241-I289 VanDerWaalsContact CG-CD1 3.41Å
242	R	66.2	Low	62.3	Low	111 Å²	111	60.5 Å²	60.5	42%	0.419	31%	0.308	S	S	.	.	S	Bend	trans	-95.8	133.5	178.1	-60.7	-173.9	-178.8	-170.9	-1.3	110.7	G236 K239 D244 F245	G236-R242 VanDerWaalsContact O-CG 3.3Å; G236-R242 WeakPolarHBondContact O-CG 3.35Å; G236-R242 PolarHBondContact O-NE 2.93Å; K239-R242 PolarHBondContact O-N 3.34Å; R242-D244 PolarHBondContact O-N 2.71Å; R242-D244 VanDerWaalsContact O-N 3.13Å; R242-F245 WeakPolarHBondContact O-CB 3.32Å; R242-F245 PolarHBondContact O-N 3.26Å
243	T	65.4	Low	63.2	Low	47 Å²	47	64.9 Å²	64.9	29%	0.288	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-52.3	-36.1	173.9	-48.4	0	0	0	0	112.5	F245 Y246 K247 F294	T243-F245 PolarHBondContact O-N 3.26Å; T243-F245 VanDerWaalsContact O-N 3.14Å; T243-Y246 PolarHBondContact O-N 3.06Å; T243-K247 PolarHBondContact O-N 2.67Å; T243-F294 WeakPolarHBondContact CG2-O 3.28Å
244	D	68.4	Low	64.4	Low	103 Å²	103	64.3 Å²	64.3	55%	0.551	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-54.7	-32.4	178.1	-72.6	-0.9	0	0	0	114.1	R242 Y246 K247	R242-D244 PolarHBondContact O-N 2.71Å; R242-D244 VanDerWaalsContact O-N 3.13Å; D244-Y246 PolarHBondContact O-N 2.9Å; D244-K247 HydrophobicContact CB-CD 4.46Å; D244-K247 WeakPolarHBondContact OD1-CE 3.28Å; D244-K247 IonicContact OD1-NZ 2.7Å; D244-K247 PolarHBondContact OD1-NZ 2.67Å; D244-K247 IonicContact OD2-NZ 2.62Å
245	F	67.8	Low	65.8	Low	71 Å²	71	68.1 Å²	68.1	31%	0.311	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-67.3	-24.4	-179.4	-173.6	-97.4	0	0	0	112.7	K239 R242 T243 V283 P327	K239-F245 HydrophobicContact CB-CD2 4.12Å; K239-F245 HydrophobicContact CB-CE2 4.42Å; K239-F245 WeakPolarHBondContact O-CB 3.46Å; R242-F245 WeakPolarHBondContact O-CB 3.32Å; R242-F245 PolarHBondContact O-N 3.26Å; T243-F245 PolarHBondContact O-N 3.26Å; T243-F245 VanDerWaalsContact O-N 3.14Å; F245-V283 HydrophobicContact CZ-CG1 4.41Å; F245-P327 HydrophobicContact CE1-CB 4.49Å
246	Y	71.9	Confident	67.1	Low	4 Å²	4	66.6 Å²	66.6	2%	0.016	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-110.4	4.9	-176.9	-52	-76.5	0	0	0	114.1	A240 T243 D244 N248 L249 P286 F294 Y331	A240-Y246 WeakPolarHBondContact CA-OH 3.25Å; A240-Y246 WeakPolarHBondContact CB-OH 3.48Å; A240-Y246 WeakPolarHBondContact O-CE2 3.35Å; A240-Y246 PolarHBondContact O-OH 3.26Å; T243-Y246 PolarHBondContact O-N 3.06Å; D244-Y246 PolarHBondContact O-N 2.9Å; Y246-N248 PolarHBondContact O-N 3.13Å; Y246-L249 HydrophobicContact CD1-CD2 4.35Å; Y246-L249 WeakPolarHBondContact O-CB 3Å; Y246-L249 PolarHBondContact O-N 2.98Å; Y246-P286 WeakPolarHBondContact OH-CG 3.41Å; Y246-F294 HydrophobicContact CD2-CD1 4.1Å; Y246-F294 HydrophobicContact CD2-CE1 4.08Å; Y246-F294 HydrophobicContact CE2-CD1 4.18Å; Y246-F294 AromaticContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CZ 4.32Å; Y246-Y331 AromaticContact CD1-CD1 3.76Å; Y246-Y331 HydrophobicContact CD1-CD1 3.76Å; Y246-Y331 AromaticContact CD1-CD2 3.85Å; Y246-Y331 HydrophobicContact CD1-CD2 3.85Å; Y246-Y331 HydrophobicContact CD1-CE1 4.27Å; Y246-Y331 HydrophobicContact CD1-CE2 4.34Å; Y246-Y331 AromaticContact CD1-CG 3.5Å; Y246-Y331 HydrophobicContact CD1-CG 3.5Å; Y246-Y331 AromaticContact CD2-CD2 3.62Å; Y246-Y331 HydrophobicContact CD2-CD2 3.62Å; Y246-Y331 AromaticContact CD2-CE2 3.77Å; Y246-Y331 HydrophobicContact CD2-CE2 3.77Å; Y246-Y331 HydrophobicContact CD2-CG 4.17Å; Y246-Y331 VanDerWaalsContact CE1-CB 3.42Å; Y246-Y331 HydrophobicContact CE1-CD1 4.33Å; Y246-Y331 HydrophobicContact CE1-CD2 4.07Å; Y246-Y331 AromaticContact CE1-CG 3.7Å; Y246-Y331 HydrophobicContact CE1-CG 3.7Å; Y246-Y331 AromaticContact CE2-CD2 3.84Å; Y246-Y331 HydrophobicContact CE2-CD2 3.84Å; Y246-Y331 HydrophobicContact CE2-CE2 4.41Å; Y246-Y331 HydrophobicContact CE2-CG 4.33Å; Y246-Y331 HydrophobicContact CG-CD1 4.04Å; Y246-Y331 AromaticContact CG-CD2 3.61Å; Y246-Y331 HydrophobicContact CG-CD2 3.61Å; Y246-Y331 HydrophobicContact CG-CE1 4.15Å; Y246-Y331 AromaticContact CG-CE2 3.72Å; Y246-Y331 HydrophobicContact CG-CE2 3.72Å; Y246-Y331 AromaticContact CG-CG 3.76Å; Y246-Y331 HydrophobicContact CG-CG 3.76Å; Y246-Y331 AromaticContact CG-CZ 3.97Å
247	K	71.7	Confident	68.1	Low	136 Å²	136	71.3 Å²	71.3	59%	0.591	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-31.3	-176.1	-85.4	177.2	173.9	167.4	0	115	T243 D244	T243-K247 PolarHBondContact O-N 2.67Å; D244-K247 HydrophobicContact CB-CD 4.46Å; D244-K247 WeakPolarHBondContact OD1-CE 3.28Å; D244-K247 IonicContact OD1-NZ 2.7Å; D244-K247 PolarHBondContact OD1-NZ 2.67Å; D244-K247 IonicContact OD2-NZ 2.62Å
248	N	74.2	Confident	69.3	Low	158 Å²	158	75.7 Å²	75.7	85%	0.845	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	9.3	-178.6	-61.1	-25.4	0	0	0	113.1	Y246	Y246-N248 PolarHBondContact O-N 3.13Å
249	L	72.7	Confident	70.2	Confident	43 Å²	43	74.8 Å²	74.8	23%	0.225	39%	0.389	C	S	.	.			trans	-98.7	124.1	179.7	-115.7	78.1	0	0	0	110.6	Y246 Q328 Y331	Y246-L249 HydrophobicContact CD1-CD2 4.35Å; Y246-L249 WeakPolarHBondContact O-CB 3Å; Y246-L249 PolarHBondContact O-N 2.98Å; L249-Q328 HydrophobicContact CD1-CG 4.4Å; L249-Q328 HydrophobicContact CD2-CB 3.69Å; L249-Q328 HydrophobicContact CD2-CG 3.78Å; L249-Y331 HydrophobicContact CD2-CD1 4.41Å
250	N	72.9	Confident	71	Confident	125 Å²	125	71.7 Å²	71.7	67%	0.668	38%	0.376	S	S	*	.			trans	-69.2	142.6	170.3	-70.4	-3.7	0	0	0	110.6	S252	N250-S252 PolarHBondContact O-N 3.26Å
251	H	74.5	Confident	72.2	Confident	100 Å²	100	78.1 Å²	78.1	46%	0.463	41%	0.411	S	S	.	.			trans	-75	19.9	176.1	-61.3	-90.9	0	0	0	113.8	Y331 M335 N336	H251-Y331 AromaticContact CE1-CZ 3.76Å; H251-Y331 PolarHBondContact CE1-OH 2.77Å; H251-M335 WeakPolarHBondContact ND1-CG 3.45Å; H251-N336 PolarHBondContact O-ND2 3.43Å
252	S	76.7	Confident	73.2	Confident	66 Å²	66	79.7 Å²	79.7	46%	0.462	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-61	155.9	175.6	57.9	0	0	0	0	110.9	N250 R332	N250-S252 PolarHBondContact O-N 3.26Å; S252-R332 WeakPolarHBondContact O-CD 3.49Å; S252-R332 WeakPolarHBondContact O-CG 3.34Å
253	L	74.6	Confident	74.1	Confident	97 Å²	97	78.2 Å²	78.2	51%	0.508	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-49.5	144.2	173.4	-84.2	142.8	0	0	0	111.8	E339	L253-E339 WeakPolarHBondContact CD2-OE2 3.41Å
254	P	75.3	Confident	75	Confident	10 Å²	10	76.3 Å²	76.3	7%	0.065	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-59.9	139.3	175.9	24.6	-34	0	0	0	111.7	Q260 E329 R332 K333	P254-Q260 PolarHBondContact O-NE2 3.29Å; P254-E329 WeakPolarHBondContact CA-OE2 3.5Å; P254-E329 WeakPolarHBondContact CB-OE2 3.14Å; P254-R332 HydrophobicContact CB-CB 4.26Å; P254-K333 HydrophobicContact CB-CG 4.27Å; P254-K333 HydrophobicContact CG-CG 3.76Å
255	S	73.4	Confident	75.8	Confident	96 Å²	96	78.3 Å²	78.3	67%	0.671	41%	0.412	S	S	*	.			trans	-92.5	-3	-177.6	53.8	0	0	0	0	113.8	L257 E329	S255-L257 VanDerWaalsContact C-N 3.26Å; S255-L257 PolarHBondContact O-N 2.88Å; S255-E329 PolarHBondContact N-OE2 3.44Å
256	D	73.8	Confident	76.6	Confident	22 Å²	22	82 Å²	82	12%	0.118	42%	0.424	C	S	.	.			trans	-78.1	69.5	-178.5	-166.2	-6.4	0	0	0	112.9	T258 F259 Q260 E329	D256-T258 PolarHBondContact O-N 2.95Å; D256-T258 PolarHBondContact OD1-OG1 2.82Å; D256-F259 HydrophobicContact CB-CB 4.39Å; D256-F259 PolarHBondContact O-N 2.65Å; D256-F259 WeakPolarHBondContact OD1-CB 3.45Å; D256-F259 PolarHBondContact OD1-N 3.21Å; D256-F259 WeakPolarHBondContact OD2-CB 3.4Å; D256-Q260 VanDerWaalsContact O-CG 3.25Å; D256-Q260 WeakPolarHBondContact O-CG 3.35Å; D256-Q260 PolarHBondContact O-N 3.2Å; D256-Q260 VanDerWaalsContact O-N 3.11Å; D256-E329 HydrophobicContact CB-CG 4.35Å; D256-E329 PolarHBondContact N-OE2 3.29Å
257	L	72.1	Confident	77.3	Confident	114 Å²	114	83.5 Å²	83.5	60%	0.597	43%	0.43	S	S	*	.	H	α-helix	trans	-61.6	-31.3	179.2	-65.3	173	0	0	0	112.1	S255 N261	S255-L257 VanDerWaalsContact C-N 3.26Å; S255-L257 PolarHBondContact O-N 2.88Å; L257-N261 WeakPolarHBondContact O-CB 3.38Å; L257-N261 VanDerWaalsContact O-CG 3.26Å; L257-N261 PolarHBondContact O-N 3.11Å; L257-N261 VanDerWaalsContact O-N 3.15Å; L257-N261 PolarHBondContact O-ND2 3.22Å
258	T	74.6	Confident	77.9	Confident	112 Å²	112	77.6 Å²	77.6	69%	0.687	41%	0.407	S	S	*	.	H	α-helix	trans	-65.2	-49.9	178.8	32.9	0	0	0	0	111.8	D256 M262	D256-T258 PolarHBondContact O-N 2.95Å; D256-T258 PolarHBondContact OD1-OG1 2.82Å; T258-M262 VanDerWaalsContact O-CG 3.29Å; T258-M262 WeakPolarHBondContact O-CG 3.44Å
259	F	76.2	Confident	78.4	Confident	7 Å²	7	74.5 Å²	74.5	3%	0.031	39%	0.387	C	S	.	.	H	α-helix	trans	-69.5	-38.8	179.1	-172.2	-87.6	0	0	0	111.9	D256 N261 M262 K267 T270 C323 E325	D256-F259 HydrophobicContact CB-CB 4.39Å; D256-F259 PolarHBondContact O-N 2.65Å; D256-F259 WeakPolarHBondContact OD1-CB 3.45Å; D256-F259 PolarHBondContact OD1-N 3.21Å; D256-F259 WeakPolarHBondContact OD2-CB 3.4Å; F259-N261 VanDerWaalsContact C-N 3.35Å; F259-N261 PolarHBondContact O-N 3.24Å; F259-M262 HydrophobicContact CD2-SD 3.99Å; F259-M262 HydrophobicContact CG-SD 4.5Å; F259-M262 WeakPolarHBondContact O-CB 3.43Å; F259-M262 WeakPolarHBondContact O-CG 3.16Å; F259-M262 PolarHBondContact O-N 3.47Å; F259-K267 HydrophobicContact CE1-CD 4.34Å; F259-K267 HydrophobicContact CE1-CG 4.18Å; F259-K267 HydrophobicContact CZ-CG 4.12Å; F259-K267 WeakPolarHBondContact O-CE 3.45Å; F259-T270 HydrophobicContact CE2-CG2 4.23Å; F259-C323 WeakPolarHBondContact CE1-O 3.35Å; F259-E325 HydrophobicContact CD2-CG 3.93Å; F259-E325 HydrophobicContact CE2-CG 4.4Å
260	Q	74.3	Confident	79	Confident	66 Å²	66	73.7 Å²	73.7	31%	0.308	38%	0.384	S	S	.	.	H	α-helix	trans	-60.9	-42.4	178.9	-72.7	170.9	30.6	0	0	112.4	P254 D256 M262 K267	P254-Q260 PolarHBondContact O-NE2 3.29Å; D256-Q260 VanDerWaalsContact O-CG 3.25Å; D256-Q260 WeakPolarHBondContact O-CG 3.35Å; D256-Q260 PolarHBondContact O-N 3.2Å; D256-Q260 VanDerWaalsContact O-N 3.11Å; Q260-M262 PolarHBondContact O-N 3.23Å; Q260-K267 PolarHBondContact O-NZ 3Å
261	N	78.1	Confident	79.5	Confident	136 Å²	136	68.4 Å²	68.4	73%	0.727	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-2.6	179.7	-70.2	-34.5	0	0	0	114.2	L257 F259	L257-N261 WeakPolarHBondContact O-CB 3.38Å; L257-N261 VanDerWaalsContact O-CG 3.26Å; L257-N261 PolarHBondContact O-N 3.11Å; L257-N261 VanDerWaalsContact O-N 3.15Å; L257-N261 PolarHBondContact O-ND2 3.22Å; F259-N261 VanDerWaalsContact C-N 3.35Å; F259-N261 PolarHBondContact O-N 3.24Å
262	M	82.4	Confident	79.9	Confident	49 Å²	49	65.8 Å²	65.8	24%	0.241	34%	0.342	C	S	.	.	S	Bend	trans	-68.3	141	173	-59.6	-176.6	89.3	0	0	110.6	T258 F259 Q260 R266 K267	T258-M262 VanDerWaalsContact O-CG 3.29Å; T258-M262 WeakPolarHBondContact O-CG 3.44Å; F259-M262 HydrophobicContact CD2-SD 3.99Å; F259-M262 HydrophobicContact CG-SD 4.5Å; F259-M262 WeakPolarHBondContact O-CB 3.43Å; F259-M262 WeakPolarHBondContact O-CG 3.16Å; F259-M262 PolarHBondContact O-N 3.47Å; Q260-M262 PolarHBondContact O-N 3.23Å; M262-R266 HydrophobicContact CB-CB 4.41Å; M262-R266 HydrophobicContact CE-CB 3.6Å; M262-R266 HydrophobicContact CE-CG 4.29Å; M262-K267 HydrophobicContact CB-CG 4.02Å; M262-K267 VanDerWaalsContact O-CE 3.22Å; M262-K267 WeakPolarHBondContact O-CE 3.49Å; M262-K267 PolarHBondContact O-NZ 2.9Å
263	N	84.4	Confident	80.2	Confident	80 Å²	80	71.1 Å²	71.1	43%	0.428	35%	0.352	S	S	.	.			trans	-63.5	159	170.1	67.4	13.6	0	0	0	111.4	K265 R266 K267	N263-K265 VanDerWaalsContact C-N 3.27Å; N263-K265 PolarHBondContact O-N 3.03Å; N263-R266 PolarHBondContact O-N 3.32Å; N263-R266 VanDerWaalsContact OD1-CB 3.28Å; N263-R266 WeakPolarHBondContact OD1-CB 3.28Å; N263-R266 WeakPolarHBondContact OD1-CG 3.33Å; N263-R266 PolarHBondContact OD1-N 3.14Å; N263-K267 PolarHBondContact O-N 3.13Å
264	S	84.8	Confident	80.6	Confident	8 Å²	8	69.3 Å²	69.3	6%	0.056	34%	0.343	C	S	.	.	H	α-helix	trans	-55.8	-42.5	-176.2	-178.3	0	0	0	0	112.3	R266 K267 A268 Y319 E346 V347	S264-R266 PolarHBondContact O-N 3.02Å; S264-K267 WeakPolarHBondContact O-CB 3.24Å; S264-K267 PolarHBondContact O-N 3.16Å; S264-A268 PolarHBondContact O-N 2.89Å; S264-Y319 VanDerWaalsContact O-CE1 3.28Å; S264-Y319 WeakPolarHBondContact O-CE1 3.38Å; S264-Y319 WeakPolarHBondContact OG-CE1 3.32Å; S264-Y319 PolarHBondContact OG-OH 3.38Å; S264-E346 WeakPolarHBondContact CB-OE1 3.31Å; S264-E346 PolarHBondContact N-OE1 3.05Å; S264-V347 WeakPolarHBondContact OG-CG2 3.39Å
265	K	85.4	Confident	80.7	Confident	145 Å²	145	69.4 Å²	69.4	63%	0.63	34%	0.342	S	S	*	.	H	α-helix	trans	-57.9	-46.4	179.6	-172.9	174	179.3	176	0	113.1	N263 A268 E269	N263-K265 VanDerWaalsContact C-N 3.27Å; N263-K265 PolarHBondContact O-N 3.03Å; K265-A268 PolarHBondContact O-N 3.14Å; K265-E269 WeakPolarHBondContact CE-OE1 3.49Å; K265-E269 WeakPolarHBondContact O-CG 3.39Å; K265-E269 PolarHBondContact O-N 3.36Å
266	R	85.3	Confident	80.6	Confident	148 Å²	148	69.5 Å²	69.5	56%	0.558	33%	0.328	S	S	*	.	H	α-helix	trans	-68.1	-35.5	178.9	-74.7	178.7	176.4	-171.3	-0.4	112.3	M262 N263 S264 E269 T270	M262-R266 HydrophobicContact CB-CB 4.41Å; M262-R266 HydrophobicContact CE-CB 3.6Å; M262-R266 HydrophobicContact CE-CG 4.29Å; N263-R266 PolarHBondContact O-N 3.32Å; N263-R266 VanDerWaalsContact OD1-CB 3.28Å; N263-R266 WeakPolarHBondContact OD1-CB 3.28Å; N263-R266 WeakPolarHBondContact OD1-CG 3.33Å; N263-R266 PolarHBondContact OD1-N 3.14Å; S264-R266 PolarHBondContact O-N 3.02Å; R266-E269 PolarHBondContact O-N 2.54Å; R266-T270 PolarHBondContact O-N 2.84Å; R266-T270 PolarHBondContact O-OG1 2.76Å; R266-T270 VanDerWaalsContact O-OG1 3.14Å
267	K	85.3	Confident	80.6	Confident	36 Å²	36	75.1 Å²	75.1	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-61	-45.9	173.6	-72	175.6	178	158.7	0	110.8	F259 Q260 M262 N263 S264 E269 T270 W271 Y319	F259-K267 HydrophobicContact CE1-CD 4.34Å; F259-K267 HydrophobicContact CE1-CG 4.18Å; F259-K267 HydrophobicContact CZ-CG 4.12Å; F259-K267 WeakPolarHBondContact O-CE 3.45Å; Q260-K267 PolarHBondContact O-NZ 3Å; M262-K267 HydrophobicContact CB-CG 4.02Å; M262-K267 VanDerWaalsContact O-CE 3.22Å; M262-K267 WeakPolarHBondContact O-CE 3.49Å; M262-K267 PolarHBondContact O-NZ 2.9Å; N263-K267 PolarHBondContact O-N 3.13Å; S264-K267 WeakPolarHBondContact O-CB 3.24Å; S264-K267 PolarHBondContact O-N 3.16Å; K267-E269 PolarHBondContact O-N 3.11Å; K267-T270 PolarHBondContact O-N 3.14Å; K267-W271 VanDerWaalsContact O-CB 3.25Å; K267-W271 WeakPolarHBondContact O-CB 3.32Å; K267-W271 PolarHBondContact O-N 3.3Å; K267-Y319 HydrophobicContact CB-CD1 3.87Å; K267-Y319 HydrophobicContact CB-CD2 4.47Å; K267-Y319 HydrophobicContact CB-CE1 3.64Å; K267-Y319 HydrophobicContact CB-CE2 4.31Å; K267-Y319 HydrophobicContact CB-CG 4.27Å; K267-Y319 HydrophobicContact CD-CE2 4.16Å
268	A	84.8	Confident	80.5	Confident	12 Å²	12	71.4 Å²	71.4	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-60.2	-42.1	176	0	0	0	0	0	112.5	S264 K265 W271 K272 Y319	S264-A268 PolarHBondContact O-N 2.89Å; K265-A268 PolarHBondContact O-N 3.14Å; A268-W271 PolarHBondContact O-N 2.82Å; A268-K272 WeakPolarHBondContact O-CB 3.42Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.06Å; A268-Y319 HydrophobicContact CB-CD1 3.89Å; A268-Y319 HydrophobicContact CB-CE1 4.47Å
269	E	85.9	Confident	80.2	Confident	92 Å²	92	67.3 Å²	67.3	43%	0.43	31%	0.311	S	S	.	.	H	α-helix	trans	-64.2	-46.6	176.8	-72.8	170.7	-170	0	0	112.4	K265 R266 K267 W271 K272 R273	K265-E269 WeakPolarHBondContact CE-OE1 3.49Å; K265-E269 WeakPolarHBondContact O-CG 3.39Å; K265-E269 PolarHBondContact O-N 3.36Å; R266-E269 PolarHBondContact O-N 2.54Å; K267-E269 PolarHBondContact O-N 3.11Å; E269-W271 VanDerWaalsContact C-N 3.35Å; E269-K272 PolarHBondContact O-N 3.01Å; E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 PolarHBondContact O-N 3.17Å; E269-R273 VanDerWaalsContact O-N 3.07Å
270	T	84.8	Confident	79.6	Confident	27 Å²	27	71 Å²	71	17%	0.166	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-44.1	176.7	-61.8	0	0	0	0	111.1	F259 R266 K267 R273 N274	F259-T270 HydrophobicContact CE2-CG2 4.23Å; R266-T270 PolarHBondContact O-N 2.84Å; R266-T270 PolarHBondContact O-OG1 2.76Å; R266-T270 VanDerWaalsContact O-OG1 3.14Å; K267-T270 PolarHBondContact O-N 3.14Å; T270-R273 PolarHBondContact O-N 2.72Å; T270-N274 PolarHBondContact O-N 3.34Å; T270-N274 VanDerWaalsContact O-N 3.17Å; T270-N274 PolarHBondContact O-ND2 3.07Å
271	W	83	Confident	79.2	Confident	14 Å²	14	69.5 Å²	69.5	5%	0.053	32%	0.324	C	S	.	.	H	α-helix	trans	-56.2	-55.5	176.5	178.9	-117.8	0	0	0	111.1	K267 A268 E269 R273 N274 R275 L278 D287 Y288 E314 P320 C323	K267-W271 VanDerWaalsContact O-CB 3.25Å; K267-W271 WeakPolarHBondContact O-CB 3.32Å; K267-W271 PolarHBondContact O-N 3.3Å; A268-W271 PolarHBondContact O-N 2.82Å; E269-W271 VanDerWaalsContact C-N 3.35Å; W271-R273 VanDerWaalsContact C-N 3.32Å; W271-R273 PolarHBondContact O-N 2.78Å; W271-N274 PolarHBondContact O-N 3.31Å; W271-N274 VanDerWaalsContact O-N 3.12Å; W271-R275 VanDerWaalsContact CE2-CD 3.44Å; W271-R275 VanDerWaalsContact CZ2-CD 3.41Å; W271-R275 WeakPolarHBondContact O-CA 3.27Å; W271-R275 VanDerWaalsContact O-CB 3.27Å; W271-R275 WeakPolarHBondContact O-CB 3.31Å; W271-R275 PolarHBondContact O-N 3.3Å; W271-L278 HydrophobicContact CE3-CD1 4.38Å; W271-L278 HydrophobicContact CH2-CD1 4.44Å; W271-L278 HydrophobicContact CZ3-CD1 3.86Å; W271-D287 HydrophobicContact CH2-CB 4.36Å; W271-D287 WeakPolarHBondContact CH2-OD2 3.2Å; W271-Y288 WeakPolarHBondContact CZ2-OH 3.48Å; W271-E314 PolarHBondContact NE1-OE1 3.45Å; W271-P320 HydrophobicContact CD2-CG 4.41Å; W271-P320 HydrophobicContact CE3-CG 4.5Å; W271-P320 HydrophobicContact CH2-CG 3.4Å; W271-P320 HydrophobicContact CZ2-CG 3.25Å; W271-P320 HydrophobicContact CZ3-CG 4.06Å; W271-C323 HydrophobicContact CD2-CB 4.5Å; W271-C323 HydrophobicContact CE3-CB 3.76Å; W271-C323 HydrophobicContact CZ3-CB 3.8Å
272	K	83.9	Confident	78.1	Confident	44 Å²	44	66.7 Å²	66.7	19%	0.191	31%	0.312	C	S	.	.	H	α-helix	trans	-58.7	-40.5	-179.5	-76	171.2	-174.1	157	0	113.3	D182 A268 E269 N274 R275	D182-K272 VanDerWaalsContact OD1-CE 3.28Å; D182-K272 WeakPolarHBondContact OD1-CE 3.5Å; D182-K272 IonicContact OD1-NZ 2.62Å; D182-K272 PolarHBondContact OD1-NZ 3.33Å; D182-K272 IonicContact OD2-NZ 3.99Å; A268-K272 WeakPolarHBondContact O-CB 3.42Å; A268-K272 WeakPolarHBondContact O-CG 3.37Å; A268-K272 PolarHBondContact O-N 3.06Å; E269-K272 PolarHBondContact O-N 3.01Å; K272-N274 VanDerWaalsContact C-N 3.31Å; K272-N274 PolarHBondContact O-N 2.88Å; K272-R275 PolarHBondContact O-N 3.34Å
273	R	82.8	Confident	77	Confident	178 Å²	178	66.7 Å²	66.7	67%	0.672	32%	0.315	S	S	*	.	H	α-helix	trans	-61	-41.3	178	-173.6	179.7	-65.6	133	3.2	111.8	E269 T270 W271	E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 PolarHBondContact O-N 3.17Å; E269-R273 VanDerWaalsContact O-N 3.07Å; T270-R273 PolarHBondContact O-N 2.72Å; W271-R273 VanDerWaalsContact C-N 3.32Å; W271-R273 PolarHBondContact O-N 2.78Å
274	N	82.1	Confident	76.4	Confident	59 Å²	59	62.9 Å²	62.9	32%	0.316	30%	0.295	S	S	.	.	H	α-helix	trans	-90.9	-17.8	-175.1	-63.5	-17.5	0	0	0	112.9	T270 W271 K272 R276 Q277 L278	T270-N274 PolarHBondContact O-N 3.34Å; T270-N274 VanDerWaalsContact O-N 3.17Å; T270-N274 PolarHBondContact O-ND2 3.07Å; W271-N274 PolarHBondContact O-N 3.31Å; W271-N274 VanDerWaalsContact O-N 3.12Å; K272-N274 VanDerWaalsContact C-N 3.31Å; K272-N274 PolarHBondContact O-N 2.88Å; N274-R276 VanDerWaalsContact C-N 3.34Å; N274-R276 PolarHBondContact O-N 2.71Å; N274-Q277 PolarHBondContact O-N 3.38Å; N274-L278 HydrophobicContact CB-CD1 4.39Å; N274-L278 WeakPolarHBondContact O-CG 3.47Å; N274-L278 PolarHBondContact O-N 3.15Å
275	R	78.1	Confident	75.9	Confident	12 Å²	12	63.2 Å²	63.2	5%	0.045	30%	0.296	C	S	.	.	H	α-helix	trans	-55.5	-43.1	-170.8	-168.1	61.1	171.7	154.1	8.9	113.7	M175 W271 K272 L278 A279 Y288 E314	M175-R275 HydrophobicContact CE-CB 4.35Å; M175-R275 HydrophobicContact CE-CG 3.63Å; M175-R275 HydrophobicContact CG-CG 4.31Å; M175-R275 HydrophobicContact SD-CG 3.84Å; W271-R275 VanDerWaalsContact CE2-CD 3.44Å; W271-R275 VanDerWaalsContact CZ2-CD 3.41Å; W271-R275 WeakPolarHBondContact O-CA 3.27Å; W271-R275 VanDerWaalsContact O-CB 3.27Å; W271-R275 WeakPolarHBondContact O-CB 3.31Å; W271-R275 PolarHBondContact O-N 3.3Å; K272-R275 PolarHBondContact O-N 3.34Å; R275-L278 PolarHBondContact O-N 3.2Å; R275-A279 PolarHBondContact O-N 2.93Å; R275-Y288 PolarHBondContact NH1-OH 3.4Å; R275-Y288 PolarHBondContact NH2-OH 2.83Å; R275-E314 IonicContact NE-OE1 3.77Å; R275-E314 IonicContact NH2-OE1 3.74Å
276	R	71.6	Confident	75.9	Confident	99 Å²	99	56.3 Å²	56.3	37%	0.374	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-45.9	177.2	-67.5	-174.5	-178.1	-142.9	-9.1	111.8	M175 M179 N274 L278 A279 F280 D411	M175-R276 HydrophobicContact CE-CG 4.32Å; M179-R276 HydrophobicContact CE-CG 4.06Å; M179-R276 HydrophobicContact SD-CG 3.8Å; N274-R276 VanDerWaalsContact C-N 3.34Å; N274-R276 PolarHBondContact O-N 2.71Å; R276-L278 VanDerWaalsContact C-N 3.27Å; R276-L278 PolarHBondContact O-N 3.28Å; R276-A279 PolarHBondContact O-N 2.8Å; R276-F280 HydrophobicContact CB-CE2 4.2Å; R276-F280 WeakPolarHBondContact O-CD2 3.38Å; R276-F280 WeakPolarHBondContact O-CE2 3.49Å; R276-F280 PolarHBondContact O-N 2.78Å; R276-D411 IonicContact CZ-OD1 3.54Å; R276-D411 IonicContact CZ-OD2 3Å; R276-D411 IonicContact NE-OD2 3.14Å; R276-D411 IonicContact NH1-OD1 2.93Å; R276-D411 PolarHBondContact NH1-OD1 3.22Å; R276-D411 IonicContact NH1-OD2 2.82Å; R276-D411 PolarHBondContact NH1-OD2 2.9Å; R276-D411 VanDerWaalsContact NH1-OD2 3.13Å; R276-D411 IonicContact NH2-OD1 2.76Å; R276-D411 PolarHBondContact NH2-OD1 3.32Å; R276-D411 IonicContact NH2-OD2 2.69Å; R276-D411 PolarHBondContact NH2-OD2 2.64Å
277	Q	72.6	Confident	76.2	Confident	140 Å²	140	49.2 Å²	49.2	65%	0.654	24%	0.24	S	C	*	.	H	α-helix	trans	-63.5	-36.5	177.9	-63.8	-178.6	-0.5	0	0	111.4	N274 F280 S281	N274-Q277 PolarHBondContact O-N 3.38Å; Q277-F280 PolarHBondContact O-N 2.96Å; Q277-S281 VanDerWaalsContact O-CB 3.28Å; Q277-S281 WeakPolarHBondContact O-CB 3.21Å; Q277-S281 PolarHBondContact O-N 3.19Å
278	L	71.1	Confident	76.5	Confident	36 Å²	36	48.1 Å²	48.1	19%	0.188	23%	0.234	C	C	.	.	H	α-helix	trans	-67.4	-38	176.4	-70.5	172.2	0	0	0	113.1	K238 W271 N274 R275 R276 S281 T285	K238-L278 PolarHBondContact NZ-O 3Å; W271-L278 HydrophobicContact CE3-CD1 4.38Å; W271-L278 HydrophobicContact CH2-CD1 4.44Å; W271-L278 HydrophobicContact CZ3-CD1 3.86Å; N274-L278 HydrophobicContact CB-CD1 4.39Å; N274-L278 WeakPolarHBondContact O-CG 3.47Å; N274-L278 PolarHBondContact O-N 3.15Å; R275-L278 PolarHBondContact O-N 3.2Å; R276-L278 VanDerWaalsContact C-N 3.27Å; R276-L278 PolarHBondContact O-N 3.28Å; L278-S281 PolarHBondContact O-N 3.24Å; L278-T285 HydrophobicContact CD1-CG2 4.37Å; L278-T285 HydrophobicContact CD2-CG2 3.55Å
279	A	66.6	Low	76.8	Confident	26 Å²	26	48.2 Å²	48.2	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-47.4	175	0	0	0	0	0	111.2	M175 K238 R275 R276 S281	M175-A279 HydrophobicContact CE-CB 3.81Å; M175-A279 HydrophobicContact SD-CB 4.03Å; K238-A279 PolarHBondContact NZ-O 3.12Å; R275-A279 PolarHBondContact O-N 2.93Å; R276-A279 PolarHBondContact O-N 2.8Å; A279-S281 PolarHBondContact O-N 2.88Å
280	F	65.1	Low	77.2	Confident	84 Å²	84	43.9 Å²	43.9	37%	0.368	21%	0.213	S	C	.	.	H	α-helix	trans	-80.7	-10.4	-179.9	-52.5	-51.5	0	0	0	114.6	R97 R276 Q277 F413	R97-F280 HydrophobicContact CB-CD1 4.37Å; R97-F280 HydrophobicContact CB-CE1 4.46Å; R97-F280 VanDerWaalsContact O-CD1 3.3Å; R97-F280 WeakPolarHBondContact O-CD1 3.42Å; R276-F280 HydrophobicContact CB-CE2 4.2Å; R276-F280 WeakPolarHBondContact O-CD2 3.38Å; R276-F280 WeakPolarHBondContact O-CE2 3.49Å; R276-F280 PolarHBondContact O-N 2.78Å; Q277-F280 PolarHBondContact O-N 2.96Å; F280-F413 AromaticContact CE1-CE1 3.57Å; F280-F413 HydrophobicContact CE1-CE1 3.57Å; F280-F413 AromaticContact CE1-CZ 3.83Å; F280-F413 HydrophobicContact CE1-CZ 3.83Å; F280-F413 HydrophobicContact CE2-CE1 4.2Å; F280-F413 AromaticContact CZ-CE1 3.38Å; F280-F413 HydrophobicContact CZ-CE1 3.38Å; F280-F413 AromaticContact CZ-CZ 3.61Å; F280-F413 HydrophobicContact CZ-CZ 3.61Å
281	S	66	Low	77.5	Confident	35 Å²	35	42.9 Å²	42.9	25%	0.245	21%	0.207	C	C	.	.			trans	-70.7	134.5	-179.3	176.8	0	0	0	0	112.1	K238 Q277 L278 A279 V283 G284	K238-S281 WeakPolarHBondContact CE-O 3.48Å; Q277-S281 VanDerWaalsContact O-CB 3.28Å; Q277-S281 WeakPolarHBondContact O-CB 3.21Å; Q277-S281 PolarHBondContact O-N 3.19Å; L278-S281 PolarHBondContact O-N 3.24Å; A279-S281 PolarHBondContact O-N 2.88Å; S281-V283 VanDerWaalsContact C-N 3.26Å; S281-V283 PolarHBondContact OG-N 2.97Å; S281-V283 VanDerWaalsContact OG-N 3.11Å; S281-G284 PolarHBondContact OG-N 2.9Å
282	T	55.2	Low	77.9	Confident	76 Å²	76	42.6 Å²	42.6	47%	0.466	21%	0.206	S	C	.	.	S	Bend	trans	-73	-18.7	170.9	57.5	0	0	0	0	112.8	A99 K238 K239	A99-T282 HydrophobicContact CB-CG2 4.06Å; K238-T282 VanDerWaalsContact CA-O 3.32Å; K238-T282 WeakPolarHBondContact CA-O 3.35Å; K239-T282 PolarHBondContact N-O 3.46Å
283	V	59	Low	78.1	Confident	49 Å²	49	42 Å²	42	30%	0.297	21%	0.206	S	C	.	.	S	Bend	trans	-84.8	-41.7	177.3	-179.7	0	0	0	0	110.3	K238 K239 A240 F245 S281 P327	K238-V283 VanDerWaalsContact CB-O 3.28Å; K238-V283 WeakPolarHBondContact CB-O 3.16Å; K239-V283 PolarHBondContact N-O 3.11Å; A240-V283 HydrophobicContact CB-CG1 4.22Å; A240-V283 WeakPolarHBondContact CB-O 3.46Å; A240-V283 PolarHBondContact N-O 3.19Å; F245-V283 HydrophobicContact CZ-CG1 4.41Å; S281-V283 VanDerWaalsContact C-N 3.26Å; S281-V283 PolarHBondContact OG-N 2.97Å; S281-V283 VanDerWaalsContact OG-N 3.11Å; V283-P327 HydrophobicContact CG1-CG 4.43Å
284	G	70.9	Confident	78.1	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.01	18%	0.176	C	C	.	.			trans	65.7	-172.9	-178.3	0	0	0	0	0	114.6	A240 S281 P327	A240-G284 WeakPolarHBondContact CB-O 3.44Å; S281-G284 PolarHBondContact OG-N 2.9Å; G284-P327 WeakPolarHBondContact O-CG 3.46Å
285	T	74	Confident	78.1	Confident	14 Å²	14	35.5 Å²	35.5	9%	0.086	18%	0.183	C	C	.	.			trans	-134.3	146.2	171	44.6	0	0	0	0	109.7	H241 L278 D287 P327	H241-T285 PolarHBondContact NE2-O 2.79Å; L278-T285 HydrophobicContact CD1-CG2 4.37Å; L278-T285 HydrophobicContact CD2-CG2 3.55Å; T285-D287 WeakPolarHBondContact CB-OD2 3.35Å; T285-D287 PolarHBondContact O-N 3.2Å; T285-D287 PolarHBondContact OG1-OD2 2.8Å; T285-P327 HydrophobicContact CG2-CG 4.08Å
286	P	85.8	Confident	77.8	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.222	C	C	.	.			trans	-83.9	24.5	-177.8	35.6	-36.9	0	0	0	113.3	Y246 Y288 I289 F294 T330	Y246-P286 WeakPolarHBondContact OH-CG 3.41Å; P286-Y288 PolarHBondContact O-N 3.26Å; P286-Y288 VanDerWaalsContact O-N 3.13Å; P286-I289 HydrophobicContact CB-CB 4.41Å; P286-I289 HydrophobicContact CB-CD1 4.2Å; P286-I289 PolarHBondContact O-N 3.02Å; P286-F294 HydrophobicContact CB-CE2 4.18Å; P286-F294 HydrophobicContact CB-CZ 3.54Å; P286-T330 HydrophobicContact CG-CG2 3.72Å
287	D	90.8	Very high	77.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-33.5	-168.6	-62.1	-69.1	0	0	0	114	W271 T285 V310 P320 C323 T330	W271-D287 HydrophobicContact CH2-CB 4.36Å; W271-D287 WeakPolarHBondContact CH2-OD2 3.2Å; T285-D287 WeakPolarHBondContact CB-OD2 3.35Å; T285-D287 PolarHBondContact O-N 3.2Å; T285-D287 PolarHBondContact OG1-OD2 2.8Å; D287-V310 VanDerWaalsContact O-CG1 3.29Å; D287-V310 WeakPolarHBondContact O-CG1 3.31Å; D287-P320 HydrophobicContact CB-CB 4.23Å; D287-P320 HydrophobicContact CB-CG 3.92Å; D287-C323 VanDerWaalsContact OD1-CA 3.3Å; D287-C323 WeakPolarHBondContact OD1-CA 3.22Å; D287-T330 HydrophobicContact CB-CG2 4.43Å; D287-T330 WeakPolarHBondContact OD1-CG2 3.37Å
288	Y	93.4	Very high	77.8	Confident	12 Å²	12	41.6 Å²	41.6	5%	0.047	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-0.3	-178	-51.4	-87.6	0	0	0	113.3	I213 K214 P215 W271 R275 P286 S307 V310 I311 E314 P320	I213-Y288 WeakPolarHBondContact O-CB 3.15Å; K214-Y288 HydrophobicContact CB-CD1 4.3Å; K214-Y288 HydrophobicContact CB-CD2 3.79Å; K214-Y288 HydrophobicContact CB-CE2 4.15Å; K214-Y288 HydrophobicContact CB-CG 3.91Å; P215-Y288 HydrophobicContact CG-CE1 4.24Å; W271-Y288 WeakPolarHBondContact CZ2-OH 3.48Å; R275-Y288 PolarHBondContact NH1-OH 3.4Å; R275-Y288 PolarHBondContact NH2-OH 2.83Å; P286-Y288 PolarHBondContact O-N 3.26Å; P286-Y288 VanDerWaalsContact O-N 3.13Å; Y288-S307 WeakPolarHBondContact O-CA 3.04Å; Y288-S307 WeakPolarHBondContact O-CB 3.43Å; Y288-S307 PolarHBondContact O-OG 2.99Å; Y288-V310 HydrophobicContact CD1-CB 3.93Å; Y288-V310 HydrophobicContact CD1-CG1 3.36Å; Y288-V310 HydrophobicContact CE1-CB 4.49Å; Y288-V310 HydrophobicContact CE1-CG1 3.62Å; Y288-V310 HydrophobicContact CG-CG1 4.1Å; Y288-I311 HydrophobicContact CD1-CG1 3.89Å; Y288-I311 HydrophobicContact CE1-CG1 3.96Å; Y288-E314 WeakPolarHBondContact CE1-OE2 3.15Å; Y288-E314 VanDerWaalsContact OH-CD 3.29Å; Y288-E314 PolarHBondContact OH-OE1 3.3Å; Y288-E314 PolarHBondContact OH-OE2 2.73Å; Y288-P320 HydrophobicContact CE1-CB 4.4Å
289	I	90.9	Very high	78.4	Confident	15 Å²	15	42.8 Å²	42.8	8%	0.077	23%	0.234	C	C	.	.			trans	-85.6	130.4	-173.9	-60.9	-177.4	0	0	0	109.5	H241 P286 V293 F294 W306 V334	H241-I289 HydrophobicContact CB-CD1 3.56Å; H241-I289 WeakPolarHBondContact CD2-CD1 3.47Å; H241-I289 VanDerWaalsContact CG-CD1 3.41Å; P286-I289 HydrophobicContact CB-CB 4.41Å; P286-I289 HydrophobicContact CB-CD1 4.2Å; P286-I289 PolarHBondContact O-N 3.02Å; I289-V293 HydrophobicContact CG2-CB 3.62Å; I289-V293 HydrophobicContact CG2-CG1 3.77Å; I289-V293 HydrophobicContact CG2-CG2 4.08Å; I289-F294 HydrophobicContact CB-CE2 3.85Å; I289-F294 HydrophobicContact CB-CZ 3.79Å; I289-F294 HydrophobicContact CD1-CZ 4.01Å; I289-F294 HydrophobicContact CG1-CZ 4.48Å; I289-F294 HydrophobicContact CG2-CD2 4.18Å; I289-F294 HydrophobicContact CG2-CE1 4.24Å; I289-F294 HydrophobicContact CG2-CE2 3.42Å; I289-F294 VanDerWaalsContact CG2-CE2 3.42Å; I289-F294 HydrophobicContact CG2-CZ 3.44Å; I289-F294 VanDerWaalsContact CG2-CZ 3.44Å; I289-W306 PolarHBondContact O-NE1 2.93Å; I289-V334 WeakPolarHBondContact O-CG1 3.49Å
290	A	92.4	Very high	79.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.008	24%	0.239	C	C	.	.			trans	-67.3	145.3	176.9	0	0	0	0	0	111.7	E292 V293 C303 W306	A290-E292 VanDerWaalsContact C-N 3.27Å; A290-E292 VanDerWaalsContact CB-CD 3.42Å; A290-E292 HydrophobicContact CB-CG 4.47Å; A290-E292 WeakPolarHBondContact CB-OE1 3.43Å; A290-E292 WeakPolarHBondContact CB-OE2 3.39Å; A290-E292 PolarHBondContact O-N 3.01Å; A290-V293 HydrophobicContact CB-CG2 4.18Å; A290-V293 WeakPolarHBondContact O-CB 3.3Å; A290-V293 PolarHBondContact O-N 2.86Å; A290-V293 VanDerWaalsContact O-N 3.11Å; A290-C303 HydrophobicContact CB-CB 3.91Å; A290-W306 VanDerWaalsContact CA-CD1 3.45Å; A290-W306 HydrophobicContact CB-CB 3.65Å; A290-W306 HydrophobicContact CB-CD2 4.14Å; A290-W306 HydrophobicContact CB-CG 3.59Å
291	P	93.1	Very high	80.7	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.039	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-59.1	-36.6	-174.7	23	-33.6	0	0	0	112.9	V293 F294 M295 W306 V334	P291-V293 PolarHBondContact O-N 3.47Å; P291-F294 PolarHBondContact O-N 3.45Å; P291-M295 HydrophobicContact CB-CE 4.47Å; P291-W306 HydrophobicContact CG-CE3 4.4Å; P291-W306 HydrophobicContact CG-CH2 4Å; P291-W306 HydrophobicContact CG-CZ2 4.38Å; P291-W306 HydrophobicContact CG-CZ3 4Å; P291-V334 HydrophobicContact CB-CG1 4.2Å
292	E	90.8	Very high	82	Confident	8 Å²	8	43.3 Å²	43.3	4%	0.037	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-64.4	-24.8	179.6	67.1	-85.7	-169.4	0	0	113.6	A290 F294 M295 R367	A290-E292 VanDerWaalsContact C-N 3.27Å; A290-E292 VanDerWaalsContact CB-CD 3.42Å; A290-E292 HydrophobicContact CB-CG 4.47Å; A290-E292 WeakPolarHBondContact CB-OE1 3.43Å; A290-E292 WeakPolarHBondContact CB-OE2 3.39Å; A290-E292 PolarHBondContact O-N 3.01Å; E292-F294 PolarHBondContact O-N 3.22Å; E292-M295 WeakPolarHBondContact O-CB 3.25Å; E292-M295 PolarHBondContact O-N 3.28Å; E292-R367 IonicContact OE1-CZ 2.86Å; E292-R367 IonicContact OE1-NH1 3.96Å; E292-R367 PolarHBondContact OE1-NH1 3.06Å; E292-R367 IonicContact OE1-NH2 3.54Å; E292-R367 PolarHBondContact OE1-NH2 3.33Å; E292-R367 VanDerWaalsContact OE1-NH2 3.13Å; E292-R367 IonicContact OE2-CZ 3.66Å; E292-R367 IonicContact OE2-NH1 3.81Å; E292-R367 IonicContact OE2-NH2 3.04Å; E292-R367 PolarHBondContact OE2-NH2 3.29Å
293	V	87.4	Confident	83.9	Confident	31 Å²	31	39.9 Å²	39.9	19%	0.188	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-64	-27	178.1	177	0	0	0	0	111.4	I289 A290 P291 Y299 C303	I289-V293 HydrophobicContact CG2-CB 3.62Å; I289-V293 HydrophobicContact CG2-CG1 3.77Å; I289-V293 HydrophobicContact CG2-CG2 4.08Å; A290-V293 HydrophobicContact CB-CG2 4.18Å; A290-V293 WeakPolarHBondContact O-CB 3.3Å; A290-V293 PolarHBondContact O-N 2.86Å; A290-V293 VanDerWaalsContact O-N 3.11Å; P291-V293 PolarHBondContact O-N 3.47Å; V293-Y299 HydrophobicContact CG1-CE1 4.48Å; V293-Y299 HydrophobicContact CG2-CD1 4.39Å; V293-Y299 HydrophobicContact CG2-CD2 4.33Å; V293-Y299 HydrophobicContact CG2-CG 4.1Å; V293-C303 HydrophobicContact CG2-CB 3.85Å
294	F	83.6	Confident	85.6	Confident	7 Å²	7	37.5 Å²	37.5	3%	0.031	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-89.4	-9.4	175.1	-60.1	-64.9	0	0	0	113.2	T243 Y246 P286 I289 P291 E292 Y331 V334 M335	T243-F294 WeakPolarHBondContact CG2-O 3.28Å; Y246-F294 HydrophobicContact CD2-CD1 4.1Å; Y246-F294 HydrophobicContact CD2-CE1 4.08Å; Y246-F294 HydrophobicContact CE2-CD1 4.18Å; Y246-F294 AromaticContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CE1 3.68Å; Y246-F294 HydrophobicContact CE2-CZ 4.32Å; P286-F294 HydrophobicContact CB-CE2 4.18Å; P286-F294 HydrophobicContact CB-CZ 3.54Å; I289-F294 HydrophobicContact CB-CE2 3.85Å; I289-F294 HydrophobicContact CB-CZ 3.79Å; I289-F294 HydrophobicContact CD1-CZ 4.01Å; I289-F294 HydrophobicContact CG1-CZ 4.48Å; I289-F294 HydrophobicContact CG2-CD2 4.18Å; I289-F294 HydrophobicContact CG2-CE1 4.24Å; I289-F294 HydrophobicContact CG2-CE2 3.42Å; I289-F294 VanDerWaalsContact CG2-CE2 3.42Å; I289-F294 HydrophobicContact CG2-CZ 3.44Å; I289-F294 VanDerWaalsContact CG2-CZ 3.44Å; P291-F294 PolarHBondContact O-N 3.45Å; E292-F294 PolarHBondContact O-N 3.22Å; F294-Y331 HydrophobicContact CB-CE2 3.97Å; F294-Y331 HydrophobicContact CD1-CD2 4.34Å; F294-Y331 HydrophobicContact CD1-CE2 4.11Å; F294-Y331 HydrophobicContact CD2-CD2 4.13Å; F294-Y331 HydrophobicContact CD2-CE2 4.06Å; F294-Y331 HydrophobicContact CE1-CD2 4.48Å; F294-Y331 HydrophobicContact CE2-CD2 4.26Å; F294-Y331 HydrophobicContact CG-CD2 4.17Å; F294-Y331 AromaticContact CG-CE2 3.78Å; F294-Y331 HydrophobicContact CG-CE2 3.78Å; F294-Y331 HydrophobicContact CZ-CD2 4.45Å; F294-V334 HydrophobicContact CE2-CG1 4.46Å; F294-M335 HydrophobicContact CB-CE 3.24Å; F294-M335 HydrophobicContact CD2-CE 3.86Å; F294-M335 HydrophobicContact CG-CE 3.91Å
295	M	81.6	Confident	86.9	Confident	93 Å²	93	37.7 Å²	37.7	46%	0.458	20%	0.195	S	C	.	.	S	Bend	trans	-83	154.1	179.7	-62.2	-175.6	-179.8	0	0	110.9	P291 E292 N297 M335	P291-M295 HydrophobicContact CB-CE 4.47Å; E292-M295 WeakPolarHBondContact O-CB 3.25Å; E292-M295 PolarHBondContact O-N 3.28Å; M295-N297 PolarHBondContact O-N 3.4Å; M295-M335 HydrophobicContact CE-SD 4.42Å
296	Q	71.6	Confident	88	Confident	185 Å²	185	37 Å²	37	86%	0.864	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-6	-179.9	-67.1	-174.6	-6.9	0	0	113.6	G298	Q296-G298 PolarHBondContact O-N 3.11Å
297	N	73.3	Confident	88.5	Confident	156 Å²	156	37.3 Å²	37.3	83%	0.834	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	2.4	-172.8	-62.5	-5.4	0	0	0	113.4	M295	M295-N297 PolarHBondContact O-N 3.4Å
298	G	72.3	Confident	88.9	Confident	39 Å²	39	37.3 Å²	37.3	40%	0.402	19%	0.193	S	C	.	.			trans	81.5	177.3	-170.7	0	0	0	0	0	111.9	Q296	Q296-G298 PolarHBondContact O-N 3.11Å
299	Y	83.2	Confident	89.1	Confident	60 Å²	60	36.7 Å²	36.7	24%	0.235	19%	0.191	C	C	.	.			trans	-148.9	161.5	176.6	61.6	-88.8	0	0	0	108.8	R211 T235 V293 C303	R211-Y299 WeakPolarHBondContact CD-OH 3.39Å; R211-Y299 HydrophobicContact CG-CE2 4.08Å; R211-Y299 PolarHBondContact NE-OH 3.2Å; R211-Y299 VanDerWaalsContact NE-OH 3.1Å; R211-Y299 PolarHBondContact NH1-OH 3.28Å; R211-Y299 PolarHBondContact NH2-OH 2.99Å; T235-Y299 WeakPolarHBondContact CG2-OH 3.47Å; V293-Y299 HydrophobicContact CG1-CE1 4.48Å; V293-Y299 HydrophobicContact CG2-CD1 4.39Å; V293-Y299 HydrophobicContact CG2-CD2 4.33Å; V293-Y299 HydrophobicContact CG2-CG 4.1Å; Y299-C303 HydrophobicContact CD2-CB 4.49Å
300	N	88.6	Confident	89.5	Confident	61 Å²	61	36 Å²	36	33%	0.326	19%	0.187	S	C	.	.			trans	-120.3	-167	179.1	71.7	27.9	0	0	0	112	L302 C303 E364	N300-L302 PolarHBondContact O-N 3.25Å; N300-L302 WeakPolarHBondContact OD1-CA 3.22Å; N300-L302 WeakPolarHBondContact OD1-CB 3.34Å; N300-L302 WeakPolarHBondContact OD1-CG 3.26Å; N300-L302 PolarHBondContact OD1-N 3.46Å; N300-C303 PolarHBondContact O-N 2.74Å; N300-C303 PolarHBondContact O-SG 2.74Å; N300-E364 PolarHBondContact N-OE1 3.44Å; N300-E364 PolarHBondContact ND2-OE1 3.15Å; N300-E364 PolarHBondContact OD1-OE1 3.1Å
301	K	90.3	Very high	89.8	Confident	87 Å²	87	36 Å²	36	38%	0.378	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.7	-178.4	70.1	179.2	-176.4	168.7	0	114.6	H204 I209 C303 D304	H204-K301 HydrophobicContact CB-CD 4.19Å; H204-K301 PolarHBondContact CE1-O 3.38Å; I209-K301 HydrophobicContact CD1-CB 4.08Å; I209-K301 HydrophobicContact CG1-CB 3.87Å; K301-C303 PolarHBondContact O-N 2.77Å; K301-D304 PolarHBondContact O-N 3.49Å
302	L	94.7	Very high	90.1	Very high	9 Å²	9	35.7 Å²	35.7	5%	0.047	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-14.4	-178.2	-54.2	177.6	0	0	0	112.8	N300 D304 W305 W306 E364 R367 G369 A370	N300-L302 PolarHBondContact O-N 3.25Å; N300-L302 WeakPolarHBondContact OD1-CA 3.22Å; N300-L302 WeakPolarHBondContact OD1-CB 3.34Å; N300-L302 WeakPolarHBondContact OD1-CG 3.26Å; N300-L302 PolarHBondContact OD1-N 3.46Å; L302-D304 PolarHBondContact O-N 3.22Å; L302-W305 WeakPolarHBondContact O-CB 3.24Å; L302-W305 PolarHBondContact O-N 3.32Å; L302-W305 VanDerWaalsContact O-N 3.08Å; L302-W306 PolarHBondContact O-N 3.32Å; L302-E364 HydrophobicContact CD1-CG 4.2Å; L302-R367 VanDerWaalsContact C-NH1 3.33Å; L302-R367 WeakPolarHBondContact O-CD 3.36Å; L302-R367 PolarHBondContact O-NH1 3.04Å; L302-G369 VanDerWaalsContact CD2-O 3.3Å; L302-G369 WeakPolarHBondContact CD2-O 3.16Å; L302-A370 HydrophobicContact CD1-CB 3.77Å
303	C	93.5	Very high	90.4	Very high	3 Å²	3	35.5 Å²	35.5	2%	0.02	18%	0.184	C	C	.	.	H	α-helix	trans	-59.6	-32	173.5	67.9	0	0	0	0	112.3	A290 V293 Y299 N300 K301 W305 W306 S307	A290-C303 HydrophobicContact CB-CB 3.91Å; V293-C303 HydrophobicContact CG2-CB 3.85Å; Y299-C303 HydrophobicContact CD2-CB 4.49Å; N300-C303 PolarHBondContact O-N 2.74Å; N300-C303 PolarHBondContact O-SG 2.74Å; K301-C303 PolarHBondContact O-N 2.77Å; C303-W305 VanDerWaalsContact C-N 3.29Å; C303-W305 PolarHBondContact O-N 3.22Å; C303-W306 WeakPolarHBondContact O-CB 3.32Å; C303-W306 PolarHBondContact O-N 3.38Å; C303-S307 PolarHBondContact O-N 2.85Å; C303-S307 PolarHBondContact O-OG 3.21Å
304	D	94.9	Very high	90.9	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-66.8	-31.3	176.2	-68.4	-25	0	0	0	111.8	I200 H204 I209 H210 R211 I213 K301 L302 S307 L308	I200-D304 HydrophobicContact CG2-CB 3.9Å; H204-D304 IonicContact CD2-OD2 3.73Å; H204-D304 IonicContact CE1-OD2 3.67Å; H204-D304 IonicContact NE2-OD2 2.82Å; H204-D304 PolarHBondContact NE2-OD2 2.76Å; I209-D304 WeakPolarHBondContact CG2-OD2 3.44Å; H210-D304 PolarHBondContact N-OD2 3.15Å; R211-D304 WeakPolarHBondContact CA-OD1 3.49Å; R211-D304 PolarHBondContact N-OD1 3.48Å; I213-D304 HydrophobicContact CG1-CB 4.08Å; K301-D304 PolarHBondContact O-N 3.49Å; L302-D304 PolarHBondContact O-N 3.22Å; D304-S307 WeakPolarHBondContact O-CB 3.01Å; D304-S307 PolarHBondContact O-N 3.29Å; D304-L308 PolarHBondContact O-N 3.25Å
305	W	97.9	Very high	91.6	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.015	18%	0.175	C	C	.	.	H	α-helix	trans	-71.7	-33.6	176.5	-59.4	139.2	0	0	0	113	V197 I200 D201 L302 C303 L308 G309 F360 V373 I376	V197-W305 HydrophobicContact CB-CZ3 4.43Å; V197-W305 HydrophobicContact CG1-CH2 4.26Å; V197-W305 HydrophobicContact CG1-CZ3 4.39Å; V197-W305 HydrophobicContact CG2-CZ3 4.3Å; I200-W305 HydrophobicContact CB-CE3 4.46Å; I200-W305 HydrophobicContact CB-CH2 3.63Å; I200-W305 HydrophobicContact CB-CZ3 3.59Å; I200-W305 HydrophobicContact CD1-CE3 4.2Å; I200-W305 HydrophobicContact CD1-CZ3 3.89Å; I200-W305 HydrophobicContact CG1-CZ3 4.33Å; I200-W305 HydrophobicContact CG2-CD2 4.43Å; I200-W305 HydrophobicContact CG2-CE3 4.03Å; I200-W305 HydrophobicContact CG2-CH2 3.42Å; I200-W305 VanDerWaalsContact CG2-CH2 3.42Å; I200-W305 HydrophobicContact CG2-CZ2 3.87Å; I200-W305 HydrophobicContact CG2-CZ3 3.51Å; D201-W305 HydrophobicContact CB-CH2 4.36Å; L302-W305 WeakPolarHBondContact O-CB 3.24Å; L302-W305 PolarHBondContact O-N 3.32Å; L302-W305 VanDerWaalsContact O-N 3.08Å; C303-W305 VanDerWaalsContact C-N 3.29Å; C303-W305 PolarHBondContact O-N 3.22Å; W305-L308 HydrophobicContact CE3-CD2 3.92Å; W305-L308 HydrophobicContact CZ3-CD2 3.97Å; W305-L308 PolarHBondContact O-N 3.21Å; W305-G309 PolarHBondContact O-N 3.35Å; W305-G309 VanDerWaalsContact O-N 3.08Å; W305-F360 HydrophobicContact CB-CD1 4.06Å; W305-F360 HydrophobicContact CB-CE1 4.33Å; W305-F360 WeakPolarHBondContact O-CD1 3.23Å; W305-V373 HydrophobicContact CH2-CG2 4.35Å; W305-V373 HydrophobicContact CZ2-CG2 4.35Å; W305-I376 HydrophobicContact CD2-CD1 3.63Å; W305-I376 HydrophobicContact CE3-CD1 3.88Å; W305-I376 HydrophobicContact CG-CD1 4.12Å; W305-I376 HydrophobicContact CH2-CD1 4.13Å; W305-I376 HydrophobicContact CZ2-CD1 3.89Å; W305-I376 HydrophobicContact CZ3-CD1 4.13Å
306	W	97.9	Very high	92.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.3	-49.1	169.9	173.4	-79.3	0	0	0	110.8	I289 A290 P291 L302 C303 L308 G309 V310 F322 V334 W337 C361 C362	I289-W306 PolarHBondContact O-NE1 2.93Å; A290-W306 VanDerWaalsContact CA-CD1 3.45Å; A290-W306 HydrophobicContact CB-CB 3.65Å; A290-W306 HydrophobicContact CB-CD2 4.14Å; A290-W306 HydrophobicContact CB-CG 3.59Å; P291-W306 HydrophobicContact CG-CE3 4.4Å; P291-W306 HydrophobicContact CG-CH2 4Å; P291-W306 HydrophobicContact CG-CZ2 4.38Å; P291-W306 HydrophobicContact CG-CZ3 4Å; L302-W306 PolarHBondContact O-N 3.32Å; C303-W306 WeakPolarHBondContact O-CB 3.32Å; C303-W306 PolarHBondContact O-N 3.38Å; W306-L308 PolarHBondContact O-N 3.17Å; W306-G309 WeakPolarHBondContact O-CA 3.48Å; W306-G309 PolarHBondContact O-N 2.78Å; W306-V310 WeakPolarHBondContact O-CG2 3.5Å; W306-V310 PolarHBondContact O-N 3.28Å; W306-F322 HydrophobicContact CH2-CE2 4.41Å; W306-F322 HydrophobicContact CH2-CZ 4.2Å; W306-F322 AromaticContact CZ2-CE2 3.49Å; W306-F322 HydrophobicContact CZ2-CE2 3.49Å; W306-F322 VanDerWaalsContact CZ2-CE2 3.49Å; W306-F322 AromaticContact CZ2-CZ 3.71Å; W306-F322 HydrophobicContact CZ2-CZ 3.71Å; W306-V334 HydrophobicContact CZ2-CG1 4.5Å; W306-W337 HydrophobicContact CH2-CB 3.72Å; W306-W337 AromaticContact CH2-CD1 3.77Å; W306-W337 HydrophobicContact CH2-CD2 4.03Å; W306-W337 AromaticContact CH2-CG 3.57Å; W306-W337 HydrophobicContact CH2-CG 3.57Å; W306-W337 HydrophobicContact CZ2-CB 4.34Å; W306-W337 HydrophobicContact CZ3-CD2 4.33Å; W306-W337 HydrophobicContact CZ3-CG 4.27Å; W306-C361 HydrophobicContact CD2-CB 4.45Å; W306-C361 VanDerWaalsContact CE3-CA 3.46Å; W306-C361 HydrophobicContact CE3-CB 4.15Å; W306-C361 HydrophobicContact CH2-CB 4.21Å; W306-C361 HydrophobicContact CZ3-CB 4.03Å; W306-C362 WeakPolarHBondContact CZ3-O 3.36Å
307	S	97.2	Very high	93.6	Very high	6 Å²	6	21.8 Å²	21.8	4%	0.042	12%	0.117	C	C	.	.	H	α-helix	trans	-56.8	-39.6	177.8	-55.9	0	0	0	0	111.6	I213 Y288 C303 D304 V310 I311	I213-S307 WeakPolarHBondContact O-CB 3.47Å; Y288-S307 WeakPolarHBondContact O-CA 3.04Å; Y288-S307 WeakPolarHBondContact O-CB 3.43Å; Y288-S307 PolarHBondContact O-OG 2.99Å; C303-S307 PolarHBondContact O-N 2.85Å; C303-S307 PolarHBondContact O-OG 3.21Å; D304-S307 WeakPolarHBondContact O-CB 3.01Å; D304-S307 PolarHBondContact O-N 3.29Å; S307-V310 WeakPolarHBondContact O-CB 3.3Å; S307-V310 PolarHBondContact O-N 3.31Å; S307-I311 WeakPolarHBondContact O-CG1 3.31Å; S307-I311 PolarHBondContact O-N 2.74Å
308	L	98.4	Very high	94.6	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-63.5	-39.4	175.1	-172.9	59.7	0	0	0	112.8	I193 T196 V197 I200 D304 W305 W306 I311 M312 F360	I193-L308 HydrophobicContact CD1-CD1 3.59Å; I193-L308 HydrophobicContact CD1-CG 4.25Å; I193-L308 HydrophobicContact CG2-CD1 4.4Å; I193-L308 HydrophobicContact CG2-CD2 4.22Å; I193-L308 HydrophobicContact CG2-CG 4.29Å; T196-L308 HydrophobicContact CG2-CD1 3.57Å; V197-L308 HydrophobicContact CG2-CD2 3.58Å; I200-L308 HydrophobicContact CD1-CB 4.38Å; I200-L308 HydrophobicContact CD1-CD2 4.3Å; D304-L308 PolarHBondContact O-N 3.25Å; W305-L308 HydrophobicContact CE3-CD2 3.92Å; W305-L308 HydrophobicContact CZ3-CD2 3.97Å; W305-L308 PolarHBondContact O-N 3.21Å; W306-L308 PolarHBondContact O-N 3.17Å; L308-I311 PolarHBondContact O-N 3.5Å; L308-M312 PolarHBondContact O-N 3.38Å; L308-F360 HydrophobicContact CD2-CE1 4.4Å; L308-F360 HydrophobicContact CD2-CZ 4Å; L308-F360 HydrophobicContact CG-CZ 4.43Å
309	G	98.6	Very high	95.6	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62.4	-40.4	172.9	0	0	0	0	0	113.2	W305 W306 M312 Y313	W305-G309 PolarHBondContact O-N 3.35Å; W305-G309 VanDerWaalsContact O-N 3.08Å; W306-G309 WeakPolarHBondContact O-CA 3.48Å; W306-G309 PolarHBondContact O-N 2.78Å; G309-M312 PolarHBondContact O-N 2.91Å; G309-Y313 PolarHBondContact O-N 3.23Å
310	V	98.5	Very high	96.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-62.3	-42.9	173.9	176.5	0	0	0	0	110.8	D287 Y288 W306 S307 Y313 E314 P320 P321 F322	D287-V310 VanDerWaalsContact O-CG1 3.29Å; D287-V310 WeakPolarHBondContact O-CG1 3.31Å; Y288-V310 HydrophobicContact CD1-CB 3.93Å; Y288-V310 HydrophobicContact CD1-CG1 3.36Å; Y288-V310 HydrophobicContact CE1-CB 4.49Å; Y288-V310 HydrophobicContact CE1-CG1 3.62Å; Y288-V310 HydrophobicContact CG-CG1 4.1Å; W306-V310 WeakPolarHBondContact O-CG2 3.5Å; W306-V310 PolarHBondContact O-N 3.28Å; S307-V310 WeakPolarHBondContact O-CB 3.3Å; S307-V310 PolarHBondContact O-N 3.31Å; V310-Y313 PolarHBondContact O-N 2.63Å; V310-E314 PolarHBondContact O-N 2.96Å; V310-P320 HydrophobicContact CG1-CB 3.61Å; V310-P321 HydrophobicContact CG1-CG 4.43Å; V310-P321 HydrophobicContact CG2-CG 4.42Å; V310-F322 HydrophobicContact CG2-CE2 4.19Å
311	I	98.3	Very high	96.6	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.2	-44.4	175.4	-67.1	172.7	0	0	0	110.9	I193 I213 P215 L218 Y288 S307 L308 Y313 E314 M315	I193-I311 HydrophobicContact CD1-CG2 4.34Å; I213-I311 HydrophobicContact CG2-CD1 3.6Å; P215-I311 HydrophobicContact CG-CG1 4.15Å; P215-I311 HydrophobicContact CG-CG2 4.48Å; L218-I311 HydrophobicContact CD1-CD1 4Å; L218-I311 HydrophobicContact CD1-CG2 4.49Å; Y288-I311 HydrophobicContact CD1-CG1 3.89Å; Y288-I311 HydrophobicContact CE1-CG1 3.96Å; S307-I311 WeakPolarHBondContact O-CG1 3.31Å; S307-I311 PolarHBondContact O-N 2.74Å; L308-I311 PolarHBondContact O-N 3.5Å; I311-Y313 VanDerWaalsContact C-N 3.31Å; I311-Y313 PolarHBondContact O-N 2.63Å; I311-E314 PolarHBondContact O-N 3.42Å; I311-E314 VanDerWaalsContact O-N 3.12Å; I311-M315 HydrophobicContact CG2-CE 3.68Å; I311-M315 HydrophobicContact CG2-CG 4.29Å; I311-M315 HydrophobicContact CG2-SD 4.11Å; I311-M315 WeakPolarHBondContact O-CG 3.35Å; I311-M315 PolarHBondContact O-N 2.68Å
312	M	98.7	Very high	96.9	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-59.6	-42.6	177.7	-177.1	176.9	170.8	0	0	111.6	T189 I193 L308 G309 M315 L316 A353 L356 I357 F360 F381	T189-M312 HydrophobicContact CG2-CG 3.94Å; I193-M312 HydrophobicContact CD1-CB 3.74Å; I193-M312 HydrophobicContact CD1-CG 4.35Å; I193-M312 HydrophobicContact CG1-CB 4.06Å; I193-M312 HydrophobicContact CG1-CG 4.11Å; L308-M312 PolarHBondContact O-N 3.38Å; G309-M312 PolarHBondContact O-N 2.91Å; M312-M315 PolarHBondContact O-N 3.18Å; M312-L316 HydrophobicContact CE-CD1 4.1Å; M312-L316 HydrophobicContact CG-CD1 4.31Å; M312-L316 WeakPolarHBondContact O-CG 3.41Å; M312-L316 PolarHBondContact O-N 3.46Å; M312-A353 HydrophobicContact CE-CB 3.91Å; M312-L356 HydrophobicContact CE-CB 4.2Å; M312-L356 HydrophobicContact CE-CD2 3.92Å; M312-L356 HydrophobicContact CE-CG 4.3Å; M312-L356 HydrophobicContact SD-CB 4.32Å; M312-L356 HydrophobicContact SD-CD2 3.65Å; M312-L356 HydrophobicContact SD-CG 3.87Å; M312-I357 HydrophobicContact CB-CG1 4.17Å; M312-I357 HydrophobicContact CE-CD1 4.42Å; M312-I357 HydrophobicContact CE-CG1 4.09Å; M312-I357 HydrophobicContact CG-CD1 4.14Å; M312-I357 HydrophobicContact CG-CG1 3.81Å; M312-I357 HydrophobicContact SD-CG1 3.78Å; M312-F360 HydrophobicContact SD-CE2 4.42Å; M312-F381 HydrophobicContact CE-CD1 3.86Å; M312-F381 HydrophobicContact CE-CD2 4.01Å; M312-F381 HydrophobicContact CE-CE1 3.54Å; M312-F381 HydrophobicContact CE-CE2 3.75Å; M312-F381 HydrophobicContact CE-CG 4.07Å; M312-F381 HydrophobicContact CE-CZ 3.5Å; M312-F381 HydrophobicContact SD-CE1 4.37Å
313	Y	98.6	Very high	96.7	Very high	5 Å²	5	3.6 Å²	3.6	2%	0.02	2%	0.02	C	C	.	.	H	α-helix	trans	-61.5	-46.2	173.1	-174.5	-71.7	0	0	0	111	G309 V310 I311 M315 L316 I317 Y319 P321 L341 T342 F343 I357	G309-Y313 PolarHBondContact O-N 3.23Å; V310-Y313 PolarHBondContact O-N 2.63Å; I311-Y313 VanDerWaalsContact C-N 3.31Å; I311-Y313 PolarHBondContact O-N 2.63Å; Y313-M315 VanDerWaalsContact C-N 3.34Å; Y313-M315 PolarHBondContact O-N 3Å; Y313-L316 PolarHBondContact O-N 3.32Å; Y313-I317 HydrophobicContact CD1-CB 3.8Å; Y313-I317 HydrophobicContact CD1-CG1 3.71Å; Y313-I317 HydrophobicContact CD1-CG2 4.38Å; Y313-I317 HydrophobicContact CD2-CG1 4.17Å; Y313-I317 HydrophobicContact CE1-CB 3.54Å; Y313-I317 HydrophobicContact CE1-CG1 3.57Å; Y313-I317 HydrophobicContact CE1-CG2 3.62Å; Y313-I317 HydrophobicContact CE2-CG1 4.06Å; Y313-I317 HydrophobicContact CG-CG1 4.02Å; Y313-I317 VanDerWaalsContact O-CB 3.26Å; Y313-I317 WeakPolarHBondContact O-CB 3.1Å; Y313-I317 VanDerWaalsContact O-CG1 3.3Å; Y313-I317 WeakPolarHBondContact O-CG1 3.48Å; Y313-I317 PolarHBondContact O-N 2.94Å; Y313-Y319 WeakPolarHBondContact CD1-O 3.48Å; Y313-Y319 HydrophobicContact CE1-CD2 4.36Å; Y313-Y319 HydrophobicContact CE1-CE2 4.14Å; Y313-Y319 WeakPolarHBondContact CE1-O 3.47Å; Y313-P321 HydrophobicContact CD1-CB 4.07Å; Y313-P321 HydrophobicContact CD1-CG 4.28Å; Y313-P321 HydrophobicContact CD2-CB 4.08Å; Y313-P321 HydrophobicContact CD2-CG 4.42Å; Y313-P321 HydrophobicContact CE1-CB 4.03Å; Y313-P321 HydrophobicContact CE2-CB 4.02Å; Y313-P321 HydrophobicContact CG-CB 4.11Å; Y313-P321 HydrophobicContact CG-CG 4.13Å; Y313-L341 HydrophobicContact CD2-CD1 4.27Å; Y313-L341 HydrophobicContact CE2-CD1 4.28Å; Y313-T342 WeakPolarHBondContact CE2-O 3.43Å; Y313-T342 PolarHBondContact OH-O 3.33Å; Y313-F343 HydrophobicContact CD2-CD1 4.19Å; Y313-F343 AromaticContact CD2-CE1 3.82Å; Y313-F343 HydrophobicContact CD2-CE1 3.82Å; Y313-F343 AromaticContact CE2-CD1 3.79Å; Y313-F343 HydrophobicContact CE2-CD1 3.79Å; Y313-F343 AromaticContact CE2-CE1 3.86Å; Y313-F343 HydrophobicContact CE2-CE1 3.86Å; Y313-I357 HydrophobicContact CD2-CD1 4.38Å; Y313-I357 HydrophobicContact CD2-CG2 4.17Å
314	E	97.6	Very high	96.4	Very high	8 Å²	8	4.1 Å²	4.1	4%	0.037	2%	0.024	C	C	.	.	H	α-helix	trans	-62.1	-39.4	178.7	-177.1	177.3	-166.8	0	0	112.5	L178 P215 W271 R275 Y288 V310 I311 L316 G318	L178-E314 HydrophobicContact CD1-CG 4.25Å; P215-E314 WeakPolarHBondContact CG-OE2 3.49Å; W271-E314 PolarHBondContact NE1-OE1 3.45Å; R275-E314 IonicContact NE-OE1 3.77Å; R275-E314 IonicContact NH2-OE1 3.74Å; Y288-E314 WeakPolarHBondContact CE1-OE2 3.15Å; Y288-E314 VanDerWaalsContact OH-CD 3.29Å; Y288-E314 PolarHBondContact OH-OE1 3.3Å; Y288-E314 PolarHBondContact OH-OE2 2.73Å; V310-E314 PolarHBondContact O-N 2.96Å; I311-E314 PolarHBondContact O-N 3.42Å; I311-E314 VanDerWaalsContact O-N 3.12Å; E314-L316 VanDerWaalsContact C-N 3.32Å; E314-L316 PolarHBondContact O-N 3.39Å; E314-G318 WeakPolarHBondContact O-CA 3.35Å; E314-G318 PolarHBondContact O-N 3.41Å
315	M	98.1	Very high	95.9	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-58.9	-43.5	175.8	-73.4	175.7	169.2	0	0	111.6	M174 L178 T183 L184 T189 I193 I311 M312 Y313	M174-M315 HydrophobicContact CE-CE 3.83Å; M174-M315 HydrophobicContact CG-CE 3.79Å; M174-M315 HydrophobicContact SD-CE 3.66Å; L178-M315 HydrophobicContact CD1-CG 4.4Å; L178-M315 HydrophobicContact CD2-CB 4.45Å; L178-M315 HydrophobicContact CD2-CG 4.06Å; T183-M315 CarbonylContact C-O 3.48Å; T183-M315 VanDerWaalsContact CA-O 3.32Å; T183-M315 WeakPolarHBondContact CA-O 3.41Å; T183-M315 WeakPolarHBondContact CB-O 3.22Å; L184-M315 HydrophobicContact CB-CB 4.41Å; L184-M315 HydrophobicContact CD1-CB 4.23Å; L184-M315 HydrophobicContact CD1-CE 4.34Å; L184-M315 HydrophobicContact CD1-CG 3.9Å; L184-M315 HydrophobicContact CD1-SD 4.13Å; L184-M315 HydrophobicContact CG-CB 4.41Å; L184-M315 PolarHBondContact N-O 2.77Å; T189-M315 HydrophobicContact CG2-CB 4.08Å; T189-M315 HydrophobicContact CG2-SD 3.98Å; I193-M315 HydrophobicContact CD1-CE 4.47Å; I193-M315 HydrophobicContact CD1-SD 3.84Å; I193-M315 HydrophobicContact CG1-SD 4.08Å; I311-M315 HydrophobicContact CG2-CE 3.68Å; I311-M315 HydrophobicContact CG2-CG 4.29Å; I311-M315 HydrophobicContact CG2-SD 4.11Å; I311-M315 WeakPolarHBondContact O-CG 3.35Å; I311-M315 PolarHBondContact O-N 2.68Å; M312-M315 PolarHBondContact O-N 3.18Å; Y313-M315 VanDerWaalsContact C-N 3.34Å; Y313-M315 PolarHBondContact O-N 3Å
316	L	98	Very high	95.3	Very high	14 Å²	14	12.9 Å²	12.9	7%	0.073	7%	0.069	C	C	.	.	H	α-helix	trans	-86	-33.7	-174.6	-63.9	173.7	0	0	0	113.5	E186 T189 M312 Y313 E314 I349 A353 I357	E186-L316 HydrophobicContact CG-CD2 3.77Å; T189-L316 HydrophobicContact CG2-CD1 4.33Å; T189-L316 HydrophobicContact CG2-CD2 4.07Å; T189-L316 HydrophobicContact CG2-CG 4.03Å; T189-L316 WeakPolarHBondContact OG1-CD2 3.08Å; M312-L316 HydrophobicContact CE-CD1 4.1Å; M312-L316 HydrophobicContact CG-CD1 4.31Å; M312-L316 WeakPolarHBondContact O-CG 3.41Å; M312-L316 PolarHBondContact O-N 3.46Å; Y313-L316 PolarHBondContact O-N 3.32Å; E314-L316 VanDerWaalsContact C-N 3.32Å; E314-L316 PolarHBondContact O-N 3.39Å; L316-I349 HydrophobicContact CB-CD1 4.33Å; L316-I349 HydrophobicContact CD1-CD1 3.8Å; L316-I349 HydrophobicContact CD1-CG1 4.3Å; L316-A353 HydrophobicContact CD1-CB 3.81Å; L316-I357 HydrophobicContact CD1-CD1 4.24Å
317	I	96.8	Very high	94.7	Very high	6 Å²	6	14 Å²	14	3%	0.031	8%	0.076	C	C	.	.	H	α-helix	trans	-103.2	-26.9	-172.1	-51.6	-58.2	0	0	0	112.3	Y313 Y319 P344 V347 I349	Y313-I317 HydrophobicContact CD1-CB 3.8Å; Y313-I317 HydrophobicContact CD1-CG1 3.71Å; Y313-I317 HydrophobicContact CD1-CG2 4.38Å; Y313-I317 HydrophobicContact CD2-CG1 4.17Å; Y313-I317 HydrophobicContact CE1-CB 3.54Å; Y313-I317 HydrophobicContact CE1-CG1 3.57Å; Y313-I317 HydrophobicContact CE1-CG2 3.62Å; Y313-I317 HydrophobicContact CE2-CG1 4.06Å; Y313-I317 HydrophobicContact CG-CG1 4.02Å; Y313-I317 VanDerWaalsContact O-CB 3.26Å; Y313-I317 WeakPolarHBondContact O-CB 3.1Å; Y313-I317 VanDerWaalsContact O-CG1 3.3Å; Y313-I317 WeakPolarHBondContact O-CG1 3.48Å; Y313-I317 PolarHBondContact O-N 2.94Å; I317-Y319 HydrophobicContact CG2-CD1 4.35Å; I317-Y319 HydrophobicContact CG2-CE1 3.81Å; I317-Y319 HydrophobicContact CG2-CE2 4.18Å; I317-P344 HydrophobicContact CG2-CG 4.01Å; I317-V347 HydrophobicContact CD1-CB 4.26Å; I317-V347 HydrophobicContact CD1-CG1 3.63Å; I317-I349 HydrophobicContact CD1-CD1 4.27Å
318	G	94.6	Very high	94.2	Very high	4 Å²	4	16.5 Å²	16.5	4%	0.041	9%	0.087	C	C	.	.	S	Bend	trans	97.7	1.2	176.6	0	0	0	0	0	115.6	E314	E314-G318 WeakPolarHBondContact O-CA 3.35Å; E314-G318 PolarHBondContact O-N 3.41Å
319	Y	94.3	Very high	93.8	Very high	8 Å²	8	17.1 Å²	17.1	3%	0.031	9%	0.09	C	C	.	.	S	Bend	trans	-156.2	154.1	171.6	55.1	-93.5	0	0	0	109.4	S264 K267 A268 Y313 I317 C323 P344	S264-Y319 VanDerWaalsContact O-CE1 3.28Å; S264-Y319 WeakPolarHBondContact O-CE1 3.38Å; S264-Y319 WeakPolarHBondContact OG-CE1 3.32Å; S264-Y319 PolarHBondContact OG-OH 3.38Å; K267-Y319 HydrophobicContact CB-CD1 3.87Å; K267-Y319 HydrophobicContact CB-CD2 4.47Å; K267-Y319 HydrophobicContact CB-CE1 3.64Å; K267-Y319 HydrophobicContact CB-CE2 4.31Å; K267-Y319 HydrophobicContact CB-CG 4.27Å; K267-Y319 HydrophobicContact CD-CE2 4.16Å; A268-Y319 HydrophobicContact CB-CD1 3.89Å; A268-Y319 HydrophobicContact CB-CE1 4.47Å; Y313-Y319 WeakPolarHBondContact CD1-O 3.48Å; Y313-Y319 HydrophobicContact CE1-CD2 4.36Å; Y313-Y319 HydrophobicContact CE1-CE2 4.14Å; Y313-Y319 WeakPolarHBondContact CE1-O 3.47Å; I317-Y319 HydrophobicContact CG2-CD1 4.35Å; I317-Y319 HydrophobicContact CG2-CE1 3.81Å; I317-Y319 HydrophobicContact CG2-CE2 4.18Å; Y319-C323 VanDerWaalsContact CD2-SG 3.54Å; Y319-P344 WeakPolarHBondContact OH-CG 3.41Å
320	P	95.9	Very high	93.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.			trans	-72.8	149.4	178.2	29.2	-32.3	0	0	0	111	W271 D287 Y288 V310 F322 C323	W271-P320 HydrophobicContact CD2-CG 4.41Å; W271-P320 HydrophobicContact CE3-CG 4.5Å; W271-P320 HydrophobicContact CH2-CG 3.4Å; W271-P320 HydrophobicContact CZ2-CG 3.25Å; W271-P320 HydrophobicContact CZ3-CG 4.06Å; D287-P320 HydrophobicContact CB-CB 4.23Å; D287-P320 HydrophobicContact CB-CG 3.92Å; Y288-P320 HydrophobicContact CE1-CB 4.4Å; V310-P320 HydrophobicContact CG1-CB 3.61Å; P320-F322 PolarHBondContact O-N 3.12Å; P320-C323 HydrophobicContact CG-CB 4.01Å; P320-C323 PolarHBondContact O-N 3.39Å; P320-C323 VanDerWaalsContact O-N 3.13Å; P320-C323 PolarHBondContact O-SG 2.96Å
321	P	96.3	Very high	93.1	Very high	13 Å²	13	17.5 Å²	17.5	8%	0.084	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.3	-168.3	20.6	-33.5	0	0	0	114	V310 Y313 L341	V310-P321 HydrophobicContact CG1-CG 4.43Å; V310-P321 HydrophobicContact CG2-CG 4.42Å; Y313-P321 HydrophobicContact CD1-CB 4.07Å; Y313-P321 HydrophobicContact CD1-CG 4.28Å; Y313-P321 HydrophobicContact CD2-CB 4.08Å; Y313-P321 HydrophobicContact CD2-CG 4.42Å; Y313-P321 HydrophobicContact CE1-CB 4.03Å; Y313-P321 HydrophobicContact CE2-CB 4.02Å; Y313-P321 HydrophobicContact CG-CB 4.11Å; Y313-P321 HydrophobicContact CG-CG 4.13Å; P321-L341 HydrophobicContact CB-CD1 3.49Å; P321-L341 VanDerWaalsContact CB-CD1 3.49Å; P321-L341 HydrophobicContact CG-CD1 3.99Å
322	F	95.4	Very high	92.7	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.3	6.3	-173.9	-46	-62.3	0	0	0	113.9	W306 V310 P320 S324 T330 K333 V334 W337 L341	W306-F322 HydrophobicContact CH2-CE2 4.41Å; W306-F322 HydrophobicContact CH2-CZ 4.2Å; W306-F322 AromaticContact CZ2-CE2 3.49Å; W306-F322 HydrophobicContact CZ2-CE2 3.49Å; W306-F322 VanDerWaalsContact CZ2-CE2 3.49Å; W306-F322 AromaticContact CZ2-CZ 3.71Å; W306-F322 HydrophobicContact CZ2-CZ 3.71Å; V310-F322 HydrophobicContact CG2-CE2 4.19Å; P320-F322 PolarHBondContact O-N 3.12Å; F322-S324 PolarHBondContact O-N 3.12Å; F322-S324 PolarHBondContact O-OG 3.38Å; F322-T330 HydrophobicContact CB-CG2 4.23Å; F322-T330 WeakPolarHBondContact O-CA 3.5Å; F322-T330 WeakPolarHBondContact O-CG2 3.17Å; F322-T330 PolarHBondContact O-OG1 2.61Å; F322-K333 HydrophobicContact CB-CB 3.94Å; F322-K333 HydrophobicContact CD1-CB 4.06Å; F322-K333 HydrophobicContact CG-CB 4.43Å; F322-K333 WeakPolarHBondContact O-CD 3.01Å; F322-V334 HydrophobicContact CB-CG2 3.75Å; F322-V334 HydrophobicContact CD2-CG2 3.7Å; F322-V334 HydrophobicContact CE2-CG2 4.49Å; F322-V334 HydrophobicContact CG-CG2 3.75Å; F322-W337 HydrophobicContact CE1-CB 3.85Å; F322-W337 HydrophobicContact CZ-CB 3.88Å; F322-L341 HydrophobicContact CE1-CB 4.01Å; F322-L341 HydrophobicContact CE1-CD1 4.47Å; F322-L341 HydrophobicContact CZ-CB 4.25Å; F322-L341 HydrophobicContact CZ-CD1 4.25Å
323	C	90.9	Very high	92.5	Very high	4 Å²	4	20.4 Å²	20.4	3%	0.027	10%	0.103	C	C	.	.			trans	-55.4	142.6	-178.1	65.1	0	0	0	0	112.2	F259 W271 D287 Y319 P320 K333	F259-C323 WeakPolarHBondContact CE1-O 3.35Å; W271-C323 HydrophobicContact CD2-CB 4.5Å; W271-C323 HydrophobicContact CE3-CB 3.76Å; W271-C323 HydrophobicContact CZ3-CB 3.8Å; D287-C323 VanDerWaalsContact OD1-CA 3.3Å; D287-C323 WeakPolarHBondContact OD1-CA 3.22Å; Y319-C323 VanDerWaalsContact CD2-SG 3.54Å; P320-C323 HydrophobicContact CG-CB 4.01Å; P320-C323 PolarHBondContact O-N 3.39Å; P320-C323 VanDerWaalsContact O-N 3.13Å; P320-C323 PolarHBondContact O-SG 2.96Å; C323-K333 PolarHBondContact O-NZ 3.02Å
324	S	88.1	Confident	92.3	Very high	14 Å²	14	20.1 Å²	20.1	10%	0.098	10%	0.102	C	C	.	.			trans	-151.5	171	178.6	-52.9	0	0	0	0	109.5	F322 T326 T330 K333	F322-S324 PolarHBondContact O-N 3.12Å; F322-S324 PolarHBondContact O-OG 3.38Å; S324-T326 VanDerWaalsContact C-N 3.27Å; S324-T326 PolarHBondContact O-N 3.5Å; S324-T330 PolarHBondContact N-OG1 3.36Å; S324-T330 PolarHBondContact OG-N 2.89Å; S324-K333 WeakPolarHBondContact OG-CD 2.94Å; S324-K333 VanDerWaalsContact OG-CE 3.27Å; S324-K333 WeakPolarHBondContact OG-CE 3.43Å; S324-K333 PolarHBondContact OG-NZ 2.94Å
325	E	83	Confident	92.1	Very high	133 Å²	133	21 Å²	21	62%	0.621	11%	0.106	S	C	*	.	S	Bend	trans	-68.3	-27.5	176.2	-62	-167.7	164.5	0	0	113	F259	F259-E325 HydrophobicContact CD2-CG 3.93Å; F259-E325 HydrophobicContact CE2-CG 4.4Å
326	T	85.5	Confident	91.9	Very high	55 Å²	55	22.8 Å²	22.8	34%	0.337	12%	0.116	S	C	.	.	S	Bend	trans	-125.3	146	-179	71.1	0	0	0	0	112.3	S324 Q328 E329 T330	S324-T326 VanDerWaalsContact C-N 3.27Å; S324-T326 PolarHBondContact O-N 3.5Å; T326-Q328 PolarHBondContact O-N 3.01Å; T326-E329 PolarHBondContact O-N 3.32Å; T326-E329 WeakPolarHBondContact OG1-CG 3.48Å; T326-E329 PolarHBondContact OG1-N 3.13Å; T326-T330 PolarHBondContact O-N 2.86Å; T326-T330 VanDerWaalsContact O-N 3.13Å; T326-T330 PolarHBondContact O-OG1 3.14Å
327	P	86.7	Confident	91.8	Very high	23 Å²	23	23.8 Å²	23.8	15%	0.149	12%	0.118	C	C	.	.	H	α-helix	trans	-57.3	-31.5	175.5	-24.8	33.4	0	0	0	113.6	A240 F245 V283 G284 T285 T330 Y331	A240-P327 HydrophobicContact CB-CB 3.93Å; A240-P327 HydrophobicContact CB-CG 4.47Å; F245-P327 HydrophobicContact CE1-CB 4.49Å; V283-P327 HydrophobicContact CG1-CG 4.43Å; G284-P327 WeakPolarHBondContact O-CG 3.46Å; T285-P327 HydrophobicContact CG2-CG 4.08Å; P327-T330 PolarHBondContact O-N 3.49Å; P327-Y331 WeakPolarHBondContact O-CB 3.42Å; P327-Y331 PolarHBondContact O-N 3.25Å
328	Q	87	Confident	91.7	Very high	60 Å²	60	31.5 Å²	31.5	28%	0.28	15%	0.147	S	C	.	.	H	α-helix	trans	-64.9	-43.7	177.9	-70.8	83.7	-1.9	0	0	112.4	L249 T326 Y331 R332	L249-Q328 HydrophobicContact CD1-CG 4.4Å; L249-Q328 HydrophobicContact CD2-CB 3.69Å; L249-Q328 HydrophobicContact CD2-CG 3.78Å; T326-Q328 PolarHBondContact O-N 3.01Å; Q328-Y331 WeakPolarHBondContact O-CB 2.93Å; Q328-Y331 PolarHBondContact O-N 3.22Å; Q328-R332 WeakPolarHBondContact O-CG 3.2Å; Q328-R332 PolarHBondContact O-N 2.71Å; Q328-R332 VanDerWaalsContact O-N 3.07Å
329	E	89.6	Confident	91.7	Very high	13 Å²	13	37.4 Å²	37.4	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-70	-40	176	-69	-61.1	115.3	0	0	111.2	P254 S255 D256 T326 Y331 R332 K333	P254-E329 WeakPolarHBondContact CA-OE2 3.5Å; P254-E329 WeakPolarHBondContact CB-OE2 3.14Å; S255-E329 PolarHBondContact N-OE2 3.44Å; D256-E329 HydrophobicContact CB-CG 4.35Å; D256-E329 PolarHBondContact N-OE2 3.29Å; T326-E329 PolarHBondContact O-N 3.32Å; T326-E329 WeakPolarHBondContact OG1-CG 3.48Å; T326-E329 PolarHBondContact OG1-N 3.13Å; E329-Y331 VanDerWaalsContact C-N 3.31Å; E329-Y331 PolarHBondContact O-N 3.36Å; E329-R332 PolarHBondContact O-N 2.8Å; E329-R332 IonicContact OE1-CZ 2.79Å; E329-R332 IonicContact OE1-NH1 3.84Å; E329-R332 PolarHBondContact OE1-NH1 2.94Å; E329-K333 WeakPolarHBondContact O-CG 3.49Å; E329-K333 PolarHBondContact O-N 3.33Å
330	T	91.2	Very high	91.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.1	-46	171.7	-60.5	0	0	0	0	110.8	P286 D287 F322 S324 T326 P327 R332 K333 V334	P286-T330 HydrophobicContact CG-CG2 3.72Å; D287-T330 HydrophobicContact CB-CG2 4.43Å; D287-T330 WeakPolarHBondContact OD1-CG2 3.37Å; F322-T330 HydrophobicContact CB-CG2 4.23Å; F322-T330 WeakPolarHBondContact O-CA 3.5Å; F322-T330 WeakPolarHBondContact O-CG2 3.17Å; F322-T330 PolarHBondContact O-OG1 2.61Å; S324-T330 PolarHBondContact N-OG1 3.36Å; S324-T330 PolarHBondContact OG-N 2.89Å; T326-T330 PolarHBondContact O-N 2.86Å; T326-T330 VanDerWaalsContact O-N 3.13Å; T326-T330 PolarHBondContact O-OG1 3.14Å; P327-T330 PolarHBondContact O-N 3.49Å; T330-R332 PolarHBondContact O-N 3.23Å; T330-K333 WeakPolarHBondContact O-CB 3.36Å; T330-K333 PolarHBondContact O-N 2.77Å; T330-V334 HydrophobicContact CG2-CG2 4.37Å; T330-V334 WeakPolarHBondContact O-CG2 3.37Å; T330-V334 PolarHBondContact O-N 3.44Å
331	Y	90.2	Very high	91.8	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.027	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-45.3	175.9	169.7	-96	0	0	0	112.6	Y246 L249 H251 F294 P327 Q328 E329 K333 V334 M335	Y246-Y331 AromaticContact CD1-CD1 3.76Å; Y246-Y331 HydrophobicContact CD1-CD1 3.76Å; Y246-Y331 AromaticContact CD1-CD2 3.85Å; Y246-Y331 HydrophobicContact CD1-CD2 3.85Å; Y246-Y331 HydrophobicContact CD1-CE1 4.27Å; Y246-Y331 HydrophobicContact CD1-CE2 4.34Å; Y246-Y331 AromaticContact CD1-CG 3.5Å; Y246-Y331 HydrophobicContact CD1-CG 3.5Å; Y246-Y331 AromaticContact CD2-CD2 3.62Å; Y246-Y331 HydrophobicContact CD2-CD2 3.62Å; Y246-Y331 AromaticContact CD2-CE2 3.77Å; Y246-Y331 HydrophobicContact CD2-CE2 3.77Å; Y246-Y331 HydrophobicContact CD2-CG 4.17Å; Y246-Y331 VanDerWaalsContact CE1-CB 3.42Å; Y246-Y331 HydrophobicContact CE1-CD1 4.33Å; Y246-Y331 HydrophobicContact CE1-CD2 4.07Å; Y246-Y331 AromaticContact CE1-CG 3.7Å; Y246-Y331 HydrophobicContact CE1-CG 3.7Å; Y246-Y331 AromaticContact CE2-CD2 3.84Å; Y246-Y331 HydrophobicContact CE2-CD2 3.84Å; Y246-Y331 HydrophobicContact CE2-CE2 4.41Å; Y246-Y331 HydrophobicContact CE2-CG 4.33Å; Y246-Y331 HydrophobicContact CG-CD1 4.04Å; Y246-Y331 AromaticContact CG-CD2 3.61Å; Y246-Y331 HydrophobicContact CG-CD2 3.61Å; Y246-Y331 HydrophobicContact CG-CE1 4.15Å; Y246-Y331 AromaticContact CG-CE2 3.72Å; Y246-Y331 HydrophobicContact CG-CE2 3.72Å; Y246-Y331 AromaticContact CG-CG 3.76Å; Y246-Y331 HydrophobicContact CG-CG 3.76Å; Y246-Y331 AromaticContact CG-CZ 3.97Å; L249-Y331 HydrophobicContact CD2-CD1 4.41Å; H251-Y331 AromaticContact CE1-CZ 3.76Å; H251-Y331 PolarHBondContact CE1-OH 2.77Å; F294-Y331 HydrophobicContact CB-CE2 3.97Å; F294-Y331 HydrophobicContact CD1-CD2 4.34Å; F294-Y331 HydrophobicContact CD1-CE2 4.11Å; F294-Y331 HydrophobicContact CD2-CD2 4.13Å; F294-Y331 HydrophobicContact CD2-CE2 4.06Å; F294-Y331 HydrophobicContact CE1-CD2 4.48Å; F294-Y331 HydrophobicContact CE2-CD2 4.26Å; F294-Y331 HydrophobicContact CG-CD2 4.17Å; F294-Y331 AromaticContact CG-CE2 3.78Å; F294-Y331 HydrophobicContact CG-CE2 3.78Å; F294-Y331 HydrophobicContact CZ-CD2 4.45Å; P327-Y331 WeakPolarHBondContact O-CB 3.42Å; P327-Y331 PolarHBondContact O-N 3.25Å; Q328-Y331 WeakPolarHBondContact O-CB 2.93Å; Q328-Y331 PolarHBondContact O-N 3.22Å; E329-Y331 VanDerWaalsContact C-N 3.31Å; E329-Y331 PolarHBondContact O-N 3.36Å; Y331-K333 VanDerWaalsContact C-N 3.31Å; Y331-K333 PolarHBondContact O-N 3.32Å; Y331-V334 PolarHBondContact O-N 3.37Å; Y331-M335 HydrophobicContact CD1-CG 4.48Å; Y331-M335 HydrophobicContact CD2-CE 4.41Å; Y331-M335 HydrophobicContact CD2-CG 4.32Å; Y331-M335 HydrophobicContact CE1-CG 4.12Å; Y331-M335 HydrophobicContact CE2-CE 3.5Å; Y331-M335 HydrophobicContact CE2-CG 3.95Å; Y331-M335 WeakPolarHBondContact O-CB 3.4Å; Y331-M335 WeakPolarHBondContact O-CG 3.49Å; Y331-M335 PolarHBondContact O-N 3.17Å
332	R	91.2	Very high	91.8	Very high	47 Å²	47	42.4 Å²	42.4	18%	0.177	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-39.3	176.1	-73.2	177.8	178.6	120.6	1.1	112.1	S252 P254 Q328 E329 T330 N336	S252-R332 WeakPolarHBondContact O-CD 3.49Å; S252-R332 WeakPolarHBondContact O-CG 3.34Å; P254-R332 HydrophobicContact CB-CB 4.26Å; Q328-R332 WeakPolarHBondContact O-CG 3.2Å; Q328-R332 PolarHBondContact O-N 2.71Å; Q328-R332 VanDerWaalsContact O-N 3.07Å; E329-R332 PolarHBondContact O-N 2.8Å; E329-R332 IonicContact OE1-CZ 2.79Å; E329-R332 IonicContact OE1-NH1 3.84Å; E329-R332 PolarHBondContact OE1-NH1 2.94Å; T330-R332 PolarHBondContact O-N 3.23Å; R332-N336 WeakPolarHBondContact O-CB 3.35Å; R332-N336 PolarHBondContact O-N 3Å; R332-N336 VanDerWaalsContact O-N 3.1Å; R332-N336 PolarHBondContact O-ND2 2.58Å
333	K	93.9	Very high	91.8	Very high	14 Å²	14	44.6 Å²	44.6	6%	0.061	21%	0.214	C	C	.	.	H	α-helix	trans	-63.9	-51.3	174.4	-73.3	178.4	-178.8	168.5	0	111.5	P254 F322 C323 S324 E329 T330 Y331 M335 N336 W337 T340	P254-K333 HydrophobicContact CB-CG 4.27Å; P254-K333 HydrophobicContact CG-CG 3.76Å; F322-K333 HydrophobicContact CB-CB 3.94Å; F322-K333 HydrophobicContact CD1-CB 4.06Å; F322-K333 HydrophobicContact CG-CB 4.43Å; F322-K333 WeakPolarHBondContact O-CD 3.01Å; C323-K333 PolarHBondContact O-NZ 3.02Å; S324-K333 WeakPolarHBondContact OG-CD 2.94Å; S324-K333 VanDerWaalsContact OG-CE 3.27Å; S324-K333 WeakPolarHBondContact OG-CE 3.43Å; S324-K333 PolarHBondContact OG-NZ 2.94Å; E329-K333 WeakPolarHBondContact O-CG 3.49Å; E329-K333 PolarHBondContact O-N 3.33Å; T330-K333 WeakPolarHBondContact O-CB 3.36Å; T330-K333 PolarHBondContact O-N 2.77Å; Y331-K333 VanDerWaalsContact C-N 3.31Å; Y331-K333 PolarHBondContact O-N 3.32Å; K333-M335 VanDerWaalsContact C-N 3.27Å; K333-M335 PolarHBondContact O-N 2.89Å; K333-N336 CarbonylContact O-C 3.5Å; K333-N336 WeakPolarHBondContact O-CA 3.28Å; K333-N336 PolarHBondContact O-N 3.36Å; K333-W337 PolarHBondContact O-N 2.85Å; K333-T340 HydrophobicContact CB-CG2 4.34Å; K333-T340 HydrophobicContact CG-CG2 4.14Å; K333-T340 PolarHBondContact O-OG1 3.15Å
334	V	94.4	Very high	92	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-54.6	-44.5	177.2	171.4	0	0	0	0	111.2	I289 P291 F294 W306 F322 T330 Y331 N336 W337	I289-V334 WeakPolarHBondContact O-CG1 3.49Å; P291-V334 HydrophobicContact CB-CG1 4.2Å; F294-V334 HydrophobicContact CE2-CG1 4.46Å; W306-V334 HydrophobicContact CZ2-CG1 4.5Å; F322-V334 HydrophobicContact CB-CG2 3.75Å; F322-V334 HydrophobicContact CD2-CG2 3.7Å; F322-V334 HydrophobicContact CE2-CG2 4.49Å; F322-V334 HydrophobicContact CG-CG2 3.75Å; T330-V334 HydrophobicContact CG2-CG2 4.37Å; T330-V334 WeakPolarHBondContact O-CG2 3.37Å; T330-V334 PolarHBondContact O-N 3.44Å; Y331-V334 PolarHBondContact O-N 3.37Å; V334-N336 VanDerWaalsContact C-N 3.29Å; V334-N336 PolarHBondContact O-N 2.59Å; V334-W337 WeakPolarHBondContact O-CB 3.48Å; V334-W337 PolarHBondContact O-N 3.29Å
335	M	92.6	Very high	92.1	Very high	27 Å²	27	50.9 Å²	50.9	13%	0.133	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-27.8	178.7	-75.4	-69.4	176.6	0	0	114	H251 F294 M295 Y331 K333	H251-M335 WeakPolarHBondContact ND1-CG 3.45Å; F294-M335 HydrophobicContact CB-CE 3.24Å; F294-M335 HydrophobicContact CD2-CE 3.86Å; F294-M335 HydrophobicContact CG-CE 3.91Å; M295-M335 HydrophobicContact CE-SD 4.42Å; Y331-M335 HydrophobicContact CD1-CG 4.48Å; Y331-M335 HydrophobicContact CD2-CE 4.41Å; Y331-M335 HydrophobicContact CD2-CG 4.32Å; Y331-M335 HydrophobicContact CE1-CG 4.12Å; Y331-M335 HydrophobicContact CE2-CE 3.5Å; Y331-M335 HydrophobicContact CE2-CG 3.95Å; Y331-M335 WeakPolarHBondContact O-CB 3.4Å; Y331-M335 WeakPolarHBondContact O-CG 3.49Å; Y331-M335 PolarHBondContact O-N 3.17Å; K333-M335 VanDerWaalsContact C-N 3.27Å; K333-M335 PolarHBondContact O-N 2.89Å
336	N	94.3	Very high	92.4	Very high	37 Å²	37	49.6 Å²	49.6	20%	0.198	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	38.4	177.3	-63.3	-78.1	0	0	0	110.6	H251 R332 K333 V334 R338 E339 T340	H251-N336 PolarHBondContact O-ND2 3.43Å; R332-N336 WeakPolarHBondContact O-CB 3.35Å; R332-N336 PolarHBondContact O-N 3Å; R332-N336 VanDerWaalsContact O-N 3.1Å; R332-N336 PolarHBondContact O-ND2 2.58Å; K333-N336 CarbonylContact O-C 3.5Å; K333-N336 WeakPolarHBondContact O-CA 3.28Å; K333-N336 PolarHBondContact O-N 3.36Å; V334-N336 VanDerWaalsContact C-N 3.29Å; V334-N336 PolarHBondContact O-N 2.59Å; N336-R338 PolarHBondContact O-N 3.03Å; N336-R338 VanDerWaalsContact O-N 3.15Å; N336-E339 PolarHBondContact O-N 3.06Å; N336-T340 HydrophobicContact CB-CG2 4.34Å; N336-T340 WeakPolarHBondContact O-CG2 2.91Å; N336-T340 PolarHBondContact O-N 2.75Å; N336-T340 PolarHBondContact O-OG1 3.22Å
337	W	96.1	Very high	92.7	Very high	34 Å²	34	48.4 Å²	48.4	13%	0.129	24%	0.241	C	C	.	.	H	α-helix	trans	-57.6	-31.3	-174.9	63.9	-96	0	0	0	113	W306 F322 K333 V334 E339 T340 L341 C361 C362 E363	W306-W337 HydrophobicContact CH2-CB 3.72Å; W306-W337 AromaticContact CH2-CD1 3.77Å; W306-W337 HydrophobicContact CH2-CD2 4.03Å; W306-W337 AromaticContact CH2-CG 3.57Å; W306-W337 HydrophobicContact CH2-CG 3.57Å; W306-W337 HydrophobicContact CZ2-CB 4.34Å; W306-W337 HydrophobicContact CZ3-CD2 4.33Å; W306-W337 HydrophobicContact CZ3-CG 4.27Å; F322-W337 HydrophobicContact CE1-CB 3.85Å; F322-W337 HydrophobicContact CZ-CB 3.88Å; K333-W337 PolarHBondContact O-N 2.85Å; V334-W337 WeakPolarHBondContact O-CB 3.48Å; V334-W337 PolarHBondContact O-N 3.29Å; W337-E339 PolarHBondContact O-N 2.95Å; W337-E339 VanDerWaalsContact O-N 3.17Å; W337-T340 WeakPolarHBondContact CA-OG1 3.43Å; W337-T340 PolarHBondContact O-N 3.43Å; W337-L341 WeakPolarHBondContact O-CB 3.44Å; W337-L341 PolarHBondContact O-N 3.33Å; W337-C361 VanDerWaalsContact CE3-O 3.29Å; W337-C361 WeakPolarHBondContact CZ3-O 3.24Å; W337-C362 VanDerWaalsContact CH2-CA 3.46Å; W337-C362 HydrophobicContact CH2-CB 3.78Å; W337-C362 HydrophobicContact CZ2-CB 4.42Å; W337-C362 HydrophobicContact CZ3-CB 4.19Å; W337-E363 VanDerWaalsContact CH2-OE2 3.3Å; W337-E363 WeakPolarHBondContact CH2-OE2 3.47Å; W337-E363 HydrophobicContact CZ2-CB 4.37Å; W337-E363 VanDerWaalsContact CZ2-N 3.34Å; W337-E363 WeakPolarHBondContact CZ2-OE2 3.11Å
338	R	95.4	Very high	92.9	Very high	168 Å²	168	53.2 Å²	53.2	63%	0.634	27%	0.272	S	S	*	.	H	α-helix	trans	-57.4	-29.8	177	-67.5	-178.5	-177.6	-89.6	-6.6	113.2	N336 E363	N336-R338 PolarHBondContact O-N 3.03Å; N336-R338 VanDerWaalsContact O-N 3.15Å; R338-E363 IonicContact CZ-OE2 2.7Å; R338-E363 IonicContact NH1-OE2 2.89Å; R338-E363 VanDerWaalsContact NH2-CD 3.28Å; R338-E363 IonicContact NH2-OE1 3.6Å; R338-E363 IonicContact NH2-OE2 2.95Å; R338-E363 PolarHBondContact NH2-OE2 2.97Å
339	E	94	Very high	93.4	Very high	128 Å²	128	51.3 Å²	51.3	60%	0.598	26%	0.264	S	S	*	.	H	α-helix	trans	-103.4	-28.3	179.5	-64.5	-178.8	-156.8	0	0	112.4	L253 N336 W337	L253-E339 WeakPolarHBondContact CD2-OE2 3.41Å; N336-E339 PolarHBondContact O-N 3.06Å; W337-E339 PolarHBondContact O-N 2.95Å; W337-E339 VanDerWaalsContact O-N 3.17Å
340	T	95.5	Very high	93.8	Very high	23 Å²	23	52.4 Å²	52.4	14%	0.141	27%	0.273	C	S	.	.	H	α-helix	trans	-99.4	-20.9	-171	61.8	0	0	0	0	114.2	K333 N336 W337 T342	K333-T340 HydrophobicContact CB-CG2 4.34Å; K333-T340 HydrophobicContact CG-CG2 4.14Å; K333-T340 PolarHBondContact O-OG1 3.15Å; N336-T340 HydrophobicContact CB-CG2 4.34Å; N336-T340 WeakPolarHBondContact O-CG2 2.91Å; N336-T340 PolarHBondContact O-N 2.75Å; N336-T340 PolarHBondContact O-OG1 3.22Å; W337-T340 WeakPolarHBondContact CA-OG1 3.43Å; W337-T340 PolarHBondContact O-N 3.43Å; T340-T342 PolarHBondContact O-N 3.05Å
341	L	97.1	Very high	94.1	Very high	17 Å²	17	58.8 Å²	58.8	9%	0.089	30%	0.302	C	S	.	.			trans	-73.6	96.8	172.1	-178.9	58.1	0	0	0	109.3	Y313 P321 F322 W337 L358 C361	Y313-L341 HydrophobicContact CD2-CD1 4.27Å; Y313-L341 HydrophobicContact CE2-CD1 4.28Å; P321-L341 HydrophobicContact CB-CD1 3.49Å; P321-L341 VanDerWaalsContact CB-CD1 3.49Å; P321-L341 HydrophobicContact CG-CD1 3.99Å; F322-L341 HydrophobicContact CE1-CB 4.01Å; F322-L341 HydrophobicContact CE1-CD1 4.47Å; F322-L341 HydrophobicContact CZ-CB 4.25Å; F322-L341 HydrophobicContact CZ-CD1 4.25Å; W337-L341 WeakPolarHBondContact O-CB 3.44Å; W337-L341 PolarHBondContact O-N 3.33Å; L341-L358 HydrophobicContact CD2-CD2 3.8Å; L341-L358 HydrophobicContact CG-CD2 4.25Å; L341-C361 HydrophobicContact CD2-CB 3.62Å
342	T	95.6	Very high	94.5	Very high	86 Å²	86	62.4 Å²	62.4	53%	0.528	32%	0.318	S	S	.	.			trans	-131.7	151.3	-177.6	56.7	0	0	0	0	110.8	Y313 T340	Y313-T342 WeakPolarHBondContact CE2-O 3.43Å; Y313-T342 PolarHBondContact OH-O 3.33Å; T340-T342 PolarHBondContact O-N 3.05Å
343	F	96.1	Very high	94.9	Very high	46 Å²	46	60.1 Å²	60.1	20%	0.202	31%	0.31	C	S	.	.			trans	-101.3	127.5	176.5	-60.7	-83.5	0	0	0	109.4	Y313 I349 K354 I357 L358	Y313-F343 HydrophobicContact CD2-CD1 4.19Å; Y313-F343 AromaticContact CD2-CE1 3.82Å; Y313-F343 HydrophobicContact CD2-CE1 3.82Å; Y313-F343 AromaticContact CE2-CD1 3.79Å; Y313-F343 HydrophobicContact CE2-CD1 3.79Å; Y313-F343 AromaticContact CE2-CE1 3.86Å; Y313-F343 HydrophobicContact CE2-CE1 3.86Å; F343-I349 HydrophobicContact CD1-CD1 4.16Å; F343-I349 HydrophobicContact CE1-CD1 4.12Å; F343-K354 HydrophobicContact CD1-CG 4.11Å; F343-K354 HydrophobicContact CD2-CD 4.32Å; F343-K354 HydrophobicContact CD2-CG 4.23Å; F343-K354 HydrophobicContact CE1-CB 4.39Å; F343-K354 HydrophobicContact CE1-CG 4.03Å; F343-K354 HydrophobicContact CE2-CB 4.13Å; F343-K354 HydrophobicContact CE2-CG 4.16Å; F343-K354 HydrophobicContact CG-CD 4.41Å; F343-K354 HydrophobicContact CG-CG 4.2Å; F343-K354 HydrophobicContact CZ-CB 3.99Å; F343-K354 HydrophobicContact CZ-CG 4.06Å; F343-I357 HydrophobicContact CE1-CB 4.42Å; F343-I357 HydrophobicContact CE1-CD1 3.97Å; F343-I357 HydrophobicContact CE1-CG2 4.2Å; F343-I357 HydrophobicContact CZ-CB 4.19Å; F343-I357 HydrophobicContact CZ-CG2 3.97Å; F343-L358 HydrophobicContact CE2-CD1 4.22Å; F343-L358 HydrophobicContact CE2-CD2 4.01Å; F343-L358 HydrophobicContact CE2-CG 4.02Å; F343-L358 HydrophobicContact CZ-CD2 4.38Å; F343-L358 HydrophobicContact CZ-CG 4.21Å
344	P	93.6	Very high	95.1	Very high	17 Å²	17	61.8 Å²	61.8	11%	0.11	32%	0.317	C	S	.	.			trans	-62.9	127.7	178.1	-19.6	31.4	0	0	0	110.7	I317 Y319 E346 V347	I317-P344 HydrophobicContact CG2-CG 4.01Å; Y319-P344 WeakPolarHBondContact OH-CG 3.41Å; P344-E346 WeakPolarHBondContact CB-OE2 3.5Å; P344-E346 PolarHBondContact O-N 3.37Å; P344-E346 VanDerWaalsContact O-N 3.16Å; P344-V347 HydrophobicContact CB-CB 4.4Å; P344-V347 HydrophobicContact CB-CG2 3.93Å; P344-V347 HydrophobicContact CG-CG2 4.25Å; P344-V347 PolarHBondContact O-N 2.7Å; P344-V347 VanDerWaalsContact O-N 3.15Å
345	P	90.4	Very high	95.3	Very high	133 Å²	133	65 Å²	65	86%	0.864	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.6	-176.1	26	-35.2	0	0	0	113.3
346	E	89.6	Confident	95.6	Very high	106 Å²	106	63.7 Å²	63.7	50%	0.495	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-10	179.2	71.4	-88	-152.6	0	0	114.8	S264 P344	S264-E346 WeakPolarHBondContact CB-OE1 3.31Å; S264-E346 PolarHBondContact N-OE1 3.05Å; P344-E346 WeakPolarHBondContact CB-OE2 3.5Å; P344-E346 PolarHBondContact O-N 3.37Å; P344-E346 VanDerWaalsContact O-N 3.16Å
347	V	91.6	Very high	95.8	Very high	31 Å²	31	61.9 Å²	61.9	19%	0.188	32%	0.318	C	S	.	.	S	Bend	trans	-98.9	125	-177.4	179.5	0	0	0	0	110	S264 I317 P344 I349	S264-V347 WeakPolarHBondContact OG-CG2 3.39Å; I317-V347 HydrophobicContact CD1-CB 4.26Å; I317-V347 HydrophobicContact CD1-CG1 3.63Å; P344-V347 HydrophobicContact CB-CB 4.4Å; P344-V347 HydrophobicContact CB-CG2 3.93Å; P344-V347 HydrophobicContact CG-CG2 4.25Å; P344-V347 PolarHBondContact O-N 2.7Å; P344-V347 VanDerWaalsContact O-N 3.15Å; V347-I349 PolarHBondContact O-N 2.83Å
348	P	92.4	Very high	95.9	Very high	123 Å²	123	64 Å²	64	80%	0.799	33%	0.331	S	S	*	.			trans	-71.5	124.3	177.1	29.5	-33.5	0	0	0	110.5
349	I	96.6	Very high	96	Very high	21 Å²	21	59.6 Å²	59.6	11%	0.108	32%	0.315	C	S	.	.			trans	-153	135.4	175.6	178	170.2	0	0	0	109.2	L316 I317 F343 V347 A353 K354 I357	L316-I349 HydrophobicContact CB-CD1 4.33Å; L316-I349 HydrophobicContact CD1-CD1 3.8Å; L316-I349 HydrophobicContact CD1-CG1 4.3Å; I317-I349 HydrophobicContact CD1-CD1 4.27Å; F343-I349 HydrophobicContact CD1-CD1 4.16Å; F343-I349 HydrophobicContact CE1-CD1 4.12Å; V347-I349 PolarHBondContact O-N 2.83Å; I349-A353 HydrophobicContact CD1-CB 4.01Å; I349-A353 HydrophobicContact CG1-CB 3.71Å; I349-K354 HydrophobicContact CD1-CG 4.05Å; I349-K354 HydrophobicContact CG1-CG 4.03Å; I349-K354 HydrophobicContact CG2-CD 4.38Å; I349-K354 VanDerWaalsContact CG2-CE 3.4Å; I349-K354 HydrophobicContact CG2-CG 4.13Å; I349-K354 WeakPolarHBondContact O-CE 3.04Å; I349-I357 HydrophobicContact CD1-CD1 4.05Å
350	S	98	Very high	96.2	Very high	35 Å²	35	53.5 Å²	53.5	25%	0.245	29%	0.286	C	S	.	.			trans	-70.8	155.3	-178.5	75.1	0	0	0	0	112.2	E186 K352 A353 K354	E186-S350 VanDerWaalsContact CD-OG 3.25Å; E186-S350 VanDerWaalsContact OE1-CB 3.23Å; E186-S350 WeakPolarHBondContact OE1-CB 3.18Å; E186-S350 PolarHBondContact OE1-N 2.91Å; E186-S350 PolarHBondContact OE1-OG 2.98Å; E186-S350 WeakPolarHBondContact OE2-CB 3.36Å; E186-S350 PolarHBondContact OE2-OG 3.02Å; S350-K352 PolarHBondContact O-N 3.43Å; S350-A353 PolarHBondContact O-N 3.3Å; S350-A353 WeakPolarHBondContact OG-CB 3.48Å; S350-A353 PolarHBondContact OG-N 3.23Å; S350-A353 VanDerWaalsContact OG-N 3.16Å; S350-K354 WeakPolarHBondContact O-CG 3.49Å; S350-K354 PolarHBondContact O-N 3.44Å
351	E	98	Very high	96.3	Very high	134 Å²	134	52.4 Å²	52.4	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-62.8	-32.8	175.3	-65.7	-55.3	131.4	0	0	112	K354 D355	E351-K354 PolarHBondContact O-N 3.32Å; E351-K354 IonicContact OE1-NZ 2.76Å; E351-K354 PolarHBondContact OE1-NZ 2.82Å; E351-D355 VanDerWaalsContact O-CB 3.29Å; E351-D355 WeakPolarHBondContact O-CB 3.5Å; E351-D355 PolarHBondContact O-N 2.69Å
352	K	98.4	Very high	96.3	Very high	83 Å²	83	52.2 Å²	52.2	36%	0.361	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-44.5	174.6	-69.5	-179.6	167.3	-163	0	111.6	S350 L356 P380 F381 E383	S350-K352 PolarHBondContact O-N 3.43Å; K352-L356 PolarHBondContact O-N 3.36Å; K352-L356 VanDerWaalsContact O-N 3.11Å; K352-P380 HydrophobicContact CD-CB 4.32Å; K352-P380 WeakPolarHBondContact CD-O 3.42Å; K352-P380 WeakPolarHBondContact CE-O 3.37Å; K352-P380 HydrophobicContact CG-CB 4.35Å; K352-P380 PolarHBondContact NZ-O 3.4Å; K352-F381 HydrophobicContact CB-CB 4.29Å; K352-F381 HydrophobicContact CB-CD2 4.29Å; K352-E383 IonicContact NZ-OE2 2.63Å; K352-E383 PolarHBondContact NZ-OE2 2.83Å
353	A	98.4	Very high	96.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.1	-43.9	178.7	0	0	0	0	0	111.9	M312 L316 I349 S350 L356 I357 F381	M312-A353 HydrophobicContact CE-CB 3.91Å; L316-A353 HydrophobicContact CD1-CB 3.81Å; I349-A353 HydrophobicContact CD1-CB 4.01Å; I349-A353 HydrophobicContact CG1-CB 3.71Å; S350-A353 PolarHBondContact O-N 3.3Å; S350-A353 WeakPolarHBondContact OG-CB 3.48Å; S350-A353 PolarHBondContact OG-N 3.23Å; S350-A353 VanDerWaalsContact OG-N 3.16Å; A353-L356 PolarHBondContact O-N 2.82Å; A353-I357 WeakPolarHBondContact O-CG1 3.28Å; A353-I357 PolarHBondContact O-N 3.03Å; A353-F381 HydrophobicContact CB-CD2 3.94Å; A353-F381 HydrophobicContact CB-CE2 3.75Å
354	K	98.4	Very high	96	Very high	49 Å²	49	50 Å²	50	21%	0.213	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-47.7	175.1	-67.6	178.2	-163.1	163.7	0	111.8	F343 I349 S350 E351 L356 I357 L358	F343-K354 HydrophobicContact CD1-CG 4.11Å; F343-K354 HydrophobicContact CD2-CD 4.32Å; F343-K354 HydrophobicContact CD2-CG 4.23Å; F343-K354 HydrophobicContact CE1-CB 4.39Å; F343-K354 HydrophobicContact CE1-CG 4.03Å; F343-K354 HydrophobicContact CE2-CB 4.13Å; F343-K354 HydrophobicContact CE2-CG 4.16Å; F343-K354 HydrophobicContact CG-CD 4.41Å; F343-K354 HydrophobicContact CG-CG 4.2Å; F343-K354 HydrophobicContact CZ-CB 3.99Å; F343-K354 HydrophobicContact CZ-CG 4.06Å; I349-K354 HydrophobicContact CD1-CG 4.05Å; I349-K354 HydrophobicContact CG1-CG 4.03Å; I349-K354 HydrophobicContact CG2-CD 4.38Å; I349-K354 VanDerWaalsContact CG2-CE 3.4Å; I349-K354 HydrophobicContact CG2-CG 4.13Å; I349-K354 WeakPolarHBondContact O-CE 3.04Å; S350-K354 WeakPolarHBondContact O-CG 3.49Å; S350-K354 PolarHBondContact O-N 3.44Å; E351-K354 PolarHBondContact O-N 3.32Å; E351-K354 IonicContact OE1-NZ 2.76Å; E351-K354 PolarHBondContact OE1-NZ 2.82Å; K354-L356 PolarHBondContact O-N 2.62Å; K354-I357 PolarHBondContact O-N 3.16Å; K354-L358 VanDerWaalsContact O-CG 3.31Å; K354-L358 WeakPolarHBondContact O-CG 3.45Å; K354-L358 PolarHBondContact O-N 3.34Å
355	D	98.4	Very high	95.9	Very high	66 Å²	66	56 Å²	56	35%	0.353	29%	0.291	S	S	.	.	H	α-helix	trans	-57.7	-47.8	179.2	175.6	73.2	0	0	0	111.6	E351 I357 L358 R359	E351-D355 VanDerWaalsContact O-CB 3.29Å; E351-D355 WeakPolarHBondContact O-CB 3.5Å; E351-D355 PolarHBondContact O-N 2.69Å; D355-I357 PolarHBondContact O-N 2.95Å; D355-L358 PolarHBondContact O-N 3.41Å; D355-R359 WeakPolarHBondContact O-CB 3.47Å; D355-R359 WeakPolarHBondContact O-CG 3.46Å; D355-R359 PolarHBondContact O-N 2.96Å; D355-R359 IonicContact OD1-NE 2.68Å; D355-R359 IonicContact OD2-CZ 3.91Å; D355-R359 VanDerWaalsContact OD2-CZ 3.22Å; D355-R359 IonicContact OD2-NE 2.73Å; D355-R359 PolarHBondContact OD2-NE 3.26Å; D355-R359 IonicContact OD2-NH2 3.14Å; D355-R359 PolarHBondContact OD2-NH2 2.82Å
356	L	98.6	Very high	96.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.2	-43.1	178.5	178.9	59.8	0	0	0	112.2	M312 K352 A353 K354 L358 R359 F360 I368 N379 F381 F382	M312-L356 HydrophobicContact CE-CB 4.2Å; M312-L356 HydrophobicContact CE-CD2 3.92Å; M312-L356 HydrophobicContact CE-CG 4.3Å; M312-L356 HydrophobicContact SD-CB 4.32Å; M312-L356 HydrophobicContact SD-CD2 3.65Å; M312-L356 HydrophobicContact SD-CG 3.87Å; K352-L356 PolarHBondContact O-N 3.36Å; K352-L356 VanDerWaalsContact O-N 3.11Å; A353-L356 PolarHBondContact O-N 2.82Å; K354-L356 PolarHBondContact O-N 2.62Å; L356-L358 VanDerWaalsContact C-N 3.34Å; L356-L358 PolarHBondContact O-N 2.7Å; L356-R359 PolarHBondContact O-N 2.99Å; L356-F360 HydrophobicContact CD1-CD2 3.81Å; L356-F360 HydrophobicContact CD1-CE2 3.43Å; L356-F360 VanDerWaalsContact CD1-CE2 3.43Å; L356-F360 HydrophobicContact CD1-CZ 3.82Å; L356-F360 HydrophobicContact CD2-CE2 3.87Å; L356-F360 HydrophobicContact CG-CD2 3.8Å; L356-F360 HydrophobicContact CG-CE2 3.51Å; L356-F360 HydrophobicContact CG-CZ 4.35Å; L356-F360 WeakPolarHBondContact O-CD2 3.29Å; L356-F360 PolarHBondContact O-N 3.21Å; L356-I368 HydrophobicContact CD1-CD1 4.04Å; L356-N379 HydrophobicContact CD1-CB 4.24Å; L356-N379 VanDerWaalsContact CD1-ND2 3.31Å; L356-N379 WeakPolarHBondContact CD1-ND2 3.39Å; L356-F381 HydrophobicContact CB-CB 4.23Å; L356-F381 HydrophobicContact CD2-CB 3.84Å; L356-F381 HydrophobicContact CD2-CD1 3.38Å; L356-F381 HydrophobicContact CD2-CE1 4.2Å; L356-F381 HydrophobicContact CD2-CG 3.83Å; L356-F382 HydrophobicContact CD1-CE2 4.33Å; L356-F382 HydrophobicContact CD2-CD2 4.44Å; L356-F382 HydrophobicContact CD2-CE1 4.4Å; L356-F382 HydrophobicContact CD2-CE2 3.59Å; L356-F382 HydrophobicContact CD2-CZ 3.57Å
357	I	98.7	Very high	96.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-45.7	175.8	-71.2	166.5	0	0	0	110.9	M312 Y313 L316 F343 I349 A353 K354 D355 R359 F360 C361	M312-I357 HydrophobicContact CB-CG1 4.17Å; M312-I357 HydrophobicContact CE-CD1 4.42Å; M312-I357 HydrophobicContact CE-CG1 4.09Å; M312-I357 HydrophobicContact CG-CD1 4.14Å; M312-I357 HydrophobicContact CG-CG1 3.81Å; M312-I357 HydrophobicContact SD-CG1 3.78Å; Y313-I357 HydrophobicContact CD2-CD1 4.38Å; Y313-I357 HydrophobicContact CD2-CG2 4.17Å; L316-I357 HydrophobicContact CD1-CD1 4.24Å; F343-I357 HydrophobicContact CE1-CB 4.42Å; F343-I357 HydrophobicContact CE1-CD1 3.97Å; F343-I357 HydrophobicContact CE1-CG2 4.2Å; F343-I357 HydrophobicContact CZ-CB 4.19Å; F343-I357 HydrophobicContact CZ-CG2 3.97Å; I349-I357 HydrophobicContact CD1-CD1 4.05Å; A353-I357 WeakPolarHBondContact O-CG1 3.28Å; A353-I357 PolarHBondContact O-N 3.03Å; K354-I357 PolarHBondContact O-N 3.16Å; D355-I357 PolarHBondContact O-N 2.95Å; I357-R359 VanDerWaalsContact C-N 3.3Å; I357-R359 PolarHBondContact O-N 3.36Å; I357-F360 PolarHBondContact O-N 3.44Å; I357-C361 WeakPolarHBondContact O-CB 3.41Å; I357-C361 PolarHBondContact O-N 2.97Å
358	L	98.4	Very high	96.7	Very high	78 Å²	78	49.7 Å²	49.7	41%	0.408	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-35.1	179.1	-69.7	172.7	0	0	0	112.2	L341 F343 K354 D355 L356 C361	L341-L358 HydrophobicContact CD2-CD2 3.8Å; L341-L358 HydrophobicContact CG-CD2 4.25Å; F343-L358 HydrophobicContact CE2-CD1 4.22Å; F343-L358 HydrophobicContact CE2-CD2 4.01Å; F343-L358 HydrophobicContact CE2-CG 4.02Å; F343-L358 HydrophobicContact CZ-CD2 4.38Å; F343-L358 HydrophobicContact CZ-CG 4.21Å; K354-L358 VanDerWaalsContact O-CG 3.31Å; K354-L358 WeakPolarHBondContact O-CG 3.45Å; K354-L358 PolarHBondContact O-N 3.34Å; D355-L358 PolarHBondContact O-N 3.41Å; L356-L358 VanDerWaalsContact C-N 3.34Å; L356-L358 PolarHBondContact O-N 2.7Å; L358-C361 CarbonylContact O-C 3.56Å
359	R	98.1	Very high	96.8	Very high	75 Å²	75	43.9 Å²	43.9	28%	0.283	21%	0.21	S	C	.	.	H	α-helix	trans	-73.5	-27.6	175.8	-76.3	-158.3	-87.5	159.7	-19.7	114	D355 L356 I357 C362 I368 N379	D355-R359 WeakPolarHBondContact O-CB 3.47Å; D355-R359 WeakPolarHBondContact O-CG 3.46Å; D355-R359 PolarHBondContact O-N 2.96Å; D355-R359 IonicContact OD1-NE 2.68Å; D355-R359 IonicContact OD2-CZ 3.91Å; D355-R359 VanDerWaalsContact OD2-CZ 3.22Å; D355-R359 IonicContact OD2-NE 2.73Å; D355-R359 PolarHBondContact OD2-NE 3.26Å; D355-R359 IonicContact OD2-NH2 3.14Å; D355-R359 PolarHBondContact OD2-NH2 2.82Å; L356-R359 PolarHBondContact O-N 2.99Å; I357-R359 VanDerWaalsContact C-N 3.3Å; I357-R359 PolarHBondContact O-N 3.36Å; R359-C362 PolarHBondContact O-SG 3.12Å; R359-C362 VanDerWaalsContact O-SG 3.4Å; R359-I368 HydrophobicContact CB-CB 4.1Å; R359-I368 HydrophobicContact CB-CD1 4.48Å; R359-I368 HydrophobicContact CB-CG2 4.14Å; R359-I368 WeakPolarHBondContact O-CG2 3.49Å; R359-I368 PolarHBondContact O-N 3.4Å; R359-I368 VanDerWaalsContact O-N 3.1Å; R359-N379 PolarHBondContact NH1-ND2 3.47Å; R359-N379 PolarHBondContact NH2-ND2 3Å
360	F	98.5	Very high	96.4	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-75.8	-44	168.4	-78.2	-50.2	0	0	0	112	I193 W305 L308 M312 L356 I357 C362 R367 I368 I376	I193-F360 HydrophobicContact CG2-CE2 4.47Å; W305-F360 HydrophobicContact CB-CD1 4.06Å; W305-F360 HydrophobicContact CB-CE1 4.33Å; W305-F360 WeakPolarHBondContact O-CD1 3.23Å; L308-F360 HydrophobicContact CD2-CE1 4.4Å; L308-F360 HydrophobicContact CD2-CZ 4Å; L308-F360 HydrophobicContact CG-CZ 4.43Å; M312-F360 HydrophobicContact SD-CE2 4.42Å; L356-F360 HydrophobicContact CD1-CD2 3.81Å; L356-F360 HydrophobicContact CD1-CE2 3.43Å; L356-F360 VanDerWaalsContact CD1-CE2 3.43Å; L356-F360 HydrophobicContact CD1-CZ 3.82Å; L356-F360 HydrophobicContact CD2-CE2 3.87Å; L356-F360 HydrophobicContact CG-CD2 3.8Å; L356-F360 HydrophobicContact CG-CE2 3.51Å; L356-F360 HydrophobicContact CG-CZ 4.35Å; L356-F360 WeakPolarHBondContact O-CD2 3.29Å; L356-F360 PolarHBondContact O-N 3.21Å; I357-F360 PolarHBondContact O-N 3.44Å; F360-C362 PolarHBondContact O-N 3.49Å; F360-R367 VanDerWaalsContact O-CD 3.23Å; F360-R367 WeakPolarHBondContact O-CD 3.49Å; F360-R367 WeakPolarHBondContact O-CG 3.43Å; F360-R367 PolarHBondContact O-NE 3.03Å; F360-I368 HydrophobicContact CD1-CG2 3.33Å; F360-I368 HydrophobicContact CE1-CG2 3.61Å; F360-I368 HydrophobicContact CG-CG2 4.02Å; F360-I368 HydrophobicContact CZ-CG2 4.5Å; F360-I376 HydrophobicContact CE1-CD1 4.06Å; F360-I376 HydrophobicContact CE1-CG1 4.22Å; F360-I376 HydrophobicContact CE1-CG2 4.04Å; F360-I376 HydrophobicContact CZ-CG2 3.75Å
361	C	98	Very high	95.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-97.7	56.1	-173.7	-62.9	0	0	0	0	112.4	W306 W337 L341 I357 L358	W306-C361 HydrophobicContact CD2-CB 4.45Å; W306-C361 VanDerWaalsContact CE3-CA 3.46Å; W306-C361 HydrophobicContact CE3-CB 4.15Å; W306-C361 HydrophobicContact CH2-CB 4.21Å; W306-C361 HydrophobicContact CZ3-CB 4.03Å; W337-C361 VanDerWaalsContact CE3-O 3.29Å; W337-C361 WeakPolarHBondContact CZ3-O 3.24Å; L341-C361 HydrophobicContact CD2-CB 3.62Å; I357-C361 WeakPolarHBondContact O-CB 3.41Å; I357-C361 PolarHBondContact O-N 2.97Å; L358-C361 CarbonylContact O-C 3.56Å
362	C	96.7	Very high	95.7	Very high	14 Å²	14	45.7 Å²	45.7	10%	0.095	24%	0.236	C	C	.	.	S	Bend	trans	-126.4	-176.9	171.6	65.7	0	0	0	0	112.3	W306 W337 R359 F360 R367	W306-C362 WeakPolarHBondContact CZ3-O 3.36Å; W337-C362 VanDerWaalsContact CH2-CA 3.46Å; W337-C362 HydrophobicContact CH2-CB 3.78Å; W337-C362 HydrophobicContact CZ2-CB 4.42Å; W337-C362 HydrophobicContact CZ3-CB 4.19Å; R359-C362 PolarHBondContact O-SG 3.12Å; R359-C362 VanDerWaalsContact O-SG 3.4Å; F360-C362 PolarHBondContact O-N 3.49Å; C362-R367 PolarHBondContact O-NE 2.92Å; C362-R367 PolarHBondContact O-NH2 3.45Å; C362-R367 VanDerWaalsContact SG-CA 3.53Å
363	E	93.8	Very high	95.5	Very high	45 Å²	45	42.2 Å²	42.2	21%	0.21	22%	0.222	C	C	.	.			trans	-55.6	148.9	175	64.8	-87.2	-162.2	0	0	112.7	W337 R338 E365 H366 R367	W337-E363 VanDerWaalsContact CH2-OE2 3.3Å; W337-E363 WeakPolarHBondContact CH2-OE2 3.47Å; W337-E363 HydrophobicContact CZ2-CB 4.37Å; W337-E363 VanDerWaalsContact CZ2-N 3.34Å; W337-E363 WeakPolarHBondContact CZ2-OE2 3.11Å; R338-E363 IonicContact CZ-OE2 2.7Å; R338-E363 IonicContact NH1-OE2 2.89Å; R338-E363 VanDerWaalsContact NH2-CD 3.28Å; R338-E363 IonicContact NH2-OE1 3.6Å; R338-E363 IonicContact NH2-OE2 2.95Å; R338-E363 PolarHBondContact NH2-OE2 2.97Å; E363-E365 PolarHBondContact O-N 3.5Å; E363-H366 HydrophobicContact CG-CB 4.27Å; E363-H366 PolarHBondContact O-N 2.99Å; E363-H366 IonicContact OE1-CE1 3.83Å; E363-H366 IonicContact OE1-CG 2.66Å; E363-H366 IonicContact OE1-ND1 3.06Å; E363-H366 PolarHBondContact OE1-ND1 3.21Å; E363-R367 PolarHBondContact O-N 2.95Å; E363-R367 VanDerWaalsContact O-N 3.11Å
364	E	92.1	Very high	95.5	Very high	41 Å²	41	46.9 Å²	46.9	19%	0.192	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-56.6	-36.9	-173.9	-177.4	-179.6	-179.4	0	0	112.7	N300 L302 H366 R367	N300-E364 PolarHBondContact N-OE1 3.44Å; N300-E364 PolarHBondContact ND2-OE1 3.15Å; N300-E364 PolarHBondContact OD1-OE1 3.1Å; L302-E364 HydrophobicContact CD1-CG 4.2Å; E364-H366 VanDerWaalsContact C-N 3.33Å; E364-H366 PolarHBondContact O-N 2.92Å; E364-R367 PolarHBondContact O-N 3.32Å
365	E	91.1	Very high	95.4	Very high	142 Å²	142	48 Å²	48	66%	0.664	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-69.4	-27.8	-175.2	-60.2	84.9	174.2	0	0	113.8	E363	E363-E365 PolarHBondContact O-N 3.5Å
366	H	94.2	Very high	95.4	Very high	136 Å²	136	44.8 Å²	44.8	63%	0.63	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-114.5	9.2	-178.4	-57.1	117.3	0	0	0	112.7	E363 E364	E363-H366 HydrophobicContact CG-CB 4.27Å; E363-H366 PolarHBondContact O-N 2.99Å; E363-H366 IonicContact OE1-CE1 3.83Å; E363-H366 IonicContact OE1-CG 2.66Å; E363-H366 IonicContact OE1-ND1 3.06Å; E363-H366 PolarHBondContact OE1-ND1 3.21Å; E364-H366 VanDerWaalsContact C-N 3.33Å; E364-H366 PolarHBondContact O-N 2.92Å
367	R	97.3	Very high	95.3	Very high	1 Å²	1	47.1 Å²	47.1	0%	0.004	24%	0.242	C	C	.	.			trans	-68.8	133.9	-179.6	-166.4	173.7	-60.6	157.2	5.7	110.7	E292 L302 F360 C362 E363 E364 G369 A370	E292-R367 IonicContact OE1-CZ 2.86Å; E292-R367 IonicContact OE1-NH1 3.96Å; E292-R367 PolarHBondContact OE1-NH1 3.06Å; E292-R367 IonicContact OE1-NH2 3.54Å; E292-R367 PolarHBondContact OE1-NH2 3.33Å; E292-R367 VanDerWaalsContact OE1-NH2 3.13Å; E292-R367 IonicContact OE2-CZ 3.66Å; E292-R367 IonicContact OE2-NH1 3.81Å; E292-R367 IonicContact OE2-NH2 3.04Å; E292-R367 PolarHBondContact OE2-NH2 3.29Å; L302-R367 VanDerWaalsContact C-NH1 3.33Å; L302-R367 WeakPolarHBondContact O-CD 3.36Å; L302-R367 PolarHBondContact O-NH1 3.04Å; F360-R367 VanDerWaalsContact O-CD 3.23Å; F360-R367 WeakPolarHBondContact O-CD 3.49Å; F360-R367 WeakPolarHBondContact O-CG 3.43Å; F360-R367 PolarHBondContact O-NE 3.03Å; C362-R367 PolarHBondContact O-NE 2.92Å; C362-R367 PolarHBondContact O-NH2 3.45Å; C362-R367 VanDerWaalsContact SG-CA 3.53Å; E363-R367 PolarHBondContact O-N 2.95Å; E363-R367 VanDerWaalsContact O-N 3.11Å; E364-R367 PolarHBondContact O-N 3.32Å; R367-G369 PolarHBondContact O-N 3.38Å; R367-A370 WeakPolarHBondContact O-CB 3.29Å; R367-A370 PolarHBondContact O-N 2.89Å; R367-A370 VanDerWaalsContact O-N 3.09Å
368	I	97.1	Very high	95.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	134.5	175.7	-162.4	178.1	0	0	0	110.4	L356 R359 F360 E375 I376 N379	L356-I368 HydrophobicContact CD1-CD1 4.04Å; R359-I368 HydrophobicContact CB-CB 4.1Å; R359-I368 HydrophobicContact CB-CD1 4.48Å; R359-I368 HydrophobicContact CB-CG2 4.14Å; R359-I368 WeakPolarHBondContact O-CG2 3.49Å; R359-I368 PolarHBondContact O-N 3.4Å; R359-I368 VanDerWaalsContact O-N 3.1Å; F360-I368 HydrophobicContact CD1-CG2 3.33Å; F360-I368 HydrophobicContact CE1-CG2 3.61Å; F360-I368 HydrophobicContact CG-CG2 4.02Å; F360-I368 HydrophobicContact CZ-CG2 4.5Å; I368-E375 HydrophobicContact CG1-CB 4.22Å; I368-E375 HydrophobicContact CG1-CG 3.73Å; I368-I376 HydrophobicContact CB-CG1 4.46Å; I368-I376 HydrophobicContact CD1-CG1 4.28Å; I368-I376 HydrophobicContact CG1-CG1 3.89Å; I368-I376 HydrophobicContact CG2-CG1 4.19Å; I368-N379 HydrophobicContact CD1-CB 4.43Å
369	G	93.5	Very high	95.2	Very high	2 Å²	2	48 Å²	48	2%	0.021	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	1.2	-173.8	0	0	0	0	0	114.5	L302 R367 S372 E375	L302-G369 VanDerWaalsContact CD2-O 3.3Å; L302-G369 WeakPolarHBondContact CD2-O 3.16Å; R367-G369 PolarHBondContact O-N 3.38Å; G369-S372 WeakPolarHBondContact CA-O 3.41Å; G369-E375 PolarHBondContact N-OE2 3.33Å
370	A	89.4	Confident	95.2	Very high	43 Å²	43	47.5 Å²	47.5	36%	0.355	26%	0.261	S	S	.	.	S	Bend	trans	-60.8	-43.4	174.9	0	0	0	0	0	112.5	L302 R367	L302-A370 HydrophobicContact CD1-CB 3.77Å; R367-A370 WeakPolarHBondContact O-CB 3.29Å; R367-A370 PolarHBondContact O-N 2.89Å; R367-A370 VanDerWaalsContact O-N 3.09Å
371	V	88	Confident	95.2	Very high	138 Å²	138	47.9 Å²	47.9	84%	0.836	26%	0.263	S	S	*	.	S	Bend	trans	-83.6	-55.8	-179.6	-177.6	0	0	0	0	110.6
372	S	92.4	Very high	95.2	Very high	47 Å²	47	48.2 Å²	48.2	33%	0.329	26%	0.264	S	S	.	.			trans	-160.1	166.1	170.3	91.5	0	0	0	0	111.8	G369 E374 E375	G369-S372 WeakPolarHBondContact CA-O 3.41Å; S372-E374 VanDerWaalsContact CB-OE2 3.26Å; S372-E374 WeakPolarHBondContact CB-OE2 3.44Å; S372-E374 PolarHBondContact O-N 3.02Å; S372-E374 WeakPolarHBondContact OG-CB 3.46Å; S372-E374 PolarHBondContact OG-N 3.44Å; S372-E374 PolarHBondContact OG-OE2 2.88Å; S372-E375 WeakPolarHBondContact O-CB 3.41Å; S372-E375 PolarHBondContact O-N 3Å
373	V	95.4	Very high	95.2	Very high	10 Å²	10	54.1 Å²	54.1	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-22.3	-180	70.1	0	0	0	0	112.5	V197 D201 W305 E375 I376 K377	V197-V373 HydrophobicContact CG1-CG2 3.57Å; D201-V373 HydrophobicContact CB-CB 4.38Å; D201-V373 HydrophobicContact CB-CG2 3.91Å; W305-V373 HydrophobicContact CH2-CG2 4.35Å; W305-V373 HydrophobicContact CZ2-CG2 4.35Å; V373-E375 PolarHBondContact O-N 3.48Å; V373-I376 HydrophobicContact CG2-CD1 4.45Å; V373-I376 WeakPolarHBondContact O-CA 3.41Å; V373-I376 WeakPolarHBondContact O-CB 3.48Å; V373-I376 PolarHBondContact O-N 3.45Å; V373-K377 HydrophobicContact CG1-CD 4.45Å; V373-K377 HydrophobicContact CG2-CG 4.48Å; V373-K377 PolarHBondContact O-N 2.89Å
374	E	96.7	Very high	95.3	Very high	98 Å²	98	55.5 Å²	55.5	46%	0.458	32%	0.316	S	S	.	.	H	α-helix	trans	-61.9	-28.4	177.8	-72	57.2	-133.6	0	0	112	S372 I376 K377 S378	S372-E374 VanDerWaalsContact CB-OE2 3.26Å; S372-E374 WeakPolarHBondContact CB-OE2 3.44Å; S372-E374 PolarHBondContact O-N 3.02Å; S372-E374 WeakPolarHBondContact OG-CB 3.46Å; S372-E374 PolarHBondContact OG-N 3.44Å; S372-E374 PolarHBondContact OG-OE2 2.88Å; E374-I376 VanDerWaalsContact C-N 3.29Å; E374-I376 PolarHBondContact O-N 2.98Å; E374-K377 PolarHBondContact O-N 2.95Å; E374-K377 IonicContact OE1-NZ 3.06Å; E374-K377 PolarHBondContact OE1-NZ 3.01Å; E374-S378 VanDerWaalsContact O-CB 3.28Å; E374-S378 WeakPolarHBondContact O-CB 3.21Å; E374-S378 PolarHBondContact O-N 3.2Å; E374-S378 PolarHBondContact O-OG 3.36Å
375	E	96.7	Very high	95.5	Very high	71 Å²	71	54.8 Å²	54.8	33%	0.332	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-40.3	171.8	-165.2	-166.1	176.7	0	0	111.3	I368 G369 S372 V373 S378	I368-E375 HydrophobicContact CG1-CB 4.22Å; I368-E375 HydrophobicContact CG1-CG 3.73Å; G369-E375 PolarHBondContact N-OE2 3.33Å; S372-E375 WeakPolarHBondContact O-CB 3.41Å; S372-E375 PolarHBondContact O-N 3Å; V373-E375 PolarHBondContact O-N 3.48Å; E375-S378 PolarHBondContact O-OG 2.9Å
376	I	97.8	Very high	95.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68.3	-51	175.3	-56.5	170.4	0	0	0	109.3	V197 W305 F360 I368 V373 E374 S378 N379 F382	V197-I376 HydrophobicContact CG1-CB 4.46Å; V197-I376 HydrophobicContact CG1-CG2 4.05Å; V197-I376 HydrophobicContact CG2-CG2 3.68Å; W305-I376 HydrophobicContact CD2-CD1 3.63Å; W305-I376 HydrophobicContact CE3-CD1 3.88Å; W305-I376 HydrophobicContact CG-CD1 4.12Å; W305-I376 HydrophobicContact CH2-CD1 4.13Å; W305-I376 HydrophobicContact CZ2-CD1 3.89Å; W305-I376 HydrophobicContact CZ3-CD1 4.13Å; F360-I376 HydrophobicContact CE1-CD1 4.06Å; F360-I376 HydrophobicContact CE1-CG1 4.22Å; F360-I376 HydrophobicContact CE1-CG2 4.04Å; F360-I376 HydrophobicContact CZ-CG2 3.75Å; I368-I376 HydrophobicContact CB-CG1 4.46Å; I368-I376 HydrophobicContact CD1-CG1 4.28Å; I368-I376 HydrophobicContact CG1-CG1 3.89Å; I368-I376 HydrophobicContact CG2-CG1 4.19Å; V373-I376 HydrophobicContact CG2-CD1 4.45Å; V373-I376 WeakPolarHBondContact O-CA 3.41Å; V373-I376 WeakPolarHBondContact O-CB 3.48Å; V373-I376 PolarHBondContact O-N 3.45Å; E374-I376 VanDerWaalsContact C-N 3.29Å; E374-I376 PolarHBondContact O-N 2.98Å; I376-S378 PolarHBondContact O-N 3.42Å; I376-N379 VanDerWaalsContact O-CB 3.24Å; I376-N379 WeakPolarHBondContact O-CB 3.19Å; I376-N379 PolarHBondContact O-N 3.42Å; I376-N379 VanDerWaalsContact O-N 3.1Å; I376-F382 HydrophobicContact CG2-CE2 3.8Å; I376-F382 HydrophobicContact CG2-CZ 4.34Å; I376-F382 WeakPolarHBondContact O-CD2 3.24Å; I376-F382 VanDerWaalsContact O-CE2 3.28Å; I376-F382 WeakPolarHBondContact O-CE2 3.44Å
377	K	97.6	Very high	95.8	Very high	49 Å²	49	45.4 Å²	45.4	21%	0.213	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-28.4	-176.1	-64.4	175.1	-173.6	163.7	0	113.8	V373 E374 Y387	V373-K377 HydrophobicContact CG1-CD 4.45Å; V373-K377 HydrophobicContact CG2-CG 4.48Å; V373-K377 PolarHBondContact O-N 2.89Å; E374-K377 PolarHBondContact O-N 2.95Å; E374-K377 IonicContact OE1-NZ 3.06Å; E374-K377 PolarHBondContact OE1-NZ 3.01Å; K377-Y387 WeakPolarHBondContact CA-OH 3.43Å; K377-Y387 HydrophobicContact CB-CD2 4.23Å; K377-Y387 HydrophobicContact CB-CE1 4.4Å; K377-Y387 HydrophobicContact CB-CE2 3.67Å; K377-Y387 HydrophobicContact CD-CD1 4.41Å; K377-Y387 HydrophobicContact CD-CD2 4.47Å; K377-Y387 HydrophobicContact CD-CG 4.37Å; K377-Y387 HydrophobicContact CG-CD1 4.24Å; K377-Y387 HydrophobicContact CG-CD2 4.36Å; K377-Y387 HydrophobicContact CG-CE1 3.89Å; K377-Y387 HydrophobicContact CG-CE2 4.02Å; K377-Y387 HydrophobicContact CG-CG 4.46Å; K377-Y387 PolarHBondContact O-OH 3.27Å
378	S	96.9	Very high	95.6	Very high	92 Å²	92	51.8 Å²	51.8	64%	0.643	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	0.6	179.6	58.4	0	0	0	0	114.2	E374 E375 I376	E374-S378 VanDerWaalsContact O-CB 3.28Å; E374-S378 WeakPolarHBondContact O-CB 3.21Å; E374-S378 PolarHBondContact O-N 3.2Å; E374-S378 PolarHBondContact O-OG 3.36Å; E375-S378 PolarHBondContact O-OG 2.9Å; I376-S378 PolarHBondContact O-N 3.42Å
379	N	98.2	Very high	95.5	Very high	4 Å²	4	56 Å²	56	2%	0.021	33%	0.325	C	S	.	.	S	Bend	trans	-62.7	137.5	178	-175.4	-60.9	0	0	0	111.4	L356 R359 I368 I376 F381 F382	L356-N379 HydrophobicContact CD1-CB 4.24Å; L356-N379 VanDerWaalsContact CD1-ND2 3.31Å; L356-N379 WeakPolarHBondContact CD1-ND2 3.39Å; R359-N379 PolarHBondContact NH1-ND2 3.47Å; R359-N379 PolarHBondContact NH2-ND2 3Å; I368-N379 HydrophobicContact CD1-CB 4.43Å; I376-N379 VanDerWaalsContact O-CB 3.24Å; I376-N379 WeakPolarHBondContact O-CB 3.19Å; I376-N379 PolarHBondContact O-N 3.42Å; I376-N379 VanDerWaalsContact O-N 3.1Å; N379-F381 PolarHBondContact O-N 3.22Å; N379-F381 VanDerWaalsContact OD1-CB 3.29Å; N379-F381 WeakPolarHBondContact OD1-CB 3.31Å; N379-F381 PolarHBondContact OD1-N 3.47Å; N379-F382 HydrophobicContact CB-CD2 3.92Å; N379-F382 HydrophobicContact CB-CE2 4.26Å; N379-F382 PolarHBondContact O-N 2.82Å
380	P	98.2	Very high	95.6	Very high	64 Å²	64	56.5 Å²	56.5	42%	0.416	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-56.2	-21	179.1	-27.6	35.5	0	0	0	116.1	K352 F382 E383	K352-P380 HydrophobicContact CD-CB 4.32Å; K352-P380 WeakPolarHBondContact CD-O 3.42Å; K352-P380 WeakPolarHBondContact CE-O 3.37Å; K352-P380 HydrophobicContact CG-CB 4.35Å; K352-P380 PolarHBondContact NZ-O 3.4Å; P380-F382 PolarHBondContact O-N 3.33Å; P380-E383 WeakPolarHBondContact O-CB 3.44Å; P380-E383 PolarHBondContact O-N 3.07Å
381	F	98.6	Very high	95.8	Very high	8 Å²	8	55.5 Å²	55.5	4%	0.035	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-64.7	-28.4	172.6	-178.7	-102.4	0	0	0	112.4	E186 T189 Q190 M312 K352 A353 L356 N379 E383	E186-F381 HydrophobicContact CB-CE2 4.45Å; T189-F381 HydrophobicContact CG2-CZ 4.28Å; Q190-F381 HydrophobicContact CB-CE1 3.94Å; Q190-F381 HydrophobicContact CB-CZ 4.05Å; Q190-F381 HydrophobicContact CG-CE1 4.22Å; Q190-F381 PolarHBondContact NE2-O 3.11Å; M312-F381 HydrophobicContact CE-CD1 3.86Å; M312-F381 HydrophobicContact CE-CD2 4.01Å; M312-F381 HydrophobicContact CE-CE1 3.54Å; M312-F381 HydrophobicContact CE-CE2 3.75Å; M312-F381 HydrophobicContact CE-CG 4.07Å; M312-F381 HydrophobicContact CE-CZ 3.5Å; M312-F381 HydrophobicContact SD-CE1 4.37Å; K352-F381 HydrophobicContact CB-CB 4.29Å; K352-F381 HydrophobicContact CB-CD2 4.29Å; A353-F381 HydrophobicContact CB-CD2 3.94Å; A353-F381 HydrophobicContact CB-CE2 3.75Å; L356-F381 HydrophobicContact CB-CB 4.23Å; L356-F381 HydrophobicContact CD2-CB 3.84Å; L356-F381 HydrophobicContact CD2-CD1 3.38Å; L356-F381 HydrophobicContact CD2-CE1 4.2Å; L356-F381 HydrophobicContact CD2-CG 3.83Å; N379-F381 PolarHBondContact O-N 3.22Å; N379-F381 VanDerWaalsContact OD1-CB 3.29Å; N379-F381 WeakPolarHBondContact OD1-CB 3.31Å; N379-F381 PolarHBondContact OD1-N 3.47Å; F381-E383 VanDerWaalsContact C-N 3.33Å
382	F	98.4	Very high	96	Very high	7 Å²	7	54.9 Å²	54.9	3%	0.031	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-93.6	18.1	177.7	-58.2	-66.7	0	0	0	113.6	Q190 I193 A194 V197 L356 I376 N379 P380 G384 V385 Y387	Q190-F382 HydrophobicContact CG-CD1 4.05Å; I193-F382 HydrophobicContact CB-CE1 4.32Å; I193-F382 HydrophobicContact CG2-CE1 3.89Å; I193-F382 HydrophobicContact CG2-CZ 3.72Å; A194-F382 HydrophobicContact CB-CD1 4.05Å; A194-F382 HydrophobicContact CB-CE1 4.06Å; V197-F382 HydrophobicContact CG2-CZ 4.44Å; L356-F382 HydrophobicContact CD1-CE2 4.33Å; L356-F382 HydrophobicContact CD2-CD2 4.44Å; L356-F382 HydrophobicContact CD2-CE1 4.4Å; L356-F382 HydrophobicContact CD2-CE2 3.59Å; L356-F382 HydrophobicContact CD2-CZ 3.57Å; I376-F382 HydrophobicContact CG2-CE2 3.8Å; I376-F382 HydrophobicContact CG2-CZ 4.34Å; I376-F382 WeakPolarHBondContact O-CD2 3.24Å; I376-F382 VanDerWaalsContact O-CE2 3.28Å; I376-F382 WeakPolarHBondContact O-CE2 3.44Å; N379-F382 HydrophobicContact CB-CD2 3.92Å; N379-F382 HydrophobicContact CB-CE2 4.26Å; N379-F382 PolarHBondContact O-N 2.82Å; P380-F382 PolarHBondContact O-N 3.33Å; F382-G384 PolarHBondContact O-N 3.5Å; F382-V385 HydrophobicContact CB-CB 4.32Å; F382-V385 HydrophobicContact CB-CG2 3.97Å; F382-V385 HydrophobicContact CD1-CG2 4.25Å; F382-V385 WeakPolarHBondContact O-CB 3.3Å; F382-V385 WeakPolarHBondContact O-CG2 3.39Å; F382-V385 PolarHBondContact O-N 3.04Å; F382-Y387 WeakPolarHBondContact CB-OH 3.42Å; F382-Y387 WeakPolarHBondContact CD2-OH 3.47Å; F382-Y387 WeakPolarHBondContact CG-OH 3.48Å
383	E	96.6	Very high	95.9	Very high	139 Å²	139	58.5 Å²	58.5	65%	0.65	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	126.3	173.5	-173.5	174.5	-172.7	0	0	110.5	Q190 K352 P380 F381	Q190-E383 PolarHBondContact NE2-O 3.4Å; K352-E383 IonicContact NZ-OE2 2.63Å; K352-E383 PolarHBondContact NZ-OE2 2.83Å; P380-E383 WeakPolarHBondContact O-CB 3.44Å; P380-E383 PolarHBondContact O-N 3.07Å; F381-E383 VanDerWaalsContact C-N 3.33Å
384	G	95.1	Very high	95.8	Very high	73 Å²	73	63.8 Å²	63.8	75%	0.753	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-5.5	-178.2	0	0	0	0	0	115.6	F382 D386	F382-G384 PolarHBondContact O-N 3.5Å; G384-D386 PolarHBondContact O-N 3.13Å
385	V	97	Very high	95.7	Very high	27 Å²	27	59.8 Å²	59.8	16%	0.164	33%	0.326	C	S	.	.			trans	-74.7	125.7	176.5	179.2	0	0	0	0	110.6	Q190 A194 F382 Y387 I390	Q190-V385 VanDerWaalsContact CD-CG2 3.5Å; Q190-V385 HydrophobicContact CG-CG2 3.68Å; A194-V385 HydrophobicContact CB-CG1 3.88Å; A194-V385 HydrophobicContact CB-CG2 4.44Å; F382-V385 HydrophobicContact CB-CB 4.32Å; F382-V385 HydrophobicContact CB-CG2 3.97Å; F382-V385 HydrophobicContact CD1-CG2 4.25Å; F382-V385 WeakPolarHBondContact O-CB 3.3Å; F382-V385 WeakPolarHBondContact O-CG2 3.39Å; F382-V385 PolarHBondContact O-N 3.04Å; V385-Y387 HydrophobicContact CB-CE2 4.12Å; V385-Y387 HydrophobicContact CG1-CD1 4.06Å; V385-Y387 HydrophobicContact CG1-CD2 4.1Å; V385-Y387 HydrophobicContact CG1-CE1 3.86Å; V385-Y387 HydrophobicContact CG1-CE2 3.89Å; V385-Y387 HydrophobicContact CG1-CG 4.17Å; V385-I390 HydrophobicContact CG1-CD1 4.11Å
386	D	96.1	Very high	95.6	Very high	39 Å²	39	58.5 Å²	58.5	21%	0.209	33%	0.328	C	S	.	.			trans	-97.1	96.7	170.5	180	-13.3	0	0	0	109.1	G384 D388 H389 I390 R393	G384-D386 PolarHBondContact O-N 3.13Å; D386-D388 VanDerWaalsContact C-N 3.26Å; D386-D388 PolarHBondContact O-N 3.34Å; D386-D388 PolarHBondContact OD1-N 3.42Å; D386-D388 VanDerWaalsContact OD1-N 3.12Å; D386-H389 VanDerWaalsContact CG-ND1 3.32Å; D386-H389 PolarHBondContact O-N 3.06Å; D386-H389 IonicContact OD1-CG 3.72Å; D386-H389 PolarHBondContact OD1-N 2.7Å; D386-H389 VanDerWaalsContact OD1-N 3.12Å; D386-H389 IonicContact OD1-ND1 3.96Å; D386-H389 PolarHBondContact OD1-ND1 3.09Å; D386-H389 IonicContact OD2-CE1 3.57Å; D386-H389 IonicContact OD2-CG 3.53Å; D386-H389 IonicContact OD2-ND1 2.62Å; D386-H389 PolarHBondContact OD2-ND1 3.22Å; D386-I390 WeakPolarHBondContact O-CA 3.39Å; D386-I390 VanDerWaalsContact O-CB 3.27Å; D386-I390 WeakPolarHBondContact O-CB 3.15Å; D386-I390 PolarHBondContact O-N 3.06Å; D386-R393 IonicContact OD2-CZ 3.45Å; D386-R393 IonicContact OD2-NE 3.54Å; D386-R393 IonicContact OD2-NH2 3.13Å; D386-R393 PolarHBondContact OD2-NH2 3.35Å
387	Y	95.3	Very high	95.4	Very high	42 Å²	42	60.2 Å²	60.2	17%	0.165	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.1	-176.6	-72.5	-77.5	0	0	0	114.1	A194 L198 K377 F382 V385	A194-Y387 HydrophobicContact CB-CE1 3.98Å; L198-Y387 HydrophobicContact CD1-CD1 4.14Å; L198-Y387 HydrophobicContact CD2-CD1 3.91Å; L198-Y387 HydrophobicContact CG-CD1 4.08Å; K377-Y387 WeakPolarHBondContact CA-OH 3.43Å; K377-Y387 HydrophobicContact CB-CD2 4.23Å; K377-Y387 HydrophobicContact CB-CE1 4.4Å; K377-Y387 HydrophobicContact CB-CE2 3.67Å; K377-Y387 HydrophobicContact CD-CD1 4.41Å; K377-Y387 HydrophobicContact CD-CD2 4.47Å; K377-Y387 HydrophobicContact CD-CG 4.37Å; K377-Y387 HydrophobicContact CG-CD1 4.24Å; K377-Y387 HydrophobicContact CG-CD2 4.36Å; K377-Y387 HydrophobicContact CG-CE1 3.89Å; K377-Y387 HydrophobicContact CG-CE2 4.02Å; K377-Y387 HydrophobicContact CG-CG 4.46Å; K377-Y387 PolarHBondContact O-OH 3.27Å; F382-Y387 WeakPolarHBondContact CB-OH 3.42Å; F382-Y387 WeakPolarHBondContact CD2-OH 3.47Å; F382-Y387 WeakPolarHBondContact CG-OH 3.48Å; V385-Y387 HydrophobicContact CB-CE2 4.12Å; V385-Y387 HydrophobicContact CG1-CD1 4.06Å; V385-Y387 HydrophobicContact CG1-CD2 4.1Å; V385-Y387 HydrophobicContact CG1-CE1 3.86Å; V385-Y387 HydrophobicContact CG1-CE2 3.89Å; V385-Y387 HydrophobicContact CG1-CG 4.17Å
388	D	93.1	Very high	95.1	Very high	135 Å²	135	62.3 Å²	62.3	72%	0.722	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-35.9	-179	-66	-34.3	0	0	0	110.8	D386	D386-D388 VanDerWaalsContact C-N 3.26Å; D386-D388 PolarHBondContact O-N 3.34Å; D386-D388 PolarHBondContact OD1-N 3.42Å; D386-D388 VanDerWaalsContact OD1-N 3.12Å
389	H	94.6	Very high	94.8	Very high	89 Å²	89	59.1 Å²	59.1	41%	0.412	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	6.1	-173	-47.5	92.7	0	0	0	114.7	D386 R391 E392 R393	D386-H389 VanDerWaalsContact CG-ND1 3.32Å; D386-H389 PolarHBondContact O-N 3.06Å; D386-H389 IonicContact OD1-CG 3.72Å; D386-H389 PolarHBondContact OD1-N 2.7Å; D386-H389 VanDerWaalsContact OD1-N 3.12Å; D386-H389 IonicContact OD1-ND1 3.96Å; D386-H389 PolarHBondContact OD1-ND1 3.09Å; D386-H389 IonicContact OD2-CE1 3.57Å; D386-H389 IonicContact OD2-CG 3.53Å; D386-H389 IonicContact OD2-ND1 2.62Å; D386-H389 PolarHBondContact OD2-ND1 3.22Å; H389-R391 PolarHBondContact O-N 3.38Å; H389-R391 VanDerWaalsContact O-N 3.12Å; H389-E392 VanDerWaalsContact CA-OE2 3.31Å; H389-E392 WeakPolarHBondContact CA-OE2 3.39Å; H389-E392 WeakPolarHBondContact CB-OE2 3.42Å; H389-E392 IonicContact CD2-OE2 3.32Å; H389-E392 PolarHBondContact CD2-OE2 2.78Å; H389-E392 IonicContact CG-OE2 2.61Å; H389-E392 PolarHBondContact O-N 2.7Å; H389-R393 WeakPolarHBondContact O-CG 3.4Å; H389-R393 PolarHBondContact O-N 2.71Å
390	I	95.4	Very high	94.4	Very high	12 Å²	12	65.3 Å²	65.3	6%	0.062	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-37.9	-176	-171.2	168	0	0	0	112.6	W148 F191 A194 E195 L198 H225 V385 D386	W148-I390 HydrophobicContact CH2-CG2 4.17Å; F191-I390 HydrophobicContact CD2-CD1 4.14Å; F191-I390 HydrophobicContact CD2-CG1 4.02Å; F191-I390 HydrophobicContact CE2-CD1 4.28Å; F191-I390 HydrophobicContact CE2-CG1 3.74Å; A194-I390 HydrophobicContact CB-CD1 3.75Å; E195-I390 HydrophobicContact CG-CD1 3.7Å; E195-I390 HydrophobicContact CG-CG1 4Å; E195-I390 HydrophobicContact CG-CG2 4.49Å; L198-I390 HydrophobicContact CD1-CG2 3.65Å; H225-I390 PolarHBondContact CE1-O 2.72Å; V385-I390 HydrophobicContact CG1-CD1 4.11Å; D386-I390 WeakPolarHBondContact O-CA 3.39Å; D386-I390 VanDerWaalsContact O-CB 3.27Å; D386-I390 WeakPolarHBondContact O-CB 3.15Å; D386-I390 PolarHBondContact O-N 3.06Å
391	R	94.2	Very high	94	Very high	22 Å²	22	65 Å²	65	8%	0.083	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.3	-178	-152.6	-177.5	-179.7	91.2	13.1	114	L147 W148 D221 R223 H225 V226 H389	L147-R391 VanDerWaalsContact O-CZ 3.28Å; L147-R391 PolarHBondContact O-NH1 3.15Å; L147-R391 PolarHBondContact O-NH2 3.4Å; W148-R391 HydrophobicContact CH2-CB 4.16Å; W148-R391 HydrophobicContact CH2-CG 4.29Å; D221-R391 IonicContact OD2-NH2 3.96Å; D221-R391 PolarHBondContact OD2-NH2 3.4Å; R223-R391 PolarHBondContact NH1-O 3.14Å; R223-R391 PolarHBondContact NH2-O 3.21Å; H225-R391 HydrophobicContact CB-CG 4.18Å; H225-R391 PolarHBondContact CE1-O 3.08Å; H225-R391 PolarHBondContact NE2-O 3.08Å; V226-R391 PolarHBondContact O-NH1 2.94Å; V226-R391 PolarHBondContact O-NH2 3.28Å; V226-R391 VanDerWaalsContact O-NH2 3.16Å; H389-R391 PolarHBondContact O-N 3.38Å; H389-R391 VanDerWaalsContact O-N 3.12Å
392	E	91.4	Very high	93.6	Very high	125 Å²	125	74.2 Å²	74.2	58%	0.584	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-18.9	176.1	-69.2	129	-158.3	0	0	112.2	R223 H389	R223-E392 PolarHBondContact NH2-O 3.26Å; H389-E392 VanDerWaalsContact CA-OE2 3.31Å; H389-E392 WeakPolarHBondContact CA-OE2 3.39Å; H389-E392 WeakPolarHBondContact CB-OE2 3.42Å; H389-E392 IonicContact CD2-OE2 3.32Å; H389-E392 PolarHBondContact CD2-OE2 2.78Å; H389-E392 IonicContact CG-OE2 2.61Å; H389-E392 PolarHBondContact O-N 2.7Å
393	R	89.8	Confident	93.2	Very high	123 Å²	123	76.4 Å²	76.4	46%	0.464	41%	0.414	S	S	.	.	S	Bend	trans	-80.1	163.1	175.7	-66.5	172.8	-177.3	-158.6	-0.3	111.2	R223 H225 D386 H389	R223-R393 PolarHBondContact NH2-O 3.43Å; H225-R393 PolarHBondContact CE1-O 3.48Å; H225-R393 PolarHBondContact NE2-O 2.88Å; H225-R393 VanDerWaalsContact NE2-O 3.12Å; D386-R393 IonicContact OD2-CZ 3.45Å; D386-R393 IonicContact OD2-NE 3.54Å; D386-R393 IonicContact OD2-NH2 3.13Å; D386-R393 PolarHBondContact OD2-NH2 3.35Å; H389-R393 WeakPolarHBondContact O-CG 3.4Å; H389-R393 PolarHBondContact O-N 2.71Å
394	P	93.4	Very high	92.7	Very high	120 Å²	120	74.2 Å²	74.2	78%	0.779	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.3	138.6	170.1	-22.5	34.2	0	0	0	111.1
395	A	94.4	Very high	92.4	Very high	14 Å²	14	74.2 Å²	74.2	12%	0.116	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-68.1	155.9	174.1	0	0	0	0	0	111.8	F191 R223 G224 I397	F191-A395 HydrophobicContact CE1-CB 3.8Å; F191-A395 VanDerWaalsContact CZ-CA 3.47Å; F191-A395 HydrophobicContact CZ-CB 3.73Å; R223-A395 VanDerWaalsContact O-CB 3.26Å; R223-A395 WeakPolarHBondContact O-CB 3.38Å; G224-A395 WeakPolarHBondContact O-CB 3.49Å; A395-I397 VanDerWaalsContact C-N 3.28Å; A395-I397 PolarHBondContact O-N 3.07Å
396	A	95.2	Very high	92.2	Very high	44 Å²	44	73.9 Å²	73.9	36%	0.364	39%	0.386	S	S	.	.	S	Bend	trans	-59.2	-37	-179.4	0	0	0	0	0	113.4	A188 F191 Y192	A188-A396 HydrophobicContact CB-CB 4.05Å; F191-A396 HydrophobicContact CB-CB 3.72Å; F191-A396 HydrophobicContact CD1-CB 3.74Å; F191-A396 HydrophobicContact CG-CB 3.74Å; Y192-A396 HydrophobicContact CE2-CB 4.49Å
397	I	94.4	Very high	92	Very high	37 Å²	37	72.9 Å²	72.9	19%	0.19	38%	0.382	C	S	.	.	S	Bend	trans	-120.9	116.6	174	-54.8	175.9	0	0	0	108.5	L177 L184 Y192 A395	L177-I397 HydrophobicContact CD1-CD1 4.33Å; L177-I397 HydrophobicContact CD2-CD1 4.19Å; L184-I397 HydrophobicContact CD2-CD1 3.9Å; Y192-I397 HydrophobicContact CE2-CD1 4.06Å; Y192-I397 HydrophobicContact CE2-CG1 4.23Å; Y192-I397 VanDerWaalsContact OH-CB 3.31Å; Y192-I397 WeakPolarHBondContact OH-CB 3.44Å; Y192-I397 PolarHBondContact OH-N 3.2Å; A395-I397 VanDerWaalsContact C-N 3.28Å; A395-I397 PolarHBondContact O-N 3.07Å
398	P	89.9	Confident	91.8	Very high	92 Å²	92	74.1 Å²	74.1	60%	0.597	40%	0.396	S	S	*	.			trans	-71.6	139.4	177.8	28.7	-33.6	0	0	0	111
399	I	91.7	Very high	91.7	Very high	25 Å²	25	68.9 Å²	68.9	13%	0.128	37%	0.368	C	S	.	.			trans	-89.8	117	176.4	-58.8	-57.1	0	0	0	109.4	L220 G224 I401	L220-I399 HydrophobicContact CB-CD1 4.49Å; L220-I399 HydrophobicContact CD1-CD1 4.16Å; G224-I399 VanDerWaalsContact CA-CG1 3.47Å; I399-I401 HydrophobicContact CG2-CG2 3.72Å; I399-I401 PolarHBondContact O-N 3.48Å
400	N	89	Confident	91.4	Very high	135 Å²	135	66.1 Å²	66.1	72%	0.722	36%	0.355	S	S	*	.			trans	-90.9	104.3	176	-67.5	-32.4	0	0	0	109.8
401	I	90.4	Very high	90.9	Very high	57 Å²	57	66.9 Å²	66.9	29%	0.292	36%	0.359	S	S	.	.			trans	-121.1	141.6	176.1	51.9	168.4	0	0	0	110.1	P170 A222 I399 D406	P170-I401 HydrophobicContact CB-CD1 4.31Å; P170-I401 HydrophobicContact CB-CG2 3.93Å; P170-I401 HydrophobicContact CG-CD1 3.77Å; P170-I401 HydrophobicContact CG-CG2 4.38Å; A222-I401 HydrophobicContact CB-CD1 3.79Å; I399-I401 HydrophobicContact CG2-CG2 3.72Å; I399-I401 PolarHBondContact O-N 3.48Å; I401-D406 HydrophobicContact CB-CB 4.22Å; I401-D406 HydrophobicContact CG2-CB 4.34Å
402	K	90.3	Very high	90.3	Very high	202 Å²	202	73.9 Å²	73.9	88%	0.878	39%	0.393	S	S	*	.	S	Bend	trans	-92.1	-27.2	-178.3	-62.9	174.9	-177.1	172.9	0	112.7	D406	K402-D406 WeakPolarHBondContact CB-OD2 3.34Å; K402-D406 PolarHBondContact N-OD2 3.15Å
403	S	90.3	Very high	89.7	Confident	53 Å²	53	69.6 Å²	69.6	37%	0.371	37%	0.372	S	S	.	.	S	Bend	trans	-152.6	170	-177	60.9	0	0	0	0	111.2	D405 D406	S403-D405 WeakPolarHBondContact CB-OD1 3.17Å; S403-D405 PolarHBondContact O-N 3.43Å; S403-D405 PolarHBondContact OG-OD1 3.25Å; S403-D406 VanDerWaalsContact O-CB 3.3Å; S403-D406 WeakPolarHBondContact O-CB 3.4Å; S403-D406 PolarHBondContact O-N 3.38Å; S403-D406 PolarHBondContact OG-N 2.96Å
404	I	86.1	Confident	89.1	Confident	93 Å²	93	68.2 Å²	68.2	48%	0.477	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-19.5	-179	59.8	168.2	0	0	0	113.6	V114 F168 M462	V114-I404 HydrophobicContact CG2-CD1 4.08Å; V114-I404 HydrophobicContact CG2-CG1 4.43Å; F168-I404 WeakPolarHBondContact CD1-O 3.48Å; F168-I404 WeakPolarHBondContact CE1-O 3.38Å; I404-M462 HydrophobicContact CG2-CE 3.46Å; I404-M462 VanDerWaalsContact CG2-CE 3.46Å
405	D	89	Confident	87.8	Confident	73 Å²	73	69.4 Å²	69.4	39%	0.39	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	13.4	179.1	60.2	-19.3	0	0	0	111.5	L105 V114 S403 T407	L105-D405 HydrophobicContact CD2-CB 3.98Å; V114-D405 HydrophobicContact CG2-CB 4.41Å; S403-D405 WeakPolarHBondContact CB-OD1 3.17Å; S403-D405 PolarHBondContact O-N 3.43Å; S403-D405 PolarHBondContact OG-OD1 3.25Å; D405-T407 PolarHBondContact O-N 3.04Å
406	D	91.4	Very high	86.4	Confident	20 Å²	20	70 Å²	70	11%	0.107	38%	0.382	C	S	.	.			trans	-64.4	125.4	179	-163.9	-18.3	0	0	0	110.5	F168 I401 K402 S403 S408	F168-D406 WeakPolarHBondContact CZ-O 3.31Å; I401-D406 HydrophobicContact CB-CB 4.22Å; I401-D406 HydrophobicContact CG2-CB 4.34Å; K402-D406 WeakPolarHBondContact CB-OD2 3.34Å; K402-D406 PolarHBondContact N-OD2 3.15Å; S403-D406 VanDerWaalsContact O-CB 3.3Å; S403-D406 WeakPolarHBondContact O-CB 3.4Å; S403-D406 PolarHBondContact O-N 3.38Å; S403-D406 PolarHBondContact OG-N 2.96Å; D406-S408 VanDerWaalsContact OD1-CB 3.27Å; D406-S408 WeakPolarHBondContact OD1-CB 3.42Å; D406-S408 PolarHBondContact OD1-N 3.3Å; D406-S408 PolarHBondContact OD1-OG 3.47Å
407	T	92.6	Very high	84.8	Confident	18 Å²	18	73.4 Å²	73.4	11%	0.11	40%	0.395	C	S	.	.			trans	-114	16	-179.8	56.1	0	0	0	0	112.6	K93 I95 L105 F168 D405 N409 F410	K93-T407 HydrophobicContact CD-CG2 4.15Å; K93-T407 VanDerWaalsContact CD-OG1 3.31Å; K93-T407 WeakPolarHBondContact CD-OG1 3.33Å; K93-T407 PolarHBondContact NZ-OG1 2.95Å; I95-T407 HydrophobicContact CG2-CG2 3.7Å; L105-T407 HydrophobicContact CD2-CG2 3.75Å; F168-T407 HydrophobicContact CZ-CG2 4.23Å; D405-T407 PolarHBondContact O-N 3.04Å; T407-N409 PolarHBondContact O-N 2.86Å; T407-N409 VanDerWaalsContact O-N 3.15Å; T407-F410 PolarHBondContact O-N 3.27Å
408	S	91.1	Very high	83.5	Confident	67 Å²	67	72.2 Å²	72.2	47%	0.469	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-17.1	-179.3	69	0	0	0	0	114.5	K180 D406 F410	K180-S408 PolarHBondContact NZ-O 2.86Å; D406-S408 VanDerWaalsContact OD1-CB 3.27Å; D406-S408 WeakPolarHBondContact OD1-CB 3.42Å; D406-S408 PolarHBondContact OD1-N 3.3Å; D406-S408 PolarHBondContact OD1-OG 3.47Å; S408-F410 VanDerWaalsContact C-N 3.33Å
409	N	91.2	Very high	82.1	Confident	26 Å²	26	70 Å²	70	14%	0.139	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	4	175.5	-63.6	-40	0	0	0	113.5	P170 T176 K180 T407	P170-N409 WeakPolarHBondContact O-CB 3.36Å; P170-N409 PolarHBondContact O-ND2 3.4Å; T176-N409 WeakPolarHBondContact CG2-O 3.47Å; K180-N409 PolarHBondContact NZ-OD1 2.98Å; T407-N409 PolarHBondContact O-N 2.86Å; T407-N409 VanDerWaalsContact O-N 3.15Å
410	F	88.9	Confident	80.5	Confident	31 Å²	31	71.7 Å²	71.7	14%	0.136	38%	0.383	C	S	.	.	S	Bend	trans	-112.1	152.8	176.4	-63.2	-93.5	0	0	0	110.5	I95 F168 L169 T407 S408	I95-F410 HydrophobicContact CB-CD1 3.91Å; I95-F410 HydrophobicContact CB-CE1 4.3Å; I95-F410 HydrophobicContact CB-CG 4.14Å; I95-F410 HydrophobicContact CD1-CE1 4.36Å; I95-F410 HydrophobicContact CG2-CG 4.44Å; I95-F410 WeakPolarHBondContact O-CD1 3.34Å; F168-F410 HydrophobicContact CD2-CZ 4.45Å; F168-F410 HydrophobicContact CE2-CD2 4.42Å; F168-F410 AromaticContact CE2-CE2 3.48Å; F168-F410 HydrophobicContact CE2-CE2 3.48Å; F168-F410 VanDerWaalsContact CE2-CE2 3.48Å; F168-F410 AromaticContact CE2-CZ 3.55Å; F168-F410 HydrophobicContact CE2-CZ 3.55Å; F168-F410 HydrophobicContact CZ-CD2 4.46Å; F168-F410 AromaticContact CZ-CE2 3.65Å; F168-F410 HydrophobicContact CZ-CE2 3.65Å; F168-F410 HydrophobicContact CZ-CZ 4.19Å; L169-F410 VanDerWaalsContact O-CZ 3.29Å; L169-F410 WeakPolarHBondContact O-CZ 3.46Å; T407-F410 PolarHBondContact O-N 3.27Å; S408-F410 VanDerWaalsContact C-N 3.33Å
411	D	83.6	Confident	78.4	Confident	27 Å²	27	70.8 Å²	70.8	14%	0.144	38%	0.384	C	S	.	.			trans	-66.7	150.2	170	-80.2	-28.2	0	0	0	111.6	R276 F413	R276-D411 IonicContact CZ-OD1 3.54Å; R276-D411 IonicContact CZ-OD2 3Å; R276-D411 IonicContact NE-OD2 3.14Å; R276-D411 IonicContact NH1-OD1 2.93Å; R276-D411 PolarHBondContact NH1-OD1 3.22Å; R276-D411 IonicContact NH1-OD2 2.82Å; R276-D411 PolarHBondContact NH1-OD2 2.9Å; R276-D411 VanDerWaalsContact NH1-OD2 3.13Å; R276-D411 IonicContact NH2-OD1 2.76Å; R276-D411 PolarHBondContact NH2-OD1 3.32Å; R276-D411 IonicContact NH2-OD2 2.69Å; R276-D411 PolarHBondContact NH2-OD2 2.64Å; D411-F413 HydrophobicContact CB-CE2 3.88Å; D411-F413 HydrophobicContact CB-CZ 4.02Å; D411-F413 WeakPolarHBondContact O-CD2 3.46Å; D411-F413 WeakPolarHBondContact O-CE2 3.45Å
412	E	82.7	Confident	76.1	Confident	169 Å²	169	72.4 Å²	72.4	79%	0.79	40%	0.397	S	S	*	.			trans	-79.6	124	171.6	-66.4	-166.4	163.5	0	0	110.2
413	F	79.4	Confident	73.7	Confident	36 Å²	36	69.4 Å²	69.4	16%	0.158	40%	0.396	C	S	.	.			trans	-109.6	138	172.5	-63.2	-85	0	0	0	108.6	V94 I95 R97 F280 D411	V94-F413 HydrophobicContact CB-CB 4.17Å; V94-F413 HydrophobicContact CG1-CB 3.89Å; V94-F413 HydrophobicContact CG1-CD2 4.48Å; V94-F413 HydrophobicContact CG1-CG 4.27Å; I95-F413 WeakPolarHBondContact O-CE2 3.36Å; R97-F413 HydrophobicContact CB-CD1 4.31Å; R97-F413 HydrophobicContact CB-CE1 4.19Å; R97-F413 HydrophobicContact CG-CD1 3.8Å; R97-F413 HydrophobicContact CG-CE1 4.17Å; R97-F413 HydrophobicContact CG-CG 4.33Å; F280-F413 AromaticContact CE1-CE1 3.57Å; F280-F413 HydrophobicContact CE1-CE1 3.57Å; F280-F413 AromaticContact CE1-CZ 3.83Å; F280-F413 HydrophobicContact CE1-CZ 3.83Å; F280-F413 HydrophobicContact CE2-CE1 4.2Å; F280-F413 AromaticContact CZ-CE1 3.38Å; F280-F413 HydrophobicContact CZ-CE1 3.38Å; F280-F413 AromaticContact CZ-CZ 3.61Å; F280-F413 HydrophobicContact CZ-CZ 3.61Å; D411-F413 HydrophobicContact CB-CE2 3.88Å; D411-F413 HydrophobicContact CB-CZ 4.02Å; D411-F413 WeakPolarHBondContact O-CD2 3.46Å; D411-F413 WeakPolarHBondContact O-CE2 3.45Å
414	P	75.8	Confident	71.3	Confident	93 Å²	93	71.9 Å²	71.9	60%	0.604	41%	0.409	S	S	*	.			trans	-60.7	154.7	169.5	23.6	-28.1	0	0	0	109.3	R97 S416	R97-P414 PolarHBondContact NH2-O 2.98Å; P414-S416 PolarHBondContact O-N 3.05Å
415	D	66.6	Low	69.1	Low	145 Å²	145	76.6 Å²	76.6	78%	0.775	43%	0.429	S	S	*	.			trans	-60.7	137.7	173.1	-74	-38.3	0	0	0	110
416	S	65.3	Low	66.7	Low	26 Å²	26	78.9 Å²	78.9	18%	0.182	45%	0.445	C	S	.	.			trans	-118.2	139.2	-178.7	158.7	0	0	0	0	109.2	E102 R104 P414 I418	E102-S416 WeakPolarHBondContact OE2-CB 3.47Å; E102-S416 PolarHBondContact OE2-OG 2.89Å; R104-S416 PolarHBondContact NH2-O 2.93Å; P414-S416 PolarHBondContact O-N 3.05Å; S416-I418 PolarHBondContact O-N 3.1Å; S416-I418 VanDerWaalsContact O-N 3.15Å; S416-I418 PolarHBondContact OG-N 3.22Å
417	D	61.8	Low	64.3	Low	117 Å²	117	80.7 Å²	80.7	63%	0.626	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-78.8	16.7	-178.6	-86.9	-14.5	0	0	0	113.5	L419 T420	D417-L419 PolarHBondContact O-N 2.97Å; D417-T420 HydrophobicContact CB-CG2 4.25Å; D417-T420 VanDerWaalsContact CB-OG1 3.25Å; D417-T420 WeakPolarHBondContact CB-OG1 3.4Å; D417-T420 WeakPolarHBondContact O-CA 3.31Å; D417-T420 WeakPolarHBondContact O-CB 3.05Å; D417-T420 PolarHBondContact O-N 2.67Å; D417-T420 PolarHBondContact O-OG1 3Å
418	I	66.1	Low	61.9	Low	11 Å²	11	88 Å²	88	6%	0.056	50%	0.498	C	S	.	.	G	3₁₀ helix	trans	-57	-28.7	-177.3	-146	165.2	0	0	0	113.6	E102 I119 R121 S416	E102-I418 HydrophobicContact CG-CB 4.38Å; E102-I418 HydrophobicContact CG-CD1 3.97Å; E102-I418 HydrophobicContact CG-CG2 3.73Å; E102-I418 WeakPolarHBondContact OE1-CG2 3.27Å; I119-I418 HydrophobicContact CD1-CG2 3.87Å; I119-I418 HydrophobicContact CG2-CG2 4.36Å; R121-I418 HydrophobicContact CG-CD1 4.24Å; R121-I418 HydrophobicContact CG-CG1 4.41Å; S416-I418 PolarHBondContact O-N 3.1Å; S416-I418 VanDerWaalsContact O-N 3.15Å; S416-I418 PolarHBondContact OG-N 3.22Å
419	L	61.6	Low	59.7	Low	46 Å²	46	89.5 Å²	89.5	24%	0.241	50%	0.497	C	S	.	.	G	3₁₀ helix	trans	-87.9	-11.5	178.3	-66.3	-173.3	0	0	0	112.5	L86 R104 I119 Y163 D417	L86-L419 HydrophobicContact CD1-CD2 4.19Å; L86-L419 HydrophobicContact CD2-CD2 3.88Å; R104-L419 VanDerWaalsContact CZ-CD1 3.41Å; I119-L419 HydrophobicContact CD1-CD2 3.63Å; I119-L419 HydrophobicContact CD1-CG 4.16Å; I119-L419 HydrophobicContact CG1-CD2 4.48Å; Y163-L419 HydrophobicContact CE1-CD2 4.31Å; D417-L419 PolarHBondContact O-N 2.97Å
420	T	56.9	Low	57.5	Low	61 Å²	61	91.1 Å²	91.1	37%	0.374	51%	0.51	S	S	.	.	S	Bend	trans	-83.8	132.2	171.5	71.5	0	0	0	0	108.9	D417 T422	D417-T420 HydrophobicContact CB-CG2 4.25Å; D417-T420 VanDerWaalsContact CB-OG1 3.25Å; D417-T420 WeakPolarHBondContact CB-OG1 3.4Å; D417-T420 WeakPolarHBondContact O-CA 3.31Å; D417-T420 WeakPolarHBondContact O-CB 3.05Å; D417-T420 PolarHBondContact O-N 2.67Å; D417-T420 PolarHBondContact O-OG1 3Å; T420-T422 VanDerWaalsContact C-N 3.32Å; T420-T422 PolarHBondContact O-N 3.5Å
421	P	46.1	Very low	55.5	Low	115 Å²	115	96.4 Å²	96.4	75%	0.747	54%	0.535	S	S	*	.			trans	-68.1	94.1	173	25.8	-30.4	0	0	0	108.5	T423	P421-T423 PolarHBondContact O-N 3.01Å
422	T	41.6	Very low	53.8	Low	92 Å²	92	98.2 Å²	98.2	56%	0.564	55%	0.554	S	S	*	*			trans	-64.6	113	176.8	-22.3	0	0	0	0	108	T420 T424	T420-T422 VanDerWaalsContact C-N 3.32Å; T420-T422 PolarHBondContact O-N 3.5Å; T422-T424 PolarHBondContact O-N 3.22Å; T422-T424 VanDerWaalsContact O-N 3.16Å
423	T	39.1	Very low	52.3	Low	138 Å²	138	93.5 Å²	93.5	85%	0.847	53%	0.534	S	S	*	.			trans	-75.3	9.9	175.1	-33.7	0	0	0	0	111.8	P421	P421-T423 PolarHBondContact O-N 3.01Å
424	T	41.3	Very low	50.9	Low	105 Å²	105	94.4 Å²	94.4	64%	0.644	54%	0.541	S	S	*	.	S	Bend	trans	-133.9	128	-170.3	25.7	0	0	0	0	111.5	T422	T422-T424 PolarHBondContact O-N 3.22Å; T422-T424 VanDerWaalsContact O-N 3.16Å
425	Q	38.8	Very low	49.8	Very low	192 Å²	192	97.2 Å²	97.2	90%	0.897	54%	0.543	S	S	*	.			trans	80.3	61.3	-177.5	-52.9	-163.5	2.5	0	0	115.6	S427	Q425-S427 PolarHBondContact O-N 3.39Å; Q425-S427 VanDerWaalsContact O-N 3.14Å
426	V	38.5	Very low	49.2	Very low	122 Å²	122	94.1 Å²	94.1	74%	0.739	53%	0.527	S	S	*	.			trans	-55.8	110.6	151.1	-178.4	0	0	0	0	107.1
427	S	42.3	Very low	48.9	Very low	58 Å²	58	98 Å²	98	41%	0.406	54%	0.54	S	S	.	.			trans	-49.5	149.8	152.3	48.6	0	0	0	0	108.3	Q425 H429	Q425-S427 PolarHBondContact O-N 3.39Å; Q425-S427 VanDerWaalsContact O-N 3.14Å; S427-H429 PolarHBondContact O-N 3.01Å
428	N	41	Very low	49.1	Very low	172 Å²	172	95.3 Å²	95.3	92%	0.92	53%	0.526	S	S	*	.	S	Bend	trans	-56.6	14.5	-174.3	-81.1	-21.1	0	0	0	116.9
429	H	44.9	Very low	49.1	Very low	98 Å²	98	100.8 Å²	100.8	45%	0.454	55%	0.546	S	S	.	.			trans	-90.3	122.9	173.3	-65.3	-56	0	0	0	110.8	S427 D433	S427-H429 PolarHBondContact O-N 3.01Å; H429-D433 HydrophobicContact CB-CB 4.3Å
430	S	45.8	Very low	49.2	Very low	59 Å²	59	99.7 Å²	99.7	41%	0.413	54%	0.542	S	S	.	.			trans	-62.4	150	174.9	66.2	0	0	0	0	110.4	A432 D433	S430-A432 PolarHBondContact O-N 3.2Å; S430-D433 PolarHBondContact N-OD2 3.46Å; S430-D433 WeakPolarHBondContact O-CB 3.29Å; S430-D433 PolarHBondContact O-N 2.94Å; S430-D433 PolarHBondContact OG-N 3.46Å; S430-D433 PolarHBondContact OG-OD2 3.11Å
431	E	46.7	Very low	50	Low	142 Å²	142	97.1 Å²	97.1	66%	0.664	53%	0.525	S	S	*	.	H	α-helix	trans	-54.3	-22	174	-160.8	-175.2	167.1	0	0	112.3	K435	E431-K435 PolarHBondContact O-N 3.17Å
432	A	48.9	Very low	50.9	Low	65 Å²	65	93.6 Å²	93.6	54%	0.537	50%	0.499	S	S	.	.	H	α-helix	trans	-69.5	-38.1	171.8	0	0	0	0	0	113.1	S430 K435 N436	S430-A432 PolarHBondContact O-N 3.2Å; A432-K435 PolarHBondContact O-N 2.94Å; A432-N436 WeakPolarHBondContact O-CB 3.46Å; A432-N436 PolarHBondContact O-N 3.22Å
433	D	50.3	Low	52.2	Low	70 Å²	70	92.1 Å²	92.1	37%	0.374	49%	0.488	S	S	.	.	H	α-helix	trans	-68.9	-36.4	179.6	-69.9	-49	0	0	0	112.7	H429 S430 N436 K437	H429-D433 HydrophobicContact CB-CB 4.3Å; S430-D433 PolarHBondContact N-OD2 3.46Å; S430-D433 WeakPolarHBondContact O-CB 3.29Å; S430-D433 PolarHBondContact O-N 2.94Å; S430-D433 PolarHBondContact OG-N 3.46Å; S430-D433 PolarHBondContact OG-OD2 3.11Å; D433-N436 PolarHBondContact O-N 2.95Å; D433-K437 PolarHBondContact O-N 3.37Å
434	L	49.7	Very low	54	Low	56 Å²	56	85.7 Å²	85.7	29%	0.293	45%	0.449	S	S	.	.	H	α-helix	trans	-66.2	-45	174	-84.1	144.6	0	0	0	111.3	N436 K437 D438	L434-N436 VanDerWaalsContact C-N 3.28Å; L434-N436 PolarHBondContact O-N 3.12Å; L434-K437 PolarHBondContact O-N 2.97Å; L434-D438 PolarHBondContact O-N 2.94Å; L434-D438 VanDerWaalsContact O-N 3.15Å
435	K	52.4	Low	55.9	Low	151 Å²	151	84.7 Å²	84.7	66%	0.657	44%	0.442	S	S	*	.	H	α-helix	trans	-61.5	-35.8	172.2	-88.3	179.2	179.2	167.5	0	112.5	E431 A432 K437	E431-K435 PolarHBondContact O-N 3.17Å; A432-K435 PolarHBondContact O-N 2.94Å; K435-K437 VanDerWaalsContact C-N 3.26Å; K435-K437 PolarHBondContact O-N 3.36Å
436	N	53.7	Low	58	Low	80 Å²	80	78.3 Å²	78.3	43%	0.428	41%	0.411	S	S	.	.	H	α-helix	trans	-75.6	-14.1	-177.4	-138.4	19.5	0	0	0	113.5	E18 A432 D433 L434 W439	E18-N436 PolarHBondContact OE2-ND2 3.01Å; A432-N436 WeakPolarHBondContact O-CB 3.46Å; A432-N436 PolarHBondContact O-N 3.22Å; D433-N436 PolarHBondContact O-N 2.95Å; L434-N436 VanDerWaalsContact C-N 3.28Å; L434-N436 PolarHBondContact O-N 3.12Å; N436-W439 PolarHBondContact O-NE1 3.49Å
437	K	60.3	Low	60	Low	108 Å²	108	73.5 Å²	73.5	47%	0.47	38%	0.379	S	S	.	.	H	α-helix	trans	-111.2	-4.5	177.5	-68.4	-177	179.2	179.8	0	114.3	L126 D433 L434 K435 W439 V440	L126-K437 HydrophobicContact CD1-CB 4.11Å; L126-K437 HydrophobicContact CD1-CD 4.49Å; L126-K437 HydrophobicContact CD2-CB 4.34Å; L126-K437 HydrophobicContact CD2-CD 4.49Å; D433-K437 PolarHBondContact O-N 3.37Å; L434-K437 PolarHBondContact O-N 2.97Å; K435-K437 VanDerWaalsContact C-N 3.26Å; K435-K437 PolarHBondContact O-N 3.36Å; K437-W439 PolarHBondContact O-N 2.91Å; K437-W439 VanDerWaalsContact O-N 3.08Å; K437-V440 WeakPolarHBondContact O-CG1 3.17Å; K437-V440 WeakPolarHBondContact O-CG2 3.22Å; K437-V440 PolarHBondContact O-N 3.3Å; K437-V440 VanDerWaalsContact O-N 3.08Å
438	D	65.5	Low	61.9	Low	61 Å²	61	70.9 Å²	70.9	33%	0.326	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-62.3	-22	-176.8	-139.3	20.4	0	0	0	113.3	K122 L434 V440 F441	K122-D438 IonicContact NZ-OD1 2.7Å; K122-D438 PolarHBondContact NZ-OD1 3.34Å; K122-D438 IonicContact NZ-OD2 3.5Å; L434-D438 PolarHBondContact O-N 2.94Å; L434-D438 VanDerWaalsContact O-N 3.15Å; D438-V440 PolarHBondContact O-N 2.95Å; D438-V440 VanDerWaalsContact O-N 3.14Å; D438-F441 PolarHBondContact O-N 2.92Å
439	W	65.1	Low	63.5	Low	125 Å²	125	64 Å²	64	47%	0.473	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-59.8	-22.1	175.2	71.1	-89.9	0	0	0	113.5	N436 K437 F441 I442	N436-W439 PolarHBondContact O-NE1 3.49Å; K437-W439 PolarHBondContact O-N 2.91Å; K437-W439 VanDerWaalsContact O-N 3.08Å; W439-F441 PolarHBondContact O-N 3.3Å; W439-I442 HydrophobicContact CB-CD1 3.73Å; W439-I442 HydrophobicContact CB-CG1 4.4Å; W439-I442 VanDerWaalsContact O-CB 3.31Å; W439-I442 WeakPolarHBondContact O-CB 3.45Å; W439-I442 WeakPolarHBondContact O-CD1 3.34Å; W439-I442 WeakPolarHBondContact O-CG1 3.4Å; W439-I442 PolarHBondContact O-N 3.46Å; W439-I442 VanDerWaalsContact O-N 3.09Å
440	V	65.6	Low	64.7	Low	24 Å²	24	62.6 Å²	62.6	15%	0.145	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-68.3	-15.8	176.8	-52.7	0	0	0	0	112.7	L126 V131 R135 K437 D438	L126-V440 HydrophobicContact CD2-CG2 3.9Å; V131-V440 HydrophobicContact CG1-CB 4.03Å; V131-V440 HydrophobicContact CG1-CG2 3.9Å; V131-V440 HydrophobicContact CG2-CG2 3.89Å; R135-V440 PolarHBondContact NE-O 2.89Å; R135-V440 PolarHBondContact NH2-O 3.34Å; K437-V440 WeakPolarHBondContact O-CG1 3.17Å; K437-V440 WeakPolarHBondContact O-CG2 3.22Å; K437-V440 PolarHBondContact O-N 3.3Å; K437-V440 VanDerWaalsContact O-N 3.08Å; D438-V440 PolarHBondContact O-N 2.95Å; D438-V440 VanDerWaalsContact O-N 3.14Å
441	F	71.9	Confident	65.4	Low	6 Å²	6	60 Å²	60	3%	0.026	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-102	13.8	174.7	-53.7	-67.7	0	0	0	112.6	K122 M125 L126 V131 I134 Q157 L162 D438 W439 Y444	K122-F441 HydrophobicContact CB-CE2 4.13Å; K122-F441 HydrophobicContact CB-CZ 4.43Å; K122-F441 HydrophobicContact CD-CD2 4.06Å; K122-F441 HydrophobicContact CD-CE2 4.04Å; K122-F441 HydrophobicContact CG-CD2 4.29Å; K122-F441 HydrophobicContact CG-CE2 3.89Å; K122-F441 HydrophobicContact CG-CZ 4.26Å; M125-F441 HydrophobicContact CB-CZ 4.32Å; L126-F441 HydrophobicContact CD1-CE2 4.49Å; L126-F441 HydrophobicContact CD2-CE2 4.37Å; L126-F441 HydrophobicContact CD2-CZ 4.31Å; L126-F441 HydrophobicContact CG-CE2 4.34Å; L126-F441 HydrophobicContact CG-CZ 4.29Å; V131-F441 HydrophobicContact CB-CE1 4.44Å; V131-F441 HydrophobicContact CG1-CD1 4.32Å; V131-F441 HydrophobicContact CG1-CE1 4.02Å; V131-F441 HydrophobicContact CG2-CE1 3.89Å; V131-F441 HydrophobicContact CG2-CZ 3.92Å; I134-F441 HydrophobicContact CD1-CE1 4.26Å; Q157-F441 PolarHBondContact NE2-O 2.99Å; Q157-F441 VanDerWaalsContact OE1-CB 3.27Å; L162-F441 HydrophobicContact CD1-CD1 3.73Å; L162-F441 HydrophobicContact CD1-CE1 3.66Å; L162-F441 HydrophobicContact CD1-CZ 4.44Å; L162-F441 HydrophobicContact CD2-CB 4.24Å; L162-F441 HydrophobicContact CD2-CD1 3.97Å; L162-F441 HydrophobicContact CD2-CG 4.02Å; L162-F441 HydrophobicContact CG-CD1 4.42Å; D438-F441 PolarHBondContact O-N 2.92Å; W439-F441 PolarHBondContact O-N 3.3Å; F441-Y444 WeakPolarHBondContact O-CB 3.37Å; F441-Y444 PolarHBondContact O-N 3.48Å
442	I	65.9	Low	65.8	Low	41 Å²	41	54.7 Å²	54.7	21%	0.21	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	142.3	169.3	-72	167.6	0	0	0	109.3	M22 W439 Y444	M22-I442 HydrophobicContact CG-CD1 4.48Å; W439-I442 HydrophobicContact CB-CD1 3.73Å; W439-I442 HydrophobicContact CB-CG1 4.4Å; W439-I442 VanDerWaalsContact O-CB 3.31Å; W439-I442 WeakPolarHBondContact O-CB 3.45Å; W439-I442 WeakPolarHBondContact O-CD1 3.34Å; W439-I442 WeakPolarHBondContact O-CG1 3.4Å; W439-I442 PolarHBondContact O-N 3.46Å; W439-I442 VanDerWaalsContact O-N 3.09Å; I442-Y444 PolarHBondContact O-N 3.48Å
443	N	69.3	Low	65.8	Low	62 Å²	62	54.8 Å²	54.8	33%	0.332	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	5.4	-172.2	-58.4	-23	0	0	0	115.9	N29 R138 T445	N29-N443 PolarHBondContact ND2-ND2 3.45Å; N29-N443 PolarHBondContact OD1-ND2 3.3Å; N29-N443 VanDerWaalsContact OD1-ND2 3.1Å; R138-N443 PolarHBondContact NH1-O 3.04Å; N443-T445 PolarHBondContact O-N 2.87Å; N443-T445 VanDerWaalsContact O-N 3.15Å
444	Y	75.4	Confident	65.6	Low	3 Å²	3	52.1 Å²	52.1	1%	0.012	26%	0.257	C	S	.	.			trans	-57.1	-31	176.9	-173.1	-98.6	0	0	0	112.7	I134 R138 S155 F156 Q157 L162 Y163 L164 F441 I442 Y446	I134-Y444 HydrophobicContact CG2-CD2 4.21Å; I134-Y444 HydrophobicContact CG2-CE2 3.54Å; R138-Y444 VanDerWaalsContact NH1-CA 3.34Å; S155-Y444 WeakPolarHBondContact CB-O 3.02Å; S155-Y444 PolarHBondContact OG-O 3.06Å; F156-Y444 WeakPolarHBondContact O-CD1 2.98Å; F156-Y444 WeakPolarHBondContact O-CE1 3.15Å; Q157-Y444 HydrophobicContact CB-CD1 4.16Å; L162-Y444 HydrophobicContact CB-CD1 4.49Å; L162-Y444 HydrophobicContact CB-CE1 3.78Å; L162-Y444 HydrophobicContact CB-CE2 4.26Å; L162-Y444 HydrophobicContact CD1-CD2 4.37Å; L162-Y444 HydrophobicContact CD1-CE2 4.05Å; L162-Y444 HydrophobicContact CD2-CD1 3.96Å; L162-Y444 HydrophobicContact CD2-CD2 4.33Å; L162-Y444 HydrophobicContact CD2-CE1 4.09Å; L162-Y444 HydrophobicContact CD2-CE2 4.47Å; L162-Y444 HydrophobicContact CD2-CG 4.07Å; L162-Y444 HydrophobicContact CG-CE1 4.44Å; Y163-Y444 WeakPolarHBondContact O-CE1 3.36Å; L164-Y444 WeakPolarHBondContact CD1-OH 3.36Å; L164-Y444 VanDerWaalsContact CG-OH 3.22Å; L164-Y444 WeakPolarHBondContact CG-OH 3.39Å; F441-Y444 WeakPolarHBondContact O-CB 3.37Å; F441-Y444 PolarHBondContact O-N 3.48Å; I442-Y444 PolarHBondContact O-N 3.48Å; Y444-Y446 PolarHBondContact O-N 3.29Å
445	T	81.5	Confident	65.1	Low	84 Å²	84	56.2 Å²	56.2	52%	0.515	27%	0.268	S	S	.	.			trans	-71.2	122.4	-177.8	-52.1	0	0	0	0	112.5	S155 N443	S155-T445 CarbonylContact O-C 3.57Å; S155-T445 VanDerWaalsContact O-CA 3.23Å; S155-T445 WeakPolarHBondContact O-CA 3.3Å; S155-T445 WeakPolarHBondContact O-CG2 3.29Å; N443-T445 PolarHBondContact O-N 2.87Å; N443-T445 VanDerWaalsContact O-N 3.15Å
446	Y	83.1	Confident	64.5	Low	58 Å²	58	52.9 Å²	52.9	23%	0.227	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	151.3	177.9	170	-95.8	0	0	0	111.3	V142 M152 Y154 S155 Y444 R448	V142-Y446 HydrophobicContact CB-CE2 4.28Å; V142-Y446 HydrophobicContact CG1-CD2 4.14Å; V142-Y446 HydrophobicContact CG1-CE2 3.54Å; V142-Y446 HydrophobicContact CG2-CD1 3.91Å; V142-Y446 HydrophobicContact CG2-CD2 3.71Å; V142-Y446 HydrophobicContact CG2-CE1 3.94Å; V142-Y446 HydrophobicContact CG2-CE2 3.76Å; V142-Y446 HydrophobicContact CG2-CG 3.77Å; M152-Y446 HydrophobicContact CE-CD1 3.42Å; M152-Y446 VanDerWaalsContact CE-CD1 3.42Å; M152-Y446 HydrophobicContact CE-CE1 3.75Å; M152-Y446 HydrophobicContact CE-CG 4.17Å; Y154-Y446 VanDerWaalsContact CA-O 3.31Å; Y154-Y446 WeakPolarHBondContact CA-O 3.29Å; S155-Y446 PolarHBondContact N-O 3.46Å; S155-Y446 PolarHBondContact O-N 3.07Å; S155-Y446 VanDerWaalsContact OG-CB 3.29Å; S155-Y446 WeakPolarHBondContact OG-CB 3.34Å; S155-Y446 PolarHBondContact OG-N 3.07Å; Y444-Y446 PolarHBondContact O-N 3.29Å; Y446-R448 HydrophobicContact CE1-CB 3.76Å
447	K	80.5	Confident	63.5	Low	20 Å²	20	51.7 Å²	51.7	9%	0.087	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	119.7	173.3	-56.2	-170	-169.6	-165.1	0	110.6	F76 L79 T82 L84 Y154	F76-K447 WeakPolarHBondContact CE2-O 3.34Å; F76-K447 WeakPolarHBondContact CZ-O 3.47Å; L79-K447 HydrophobicContact CD1-CD 4.35Å; L79-K447 HydrophobicContact CD2-CD 4.45Å; L79-K447 HydrophobicContact CG-CD 3.89Å; L79-K447 PolarHBondContact O-NZ 3.37Å; T82-K447 PolarHBondContact O-NZ 2.98Å; L84-K447 HydrophobicContact CD1-CD 4.01Å; L84-K447 HydrophobicContact CD1-CG 4.38Å; Y154-K447 HydrophobicContact CD1-CB 4.24Å; Y154-K447 HydrophobicContact CD1-CG 4.27Å
448	R	81.9	Confident	62.2	Low	4 Å²	4	51.7 Å²	51.7	2%	0.015	28%	0.282	C	S	.	.			trans	-75.3	140.4	178.2	-167.6	173.4	-62.1	-135.5	4.9	111.5	L141 D145 K151 M152 F153 Y446 E450 G451	L141-R448 PolarHBondContact O-NH2 3.39Å; D145-R448 IonicContact OD1-NH1 3.72Å; K151-R448 VanDerWaalsContact CE-CD 3.44Å; M152-R448 PolarHBondContact O-NE 3.03Å; M152-R448 PolarHBondContact O-NH2 2.92Å; F153-R448 WeakPolarHBondContact O-CB 3.14Å; F153-R448 PolarHBondContact O-N 2.86Å; Y446-R448 HydrophobicContact CE1-CB 3.76Å; R448-E450 VanDerWaalsContact CD-OE2 3.24Å; R448-E450 WeakPolarHBondContact CD-OE2 3.35Å; R448-E450 HydrophobicContact CG-CB 4.42Å; R448-E450 WeakPolarHBondContact CG-OE2 3.43Å; R448-G451 PolarHBondContact O-N 3.49Å; R448-G451 VanDerWaalsContact O-N 3.07Å
449	F	75.7	Confident	60.9	Low	27 Å²	27	50.6 Å²	50.6	12%	0.118	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.1	-45.7	176.7	-173.9	-103.4	0	0	0	112.1	K72 E73 F76 G451 L452	K72-F449 HydrophobicContact CB-CZ 3.93Å; E73-F449 HydrophobicContact CG-CE2 4.23Å; E73-F449 HydrophobicContact CG-CZ 4.25Å; E73-F449 WeakPolarHBondContact OE1-CE2 3.38Å; F76-F449 HydrophobicContact CB-CD2 3.8Å; F76-F449 HydrophobicContact CB-CE2 3.78Å; F76-F449 AromaticContact CD1-CD2 3.51Å; F76-F449 HydrophobicContact CD1-CD2 3.51Å; F76-F449 HydrophobicContact CD1-CE2 4.06Å; F76-F449 AromaticContact CD2-CD2 3.92Å; F76-F449 HydrophobicContact CD2-CD2 3.92Å; F76-F449 HydrophobicContact CE1-CB 4.45Å; F76-F449 AromaticContact CE1-CD2 3.89Å; F76-F449 HydrophobicContact CE1-CD2 3.89Å; F76-F449 HydrophobicContact CE2-CB 4.21Å; F76-F449 HydrophobicContact CE2-CD2 4.32Å; F76-F449 AromaticContact CG-CD2 3.48Å; F76-F449 HydrophobicContact CG-CD2 3.48Å; F76-F449 VanDerWaalsContact CG-CD2 3.48Å; F76-F449 AromaticContact CG-CE2 3.98Å; F76-F449 HydrophobicContact CG-CE2 3.98Å; F76-F449 HydrophobicContact CZ-CB 4.14Å; F76-F449 HydrophobicContact CZ-CD2 4.28Å; F449-G451 PolarHBondContact O-N 3.47Å; F449-G451 VanDerWaalsContact O-N 3.14Å; F449-L452 HydrophobicContact CD2-CD1 4.36Å; F449-L452 HydrophobicContact CE2-CD1 4.43Å; F449-L452 WeakPolarHBondContact O-CB 3.38Å; F449-L452 WeakPolarHBondContact O-CD1 3.38Å; F449-L452 WeakPolarHBondContact O-CG 3.41Å; F449-L452 PolarHBondContact O-N 3.09Å; F449-L452 VanDerWaalsContact O-N 3.17Å
450	E	70.5	Confident	59.4	Low	68 Å²	68	49.6 Å²	49.6	32%	0.318	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-65.9	-14.5	176.3	-61.9	72	-150.4	0	0	112.7	R448 L452 T453	R448-E450 VanDerWaalsContact CD-OE2 3.24Å; R448-E450 WeakPolarHBondContact CD-OE2 3.35Å; R448-E450 HydrophobicContact CG-CB 4.42Å; R448-E450 WeakPolarHBondContact CG-OE2 3.43Å; E450-L452 PolarHBondContact O-N 3.03Å; E450-T453 PolarHBondContact O-N 3.41Å; E450-T453 PolarHBondContact O-OG1 3.26Å
451	G	59.4	Low	58.5	Low	5 Å²	5	54.1 Å²	54.1	5%	0.052	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-61.5	-9.6	171.7	0	0	0	0	0	113.9	Y154 R448 F449	Y154-G451 PolarHBondContact OH-O 2.89Å; R448-G451 PolarHBondContact O-N 3.49Å; R448-G451 VanDerWaalsContact O-N 3.07Å; F449-G451 PolarHBondContact O-N 3.47Å; F449-G451 VanDerWaalsContact O-N 3.14Å
452	L	55.3	Low	56.9	Low	31 Å²	31	57.8 Å²	57.8	16%	0.162	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-81.4	-29.4	173	-68.9	159.6	0	0	0	113.6	E75 F76 L79 F449 E450 A454 R455	E75-L452 HydrophobicContact CB-CD2 4.07Å; F76-L452 HydrophobicContact CB-CD1 3.46Å; F76-L452 VanDerWaalsContact CB-CD1 3.46Å; F76-L452 HydrophobicContact CD2-CD1 3.78Å; F76-L452 HydrophobicContact CD2-CG 4.43Å; F76-L452 HydrophobicContact CG-CD1 4.02Å; L79-L452 HydrophobicContact CB-CD2 4.12Å; L79-L452 HydrophobicContact CD2-CD2 3.86Å; L79-L452 HydrophobicContact CD2-CG 4.16Å; F449-L452 HydrophobicContact CD2-CD1 4.36Å; F449-L452 HydrophobicContact CE2-CD1 4.43Å; F449-L452 WeakPolarHBondContact O-CB 3.38Å; F449-L452 WeakPolarHBondContact O-CD1 3.38Å; F449-L452 WeakPolarHBondContact O-CG 3.41Å; F449-L452 PolarHBondContact O-N 3.09Å; F449-L452 VanDerWaalsContact O-N 3.17Å; E450-L452 PolarHBondContact O-N 3.03Å; L452-A454 PolarHBondContact O-N 2.81Å; L452-R455 PolarHBondContact O-N 3.09Å
453	T	48.3	Very low	55.4	Low	67 Å²	67	63.9 Å²	63.9	41%	0.411	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-11.6	-172.5	53.7	0	0	0	0	112.9	E450 R455 A457	E450-T453 PolarHBondContact O-N 3.41Å; E450-T453 PolarHBondContact O-OG1 3.26Å; T453-R455 PolarHBondContact O-N 3.2Å; T453-A457 WeakPolarHBondContact O-CB 3.41Å
454	A	47.3	Very low	53.8	Low	14 Å²	14	65.9 Å²	65.9	12%	0.116	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.8	172.5	0	0	0	0	0	114	H113 L452 G456	H113-A454 HydrophobicContact CB-CB 4.35Å; L452-A454 PolarHBondContact O-N 2.81Å; A454-G456 PolarHBondContact O-N 2.98Å; A454-G456 VanDerWaalsContact O-N 3.11Å
455	R	38.4	Very low	51.8	Low	142 Å²	142	69 Å²	69	54%	0.536	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	93.8	163.3	-81.2	-173.5	178.1	-175.9	-1.3	109.9	E75 D110 T111 L452 T453 A457	E75-R455 IonicContact OE2-NH1 3.89Å; D110-R455 IonicContact OD2-NH2 3.58Å; D110-R455 PolarHBondContact OD2-NH2 3.28Å; D110-R455 VanDerWaalsContact OD2-NH2 3.11Å; T111-R455 HydrophobicContact CG2-CG 3.55Å; L452-R455 PolarHBondContact O-N 3.09Å; T453-R455 PolarHBondContact O-N 3.2Å; R455-A457 VanDerWaalsContact C-N 3.33Å; R455-A457 PolarHBondContact O-N 2.9Å
456	G	39.8	Very low	49.5	Very low	80 Å²	80	74.6 Å²	74.6	83%	0.825	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	5.4	167.2	0	0	0	0	0	116.5	A454 I458	A454-G456 PolarHBondContact O-N 2.98Å; A454-G456 VanDerWaalsContact O-N 3.11Å; G456-I458 PolarHBondContact O-N 2.91Å
457	A	33.3	Very low	47	Very low	56 Å²	56	87.4 Å²	87.4	46%	0.463	47%	0.466	S	S	.	.			trans	-88.6	105.7	169.2	0	0	0	0	0	110.2	T453 R455 P459	T453-A457 WeakPolarHBondContact O-CB 3.41Å; R455-A457 VanDerWaalsContact C-N 3.33Å; R455-A457 PolarHBondContact O-N 2.9Å; A457-P459 WeakPolarHBondContact O-CD 3.39Å
458	I	32.9	Very low	45.3	Very low	108 Å²	108	90.8 Å²	90.8	55%	0.554	49%	0.485	S	S	*	.			trans	-53.1	119.4	156.6	-73.3	171	0	0	0	107.1	G456 M462	G456-I458 PolarHBondContact O-N 2.91Å; I458-M462 HydrophobicContact CB-SD 4.46Å; I458-M462 HydrophobicContact CG2-CB 3.17Å; I458-M462 HydrophobicContact CG2-CG 4Å; I458-M462 HydrophobicContact CG2-SD 3.69Å
459	P	37.3	Very low	43.4	Very low	37 Å²	37	95.4 Å²	95.4	24%	0.24	51%	0.51	C	S	.	.			trans	-49.9	147.3	178.7	-29.6	36.2	0	0	0	112	A457 Y461 M462	A457-P459 WeakPolarHBondContact O-CD 3.39Å; P459-Y461 HydrophobicContact CB-CD1 3.45Å; P459-Y461 VanDerWaalsContact CB-CD1 3.45Å; P459-Y461 HydrophobicContact CB-CD2 4.29Å; P459-Y461 HydrophobicContact CB-CE1 3.09Å; P459-Y461 HydrophobicContact CB-CE2 3.98Å; P459-Y461 HydrophobicContact CB-CG 4.05Å; P459-Y461 HydrophobicContact CG-CE1 3.74Å; P459-Y461 HydrophobicContact CG-CE2 4.32Å; P459-Y461 WeakPolarHBondContact CG-OH 2.81Å; P459-Y461 PolarHBondContact O-N 2.93Å; P459-M462 HydrophobicContact CG-CE 4.43Å; P459-M462 WeakPolarHBondContact O-CB 3.34Å; P459-M462 PolarHBondContact O-N 2.96Å
460	S	34.6	Very low	41.6	Very low	105 Å²	105	99.2 Å²	99.2	73%	0.734	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-55.3	-30.8	-177.1	46.8	0	0	0	0	113.3	M462 K463	S460-M462 PolarHBondContact O-N 3.04Å; S460-K463 WeakPolarHBondContact O-CB 3.33Å; S460-K463 PolarHBondContact O-N 3.06Å
461	Y	45.5	Very low	39.9	Very low	118 Å²	118	101 Å²	101	46%	0.463	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-65.7	-16.4	174.4	64.1	-106.8	0	0	0	114.4	P459 S464	P459-Y461 HydrophobicContact CB-CD1 3.45Å; P459-Y461 VanDerWaalsContact CB-CD1 3.45Å; P459-Y461 HydrophobicContact CB-CD2 4.29Å; P459-Y461 HydrophobicContact CB-CE1 3.09Å; P459-Y461 HydrophobicContact CB-CE2 3.98Å; P459-Y461 HydrophobicContact CB-CG 4.05Å; P459-Y461 HydrophobicContact CG-CE1 3.74Å; P459-Y461 HydrophobicContact CG-CE2 4.32Å; P459-Y461 WeakPolarHBondContact CG-OH 2.81Å; P459-Y461 PolarHBondContact O-N 2.93Å; Y461-S464 PolarHBondContact O-OG 3.11Å
462	M	38.5	Very low	38.7	Very low	84 Å²	84	107 Å²	107	41%	0.414	58%	0.575	S	S	.	*	G	3₁₀ helix	trans	-88.5	-5.5	172.6	-72.2	-172.5	-170.3	0	0	112.8	I404 I458 P459 S460	I404-M462 HydrophobicContact CG2-CE 3.46Å; I404-M462 VanDerWaalsContact CG2-CE 3.46Å; I458-M462 HydrophobicContact CB-SD 4.46Å; I458-M462 HydrophobicContact CG2-CB 3.17Å; I458-M462 HydrophobicContact CG2-CG 4Å; I458-M462 HydrophobicContact CG2-SD 3.69Å; P459-M462 HydrophobicContact CG-CE 4.43Å; P459-M462 WeakPolarHBondContact O-CB 3.34Å; P459-M462 PolarHBondContact O-N 2.96Å; S460-M462 PolarHBondContact O-N 3.04Å
463	K	34.5	Very low	37.6	Very low	168 Å²	168	112.1 Å²	112.1	73%	0.73	60%	0.602	S	S	*	*	S	Bend	trans	-85.2	-16.4	174.9	-69.1	-174.3	177.6	-179.3	0	113.1	S460 G465	S460-K463 WeakPolarHBondContact O-CB 3.33Å; S460-K463 PolarHBondContact O-N 3.06Å; K463-G465 PolarHBondContact O-N 3.3Å
464	S	35	Very low	36.8	Very low	104 Å²	104	115.3 Å²	115.3	73%	0.727	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	72.9	177.2	54	0	0	0	0	111.1	Y461	Y461-S464 PolarHBondContact O-OG 3.11Å
465	G	34.8	Very low	36	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-164.4	5.2	175.8	0	0	0	0	0	115.5	K463	K463-G465 PolarHBondContact O-N 3.3Å
466	K	33.1	Very low	35.8	Very low	202 Å²	202	121.5 Å²	121.5	88%	0.878	66%	0.664	S	S	*	*			trans	-135.1	82.8	172.7	-72.2	-170.6	179.1	-177.8	0	110.1
467	R	30.7	Very low	35.5	Very low	327 Å²	327	125.3 Å²	125.3	100%	1.234	65%	0.65	S	S	*	*			trans	-138.7	0	140.2	-83.2	-164	176.3	174.8	-0.9	108.4

Retrieved 467 of 467 residues in 93 ms (Link to these results)

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