A0A077ZPR3_TRITR Loading...

Arf GAP with coiled coil, ANK repeat and PH

AlphaFold DB , UniProt , Accession A0A077ZPR3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 586 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	50	Low	60.6	Low	230 Å²	230	131.5 Å²	131.5	100%	1.133	64%	0.639	S	S	*	*				0	-17.9	0	-97.7	172.5	-176.9	0	0	115.8
2	N	56.9	Low	61.9	Low	129 Å²	129	131.4 Å²	131.4	69%	0.69	63%	0.632	S	S	*	*	H	α-helix	trans	-92.6	-16.3	-168.1	-93.9	-17.5	0	0	0	118.7	W6	N2-W6 PolarHBondContact O-N 3.09Å
3	R	56.6	Low	63.6	Low	225 Å²	225	129.7 Å²	129.7	85%	0.849	62%	0.623	S	S	*	*	H	α-helix	trans	-78.9	-36.9	-173.9	-78.9	-173.5	171.9	-158.7	-1.7	114.6	W6 V7	R3-W6 WeakPolarHBondContact O-CB 3.34Å; R3-W6 PolarHBondContact O-N 3.34Å; R3-V7 WeakPolarHBondContact O-CG2 3.28Å; R3-V7 PolarHBondContact O-N 2.89Å; R3-V7 VanDerWaalsContact O-N 3.11Å
4	I	58.4	Low	65.1	Low	126 Å²	126	126.7 Å²	126.7	65%	0.646	61%	0.608	S	S	*	*	H	α-helix	trans	-68.4	-43.4	-178.6	-71.6	166.3	0	0	0	111.6	W6 V7 H8	I4-W6 VanDerWaalsContact C-N 3.28Å; I4-W6 PolarHBondContact O-N 3.06Å; I4-V7 PolarHBondContact O-N 3.14Å; I4-H8 PolarHBondContact O-N 3.12Å
5	N	61.3	Low	66.2	Low	113 Å²	113	126.7 Å²	126.7	60%	0.604	61%	0.61	S	S	*	*	H	α-helix	trans	-61.8	-38.5	174.7	-85.7	-8.1	0	0	0	111.5	H8 T9	N5-H8 PolarHBondContact O-N 2.99Å; N5-T9 PolarHBondContact O-N 3.42Å; N5-T9 PolarHBondContact O-OG1 3.45Å
6	W	60.8	Low	67.3	Low	182 Å²	182	126.3 Å²	126.3	69%	0.689	61%	0.611	S	S	*	*	H	α-helix	trans	-59.6	-47.1	174.7	-104	84.6	0	0	0	112.2	N2 R3 I4 H8 T9 S10	N2-W6 PolarHBondContact O-N 3.09Å; R3-W6 WeakPolarHBondContact O-CB 3.34Å; R3-W6 PolarHBondContact O-N 3.34Å; I4-W6 VanDerWaalsContact C-N 3.28Å; I4-W6 PolarHBondContact O-N 3.06Å; W6-H8 PolarHBondContact O-N 3.43Å; W6-T9 VanDerWaalsContact CA-OG1 3.26Å; W6-T9 WeakPolarHBondContact CA-OG1 3.09Å; W6-T9 PolarHBondContact O-N 3.37Å; W6-T9 PolarHBondContact O-OG1 3.38Å; W6-S10 PolarHBondContact O-N 2.82Å; W6-S10 PolarHBondContact O-OG 3.49Å; W6-S10 VanDerWaalsContact O-OG 3.08Å
7	V	62.4	Low	68.6	Low	87 Å²	87	126.2 Å²	126.2	53%	0.527	61%	0.61	S	S	.	*	H	α-helix	trans	-61.1	-43.1	176.1	175.5	0	0	0	0	111.4	R3 I4 S10 K11	R3-V7 WeakPolarHBondContact O-CG2 3.28Å; R3-V7 PolarHBondContact O-N 2.89Å; R3-V7 VanDerWaalsContact O-N 3.11Å; I4-V7 PolarHBondContact O-N 3.14Å; V7-S10 WeakPolarHBondContact O-CA 3.21Å; V7-S10 WeakPolarHBondContact O-CB 3.34Å; V7-S10 PolarHBondContact O-N 2.98Å; V7-S10 VanDerWaalsContact O-N 3.16Å; V7-K11 WeakPolarHBondContact O-CG 3.47Å; V7-K11 PolarHBondContact O-N 3.18Å
8	H	61.5	Low	69.7	Low	127 Å²	127	122.7 Å²	122.7	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-66.1	-38.5	176.1	-94.3	-79.1	0	0	0	113.1	I4 N5 W6 S10 K11	I4-H8 PolarHBondContact O-N 3.12Å; N5-H8 PolarHBondContact O-N 2.99Å; W6-H8 PolarHBondContact O-N 3.43Å; H8-S10 VanDerWaalsContact C-N 3.3Å; H8-K11 PolarHBondContact O-N 3.24Å
9	T	62.9	Low	70.7	Confident	69 Å²	69	122.9 Å²	122.9	42%	0.423	60%	0.602	S	S	.	*	H	α-helix	trans	-65.2	-35.2	170.1	31.2	0	0	0	0	112.1	N5 W6 K11 K12	N5-T9 PolarHBondContact O-N 3.42Å; N5-T9 PolarHBondContact O-OG1 3.45Å; W6-T9 VanDerWaalsContact CA-OG1 3.26Å; W6-T9 WeakPolarHBondContact CA-OG1 3.09Å; W6-T9 PolarHBondContact O-N 3.37Å; W6-T9 PolarHBondContact O-OG1 3.38Å; T9-K11 PolarHBondContact O-N 2.98Å; T9-K12 WeakPolarHBondContact O-CB 3.29Å; T9-K12 WeakPolarHBondContact O-CG 3.43Å; T9-K12 PolarHBondContact O-N 3.07Å
10	S	63.7	Low	71.8	Confident	69 Å²	69	121 Å²	121	48%	0.483	59%	0.594	S	S	.	*	H	α-helix	trans	-62.2	-31.4	173.7	-65.6	0	0	0	0	111.1	W6 V7 H8 K12 H13	W6-S10 PolarHBondContact O-N 2.82Å; W6-S10 PolarHBondContact O-OG 3.49Å; W6-S10 VanDerWaalsContact O-OG 3.08Å; V7-S10 WeakPolarHBondContact O-CA 3.21Å; V7-S10 WeakPolarHBondContact O-CB 3.34Å; V7-S10 PolarHBondContact O-N 2.98Å; V7-S10 VanDerWaalsContact O-N 3.16Å; H8-S10 VanDerWaalsContact C-N 3.3Å; S10-K12 VanDerWaalsContact C-N 3.31Å; S10-K12 PolarHBondContact O-N 2.88Å; S10-H13 PolarHBondContact O-CE1 3.13Å; S10-H13 PolarHBondContact O-ND1 3.43Å
11	K	72	Confident	72.9	Confident	90 Å²	90	118.7 Å²	118.7	39%	0.391	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77	-0.6	176.3	-67.8	-169.2	164.2	-150.2	0	116.2	V7 H8 T9 H13 E14	V7-K11 WeakPolarHBondContact O-CG 3.47Å; V7-K11 PolarHBondContact O-N 3.18Å; H8-K11 PolarHBondContact O-N 3.24Å; T9-K11 PolarHBondContact O-N 2.98Å; K11-H13 PolarHBondContact O-N 3.42Å; K11-H13 VanDerWaalsContact O-N 3.12Å; K11-E14 HydrophobicContact CB-CG 4.39Å; K11-E14 WeakPolarHBondContact CE-OE1 3.3Å; K11-E14 WeakPolarHBondContact CG-OE1 3.39Å; K11-E14 IonicContact NZ-OE1 3.38Å; K11-E14 IonicContact NZ-OE2 2.78Å; K11-E14 WeakPolarHBondContact O-CB 3.29Å; K11-E14 PolarHBondContact O-N 3.23Å
12	K	76	Confident	74.9	Confident	130 Å²	130	114 Å²	114	57%	0.565	56%	0.563	S	S	*	*	H	α-helix	trans	-56.2	-29.7	175.8	-76.7	-179.3	174.7	-179.4	0	112.8	T9 S10 E14 I15 L16	T9-K12 WeakPolarHBondContact O-CB 3.29Å; T9-K12 WeakPolarHBondContact O-CG 3.43Å; T9-K12 PolarHBondContact O-N 3.07Å; S10-K12 VanDerWaalsContact C-N 3.31Å; S10-K12 PolarHBondContact O-N 2.88Å; K12-E14 VanDerWaalsContact C-N 3.33Å; K12-I15 PolarHBondContact O-N 3.26Å; K12-L16 PolarHBondContact O-N 2.91Å; K12-L16 VanDerWaalsContact O-N 3.15Å
13	H	84.1	Confident	76.7	Confident	109 Å²	109	111.6 Å²	111.6	51%	0.505	55%	0.55	S	S	.	*	H	α-helix	trans	-63.3	-36.5	174.6	71.5	-82.2	0	0	0	112.2	S10 K11 I15 L16 E17	S10-H13 PolarHBondContact O-CE1 3.13Å; S10-H13 PolarHBondContact O-ND1 3.43Å; K11-H13 PolarHBondContact O-N 3.42Å; K11-H13 VanDerWaalsContact O-N 3.12Å; H13-I15 VanDerWaalsContact C-N 3.32Å; H13-I15 PolarHBondContact O-N 3.41Å; H13-L16 PolarHBondContact O-N 2.76Å; H13-E17 VanDerWaalsContact O-CB 3.26Å; H13-E17 WeakPolarHBondContact O-CB 3.48Å; H13-E17 PolarHBondContact O-N 3.43Å
14	E	84.8	Confident	78.6	Confident	88 Å²	88	107.3 Å²	107.3	41%	0.411	54%	0.535	S	S	.	.	H	α-helix	trans	-61.4	-39.9	177.5	-59.5	176.3	-172.6	0	0	111.2	K11 K12 A18	K11-E14 HydrophobicContact CB-CG 4.39Å; K11-E14 WeakPolarHBondContact CE-OE1 3.3Å; K11-E14 WeakPolarHBondContact CG-OE1 3.39Å; K11-E14 IonicContact NZ-OE1 3.38Å; K11-E14 IonicContact NZ-OE2 2.78Å; K11-E14 WeakPolarHBondContact O-CB 3.29Å; K11-E14 PolarHBondContact O-N 3.23Å; K12-E14 VanDerWaalsContact C-N 3.33Å; E14-A18 WeakPolarHBondContact O-CB 3.18Å; E14-A18 PolarHBondContact O-N 2.9Å
15	I	81.3	Confident	80.3	Confident	126 Å²	126	104.1 Å²	104.1	65%	0.646	53%	0.528	S	S	*	.	H	α-helix	trans	-68.4	-44.3	177.2	-60.3	175.2	0	0	0	110.8	K12 H13 E17 A18 F19	K12-I15 PolarHBondContact O-N 3.26Å; H13-I15 VanDerWaalsContact C-N 3.32Å; H13-I15 PolarHBondContact O-N 3.41Å; I15-E17 VanDerWaalsContact C-N 3.32Å; I15-A18 PolarHBondContact O-N 3.15Å; I15-F19 WeakPolarHBondContact O-CB 3.47Å; I15-F19 PolarHBondContact O-N 3.33Å
16	L	84.1	Confident	81.9	Confident	120 Å²	120	100.7 Å²	100.7	63%	0.628	51%	0.511	S	S	*	.	H	α-helix	trans	-66.1	-37	178.5	-71.9	172.2	0	0	0	111.7	K12 H13 F19 L20	K12-L16 PolarHBondContact O-N 2.91Å; K12-L16 VanDerWaalsContact O-N 3.15Å; H13-L16 PolarHBondContact O-N 2.76Å; L16-F19 PolarHBondContact O-N 2.67Å; L16-L20 VanDerWaalsContact O-CB 3.32Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 PolarHBondContact O-N 3Å
17	E	89.3	Confident	83.5	Confident	125 Å²	125	97.1 Å²	97.1	58%	0.584	50%	0.501	S	S	*	.	H	α-helix	trans	-64.3	-48	174.3	-173.2	173.4	-164.8	0	0	110.8	H13 I15 F19 L20 S21	H13-E17 VanDerWaalsContact O-CB 3.26Å; H13-E17 WeakPolarHBondContact O-CB 3.48Å; H13-E17 PolarHBondContact O-N 3.43Å; I15-E17 VanDerWaalsContact C-N 3.32Å; E17-F19 VanDerWaalsContact C-N 3.3Å; E17-F19 PolarHBondContact O-N 3.02Å; E17-L20 PolarHBondContact O-N 2.9Å; E17-S21 PolarHBondContact O-N 3.26Å; E17-S21 PolarHBondContact O-OG 2.96Å; E17-S21 VanDerWaalsContact O-OG 3.13Å
18	A	87.9	Confident	85	Confident	63 Å²	63	96 Å²	96	52%	0.521	50%	0.495	S	S	.	.	H	α-helix	trans	-59.8	-40	174.6	0	0	0	0	0	112.4	E14 I15 S21 F22	E14-A18 WeakPolarHBondContact O-CB 3.18Å; E14-A18 PolarHBondContact O-N 2.9Å; I15-A18 PolarHBondContact O-N 3.15Å; A18-S21 PolarHBondContact O-N 3.08Å; A18-F22 WeakPolarHBondContact O-CB 3.18Å; A18-F22 PolarHBondContact O-N 2.92Å
19	F	89.1	Confident	86.5	Confident	127 Å²	127	96.9 Å²	96.9	56%	0.557	50%	0.497	S	S	*	.	H	α-helix	trans	-67.5	-40.3	176.9	-167.5	-110.1	0	0	0	112	I15 L16 E17 F22 I23	I15-F19 WeakPolarHBondContact O-CB 3.47Å; I15-F19 PolarHBondContact O-N 3.33Å; L16-F19 PolarHBondContact O-N 2.67Å; E17-F19 VanDerWaalsContact C-N 3.3Å; E17-F19 PolarHBondContact O-N 3.02Å; F19-F22 WeakPolarHBondContact O-CB 3.5Å; F19-F22 PolarHBondContact O-N 2.96Å; F19-I23 HydrophobicContact CD1-CD1 3.8Å; F19-I23 HydrophobicContact CD1-CG1 4.5Å; F19-I23 HydrophobicContact CE1-CD1 3.62Å; F19-I23 HydrophobicContact CE1-CG1 4.34Å; F19-I23 HydrophobicContact CZ-CD1 4.37Å; F19-I23 WeakPolarHBondContact O-CG1 3.26Å; F19-I23 PolarHBondContact O-N 3.36Å
20	L	92.9	Very high	88	Confident	85 Å²	85	100.1 Å²	100.1	45%	0.445	51%	0.506	S	S	.	.	H	α-helix	trans	-64.9	-44.3	174.8	-177.3	62.6	0	0	0	111.3	L16 E17 F22 I23 Y24	L16-L20 VanDerWaalsContact O-CB 3.32Å; L16-L20 WeakPolarHBondContact O-CB 3.38Å; L16-L20 PolarHBondContact O-N 3Å; E17-L20 PolarHBondContact O-N 2.9Å; L20-F22 VanDerWaalsContact C-N 3.29Å; L20-F22 PolarHBondContact O-N 3.43Å; L20-I23 PolarHBondContact O-N 3.37Å; L20-I23 VanDerWaalsContact O-N 3.16Å; L20-Y24 HydrophobicContact CD1-CD2 4.04Å; L20-Y24 HydrophobicContact CD1-CE2 3.54Å; L20-Y24 HydrophobicContact CD2-CE2 4.01Å; L20-Y24 HydrophobicContact CG-CD2 3.86Å; L20-Y24 HydrophobicContact CG-CE2 3.53Å; L20-Y24 VanDerWaalsContact O-CD2 3.24Å; L20-Y24 WeakPolarHBondContact O-CD2 3.25Å; L20-Y24 PolarHBondContact O-N 2.98Å
21	S	94.3	Very high	89.4	Confident	72 Å²	72	101.7 Å²	101.7	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-58.6	-40.6	172.5	-63	0	0	0	0	111.9	E17 A18 Y24 A25	E17-S21 PolarHBondContact O-N 3.26Å; E17-S21 PolarHBondContact O-OG 2.96Å; E17-S21 VanDerWaalsContact O-OG 3.13Å; A18-S21 PolarHBondContact O-N 3.08Å; S21-Y24 PolarHBondContact O-N 2.87Å; S21-A25 WeakPolarHBondContact O-CB 3.43Å; S21-A25 PolarHBondContact O-N 3.07Å
22	F	93.4	Very high	90.2	Very high	131 Å²	131	102.8 Å²	102.8	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-63.2	-42.3	174.7	176.8	-100.2	0	0	0	112.1	A18 F19 L20 A25 T26	A18-F22 WeakPolarHBondContact O-CB 3.18Å; A18-F22 PolarHBondContact O-N 2.92Å; F19-F22 WeakPolarHBondContact O-CB 3.5Å; F19-F22 PolarHBondContact O-N 2.96Å; L20-F22 VanDerWaalsContact C-N 3.29Å; L20-F22 PolarHBondContact O-N 3.43Å; F22-A25 PolarHBondContact O-N 3.2Å; F22-T26 WeakPolarHBondContact O-CB 3.42Å; F22-T26 PolarHBondContact O-N 2.92Å; F22-T26 PolarHBondContact O-OG1 2.97Å
23	I	94.8	Very high	90.7	Very high	80 Å²	80	98.4 Å²	98.4	41%	0.41	50%	0.504	S	S	.	.	H	α-helix	trans	-60.8	-47.9	175.6	-70	168.2	0	0	0	110.6	F19 L20 A25 T26 E27	F19-I23 HydrophobicContact CD1-CD1 3.8Å; F19-I23 HydrophobicContact CD1-CG1 4.5Å; F19-I23 HydrophobicContact CE1-CD1 3.62Å; F19-I23 HydrophobicContact CE1-CG1 4.34Å; F19-I23 HydrophobicContact CZ-CD1 4.37Å; F19-I23 WeakPolarHBondContact O-CG1 3.26Å; F19-I23 PolarHBondContact O-N 3.36Å; L20-I23 PolarHBondContact O-N 3.37Å; L20-I23 VanDerWaalsContact O-N 3.16Å; I23-A25 PolarHBondContact O-N 3.38Å; I23-T26 PolarHBondContact O-N 3.29Å; I23-E27 WeakPolarHBondContact O-CB 3.34Å; I23-E27 PolarHBondContact O-N 3.23Å
24	Y	95.4	Very high	90.9	Very high	134 Å²	134	98.3 Å²	98.3	53%	0.525	50%	0.503	S	S	.	.	H	α-helix	trans	-62.3	-41.4	177.8	-78	-59.7	0	0	0	112.6	L20 S21 T26 E27 T28	L20-Y24 HydrophobicContact CD1-CD2 4.04Å; L20-Y24 HydrophobicContact CD1-CE2 3.54Å; L20-Y24 HydrophobicContact CD2-CE2 4.01Å; L20-Y24 HydrophobicContact CG-CD2 3.86Å; L20-Y24 HydrophobicContact CG-CE2 3.53Å; L20-Y24 VanDerWaalsContact O-CD2 3.24Å; L20-Y24 WeakPolarHBondContact O-CD2 3.25Å; L20-Y24 PolarHBondContact O-N 2.98Å; S21-Y24 PolarHBondContact O-N 2.87Å; Y24-T26 VanDerWaalsContact C-N 3.3Å; Y24-T26 PolarHBondContact O-N 2.88Å; Y24-E27 PolarHBondContact O-N 3Å; Y24-T28 WeakPolarHBondContact O-CB 3.47Å; Y24-T28 PolarHBondContact O-N 2.85Å; Y24-T28 PolarHBondContact O-OG1 3.47Å
25	A	94.9	Very high	90.9	Very high	60 Å²	60	97.8 Å²	97.8	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-40.1	175.3	0	0	0	0	0	111.6	S21 F22 I23 F29	S21-A25 WeakPolarHBondContact O-CB 3.43Å; S21-A25 PolarHBondContact O-N 3.07Å; F22-A25 PolarHBondContact O-N 3.2Å; I23-A25 PolarHBondContact O-N 3.38Å; A25-F29 WeakPolarHBondContact O-CB 3.47Å; A25-F29 PolarHBondContact O-N 3.08Å
26	T	94.1	Very high	90.9	Very high	41 Å²	41	97.2 Å²	97.2	25%	0.252	50%	0.501	S	S	.	.	H	α-helix	trans	-68.8	-43.6	178.8	-54	0	0	0	0	111.6	F22 I23 Y24 F29 F30	F22-T26 WeakPolarHBondContact O-CB 3.42Å; F22-T26 PolarHBondContact O-N 2.92Å; F22-T26 PolarHBondContact O-OG1 2.97Å; I23-T26 PolarHBondContact O-N 3.29Å; Y24-T26 VanDerWaalsContact C-N 3.3Å; Y24-T26 PolarHBondContact O-N 2.88Å; T26-F29 PolarHBondContact O-N 3.02Å; T26-F30 HydrophobicContact CG2-CD2 3.72Å; T26-F30 HydrophobicContact CG2-CE2 3.41Å; T26-F30 VanDerWaalsContact CG2-CE2 3.41Å; T26-F30 HydrophobicContact CG2-CZ 4.49Å; T26-F30 WeakPolarHBondContact O-CD2 3.5Å; T26-F30 PolarHBondContact O-N 2.97Å
27	E	94.5	Very high	90.8	Very high	106 Å²	106	97.2 Å²	97.2	50%	0.495	50%	0.497	S	S	.	.	H	α-helix	trans	-58.8	-48.5	174.1	-173.4	-129.5	160.8	0	0	110.9	I23 Y24 F29 F30 H31	I23-E27 WeakPolarHBondContact O-CB 3.34Å; I23-E27 PolarHBondContact O-N 3.23Å; Y24-E27 PolarHBondContact O-N 3Å; E27-F29 VanDerWaalsContact C-N 3.32Å; E27-F29 PolarHBondContact O-N 3.1Å; E27-F30 PolarHBondContact O-N 2.86Å; E27-H31 WeakPolarHBondContact O-CB 3.27Å; E27-H31 PolarHBondContact O-N 3.26Å
28	T	94.8	Very high	90.5	Very high	65 Å²	65	96.7 Å²	96.7	40%	0.399	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-42.8	177.2	-52.3	0	0	0	0	111.4	Y24 H31 Q32	Y24-T28 WeakPolarHBondContact O-CB 3.47Å; Y24-T28 PolarHBondContact O-N 2.85Å; Y24-T28 PolarHBondContact O-OG1 3.47Å; T28-H31 PolarHBondContact O-N 3.02Å; T28-Q32 HydrophobicContact CG2-CG 4.48Å; T28-Q32 WeakPolarHBondContact O-CB 3.2Å; T28-Q32 VanDerWaalsContact O-CG 3.29Å; T28-Q32 WeakPolarHBondContact O-CG 3.5Å; T28-Q32 PolarHBondContact O-N 3Å
29	F	92.9	Very high	89.9	Confident	144 Å²	144	96.9 Å²	96.9	63%	0.632	49%	0.492	S	S	*	.	H	α-helix	trans	-61.5	-46	176.7	176.9	-97.5	0	0	0	112.2	A25 T26 E27 G33	A25-F29 WeakPolarHBondContact O-CB 3.47Å; A25-F29 PolarHBondContact O-N 3.08Å; T26-F29 PolarHBondContact O-N 3.02Å; E27-F29 VanDerWaalsContact C-N 3.32Å; E27-F29 PolarHBondContact O-N 3.1Å; F29-G33 PolarHBondContact O-N 3.22Å
30	F	93.7	Very high	89.4	Confident	137 Å²	137	95.7 Å²	95.7	60%	0.601	49%	0.491	S	S	*	.	H	α-helix	trans	-66.4	-37.9	176.8	-77.4	-59.2	0	0	0	112.4	T26 E27 G33 H34	T26-F30 HydrophobicContact CG2-CD2 3.72Å; T26-F30 HydrophobicContact CG2-CE2 3.41Å; T26-F30 VanDerWaalsContact CG2-CE2 3.41Å; T26-F30 HydrophobicContact CG2-CZ 4.49Å; T26-F30 WeakPolarHBondContact O-CD2 3.5Å; T26-F30 PolarHBondContact O-N 2.97Å; E27-F30 PolarHBondContact O-N 2.86Å; F30-G33 PolarHBondContact O-N 2.86Å; F30-H34 WeakPolarHBondContact O-CB 3.42Å; F30-H34 PolarHBondContact O-N 3.15Å
31	H	92.2	Very high	88.9	Confident	102 Å²	102	96.9 Å²	96.9	47%	0.472	49%	0.49	S	S	.	.	H	α-helix	trans	-65	-46.6	177.3	-151.4	-60.8	0	0	0	111.1	E27 T28 G33 H34 D35	E27-H31 WeakPolarHBondContact O-CB 3.27Å; E27-H31 PolarHBondContact O-N 3.26Å; T28-H31 PolarHBondContact O-N 3.02Å; H31-G33 VanDerWaalsContact C-N 3.35Å; H31-G33 PolarHBondContact O-N 2.9Å; H31-H34 WeakPolarHBondContact O-CB 3.43Å; H31-H34 PolarHBondContact O-N 2.86Å; H31-D35 IonicContact CE1-OD1 2.66Å; H31-D35 IonicContact CE1-OD2 2.97Å; H31-D35 IonicContact ND1-OD1 3.28Å; H31-D35 IonicContact ND1-OD2 3.45Å; H31-D35 PolarHBondContact ND1-OD2 3.34Å; H31-D35 VanDerWaalsContact O-CG 3.24Å; H31-D35 PolarHBondContact O-N 2.91Å
32	Q	89.6	Confident	88.4	Confident	113 Å²	113	98.1 Å²	98.1	53%	0.528	49%	0.49	S	S	.	.	H	α-helix	trans	-60.2	-44.6	174.5	-72.9	175.7	6	0	0	111.7	T28 H34 D35 L36	T28-Q32 HydrophobicContact CG2-CG 4.48Å; T28-Q32 WeakPolarHBondContact O-CB 3.2Å; T28-Q32 VanDerWaalsContact O-CG 3.29Å; T28-Q32 WeakPolarHBondContact O-CG 3.5Å; T28-Q32 PolarHBondContact O-N 3Å; Q32-H34 VanDerWaalsContact C-N 3.31Å; Q32-H34 PolarHBondContact O-N 2.77Å; Q32-D35 PolarHBondContact O-N 2.64Å; Q32-L36 WeakPolarHBondContact O-CB 3.44Å; Q32-L36 PolarHBondContact O-N 2.66Å
33	G	86.6	Confident	87.9	Confident	39 Å²	39	97.2 Å²	97.2	40%	0.402	49%	0.492	S	S	.	.	H	α-helix	trans	-61.9	-38.5	176.2	0	0	0	0	0	112.7	F29 F30 H31 F37	F29-G33 PolarHBondContact O-N 3.22Å; F30-G33 PolarHBondContact O-N 2.86Å; H31-G33 VanDerWaalsContact C-N 3.35Å; H31-G33 PolarHBondContact O-N 2.9Å; G33-F37 VanDerWaalsContact O-CB 3.23Å; G33-F37 WeakPolarHBondContact O-CB 3.38Å; G33-F37 PolarHBondContact O-N 2.77Å
34	H	88.3	Confident	87.5	Confident	106 Å²	106	97.2 Å²	97.2	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-67.1	-44.2	175	178.7	-90.6	0	0	0	111.9	F30 H31 Q32 F37 Q38	F30-H34 WeakPolarHBondContact O-CB 3.42Å; F30-H34 PolarHBondContact O-N 3.15Å; H31-H34 WeakPolarHBondContact O-CB 3.43Å; H31-H34 PolarHBondContact O-N 2.86Å; Q32-H34 VanDerWaalsContact C-N 3.31Å; Q32-H34 PolarHBondContact O-N 2.77Å; H34-F37 PolarHBondContact O-N 3.34Å; H34-Q38 PolarHBondContact CE1-OE1 3.17Å; H34-Q38 VanDerWaalsContact O-CB 3.28Å; H34-Q38 WeakPolarHBondContact O-CB 3.36Å; H34-Q38 PolarHBondContact O-N 2.86Å
35	D	85.7	Confident	87.2	Confident	78 Å²	78	95.5 Å²	95.5	42%	0.417	49%	0.49	S	S	.	.	H	α-helix	trans	-66.9	-43.6	-179.4	-66.1	-25.7	0	0	0	111.7	H31 Q32 F37 Q38 S39	H31-D35 IonicContact CE1-OD1 2.66Å; H31-D35 IonicContact CE1-OD2 2.97Å; H31-D35 IonicContact ND1-OD1 3.28Å; H31-D35 IonicContact ND1-OD2 3.45Å; H31-D35 PolarHBondContact ND1-OD2 3.34Å; H31-D35 VanDerWaalsContact O-CG 3.24Å; H31-D35 PolarHBondContact O-N 2.91Å; Q32-D35 PolarHBondContact O-N 2.64Å; D35-F37 VanDerWaalsContact C-N 3.35Å; D35-Q38 PolarHBondContact O-N 3.16Å; D35-S39 PolarHBondContact O-N 2.95Å; D35-S39 VanDerWaalsContact O-N 3.09Å
36	L	80.7	Confident	86.8	Confident	114 Å²	114	96.9 Å²	96.9	60%	0.597	49%	0.489	S	S	*	.	H	α-helix	trans	-58.5	-45.8	170.9	-92.2	150	0	0	0	111.5	Q32 S39 D40	Q32-L36 WeakPolarHBondContact O-CB 3.44Å; Q32-L36 PolarHBondContact O-N 2.66Å; L36-S39 PolarHBondContact O-OG 2.94Å; L36-S39 VanDerWaalsContact O-OG 3.08Å; L36-D40 PolarHBondContact O-N 2.8Å
37	F	80.8	Confident	86.7	Confident	120 Å²	120	100.4 Å²	100.4	53%	0.526	50%	0.503	S	S	.	.	H	α-helix	trans	-64.1	-43.5	177.2	-175.2	-99.4	0	0	0	110.5	G33 H34 D35 S39 D40 W41	G33-F37 VanDerWaalsContact O-CB 3.23Å; G33-F37 WeakPolarHBondContact O-CB 3.38Å; G33-F37 PolarHBondContact O-N 2.77Å; H34-F37 PolarHBondContact O-N 3.34Å; D35-F37 VanDerWaalsContact C-N 3.35Å; F37-S39 PolarHBondContact O-N 3.08Å; F37-D40 PolarHBondContact O-N 3.44Å; F37-W41 HydrophobicContact CD1-CB 3.87Å; F37-W41 HydrophobicContact CD1-CG 4.14Å; F37-W41 HydrophobicContact CE1-CB 3.65Å; F37-W41 AromaticContact CE1-CD1 3.73Å; F37-W41 AromaticContact CE1-CD2 3.84Å; F37-W41 HydrophobicContact CE1-CD2 3.84Å; F37-W41 HydrophobicContact CE1-CE3 4.43Å; F37-W41 AromaticContact CE1-CG 3.45Å; F37-W41 HydrophobicContact CE1-CG 3.45Å; F37-W41 VanDerWaalsContact CE1-CG 3.45Å; F37-W41 HydrophobicContact CE2-CB 4.33Å; F37-W41 HydrophobicContact CE2-CD2 4.49Å; F37-W41 HydrophobicContact CE2-CE3 4.31Å; F37-W41 HydrophobicContact CG-CB 4.3Å; F37-W41 HydrophobicContact CZ-CB 3.9Å; F37-W41 AromaticContact CZ-CD2 3.61Å; F37-W41 HydrophobicContact CZ-CD2 3.61Å; F37-W41 AromaticContact CZ-CE3 3.74Å; F37-W41 HydrophobicContact CZ-CE3 3.74Å; F37-W41 AromaticContact CZ-CG 3.69Å; F37-W41 HydrophobicContact CZ-CG 3.69Å; F37-W41 HydrophobicContact CZ-CZ3 4.48Å; F37-W41 WeakPolarHBondContact O-CA 3.48Å; F37-W41 WeakPolarHBondContact O-CB 2.98Å; F37-W41 PolarHBondContact O-N 2.84Å
38	Q	83.3	Confident	86.6	Confident	113 Å²	113	100.9 Å²	100.9	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-67	-37.9	-174.6	-172.6	164.8	1.3	0	0	113.1	H34 D35	H34-Q38 PolarHBondContact CE1-OE1 3.17Å; H34-Q38 VanDerWaalsContact O-CB 3.28Å; H34-Q38 WeakPolarHBondContact O-CB 3.36Å; H34-Q38 PolarHBondContact O-N 2.86Å; D35-Q38 PolarHBondContact O-N 3.16Å
39	S	75.2	Confident	86.6	Confident	68 Å²	68	101 Å²	101	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-43.7	176.7	61.2	0	0	0	0	112	D35 L36 F37	D35-S39 PolarHBondContact O-N 2.95Å; D35-S39 VanDerWaalsContact O-N 3.09Å; L36-S39 PolarHBondContact O-OG 2.94Å; L36-S39 VanDerWaalsContact O-OG 3.08Å; F37-S39 PolarHBondContact O-N 3.08Å
40	D	79	Confident	86.6	Confident	102 Å²	102	97.7 Å²	97.7	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-86	-36.9	-173.9	-66.9	-5.8	0	0	0	111.7	L36 F37 L42 N43 V44	L36-D40 PolarHBondContact O-N 2.8Å; F37-D40 PolarHBondContact O-N 3.44Å; D40-L42 VanDerWaalsContact C-N 3.3Å; D40-L42 PolarHBondContact O-N 3.48Å; D40-N43 PolarHBondContact O-N 2.79Å; D40-V44 WeakPolarHBondContact O-CG2 3.5Å; D40-V44 PolarHBondContact O-N 3.47Å
41	W	83.2	Confident	86.7	Confident	109 Å²	109	98.8 Å²	98.8	41%	0.413	50%	0.504	S	S	.	.	H	α-helix	trans	-60.5	-38.1	-178.7	173.3	-121.7	0	0	0	112.3	F37 N43 V44 K45	F37-W41 HydrophobicContact CD1-CB 3.87Å; F37-W41 HydrophobicContact CD1-CG 4.14Å; F37-W41 HydrophobicContact CE1-CB 3.65Å; F37-W41 AromaticContact CE1-CD1 3.73Å; F37-W41 AromaticContact CE1-CD2 3.84Å; F37-W41 HydrophobicContact CE1-CD2 3.84Å; F37-W41 HydrophobicContact CE1-CE3 4.43Å; F37-W41 AromaticContact CE1-CG 3.45Å; F37-W41 HydrophobicContact CE1-CG 3.45Å; F37-W41 VanDerWaalsContact CE1-CG 3.45Å; F37-W41 HydrophobicContact CE2-CB 4.33Å; F37-W41 HydrophobicContact CE2-CD2 4.49Å; F37-W41 HydrophobicContact CE2-CE3 4.31Å; F37-W41 HydrophobicContact CG-CB 4.3Å; F37-W41 HydrophobicContact CZ-CB 3.9Å; F37-W41 AromaticContact CZ-CD2 3.61Å; F37-W41 HydrophobicContact CZ-CD2 3.61Å; F37-W41 AromaticContact CZ-CE3 3.74Å; F37-W41 HydrophobicContact CZ-CE3 3.74Å; F37-W41 AromaticContact CZ-CG 3.69Å; F37-W41 HydrophobicContact CZ-CG 3.69Å; F37-W41 HydrophobicContact CZ-CZ3 4.48Å; F37-W41 WeakPolarHBondContact O-CA 3.48Å; F37-W41 WeakPolarHBondContact O-CB 2.98Å; F37-W41 PolarHBondContact O-N 2.84Å; W41-N43 VanDerWaalsContact C-N 3.31Å; W41-N43 PolarHBondContact O-N 3.24Å; W41-V44 HydrophobicContact CE3-CG1 4.47Å; W41-V44 HydrophobicContact CZ3-CG1 4.45Å; W41-V44 PolarHBondContact O-N 2.85Å; W41-K45 HydrophobicContact CD2-CB 4.24Å; W41-K45 HydrophobicContact CZ2-CB 4.19Å; W41-K45 HydrophobicContact CZ2-CD 4.34Å; W41-K45 HydrophobicContact CZ2-CG 4.3Å; W41-K45 WeakPolarHBondContact O-CA 3.21Å; W41-K45 WeakPolarHBondContact O-CB 3.4Å; W41-K45 PolarHBondContact O-N 3.32Å
42	L	83.1	Confident	86.8	Confident	99 Å²	99	98.5 Å²	98.5	52%	0.518	51%	0.505	S	S	.	.	H	α-helix	trans	-62.8	-41.5	-178.4	-168.8	64.9	0	0	0	111.3	D40 N46	D40-L42 VanDerWaalsContact C-N 3.3Å; D40-L42 PolarHBondContact O-N 3.48Å; L42-N46 WeakPolarHBondContact O-CB 3.23Å; L42-N46 PolarHBondContact O-N 2.87Å; L42-N46 PolarHBondContact O-ND2 2.9Å; L42-N46 VanDerWaalsContact O-ND2 3.15Å
43	N	83.8	Confident	87	Confident	112 Å²	112	99.3 Å²	99.3	60%	0.599	51%	0.509	S	S	*	.	H	α-helix	trans	-67.5	-49.6	176.4	-70.7	-27.6	0	0	0	111.3	D40 W41 K45 N46 E47	D40-N43 PolarHBondContact O-N 2.79Å; W41-N43 VanDerWaalsContact C-N 3.31Å; W41-N43 PolarHBondContact O-N 3.24Å; N43-K45 VanDerWaalsContact C-N 3.31Å; N43-K45 PolarHBondContact O-N 3.34Å; N43-N46 PolarHBondContact O-N 2.84Å; N43-E47 PolarHBondContact O-N 2.82Å
44	V	86.1	Confident	87.3	Confident	80 Å²	80	100.4 Å²	100.4	49%	0.485	51%	0.511	S	S	.	.	H	α-helix	trans	-59.3	-43.3	178.3	173.9	0	0	0	0	111.2	D40 W41 E47 L48	D40-V44 WeakPolarHBondContact O-CG2 3.5Å; D40-V44 PolarHBondContact O-N 3.47Å; W41-V44 HydrophobicContact CE3-CG1 4.47Å; W41-V44 HydrophobicContact CZ3-CG1 4.45Å; W41-V44 PolarHBondContact O-N 2.85Å; V44-E47 PolarHBondContact O-N 2.94Å; V44-L48 VanDerWaalsContact O-CB 3.3Å; V44-L48 WeakPolarHBondContact O-CB 3.06Å; V44-L48 PolarHBondContact O-N 3.09Å
45	K	87.9	Confident	87.6	Confident	98 Å²	98	100.1 Å²	100.1	43%	0.426	51%	0.512	S	S	.	.	H	α-helix	trans	-61	-47.5	177.7	178.5	-175	174.4	-172.7	0	111.2	W41 N43 L48 V49	W41-K45 HydrophobicContact CD2-CB 4.24Å; W41-K45 HydrophobicContact CZ2-CB 4.19Å; W41-K45 HydrophobicContact CZ2-CD 4.34Å; W41-K45 HydrophobicContact CZ2-CG 4.3Å; W41-K45 WeakPolarHBondContact O-CA 3.21Å; W41-K45 WeakPolarHBondContact O-CB 3.4Å; W41-K45 PolarHBondContact O-N 3.32Å; N43-K45 VanDerWaalsContact C-N 3.31Å; N43-K45 PolarHBondContact O-N 3.34Å; K45-L48 PolarHBondContact O-N 2.83Å; K45-V49 WeakPolarHBondContact O-CB 3.33Å; K45-V49 VanDerWaalsContact O-CG2 3.25Å; K45-V49 WeakPolarHBondContact O-CG2 3.32Å; K45-V49 PolarHBondContact O-N 2.87Å
46	N	88.3	Confident	88	Confident	88 Å²	88	103 Å²	103	47%	0.471	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-41.1	180	-70.8	-21.5	0	0	0	111.3	L42 N43 V49 S50	L42-N46 WeakPolarHBondContact O-CB 3.23Å; L42-N46 PolarHBondContact O-N 2.87Å; L42-N46 PolarHBondContact O-ND2 2.9Å; L42-N46 VanDerWaalsContact O-ND2 3.15Å; N43-N46 PolarHBondContact O-N 2.84Å; N46-V49 PolarHBondContact O-N 2.85Å; N46-S50 WeakPolarHBondContact O-CB 3.36Å; N46-S50 PolarHBondContact O-N 2.94Å
47	E	92	Very high	88.7	Confident	115 Å²	115	100.8 Å²	100.8	54%	0.537	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-45.1	174.5	-175.4	167.3	164.7	0	0	111.7	N43 V44 V49 S50 R51	N43-E47 PolarHBondContact O-N 2.82Å; V44-E47 PolarHBondContact O-N 2.94Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 2.97Å; E47-S50 PolarHBondContact O-N 2.96Å; E47-R51 WeakPolarHBondContact O-CB 3.47Å; E47-R51 PolarHBondContact O-N 3.34Å; E47-R51 IonicContact OE1-NH1 3.01Å; E47-R51 PolarHBondContact OE1-NH1 3.11Å
48	L	91.6	Very high	89.2	Confident	116 Å²	116	99 Å²	99	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-61.7	-41.6	178.6	-155.9	91.6	0	0	0	111.6	V44 K45 R51 L52	V44-L48 VanDerWaalsContact O-CB 3.3Å; V44-L48 WeakPolarHBondContact O-CB 3.06Å; V44-L48 PolarHBondContact O-N 3.09Å; K45-L48 PolarHBondContact O-N 2.83Å; L48-R51 PolarHBondContact O-N 3.12Å; L48-L52 VanDerWaalsContact O-CB 3.26Å; L48-L52 WeakPolarHBondContact O-CB 3.22Å; L48-L52 PolarHBondContact O-N 3.22Å
49	V	95.1	Very high	89.6	Confident	69 Å²	69	97.1 Å²	97.1	42%	0.418	50%	0.5	S	S	.	.	H	α-helix	trans	-63.6	-45.5	176.1	169.2	0	0	0	0	110.8	K45 N46 E47 L52 Q53	K45-V49 WeakPolarHBondContact O-CB 3.33Å; K45-V49 VanDerWaalsContact O-CG2 3.25Å; K45-V49 WeakPolarHBondContact O-CG2 3.32Å; K45-V49 PolarHBondContact O-N 2.87Å; N46-V49 PolarHBondContact O-N 2.85Å; E47-V49 VanDerWaalsContact C-N 3.33Å; E47-V49 PolarHBondContact O-N 2.97Å; V49-L52 PolarHBondContact O-N 3.49Å; V49-Q53 WeakPolarHBondContact O-CG 3.15Å; V49-Q53 PolarHBondContact O-N 2.91Å
50	S	92.7	Very high	90.3	Very high	74 Å²	74	100.1 Å²	100.1	52%	0.517	50%	0.501	S	S	.	.	H	α-helix	trans	-60.3	-47.2	176.5	178.8	0	0	0	0	111.6	N46 E47 L52 Q53 S54	N46-S50 WeakPolarHBondContact O-CB 3.36Å; N46-S50 PolarHBondContact O-N 2.94Å; E47-S50 PolarHBondContact O-N 2.96Å; S50-L52 VanDerWaalsContact C-N 3.34Å; S50-L52 PolarHBondContact O-N 3.28Å; S50-Q53 WeakPolarHBondContact O-CB 3.39Å; S50-Q53 PolarHBondContact O-N 3.3Å; S50-Q53 VanDerWaalsContact O-N 3.14Å; S50-S54 PolarHBondContact O-N 3.25Å
51	R	95	Very high	90.8	Very high	159 Å²	159	99.3 Å²	99.3	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-65.1	-37.8	179.9	-151.2	157.1	-177.6	160.9	-3.6	112.1	E47 L48 S54 L55	E47-R51 WeakPolarHBondContact O-CB 3.47Å; E47-R51 PolarHBondContact O-N 3.34Å; E47-R51 IonicContact OE1-NH1 3.01Å; E47-R51 PolarHBondContact OE1-NH1 3.11Å; L48-R51 PolarHBondContact O-N 3.12Å; R51-S54 PolarHBondContact O-N 3.45Å; R51-L55 WeakPolarHBondContact O-CB 3.39Å; R51-L55 WeakPolarHBondContact O-CG 3.5Å; R51-L55 PolarHBondContact O-N 2.68Å
52	L	94	Very high	90.9	Very high	96 Å²	96	98.6 Å²	98.6	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-66.5	-38.4	173.6	-174.1	67.3	0	0	0	112	L48 V49 S50 K56	L48-L52 VanDerWaalsContact O-CB 3.26Å; L48-L52 WeakPolarHBondContact O-CB 3.22Å; L48-L52 PolarHBondContact O-N 3.22Å; V49-L52 PolarHBondContact O-N 3.49Å; S50-L52 VanDerWaalsContact C-N 3.34Å; S50-L52 PolarHBondContact O-N 3.28Å; L52-K56 WeakPolarHBondContact O-CB 3.43Å; L52-K56 VanDerWaalsContact O-CG 3.3Å; L52-K56 WeakPolarHBondContact O-CG 3.22Å; L52-K56 PolarHBondContact O-N 2.93Å
53	Q	93.8	Very high	90.8	Very high	130 Å²	130	99.6 Å²	99.6	61%	0.607	50%	0.499	S	S	*	.	H	α-helix	trans	-65.5	-44.1	174.2	-75	178.6	-4.6	0	0	111.4	V49 S50 K56 E57	V49-Q53 WeakPolarHBondContact O-CG 3.15Å; V49-Q53 PolarHBondContact O-N 2.91Å; S50-Q53 WeakPolarHBondContact O-CB 3.39Å; S50-Q53 PolarHBondContact O-N 3.3Å; S50-Q53 VanDerWaalsContact O-N 3.14Å; Q53-K56 PolarHBondContact O-N 3.35Å; Q53-E57 PolarHBondContact O-N 3.08Å
54	S	94.1	Very high	90.8	Very high	63 Å²	63	99.8 Å²	99.8	44%	0.441	50%	0.495	S	S	.	.	H	α-helix	trans	-56.6	-51.2	173.5	-172.8	0	0	0	0	111.4	S50 R51 K56 E57 D58	S50-S54 PolarHBondContact O-N 3.25Å; R51-S54 PolarHBondContact O-N 3.45Å; S54-K56 VanDerWaalsContact C-N 3.3Å; S54-K56 PolarHBondContact O-N 2.95Å; S54-E57 PolarHBondContact O-N 2.76Å; S54-E57 VanDerWaalsContact O-N 3.1Å; S54-D58 VanDerWaalsContact O-CG 3.27Å; S54-D58 PolarHBondContact O-N 3.04Å
55	L	94.2	Very high	90.5	Very high	99 Å²	99	102 Å²	102	52%	0.518	50%	0.498	S	S	.	.	H	α-helix	trans	-60.9	-37.6	179.2	-79.3	163.4	0	0	0	112.7	R51 T59	R51-L55 WeakPolarHBondContact O-CB 3.39Å; R51-L55 WeakPolarHBondContact O-CG 3.5Å; R51-L55 PolarHBondContact O-N 2.68Å; L55-T59 WeakPolarHBondContact O-CB 3.38Å; L55-T59 PolarHBondContact O-N 3.16Å; L55-T59 PolarHBondContact O-OG1 2.72Å
56	K	94.6	Very high	89.4	Confident	138 Å²	138	102.4 Å²	102.4	60%	0.6	50%	0.503	S	S	*	.	H	α-helix	trans	-64.3	-42.3	174.6	-79.2	177.4	176.9	-176.7	0	111.6	L52 Q53 S54 T59 R60	L52-K56 WeakPolarHBondContact O-CB 3.43Å; L52-K56 VanDerWaalsContact O-CG 3.3Å; L52-K56 WeakPolarHBondContact O-CG 3.22Å; L52-K56 PolarHBondContact O-N 2.93Å; Q53-K56 PolarHBondContact O-N 3.35Å; S54-K56 VanDerWaalsContact C-N 3.3Å; S54-K56 PolarHBondContact O-N 2.95Å; K56-T59 PolarHBondContact O-N 2.93Å; K56-R60 WeakPolarHBondContact O-CB 3.49Å; K56-R60 PolarHBondContact O-N 2.67Å
57	E	94.2	Very high	88.7	Confident	69 Å²	69	104.9 Å²	104.9	32%	0.322	51%	0.511	S	S	.	.	H	α-helix	trans	-68.4	-43.1	178	-178.9	54.5	-155.3	0	0	111.6	Q53 S54 T59 R60 Q61	Q53-E57 PolarHBondContact O-N 3.08Å; S54-E57 PolarHBondContact O-N 2.76Å; S54-E57 VanDerWaalsContact O-N 3.1Å; E57-T59 VanDerWaalsContact C-N 3.3Å; E57-T59 PolarHBondContact O-N 3.38Å; E57-R60 WeakPolarHBondContact O-CB 3.34Å; E57-R60 PolarHBondContact O-N 2.89Å; E57-R60 VanDerWaalsContact O-N 3.17Å; E57-R60 IonicContact OE1-CZ 2.67Å; E57-R60 IonicContact OE1-NE 3.56Å; E57-R60 IonicContact OE1-NH2 2.98Å; E57-R60 PolarHBondContact OE1-NH2 2.99Å; E57-R60 IonicContact OE2-CZ 3.09Å; E57-R60 IonicContact OE2-NE 3.29Å; E57-R60 PolarHBondContact OE2-NE 3.37Å; E57-R60 IonicContact OE2-NH2 3.88Å; E57-R60 PolarHBondContact OE2-NH2 3.37Å; E57-Q61 WeakPolarHBondContact O-CG 3.5Å; E57-Q61 PolarHBondContact O-N 3.24Å; E57-Q61 WeakPolarHBondContact OE1-CG 3.05Å; E57-Q61 PolarHBondContact OE1-NE2 3.33Å
58	D	92.9	Very high	87.8	Confident	82 Å²	82	103.3 Å²	103.3	44%	0.439	51%	0.507	S	S	.	.	H	α-helix	trans	-59	-43	174.5	-68	-27.4	0	0	0	111.3	S54 Q61 L62	S54-D58 VanDerWaalsContact O-CG 3.27Å; S54-D58 PolarHBondContact O-N 3.04Å; D58-Q61 PolarHBondContact O-N 2.76Å; D58-L62 WeakPolarHBondContact O-CB 3.47Å; D58-L62 PolarHBondContact O-N 3.28Å
59	T	90.1	Very high	86.6	Confident	73 Å²	73	105.1 Å²	105.1	45%	0.448	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-45.8	175.9	-56.1	0	0	0	0	110.7	L55 K56 E57 Q61 L62 E63	L55-T59 WeakPolarHBondContact O-CB 3.38Å; L55-T59 PolarHBondContact O-N 3.16Å; L55-T59 PolarHBondContact O-OG1 2.72Å; K56-T59 PolarHBondContact O-N 2.93Å; E57-T59 VanDerWaalsContact C-N 3.3Å; E57-T59 PolarHBondContact O-N 3.38Å; T59-Q61 PolarHBondContact O-N 3.28Å; T59-L62 PolarHBondContact O-N 2.85Å; T59-E63 WeakPolarHBondContact O-CB 3.33Å; T59-E63 WeakPolarHBondContact O-CG 3.5Å; T59-E63 PolarHBondContact O-N 2.97Å
60	R	91.2	Very high	84.9	Confident	132 Å²	132	108.3 Å²	108.3	50%	0.498	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-40.8	178	-169.6	-170.3	72.9	87.8	2	112.1	K56 E57 K64	K56-R60 WeakPolarHBondContact O-CB 3.49Å; K56-R60 PolarHBondContact O-N 2.67Å; E57-R60 WeakPolarHBondContact O-CB 3.34Å; E57-R60 PolarHBondContact O-N 2.89Å; E57-R60 VanDerWaalsContact O-N 3.17Å; E57-R60 IonicContact OE1-CZ 2.67Å; E57-R60 IonicContact OE1-NE 3.56Å; E57-R60 IonicContact OE1-NH2 2.98Å; E57-R60 PolarHBondContact OE1-NH2 2.99Å; E57-R60 IonicContact OE2-CZ 3.09Å; E57-R60 IonicContact OE2-NE 3.29Å; E57-R60 PolarHBondContact OE2-NE 3.37Å; E57-R60 IonicContact OE2-NH2 3.88Å; E57-R60 PolarHBondContact OE2-NH2 3.37Å; R60-K64 WeakPolarHBondContact O-CB 3.41Å; R60-K64 PolarHBondContact O-N 3.29Å
61	Q	89.5	Confident	83.4	Confident	84 Å²	84	108.5 Å²	108.5	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-66.3	-40.7	175.8	-73	-176.8	20.7	0	0	111.7	E57 D58 T59 K64 K65	E57-Q61 WeakPolarHBondContact O-CG 3.5Å; E57-Q61 PolarHBondContact O-N 3.24Å; E57-Q61 WeakPolarHBondContact OE1-CG 3.05Å; E57-Q61 PolarHBondContact OE1-NE2 3.33Å; D58-Q61 PolarHBondContact O-N 2.76Å; T59-Q61 PolarHBondContact O-N 3.28Å; Q61-K64 PolarHBondContact O-N 3.17Å; Q61-K65 WeakPolarHBondContact O-CB 3.45Å; Q61-K65 WeakPolarHBondContact O-CG 3.46Å; Q61-K65 PolarHBondContact O-N 3.48Å
62	L	85.7	Confident	81.8	Confident	95 Å²	95	107.6 Å²	107.6	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-64.7	-45.8	175.8	-176.2	63.2	0	0	0	111.1	D58 T59 K64 K65 M66	D58-L62 WeakPolarHBondContact O-CB 3.47Å; D58-L62 PolarHBondContact O-N 3.28Å; T59-L62 PolarHBondContact O-N 2.85Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 2.87Å; L62-K65 PolarHBondContact O-N 2.93Å; L62-M66 HydrophobicContact CG-SD 4.3Å; L62-M66 WeakPolarHBondContact O-CB 3.28Å; L62-M66 VanDerWaalsContact O-CG 3.28Å; L62-M66 WeakPolarHBondContact O-CG 3.47Å; L62-M66 PolarHBondContact O-N 3.47Å
63	E	80	Confident	79.8	Confident	120 Å²	120	105.7 Å²	105.7	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-56.8	-47.4	174.1	-78.6	-178.8	164.5	0	0	111.1	T59 M66 Q67	T59-E63 WeakPolarHBondContact O-CB 3.33Å; T59-E63 WeakPolarHBondContact O-CG 3.5Å; T59-E63 PolarHBondContact O-N 2.97Å; E63-M66 CarbonylContact O-C 3.55Å; E63-M66 PolarHBondContact O-N 3.01Å; E63-M66 VanDerWaalsContact O-N 3.17Å; E63-Q67 WeakPolarHBondContact O-CB 3.43Å; E63-Q67 PolarHBondContact O-N 3.49Å
64	K	83.9	Confident	77.5	Confident	116 Å²	116	102.7 Å²	102.7	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-47.6	176	-172.2	175.4	179.4	-179.8	0	111.8	R60 Q61 L62 M66 Q67 D68	R60-K64 WeakPolarHBondContact O-CB 3.41Å; R60-K64 PolarHBondContact O-N 3.29Å; Q61-K64 PolarHBondContact O-N 3.17Å; L62-K64 VanDerWaalsContact C-N 3.34Å; L62-K64 PolarHBondContact O-N 2.87Å; K64-M66 VanDerWaalsContact C-N 3.25Å; K64-M66 PolarHBondContact O-N 2.91Å; K64-Q67 PolarHBondContact O-N 2.97Å; K64-Q67 VanDerWaalsContact O-N 3.11Å; K64-D68 WeakPolarHBondContact O-CB 3.39Å; K64-D68 PolarHBondContact O-N 2.91Å
65	K	79.7	Confident	75.1	Confident	127 Å²	127	108.6 Å²	108.6	55%	0.552	53%	0.53	S	S	*	.	H	α-helix	trans	-59.8	-34.6	175.1	-77.1	177.6	-179.7	175.2	0	112.5	Q61 L62 R69	Q61-K65 WeakPolarHBondContact O-CB 3.45Å; Q61-K65 WeakPolarHBondContact O-CG 3.46Å; Q61-K65 PolarHBondContact O-N 3.48Å; L62-K65 PolarHBondContact O-N 2.93Å; K65-R69 WeakPolarHBondContact O-CB 3.5Å; K65-R69 VanDerWaalsContact O-CG 3.3Å; K65-R69 WeakPolarHBondContact O-CG 3.14Å; K65-R69 PolarHBondContact O-N 2.93Å; K65-R69 VanDerWaalsContact O-N 3.08Å; K65-R69 PolarHBondContact O-NE 3.3Å
66	M	65.2	Low	72.6	Confident	106 Å²	106	110.2 Å²	110.2	52%	0.522	54%	0.535	S	S	.	.	H	α-helix	trans	-72.8	-39	175.5	-72.1	-177.2	80.6	0	0	111.3	L62 E63 K64 R69 H70	L62-M66 HydrophobicContact CG-SD 4.3Å; L62-M66 WeakPolarHBondContact O-CB 3.28Å; L62-M66 VanDerWaalsContact O-CG 3.28Å; L62-M66 WeakPolarHBondContact O-CG 3.47Å; L62-M66 PolarHBondContact O-N 3.47Å; E63-M66 CarbonylContact O-C 3.55Å; E63-M66 PolarHBondContact O-N 3.01Å; E63-M66 VanDerWaalsContact O-N 3.17Å; K64-M66 VanDerWaalsContact C-N 3.25Å; K64-M66 PolarHBondContact O-N 2.91Å; M66-R69 PolarHBondContact O-N 3.28Å; M66-H70 WeakPolarHBondContact O-CB 2.93Å; M66-H70 PolarHBondContact O-N 2.79Å
67	Q	73	Confident	70.1	Confident	139 Å²	139	108 Å²	108	65%	0.65	53%	0.532	S	S	*	.	H	α-helix	trans	-68	-42.4	177.2	-164.5	169.4	9	0	0	111.5	E63 K64 H70 A71	E63-Q67 WeakPolarHBondContact O-CB 3.43Å; E63-Q67 PolarHBondContact O-N 3.49Å; K64-Q67 PolarHBondContact O-N 2.97Å; K64-Q67 VanDerWaalsContact O-N 3.11Å; Q67-H70 CarbonylContact O-C 3.46Å; Q67-H70 PolarHBondContact O-N 2.9Å; Q67-A71 WeakPolarHBondContact O-CB 3.2Å; Q67-A71 PolarHBondContact O-N 3.26Å
68	D	73.5	Confident	67.6	Low	83 Å²	83	112.2 Å²	112.2	44%	0.444	55%	0.55	S	S	.	.	H	α-helix	trans	-62.7	-43.7	173.6	-65.9	-19.6	0	0	0	110.5	K64 H70 A71 L72	K64-D68 WeakPolarHBondContact O-CB 3.39Å; K64-D68 PolarHBondContact O-N 2.91Å; D68-H70 VanDerWaalsContact C-N 3.33Å; D68-H70 PolarHBondContact O-N 3.22Å; D68-A71 PolarHBondContact O-N 2.77Å; D68-L72 WeakPolarHBondContact O-CG 3.47Å; D68-L72 PolarHBondContact O-N 2.75Å
69	R	66.7	Low	65.1	Low	154 Å²	154	114.4 Å²	114.4	58%	0.581	56%	0.561	S	S	*	*	H	α-helix	trans	-63.2	-37	172.8	-80.5	-170.4	-71	170.2	-4.2	112.9	K65 M66 L72	K65-R69 WeakPolarHBondContact O-CB 3.5Å; K65-R69 VanDerWaalsContact O-CG 3.3Å; K65-R69 WeakPolarHBondContact O-CG 3.14Å; K65-R69 PolarHBondContact O-N 2.93Å; K65-R69 VanDerWaalsContact O-N 3.08Å; K65-R69 PolarHBondContact O-NE 3.3Å; M66-R69 PolarHBondContact O-N 3.28Å; R69-L72 PolarHBondContact O-N 3.16Å
70	H	59.2	Low	62.6	Low	136 Å²	136	117.3 Å²	117.3	63%	0.63	57%	0.569	S	S	*	*	H	α-helix	trans	-71.2	-34	176.5	-168.5	66.2	0	0	0	111.6	M66 Q67 D68 V73	M66-H70 WeakPolarHBondContact O-CB 2.93Å; M66-H70 PolarHBondContact O-N 2.79Å; Q67-H70 CarbonylContact O-C 3.46Å; Q67-H70 PolarHBondContact O-N 2.9Å; D68-H70 VanDerWaalsContact C-N 3.33Å; D68-H70 PolarHBondContact O-N 3.22Å; H70-V73 WeakPolarHBondContact O-CB 3.34Å; H70-V73 PolarHBondContact O-N 2.93Å
71	A	61.4	Low	60.4	Low	78 Å²	78	115.2 Å²	115.2	65%	0.645	57%	0.573	S	S	*	*	H	α-helix	trans	-68.9	-33.4	174.4	0	0	0	0	0	112.5	Q67 D68 V73	Q67-A71 WeakPolarHBondContact O-CB 3.2Å; Q67-A71 PolarHBondContact O-N 3.26Å; D68-A71 PolarHBondContact O-N 2.77Å; A71-V73 PolarHBondContact O-N 2.9Å
72	L	61.8	Low	58.5	Low	139 Å²	139	114.1 Å²	114.1	73%	0.728	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-7.7	171.1	-72.9	166.8	0	0	0	113.7	D68 R69 P74	D68-L72 WeakPolarHBondContact O-CG 3.47Å; D68-L72 PolarHBondContact O-N 2.75Å; R69-L72 PolarHBondContact O-N 3.16Å; L72-P74 VanDerWaalsContact C-CD 3.49Å; L72-P74 WeakPolarHBondContact O-CD 3.27Å
73	V	50.1	Low	56.7	Low	56 Å²	56	110.9 Å²	110.9	34%	0.339	56%	0.563	S	S	.	*	S	Bend	trans	-88.9	97.3	166.2	-176.3	0	0	0	0	106.5	H70 A71 K75 V77 F78	H70-V73 WeakPolarHBondContact O-CB 3.34Å; H70-V73 PolarHBondContact O-N 2.93Å; A71-V73 PolarHBondContact O-N 2.9Å; V73-K75 PolarHBondContact O-N 3.4Å; V73-V77 HydrophobicContact CG1-CB 3.96Å; V73-V77 HydrophobicContact CG1-CG1 4.35Å; V73-V77 HydrophobicContact CG1-CG2 4.18Å; V73-F78 HydrophobicContact CG1-CE2 4Å
74	P	46.5	Very low	55.1	Low	67 Å²	67	112.7 Å²	112.7	44%	0.435	58%	0.576	S	S	.	*			trans	-52.5	139.4	171.8	1.7	-7.9	0	0	0	108.7	L72 E76 V77	L72-P74 VanDerWaalsContact C-CD 3.49Å; L72-P74 WeakPolarHBondContact O-CD 3.27Å; P74-E76 HydrophobicContact CB-CB 4.28Å; P74-E76 PolarHBondContact O-N 2.94Å; P74-V77 HydrophobicContact CB-CG2 4.4Å; P74-V77 HydrophobicContact CG-CG2 3.76Å; P74-V77 WeakPolarHBondContact O-CB 3.23Å; P74-V77 WeakPolarHBondContact O-CG2 3.45Å; P74-V77 PolarHBondContact O-N 3.25Å
75	K	44.2	Very low	53.7	Low	188 Å²	188	108.7 Å²	108.7	82%	0.817	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-52.9	-22.4	171.6	-75.4	-177.6	175.3	177.8	0	111.5	V73 V77 F78	V73-K75 PolarHBondContact O-N 3.4Å; K75-V77 VanDerWaalsContact C-N 3.33Å; K75-V77 PolarHBondContact O-N 3.28Å; K75-F78 PolarHBondContact O-N 2.92Å
76	E	40.5	Very low	52.4	Low	133 Å²	133	109.9 Å²	109.9	62%	0.621	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-68.9	-21.6	175.3	-63.9	170.6	-175.9	0	0	114.4	P74 F78 L79 H80	P74-E76 HydrophobicContact CB-CB 4.28Å; P74-E76 PolarHBondContact O-N 2.94Å; E76-F78 PolarHBondContact O-N 3.32Å; E76-L79 CarbonylContact O-C 3.31Å; E76-L79 WeakPolarHBondContact O-CA 3.49Å; E76-L79 PolarHBondContact O-N 2.78Å; E76-H80 PolarHBondContact O-N 3.37Å; E76-H80 VanDerWaalsContact O-N 3.1Å
77	V	43.4	Very low	52.3	Low	90 Å²	90	106.9 Å²	106.9	55%	0.545	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-63.5	-27.4	171.7	-179.6	0	0	0	0	111	V73 P74 K75	V73-V77 HydrophobicContact CG1-CB 3.96Å; V73-V77 HydrophobicContact CG1-CG1 4.35Å; V73-V77 HydrophobicContact CG1-CG2 4.18Å; P74-V77 HydrophobicContact CB-CG2 4.4Å; P74-V77 HydrophobicContact CG-CG2 3.76Å; P74-V77 WeakPolarHBondContact O-CB 3.23Å; P74-V77 WeakPolarHBondContact O-CG2 3.45Å; P74-V77 PolarHBondContact O-N 3.25Å; K75-V77 VanDerWaalsContact C-N 3.33Å; K75-V77 PolarHBondContact O-N 3.28Å
78	F	41.6	Very low	51.8	Low	159 Å²	159	106.1 Å²	106.1	70%	0.697	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-83.7	-12.6	170.9	-66.6	-78	0	0	0	113.3	V73 K75 E76	V73-F78 HydrophobicContact CG1-CE2 4Å; K75-F78 PolarHBondContact O-N 2.92Å; E76-F78 PolarHBondContact O-N 3.32Å
79	L	38.8	Very low	51.7	Low	127 Å²	127	106.4 Å²	106.4	67%	0.665	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-4.3	-177.6	-70.1	165.6	0	0	0	114.3	E76 P81	E76-L79 CarbonylContact O-C 3.31Å; E76-L79 WeakPolarHBondContact O-CA 3.49Å; E76-L79 PolarHBondContact O-N 2.78Å; L79-P81 VanDerWaalsContact O-CD 3.23Å; L79-P81 WeakPolarHBondContact O-CD 3.38Å
80	H	39.1	Very low	52.1	Low	135 Å²	135	99.7 Å²	99.7	63%	0.625	55%	0.551	S	S	*	*			trans	-102.3	89.6	167.4	-88.8	-75.5	0	0	0	110	E76 C82	E76-H80 PolarHBondContact O-N 3.37Å; E76-H80 VanDerWaalsContact O-N 3.1Å; H80-C82 PolarHBondContact O-N 3.48Å
81	P	45.2	Very low	53	Low	88 Å²	88	96.6 Å²	96.6	57%	0.571	54%	0.541	S	S	*	.	S	Bend	trans	-75.4	-7.4	-178.3	-6.9	27.4	0	0	0	111.7	L79 L192	L79-P81 VanDerWaalsContact O-CD 3.23Å; L79-P81 WeakPolarHBondContact O-CD 3.38Å; P81-L192 WeakPolarHBondContact O-CD2 3.18Å
82	C	48.3	Very low	54.1	Low	60 Å²	60	93.5 Å²	93.5	41%	0.405	51%	0.513	S	S	.	.	S	Bend	trans	-155	103.4	174.4	-75	0	0	0	0	105.1	H80 L84	H80-C82 PolarHBondContact O-N 3.48Å; C82-L84 PolarHBondContact O-N 3.09Å
83	G	48.9	Very low	55.2	Low	27 Å²	27	88.2 Å²	88.2	28%	0.278	49%	0.485	S	S	.	.	B	Isolated β-bridge	trans	-67	100.8	170.1	0	0	0	0	0	108.1	S85	G83-S85 PolarHBondContact O-N 3.04Å
84	L	46.7	Very low	56.8	Low	159 Å²	159	86 Å²	86	83%	0.832	47%	0.474	S	S	*	.			trans	-61.1	114.8	153.6	-75.3	162.5	0	0	0	104.5	C82	C82-L84 PolarHBondContact O-N 3.09Å
85	S	53	Low	58.8	Low	32 Å²	32	87.1 Å²	87.1	22%	0.224	47%	0.47	C	S	.	.			trans	-61	154.1	176.1	-156.5	0	0	0	0	109.3	G83 D87 V90 E93	G83-S85 PolarHBondContact O-N 3.04Å; S85-D87 PolarHBondContact O-N 3.33Å; S85-V90 VanDerWaalsContact CB-CB 3.5Å; S85-E93 WeakPolarHBondContact CB-OE1 3.45Å; S85-E93 PolarHBondContact OG-OE1 3.23Å
86	V	54.2	Low	61	Low	152 Å²	152	78.1 Å²	78.1	92%	0.921	43%	0.431	S	S	*	.	S	Bend	trans	-65.1	-22.9	168.4	-172	0	0	0	0	110	P88	V86-P88 WeakPolarHBondContact O-CD 3.39Å
87	D	62	Low	63.4	Low	42 Å²	42	74.1 Å²	74.1	23%	0.225	41%	0.411	C	S	.	.	S	Bend	trans	-80.3	115.1	176.8	-171.6	-15.7	0	0	0	111	S85 D89 V90 K115	S85-D87 PolarHBondContact O-N 3.33Å; D87-D89 PolarHBondContact O-N 2.98Å; D87-D89 VanDerWaalsContact O-N 3.15Å; D87-D89 WeakPolarHBondContact OD1-CB 3.26Å; D87-D89 PolarHBondContact OD1-N 3.22Å; D87-V90 HydrophobicContact CB-CB 4.41Å; D87-V90 HydrophobicContact CB-CG2 3.81Å; D87-V90 PolarHBondContact O-N 3.13Å; D87-V90 VanDerWaalsContact O-N 3.08Å; D87-K115 IonicContact OD1-NZ 3.24Å; D87-K115 IonicContact OD2-NZ 3.49Å; D87-K115 PolarHBondContact OD2-NZ 3.08Å
88	P	61.9	Low	65.6	Low	124 Å²	124	72 Å²	72	81%	0.805	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-18	-178.4	26.7	-34.4	0	0	0	113.6	V86 V90	V86-P88 WeakPolarHBondContact O-CD 3.39Å; P88-V90 VanDerWaalsContact C-N 3.33Å
89	D	71.6	Confident	67.8	Low	88 Å²	88	67 Å²	67	47%	0.471	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-15.1	177.6	-63.2	-20.3	0	0	0	112.8	D87 K115	D87-D89 PolarHBondContact O-N 2.98Å; D87-D89 VanDerWaalsContact O-N 3.15Å; D87-D89 WeakPolarHBondContact OD1-CB 3.26Å; D87-D89 PolarHBondContact OD1-N 3.22Å; D89-K115 HydrophobicContact CB-CD 4.08Å; D89-K115 HydrophobicContact CB-CG 4.19Å; D89-K115 IonicContact OD2-NZ 3.74Å
90	V	75.8	Confident	69.6	Low	14 Å²	14	62 Å²	62	9%	0.085	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	112.9	-179.6	176.8	0	0	0	0	109.5	S85 D87 P88 E93 I113 I114 K115	S85-V90 VanDerWaalsContact CB-CB 3.5Å; D87-V90 HydrophobicContact CB-CB 4.41Å; D87-V90 HydrophobicContact CB-CG2 3.81Å; D87-V90 PolarHBondContact O-N 3.13Å; D87-V90 VanDerWaalsContact O-N 3.08Å; P88-V90 VanDerWaalsContact C-N 3.33Å; V90-E93 HydrophobicContact CG1-CB 4.16Å; V90-E93 HydrophobicContact CG1-CG 4.36Å; V90-I113 HydrophobicContact CG1-CG2 3.81Å; V90-I113 HydrophobicContact CG2-CG2 4.07Å; V90-I114 WeakPolarHBondContact CA-O 3.28Å; V90-K115 HydrophobicContact CG2-CB 4.28Å; V90-K115 HydrophobicContact CG2-CD 3.84Å; V90-K115 HydrophobicContact CG2-CG 4.45Å
91	V	78.1	Confident	71	Confident	71 Å²	71	60.3 Å²	60.3	43%	0.43	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	-40.8	-179.4	-178.1	0	0	0	0	111.2	I114 A199	V91-I114 HydrophobicContact CB-CB 4.18Å; V91-I114 HydrophobicContact CB-CG2 3.94Å; V91-I114 HydrophobicContact CG2-CG2 4.19Å; V91-I114 PolarHBondContact N-O 2.85Å; V91-A199 HydrophobicContact CG1-CB 4.29Å
92	M	84.2	Confident	71.8	Confident	12 Å²	12	66 Å²	66	6%	0.059	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	141.1	179.5	-168.5	172.1	-178.1	0	0	110.4	I114 A195 W196 A199	M92-I114 HydrophobicContact CB-CD1 4.17Å; M92-I114 PolarHBondContact O-N 3.49Å; M92-A195 HydrophobicContact CE-CB 3.74Å; M92-A195 HydrophobicContact SD-CB 4.46Å; M92-W196 HydrophobicContact CE-CD2 3.83Å; M92-W196 HydrophobicContact CE-CG 3.76Å; M92-W196 HydrophobicContact CE-CZ2 4.44Å; M92-W196 HydrophobicContact CG-CD2 4.46Å; M92-W196 HydrophobicContact CG-CE3 4.46Å; M92-W196 HydrophobicContact CG-CH2 4.36Å; M92-W196 HydrophobicContact CG-CZ2 4.38Å; M92-W196 HydrophobicContact CG-CZ3 4.42Å; M92-W196 HydrophobicContact SD-CB 4.48Å; M92-W196 HydrophobicContact SD-CD2 3.77Å; M92-W196 HydrophobicContact SD-CE3 4.01Å; M92-W196 HydrophobicContact SD-CG 4Å; M92-A199 HydrophobicContact CB-CB 3.91Å; M92-A199 HydrophobicContact CG-CB 4.39Å; M92-A199 HydrophobicContact SD-CB 3.57Å; M92-A199 VanDerWaalsContact SD-CB 3.57Å
93	E	85.2	Confident	72.2	Confident	28 Å²	28	67.6 Å²	67.6	13%	0.131	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159	170	64.4	177.7	155.4	0	0	112.6	S85 V90 W111 F112 I113	S85-E93 WeakPolarHBondContact CB-OE1 3.45Å; S85-E93 PolarHBondContact OG-OE1 3.23Å; V90-E93 HydrophobicContact CG1-CB 4.16Å; V90-E93 HydrophobicContact CG1-CG 4.36Å; E93-W111 HydrophobicContact CB-CZ2 4.4Å; E93-W111 HydrophobicContact CG-CZ2 3.99Å; E93-W111 PolarHBondContact OE2-NE1 2.67Å; E93-F112 CarbonylContact C-O 3.6Å; E93-F112 WeakPolarHBondContact CA-O 3.42Å; E93-F112 WeakPolarHBondContact CB-O 3.38Å; E93-I113 HydrophobicContact CB-CB 4.46Å; E93-I113 HydrophobicContact CB-CG1 4.04Å; E93-I113 HydrophobicContact CB-CG2 4.49Å
94	G	84.4	Confident	72.5	Confident	10 Å²	10	72.5 Å²	72.5	10%	0.103	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.5	178.3	176.2	0	0	0	0	0	114.3	F112	G94-F112 PolarHBondContact N-O 3.22Å; G94-F112 PolarHBondContact O-N 3.29Å
95	Y	87.8	Confident	73.7	Confident	90 Å²	90	72.4 Å²	72.4	35%	0.353	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	131.5	178	-74.3	-70.1	0	0	0	112.4	R109 R110 W111	Y95-R109 HydrophobicContact CD1-CG 3.82Å; Y95-R109 HydrophobicContact CG-CG 4.3Å; Y95-R110 WeakPolarHBondContact CA-O 3.4Å; Y95-W111 AromaticContact CD1-CE3 3.92Å; Y95-W111 HydrophobicContact CD1-CE3 3.92Å; Y95-W111 AromaticContact CD2-CE3 3.44Å; Y95-W111 HydrophobicContact CD2-CE3 3.44Å; Y95-W111 VanDerWaalsContact CD2-CE3 3.44Å; Y95-W111 AromaticContact CD2-CZ3 3.38Å; Y95-W111 HydrophobicContact CD2-CZ3 3.38Å; Y95-W111 HydrophobicContact CE1-CB 4.38Å; Y95-W111 AromaticContact CE1-CE3 3.86Å; Y95-W111 HydrophobicContact CE1-CE3 3.86Å; Y95-W111 AromaticContact CE2-CE3 3.36Å; Y95-W111 HydrophobicContact CE2-CE3 3.36Å; Y95-W111 AromaticContact CE2-CZ3 3.33Å; Y95-W111 HydrophobicContact CE2-CZ3 3.33Å; Y95-W111 AromaticContact CG-CE3 3.72Å; Y95-W111 HydrophobicContact CG-CE3 3.72Å; Y95-W111 HydrophobicContact CG-CZ3 4.08Å; Y95-W111 AromaticContact CZ-CE3 3.57Å
96	L	90.3	Very high	74.8	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.5	163	-65.7	169.8	0	0	0	109.3	R109 R110 F112 F166 L185 Q186 A187 W196	L96-R109 WeakPolarHBondContact O-CA 3.46Å; L96-R110 PolarHBondContact N-O 3.27Å; L96-R110 PolarHBondContact O-N 2.96Å; L96-R110 VanDerWaalsContact O-O 3.12Å; L96-F112 HydrophobicContact CB-CD2 3.56Å; L96-F112 HydrophobicContact CB-CE2 3.78Å; L96-F112 HydrophobicContact CB-CG 4.35Å; L96-F112 HydrophobicContact CD1-CB 4.17Å; L96-F112 HydrophobicContact CD1-CD2 4.07Å; L96-F112 HydrophobicContact CD1-CG 4.03Å; L96-F112 HydrophobicContact CG-CD2 4.18Å; L96-F166 HydrophobicContact CD1-CE1 4.47Å; L96-F166 HydrophobicContact CD1-CZ 3.86Å; L96-F166 HydrophobicContact CD2-CE1 3.99Å; L96-F166 HydrophobicContact CD2-CZ 4.19Å; L96-L185 HydrophobicContact CD1-CB 4.48Å; L96-L185 HydrophobicContact CD1-CD1 4.08Å; L96-Q186 WeakPolarHBondContact CD2-O 3.14Å; L96-A187 HydrophobicContact CD2-CB 3.97Å; L96-W196 HydrophobicContact CD1-CD2 3.73Å; L96-W196 HydrophobicContact CD1-CE3 3.9Å; L96-W196 HydrophobicContact CD1-CG 4.26Å; L96-W196 HydrophobicContact CD1-CH2 4.14Å; L96-W196 HydrophobicContact CD1-CZ2 3.96Å; L96-W196 HydrophobicContact CD1-CZ3 4.09Å; L96-W196 HydrophobicContact CD2-CD2 4.25Å; L96-W196 HydrophobicContact CD2-CG 4.1Å; L96-W196 HydrophobicContact CG-CD2 4.23Å; L96-W196 HydrophobicContact CG-CZ2 4.01Å
97	F	91.6	Very high	76.3	Confident	48 Å²	48	68.5 Å²	68.5	21%	0.211	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.9	165.7	-64.7	-102.9	0	0	0	109.4	W107 N108 R109 L185 Q186	F97-W107 HydrophobicContact CB-CB 4.37Å; F97-W107 HydrophobicContact CB-CE3 3.78Å; F97-W107 HydrophobicContact CD1-CB 4.42Å; F97-W107 WeakPolarHBondContact O-CZ3 3.39Å; F97-N108 WeakPolarHBondContact CA-O 3.3Å; F97-R109 HydrophobicContact CD1-CB 3.79Å; F97-R109 HydrophobicContact CD1-CG 4.21Å; F97-R109 HydrophobicContact CD2-CG 4.2Å; F97-R109 HydrophobicContact CE1-CB 3.58Å; F97-R109 HydrophobicContact CE1-CG 3.91Å; F97-R109 HydrophobicContact CE2-CB 4.46Å; F97-R109 HydrophobicContact CE2-CG 3.88Å; F97-R109 HydrophobicContact CG-CB 4.34Å; F97-R109 HydrophobicContact CG-CG 4.35Å; F97-R109 HydrophobicContact CZ-CB 3.93Å; F97-R109 HydrophobicContact CZ-CG 3.73Å; F97-L185 CarbonylContact O-C 3.59Å; F97-L185 VanDerWaalsContact O-CA 3.3Å; F97-L185 WeakPolarHBondContact O-CA 3.38Å; F97-Q186 HydrophobicContact CB-CB 4.17Å; F97-Q186 PolarHBondContact N-O 3.17Å; F97-Q186 PolarHBondContact O-N 2.98Å
98	K	89.9	Confident	77.4	Confident	47 Å²	47	70 Å²	70	20%	0.204	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	128.7	172.5	-175.4	-171.4	177.9	173	0	109.7	W107 N108 F112 M144 L185	K98-W107 WeakPolarHBondContact O-CA 2.93Å; K98-N108 PolarHBondContact N-O 3.27Å; K98-N108 PolarHBondContact O-N 2.88Å; K98-F112 HydrophobicContact CB-CE2 4.4Å; K98-F112 HydrophobicContact CB-CZ 4.04Å; K98-F112 HydrophobicContact CD-CZ 4.48Å; K98-M144 HydrophobicContact CD-CE 3.34Å; K98-M144 HydrophobicContact CG-CE 3.92Å; K98-L185 HydrophobicContact CB-CD2 3.93Å; K98-L185 HydrophobicContact CG-CD2 3.99Å
99	R	87.2	Confident	78.6	Confident	52 Å²	52	69.7 Å²	69.7	20%	0.196	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	130.1	169.8	-162.7	176.1	71.6	166.6	-2.1	109.9	R105 T106 W107 M184	R99-R105 HydrophobicContact CG-CB 4.07Å; R99-T106 CarbonylContact C-O 3.5Å; R99-T106 WeakPolarHBondContact CA-O 3.42Å; R99-W107 HydrophobicContact CB-CD2 3.97Å; R99-W107 HydrophobicContact CB-CE3 3.96Å; R99-W107 HydrophobicContact CB-CH2 3.94Å; R99-W107 HydrophobicContact CB-CZ2 3.89Å; R99-W107 HydrophobicContact CB-CZ3 3.93Å; R99-W107 HydrophobicContact CG-CD2 4.2Å; R99-W107 HydrophobicContact CG-CZ2 3.97Å; R99-M184 HydrophobicContact CB-CB 4.02Å; R99-M184 VanDerWaalsContact CZ-SD 3.54Å; R99-M184 PolarHBondContact N-O 2.9Å
100	S	77.2	Confident	79.3	Confident	23 Å²	23	69 Å²	69	16%	0.161	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-61.8	136.1	168	177.4	0	0	0	0	110.1	R102 T106	S100-R102 PolarHBondContact O-N 3.35Å; S100-R102 VanDerWaalsContact OG-CB 3.27Å; S100-R102 WeakPolarHBondContact OG-CB 3.4Å; S100-R102 WeakPolarHBondContact OG-CG 3.42Å; S100-R102 PolarHBondContact OG-N 3.01Å; S100-T106 WeakPolarHBondContact CB-O 3.5Å; S100-T106 WeakPolarHBondContact CB-OG1 3.42Å; S100-T106 PolarHBondContact N-O 3.48Å
101	S	67.6	Low	79.8	Confident	100 Å²	100	71.5 Å²	71.5	70%	0.699	35%	0.346	S	S	*	.	S	Bend	trans	-79	0.3	169.3	-50.7	0	0	0	0	112.6
102	R	62.4	Low	80.3	Confident	207 Å²	207	68.1 Å²	68.1	78%	0.781	33%	0.325	S	S	*	.	S	Bend	trans	-78.2	164.1	176.2	-56.4	-178	177.8	-163.2	-1.1	110.9	S100 I104	S100-R102 PolarHBondContact O-N 3.35Å; S100-R102 VanDerWaalsContact OG-CB 3.27Å; S100-R102 WeakPolarHBondContact OG-CB 3.4Å; S100-R102 WeakPolarHBondContact OG-CG 3.42Å; S100-R102 PolarHBondContact OG-N 3.01Å; R102-I104 VanDerWaalsContact C-N 3.26Å; R102-I104 CarbonylContact O-C 3.51Å; R102-I104 VanDerWaalsContact O-C 3.31Å; R102-I104 PolarHBondContact O-N 3.12Å
103	A	57.2	Low	80.5	Confident	94 Å²	94	68.5 Å²	68.5	78%	0.777	33%	0.328	S	S	*	.	S	Bend	trans	-48.7	-44.9	-177.2	0	0	0	0	0	113.2	R105	A103-R105 PolarHBondContact O-N 3.36Å
104	I	53.5	Low	80.6	Confident	130 Å²	130	67.2 Å²	67.2	67%	0.667	32%	0.321	S	S	*	.	S	Bend	trans	-81.4	108.2	167.4	-49.3	176.6	0	0	0	107.7	R102 T106	R102-I104 VanDerWaalsContact C-N 3.26Å; R102-I104 CarbonylContact O-C 3.51Å; R102-I104 VanDerWaalsContact O-C 3.31Å; R102-I104 PolarHBondContact O-N 3.12Å; I104-T106 HydrophobicContact CB-CG2 4.17Å; I104-T106 HydrophobicContact CG2-CG2 3.48Å; I104-T106 VanDerWaalsContact CG2-CG2 3.48Å; I104-T106 PolarHBondContact O-N 3.1Å
105	R	72	Confident	80.5	Confident	156 Å²	156	68.1 Å²	68.1	59%	0.589	32%	0.323	S	S	*	.			trans	-70.9	56.1	177.5	-63.9	178.6	-178.7	-176.4	1.1	111.4	R99 A103	R99-R105 HydrophobicContact CG-CB 4.07Å; A103-R105 PolarHBondContact O-N 3.36Å
106	T	77.8	Confident	80.1	Confident	63 Å²	63	68.3 Å²	68.3	39%	0.387	33%	0.33	S	S	.	.			trans	-65.7	142.3	177.4	56.7	0	0	0	0	110.2	R99 S100 I104 N108	R99-T106 CarbonylContact C-O 3.5Å; R99-T106 WeakPolarHBondContact CA-O 3.42Å; S100-T106 WeakPolarHBondContact CB-O 3.5Å; S100-T106 WeakPolarHBondContact CB-OG1 3.42Å; S100-T106 PolarHBondContact N-O 3.48Å; I104-T106 HydrophobicContact CB-CG2 4.17Å; I104-T106 HydrophobicContact CG2-CG2 3.48Å; I104-T106 VanDerWaalsContact CG2-CG2 3.48Å; I104-T106 PolarHBondContact O-N 3.1Å; T106-N108 PolarHBondContact OG1-ND2 3.22Å
107	W	84.3	Confident	79.8	Confident	39 Å²	39	70.8 Å²	70.8	15%	0.148	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	115.3	179.1	-73.5	85.2	0	0	0	108.7	F97 K98 R99 R162 C165 M184 Q186	F97-W107 HydrophobicContact CB-CB 4.37Å; F97-W107 HydrophobicContact CB-CE3 3.78Å; F97-W107 HydrophobicContact CD1-CB 4.42Å; F97-W107 WeakPolarHBondContact O-CZ3 3.39Å; K98-W107 WeakPolarHBondContact O-CA 2.93Å; R99-W107 HydrophobicContact CB-CD2 3.97Å; R99-W107 HydrophobicContact CB-CE3 3.96Å; R99-W107 HydrophobicContact CB-CH2 3.94Å; R99-W107 HydrophobicContact CB-CZ2 3.89Å; R99-W107 HydrophobicContact CB-CZ3 3.93Å; R99-W107 HydrophobicContact CG-CD2 4.2Å; R99-W107 HydrophobicContact CG-CZ2 3.97Å; W107-R162 VanDerWaalsContact CD1-CZ 3.42Å; W107-R162 HydrophobicContact CZ2-CB 4.46Å; W107-C165 HydrophobicContact CH2-CB 4.45Å; W107-C165 WeakPolarHBondContact CH2-SG 3.04Å; W107-M184 HydrophobicContact CH2-CB 4.48Å; W107-M184 HydrophobicContact CH2-CG 3.8Å; W107-M184 HydrophobicContact CZ2-CG 4.41Å; W107-Q186 HydrophobicContact CE3-CB 4.02Å; W107-Q186 HydrophobicContact CH2-CB 4.03Å; W107-Q186 HydrophobicContact CZ3-CB 3.47Å; W107-Q186 VanDerWaalsContact CZ3-CB 3.47Å
108	N	85	Confident	79.5	Confident	74 Å²	74	71.8 Å²	71.8	40%	0.396	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125	-177.1	-65.9	-76.3	0	0	0	109.4	F97 K98 T106	F97-N108 WeakPolarHBondContact CA-O 3.3Å; K98-N108 PolarHBondContact N-O 3.27Å; K98-N108 PolarHBondContact O-N 2.88Å; T106-N108 PolarHBondContact OG1-ND2 3.22Å
109	R	87.4	Confident	79.5	Confident	118 Å²	118	69.6 Å²	69.6	45%	0.445	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	128.1	175.1	-154.7	-177.7	-171.3	-153.8	1.9	109.1	Y95 L96 F97 D188	Y95-R109 HydrophobicContact CD1-CG 3.82Å; Y95-R109 HydrophobicContact CG-CG 4.3Å; L96-R109 WeakPolarHBondContact O-CA 3.46Å; F97-R109 HydrophobicContact CD1-CB 3.79Å; F97-R109 HydrophobicContact CD1-CG 4.21Å; F97-R109 HydrophobicContact CD2-CG 4.2Å; F97-R109 HydrophobicContact CE1-CB 3.58Å; F97-R109 HydrophobicContact CE1-CG 3.91Å; F97-R109 HydrophobicContact CE2-CB 4.46Å; F97-R109 HydrophobicContact CE2-CG 3.88Å; F97-R109 HydrophobicContact CG-CB 4.34Å; F97-R109 HydrophobicContact CG-CG 4.35Å; F97-R109 HydrophobicContact CZ-CB 3.93Å; F97-R109 HydrophobicContact CZ-CG 3.73Å; R109-D188 IonicContact NH2-OD2 3.58Å; R109-D188 PolarHBondContact NH2-OD2 3.12Å
110	R	86.5	Confident	79.6	Confident	73 Å²	73	67.3 Å²	67.3	28%	0.275	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.1	176	-59.7	-69.9	-172.7	-166	2	109.2	Y95 L96 F112 Y121 P124	Y95-R110 WeakPolarHBondContact CA-O 3.4Å; L96-R110 PolarHBondContact N-O 3.27Å; L96-R110 PolarHBondContact O-N 2.96Å; L96-R110 VanDerWaalsContact O-O 3.12Å; R110-F112 HydrophobicContact CB-CD2 4.16Å; R110-F112 HydrophobicContact CB-CE2 3.74Å; R110-F112 HydrophobicContact CB-CZ 4.48Å; R110-F112 WeakPolarHBondContact O-CD2 3.44Å; R110-Y121 HydrophobicContact CB-CD2 4.24Å; R110-Y121 HydrophobicContact CB-CG 4.44Å; R110-Y121 HydrophobicContact CG-CD2 4.11Å; R110-P124 VanDerWaalsContact NH1-CB 3.28Å; R110-P124 VanDerWaalsContact NH1-CD 3.29Å
111	W	86	Confident	80.1	Confident	67 Å²	67	68.1 Å²	68.1	25%	0.254	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	119.1	170.3	-168.3	-94.9	0	0	0	108.6	E93 Y95 Y121 V122	E93-W111 HydrophobicContact CB-CZ2 4.4Å; E93-W111 HydrophobicContact CG-CZ2 3.99Å; E93-W111 PolarHBondContact OE2-NE1 2.67Å; Y95-W111 AromaticContact CD1-CE3 3.92Å; Y95-W111 HydrophobicContact CD1-CE3 3.92Å; Y95-W111 AromaticContact CD2-CE3 3.44Å; Y95-W111 HydrophobicContact CD2-CE3 3.44Å; Y95-W111 VanDerWaalsContact CD2-CE3 3.44Å; Y95-W111 AromaticContact CD2-CZ3 3.38Å; Y95-W111 HydrophobicContact CD2-CZ3 3.38Å; Y95-W111 HydrophobicContact CE1-CB 4.38Å; Y95-W111 AromaticContact CE1-CE3 3.86Å; Y95-W111 HydrophobicContact CE1-CE3 3.86Å; Y95-W111 AromaticContact CE2-CE3 3.36Å; Y95-W111 HydrophobicContact CE2-CE3 3.36Å; Y95-W111 AromaticContact CE2-CZ3 3.33Å; Y95-W111 HydrophobicContact CE2-CZ3 3.33Å; Y95-W111 AromaticContact CG-CE3 3.72Å; Y95-W111 HydrophobicContact CG-CE3 3.72Å; Y95-W111 HydrophobicContact CG-CZ3 4.08Å; Y95-W111 AromaticContact CZ-CE3 3.57Å; W111-Y121 CarbonylContact O-C 3.6Å; W111-Y121 WeakPolarHBondContact O-CA 3.43Å; W111-Y121 WeakPolarHBondContact O-CB 3.34Å; W111-V122 HydrophobicContact CB-CB 4.29Å; W111-V122 HydrophobicContact CB-CG2 4.06Å; W111-V122 HydrophobicContact CG-CG2 4.35Å; W111-V122 PolarHBondContact O-N 2.69Å
112	F	89.8	Confident	80.8	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	147.6	-179.4	-80.3	-96.1	0	0	0	110.8	E93 G94 L96 K98 R110 L119 L120 Y121 M144 L185 W196	E93-F112 CarbonylContact C-O 3.6Å; E93-F112 WeakPolarHBondContact CA-O 3.42Å; E93-F112 WeakPolarHBondContact CB-O 3.38Å; G94-F112 PolarHBondContact N-O 3.22Å; G94-F112 PolarHBondContact O-N 3.29Å; L96-F112 HydrophobicContact CB-CD2 3.56Å; L96-F112 HydrophobicContact CB-CE2 3.78Å; L96-F112 HydrophobicContact CB-CG 4.35Å; L96-F112 HydrophobicContact CD1-CB 4.17Å; L96-F112 HydrophobicContact CD1-CD2 4.07Å; L96-F112 HydrophobicContact CD1-CG 4.03Å; L96-F112 HydrophobicContact CG-CD2 4.18Å; K98-F112 HydrophobicContact CB-CE2 4.4Å; K98-F112 HydrophobicContact CB-CZ 4.04Å; K98-F112 HydrophobicContact CD-CZ 4.48Å; R110-F112 HydrophobicContact CB-CD2 4.16Å; R110-F112 HydrophobicContact CB-CE2 3.74Å; R110-F112 HydrophobicContact CB-CZ 4.48Å; R110-F112 WeakPolarHBondContact O-CD2 3.44Å; F112-L119 HydrophobicContact CD1-CD1 3.95Å; F112-L119 HydrophobicContact CD1-CG 4.2Å; F112-L120 CarbonylContact C-O 3.52Å; F112-L120 VanDerWaalsContact CA-O 3.27Å; F112-L120 WeakPolarHBondContact CA-O 3.5Å; F112-L120 WeakPolarHBondContact CD1-O 3.15Å; F112-Y121 HydrophobicContact CE1-CD1 4.2Å; F112-Y121 HydrophobicContact CE1-CG 4.41Å; F112-Y121 HydrophobicContact CZ-CD1 4.46Å; F112-Y121 HydrophobicContact CZ-CG 4.48Å; F112-M144 HydrophobicContact CE1-CE 3.39Å; F112-M144 HydrophobicContact CE1-SD 3.78Å; F112-M144 HydrophobicContact CZ-CE 3.64Å; F112-L185 HydrophobicContact CE1-CD2 4.2Å; F112-L185 HydrophobicContact CE2-CD2 4.34Å; F112-L185 HydrophobicContact CZ-CD2 3.74Å; F112-W196 HydrophobicContact CB-CH2 3.6Å; F112-W196 HydrophobicContact CB-CZ2 4.27Å; F112-W196 HydrophobicContact CB-CZ3 4.18Å
113	I	86.7	Confident	81.5	Confident	20 Å²	20	58 Å²	58	10%	0.103	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.9	-179.4	-54.3	172.2	0	0	0	108.1	V90 E93 K115 L120 V122	V90-I113 HydrophobicContact CG1-CG2 3.81Å; V90-I113 HydrophobicContact CG2-CG2 4.07Å; E93-I113 HydrophobicContact CB-CB 4.46Å; E93-I113 HydrophobicContact CB-CG1 4.04Å; E93-I113 HydrophobicContact CB-CG2 4.49Å; I113-K115 HydrophobicContact CG2-CB 4.21Å; I113-L120 HydrophobicContact CB-CB 4.4Å; I113-L120 PolarHBondContact N-O 3.48Å; I113-L120 PolarHBondContact O-N 3.19Å; I113-V122 HydrophobicContact CD1-CG2 4.05Å
114	I	87.4	Confident	82	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	111.5	169	-57.8	172.5	0	0	0	107.7	V90 V91 M92 K118 L119 L148 W196 A199 L200 T203	V90-I114 WeakPolarHBondContact CA-O 3.28Å; V91-I114 HydrophobicContact CB-CB 4.18Å; V91-I114 HydrophobicContact CB-CG2 3.94Å; V91-I114 HydrophobicContact CG2-CG2 4.19Å; V91-I114 PolarHBondContact N-O 2.85Å; M92-I114 HydrophobicContact CB-CD1 4.17Å; M92-I114 PolarHBondContact O-N 3.49Å; I114-K118 WeakPolarHBondContact CA-O 3.01Å; I114-L119 HydrophobicContact CG1-CD1 3.83Å; I114-L148 HydrophobicContact CG2-CD1 4.21Å; I114-W196 HydrophobicContact CD1-CE3 3.92Å; I114-W196 HydrophobicContact CD1-CZ3 3.74Å; I114-W196 HydrophobicContact CG1-CZ3 3.86Å; I114-A199 HydrophobicContact CD1-CB 4.03Å; I114-L200 HydrophobicContact CD1-CD2 3.56Å; I114-L200 HydrophobicContact CD1-CG 3.75Å; I114-L200 HydrophobicContact CG1-CD2 4.07Å; I114-T203 HydrophobicContact CG2-CG2 3.92Å
115	K	82.4	Confident	82.5	Confident	30 Å²	30	58.6 Å²	58.6	13%	0.13	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	141.6	180	177	163.2	178.4	164.3	0	109.9	D87 D89 V90 I113 N117 K118 I137	D87-K115 IonicContact OD1-NZ 3.24Å; D87-K115 IonicContact OD2-NZ 3.49Å; D87-K115 PolarHBondContact OD2-NZ 3.08Å; D89-K115 HydrophobicContact CB-CD 4.08Å; D89-K115 HydrophobicContact CB-CG 4.19Å; D89-K115 IonicContact OD2-NZ 3.74Å; V90-K115 HydrophobicContact CG2-CB 4.28Å; V90-K115 HydrophobicContact CG2-CD 3.84Å; V90-K115 HydrophobicContact CG2-CG 4.45Å; I113-K115 HydrophobicContact CG2-CB 4.21Å; K115-N117 VanDerWaalsContact C-N 3.32Å; K115-N117 PolarHBondContact O-N 3.09Å; K115-K118 PolarHBondContact N-O 3.37Å; K115-K118 VanDerWaalsContact N-O 3.15Å; K115-K118 WeakPolarHBondContact O-CA 3.18Å; K115-K118 WeakPolarHBondContact O-CB 3.35Å; K115-K118 PolarHBondContact O-N 2.96Å; K115-I137 HydrophobicContact CD-CD1 4.05Å
116	N	80.2	Confident	81.9	Confident	94 Å²	94	52.2 Å²	52.2	50%	0.503	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	42.5	174.6	-59.2	-11.5	0	0	0	114.3	K118	N116-K118 WeakPolarHBondContact O-CG 3.38Å; N116-K118 PolarHBondContact O-N 2.9Å
117	N	83.1	Confident	80.6	Confident	51 Å²	51	54.2 Å²	54.2	27%	0.273	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	18.7	-175.5	-56.6	-29.2	0	0	0	115	K115 L148 A207	K115-N117 VanDerWaalsContact C-N 3.32Å; K115-N117 PolarHBondContact O-N 3.09Å; N117-L148 WeakPolarHBondContact O-CB 3.28Å; N117-L148 WeakPolarHBondContact O-CG 3.45Å; N117-L148 PolarHBondContact O-N 2.86Å; N117-A207 HydrophobicContact CB-CB 4.16Å; N117-A207 VanDerWaalsContact CG-CB 3.43Å; N117-A207 WeakPolarHBondContact ND2-CB 3.43Å; N117-A207 WeakPolarHBondContact OD1-CB 3.34Å
118	K	87.1	Confident	79.1	Confident	70 Å²	70	57.1 Å²	57.1	30%	0.304	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.4	177.2	-56.8	-175.2	-179.7	-159.9	0	111	I114 K115 N116 L120 E145 D146	I114-K118 WeakPolarHBondContact CA-O 3.01Å; K115-K118 PolarHBondContact N-O 3.37Å; K115-K118 VanDerWaalsContact N-O 3.15Å; K115-K118 WeakPolarHBondContact O-CA 3.18Å; K115-K118 WeakPolarHBondContact O-CB 3.35Å; K115-K118 PolarHBondContact O-N 2.96Å; N116-K118 WeakPolarHBondContact O-CG 3.38Å; N116-K118 PolarHBondContact O-N 2.9Å; K118-L120 HydrophobicContact CB-CD2 4.06Å; K118-L120 HydrophobicContact CB-CG 4.27Å; K118-E145 WeakPolarHBondContact CA-O 3.34Å; K118-D146 VanDerWaalsContact CD-OD1 3.22Å; K118-D146 WeakPolarHBondContact CD-OD1 3.3Å; K118-D146 WeakPolarHBondContact CE-O 3.26Å; K118-D146 WeakPolarHBondContact CE-OD1 3.38Å; K118-D146 WeakPolarHBondContact CG-O 3.42Å; K118-D146 IonicContact NZ-OD1 3.59Å; K118-D146 PolarHBondContact NZ-OD1 2.99Å; K118-D146 IonicContact NZ-OD2 3.66Å
119	L	89.7	Confident	77.5	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	117.1	166.6	-179.2	62.8	0	0	0	108.8	F112 I114 M144 E145 L148 L185 L200	F112-L119 HydrophobicContact CD1-CD1 3.95Å; F112-L119 HydrophobicContact CD1-CG 4.2Å; I114-L119 HydrophobicContact CG1-CD1 3.83Å; L119-M144 HydrophobicContact CD2-CG 4.48Å; L119-M144 HydrophobicContact CD2-SD 3.72Å; L119-M144 HydrophobicContact CG-CB 4.47Å; L119-M144 HydrophobicContact CG-SD 4.32Å; L119-M144 WeakPolarHBondContact O-CA 3.4Å; L119-M144 WeakPolarHBondContact O-CB 3.26Å; L119-M144 PolarHBondContact O-N 3.23Å; L119-E145 HydrophobicContact CB-CB 4.36Å; L119-E145 PolarHBondContact N-O 2.95Å; L119-E145 PolarHBondContact O-N 3.4Å; L119-E145 VanDerWaalsContact O-N 3.12Å; L119-L148 HydrophobicContact CB-CD1 4.44Å; L119-L148 HydrophobicContact CB-CD2 4.03Å; L119-L185 HydrophobicContact CD2-CD1 4.37Å; L119-L200 HydrophobicContact CD1-CD2 4.32Å; L119-L200 HydrophobicContact CD2-CD2 4.33Å
120	L	88.3	Confident	75.8	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	155.6	-174.3	-52.7	170.8	0	0	0	109.8	F112 I113 K118 I137 C141 T142 V143	F112-L120 CarbonylContact C-O 3.52Å; F112-L120 VanDerWaalsContact CA-O 3.27Å; F112-L120 WeakPolarHBondContact CA-O 3.5Å; F112-L120 WeakPolarHBondContact CD1-O 3.15Å; I113-L120 HydrophobicContact CB-CB 4.4Å; I113-L120 PolarHBondContact N-O 3.48Å; I113-L120 PolarHBondContact O-N 3.19Å; K118-L120 HydrophobicContact CB-CD2 4.06Å; K118-L120 HydrophobicContact CB-CG 4.27Å; L120-I137 HydrophobicContact CD1-CD1 4.28Å; L120-I137 HydrophobicContact CD1-CG1 4.21Å; L120-I137 HydrophobicContact CD1-CG2 3.98Å; L120-I137 HydrophobicContact CD2-CG2 4.45Å; L120-C141 HydrophobicContact CB-CB 4.42Å; L120-T142 WeakPolarHBondContact CA-O 3.18Å; L120-V143 HydrophobicContact CD2-CB 4.01Å; L120-V143 HydrophobicContact CD2-CG1 4.09Å; L120-V143 HydrophobicContact CD2-CG2 3.63Å
121	Y	87.4	Confident	73.9	Confident	40 Å²	40	64.1 Å²	64.1	16%	0.157	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.7	161.4	69.1	-91.8	0	0	0	112.2	R110 W111 F112 T142 M144	R110-Y121 HydrophobicContact CB-CD2 4.24Å; R110-Y121 HydrophobicContact CB-CG 4.44Å; R110-Y121 HydrophobicContact CG-CD2 4.11Å; W111-Y121 CarbonylContact O-C 3.6Å; W111-Y121 WeakPolarHBondContact O-CA 3.43Å; W111-Y121 WeakPolarHBondContact O-CB 3.34Å; F112-Y121 HydrophobicContact CE1-CD1 4.2Å; F112-Y121 HydrophobicContact CE1-CG 4.41Å; F112-Y121 HydrophobicContact CZ-CD1 4.46Å; F112-Y121 HydrophobicContact CZ-CG 4.48Å; Y121-T142 HydrophobicContact CE1-CG2 3.83Å; Y121-T142 HydrophobicContact CE2-CG2 4.39Å; Y121-T142 VanDerWaalsContact CZ-CB 3.49Å; Y121-T142 PolarHBondContact N-O 3.04Å; Y121-T142 PolarHBondContact O-N 3.13Å; Y121-T142 WeakPolarHBondContact OH-CG2 3.42Å; Y121-M144 HydrophobicContact CD1-CB 4.17Å; Y121-M144 HydrophobicContact CD1-CE 4.18Å; Y121-M144 HydrophobicContact CE1-CB 4.39Å; Y121-M144 HydrophobicContact CE1-CE 4.36Å
122	V	82.5	Confident	72	Confident	7 Å²	7	68.8 Å²	68.8	4%	0.042	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	134	-177.6	-175.4	0	0	0	0	110.5	W111 I113 V126 F128	W111-V122 HydrophobicContact CB-CB 4.29Å; W111-V122 HydrophobicContact CB-CG2 4.06Å; W111-V122 HydrophobicContact CG-CG2 4.35Å; W111-V122 PolarHBondContact O-N 2.69Å; I113-V122 HydrophobicContact CD1-CG2 4.05Å; V122-V126 HydrophobicContact CG1-CB 4.17Å; V122-V126 HydrophobicContact CG1-CG2 4.25Å; V122-F128 HydrophobicContact CG1-CZ 4.27Å
123	R	77.8	Confident	70	Confident	87 Å²	87	75.2 Å²	75.2	33%	0.328	37%	0.373	S	S	.	.			trans	-70.2	143	175.7	-68.3	-178.4	-170.4	137.6	1.6	110.1	E125 V126 T139 G140 C141 T142	R123-E125 PolarHBondContact O-N 3.43Å; R123-V126 HydrophobicContact CB-CG2 4.27Å; R123-V126 PolarHBondContact O-N 2.97Å; R123-T139 PolarHBondContact NH1-O 3.03Å; R123-G140 PolarHBondContact N-O 3.5Å; R123-C141 PolarHBondContact NH2-O 3.08Å; R123-T142 WeakPolarHBondContact CG-OG1 3.22Å; R123-T142 PolarHBondContact NE-OG1 2.93Å; R123-T142 VanDerWaalsContact NE-OG1 3.17Å
124	P	66.7	Low	68.3	Low	77 Å²	77	79.4 Å²	79.4	50%	0.5	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-24.9	179.6	24.5	-30.1	0	0	0	113.7	R110 V126	R110-P124 VanDerWaalsContact NH1-CB 3.28Å; R110-P124 VanDerWaalsContact NH1-CD 3.29Å; P124-V126 PolarHBondContact O-N 3.37Å
125	E	63.4	Low	66.8	Low	160 Å²	160	80.8 Å²	80.8	75%	0.748	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-10.1	-179.9	-58.9	111.4	-143.9	0	0	113.3	R123 D127	R123-E125 PolarHBondContact O-N 3.43Å; E125-D127 PolarHBondContact O-N 3.16Å; E125-D127 VanDerWaalsContact O-N 3.16Å
126	V	59.5	Low	65.8	Low	23 Å²	23	83.3 Å²	83.3	14%	0.139	42%	0.424	C	S	.	.	S	Bend	trans	-75.7	105.8	175.7	-175.8	0	0	0	0	108.4	V122 R123 P124 F128 G140	V122-V126 HydrophobicContact CG1-CB 4.17Å; V122-V126 HydrophobicContact CG1-CG2 4.25Å; R123-V126 HydrophobicContact CB-CG2 4.27Å; R123-V126 PolarHBondContact O-N 2.97Å; P124-V126 PolarHBondContact O-N 3.37Å; V126-F128 PolarHBondContact O-N 3Å; V126-F128 VanDerWaalsContact O-N 3.11Å; V126-G140 VanDerWaalsContact CG2-CA 3.45Å; V126-G140 WeakPolarHBondContact CG2-O 3.26Å
127	D	51	Low	64.8	Low	105 Å²	105	81.8 Å²	81.8	56%	0.561	42%	0.416	S	S	*	.			trans	-73.6	101.5	-179.9	-147.4	-5	0	0	0	109.5	E125 N129 N130	E125-D127 PolarHBondContact O-N 3.16Å; E125-D127 VanDerWaalsContact O-N 3.16Å; D127-N129 PolarHBondContact O-N 3.38Å; D127-N130 PolarHBondContact O-N 3.04Å
128	F	53.6	Low	63.8	Low	100 Å²	100	83.5 Å²	83.5	44%	0.439	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19.7	-178.1	-73.8	-82.7	0	0	0	113.6	V122 V126	V122-F128 HydrophobicContact CG1-CZ 4.27Å; V126-F128 PolarHBondContact O-N 3Å; V126-F128 VanDerWaalsContact O-N 3.11Å
129	N	51.9	Low	62.6	Low	144 Å²	144	84.2 Å²	84.2	77%	0.77	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-23	-176	-67.6	-23.8	0	0	0	113.9	D127	D127-N129 PolarHBondContact O-N 3.38Å
130	N	50.1	Low	61.5	Low	143 Å²	143	84.3 Å²	84.3	77%	0.765	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.8	-0	-167.8	-95.5	-0.3	0	0	0	115.8	D127	D127-N130 PolarHBondContact O-N 3.04Å
131	Q	46.4	Very low	61.1	Low	124 Å²	124	84.4 Å²	84.4	58%	0.579	44%	0.444	S	S	*	.	S	Bend	trans	-124.6	123.6	172.5	-69	-170.8	-6.4	0	0	110.8	F133	Q131-F133 PolarHBondContact O-N 3.45Å
132	L	46.1	Very low	60.8	Low	166 Å²	166	84.1 Å²	84.1	87%	0.869	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-55.2	126.4	165.2	-95.2	70.9	0	0	0	107.9
133	F	48.1	Very low	60.8	Low	135 Å²	135	86.8 Å²	86.8	59%	0.592	46%	0.462	S	S	*	.	S	Bend	trans	-48.2	138.6	162.3	-86	-100.1	0	0	0	109.4	Q131 V135	Q131-F133 PolarHBondContact O-N 3.45Å; F133-V135 HydrophobicContact CE1-CG2 4.48Å
134	P	50.6	Low	61.1	Low	108 Å²	108	83.5 Å²	83.5	70%	0.701	45%	0.451	S	S	*	.	P	Polyproline II helix	cis	-92	144.1	17.3	15.6	-0.8	0	0	0	114.5	D136	P134-D136 PolarHBondContact O-N 3.09Å
135	V	56	Low	61.8	Low	29 Å²	29	80.7 Å²	80.7	18%	0.176	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-65.9	117.9	171.1	179.9	0	0	0	0	108.7	F133 I137	F133-V135 HydrophobicContact CE1-CG2 4.48Å; V135-I137 PolarHBondContact O-N 3.39Å
136	D	61.4	Low	62.6	Low	83 Å²	83	77.7 Å²	77.7	44%	0.444	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-63.2	124.4	174.5	173.6	21.9	0	0	0	110.2	P134 S138 T139 G140	P134-D136 PolarHBondContact O-N 3.09Å; D136-S138 PolarHBondContact O-N 3.06Å; D136-S138 PolarHBondContact OD1-N 3.19Å; D136-S138 VanDerWaalsContact OD1-N 3.11Å; D136-S138 PolarHBondContact OD1-OG 3.49Å; D136-S138 PolarHBondContact OD2-OG 3.02Å; D136-T139 PolarHBondContact O-N 3.35Å; D136-T139 PolarHBondContact OD2-OG1 3.29Å; D136-G140 PolarHBondContact O-N 2.97Å
137	I	60.4	Low	63.6	Low	62 Å²	62	78.7 Å²	78.7	32%	0.318	43%	0.425	S	S	.	.	H	α-helix	trans	-56.9	-36.2	-178.1	-61.9	172.7	0	0	0	110.5	K115 L120 V135 T139	K115-I137 HydrophobicContact CD-CD1 4.05Å; L120-I137 HydrophobicContact CD1-CD1 4.28Å; L120-I137 HydrophobicContact CD1-CG1 4.21Å; L120-I137 HydrophobicContact CD1-CG2 3.98Å; L120-I137 HydrophobicContact CD2-CG2 4.45Å; V135-I137 PolarHBondContact O-N 3.39Å; I137-T139 PolarHBondContact O-N 3.34Å
138	S	61.5	Low	65.2	Low	87 Å²	87	73.7 Å²	73.7	61%	0.608	40%	0.398	S	S	*	.	H	α-helix	trans	-69.7	-34.3	-173.7	83.4	0	0	0	0	112.9	D136	D136-S138 PolarHBondContact O-N 3.06Å; D136-S138 PolarHBondContact OD1-N 3.19Å; D136-S138 VanDerWaalsContact OD1-N 3.11Å; D136-S138 PolarHBondContact OD1-OG 3.49Å; D136-S138 PolarHBondContact OD2-OG 3.02Å
139	T	61	Low	66.4	Low	84 Å²	84	73.8 Å²	73.8	52%	0.515	40%	0.396	S	S	.	.	H	α-helix	trans	-105.4	-38.7	-172.1	50.1	0	0	0	0	112.9	R123 D136 I137	R123-T139 PolarHBondContact NH1-O 3.03Å; D136-T139 PolarHBondContact O-N 3.35Å; D136-T139 PolarHBondContact OD2-OG1 3.29Å; I137-T139 PolarHBondContact O-N 3.34Å
140	G	67.7	Low	67.6	Low	3 Å²	3	72.4 Å²	72.4	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-99.9	-14.7	-170.4	0	0	0	0	0	116.3	R123 V126 D136	R123-G140 PolarHBondContact N-O 3.5Å; V126-G140 VanDerWaalsContact CG2-CA 3.45Å; V126-G140 WeakPolarHBondContact CG2-O 3.26Å; D136-G140 PolarHBondContact O-N 2.97Å
141	C	79	Confident	69.1	Low	5 Å²	5	66 Å²	66	3%	0.034	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	147.3	-172.2	-69.4	0	0	0	0	112.4	L120 R123	L120-C141 HydrophobicContact CB-CB 4.42Å; R123-C141 PolarHBondContact NH2-O 3.08Å
142	T	82.8	Confident	70.9	Confident	35 Å²	35	65.1 Å²	65.1	22%	0.215	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.2	164.3	-54.5	0	0	0	0	108.5	L120 Y121 R123 M144	L120-T142 WeakPolarHBondContact CA-O 3.18Å; Y121-T142 HydrophobicContact CE1-CG2 3.83Å; Y121-T142 HydrophobicContact CE2-CG2 4.39Å; Y121-T142 VanDerWaalsContact CZ-CB 3.49Å; Y121-T142 PolarHBondContact N-O 3.04Å; Y121-T142 PolarHBondContact O-N 3.13Å; Y121-T142 WeakPolarHBondContact OH-CG2 3.42Å; R123-T142 WeakPolarHBondContact CG-OG1 3.22Å; R123-T142 PolarHBondContact NE-OG1 2.93Å; R123-T142 VanDerWaalsContact NE-OG1 3.17Å; T142-M144 PolarHBondContact O-N 3.07Å
143	V	82.7	Confident	73	Confident	62 Å²	62	57.4 Å²	57.4	38%	0.376	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	116	172.4	-173.3	0	0	0	0	108.1	L120 D146	L120-V143 HydrophobicContact CD2-CB 4.01Å; L120-V143 HydrophobicContact CD2-CG1 4.09Å; L120-V143 HydrophobicContact CD2-CG2 3.63Å; V143-D146 HydrophobicContact CG1-CB 3.78Å
144	M	82.5	Confident	74.7	Confident	19 Å²	19	55.1 Å²	55.1	9%	0.094	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-48.2	171.1	173.2	177.3	-77.1	0	0	109.9	K98 F112 L119 Y121 T142 H183 L185	K98-M144 HydrophobicContact CD-CE 3.34Å; K98-M144 HydrophobicContact CG-CE 3.92Å; F112-M144 HydrophobicContact CE1-CE 3.39Å; F112-M144 HydrophobicContact CE1-SD 3.78Å; F112-M144 HydrophobicContact CZ-CE 3.64Å; L119-M144 HydrophobicContact CD2-CG 4.48Å; L119-M144 HydrophobicContact CD2-SD 3.72Å; L119-M144 HydrophobicContact CG-CB 4.47Å; L119-M144 HydrophobicContact CG-SD 4.32Å; L119-M144 WeakPolarHBondContact O-CA 3.4Å; L119-M144 WeakPolarHBondContact O-CB 3.26Å; L119-M144 PolarHBondContact O-N 3.23Å; Y121-M144 HydrophobicContact CD1-CB 4.17Å; Y121-M144 HydrophobicContact CD1-CE 4.18Å; Y121-M144 HydrophobicContact CE1-CB 4.39Å; Y121-M144 HydrophobicContact CE1-CE 4.36Å; T142-M144 PolarHBondContact O-N 3.07Å; M144-H183 HydrophobicContact SD-CB 4.24Å; M144-L185 HydrophobicContact CE-CD2 4.3Å
145	E	82	Confident	76.5	Confident	17 Å²	17	53.2 Å²	53.2	8%	0.079	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.4	174.3	-73.5	-60.9	163.5	0	0	109.3	K118 L119 L148 T170 H183	K118-E145 WeakPolarHBondContact CA-O 3.34Å; L119-E145 HydrophobicContact CB-CB 4.36Å; L119-E145 PolarHBondContact N-O 2.95Å; L119-E145 PolarHBondContact O-N 3.4Å; L119-E145 VanDerWaalsContact O-N 3.12Å; E145-L148 HydrophobicContact CB-CD2 4.16Å; E145-T170 HydrophobicContact CG-CG2 3.61Å; E145-T170 WeakPolarHBondContact OE1-CB 3.44Å; E145-T170 WeakPolarHBondContact OE1-CG2 3.35Å; E145-T170 PolarHBondContact OE1-OG1 3.3Å; E145-H183 IonicContact OE1-CD2 2.93Å; E145-H183 IonicContact OE1-NE2 3.32Å
146	D	80.1	Confident	77.7	Confident	97 Å²	97	52.9 Å²	52.9	52%	0.519	29%	0.288	S	S	.	.	S	Bend	trans	-87.9	-13.9	-173.2	-151.4	28.5	0	0	0	112.4	K118 V143	K118-D146 VanDerWaalsContact CD-OD1 3.22Å; K118-D146 WeakPolarHBondContact CD-OD1 3.3Å; K118-D146 WeakPolarHBondContact CE-O 3.26Å; K118-D146 WeakPolarHBondContact CE-OD1 3.38Å; K118-D146 WeakPolarHBondContact CG-O 3.42Å; K118-D146 IonicContact NZ-OD1 3.59Å; K118-D146 PolarHBondContact NZ-OD1 2.99Å; K118-D146 IonicContact NZ-OD2 3.66Å; V143-D146 HydrophobicContact CG1-CB 3.78Å
147	D	80.6	Confident	78.1	Confident	45 Å²	45	54.2 Å²	54.2	24%	0.241	29%	0.291	C	S	.	.			trans	-150	104.9	174	-171.8	-8.4	0	0	0	111.1	R149	D147-R149 VanDerWaalsContact C-N 3.26Å; D147-R149 PolarHBondContact O-N 2.94Å; D147-R149 VanDerWaalsContact OD1-CB 3.25Å; D147-R149 WeakPolarHBondContact OD1-CB 3.41Å; D147-R149 VanDerWaalsContact OD1-CG 3.26Å; D147-R149 WeakPolarHBondContact OD1-CG 3.29Å; D147-R149 IonicContact OD1-CZ 3.82Å; D147-R149 PolarHBondContact OD1-N 3.26Å; D147-R149 IonicContact OD1-NE 2.9Å; D147-R149 PolarHBondContact OD1-NE 2.81Å; D147-R149 IonicContact OD1-NH2 3.89Å; D147-R149 IonicContact OD2-CZ 3.25Å; D147-R149 VanDerWaalsContact OD2-CZ 3.25Å; D147-R149 IonicContact OD2-NE 3.02Å; D147-R149 PolarHBondContact OD2-NE 2.82Å; D147-R149 IonicContact OD2-NH2 2.67Å; D147-R149 PolarHBondContact OD2-NH2 3.45Å
148	L	83.8	Confident	78.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-69.9	-18.5	-179.5	-74.2	174	0	0	0	113.5	I114 N117 L119 E145 L150 C151 L200 T203 I204	I114-L148 HydrophobicContact CG2-CD1 4.21Å; N117-L148 WeakPolarHBondContact O-CB 3.28Å; N117-L148 WeakPolarHBondContact O-CG 3.45Å; N117-L148 PolarHBondContact O-N 2.86Å; L119-L148 HydrophobicContact CB-CD1 4.44Å; L119-L148 HydrophobicContact CB-CD2 4.03Å; E145-L148 HydrophobicContact CB-CD2 4.16Å; L148-L150 PolarHBondContact O-N 3.19Å; L148-C151 HydrophobicContact CD2-CB 4.32Å; L148-C151 WeakPolarHBondContact O-CB 3.38Å; L148-C151 PolarHBondContact O-N 3.13Å; L148-L200 HydrophobicContact CD1-CD2 4.05Å; L148-L200 HydrophobicContact CD2-CD2 4.2Å; L148-T203 HydrophobicContact CD1-CG2 3.9Å; L148-I204 HydrophobicContact CB-CG1 4.08Å; L148-I204 WeakPolarHBondContact O-CG1 3.49Å
149	R	80.6	Confident	78.3	Confident	101 Å²	101	57.8 Å²	57.8	38%	0.381	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-55.3	-32.1	-173.1	-70.3	176.6	-64.5	-179.7	0.4	113.9	D147 A207 L208	D147-R149 VanDerWaalsContact C-N 3.26Å; D147-R149 PolarHBondContact O-N 2.94Å; D147-R149 VanDerWaalsContact OD1-CB 3.25Å; D147-R149 WeakPolarHBondContact OD1-CB 3.41Å; D147-R149 VanDerWaalsContact OD1-CG 3.26Å; D147-R149 WeakPolarHBondContact OD1-CG 3.29Å; D147-R149 IonicContact OD1-CZ 3.82Å; D147-R149 PolarHBondContact OD1-N 3.26Å; D147-R149 IonicContact OD1-NE 2.9Å; D147-R149 PolarHBondContact OD1-NE 2.81Å; D147-R149 IonicContact OD1-NH2 3.89Å; D147-R149 IonicContact OD2-CZ 3.25Å; D147-R149 VanDerWaalsContact OD2-CZ 3.25Å; D147-R149 IonicContact OD2-NE 3.02Å; D147-R149 PolarHBondContact OD2-NE 2.82Å; D147-R149 IonicContact OD2-NH2 2.67Å; D147-R149 PolarHBondContact OD2-NH2 3.45Å; R149-A207 WeakPolarHBondContact CD-O 3.47Å; R149-A207 HydrophobicContact CG-CB 3.26Å; R149-L208 HydrophobicContact CB-CD2 4.38Å
150	L	75.6	Confident	78.6	Confident	115 Å²	115	54.9 Å²	54.9	60%	0.602	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-91.2	-6	-177.3	-56.9	-179.6	0	0	0	112.7	L148 P171	L148-L150 PolarHBondContact O-N 3.19Å; L150-P171 HydrophobicContact CB-CG 3.51Å; L150-P171 HydrophobicContact CD1-CG 4.42Å; L150-P171 WeakPolarHBondContact O-CD 3.49Å; L150-P171 WeakPolarHBondContact O-CG 3.29Å
151	C	83.4	Confident	78.5	Confident	10 Å²	10	62.2 Å²	62.2	7%	0.068	34%	0.344	C	S	.	.			trans	-81.1	144.7	-175.3	-60.7	0	0	0	0	111.9	L148 V168 V169 T170 I204	L148-C151 HydrophobicContact CD2-CB 4.32Å; L148-C151 WeakPolarHBondContact O-CB 3.38Å; L148-C151 PolarHBondContact O-N 3.13Å; C151-V168 HydrophobicContact CB-CG1 4.04Å; C151-V169 WeakPolarHBondContact CA-O 3.45Å; C151-T170 HydrophobicContact CB-CG2 4.21Å; C151-T170 WeakPolarHBondContact SG-CG2 3.4Å; C151-I204 HydrophobicContact CB-CD1 4.32Å; C151-I204 WeakPolarHBondContact O-CD1 3.49Å
152	L	84.2	Confident	78.6	Confident	104 Å²	104	67.2 Å²	67.2	55%	0.545	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	127	167.7	175.6	70.5	0	0	0	109.4	V169	L152-V169 HydrophobicContact CB-CB 4.28Å; L152-V169 PolarHBondContact N-O 3.08Å; L152-V169 PolarHBondContact O-N 3.08Å
153	V	88.4	Confident	78.7	Confident	5 Å²	5	74.2 Å²	74.2	3%	0.03	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.4	177.5	-175.2	0	0	0	0	110.4	F166 E167 V168 I197 L200 K201 I204	V153-F166 HydrophobicContact CG1-CD2 4.21Å; V153-E167 WeakPolarHBondContact CA-O 3.32Å; V153-V168 HydrophobicContact CG2-CG1 4.24Å; V153-V168 HydrophobicContact CG2-CG2 4.17Å; V153-I197 HydrophobicContact CG1-CB 4.39Å; V153-I197 HydrophobicContact CG1-CG1 4.09Å; V153-I197 HydrophobicContact CG1-CG2 4.21Å; V153-L200 HydrophobicContact CG1-CB 4.43Å; V153-L200 HydrophobicContact CG1-CD1 4.04Å; V153-L200 HydrophobicContact CG2-CB 3.87Å; V153-L200 HydrophobicContact CG2-CD1 4.07Å; V153-K201 WeakPolarHBondContact O-CE 3.49Å; V153-I204 HydrophobicContact CG2-CD1 3.8Å
154	R	85.3	Confident	79	Confident	86 Å²	86	74.3 Å²	74.3	33%	0.325	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	149.7	179.6	62.6	-173.2	-177.6	132.4	16	111.6	Q157 F166 E167	R154-Q157 VanDerWaalsContact NH1-NE2 3.12Å; R154-F166 WeakPolarHBondContact O-CA 3.49Å; R154-E167 WeakPolarHBondContact CD-OE1 3.45Å; R154-E167 HydrophobicContact CG-CG 3.3Å; R154-E167 WeakPolarHBondContact CG-OE1 3.23Å; R154-E167 IonicContact CZ-OE1 3.51Å; R154-E167 IonicContact CZ-OE2 2.64Å; R154-E167 PolarHBondContact N-O 2.95Å; R154-E167 IonicContact NE-OE1 3.52Å; R154-E167 PolarHBondContact NE-OE1 3.41Å; R154-E167 IonicContact NE-OE2 2.66Å; R154-E167 PolarHBondContact NE-OE2 3.3Å; R154-E167 IonicContact NH1-OE1 2.96Å; R154-E167 IonicContact NH2-OE1 2.81Å; R154-E167 PolarHBondContact NH2-OE1 3.49Å; R154-E167 IonicContact NH2-OE2 3.94Å; R154-E167 PolarHBondContact NH2-OE2 3.27Å; R154-E167 PolarHBondContact O-N 3.17Å
155	P	87.6	Confident	79.4	Confident	69 Å²	69	73.6 Å²	73.6	45%	0.448	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	142.7	167.9	-20.1	32	0	0	0	109.9	Q157 I197	P155-Q157 PolarHBondContact O-N 3.28Å; P155-I197 HydrophobicContact CG-CD1 4.12Å
156	A	81.2	Confident	79.8	Confident	21 Å²	21	72.8 Å²	72.8	17%	0.174	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-62.6	138.1	178.9	0	0	0	0	0	109.6	C160 C165 M184	A156-C160 HydrophobicContact CB-CB 3.94Å; A156-C165 HydrophobicContact CB-CB 3.63Å; A156-C165 WeakPolarHBondContact CB-O 3.13Å; A156-C165 PolarHBondContact N-O 3.11Å; A156-C165 VanDerWaalsContact N-O 3.08Å; A156-M184 HydrophobicContact CB-CE 4.38Å
157	Q	70.8	Confident	80.3	Confident	111 Å²	111	68.5 Å²	68.5	52%	0.519	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-62	159	175.3	-66.3	179.5	-23.7	0	0	111.2	R154 P155 S159 C160	R154-Q157 VanDerWaalsContact NH1-NE2 3.12Å; P155-Q157 PolarHBondContact O-N 3.28Å; Q157-S159 PolarHBondContact O-N 3.16Å; Q157-C160 WeakPolarHBondContact O-CB 3.4Å; Q157-C160 PolarHBondContact O-N 3.19Å
158	S	61.7	Low	80.6	Confident	132 Å²	132	66.4 Å²	66.4	92%	0.923	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-15.4	-177.3	-37.5	0	0	0	0	114.8	C160	S158-C160 PolarHBondContact O-N 2.96Å
159	S	63.9	Low	80.6	Confident	93 Å²	93	67.6 Å²	67.6	65%	0.65	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-6.7	175	57.7	0	0	0	0	114.2	Q157	Q157-S159 PolarHBondContact O-N 3.16Å
160	C	66.3	Low	80.1	Confident	23 Å²	23	62.8 Å²	62.8	16%	0.155	33%	0.326	C	S	.	.			trans	-81.9	118.1	175.3	174.4	0	0	0	0	111	A156 Q157 S158 R162 C165 M184	A156-C160 HydrophobicContact CB-CB 3.94Å; Q157-C160 WeakPolarHBondContact O-CB 3.4Å; Q157-C160 PolarHBondContact O-N 3.19Å; S158-C160 PolarHBondContact O-N 2.96Å; C160-R162 PolarHBondContact O-N 3.23Å; C160-R162 PolarHBondContact SG-N 3.16Å; C160-R162 PolarHBondContact SG-O 3.18Å; C160-C165 WeakPolarHBondContact SG-CB 3.36Å; C160-M184 HydrophobicContact CB-SD 4.41Å
161	D	66.2	Low	79.7	Confident	157 Å²	157	60.5 Å²	60.5	84%	0.84	32%	0.318	S	S	*	.	S	Bend	trans	-62.7	-12.6	179.2	-54.2	-42.4	0	0	0	114.5
162	R	80.5	Confident	78.6	Confident	110 Å²	110	63 Å²	63	42%	0.415	34%	0.335	S	S	.	.	S	Bend	trans	-113.2	139.3	-175.5	-68.4	-161	-179.2	-165	0	112.4	W107 C160 C165	W107-R162 VanDerWaalsContact CD1-CZ 3.42Å; W107-R162 HydrophobicContact CZ2-CB 4.46Å; C160-R162 PolarHBondContact O-N 3.23Å; C160-R162 PolarHBondContact SG-N 3.16Å; C160-R162 PolarHBondContact SG-O 3.18Å; R162-C165 VanDerWaalsContact CB-SG 3.56Å; R162-C165 PolarHBondContact O-SG 2.82Å; R162-C165 VanDerWaalsContact O-SG 3.33Å
163	R	86.3	Confident	77.3	Confident	181 Å²	181	64.5 Å²	64.5	68%	0.683	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	154.7	175.5	-67.1	-175.2	-66.1	173.2	-1	111.3	C165 Q186	R163-C165 PolarHBondContact O-N 2.76Å; R163-Q186 WeakPolarHBondContact O-CG 3.43Å; R163-Q186 PolarHBondContact O-NE2 3.43Å
164	Y	88.6	Confident	75.5	Confident	64 Å²	64	71.4 Å²	71.4	25%	0.251	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.9	23.4	175.6	-39.1	-45.3	0	0	0	114	A187 E190	Y164-A187 WeakPolarHBondContact CB-O 3.22Å; Y164-A187 PolarHBondContact O-N 2.84Å; Y164-A187 VanDerWaalsContact O-N 3.16Å; Y164-E190 HydrophobicContact CD1-CB 3.87Å; Y164-E190 HydrophobicContact CE1-CB 3.77Å
165	C	90.5	Very high	73.9	Confident	4 Å²	4	74 Å²	74	3%	0.027	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	147.3	173.1	-65	0	0	0	0	111.7	W107 A156 C160 R162 R163 L185 Q186	W107-C165 HydrophobicContact CH2-CB 4.45Å; W107-C165 WeakPolarHBondContact CH2-SG 3.04Å; A156-C165 HydrophobicContact CB-CB 3.63Å; A156-C165 WeakPolarHBondContact CB-O 3.13Å; A156-C165 PolarHBondContact N-O 3.11Å; A156-C165 VanDerWaalsContact N-O 3.08Å; C160-C165 WeakPolarHBondContact SG-CB 3.36Å; R162-C165 VanDerWaalsContact CB-SG 3.56Å; R162-C165 PolarHBondContact O-SG 2.82Å; R162-C165 VanDerWaalsContact O-SG 3.33Å; R163-C165 PolarHBondContact O-N 2.76Å; C165-L185 CarbonylContact C-O 3.59Å; C165-L185 WeakPolarHBondContact CA-O 3.41Å; C165-Q186 VanDerWaalsContact SG-CB 3.57Å
166	F	91.1	Very high	71.9	Confident	0 Å²	0	76 Å²	76	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	157.4	171.8	64.8	-82.8	0	0	0	108.8	L96 V153 R154 V168 L185 R193 W196 I197 L200	L96-F166 HydrophobicContact CD1-CE1 4.47Å; L96-F166 HydrophobicContact CD1-CZ 3.86Å; L96-F166 HydrophobicContact CD2-CE1 3.99Å; L96-F166 HydrophobicContact CD2-CZ 4.19Å; V153-F166 HydrophobicContact CG1-CD2 4.21Å; R154-F166 WeakPolarHBondContact O-CA 3.49Å; F166-V168 HydrophobicContact CD2-CG2 4.48Å; F166-V168 HydrophobicContact CE2-CG2 4.32Å; F166-L185 HydrophobicContact CD1-CB 4.36Å; F166-L185 HydrophobicContact CD2-CB 4.41Å; F166-L185 HydrophobicContact CE1-CB 3.92Å; F166-L185 HydrophobicContact CE2-CB 3.96Å; F166-L185 HydrophobicContact CE2-CD1 3.83Å; F166-L185 HydrophobicContact CE2-CG 4.46Å; F166-L185 HydrophobicContact CZ-CB 3.71Å; F166-L185 HydrophobicContact CZ-CD1 3.97Å; F166-L185 HydrophobicContact CZ-CG 4.48Å; F166-L185 PolarHBondContact N-O 2.75Å; F166-L185 PolarHBondContact O-N 2.84Å; F166-L185 VanDerWaalsContact O-O 3.08Å; F166-R193 HydrophobicContact CB-CG 4.38Å; F166-R193 HydrophobicContact CD1-CG 3.99Å; F166-W196 HydrophobicContact CE1-CB 4.06Å; F166-W196 HydrophobicContact CE2-CB 4.4Å; F166-W196 HydrophobicContact CZ-CB 3.72Å; F166-W196 HydrophobicContact CZ-CG 4.2Å; F166-I197 HydrophobicContact CB-CD1 3.81Å; F166-I197 HydrophobicContact CB-CG1 3.94Å; F166-I197 HydrophobicContact CD2-CG1 4.11Å; F166-I197 HydrophobicContact CG-CD1 4.35Å; F166-I197 HydrophobicContact CG-CG1 3.99Å; F166-L200 HydrophobicContact CE2-CD1 3.81Å
167	E	89.4	Confident	70	Confident	8 Å²	8	77.6 Å²	77.6	4%	0.037	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.4	-178.3	66.5	-169.3	131.8	0	0	110.8	V153 R154 V169 H183 M184	V153-E167 WeakPolarHBondContact CA-O 3.32Å; R154-E167 WeakPolarHBondContact CD-OE1 3.45Å; R154-E167 HydrophobicContact CG-CG 3.3Å; R154-E167 WeakPolarHBondContact CG-OE1 3.23Å; R154-E167 IonicContact CZ-OE1 3.51Å; R154-E167 IonicContact CZ-OE2 2.64Å; R154-E167 PolarHBondContact N-O 2.95Å; R154-E167 IonicContact NE-OE1 3.52Å; R154-E167 PolarHBondContact NE-OE1 3.41Å; R154-E167 IonicContact NE-OE2 2.66Å; R154-E167 PolarHBondContact NE-OE2 3.3Å; R154-E167 IonicContact NH1-OE1 2.96Å; R154-E167 IonicContact NH2-OE1 2.81Å; R154-E167 PolarHBondContact NH2-OE1 3.49Å; R154-E167 IonicContact NH2-OE2 3.94Å; R154-E167 PolarHBondContact NH2-OE2 3.27Å; R154-E167 PolarHBondContact O-N 3.17Å; E167-V169 HydrophobicContact CG-CG2 4.08Å; E167-H183 VanDerWaalsContact CA-O 3.28Å; E167-H183 WeakPolarHBondContact CA-O 3.47Å; E167-M184 HydrophobicContact CB-CE 4.38Å
168	V	87.7	Confident	68.9	Low	0 Å²	0	77.7 Å²	77.7	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	107.3	170.2	-175	0	0	0	0	105.7	C151 V153 F166 T170 H183 L185 L200	C151-V168 HydrophobicContact CB-CG1 4.04Å; V153-V168 HydrophobicContact CG2-CG1 4.24Å; V153-V168 HydrophobicContact CG2-CG2 4.17Å; F166-V168 HydrophobicContact CD2-CG2 4.48Å; F166-V168 HydrophobicContact CE2-CG2 4.32Å; V168-T170 HydrophobicContact CG1-CG2 4.09Å; V168-H183 PolarHBondContact N-O 2.94Å; V168-H183 PolarHBondContact O-N 3.35Å; V168-L185 HydrophobicContact CG2-CD1 4.15Å; V168-L200 HydrophobicContact CG2-CD1 3.99Å
169	V	82.7	Confident	68.4	Low	26 Å²	26	77.7 Å²	77.7	16%	0.158	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.7	-179.3	-176.9	0	0	0	0	107.8	C151 L152 E167 V180	C151-V169 WeakPolarHBondContact CA-O 3.45Å; L152-V169 HydrophobicContact CB-CB 4.28Å; L152-V169 PolarHBondContact N-O 3.08Å; L152-V169 PolarHBondContact O-N 3.08Å; E167-V169 HydrophobicContact CG-CG2 4.08Å; V169-V180 HydrophobicContact CG1-CG1 3.61Å
170	T	71.8	Confident	68	Low	0 Å²	0	76.6 Å²	76.6	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.5	-175.2	60.3	0	0	0	0	110.5	E145 C151 V168 S172 V180 L181	E145-T170 HydrophobicContact CG-CG2 3.61Å; E145-T170 WeakPolarHBondContact OE1-CB 3.44Å; E145-T170 WeakPolarHBondContact OE1-CG2 3.35Å; E145-T170 PolarHBondContact OE1-OG1 3.3Å; C151-T170 HydrophobicContact CB-CG2 4.21Å; C151-T170 WeakPolarHBondContact SG-CG2 3.4Å; V168-T170 HydrophobicContact CG1-CG2 4.09Å; T170-S172 PolarHBondContact O-N 3.39Å; T170-V180 WeakPolarHBondContact O-CG1 3.44Å; T170-L181 PolarHBondContact N-O 2.9Å; T170-L181 PolarHBondContact OG1-O 3.41Å
171	P	66.4	Low	67.9	Low	67 Å²	67	77.9 Å²	77.9	44%	0.435	41%	0.413	S	S	.	.			trans	-77.2	-8.2	-175.7	26.4	-29.5	0	0	0	113	L150 K173	L150-P171 HydrophobicContact CB-CG 3.51Å; L150-P171 HydrophobicContact CD1-CG 4.42Å; L150-P171 WeakPolarHBondContact O-CD 3.49Å; L150-P171 WeakPolarHBondContact O-CG 3.29Å; P171-K173 PolarHBondContact O-N 3.11Å; P171-K173 VanDerWaalsContact O-N 3.09Å
172	S	61.3	Low	68.4	Low	61 Å²	61	72.6 Å²	72.6	43%	0.427	39%	0.389	S	S	.	.			trans	-54.9	113	174.4	-59.8	0	0	0	0	110.4	T170	T170-S172 PolarHBondContact O-N 3.39Å
173	K	56	Low	68.6	Low	137 Å²	137	68.5 Å²	68.5	60%	0.596	37%	0.374	S	S	*	.			trans	-94.5	136.9	172.9	-69	180	-179.9	179.3	0	109.1	P171	P171-K173 PolarHBondContact O-N 3.11Å; P171-K173 VanDerWaalsContact O-N 3.09Å
174	Y	51.5	Low	68.7	Low	149 Å²	149	60.8 Å²	60.8	58%	0.584	35%	0.346	S	S	*	.			trans	-65.1	143.9	161.7	-87.6	-82.6	0	0	0	108.9	S176 S177 L181	Y174-S176 PolarHBondContact O-N 3.35Å; Y174-S177 PolarHBondContact O-N 3.46Å; Y174-S177 VanDerWaalsContact O-N 3.08Å; Y174-L181 HydrophobicContact CD2-CD1 3.98Å; Y174-L181 HydrophobicContact CD2-CD2 4.32Å; Y174-L181 HydrophobicContact CE2-CD1 3.87Å; Y174-L181 HydrophobicContact CE2-CD2 4.3Å
175	P	49.7	Very low	68.9	Low	141 Å²	141	57.8 Å²	57.8	92%	0.916	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-22.9	179.4	-24.6	32.1	0	0	0	114.4
176	S	47.1	Very low	69	Low	110 Å²	110	59 Å²	59	77%	0.769	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	3.2	-176.6	50.1	0	0	0	0	115.2	Y174	Y174-S176 PolarHBondContact O-N 3.35Å
177	S	40.6	Very low	69	Low	56 Å²	56	59 Å²	59	39%	0.392	34%	0.34	S	S	.	.			trans	-137.1	122.9	-174.7	-56.8	0	0	0	0	112.3	Y174 I179	Y174-S177 PolarHBondContact O-N 3.46Å; Y174-S177 VanDerWaalsContact O-N 3.08Å; S177-I179 PolarHBondContact O-N 3.42Å; S177-I179 VanDerWaalsContact O-N 3.13Å
178	S	47.8	Very low	68.8	Low	113 Å²	113	62.6 Å²	62.6	79%	0.79	36%	0.359	S	S	*	.			trans	-71.6	1.2	175.6	-66.6	0	0	0	0	114.5
179	I	50.8	Low	68.5	Low	132 Å²	132	64.2 Å²	64.2	68%	0.677	37%	0.37	S	S	*	.	S	Bend	trans	-91.2	129.7	-172.2	-57.3	172	0	0	0	110.3	S177	S177-I179 PolarHBondContact O-N 3.42Å; S177-I179 VanDerWaalsContact O-N 3.13Å
180	V	55.3	Low	68.7	Low	69 Å²	69	67.8 Å²	67.8	42%	0.418	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-67.2	129	171.6	-176	0	0	0	0	109.1	V169 T170 S182	V169-V180 HydrophobicContact CG1-CG1 3.61Å; T170-V180 WeakPolarHBondContact O-CG1 3.44Å; V180-S182 PolarHBondContact O-N 3.02Å
181	L	64	Low	69.2	Low	51 Å²	51	71.6 Å²	71.6	27%	0.267	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	129.2	177.6	-69.4	170.1	0	0	0	109.8	T170 Y174	T170-L181 PolarHBondContact N-O 2.9Å; T170-L181 PolarHBondContact OG1-O 3.41Å; Y174-L181 HydrophobicContact CD2-CD1 3.98Å; Y174-L181 HydrophobicContact CD2-CD2 4.32Å; Y174-L181 HydrophobicContact CE2-CD1 3.87Å; Y174-L181 HydrophobicContact CE2-CD2 4.3Å
182	S	77.6	Confident	70.1	Confident	46 Å²	46	70.2 Å²	70.2	32%	0.322	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.3	172.4	70	0	0	0	0	109.7	V180	V180-S182 PolarHBondContact O-N 3.02Å
183	H	85.3	Confident	71.4	Confident	24 Å²	24	69.6 Å²	69.6	11%	0.111	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.4	175.1	-66.1	-48.5	0	0	0	110.4	M144 E145 E167 V168	M144-H183 HydrophobicContact SD-CB 4.24Å; E145-H183 IonicContact OE1-CD2 2.93Å; E145-H183 IonicContact OE1-NE2 3.32Å; E167-H183 VanDerWaalsContact CA-O 3.28Å; E167-H183 WeakPolarHBondContact CA-O 3.47Å; V168-H183 PolarHBondContact N-O 2.94Å; V168-H183 PolarHBondContact O-N 3.35Å
184	M	88.4	Confident	73	Confident	19 Å²	19	67.7 Å²	67.7	9%	0.094	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.8	179.7	-165.2	159.7	-73.8	0	0	110.5	R99 W107 A156 C160 E167	R99-M184 HydrophobicContact CB-CB 4.02Å; R99-M184 VanDerWaalsContact CZ-SD 3.54Å; R99-M184 PolarHBondContact N-O 2.9Å; W107-M184 HydrophobicContact CH2-CB 4.48Å; W107-M184 HydrophobicContact CH2-CG 3.8Å; W107-M184 HydrophobicContact CZ2-CG 4.41Å; A156-M184 HydrophobicContact CB-CE 4.38Å; C160-M184 HydrophobicContact CB-SD 4.41Å; E167-M184 HydrophobicContact CB-CE 4.38Å
185	L	92.6	Very high	74.6	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	150.8	-175.6	-59.6	177.5	0	0	0	110.1	L96 F97 K98 F112 L119 M144 C165 F166 V168	L96-L185 HydrophobicContact CD1-CB 4.48Å; L96-L185 HydrophobicContact CD1-CD1 4.08Å; F97-L185 CarbonylContact O-C 3.59Å; F97-L185 VanDerWaalsContact O-CA 3.3Å; F97-L185 WeakPolarHBondContact O-CA 3.38Å; K98-L185 HydrophobicContact CB-CD2 3.93Å; K98-L185 HydrophobicContact CG-CD2 3.99Å; F112-L185 HydrophobicContact CE1-CD2 4.2Å; F112-L185 HydrophobicContact CE2-CD2 4.34Å; F112-L185 HydrophobicContact CZ-CD2 3.74Å; L119-L185 HydrophobicContact CD2-CD1 4.37Å; M144-L185 HydrophobicContact CE-CD2 4.3Å; C165-L185 CarbonylContact C-O 3.59Å; C165-L185 WeakPolarHBondContact CA-O 3.41Å; F166-L185 HydrophobicContact CD1-CB 4.36Å; F166-L185 HydrophobicContact CD2-CB 4.41Å; F166-L185 HydrophobicContact CE1-CB 3.92Å; F166-L185 HydrophobicContact CE2-CB 3.96Å; F166-L185 HydrophobicContact CE2-CD1 3.83Å; F166-L185 HydrophobicContact CE2-CG 4.46Å; F166-L185 HydrophobicContact CZ-CB 3.71Å; F166-L185 HydrophobicContact CZ-CD1 3.97Å; F166-L185 HydrophobicContact CZ-CG 4.48Å; F166-L185 PolarHBondContact N-O 2.75Å; F166-L185 PolarHBondContact O-N 2.84Å; F166-L185 VanDerWaalsContact O-O 3.08Å; V168-L185 HydrophobicContact CG2-CD1 4.15Å
186	Q	92.2	Very high	76.6	Confident	29 Å²	29	55.2 Å²	55.2	14%	0.136	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	129.5	178.5	-178.7	-171.3	0.7	0	0	110.2	L96 F97 W107 R163 C165	L96-Q186 WeakPolarHBondContact CD2-O 3.14Å; F97-Q186 HydrophobicContact CB-CB 4.17Å; F97-Q186 PolarHBondContact N-O 3.17Å; F97-Q186 PolarHBondContact O-N 2.98Å; W107-Q186 HydrophobicContact CE3-CB 4.02Å; W107-Q186 HydrophobicContact CH2-CB 4.03Å; W107-Q186 HydrophobicContact CZ3-CB 3.47Å; W107-Q186 VanDerWaalsContact CZ3-CB 3.47Å; R163-Q186 WeakPolarHBondContact O-CG 3.43Å; R163-Q186 PolarHBondContact O-NE2 3.43Å; C165-Q186 VanDerWaalsContact SG-CB 3.57Å
187	A	90.4	Very high	78.6	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.008	29%	0.291	C	S	.	.			trans	-92.5	160.4	171	0	0	0	0	0	112.1	L96 Y164 S189 L192 R193	L96-A187 HydrophobicContact CD2-CB 3.97Å; Y164-A187 WeakPolarHBondContact CB-O 3.22Å; Y164-A187 PolarHBondContact O-N 2.84Å; Y164-A187 VanDerWaalsContact O-N 3.16Å; A187-S189 VanDerWaalsContact C-N 3.32Å; A187-S189 PolarHBondContact O-N 2.62Å; A187-L192 HydrophobicContact CB-CB 3.84Å; A187-R193 HydrophobicContact CB-CB 4.01Å
188	D	85.5	Confident	80.8	Confident	82 Å²	82	53.6 Å²	53.6	44%	0.439	30%	0.297	S	S	.	.	S	Bend	trans	-73.7	-22.9	179.8	-72	-27.2	0	0	0	112.7	R109 L192	R109-D188 IonicContact NH2-OD2 3.58Å; R109-D188 PolarHBondContact NH2-OD2 3.12Å; D188-L192 HydrophobicContact CB-CD1 3.97Å
189	S	82.7	Confident	82.7	Confident	34 Å²	34	48.7 Å²	48.7	24%	0.238	26%	0.263	C	S	.	.	S	Bend	trans	-143.7	165.2	179	73.9	0	0	0	0	112.8	A187 S191 L192 R193	A187-S189 VanDerWaalsContact C-N 3.32Å; A187-S189 PolarHBondContact O-N 2.62Å; S189-S191 PolarHBondContact OG-OG 2.85Å; S189-L192 PolarHBondContact O-N 3.34Å; S189-L192 WeakPolarHBondContact OG-CB 3.14Å; S189-L192 WeakPolarHBondContact OG-CG 3.43Å; S189-L192 PolarHBondContact OG-N 2.98Å; S189-L192 VanDerWaalsContact OG-N 3.08Å; S189-R193 PolarHBondContact O-N 2.95Å
190	E	85.2	Confident	84.5	Confident	102 Å²	102	42.4 Å²	42.4	48%	0.477	23%	0.231	S	C	.	.	H	α-helix	trans	-63.4	-40.3	173.5	177.1	157.5	-140.6	0	0	112.6	Y164 L192 R193 L194	Y164-E190 HydrophobicContact CD1-CB 3.87Å; Y164-E190 HydrophobicContact CE1-CB 3.77Å; E190-L192 VanDerWaalsContact C-N 3.33Å; E190-L192 PolarHBondContact O-N 3.13Å; E190-R193 PolarHBondContact O-N 3.19Å; E190-R193 IonicContact OE1-NH2 2.57Å; E190-R193 PolarHBondContact OE1-NH2 2.73Å; E190-L194 HydrophobicContact CG-CD1 4.16Å; E190-L194 WeakPolarHBondContact O-CG 3.36Å; E190-L194 PolarHBondContact O-N 2.84Å
191	S	82.3	Confident	86.1	Confident	80 Å²	80	43.5 Å²	43.5	56%	0.559	23%	0.23	S	C	*	.	H	α-helix	trans	-61.3	-42.7	176.2	53.4	0	0	0	0	111.6	S189 L194 A195	S189-S191 PolarHBondContact OG-OG 2.85Å; S191-L194 PolarHBondContact O-N 2.99Å; S191-A195 WeakPolarHBondContact O-CB 3.33Å; S191-A195 PolarHBondContact O-N 3.47Å
192	L	86	Confident	87.1	Confident	37 Å²	37	48 Å²	48	19%	0.194	24%	0.243	C	C	.	.	H	α-helix	trans	-64.9	-44.3	175.2	-82.5	169	0	0	0	111.8	P81 A187 D188 S189 E190 L194 A195 W196	P81-L192 WeakPolarHBondContact O-CD2 3.18Å; A187-L192 HydrophobicContact CB-CB 3.84Å; D188-L192 HydrophobicContact CB-CD1 3.97Å; S189-L192 PolarHBondContact O-N 3.34Å; S189-L192 WeakPolarHBondContact OG-CB 3.14Å; S189-L192 WeakPolarHBondContact OG-CG 3.43Å; S189-L192 PolarHBondContact OG-N 2.98Å; S189-L192 VanDerWaalsContact OG-N 3.08Å; E190-L192 VanDerWaalsContact C-N 3.33Å; E190-L192 PolarHBondContact O-N 3.13Å; L192-L194 VanDerWaalsContact C-N 3.28Å; L192-L194 PolarHBondContact O-N 3.41Å; L192-A195 PolarHBondContact O-N 3.25Å; L192-W196 WeakPolarHBondContact O-CB 3.22Å; L192-W196 PolarHBondContact O-N 3.38Å
193	R	89.3	Confident	87.4	Confident	49 Å²	49	46.1 Å²	46.1	19%	0.185	23%	0.23	C	C	.	.	H	α-helix	trans	-54.8	-48.3	174.9	176.2	-174.1	63	171.4	2.3	110.6	F166 A187 S189 E190 A195 W196 I197	F166-R193 HydrophobicContact CB-CG 4.38Å; F166-R193 HydrophobicContact CD1-CG 3.99Å; A187-R193 HydrophobicContact CB-CB 4.01Å; S189-R193 PolarHBondContact O-N 2.95Å; E190-R193 PolarHBondContact O-N 3.19Å; E190-R193 IonicContact OE1-NH2 2.57Å; E190-R193 PolarHBondContact OE1-NH2 2.73Å; R193-A195 VanDerWaalsContact C-N 3.35Å; R193-W196 PolarHBondContact O-N 2.8Å; R193-I197 HydrophobicContact CG-CD1 3.8Å; R193-I197 HydrophobicContact CG-CG1 4.44Å; R193-I197 WeakPolarHBondContact O-CB 3.34Å; R193-I197 VanDerWaalsContact O-CG1 3.27Å; R193-I197 WeakPolarHBondContact O-CG1 3.34Å; R193-I197 PolarHBondContact O-N 3.37Å
194	L	88	Confident	87.3	Confident	96 Å²	96	45.9 Å²	45.9	50%	0.503	23%	0.229	S	C	.	.	H	α-helix	trans	-65.1	-39.8	-179.6	-68.8	172.3	0	0	0	111.6	E190 S191 L192 K198	E190-L194 HydrophobicContact CG-CD1 4.16Å; E190-L194 WeakPolarHBondContact O-CG 3.36Å; E190-L194 PolarHBondContact O-N 2.84Å; S191-L194 PolarHBondContact O-N 2.99Å; L192-L194 VanDerWaalsContact C-N 3.28Å; L192-L194 PolarHBondContact O-N 3.41Å; L194-K198 WeakPolarHBondContact O-CB 3.45Å; L194-K198 PolarHBondContact O-N 2.83Å
195	A	85.9	Confident	86.9	Confident	26 Å²	26	50.1 Å²	50.1	22%	0.215	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-48.1	175.3	0	0	0	0	0	111.8	M92 S191 L192 R193 K198 A199	M92-A195 HydrophobicContact CE-CB 3.74Å; M92-A195 HydrophobicContact SD-CB 4.46Å; S191-A195 WeakPolarHBondContact O-CB 3.33Å; S191-A195 PolarHBondContact O-N 3.47Å; L192-A195 PolarHBondContact O-N 3.25Å; R193-A195 VanDerWaalsContact C-N 3.35Å; A195-K198 PolarHBondContact O-N 3.24Å; A195-A199 WeakPolarHBondContact O-CB 3.24Å; A195-A199 PolarHBondContact O-N 3.03Å
196	W	91.5	Very high	86.3	Confident	3 Å²	3	52.9 Å²	52.9	1%	0.011	27%	0.272	C	S	.	.	H	α-helix	trans	-61	-46.6	176.8	-84.6	105.2	0	0	0	112.6	M92 L96 F112 I114 F166 L192 R193 K198 A199 L200	M92-W196 HydrophobicContact CE-CD2 3.83Å; M92-W196 HydrophobicContact CE-CG 3.76Å; M92-W196 HydrophobicContact CE-CZ2 4.44Å; M92-W196 HydrophobicContact CG-CD2 4.46Å; M92-W196 HydrophobicContact CG-CE3 4.46Å; M92-W196 HydrophobicContact CG-CH2 4.36Å; M92-W196 HydrophobicContact CG-CZ2 4.38Å; M92-W196 HydrophobicContact CG-CZ3 4.42Å; M92-W196 HydrophobicContact SD-CB 4.48Å; M92-W196 HydrophobicContact SD-CD2 3.77Å; M92-W196 HydrophobicContact SD-CE3 4.01Å; M92-W196 HydrophobicContact SD-CG 4Å; L96-W196 HydrophobicContact CD1-CD2 3.73Å; L96-W196 HydrophobicContact CD1-CE3 3.9Å; L96-W196 HydrophobicContact CD1-CG 4.26Å; L96-W196 HydrophobicContact CD1-CH2 4.14Å; L96-W196 HydrophobicContact CD1-CZ2 3.96Å; L96-W196 HydrophobicContact CD1-CZ3 4.09Å; L96-W196 HydrophobicContact CD2-CD2 4.25Å; L96-W196 HydrophobicContact CD2-CG 4.1Å; L96-W196 HydrophobicContact CG-CD2 4.23Å; L96-W196 HydrophobicContact CG-CZ2 4.01Å; F112-W196 HydrophobicContact CB-CH2 3.6Å; F112-W196 HydrophobicContact CB-CZ2 4.27Å; F112-W196 HydrophobicContact CB-CZ3 4.18Å; I114-W196 HydrophobicContact CD1-CE3 3.92Å; I114-W196 HydrophobicContact CD1-CZ3 3.74Å; I114-W196 HydrophobicContact CG1-CZ3 3.86Å; F166-W196 HydrophobicContact CE1-CB 4.06Å; F166-W196 HydrophobicContact CE2-CB 4.4Å; F166-W196 HydrophobicContact CZ-CB 3.72Å; F166-W196 HydrophobicContact CZ-CG 4.2Å; L192-W196 WeakPolarHBondContact O-CB 3.22Å; L192-W196 PolarHBondContact O-N 3.38Å; R193-W196 PolarHBondContact O-N 2.8Å; W196-K198 VanDerWaalsContact C-N 3.3Å; W196-K198 PolarHBondContact O-N 2.88Å; W196-A199 PolarHBondContact O-N 2.82Å; W196-L200 WeakPolarHBondContact O-CB 3.47Å; W196-L200 WeakPolarHBondContact O-CG 3.29Å; W196-L200 PolarHBondContact O-N 3.06Å
197	I	89.3	Confident	85.6	Confident	13 Å²	13	51.6 Å²	51.6	7%	0.067	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-43.8	176	-68.9	172.2	0	0	0	110.4	V153 P155 F166 R193 K201	V153-I197 HydrophobicContact CG1-CB 4.39Å; V153-I197 HydrophobicContact CG1-CG1 4.09Å; V153-I197 HydrophobicContact CG1-CG2 4.21Å; P155-I197 HydrophobicContact CG-CD1 4.12Å; F166-I197 HydrophobicContact CB-CD1 3.81Å; F166-I197 HydrophobicContact CB-CG1 3.94Å; F166-I197 HydrophobicContact CD2-CG1 4.11Å; F166-I197 HydrophobicContact CG-CD1 4.35Å; F166-I197 HydrophobicContact CG-CG1 3.99Å; R193-I197 HydrophobicContact CG-CD1 3.8Å; R193-I197 HydrophobicContact CG-CG1 4.44Å; R193-I197 WeakPolarHBondContact O-CB 3.34Å; R193-I197 VanDerWaalsContact O-CG1 3.27Å; R193-I197 WeakPolarHBondContact O-CG1 3.34Å; R193-I197 PolarHBondContact O-N 3.37Å; I197-K201 HydrophobicContact CG2-CD 4.06Å; I197-K201 HydrophobicContact CG2-CG 4.45Å; I197-K201 WeakPolarHBondContact O-CB 3.41Å; I197-K201 VanDerWaalsContact O-CG 3.29Å; I197-K201 WeakPolarHBondContact O-CG 3.4Å; I197-K201 PolarHBondContact O-N 3.34Å
198	K	87.4	Confident	84.9	Confident	118 Å²	118	56.3 Å²	56.3	51%	0.513	29%	0.29	S	S	.	.	H	α-helix	trans	-66.3	-42	-179.9	-169.6	179.9	-169.1	-177	0	112	L194 A195 W196 R202	L194-K198 WeakPolarHBondContact O-CB 3.45Å; L194-K198 PolarHBondContact O-N 2.83Å; A195-K198 PolarHBondContact O-N 3.24Å; W196-K198 VanDerWaalsContact C-N 3.3Å; W196-K198 PolarHBondContact O-N 2.88Å; K198-R202 VanDerWaalsContact CE-NH2 3.27Å; K198-R202 WeakPolarHBondContact O-CB 3.12Å; K198-R202 VanDerWaalsContact O-CG 3.3Å; K198-R202 WeakPolarHBondContact O-CG 3.49Å; K198-R202 PolarHBondContact O-N 3.08Å
199	A	87.4	Confident	83.9	Confident	10 Å²	10	59.6 Å²	59.6	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-64.2	-46.5	177.8	0	0	0	0	0	111.4	V91 M92 I114 A195 W196 R202 T203	V91-A199 HydrophobicContact CG1-CB 4.29Å; M92-A199 HydrophobicContact CB-CB 3.91Å; M92-A199 HydrophobicContact CG-CB 4.39Å; M92-A199 HydrophobicContact SD-CB 3.57Å; M92-A199 VanDerWaalsContact SD-CB 3.57Å; I114-A199 HydrophobicContact CD1-CB 4.03Å; A195-A199 WeakPolarHBondContact O-CB 3.24Å; A195-A199 PolarHBondContact O-N 3.03Å; W196-A199 PolarHBondContact O-N 2.82Å; A199-R202 PolarHBondContact O-N 3.4Å; A199-T203 PolarHBondContact O-N 3.43Å; A199-T203 PolarHBondContact O-OG1 2.96Å
200	L	89.1	Confident	83	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-61.5	-48.4	175.9	-72.1	165.4	0	0	0	111.3	I114 L119 L148 V153 F166 V168 W196 R202 T203 I204	I114-L200 HydrophobicContact CD1-CD2 3.56Å; I114-L200 HydrophobicContact CD1-CG 3.75Å; I114-L200 HydrophobicContact CG1-CD2 4.07Å; L119-L200 HydrophobicContact CD1-CD2 4.32Å; L119-L200 HydrophobicContact CD2-CD2 4.33Å; L148-L200 HydrophobicContact CD1-CD2 4.05Å; L148-L200 HydrophobicContact CD2-CD2 4.2Å; V153-L200 HydrophobicContact CG1-CB 4.43Å; V153-L200 HydrophobicContact CG1-CD1 4.04Å; V153-L200 HydrophobicContact CG2-CB 3.87Å; V153-L200 HydrophobicContact CG2-CD1 4.07Å; F166-L200 HydrophobicContact CE2-CD1 3.81Å; V168-L200 HydrophobicContact CG2-CD1 3.99Å; W196-L200 WeakPolarHBondContact O-CB 3.47Å; W196-L200 WeakPolarHBondContact O-CG 3.29Å; W196-L200 PolarHBondContact O-N 3.06Å; L200-R202 PolarHBondContact O-N 3.29Å; L200-T203 WeakPolarHBondContact O-CB 3.45Å; L200-T203 PolarHBondContact O-N 2.72Å; L200-T203 VanDerWaalsContact O-N 3.13Å; L200-I204 WeakPolarHBondContact O-CD1 3.45Å; L200-I204 WeakPolarHBondContact O-CG1 3.25Å; L200-I204 PolarHBondContact O-N 2.84Å
201	K	88.4	Confident	81.3	Confident	93 Å²	93	62.8 Å²	62.8	40%	0.404	33%	0.325	S	S	.	.	H	α-helix	trans	-59	-44.2	178.4	-75.9	-176.1	178.9	-166.1	0	113	V153 I197 T203 I204 E205	V153-K201 WeakPolarHBondContact O-CE 3.49Å; I197-K201 HydrophobicContact CG2-CD 4.06Å; I197-K201 HydrophobicContact CG2-CG 4.45Å; I197-K201 WeakPolarHBondContact O-CB 3.41Å; I197-K201 VanDerWaalsContact O-CG 3.29Å; I197-K201 WeakPolarHBondContact O-CG 3.4Å; I197-K201 PolarHBondContact O-N 3.34Å; K201-T203 VanDerWaalsContact C-N 3.31Å; K201-T203 PolarHBondContact O-N 2.9Å; K201-I204 PolarHBondContact O-N 3Å; K201-E205 WeakPolarHBondContact O-CB 3.31Å; K201-E205 WeakPolarHBondContact O-CG 3.35Å; K201-E205 PolarHBondContact O-N 2.97Å
202	R	84.2	Confident	78.8	Confident	145 Å²	145	67.2 Å²	67.2	55%	0.547	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-39.3	175.1	-77.2	173.1	172.6	-177.9	-10	112.6	K198 A199 L200 E205 A206	K198-R202 VanDerWaalsContact CE-NH2 3.27Å; K198-R202 WeakPolarHBondContact O-CB 3.12Å; K198-R202 VanDerWaalsContact O-CG 3.3Å; K198-R202 WeakPolarHBondContact O-CG 3.49Å; K198-R202 PolarHBondContact O-N 3.08Å; A199-R202 PolarHBondContact O-N 3.4Å; L200-R202 PolarHBondContact O-N 3.29Å; R202-E205 PolarHBondContact O-N 2.94Å; R202-A206 VanDerWaalsContact O-CB 3.28Å; R202-A206 WeakPolarHBondContact O-CB 3.35Å; R202-A206 PolarHBondContact O-N 3.08Å
203	T	85.2	Confident	76.4	Confident	7 Å²	7	70.7 Å²	70.7	4%	0.043	36%	0.364	C	S	.	.	H	α-helix	trans	-66.6	-42.2	177.5	-51.1	0	0	0	0	110.6	I114 L148 A199 L200 K201 A207	I114-T203 HydrophobicContact CG2-CG2 3.92Å; L148-T203 HydrophobicContact CD1-CG2 3.9Å; A199-T203 PolarHBondContact O-N 3.43Å; A199-T203 PolarHBondContact O-OG1 2.96Å; L200-T203 WeakPolarHBondContact O-CB 3.45Å; L200-T203 PolarHBondContact O-N 2.72Å; L200-T203 VanDerWaalsContact O-N 3.13Å; K201-T203 VanDerWaalsContact C-N 3.31Å; K201-T203 PolarHBondContact O-N 2.9Å; T203-A207 WeakPolarHBondContact O-CB 3.16Å; T203-A207 PolarHBondContact O-N 3.31Å
204	I	82.8	Confident	73.6	Confident	18 Å²	18	76.4 Å²	76.4	9%	0.092	40%	0.398	C	S	.	.	H	α-helix	trans	-61.4	-49	175.3	-63.2	163.5	0	0	0	110.5	L148 C151 V153 L200 K201 A207 L208	L148-I204 HydrophobicContact CB-CG1 4.08Å; L148-I204 WeakPolarHBondContact O-CG1 3.49Å; C151-I204 HydrophobicContact CB-CD1 4.32Å; C151-I204 WeakPolarHBondContact O-CD1 3.49Å; V153-I204 HydrophobicContact CG2-CD1 3.8Å; L200-I204 WeakPolarHBondContact O-CD1 3.45Å; L200-I204 WeakPolarHBondContact O-CG1 3.25Å; L200-I204 PolarHBondContact O-N 2.84Å; K201-I204 PolarHBondContact O-N 3Å; I204-A207 PolarHBondContact O-N 3.18Å; I204-L208 HydrophobicContact CG2-CD1 4.12Å; I204-L208 VanDerWaalsContact O-CG 3.29Å; I204-L208 WeakPolarHBondContact O-CG 3.41Å; I204-L208 PolarHBondContact O-N 2.79Å
205	E	80.2	Confident	70.8	Confident	109 Å²	109	80 Å²	80	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-60.9	-47.8	178.2	-73.9	166.9	-171.6	0	0	111.9	K201 R202 A207 L208 H209	K201-E205 WeakPolarHBondContact O-CB 3.31Å; K201-E205 WeakPolarHBondContact O-CG 3.35Å; K201-E205 PolarHBondContact O-N 2.97Å; R202-E205 PolarHBondContact O-N 2.94Å; E205-A207 VanDerWaalsContact C-N 3.33Å; E205-A207 PolarHBondContact O-N 3.44Å; E205-L208 PolarHBondContact O-N 2.75Å; E205-H209 PolarHBondContact O-CD2 3.29Å; E205-H209 PolarHBondContact O-N 2.8Å; E205-H209 VanDerWaalsContact O-N 3.12Å
206	A	80.3	Confident	68	Low	59 Å²	59	84.1 Å²	84.1	49%	0.488	44%	0.439	S	S	.	.	H	α-helix	trans	-60.1	-43.2	177.5	0	0	0	0	0	111.8	R202 L208 H209 D210	R202-A206 VanDerWaalsContact O-CB 3.28Å; R202-A206 WeakPolarHBondContact O-CB 3.35Å; R202-A206 PolarHBondContact O-N 3.08Å; A206-L208 VanDerWaalsContact C-N 3.32Å; A206-L208 PolarHBondContact O-N 3.11Å; A206-H209 PolarHBondContact O-N 3.42Å; A206-D210 PolarHBondContact O-N 2.82Å; A206-D210 VanDerWaalsContact O-N 3.07Å
207	A	77.5	Confident	64.8	Low	1 Å²	1	88.9 Å²	88.9	1%	0.008	47%	0.473	C	S	.	.	H	α-helix	trans	-69	-28.4	179.7	0	0	0	0	0	113.3	N117 R149 T203 I204 E205 S211	N117-A207 HydrophobicContact CB-CB 4.16Å; N117-A207 VanDerWaalsContact CG-CB 3.43Å; N117-A207 WeakPolarHBondContact ND2-CB 3.43Å; N117-A207 WeakPolarHBondContact OD1-CB 3.34Å; R149-A207 WeakPolarHBondContact CD-O 3.47Å; R149-A207 HydrophobicContact CG-CB 3.26Å; T203-A207 WeakPolarHBondContact O-CB 3.16Å; T203-A207 PolarHBondContact O-N 3.31Å; I204-A207 PolarHBondContact O-N 3.18Å; E205-A207 VanDerWaalsContact C-N 3.33Å; E205-A207 PolarHBondContact O-N 3.44Å; A207-S211 PolarHBondContact O-OG 3.17Å
208	L	73.9	Confident	61.8	Low	100 Å²	100	96.1 Å²	96.1	52%	0.524	51%	0.512	S	S	.	.	H	α-helix	trans	-70.2	-37.2	171.2	-72.6	168.8	0	0	0	111.7	R149 I204 E205 A206	R149-L208 HydrophobicContact CB-CD2 4.38Å; I204-L208 HydrophobicContact CG2-CD1 4.12Å; I204-L208 VanDerWaalsContact O-CG 3.29Å; I204-L208 WeakPolarHBondContact O-CG 3.41Å; I204-L208 PolarHBondContact O-N 2.79Å; E205-L208 PolarHBondContact O-N 2.75Å; A206-L208 VanDerWaalsContact C-N 3.32Å; A206-L208 PolarHBondContact O-N 3.11Å
209	H	65.2	Low	58.7	Low	152 Å²	152	93.6 Å²	93.6	70%	0.704	52%	0.52	S	S	*	.	H	α-helix	trans	-76.8	-27.4	-179.2	-75.4	-61.2	0	0	0	114.4	E205 A206 S211	E205-H209 PolarHBondContact O-CD2 3.29Å; E205-H209 PolarHBondContact O-N 2.8Å; E205-H209 VanDerWaalsContact O-N 3.12Å; A206-H209 PolarHBondContact O-N 3.42Å; H209-S211 PolarHBondContact O-N 2.83Å
210	D	65	Low	55.8	Low	139 Å²	139	98.4 Å²	98.4	74%	0.743	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-4.5	178.6	-147.1	26	0	0	0	113.2	A206 M212	A206-D210 PolarHBondContact O-N 2.82Å; A206-D210 VanDerWaalsContact O-N 3.07Å; D210-M212 VanDerWaalsContact C-N 3.35Å; D210-M212 PolarHBondContact O-N 2.79Å
211	S	47.7	Very low	52.6	Low	63 Å²	63	105.2 Å²	105.2	44%	0.441	59%	0.594	S	S	.	*			trans	-92.5	37.8	-177.8	-52.2	0	0	0	0	113.6	A207 H209 P213	A207-S211 PolarHBondContact O-OG 3.17Å; H209-S211 PolarHBondContact O-N 2.83Å; S211-P213 WeakPolarHBondContact O-CD 3.41Å
212	M	29.6	Very low	49.7	Very low	174 Å²	174	104.5 Å²	104.5	86%	0.857	61%	0.613	S	S	*	*			trans	-103.7	87.7	165	-66.7	-137.8	-55.1	0	0	110.8	D210	D210-M212 VanDerWaalsContact C-N 3.35Å; D210-M212 PolarHBondContact O-N 2.79Å
213	P	36.1	Very low	46.8	Very low	109 Å²	109	105.5 Å²	105.5	71%	0.708	63%	0.629	S	S	*	*			trans	-68.6	131.1	151.7	26.4	-23.4	0	0	0	108.5	S211 M215	S211-P213 WeakPolarHBondContact O-CD 3.41Å; P213-M215 PolarHBondContact O-N 3.06Å; P213-M215 VanDerWaalsContact O-N 3.14Å
214	D	30.3	Very low	44.1	Very low	169 Å²	169	112.9 Å²	112.9	90%	0.904	67%	0.668	S	S	*	*			trans	-40.1	115.7	174.1	-69.8	-47	0	0	0	111.7
215	M	28.9	Very low	41.3	Very low	173 Å²	173	118.7 Å²	118.7	85%	0.852	70%	0.704	S	S	*	*			trans	-135.3	128.7	167.3	-104.7	-67.1	-162.3	0	0	110.4	P213	P213-M215 PolarHBondContact O-N 3.06Å; P213-M215 VanDerWaalsContact O-N 3.14Å
216	P	28.6	Very low	38.9	Very low	112 Å²	112	123 Å²	123	73%	0.727	72%	0.721	S	S	*	*			trans	-77.3	147	-168.2	-4.3	21	0	0	0	112.9
217	S	23.8	Very low	36.2	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	73%	0.734	S	S	*	*			trans	-33.7	129.8	162.3	54.6	0	0	0	0	115.2
218	N	26	Very low	33.7	Very low	164 Å²	164	133.6 Å²	133.6	88%	0.877	78%	0.778	S	S	*	*			trans	169.7	112.3	143	-85.5	-19.4	0	0	0	105.3
219	G	22.8	Very low	31.5	Very low	66 Å²	66	133.9 Å²	133.9	68%	0.68	79%	0.786	S	S	*	*				114.5	134.7	60.1	0	0	0	0	0	107.8
220	S	25.4	Very low	29.5	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	79%	0.793	S	S	*	*			trans	68.1	101.9	160.1	56.7	0	0	0	0	120.9
221	T	22.2	Very low	27.8	Very low	143 Å²	143	137.3 Å²	137.3	88%	0.877	80%	0.8	S	S	*	*				31.4	122.5	113.4	58.9	0	0	0	0	119.5
222	G	27.2	Very low	26.7	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	82%	0.816	S	S	*	*			trans	-169.8	88.6	163.5	0	0	0	0	0	113.3
223	N	23.6	Very low	26.4	Very low	166 Å²	166	139.9 Å²	139.9	89%	0.888	81%	0.811	S	S	*	*			trans	-58.8	136	161.4	-82.4	-26.2	0	0	0	110.1
224	L	29.8	Very low	26	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	81%	0.813	S	S	*	*			trans	-158.1	106.6	154	-106.8	138.4	0	0	0	111.2
225	V	23.5	Very low	25.9	Very low	140 Å²	140	137.8 Å²	137.8	85%	0.848	81%	0.808	S	S	*	*			trans	-75.9	130.6	163.2	174.5	0	0	0	0	107.9
226	K	29.8	Very low	25.7	Very low	198 Å²	198	133 Å²	133	86%	0.861	80%	0.803	S	S	*	*			trans	-151.1	115.3	159.9	-132.1	175.8	-175.4	-180	0	111
227	A	22.4	Very low	25.8	Very low	92 Å²	92	133.9 Å²	133.9	76%	0.76	81%	0.806	S	S	*	*			trans	-85.6	144.5	169.3	0	0	0	0	0	110.1
228	M	25	Very low	26.2	Very low	192 Å²	192	133.8 Å²	133.8	95%	0.946	81%	0.812	S	S	*	*			trans	-155.5	146.6	157.9	-125.2	173.5	165.3	0	0	110.8
229	P	28.4	Very low	26.6	Very low	106 Å²	106	131.5 Å²	131.5	69%	0.688	80%	0.804	S	S	*	*			trans	-110.8	158.9	-166.3	38.8	-27.6	0	0	0	115.4
230	K	23.8	Very low	27	Very low	193 Å²	193	138.5 Å²	138.5	84%	0.839	81%	0.81	S	S	*	*			trans	52.3	103.9	146.3	-67.2	177.7	179.9	-179.7	0	118.5
231	D	28.6	Very low	27.6	Very low	169 Å²	169	139.5 Å²	139.5	90%	0.904	81%	0.807	S	S	*	*			trans	-116.7	145.7	150.4	-84.3	-39.3	0	0	0	111.5
232	H	25	Very low	28.4	Very low	168 Å²	168	140.4 Å²	140.4	78%	0.778	80%	0.801	S	S	*	*			trans	-78.6	170.8	-171.5	-76.4	-93.7	0	0	0	113.2
233	T	24.1	Very low	28.9	Very low	123 Å²	123	139.1 Å²	139.1	76%	0.755	79%	0.787	S	S	*	*			trans	98	126.4	138.2	14.3	0	0	0	0	120.2
234	T	27.7	Very low	29.5	Very low	120 Å²	120	138.3 Å²	138.3	74%	0.736	78%	0.778	S	S	*	*			trans	87.6	102.8	147.1	56.8	0	0	0	0	120.7
235	S	27.1	Very low	29.9	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	77%	0.77	S	S	*	*				70.2	102.2	116.4	-51.5	0	0	0	0	119.4
236	G	25.2	Very low	30.7	Very low	74 Å²	74	137.2 Å²	137.2	76%	0.763	76%	0.757	S	S	*	*				78.8	79.8	114.8	0	0	0	0	0	117.1
237	T	30.7	Very low	31.4	Very low	129 Å²	129	130.7 Å²	130.7	79%	0.791	74%	0.74	S	S	*	*			trans	-156.8	104.8	137.9	11.1	0	0	0	0	106.6	V239	T237-V239 PolarHBondContact O-N 3.42Å
238	A	31.6	Very low	32.6	Very low	102 Å²	102	129.7 Å²	129.7	84%	0.843	73%	0.725	S	S	*	*			trans	-71.7	77	171.4	0	0	0	0	0	108.2	R240	A238-R240 VanDerWaalsContact C-N 3.28Å; A238-R240 PolarHBondContact O-N 3.43Å
239	V	35	Very low	33.8	Very low	115 Å²	115	123 Å²	123	70%	0.697	70%	0.7	S	S	*	*			trans	-63.1	99.6	160.1	179	0	0	0	0	104.9	T237 N241	T237-V239 PolarHBondContact O-N 3.42Å; V239-N241 PolarHBondContact O-N 3.2Å
240	R	31.7	Very low	35	Very low	214 Å²	214	123.7 Å²	123.7	81%	0.808	70%	0.697	S	S	*	*			trans	-57	116	171.4	-75.1	-179.2	173.6	-175	-2.4	106.7	A238 E242	A238-R240 VanDerWaalsContact C-N 3.28Å; A238-R240 PolarHBondContact O-N 3.43Å; R240-E242 PolarHBondContact O-N 3.25Å; R240-E242 VanDerWaalsContact O-N 3.08Å
241	N	36.4	Very low	36.3	Very low	131 Å²	131	117.7 Å²	117.7	70%	0.701	68%	0.679	S	S	*	*			trans	-57.4	111.3	-176.7	-93.8	-24.9	0	0	0	110.1	V239 G243 E244	V239-N241 PolarHBondContact O-N 3.2Å; N241-G243 PolarHBondContact O-N 2.64Å; N241-E244 PolarHBondContact O-N 3.49Å; N241-E244 VanDerWaalsContact O-N 3.13Å
242	E	40.2	Very low	37.7	Very low	161 Å²	161	114.2 Å²	114.2	75%	0.752	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-11.9	173.1	-65.8	-170.8	155.8	0	0	113.4	R240 E244	R240-E242 PolarHBondContact O-N 3.25Å; R240-E242 VanDerWaalsContact O-N 3.08Å; E242-E244 VanDerWaalsContact C-N 3.29Å; E242-E244 PolarHBondContact O-N 3.16Å
243	G	36.6	Very low	39.3	Very low	51 Å²	51	110.3 Å²	110.3	53%	0.526	65%	0.647	S	S	.	*	H	α-helix	trans	-63.9	-27	173.4	0	0	0	0	0	114.6	N241 A247	N241-G243 PolarHBondContact O-N 2.64Å; G243-A247 PolarHBondContact O-N 3.4Å
244	E	36.6	Very low	41	Very low	149 Å²	149	108.7 Å²	108.7	70%	0.696	64%	0.637	S	S	*	*	H	α-helix	trans	-73.8	-37.7	-176.8	-118.1	174.6	-176.4	0	0	112.9	N241 E242 A247 T248	N241-E244 PolarHBondContact O-N 3.49Å; N241-E244 VanDerWaalsContact O-N 3.13Å; E242-E244 VanDerWaalsContact C-N 3.29Å; E242-E244 PolarHBondContact O-N 3.16Å; E244-A247 PolarHBondContact O-N 2.84Å; E244-T248 WeakPolarHBondContact O-CG2 3.47Å; E244-T248 PolarHBondContact O-N 3.23Å; E244-T248 PolarHBondContact O-OG1 3.13Å
245	Y	39.5	Very low	42.5	Very low	172 Å²	172	107.4 Å²	107.4	68%	0.675	63%	0.625	S	S	*	*	H	α-helix	trans	-65.5	-38.8	176.1	-76.9	-80.3	0	0	0	112.3	T248 A249	Y245-T248 WeakPolarHBondContact CA-OG1 3.28Å; Y245-T248 PolarHBondContact O-OG1 3.44Å; Y245-A249 VanDerWaalsContact O-CB 3.32Å; Y245-A249 WeakPolarHBondContact O-CB 3.32Å; Y245-A249 PolarHBondContact O-N 3.02Å
246	N	40	Very low	44.1	Very low	109 Å²	109	104 Å²	104	58%	0.583	60%	0.604	S	S	*	*	H	α-helix	trans	-71.5	-39.3	179.1	-72.5	-34.4	0	0	0	112	L250	N246-L250 WeakPolarHBondContact O-CB 3.36Å; N246-L250 WeakPolarHBondContact O-CD1 3.27Å; N246-L250 WeakPolarHBondContact O-CG 3.41Å; N246-L250 PolarHBondContact O-N 2.96Å
247	A	43	Very low	46	Very low	61 Å²	61	102.5 Å²	102.5	50%	0.504	58%	0.58	S	S	.	*	H	α-helix	trans	-64.5	-42.8	176.9	0	0	0	0	0	111.8	G243 E244 S251	G243-A247 PolarHBondContact O-N 3.4Å; E244-A247 PolarHBondContact O-N 2.84Å; A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.45Å; A247-S251 PolarHBondContact O-N 2.77Å
248	T	48.9	Very low	48	Very low	71 Å²	71	99.4 Å²	99.4	44%	0.436	56%	0.563	S	S	.	*	H	α-helix	trans	-66.4	-46.4	176.8	46.7	0	0	0	0	111.6	E244 Y245 L250 S251 I252	E244-T248 WeakPolarHBondContact O-CG2 3.47Å; E244-T248 PolarHBondContact O-N 3.23Å; E244-T248 PolarHBondContact O-OG1 3.13Å; Y245-T248 WeakPolarHBondContact CA-OG1 3.28Å; Y245-T248 PolarHBondContact O-OG1 3.44Å; T248-L250 PolarHBondContact O-N 3.2Å; T248-S251 PolarHBondContact O-N 3.01Å; T248-I252 WeakPolarHBondContact O-CB 3.4Å; T248-I252 WeakPolarHBondContact O-CD1 3.34Å; T248-I252 WeakPolarHBondContact O-CG1 3.3Å; T248-I252 PolarHBondContact O-N 2.85Å
249	A	50.5	Low	50	Low	51 Å²	51	98.1 Å²	98.1	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-60	-44.8	177.6	0	0	0	0	0	112.7	Y245 I252 V253	Y245-A249 VanDerWaalsContact O-CB 3.32Å; Y245-A249 WeakPolarHBondContact O-CB 3.32Å; Y245-A249 PolarHBondContact O-N 3.02Å; A249-I252 PolarHBondContact O-N 3.25Å; A249-V253 WeakPolarHBondContact O-CG2 3.46Å; A249-V253 PolarHBondContact O-N 2.95Å; A249-V253 VanDerWaalsContact O-N 3.08Å
250	L	52.8	Low	52.2	Low	120 Å²	120	92.8 Å²	92.8	63%	0.628	51%	0.51	S	S	*	.	H	α-helix	trans	-63.7	-45.3	175.9	-81.3	161.3	0	0	0	112.1	N246 T248 I252 V253 V254	N246-L250 WeakPolarHBondContact O-CB 3.36Å; N246-L250 WeakPolarHBondContact O-CD1 3.27Å; N246-L250 WeakPolarHBondContact O-CG 3.41Å; N246-L250 PolarHBondContact O-N 2.96Å; T248-L250 PolarHBondContact O-N 3.2Å; L250-I252 VanDerWaalsContact C-N 3.28Å; L250-I252 PolarHBondContact O-N 2.75Å; L250-V253 PolarHBondContact O-N 3.07Å; L250-V254 VanDerWaalsContact O-CG2 3.29Å; L250-V254 WeakPolarHBondContact O-CG2 3.43Å; L250-V254 PolarHBondContact O-N 3.06Å
251	S	52.2	Low	54.6	Low	67 Å²	67	86.2 Å²	86.2	47%	0.469	49%	0.49	S	S	.	.	H	α-helix	trans	-59.6	-40.4	177.4	-176.7	0	0	0	0	111.5	A247 T248 V254 I255	A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.45Å; A247-S251 PolarHBondContact O-N 2.77Å; T248-S251 PolarHBondContact O-N 3.01Å; S251-V254 PolarHBondContact O-N 3.31Å; S251-I255 VanDerWaalsContact O-CG1 3.26Å; S251-I255 WeakPolarHBondContact O-CG1 3.5Å; S251-I255 PolarHBondContact O-N 3.42Å
252	I	57.3	Low	56.9	Low	96 Å²	96	81.1 Å²	81.1	49%	0.492	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-46.8	177.9	-68.9	162.2	0	0	0	111.7	T248 A249 L250 V254 I255 A256	T248-I252 WeakPolarHBondContact O-CB 3.4Å; T248-I252 WeakPolarHBondContact O-CD1 3.34Å; T248-I252 WeakPolarHBondContact O-CG1 3.3Å; T248-I252 PolarHBondContact O-N 2.85Å; A249-I252 PolarHBondContact O-N 3.25Å; L250-I252 VanDerWaalsContact C-N 3.28Å; L250-I252 PolarHBondContact O-N 2.75Å; I252-V254 VanDerWaalsContact C-N 3.27Å; I252-V254 PolarHBondContact O-N 3.06Å; I252-I255 PolarHBondContact O-N 3.38Å; I252-I255 VanDerWaalsContact O-N 3.16Å; I252-A256 WeakPolarHBondContact O-CB 3.32Å; I252-A256 PolarHBondContact O-N 2.92Å
253	V	57.9	Low	59.1	Low	86 Å²	86	73.4 Å²	73.4	52%	0.521	43%	0.429	S	S	.	.	H	α-helix	trans	-60.8	-40.4	177.6	174.1	0	0	0	0	110.6	A249 L250 A256 V257	A249-V253 WeakPolarHBondContact O-CG2 3.46Å; A249-V253 PolarHBondContact O-N 2.95Å; A249-V253 VanDerWaalsContact O-N 3.08Å; L250-V253 PolarHBondContact O-N 3.07Å; V253-A256 PolarHBondContact O-N 3.02Å; V253-V257 HydrophobicContact CG1-CG2 4.35Å; V253-V257 WeakPolarHBondContact O-CB 3.47Å; V253-V257 VanDerWaalsContact O-CG2 3.28Å; V253-V257 WeakPolarHBondContact O-CG2 3.32Å; V253-V257 PolarHBondContact O-N 3.48Å
254	V	59.9	Low	61.5	Low	90 Å²	90	72 Å²	72	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-41.7	176.1	172.9	0	0	0	0	111.4	L250 S251 I252 S258	L250-V254 VanDerWaalsContact O-CG2 3.29Å; L250-V254 WeakPolarHBondContact O-CG2 3.43Å; L250-V254 PolarHBondContact O-N 3.06Å; S251-V254 PolarHBondContact O-N 3.31Å; I252-V254 VanDerWaalsContact C-N 3.27Å; I252-V254 PolarHBondContact O-N 3.06Å; V254-S258 VanDerWaalsContact O-CB 3.26Å; V254-S258 WeakPolarHBondContact O-CB 3.35Å; V254-S258 PolarHBondContact O-N 2.97Å; V254-S258 PolarHBondContact O-OG 3.48Å
255	I	60.1	Low	63.9	Low	92 Å²	92	71.5 Å²	71.5	47%	0.472	41%	0.412	S	S	.	.	H	α-helix	trans	-64.9	-48.6	176.6	-67.5	163	0	0	0	110.7	S251 I252 V257 S258 D259	S251-I255 VanDerWaalsContact O-CG1 3.26Å; S251-I255 WeakPolarHBondContact O-CG1 3.5Å; S251-I255 PolarHBondContact O-N 3.42Å; I252-I255 PolarHBondContact O-N 3.38Å; I252-I255 VanDerWaalsContact O-N 3.16Å; I255-V257 PolarHBondContact O-N 2.59Å; I255-S258 WeakPolarHBondContact O-CB 3.49Å; I255-S258 PolarHBondContact O-N 3.44Å; I255-S258 VanDerWaalsContact O-N 3.09Å; I255-D259 PolarHBondContact O-N 3.11Å
256	A	60.3	Low	66.2	Low	43 Å²	43	65 Å²	65	36%	0.355	39%	0.389	S	S	.	.	H	α-helix	trans	-59.9	-45.4	-178.9	0	0	0	0	0	112.2	I252 V253 S258 D259 Q260	I252-A256 WeakPolarHBondContact O-CB 3.32Å; I252-A256 PolarHBondContact O-N 2.92Å; V253-A256 PolarHBondContact O-N 3.02Å; A256-S258 VanDerWaalsContact C-N 3.33Å; A256-S258 PolarHBondContact O-N 2.98Å; A256-D259 PolarHBondContact O-N 3.04Å; A256-Q260 WeakPolarHBondContact O-CB 3.43Å; A256-Q260 PolarHBondContact O-N 2.99Å
257	V	64.7	Low	68.4	Low	42 Å²	42	63 Å²	63	26%	0.255	38%	0.382	S	S	.	.	H	α-helix	trans	-66	-37.4	175.6	174.7	0	0	0	0	110.9	V253 I255 Q260 I261	V253-V257 HydrophobicContact CG1-CG2 4.35Å; V253-V257 WeakPolarHBondContact O-CB 3.47Å; V253-V257 VanDerWaalsContact O-CG2 3.28Å; V253-V257 WeakPolarHBondContact O-CG2 3.32Å; V253-V257 PolarHBondContact O-N 3.48Å; I255-V257 PolarHBondContact O-N 2.59Å; V257-Q260 PolarHBondContact O-N 3.17Å; V257-I261 HydrophobicContact CG1-CD1 3.83Å; V257-I261 HydrophobicContact CG1-CG1 4.4Å; V257-I261 VanDerWaalsContact O-CG1 3.22Å; V257-I261 WeakPolarHBondContact O-CG1 3.41Å; V257-I261 PolarHBondContact O-N 3.27Å
258	S	71.9	Confident	70.6	Confident	65 Å²	65	61 Å²	61	46%	0.455	37%	0.368	S	S	.	.	H	α-helix	trans	-64.4	-42	176.3	-61.2	0	0	0	0	112	V254 I255 A256 I261 S262	V254-S258 VanDerWaalsContact O-CB 3.26Å; V254-S258 WeakPolarHBondContact O-CB 3.35Å; V254-S258 PolarHBondContact O-N 2.97Å; V254-S258 PolarHBondContact O-OG 3.48Å; I255-S258 WeakPolarHBondContact O-CB 3.49Å; I255-S258 PolarHBondContact O-N 3.44Å; I255-S258 VanDerWaalsContact O-N 3.09Å; A256-S258 VanDerWaalsContact C-N 3.33Å; A256-S258 PolarHBondContact O-N 2.98Å; S258-I261 PolarHBondContact O-N 3.46Å; S258-S262 PolarHBondContact O-N 3.48Å
259	D	74.7	Confident	72.8	Confident	75 Å²	75	57.7 Å²	57.7	40%	0.401	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-39.7	175.7	-85.4	-31.9	0	0	0	112.2	I255 A256 S262 V342 R346	I255-D259 PolarHBondContact O-N 3.11Å; A256-D259 PolarHBondContact O-N 3.04Å; D259-S262 WeakPolarHBondContact O-CB 3.44Å; D259-S262 PolarHBondContact O-N 2.93Å; D259-S262 PolarHBondContact O-OG 3.31Å; D259-V342 HydrophobicContact CB-CG1 4.48Å; D259-R346 PolarHBondContact O-NH2 2.97Å; D259-R346 IonicContact OD1-NH2 2.94Å; D259-R346 PolarHBondContact OD1-NH2 2.87Å
260	Q	81.8	Confident	74.8	Confident	2 Å²	2	59.6 Å²	59.6	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-41.4	173.8	-174.7	-178.6	-6.6	0	0	111.9	A256 V257 S262 V263 S331 I332 D335 W337 V342	A256-Q260 WeakPolarHBondContact O-CB 3.43Å; A256-Q260 PolarHBondContact O-N 2.99Å; V257-Q260 PolarHBondContact O-N 3.17Å; Q260-S262 PolarHBondContact O-N 3.48Å; Q260-V263 VanDerWaalsContact O-CB 3.24Å; Q260-V263 WeakPolarHBondContact O-CB 3.35Å; Q260-V263 WeakPolarHBondContact O-CG2 3.42Å; Q260-V263 PolarHBondContact O-N 2.94Å; Q260-S331 PolarHBondContact NE2-O 3.24Å; Q260-I332 HydrophobicContact CG-CG2 4.34Å; Q260-I332 WeakPolarHBondContact CG-O 3.21Å; Q260-I332 PolarHBondContact NE2-O 3.48Å; Q260-D335 PolarHBondContact NE2-O 2.71Å; Q260-D335 PolarHBondContact OE1-O 3.44Å; Q260-D335 VanDerWaalsContact OE1-O 3.08Å; Q260-W337 HydrophobicContact CG-CD2 3.87Å; Q260-W337 HydrophobicContact CG-CE3 3.78Å; Q260-W337 HydrophobicContact CG-CG 4.27Å; Q260-W337 HydrophobicContact CG-CZ3 4.11Å; Q260-W337 VanDerWaalsContact NE2-CG 3.29Å; Q260-V342 HydrophobicContact CB-CG2 4.21Å; Q260-V342 HydrophobicContact CG-CG2 4.49Å
261	I	81.5	Confident	76.7	Confident	76 Å²	76	55.6 Å²	55.6	39%	0.39	33%	0.327	S	S	.	.	H	α-helix	trans	-62.8	-33.6	175.3	-70.3	164.9	0	0	0	110.9	V257 S258 V263 C264 T333	V257-I261 HydrophobicContact CG1-CD1 3.83Å; V257-I261 HydrophobicContact CG1-CG1 4.4Å; V257-I261 VanDerWaalsContact O-CG1 3.22Å; V257-I261 WeakPolarHBondContact O-CG1 3.41Å; V257-I261 PolarHBondContact O-N 3.27Å; S258-I261 PolarHBondContact O-N 3.46Å; I261-V263 PolarHBondContact O-N 3.03Å; I261-V263 VanDerWaalsContact O-N 3.12Å; I261-C264 VanDerWaalsContact O-CB 3.26Å; I261-C264 WeakPolarHBondContact O-CB 3.44Å; I261-C264 PolarHBondContact O-N 3.36Å; I261-T333 HydrophobicContact CG1-CG2 4.49Å
262	S	85.4	Confident	78.7	Confident	24 Å²	24	52.6 Å²	52.6	17%	0.168	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-19.7	178.5	85.5	0	0	0	0	113.7	S258 D259 Q260 C264 N265 R346	S258-S262 PolarHBondContact O-N 3.48Å; D259-S262 WeakPolarHBondContact O-CB 3.44Å; D259-S262 PolarHBondContact O-N 2.93Å; D259-S262 PolarHBondContact O-OG 3.31Å; Q260-S262 PolarHBondContact O-N 3.48Å; S262-C264 PolarHBondContact O-N 3.35Å; S262-N265 WeakPolarHBondContact O-CB 3.43Å; S262-N265 PolarHBondContact O-N 2.86Å; S262-R346 PolarHBondContact OG-NH1 3.34Å; S262-R346 VanDerWaalsContact OG-NH1 3.12Å; S262-R346 PolarHBondContact OG-NH2 3.18Å
263	V	86.2	Confident	80.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58	-29.8	171.1	174.4	0	0	0	0	111.4	Q260 I261 N265 L266 N269 T290 V342 M345 R346	Q260-V263 VanDerWaalsContact O-CB 3.24Å; Q260-V263 WeakPolarHBondContact O-CB 3.35Å; Q260-V263 WeakPolarHBondContact O-CG2 3.42Å; Q260-V263 PolarHBondContact O-N 2.94Å; I261-V263 PolarHBondContact O-N 3.03Å; I261-V263 VanDerWaalsContact O-N 3.12Å; V263-N265 PolarHBondContact O-N 2.81Å; V263-L266 HydrophobicContact CB-CD1 4.46Å; V263-L266 HydrophobicContact CG1-CD1 4.07Å; V263-L266 WeakPolarHBondContact O-CD1 3.36Å; V263-L266 WeakPolarHBondContact O-CG 3.19Å; V263-L266 PolarHBondContact O-N 3.14Å; V263-N269 WeakPolarHBondContact O-CB 3.36Å; V263-N269 PolarHBondContact O-ND2 3.18Å; V263-T290 HydrophobicContact CG1-CG2 4.36Å; V263-V342 HydrophobicContact CG2-CG1 4.09Å; V263-M345 HydrophobicContact CG1-CB 3.75Å; V263-M345 HydrophobicContact CG1-CE 3.95Å; V263-M345 HydrophobicContact CG2-CB 4.03Å; V263-R346 HydrophobicContact CG2-CG 4.44Å
264	C	87.2	Confident	82	Confident	22 Å²	22	45.1 Å²	45.1	15%	0.149	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-66.1	-22.3	175.1	-62.6	0	0	0	0	113.1	I261 S262 L266	I261-C264 VanDerWaalsContact O-CB 3.26Å; I261-C264 WeakPolarHBondContact O-CB 3.44Å; I261-C264 PolarHBondContact O-N 3.36Å; S262-C264 PolarHBondContact O-N 3.35Å; C264-L266 VanDerWaalsContact C-N 3.31Å
265	N	86.7	Confident	83.6	Confident	137 Å²	137	40.9 Å²	40.9	73%	0.733	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-85.8	-4.4	-176.7	-59.4	-24.1	0	0	0	112.9	S262 V263	S262-N265 WeakPolarHBondContact O-CB 3.43Å; S262-N265 PolarHBondContact O-N 2.86Å; V263-N265 PolarHBondContact O-N 2.81Å
266	L	87.6	Confident	85.1	Confident	35 Å²	35	37.2 Å²	37.2	18%	0.183	22%	0.224	C	C	.	.	S	Bend	trans	-70.1	147.9	178.7	-62.4	166.8	0	0	0	110.8	V263 C264 G268 N269 M345 R346	V263-L266 HydrophobicContact CB-CD1 4.46Å; V263-L266 HydrophobicContact CG1-CD1 4.07Å; V263-L266 WeakPolarHBondContact O-CD1 3.36Å; V263-L266 WeakPolarHBondContact O-CG 3.19Å; V263-L266 PolarHBondContact O-N 3.14Å; C264-L266 VanDerWaalsContact C-N 3.31Å; L266-G268 PolarHBondContact O-N 2.66Å; L266-G268 VanDerWaalsContact O-N 3.16Å; L266-N269 HydrophobicContact CB-CB 4.23Å; L266-N269 WeakPolarHBondContact O-CB 3.41Å; L266-N269 PolarHBondContact O-N 3.35Å; L266-M345 VanDerWaalsContact CD1-O 3.23Å; L266-M345 WeakPolarHBondContact CD1-O 3.48Å; L266-R346 HydrophobicContact CD1-CB 4.44Å; L266-R346 HydrophobicContact CD1-CG 4.36Å
267	P	86.3	Confident	86.6	Confident	67 Å²	67	36.1 Å²	36.1	44%	0.435	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	122.4	179.8	-26.5	34.7	0	0	0	113	N269 R351	P267-N269 VanDerWaalsContact C-N 3.33Å; P267-R351 WeakPolarHBondContact O-CB 3.35Å
268	G	89.6	Confident	88	Confident	21 Å²	21	42.2 Å²	42.2	22%	0.216	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.3	-14.2	-178.4	0	0	0	0	0	114.3	L266 E270 L271 N350	L266-G268 PolarHBondContact O-N 2.66Å; L266-G268 VanDerWaalsContact O-N 3.16Å; G268-E270 VanDerWaalsContact C-N 3.28Å; G268-E270 WeakPolarHBondContact CA-OE2 3.4Å; G268-E270 PolarHBondContact N-OE2 3.04Å; G268-L271 PolarHBondContact O-N 3.03Å; G268-N350 VanDerWaalsContact O-CB 3.3Å; G268-N350 WeakPolarHBondContact O-CB 3.12Å; G268-N350 PolarHBondContact O-ND2 3.43Å; G268-N350 VanDerWaalsContact O-ND2 3.09Å
269	N	94	Very high	88.8	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-11.4	179.3	-74.7	9.2	0	0	0	112.8	V263 L266 P267 L271 P280 T290 G349 N350	V263-N269 WeakPolarHBondContact O-CB 3.36Å; V263-N269 PolarHBondContact O-ND2 3.18Å; L266-N269 HydrophobicContact CB-CB 4.23Å; L266-N269 WeakPolarHBondContact O-CB 3.41Å; L266-N269 PolarHBondContact O-N 3.35Å; P267-N269 VanDerWaalsContact C-N 3.33Å; N269-L271 PolarHBondContact O-N 3.17Å; N269-P280 WeakPolarHBondContact O-CD 3.1Å; N269-P280 WeakPolarHBondContact O-CG 3.19Å; N269-T290 HydrophobicContact CB-CG2 4.05Å; N269-T290 PolarHBondContact O-OG1 2.94Å; N269-G349 WeakPolarHBondContact OD1-CA 3.26Å; N269-N350 WeakPolarHBondContact OD1-CB 3.46Å; N269-N350 PolarHBondContact OD1-N 3.15Å; N269-N350 PolarHBondContact OD1-OD1 2.8Å
270	E	92.1	Very high	89.8	Confident	91 Å²	91	40.7 Å²	40.7	43%	0.425	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-15.8	171.1	71.7	-69.6	167.2	0	0	112.8	G268 D279 P280	G268-E270 VanDerWaalsContact C-N 3.28Å; G268-E270 WeakPolarHBondContact CA-OE2 3.4Å; G268-E270 PolarHBondContact N-OE2 3.04Å; E270-D279 PolarHBondContact O-N 3.25Å; E270-P280 WeakPolarHBondContact O-CD 3.28Å
271	L	93.3	Very high	90.3	Very high	36 Å²	36	45.3 Å²	45.3	19%	0.188	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-123	144.4	175.8	-53.5	179	0	0	0	110.6	G268 N269 A273 S277 K278 N350	G268-L271 PolarHBondContact O-N 3.03Å; N269-L271 PolarHBondContact O-N 3.17Å; L271-A273 PolarHBondContact O-N 3.01Å; L271-S277 CarbonylContact C-O 3.5Å; L271-S277 WeakPolarHBondContact CA-O 3.42Å; L271-K278 HydrophobicContact CD2-CG 3.94Å; L271-N350 PolarHBondContact O-ND2 3.36Å
272	C	94.3	Very high	91	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.027	24%	0.235	C	C	.	.			trans	-55.6	130.6	170.5	174.6	0	0	0	0	110.8	E274 C275 G276 S277 P280 C292	C272-E274 PolarHBondContact O-N 3.33Å; C272-C275 VanDerWaalsContact SG-SG 3.69Å; C272-G276 WeakPolarHBondContact O-CA 3.5Å; C272-G276 PolarHBondContact O-N 2.84Å; C272-S277 PolarHBondContact N-O 3.46Å; C272-P280 HydrophobicContact CB-CB 4.5Å; C272-C292 HydrophobicContact CB-CB 4.1Å; C272-C292 PolarHBondContact SG-N 3.23Å
273	A	93.1	Very high	91.5	Very high	9 Å²	9	43.1 Å²	43.1	7%	0.074	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-18.6	-177.7	0	0	0	0	0	114.9	L271 I289 T290 L291 N350 K383	L271-A273 PolarHBondContact O-N 3.01Å; A273-I289 HydrophobicContact CB-CB 3.84Å; A273-I289 HydrophobicContact CB-CD1 4.29Å; A273-I289 HydrophobicContact CB-CG2 4.04Å; A273-T290 WeakPolarHBondContact CB-O 3.29Å; A273-T290 PolarHBondContact N-O 3.24Å; A273-L291 HydrophobicContact CB-CD2 4.22Å; A273-N350 HydrophobicContact CB-CB 4.42Å; A273-N350 PolarHBondContact N-ND2 3.47Å; A273-K383 PolarHBondContact O-NZ 3.26Å
274	E	92.6	Very high	91.9	Very high	17 Å²	17	43.1 Å²	43.1	8%	0.079	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-60.6	-175.8	-42.3	-55.3	169.3	0	0	113.1	C272 L291 C295 H299 L367 I380 K383 Y384	C272-E274 PolarHBondContact O-N 3.33Å; E274-L291 HydrophobicContact CG-CD2 3.65Å; E274-C295 HydrophobicContact CB-CB 4.34Å; E274-C295 HydrophobicContact CG-CB 4.06Å; E274-H299 IonicContact OE1-CE1 2.65Å; E274-H299 IonicContact OE1-NE2 3.94Å; E274-H299 PolarHBondContact OE1-NE2 3.21Å; E274-L367 HydrophobicContact CB-CD1 4.39Å; E274-I380 HydrophobicContact CB-CD1 4.16Å; E274-I380 HydrophobicContact CB-CG1 4.18Å; E274-I380 HydrophobicContact CG-CD1 3.85Å; E274-I380 HydrophobicContact CG-CG1 3.91Å; E274-K383 IonicContact OE2-NZ 2.8Å; E274-K383 PolarHBondContact OE2-NZ 2.93Å; E274-Y384 WeakPolarHBondContact OE1-CE2 3.4Å; E274-Y384 VanDerWaalsContact OE1-CZ 3.25Å; E274-Y384 PolarHBondContact OE1-OH 3.28Å; E274-Y384 PolarHBondContact OE2-OH 3.28Å
275	C	92.4	Very high	92.3	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.007	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	-5.1	-172.2	65.4	0	0	0	0	113.9	C272 S277 C292 L367 K368 P369	C272-C275 VanDerWaalsContact SG-SG 3.69Å; C275-S277 VanDerWaalsContact C-N 3.27Å; C275-S277 PolarHBondContact O-N 3.26Å; C275-S277 PolarHBondContact SG-OG 2.89Å; C275-C292 VanDerWaalsContact SG-SG 3.69Å; C275-L367 HydrophobicContact CB-CB 4.21Å; C275-K368 CarbonylContact O-C 3.42Å; C275-P369 VanDerWaalsContact O-CD 3.26Å; C275-P369 WeakPolarHBondContact O-CD 3.36Å
276	G	90.8	Very high	92.7	Very high	14 Å²	14	36 Å²	36	14%	0.144	19%	0.187	C	C	.	.			trans	70.8	16.4	-178.7	0	0	0	0	0	115	C272	C272-G276 WeakPolarHBondContact O-CA 3.5Å; C272-G276 PolarHBondContact O-N 2.84Å
277	S	93.8	Very high	93	Very high	21 Å²	21	34.8 Å²	34.8	15%	0.147	18%	0.181	C	C	.	.			trans	-60.5	138.3	171.9	-62.6	0	0	0	0	110.4	L271 C272 C275 P369	L271-S277 CarbonylContact C-O 3.5Å; L271-S277 WeakPolarHBondContact CA-O 3.42Å; C272-S277 PolarHBondContact N-O 3.46Å; C275-S277 VanDerWaalsContact C-N 3.27Å; C275-S277 PolarHBondContact O-N 3.26Å; C275-S277 PolarHBondContact SG-OG 2.89Å; S277-P369 WeakPolarHBondContact OG-CB 3.29Å
278	K	93.1	Very high	93.4	Very high	169 Å²	169	31.6 Å²	31.6	74%	0.735	16%	0.16	S	C	*	.	B	Isolated β-bridge	trans	-67.1	154.8	179.9	-62.1	-175.7	177.4	-175.4	0	112.1	L271	L271-K278 HydrophobicContact CD2-CG 3.94Å
279	D	89.4	Confident	93.7	Very high	107 Å²	107	30.6 Å²	30.6	57%	0.572	15%	0.15	S	C	*	.	S	Bend	trans	52	55.9	170.3	-55.8	-48.7	0	0	0	114.5	E270 K281	E270-D279 PolarHBondContact O-N 3.25Å; D279-K281 PolarHBondContact O-N 2.93Å
280	P	94.3	Very high	93.9	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.013	15%	0.15	C	C	.	.			trans	-57.8	134.4	176.3	26.9	-34.3	0	0	0	111.1	N269 E270 C272 T290 L291	N269-P280 WeakPolarHBondContact O-CD 3.1Å; N269-P280 WeakPolarHBondContact O-CG 3.19Å; E270-P280 WeakPolarHBondContact O-CD 3.28Å; C272-P280 HydrophobicContact CB-CB 4.5Å; P280-T290 WeakPolarHBondContact CG-OG1 3.42Å; P280-L291 WeakPolarHBondContact CA-O 3.35Å; P280-L291 WeakPolarHBondContact CB-O 3.43Å
281	K	93.3	Very high	94	Very high	99 Å²	99	26.3 Å²	26.3	43%	0.43	13%	0.13	S	C	.	.			trans	-110.6	5.9	-178.2	-57.4	-57.6	178.9	-173	0	113.8	D279 L291 I332	D279-K281 PolarHBondContact O-N 2.93Å; K281-L291 PolarHBondContact N-O 3.03Å; K281-I332 PolarHBondContact O-N 3.43Å
282	W	95.5	Very high	94.1	Very high	54 Å²	54	25.3 Å²	25.3	21%	0.205	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	157.9	178.9	-61.9	80	0	0	0	109.2	T290 L291 I293 V329 R330 I332	W282-T290 CarbonylContact O-C 3.07Å; W282-T290 VanDerWaalsContact O-CA 3.29Å; W282-T290 WeakPolarHBondContact O-CA 3.33Å; W282-L291 HydrophobicContact CB-CB 4.33Å; W282-L291 WeakPolarHBondContact CB-O 3.5Å; W282-L291 PolarHBondContact N-O 2.93Å; W282-L291 VanDerWaalsContact N-O 3.1Å; W282-L291 PolarHBondContact O-N 3.15Å; W282-I293 HydrophobicContact CZ2-CD1 4.49Å; W282-I293 HydrophobicContact CZ2-CG1 4.4Å; W282-V329 HydrophobicContact CB-CG1 4.41Å; W282-V329 HydrophobicContact CE3-CG1 4.01Å; W282-R330 CarbonylContact C-O 3.57Å; W282-R330 WeakPolarHBondContact CA-O 3.23Å; W282-I332 WeakPolarHBondContact O-CD1 3.49Å
283	A	95.8	Very high	94	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	153.9	173.7	0	0	0	0	0	110.8	I289 V329 R330 I332 W337 M345	A283-I289 CarbonylContact C-O 3.53Å; A283-I289 WeakPolarHBondContact CA-O 3.41Å; A283-I289 WeakPolarHBondContact CB-O 3.47Å; A283-V329 CarbonylContact O-C 3.49Å; A283-V329 WeakPolarHBondContact O-CA 3.49Å; A283-R330 PolarHBondContact N-O 3.37Å; A283-R330 PolarHBondContact O-N 3.46Å; A283-I332 HydrophobicContact CB-CD1 4.36Å; A283-I332 HydrophobicContact CB-CG1 4.1Å; A283-W337 HydrophobicContact CB-CH2 3.42Å; A283-W337 VanDerWaalsContact CB-CH2 3.42Å; A283-W337 HydrophobicContact CB-CZ2 3.86Å; A283-W337 HydrophobicContact CB-CZ3 4.49Å; A283-M345 HydrophobicContact CB-CE 3.96Å
284	S	95.8	Very high	94	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	110	164.2	-178.5	0	0	0	0	108.1	N286 M287 G288 I289 S327	S284-N286 PolarHBondContact OG-OD1 2.96Å; S284-N286 VanDerWaalsContact OG-OD1 3.14Å; S284-M287 CarbonylContact O-C 3.5Å; S284-M287 PolarHBondContact O-N 2.88Å; S284-G288 PolarHBondContact O-N 3.22Å; S284-I289 PolarHBondContact N-O 3.31Å; S284-I289 PolarHBondContact O-N 3.18Å; S284-S327 WeakPolarHBondContact CB-OG 3.36Å; S284-S327 PolarHBondContact OG-OG 3.08Å
285	L	95.1	Very high	94	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.016	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-42.9	-169.7	-65.2	-177.7	0	0	0	112.1	M287 G288 K328 R330 W337 Q341 M345 L483	L285-M287 VanDerWaalsContact C-N 3.27Å; L285-M287 PolarHBondContact O-N 2.96Å; L285-G288 PolarHBondContact O-N 3.07Å; L285-K328 PolarHBondContact N-O 3.33Å; L285-R330 HydrophobicContact CD1-CB 4.38Å; L285-R330 HydrophobicContact CD1-CG 3.71Å; L285-R330 HydrophobicContact CG-CB 4.42Å; L285-R330 HydrophobicContact CG-CG 4.12Å; L285-W337 HydrophobicContact CD2-CD2 3.87Å; L285-W337 HydrophobicContact CD2-CE3 3.7Å; L285-W337 HydrophobicContact CD2-CH2 3.74Å; L285-W337 HydrophobicContact CD2-CZ2 3.88Å; L285-W337 HydrophobicContact CD2-CZ3 3.64Å; L285-Q341 HydrophobicContact CD1-CB 4.34Å; L285-Q341 HydrophobicContact CD1-CG 4.2Å; L285-Q341 HydrophobicContact CD2-CB 4.49Å; L285-M345 HydrophobicContact CD2-CG 3.99Å; L285-M345 HydrophobicContact CD2-SD 4.25Å; L285-L483 HydrophobicContact CB-CD1 4.01Å; L285-L483 HydrophobicContact CB-CD2 4.22Å
286	N	94.7	Very high	94	Very high	7 Å²	7	34.8 Å²	34.8	4%	0.037	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-23.6	179.4	72.1	-60.4	0	0	0	113.1	S284 V326 K328 F447 L483 N484	S284-N286 PolarHBondContact OG-OD1 2.96Å; S284-N286 VanDerWaalsContact OG-OD1 3.14Å; N286-V326 PolarHBondContact ND2-O 3.41Å; N286-K328 HydrophobicContact CB-CB 4.34Å; N286-K328 HydrophobicContact CB-CD 4.18Å; N286-K328 HydrophobicContact CB-CG 4.28Å; N286-K328 WeakPolarHBondContact OD1-CB 3.34Å; N286-K328 PolarHBondContact OD1-N 3.31Å; N286-F447 WeakPolarHBondContact O-CE2 3.37Å; N286-L483 HydrophobicContact CB-CB 3.79Å; N286-L483 WeakPolarHBondContact CB-O 3.34Å; N286-N484 PolarHBondContact O-ND2 3Å
287	M	94.4	Very high	93.9	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.044	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-7.9	176.9	-65.1	-171.3	169.4	0	0	113.3	S284 L285 I289 L322 V326 V353 Y384 F447	S284-M287 CarbonylContact O-C 3.5Å; S284-M287 PolarHBondContact O-N 2.88Å; L285-M287 VanDerWaalsContact C-N 3.27Å; L285-M287 PolarHBondContact O-N 2.96Å; M287-I289 VanDerWaalsContact C-N 3.34Å; M287-I289 HydrophobicContact CB-CD1 4.05Å; M287-I289 HydrophobicContact CB-CG1 3.93Å; M287-I289 PolarHBondContact O-N 2.9Å; M287-I289 HydrophobicContact SD-CD1 4.23Å; M287-L322 HydrophobicContact CE-CD2 3.79Å; M287-V326 HydrophobicContact CE-CG1 3.86Å; M287-V326 WeakPolarHBondContact CE-O 3.47Å; M287-V353 WeakPolarHBondContact O-CG1 3.4Å; M287-V353 WeakPolarHBondContact O-CG2 3.28Å; M287-Y384 HydrophobicContact CE-CD1 4.25Å; M287-Y384 HydrophobicContact CE-CG 4.16Å; M287-Y384 HydrophobicContact SD-CD1 3.98Å; M287-Y384 HydrophobicContact SD-CE1 4.12Å; M287-Y384 HydrophobicContact SD-CG 4.22Å; M287-F447 WeakPolarHBondContact O-CE2 3.19Å; M287-F447 WeakPolarHBondContact O-CZ 3.26Å
288	G	95.2	Very high	93.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	67	26.7	177.7	0	0	0	0	0	115.3	S284 L285 M345 G349	S284-G288 PolarHBondContact O-N 3.22Å; L285-G288 PolarHBondContact O-N 3.07Å; G288-M345 VanDerWaalsContact CA-SD 3.59Å; G288-G349 CarbonylContact O-C 3.32Å; G288-G349 WeakPolarHBondContact O-CA 3.45Å; G288-G349 PolarHBondContact O-N 3.44Å
289	I	95.6	Very high	93.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.4	-172.8	59.1	179.9	0	0	0	113.8	A273 A283 S284 M287 L291 N350 V353 Y384	A273-I289 HydrophobicContact CB-CB 3.84Å; A273-I289 HydrophobicContact CB-CD1 4.29Å; A273-I289 HydrophobicContact CB-CG2 4.04Å; A283-I289 CarbonylContact C-O 3.53Å; A283-I289 WeakPolarHBondContact CA-O 3.41Å; A283-I289 WeakPolarHBondContact CB-O 3.47Å; S284-I289 PolarHBondContact N-O 3.31Å; S284-I289 PolarHBondContact O-N 3.18Å; M287-I289 VanDerWaalsContact C-N 3.34Å; M287-I289 HydrophobicContact CB-CD1 4.05Å; M287-I289 HydrophobicContact CB-CG1 3.93Å; M287-I289 PolarHBondContact O-N 2.9Å; M287-I289 HydrophobicContact SD-CD1 4.23Å; I289-L291 HydrophobicContact CD1-CD1 4.41Å; I289-L291 HydrophobicContact CD1-CD2 3.96Å; I289-L291 HydrophobicContact CD1-CG 4.35Å; I289-L291 HydrophobicContact CG1-CD2 4.39Å; I289-L291 HydrophobicContact CG1-CG 4.35Å; I289-N350 WeakPolarHBondContact CA-OD1 3.28Å; I289-N350 WeakPolarHBondContact CB-OD1 3.4Å; I289-V353 HydrophobicContact CG2-CB 3.68Å; I289-V353 HydrophobicContact CG2-CG1 3.45Å; I289-V353 VanDerWaalsContact CG2-CG1 3.45Å; I289-V353 HydrophobicContact CG2-CG2 4.11Å; I289-Y384 HydrophobicContact CD1-CE1 4.37Å; I289-Y384 WeakPolarHBondContact CD1-OH 3.15Å
290	T	96.9	Very high	93.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.3	169.7	67.6	0	0	0	0	112	V263 N269 A273 P280 W282 I332 M345 N350	V263-T290 HydrophobicContact CG1-CG2 4.36Å; N269-T290 HydrophobicContact CB-CG2 4.05Å; N269-T290 PolarHBondContact O-OG1 2.94Å; A273-T290 WeakPolarHBondContact CB-O 3.29Å; A273-T290 PolarHBondContact N-O 3.24Å; P280-T290 WeakPolarHBondContact CG-OG1 3.42Å; W282-T290 CarbonylContact O-C 3.07Å; W282-T290 VanDerWaalsContact O-CA 3.29Å; W282-T290 WeakPolarHBondContact O-CA 3.33Å; T290-I332 HydrophobicContact CG2-CD1 3.99Å; T290-M345 HydrophobicContact CG2-CE 4.13Å; T290-N350 PolarHBondContact N-OD1 3.45Å; T290-N350 PolarHBondContact O-ND2 2.76Å; T290-N350 PolarHBondContact OG1-ND2 2.9Å
291	L	95.3	Very high	92.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.2	-167.2	-61.5	172.2	0	0	0	111.4	A273 E274 P280 K281 W282 I289 C295 H299	A273-L291 HydrophobicContact CB-CD2 4.22Å; E274-L291 HydrophobicContact CG-CD2 3.65Å; P280-L291 WeakPolarHBondContact CA-O 3.35Å; P280-L291 WeakPolarHBondContact CB-O 3.43Å; K281-L291 PolarHBondContact N-O 3.03Å; W282-L291 HydrophobicContact CB-CB 4.33Å; W282-L291 WeakPolarHBondContact CB-O 3.5Å; W282-L291 PolarHBondContact N-O 2.93Å; W282-L291 VanDerWaalsContact N-O 3.1Å; W282-L291 PolarHBondContact O-N 3.15Å; I289-L291 HydrophobicContact CD1-CD1 4.41Å; I289-L291 HydrophobicContact CD1-CD2 3.96Å; I289-L291 HydrophobicContact CD1-CG 4.35Å; I289-L291 HydrophobicContact CG1-CD2 4.39Å; I289-L291 HydrophobicContact CG1-CG 4.35Å; L291-C295 HydrophobicContact CD2-CB 4.29Å; L291-H299 HydrophobicContact CD1-CB 4.34Å; L291-H299 VanDerWaalsContact CD1-CD2 3.49Å; L291-H299 WeakPolarHBondContact CD1-CD2 3.2Å
292	C	95.1	Very high	90.8	Very high	15 Å²	15	28.3 Å²	28.3	10%	0.101	14%	0.144	C	C	.	.			trans	-73.4	162.7	164	72.5	0	0	0	0	110.4	C272 C275 E294 C295 S296	C272-C292 HydrophobicContact CB-CB 4.1Å; C272-C292 PolarHBondContact SG-N 3.23Å; C275-C292 VanDerWaalsContact SG-SG 3.69Å; C292-E294 VanDerWaalsContact C-N 3.26Å; C292-E294 PolarHBondContact O-N 3.11Å; C292-C295 PolarHBondContact O-N 3.31Å; C292-C295 PolarHBondContact SG-N 2.99Å; C292-C295 VanDerWaalsContact SG-SG 3.66Å; C292-S296 WeakPolarHBondContact O-CB 3.41Å; C292-S296 PolarHBondContact O-N 3.38Å
293	I	92.6	Very high	88.7	Confident	114 Å²	114	28.8 Å²	28.8	59%	0.585	15%	0.15	S	C	*	.	H	α-helix	trans	-55.4	-40.5	-177.6	-170.3	167.9	0	0	0	112.6	W282 S296 G297	W282-I293 HydrophobicContact CZ2-CD1 4.49Å; W282-I293 HydrophobicContact CZ2-CG1 4.4Å; I293-S296 PolarHBondContact O-N 3Å; I293-S296 PolarHBondContact O-OG 2.83Å; I293-G297 PolarHBondContact O-N 3.4Å
294	E	91.6	Very high	86.5	Confident	113 Å²	113	38.2 Å²	38.2	53%	0.528	19%	0.191	S	C	.	.	H	α-helix	trans	-67	-47.8	-179.3	-62.8	177.4	158.9	0	0	112.5	C292 S296 G297 I298 R376	C292-E294 VanDerWaalsContact C-N 3.26Å; C292-E294 PolarHBondContact O-N 3.11Å; E294-S296 VanDerWaalsContact C-N 3.31Å; E294-S296 PolarHBondContact O-N 3.24Å; E294-G297 PolarHBondContact O-N 2.77Å; E294-I298 PolarHBondContact O-N 3.3Å; E294-R376 IonicContact OE2-CZ 2.7Å; E294-R376 IonicContact OE2-NH1 2.88Å; E294-R376 PolarHBondContact OE2-NH1 3.14Å; E294-R376 IonicContact OE2-NH2 3.79Å; E294-R376 PolarHBondContact OE2-NH2 3.07Å
295	C	93.4	Very high	84.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67	-35.3	177.1	-71.5	0	0	0	0	111.4	E274 L291 C292 G297 I298 H299	E274-C295 HydrophobicContact CB-CB 4.34Å; E274-C295 HydrophobicContact CG-CB 4.06Å; L291-C295 HydrophobicContact CD2-CB 4.29Å; C292-C295 PolarHBondContact O-N 3.31Å; C292-C295 PolarHBondContact SG-N 2.99Å; C292-C295 VanDerWaalsContact SG-SG 3.66Å; C295-G297 VanDerWaalsContact C-N 3.26Å; C295-G297 PolarHBondContact O-N 2.75Å; C295-I298 PolarHBondContact O-N 3.38Å; C295-I298 VanDerWaalsContact O-N 3.13Å; C295-H299 PolarHBondContact O-CD2 3.21Å; C295-H299 PolarHBondContact O-N 3.4Å
296	S	92.7	Very high	82	Confident	4 Å²	4	54.8 Å²	54.8	3%	0.028	27%	0.269	C	S	.	.	H	α-helix	trans	-59	-38.8	172.6	90.9	0	0	0	0	111.7	C292 I293 E294 I298 H299 R300	C292-S296 WeakPolarHBondContact O-CB 3.41Å; C292-S296 PolarHBondContact O-N 3.38Å; I293-S296 PolarHBondContact O-N 3Å; I293-S296 PolarHBondContact O-OG 2.83Å; E294-S296 VanDerWaalsContact C-N 3.31Å; E294-S296 PolarHBondContact O-N 3.24Å; S296-I298 VanDerWaalsContact C-N 3.33Å; S296-I298 PolarHBondContact O-N 3.24Å; S296-H299 PolarHBondContact O-N 3.45Å; S296-R300 WeakPolarHBondContact O-CG 3.29Å; S296-R300 PolarHBondContact O-N 2.78Å
297	G	89.3	Confident	79.5	Confident	35 Å²	35	58.8 Å²	58.8	36%	0.361	30%	0.304	S	S	.	.	H	α-helix	trans	-67.2	-31.4	175.8	0	0	0	0	0	113.4	I293 E294 C295 C301	I293-G297 PolarHBondContact O-N 3.4Å; E294-G297 PolarHBondContact O-N 2.77Å; C295-G297 VanDerWaalsContact C-N 3.26Å; C295-G297 PolarHBondContact O-N 2.75Å; G297-C301 WeakPolarHBondContact O-CB 3.22Å; G297-C301 PolarHBondContact O-N 2.93Å
298	I	87.4	Confident	76.8	Confident	6 Å²	6	65.6 Å²	65.6	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-72	-43.2	173.5	-62.6	171.7	0	0	0	110.8	E294 C295 S296 R300 C301 R373 R376 E377 I380	E294-I298 PolarHBondContact O-N 3.3Å; C295-I298 PolarHBondContact O-N 3.38Å; C295-I298 VanDerWaalsContact O-N 3.13Å; S296-I298 VanDerWaalsContact C-N 3.33Å; S296-I298 PolarHBondContact O-N 3.24Å; I298-R300 VanDerWaalsContact C-N 3.27Å; I298-R300 PolarHBondContact O-N 2.79Å; I298-C301 VanDerWaalsContact O-CB 3.26Å; I298-C301 WeakPolarHBondContact O-CB 3.33Å; I298-C301 PolarHBondContact O-N 3.03Å; I298-R373 HydrophobicContact CD1-CG 4.07Å; I298-R373 HydrophobicContact CG1-CG 4.13Å; I298-R376 HydrophobicContact CD1-CB 3.4Å; I298-R376 HydrophobicContact CD1-CG 4.37Å; I298-E377 HydrophobicContact CG2-CB 3.92Å; I298-E377 HydrophobicContact CG2-CG 3.99Å; I298-I380 HydrophobicContact CB-CD1 4.17Å; I298-I380 HydrophobicContact CD1-CD1 4.25Å; I298-I380 HydrophobicContact CG2-CD1 3.84Å
299	H	89.8	Confident	74.2	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-58.8	-37.3	175.3	-89.6	-88.3	0	0	0	112.4	E274 L291 C295 S296 C301 L322 S327 V329 Y384	E274-H299 IonicContact OE1-CE1 2.65Å; E274-H299 IonicContact OE1-NE2 3.94Å; E274-H299 PolarHBondContact OE1-NE2 3.21Å; L291-H299 HydrophobicContact CD1-CB 4.34Å; L291-H299 VanDerWaalsContact CD1-CD2 3.49Å; L291-H299 WeakPolarHBondContact CD1-CD2 3.2Å; C295-H299 PolarHBondContact O-CD2 3.21Å; C295-H299 PolarHBondContact O-N 3.4Å; S296-H299 PolarHBondContact O-N 3.45Å; H299-C301 VanDerWaalsContact C-N 3.32Å; H299-L322 WeakPolarHBondContact O-CB 3.3Å; H299-S327 WeakPolarHBondContact CB-OG 3.31Å; H299-S327 WeakPolarHBondContact ND1-CB 3.39Å; H299-S327 PolarHBondContact ND1-OG 3.05Å; H299-V329 HydrophobicContact CB-CG2 3.75Å; H299-Y384 AromaticContact CE1-CD2 3.89Å; H299-Y384 AromaticContact CE1-CE2 3.57Å; H299-Y384 AromaticContact NE2-CE2 3.81Å
300	R	85.3	Confident	71.7	Confident	81 Å²	81	86.3 Å²	86.3	31%	0.306	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.4	174.3	-65.6	174.9	-171	-83.9	2.4	114.3	S296 I298 E302 V329	S296-R300 WeakPolarHBondContact O-CG 3.29Å; S296-R300 PolarHBondContact O-N 2.78Å; I298-R300 VanDerWaalsContact C-N 3.27Å; I298-R300 PolarHBondContact O-N 2.79Å; R300-E302 PolarHBondContact O-N 3.25Å; R300-V329 HydrophobicContact CG-CB 3.98Å; R300-V329 HydrophobicContact CG-CG2 3.99Å; R300-V329 VanDerWaalsContact CZ-CB 3.49Å; R300-V329 PolarHBondContact NH1-O 2.8Å; R300-V329 VanDerWaalsContact NH2-C 3.3Å; R300-V329 PolarHBondContact NH2-O 3.47Å
301	C	76.2	Confident	68.9	Low	32 Å²	32	89.6 Å²	89.6	22%	0.216	46%	0.46	C	S	.	.			trans	-73.7	116.6	-170.4	-172.4	0	0	0	0	111.1	G297 I298 H299 G323 R373	G297-C301 WeakPolarHBondContact O-CB 3.22Å; G297-C301 PolarHBondContact O-N 2.93Å; I298-C301 VanDerWaalsContact O-CB 3.26Å; I298-C301 WeakPolarHBondContact O-CB 3.33Å; I298-C301 PolarHBondContact O-N 3.03Å; H299-C301 VanDerWaalsContact C-N 3.32Å; C301-G323 PolarHBondContact O-N 3.28Å; C301-R373 PolarHBondContact SG-NH2 3.45Å
302	E	59.4	Low	66.2	Low	121 Å²	121	100.8 Å²	100.8	57%	0.565	50%	0.504	S	S	*	.			trans	-82.8	110.1	163.6	-69.9	177.7	-172.6	0	0	108.5	R300 K304	R300-E302 PolarHBondContact O-N 3.25Å; E302-K304 PolarHBondContact O-N 3.22Å
303	L	52.3	Low	63.3	Low	64 Å²	64	107.5 Å²	107.5	34%	0.335	53%	0.531	S	S	.	.			trans	-66.6	119.5	164	-74.9	104.4	0	0	0	108.4	R305 S321 E377	L303-R305 PolarHBondContact O-N 3.39Å; L303-S321 VanDerWaalsContact N-CB 3.3Å; L303-E377 WeakPolarHBondContact CD1-OE1 3.41Å; L303-E377 WeakPolarHBondContact CD2-OE1 3.47Å
304	K	48.7	Very low	60.7	Low	198 Å²	198	111.2 Å²	111.2	86%	0.861	54%	0.543	S	S	*	.			trans	-59.2	121.7	155.4	-68.5	-176	176.3	-177.4	0	106.6	E302	E302-K304 PolarHBondContact O-N 3.22Å
305	R	50.2	Low	58	Low	230 Å²	230	113.4 Å²	113.4	87%	0.868	56%	0.557	S	S	*	*			trans	-44.9	127.8	169.7	-72.7	179.2	174.9	163.2	-1.4	107.5	L303 A307	L303-R305 PolarHBondContact O-N 3.39Å; R305-A307 PolarHBondContact O-N 2.96Å
306	P	45.7	Very low	55.4	Low	121 Å²	121	117.1 Å²	117.1	79%	0.786	59%	0.587	S	S	*	*			trans	-54.9	120.1	169.9	20.3	-28.3	0	0	0	107.4	L308	P306-L308 PolarHBondContact O-N 3.4Å
307	A	42.7	Very low	52.6	Low	92 Å²	92	120.1 Å²	120.1	76%	0.76	61%	0.606	S	S	*	*	S	Bend	trans	-63.9	129.1	172.4	0	0	0	0	0	107	R305	R305-A307 PolarHBondContact O-N 2.96Å
308	L	38.5	Very low	50.1	Low	151 Å²	151	125.1 Å²	125.1	79%	0.791	62%	0.624	S	S	*	*			trans	69.9	82.9	167.5	-112.5	80.1	0	0	0	116.3	P306	P306-L308 PolarHBondContact O-N 3.4Å
309	E	40.8	Very low	48.1	Very low	196 Å²	196	129.7 Å²	129.7	92%	0.916	64%	0.644	S	S	*	*			trans	-119.3	109.4	136.2	-84	-172.4	171.9	0	0	108.6
310	R	41.1	Very low	46.1	Very low	240 Å²	240	133 Å²	133	91%	0.906	67%	0.667	S	S	*	*			trans	-60.9	133.5	173.4	-78.8	170.7	163.6	167	-6.1	108.7
311	G	39.3	Very low	44.4	Very low	69 Å²	69	130.6 Å²	130.6	71%	0.711	66%	0.663	S	S	*	*	S	Bend	trans	96.4	103.6	157.4	0	0	0	0	0	115.1	F313	G311-F313 VanDerWaalsContact C-N 3.31Å; G311-F313 PolarHBondContact O-N 3.09Å
312	Y	38.2	Very low	43.4	Very low	235 Å²	235	129.3 Å²	129.3	92%	0.922	65%	0.654	S	S	*	*	S	Bend	trans	67.6	-18.4	144	-122.8	-99.8	0	0	0	121.3	K314	Y312-K314 PolarHBondContact O-N 3.01Å
313	F	34.2	Very low	43.3	Very low	155 Å²	155	123.7 Å²	123.7	68%	0.68	63%	0.628	S	S	*	*			trans	-84.3	32.8	176.4	-142.4	-98.4	0	0	0	113.9	G311 I315 A316 T317	G311-F313 VanDerWaalsContact C-N 3.31Å; G311-F313 PolarHBondContact O-N 3.09Å; F313-I315 PolarHBondContact O-N 2.8Å; F313-A316 HydrophobicContact CE1-CB 4.12Å; F313-A316 HydrophobicContact CZ-CB 4.47Å; F313-T317 HydrophobicContact CD1-CG2 4.5Å; F313-T317 HydrophobicContact CE1-CG2 4.24Å
314	K	38	Very low	43.6	Very low	192 Å²	192	123.9 Å²	123.9	84%	0.835	63%	0.632	S	S	*	*			trans	-81.5	-10.2	-169.5	-121.8	-179.8	-176.8	-179.3	0	114.9	Y312	Y312-K314 PolarHBondContact O-N 3.01Å
315	I	35.4	Very low	44.4	Very low	159 Å²	159	122.2 Å²	122.2	82%	0.815	63%	0.627	S	S	*	*	S	Bend	trans	-98.3	-28.4	-171.1	-62.4	175.2	0	0	0	113	F313	F313-I315 PolarHBondContact O-N 2.8Å
316	A	37.3	Very low	45.7	Very low	78 Å²	78	113.6 Å²	113.6	65%	0.645	60%	0.6	S	S	*	*	S	Bend	trans	-101.3	-6.7	-168.8	0	0	0	0	0	116.1	F313	F313-A316 HydrophobicContact CE1-CB 4.12Å; F313-A316 HydrophobicContact CZ-CB 4.47Å
317	T	35.7	Very low	47.7	Very low	68 Å²	68	107.9 Å²	107.9	42%	0.417	56%	0.563	S	S	.	*			trans	-131	63.3	-178.2	60.6	0	0	0	0	112	F313 F319	F313-T317 HydrophobicContact CD1-CG2 4.5Å; F313-T317 HydrophobicContact CE1-CG2 4.24Å; T317-F319 HydrophobicContact CG2-CD2 4.2Å; T317-F319 HydrophobicContact CG2-CE2 3.63Å; T317-F319 HydrophobicContact CG2-CZ 4.38Å; T317-F319 PolarHBondContact O-N 3.17Å
318	N	36.8	Very low	50.1	Low	139 Å²	139	106 Å²	106	74%	0.743	54%	0.538	S	S	*	.			trans	-62	71.7	151.8	-73.8	-26.9	0	0	0	108.7	S320	N318-S320 PolarHBondContact O-N 3.33Å
319	F	44.1	Very low	52.7	Low	102 Å²	102	98.9 Å²	98.9	45%	0.447	50%	0.5	S	S	.	.			trans	-75.2	66.3	158.1	-67.7	-73.7	0	0	0	106.8	T317 S321 K381	T317-F319 HydrophobicContact CG2-CD2 4.2Å; T317-F319 HydrophobicContact CG2-CE2 3.63Å; T317-F319 HydrophobicContact CG2-CZ 4.38Å; T317-F319 PolarHBondContact O-N 3.17Å; F319-S321 PolarHBondContact O-N 3.2Å; F319-K381 HydrophobicContact CD1-CD 4.28Å
320	S	47.4	Very low	55.2	Low	69 Å²	69	94.2 Å²	94.2	48%	0.483	47%	0.474	S	S	.	.			trans	-56	128.1	159.2	35.6	0	0	0	0	106.2	N318 L385	N318-S320 PolarHBondContact O-N 3.33Å; S320-L385 WeakPolarHBondContact O-CD1 3.5Å
321	S	50.7	Low	57.6	Low	32 Å²	32	83 Å²	83	22%	0.224	43%	0.432	C	S	.	.			trans	-57	154.5	169	43.8	0	0	0	0	109.9	L303 F319	L303-S321 VanDerWaalsContact N-CB 3.3Å; F319-S321 PolarHBondContact O-N 3.2Å
322	L	54.5	Low	59.9	Low	5 Å²	5	79.7 Å²	79.7	3%	0.026	40%	0.398	C	S	.	.			trans	-63.9	-54.7	163.3	-76.7	102	0	0	0	107.9	M287 H299 V326 I380 K381 Y384 L385	M287-L322 HydrophobicContact CE-CD2 3.79Å; H299-L322 WeakPolarHBondContact O-CB 3.3Å; L322-V326 HydrophobicContact CB-CB 4.17Å; L322-V326 HydrophobicContact CB-CG1 4.48Å; L322-V326 HydrophobicContact CD2-CG1 4.26Å; L322-V326 HydrophobicContact CG-CG1 4.34Å; L322-V326 WeakPolarHBondContact O-CB 3.48Å; L322-V326 WeakPolarHBondContact O-CG2 3.47Å; L322-V326 PolarHBondContact O-N 2.95Å; L322-I380 HydrophobicContact CD1-CG2 3.96Å; L322-I380 HydrophobicContact CD2-CG2 4.32Å; L322-K381 HydrophobicContact CD1-CG 4.04Å; L322-Y384 HydrophobicContact CD2-CD2 4.48Å; L322-L385 HydrophobicContact CD1-CD1 4.02Å; L322-L385 HydrophobicContact CD1-CG 4.22Å; L322-L385 HydrophobicContact CG-CD1 4.32Å; L322-L385 HydrophobicContact CG-CD2 4.17Å; L322-L385 HydrophobicContact CG-CG 4.22Å
323	G	57.7	Low	62	Low	2 Å²	2	71.6 Å²	71.6	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	54.2	-177.4	-178.7	0	0	0	0	0	113.2	C301 Q325 V326 S327	C301-G323 PolarHBondContact O-N 3.28Å; G323-Q325 PolarHBondContact O-N 3.02Å; G323-V326 PolarHBondContact O-N 3.25Å; G323-S327 PolarHBondContact O-N 3.01Å
324	V	58.5	Low	64.3	Low	68 Å²	68	70.8 Å²	70.8	41%	0.412	38%	0.376	S	S	.	.	H	α-helix	trans	-68.9	-22	-179.3	-175.4	0	0	0	0	111.7
325	Q	65	Low	66.5	Low	163 Å²	163	64.5 Å²	64.5	76%	0.762	35%	0.351	S	S	*	.	H	α-helix	trans	-76.5	-32.4	-178.6	-59.8	-60.9	-22.1	0	0	113.1	G323	G323-Q325 PolarHBondContact O-N 3.02Å
326	V	78.3	Confident	68.8	Low	50 Å²	50	62.5 Å²	62.5	30%	0.303	35%	0.346	S	S	.	.	H	α-helix	trans	-91.9	-35.4	178.8	-176.5	0	0	0	0	111.7	N286 M287 L322 G323 L385	N286-V326 PolarHBondContact ND2-O 3.41Å; M287-V326 HydrophobicContact CE-CG1 3.86Å; M287-V326 WeakPolarHBondContact CE-O 3.47Å; L322-V326 HydrophobicContact CB-CB 4.17Å; L322-V326 HydrophobicContact CB-CG1 4.48Å; L322-V326 HydrophobicContact CD2-CG1 4.26Å; L322-V326 HydrophobicContact CG-CG1 4.34Å; L322-V326 WeakPolarHBondContact O-CB 3.48Å; L322-V326 WeakPolarHBondContact O-CG2 3.47Å; L322-V326 PolarHBondContact O-N 2.95Å; G323-V326 PolarHBondContact O-N 3.25Å; V326-L385 HydrophobicContact CG1-CD2 4.15Å
327	S	88.7	Confident	71.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.318	C	S	.	.			trans	-123.5	108.4	-179.3	-165.5	0	0	0	0	111.4	S284 H299 G323 V329	S284-S327 WeakPolarHBondContact CB-OG 3.36Å; S284-S327 PolarHBondContact OG-OG 3.08Å; H299-S327 WeakPolarHBondContact CB-OG 3.31Å; H299-S327 WeakPolarHBondContact ND1-CB 3.39Å; H299-S327 PolarHBondContact ND1-OG 3.05Å; G323-S327 PolarHBondContact O-N 3.01Å; S327-V329 VanDerWaalsContact C-N 3.32Å; S327-V329 PolarHBondContact O-N 2.57Å
328	K	91.7	Very high	73.6	Confident	53 Å²	53	60.3 Å²	60.3	23%	0.23	32%	0.317	C	S	.	.			trans	-84.4	74.7	-177.8	-64.8	-174.3	177.6	170.5	0	110.1	L285 N286 L482 L483	L285-K328 PolarHBondContact N-O 3.33Å; N286-K328 HydrophobicContact CB-CB 4.34Å; N286-K328 HydrophobicContact CB-CD 4.18Å; N286-K328 HydrophobicContact CB-CG 4.28Å; N286-K328 WeakPolarHBondContact OD1-CB 3.34Å; N286-K328 PolarHBondContact OD1-N 3.31Å; K328-L482 PolarHBondContact NZ-O 3.09Å; K328-L483 HydrophobicContact CD-CD2 3.81Å; K328-L483 WeakPolarHBondContact CD-O 3.45Å; K328-L483 WeakPolarHBondContact CE-O 3.33Å; K328-L483 VanDerWaalsContact NZ-C 3.28Å; K328-L483 PolarHBondContact NZ-O 3.35Å
329	V	94.1	Very high	76	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	132.4	-175.1	-174.7	0	0	0	0	111.9	W282 A283 H299 R300 S327	W282-V329 HydrophobicContact CB-CG1 4.41Å; W282-V329 HydrophobicContact CE3-CG1 4.01Å; A283-V329 CarbonylContact O-C 3.49Å; A283-V329 WeakPolarHBondContact O-CA 3.49Å; H299-V329 HydrophobicContact CB-CG2 3.75Å; R300-V329 HydrophobicContact CG-CB 3.98Å; R300-V329 HydrophobicContact CG-CG2 3.99Å; R300-V329 VanDerWaalsContact CZ-CB 3.49Å; R300-V329 PolarHBondContact NH1-O 2.8Å; R300-V329 VanDerWaalsContact NH2-C 3.3Å; R300-V329 PolarHBondContact NH2-O 3.47Å; S327-V329 VanDerWaalsContact C-N 3.32Å; S327-V329 PolarHBondContact O-N 2.57Å
330	R	93.6	Very high	78.2	Confident	99 Å²	99	54 Å²	54	37%	0.374	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	151.8	174.7	-65	-63.4	179.8	-84.2	0.8	111.3	W282 A283 L285 D335 W337	W282-R330 CarbonylContact C-O 3.57Å; W282-R330 WeakPolarHBondContact CA-O 3.23Å; A283-R330 PolarHBondContact N-O 3.37Å; A283-R330 PolarHBondContact O-N 3.46Å; L285-R330 HydrophobicContact CD1-CB 4.38Å; L285-R330 HydrophobicContact CD1-CG 3.71Å; L285-R330 HydrophobicContact CG-CB 4.42Å; L285-R330 HydrophobicContact CG-CG 4.12Å; R330-D335 VanDerWaalsContact CA-OD2 3.25Å; R330-D335 WeakPolarHBondContact CA-OD2 3.45Å; R330-D335 HydrophobicContact CB-CB 4.47Å; R330-D335 WeakPolarHBondContact CB-OD2 3.01Å; R330-D335 VanDerWaalsContact CD-OD2 3.31Å; R330-D335 WeakPolarHBondContact CD-OD2 3.21Å; R330-W337 HydrophobicContact CB-CZ2 3.98Å
331	S	91.6	Very high	80.5	Confident	3 Å²	3	52 Å²	52	2%	0.021	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	141.5	168.8	-176.9	0	0	0	0	109.7	Q260 T333 L334 D335 W337	Q260-S331 PolarHBondContact NE2-O 3.24Å; S331-T333 PolarHBondContact OG-N 2.92Å; S331-L334 WeakPolarHBondContact OG-CB 2.97Å; S331-L334 PolarHBondContact OG-N 3.49Å; S331-L334 VanDerWaalsContact OG-N 3.09Å; S331-D335 PolarHBondContact N-OD2 3.41Å; S331-W337 WeakPolarHBondContact O-CZ2 3.01Å; S331-W337 PolarHBondContact O-NE1 3.11Å
332	I	87.4	Confident	82.4	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-26.6	175.5	-61.3	172.6	0	0	0	111.1	Q260 K281 W282 A283 T290 W337	Q260-I332 HydrophobicContact CG-CG2 4.34Å; Q260-I332 WeakPolarHBondContact CG-O 3.21Å; Q260-I332 PolarHBondContact NE2-O 3.48Å; K281-I332 PolarHBondContact O-N 3.43Å; W282-I332 WeakPolarHBondContact O-CD1 3.49Å; A283-I332 HydrophobicContact CB-CD1 4.36Å; A283-I332 HydrophobicContact CB-CG1 4.1Å; T290-I332 HydrophobicContact CG2-CD1 3.99Å; I332-W337 HydrophobicContact CG1-CH2 3.86Å; I332-W337 HydrophobicContact CG1-CZ2 4.03Å
333	T	82.4	Confident	84.3	Confident	66 Å²	66	54.5 Å²	54.5	41%	0.405	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-21.1	-172.8	55.9	0	0	0	0	113.5	I261 S331	I261-T333 HydrophobicContact CG1-CG2 4.49Å; S331-T333 PolarHBondContact OG-N 2.92Å
334	L	81	Confident	86	Confident	138 Å²	138	54.4 Å²	54.4	72%	0.723	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-26	-175	-56.8	174.9	0	0	0	113.7	S331	S331-L334 WeakPolarHBondContact OG-CB 2.97Å; S331-L334 PolarHBondContact OG-N 3.49Å; S331-L334 VanDerWaalsContact OG-N 3.09Å
335	D	84.7	Confident	87.8	Confident	59 Å²	59	51.2 Å²	51.2	32%	0.316	26%	0.263	S	S	.	.	S	Bend	trans	-98.2	138.4	179.8	-62.8	-29	0	0	0	109.2	Q260 R330 S331	Q260-D335 PolarHBondContact NE2-O 2.71Å; Q260-D335 PolarHBondContact OE1-O 3.44Å; Q260-D335 VanDerWaalsContact OE1-O 3.08Å; R330-D335 VanDerWaalsContact CA-OD2 3.25Å; R330-D335 WeakPolarHBondContact CA-OD2 3.45Å; R330-D335 HydrophobicContact CB-CB 4.47Å; R330-D335 WeakPolarHBondContact CB-OD2 3.01Å; R330-D335 VanDerWaalsContact CD-OD2 3.31Å; R330-D335 WeakPolarHBondContact CD-OD2 3.21Å; S331-D335 PolarHBondContact N-OD2 3.41Å
336	V	82.8	Confident	89.1	Confident	118 Å²	118	47.4 Å²	47.4	72%	0.715	24%	0.242	S	C	*	.			trans	-80.6	125.6	168.9	-179	0	0	0	0	108.4
337	W	86.6	Confident	89.9	Confident	12 Å²	12	48 Å²	48	5%	0.045	24%	0.243	C	C	.	.			trans	-104.2	149	178	-65.3	4.8	0	0	0	111.1	Q260 A283 L285 R330 S331 I332 Q341 V342 M345	Q260-W337 HydrophobicContact CG-CD2 3.87Å; Q260-W337 HydrophobicContact CG-CE3 3.78Å; Q260-W337 HydrophobicContact CG-CG 4.27Å; Q260-W337 HydrophobicContact CG-CZ3 4.11Å; Q260-W337 VanDerWaalsContact NE2-CG 3.29Å; A283-W337 HydrophobicContact CB-CH2 3.42Å; A283-W337 VanDerWaalsContact CB-CH2 3.42Å; A283-W337 HydrophobicContact CB-CZ2 3.86Å; A283-W337 HydrophobicContact CB-CZ3 4.49Å; L285-W337 HydrophobicContact CD2-CD2 3.87Å; L285-W337 HydrophobicContact CD2-CE3 3.7Å; L285-W337 HydrophobicContact CD2-CH2 3.74Å; L285-W337 HydrophobicContact CD2-CZ2 3.88Å; L285-W337 HydrophobicContact CD2-CZ3 3.64Å; R330-W337 HydrophobicContact CB-CZ2 3.98Å; S331-W337 WeakPolarHBondContact O-CZ2 3.01Å; S331-W337 PolarHBondContact O-NE1 3.11Å; I332-W337 HydrophobicContact CG1-CH2 3.86Å; I332-W337 HydrophobicContact CG1-CZ2 4.03Å; W337-Q341 HydrophobicContact CB-CB 4.29Å; W337-V342 HydrophobicContact CB-CG2 3.99Å; W337-V342 HydrophobicContact CE3-CG2 4.18Å; W337-M345 HydrophobicContact CZ3-CG 3.9Å
338	E	88.3	Confident	90.1	Very high	88 Å²	88	48.4 Å²	48.4	41%	0.411	25%	0.245	S	C	.	.			trans	-67.2	148.3	170.9	-63.7	-59.6	155	0	0	110.3	E340 Q341 V342	E338-E340 PolarHBondContact O-N 3.03Å; E338-Q341 HydrophobicContact CB-CG 4.21Å; E338-Q341 WeakPolarHBondContact O-CB 3.38Å; E338-Q341 PolarHBondContact O-N 3.4Å; E338-V342 PolarHBondContact O-N 3.39Å
339	P	86.8	Confident	90.2	Very high	82 Å²	82	46 Å²	46	53%	0.532	24%	0.235	S	C	.	.	H	α-helix	trans	-58.1	-33.7	-178	22	-32	0	0	0	112.5	Q341 V342 Q343	P339-Q341 VanDerWaalsContact C-N 3.31Å; P339-Q341 PolarHBondContact O-N 3.46Å; P339-V342 PolarHBondContact O-N 2.83Å; P339-Q343 WeakPolarHBondContact O-CB 2.99Å; P339-Q343 PolarHBondContact O-N 3.47Å
340	E	91.2	Very high	90.2	Very high	27 Å²	27	46 Å²	46	13%	0.126	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-32	176.3	-58.8	76.7	-154.4	0	0	112.4	E338 Q343 L344 A475 E479 F513 R517	E338-E340 PolarHBondContact O-N 3.03Å; E340-Q343 PolarHBondContact O-N 2.96Å; E340-L344 VanDerWaalsContact O-CB 3.23Å; E340-L344 WeakPolarHBondContact O-CB 3.43Å; E340-L344 PolarHBondContact O-N 2.81Å; E340-A475 HydrophobicContact CG-CB 3.95Å; E340-E479 HydrophobicContact CB-CB 4.04Å; E340-E479 HydrophobicContact CB-CG 4.09Å; E340-F513 HydrophobicContact CB-CE2 4.14Å; E340-F513 HydrophobicContact CG-CD2 3.81Å; E340-F513 HydrophobicContact CG-CE2 3.7Å; E340-R517 IonicContact OE2-NH2 3.45Å; E340-R517 PolarHBondContact OE2-NH2 3.17Å
341	Q	94.4	Very high	90.1	Very high	27 Å²	27	47.8 Å²	47.8	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-70.5	-41.4	176.4	-66.7	170	-11.6	0	0	110.9	L285 W337 E338 P339 L344 M345 E479	L285-Q341 HydrophobicContact CD1-CB 4.34Å; L285-Q341 HydrophobicContact CD1-CG 4.2Å; L285-Q341 HydrophobicContact CD2-CB 4.49Å; W337-Q341 HydrophobicContact CB-CB 4.29Å; E338-Q341 HydrophobicContact CB-CG 4.21Å; E338-Q341 WeakPolarHBondContact O-CB 3.38Å; E338-Q341 PolarHBondContact O-N 3.4Å; P339-Q341 VanDerWaalsContact C-N 3.31Å; P339-Q341 PolarHBondContact O-N 3.46Å; Q341-L344 PolarHBondContact O-N 2.95Å; Q341-M345 VanDerWaalsContact O-CG 3.29Å; Q341-M345 WeakPolarHBondContact O-CG 3.41Å; Q341-M345 PolarHBondContact O-N 3.03Å; Q341-E479 HydrophobicContact CG-CG 4.08Å; Q341-E479 WeakPolarHBondContact CG-OE1 3.36Å; Q341-E479 PolarHBondContact NE2-OE1 3.37Å
342	V	92.3	Very high	90.2	Very high	13 Å²	13	49.9 Å²	49.9	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-47	174	178.2	0	0	0	0	109.8	D259 Q260 V263 W337 E338 P339 M345 R346	D259-V342 HydrophobicContact CB-CG1 4.48Å; Q260-V342 HydrophobicContact CB-CG2 4.21Å; Q260-V342 HydrophobicContact CG-CG2 4.49Å; V263-V342 HydrophobicContact CG2-CG1 4.09Å; W337-V342 HydrophobicContact CB-CG2 3.99Å; W337-V342 HydrophobicContact CE3-CG2 4.18Å; E338-V342 PolarHBondContact O-N 3.39Å; P339-V342 PolarHBondContact O-N 2.83Å; V342-M345 PolarHBondContact O-N 2.7Å; V342-R346 WeakPolarHBondContact O-CG 3.45Å; V342-R346 PolarHBondContact O-N 2.94Å
343	Q	92.3	Very high	90.5	Very high	75 Å²	75	49.9 Å²	49.9	35%	0.35	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-39.4	179.8	-174.2	59.4	16.9	0	0	112.7	P339 E340 M345 R346 L347 I476	P339-Q343 WeakPolarHBondContact O-CB 2.99Å; P339-Q343 PolarHBondContact O-N 3.47Å; E340-Q343 PolarHBondContact O-N 2.96Å; Q343-M345 VanDerWaalsContact C-N 3.31Å; Q343-M345 PolarHBondContact O-N 3.33Å; Q343-R346 WeakPolarHBondContact O-CB 3.37Å; Q343-R346 PolarHBondContact O-N 3.28Å; Q343-R346 VanDerWaalsContact O-N 3.11Å; Q343-L347 HydrophobicContact CG-CD1 4.48Å; Q343-L347 WeakPolarHBondContact O-CG 3.31Å; Q343-L347 PolarHBondContact O-N 3.01Å; Q343-I476 HydrophobicContact CB-CD1 4.32Å; Q343-I476 HydrophobicContact CB-CG1 4.3Å; Q343-I476 HydrophobicContact CG-CD1 3.42Å; Q343-I476 VanDerWaalsContact CG-CD1 3.42Å; Q343-I476 HydrophobicContact CG-CG1 3.93Å
344	L	95.1	Very high	91	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-44.3	173.2	178.8	60.5	0	0	0	111.4	E340 Q341 R346 L347 L348 I443 I476 E479 L480 L483	E340-L344 VanDerWaalsContact O-CB 3.23Å; E340-L344 WeakPolarHBondContact O-CB 3.43Å; E340-L344 PolarHBondContact O-N 2.81Å; Q341-L344 PolarHBondContact O-N 2.95Å; L344-R346 VanDerWaalsContact C-N 3.27Å; L344-R346 PolarHBondContact O-N 3.32Å; L344-L347 PolarHBondContact O-N 3.29Å; L344-L348 HydrophobicContact CD1-CD1 3.84Å; L344-L348 HydrophobicContact CD1-CG 4.31Å; L344-L348 HydrophobicContact CG-CD1 4.17Å; L344-L348 PolarHBondContact O-N 3.42Å; L344-I443 HydrophobicContact CD1-CG2 3.64Å; L344-I476 HydrophobicContact CB-CG2 4.17Å; L344-I476 HydrophobicContact CD1-CG2 4.25Å; L344-E479 HydrophobicContact CD2-CG 4.36Å; L344-L480 HydrophobicContact CD1-CB 3.83Å; L344-L480 HydrophobicContact CD1-CD1 4.22Å; L344-L480 HydrophobicContact CD1-CD2 4.45Å; L344-L480 HydrophobicContact CD1-CG 4.38Å; L344-L480 HydrophobicContact CD2-CB 4.05Å; L344-L480 HydrophobicContact CD2-CD1 4.2Å; L344-L483 HydrophobicContact CD2-CD1 3.58Å
345	M	95	Very high	91.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.5	-30.3	176.1	-72.3	-65.4	-58	0	0	112.8	V263 L266 A283 L285 G288 T290 W337 Q341 V342 Q343 L348 G349	V263-M345 HydrophobicContact CG1-CB 3.75Å; V263-M345 HydrophobicContact CG1-CE 3.95Å; V263-M345 HydrophobicContact CG2-CB 4.03Å; L266-M345 VanDerWaalsContact CD1-O 3.23Å; L266-M345 WeakPolarHBondContact CD1-O 3.48Å; A283-M345 HydrophobicContact CB-CE 3.96Å; L285-M345 HydrophobicContact CD2-CG 3.99Å; L285-M345 HydrophobicContact CD2-SD 4.25Å; G288-M345 VanDerWaalsContact CA-SD 3.59Å; T290-M345 HydrophobicContact CG2-CE 4.13Å; W337-M345 HydrophobicContact CZ3-CG 3.9Å; Q341-M345 VanDerWaalsContact O-CG 3.29Å; Q341-M345 WeakPolarHBondContact O-CG 3.41Å; Q341-M345 PolarHBondContact O-N 3.03Å; V342-M345 PolarHBondContact O-N 2.7Å; Q343-M345 VanDerWaalsContact C-N 3.31Å; Q343-M345 PolarHBondContact O-N 3.33Å; M345-L348 CarbonylContact O-C 3.57Å; M345-G349 PolarHBondContact O-N 2.99Å
346	R	93.1	Very high	91.8	Very high	84 Å²	84	44.5 Å²	44.5	32%	0.317	22%	0.222	S	C	.	.	H	α-helix	trans	-70.4	-35.9	173.4	-69.4	175	-171.7	-115.9	18	113.6	D259 S262 V263 L266 V342 Q343 L344 L348	D259-R346 PolarHBondContact O-NH2 2.97Å; D259-R346 IonicContact OD1-NH2 2.94Å; D259-R346 PolarHBondContact OD1-NH2 2.87Å; S262-R346 PolarHBondContact OG-NH1 3.34Å; S262-R346 VanDerWaalsContact OG-NH1 3.12Å; S262-R346 PolarHBondContact OG-NH2 3.18Å; V263-R346 HydrophobicContact CG2-CG 4.44Å; L266-R346 HydrophobicContact CD1-CB 4.44Å; L266-R346 HydrophobicContact CD1-CG 4.36Å; V342-R346 WeakPolarHBondContact O-CG 3.45Å; V342-R346 PolarHBondContact O-N 2.94Å; Q343-R346 WeakPolarHBondContact O-CB 3.37Å; Q343-R346 PolarHBondContact O-N 3.28Å; Q343-R346 VanDerWaalsContact O-N 3.11Å; L344-R346 VanDerWaalsContact C-N 3.27Å; L344-R346 PolarHBondContact O-N 3.32Å; R346-L348 VanDerWaalsContact C-N 3.35Å
347	L	94.2	Very high	92.1	Very high	63 Å²	63	39.7 Å²	39.7	33%	0.33	19%	0.191	S	C	.	.	H	α-helix	trans	-78.8	-20.4	177.4	-66.4	174	0	0	0	113.1	Q343 L344 I352 I443 I476	Q343-L347 HydrophobicContact CG-CD1 4.48Å; Q343-L347 WeakPolarHBondContact O-CG 3.31Å; Q343-L347 PolarHBondContact O-N 3.01Å; L344-L347 PolarHBondContact O-N 3.29Å; L347-I352 WeakPolarHBondContact O-CD1 3.41Å; L347-I443 HydrophobicContact CB-CB 4.44Å; L347-I443 HydrophobicContact CB-CG2 4.2Å; L347-I443 HydrophobicContact CD1-CB 4.32Å; L347-I443 HydrophobicContact CD1-CG1 3.78Å; L347-I476 HydrophobicContact CD1-CD1 4.41Å; L347-I476 HydrophobicContact CD1-CG2 3.87Å
348	L	94.7	Very high	92	Very high	7 Å²	7	41 Å²	41	4%	0.037	20%	0.2	C	C	.	.	S	Bend	trans	-104.2	-118.3	175.6	-64.1	176.5	0	0	0	110.9	L344 M345 R346 I352 V353 I443 F447 L480	L344-L348 HydrophobicContact CD1-CD1 3.84Å; L344-L348 HydrophobicContact CD1-CG 4.31Å; L344-L348 HydrophobicContact CG-CD1 4.17Å; L344-L348 PolarHBondContact O-N 3.42Å; M345-L348 CarbonylContact O-C 3.57Å; R346-L348 VanDerWaalsContact C-N 3.35Å; L348-I352 WeakPolarHBondContact O-CD1 3.35Å; L348-V353 HydrophobicContact CB-CG2 4.24Å; L348-I443 HydrophobicContact CD2-CG2 4.19Å; L348-I443 HydrophobicContact CG-CG2 4.26Å; L348-F447 HydrophobicContact CD1-CD2 3.6Å; L348-F447 HydrophobicContact CD1-CE2 4.08Å; L348-F447 HydrophobicContact CD1-CG 4.24Å; L348-F447 HydrophobicContact CD2-CB 3.86Å; L348-F447 HydrophobicContact CD2-CD2 4.2Å; L348-F447 HydrophobicContact CD2-CG 3.99Å; L348-L480 HydrophobicContact CD1-CD1 4.49Å
349	G	93.1	Very high	91.2	Very high	2 Å²	2	37.9 Å²	37.9	2%	0.021	19%	0.19	C	C	.	.			trans	91.9	163.4	-175.6	0	0	0	0	0	113.5	N269 G288 M345 R351 I352 V353	N269-G349 WeakPolarHBondContact OD1-CA 3.26Å; G288-G349 CarbonylContact O-C 3.32Å; G288-G349 WeakPolarHBondContact O-CA 3.45Å; G288-G349 PolarHBondContact O-N 3.44Å; M345-G349 PolarHBondContact O-N 2.99Å; G349-R351 VanDerWaalsContact C-N 3.28Å; G349-R351 PolarHBondContact O-N 3.23Å; G349-I352 PolarHBondContact O-N 2.69Å; G349-I352 VanDerWaalsContact O-N 3.13Å; G349-V353 WeakPolarHBondContact O-CG2 3.27Å; G349-V353 PolarHBondContact O-N 2.98Å
350	N	94	Very high	90.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-56.8	-38.5	-170	-69.1	-5.6	0	0	0	113.1	G268 N269 L271 A273 I289 T290 N354	G268-N350 VanDerWaalsContact O-CB 3.3Å; G268-N350 WeakPolarHBondContact O-CB 3.12Å; G268-N350 PolarHBondContact O-ND2 3.43Å; G268-N350 VanDerWaalsContact O-ND2 3.09Å; N269-N350 WeakPolarHBondContact OD1-CB 3.46Å; N269-N350 PolarHBondContact OD1-N 3.15Å; N269-N350 PolarHBondContact OD1-OD1 2.8Å; L271-N350 PolarHBondContact O-ND2 3.36Å; A273-N350 HydrophobicContact CB-CB 4.42Å; A273-N350 PolarHBondContact N-ND2 3.47Å; I289-N350 WeakPolarHBondContact CA-OD1 3.28Å; I289-N350 WeakPolarHBondContact CB-OD1 3.4Å; T290-N350 PolarHBondContact N-OD1 3.45Å; T290-N350 PolarHBondContact O-ND2 2.76Å; T290-N350 PolarHBondContact OG1-ND2 2.9Å; N350-N354 WeakPolarHBondContact O-CA 3.36Å; N350-N354 WeakPolarHBondContact O-CB 3.41Å; N350-N354 PolarHBondContact O-N 3.47Å; N350-N354 PolarHBondContact O-ND2 3.08Å; N350-N354 VanDerWaalsContact O-ND2 3.16Å
351	R	91.9	Very high	88.6	Confident	137 Å²	137	42.5 Å²	42.5	52%	0.517	22%	0.215	S	C	.	.	H	α-helix	trans	-62.3	-49.5	178.9	-179.9	179.4	68.4	170.4	0.4	111.4	P267 G349 N355	P267-R351 WeakPolarHBondContact O-CB 3.35Å; G349-R351 VanDerWaalsContact C-N 3.28Å; G349-R351 PolarHBondContact O-N 3.23Å; R351-N355 WeakPolarHBondContact O-CB 3.41Å; R351-N355 PolarHBondContact O-N 2.92Å; R351-N355 PolarHBondContact O-ND2 3.04Å; R351-N355 PolarHBondContact O-OD1 2.79Å
352	I	93.5	Very high	86.7	Confident	47 Å²	47	47.3 Å²	47.3	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-66.3	-50.8	-178.7	-62.3	-178.2	0	0	0	109.3	L347 L348 G349 N354 N355 I356 P444	L347-I352 WeakPolarHBondContact O-CD1 3.41Å; L348-I352 WeakPolarHBondContact O-CD1 3.35Å; G349-I352 PolarHBondContact O-N 2.69Å; G349-I352 VanDerWaalsContact O-N 3.13Å; I352-N354 PolarHBondContact O-N 3.23Å; I352-N355 WeakPolarHBondContact O-CB 3.44Å; I352-N355 PolarHBondContact O-N 3.33Å; I352-N355 VanDerWaalsContact O-N 3.16Å; I352-I356 HydrophobicContact CG2-CD1 4.07Å; I352-I356 WeakPolarHBondContact O-CG1 3.49Å; I352-I356 PolarHBondContact O-N 3.48Å; I352-I356 VanDerWaalsContact O-N 3.07Å; I352-P444 HydrophobicContact CG2-CB 4.29Å
353	V	94.1	Very high	84.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-41.1	-176.6	176.9	0	0	0	0	112	M287 I289 L348 G349 I356 Y357 F447	M287-V353 WeakPolarHBondContact O-CG1 3.4Å; M287-V353 WeakPolarHBondContact O-CG2 3.28Å; I289-V353 HydrophobicContact CG2-CB 3.68Å; I289-V353 HydrophobicContact CG2-CG1 3.45Å; I289-V353 VanDerWaalsContact CG2-CG1 3.45Å; I289-V353 HydrophobicContact CG2-CG2 4.11Å; L348-V353 HydrophobicContact CB-CG2 4.24Å; G349-V353 WeakPolarHBondContact O-CG2 3.27Å; G349-V353 PolarHBondContact O-N 2.98Å; V353-I356 WeakPolarHBondContact O-CB 3.47Å; V353-I356 PolarHBondContact O-N 3.19Å; V353-Y357 HydrophobicContact CG1-CD2 3.61Å; V353-Y357 HydrophobicContact CG1-CE2 3.85Å; V353-Y357 WeakPolarHBondContact O-CD2 3.36Å; V353-Y357 PolarHBondContact O-N 3.38Å; V353-F447 HydrophobicContact CB-CE1 4.32Å; V353-F447 HydrophobicContact CG1-CE1 3.79Å; V353-F447 HydrophobicContact CG1-CZ 3.85Å; V353-F447 HydrophobicContact CG2-CD1 4.47Å; V353-F447 HydrophobicContact CG2-CE1 3.93Å; V353-F447 HydrophobicContact CG2-CZ 3.95Å
354	N	91.6	Very high	83.2	Confident	37 Å²	37	60.5 Å²	60.5	20%	0.198	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-40.7	174.6	-71.9	-27	0	0	0	111.2	N350 I352 I356 Y357 T358 K383	N350-N354 WeakPolarHBondContact O-CA 3.36Å; N350-N354 WeakPolarHBondContact O-CB 3.41Å; N350-N354 PolarHBondContact O-N 3.47Å; N350-N354 PolarHBondContact O-ND2 3.08Å; N350-N354 VanDerWaalsContact O-ND2 3.16Å; I352-N354 PolarHBondContact O-N 3.23Å; N354-I356 PolarHBondContact O-N 3.17Å; N354-Y357 PolarHBondContact O-N 2.87Å; N354-T358 WeakPolarHBondContact O-CA 3.43Å; N354-T358 PolarHBondContact O-N 3.29Å; N354-T358 PolarHBondContact O-OG1 3.27Å; N354-K383 WeakPolarHBondContact OD1-CE 2.95Å; N354-K383 PolarHBondContact OD1-NZ 2.88Å
355	N	91.1	Very high	81.8	Confident	93 Å²	93	68.3 Å²	68.3	50%	0.497	31%	0.312	S	S	.	.	H	α-helix	trans	-59.7	-30.1	175.6	-74.2	-15.2	0	0	0	112.5	R351 I352 A359	R351-N355 WeakPolarHBondContact O-CB 3.41Å; R351-N355 PolarHBondContact O-N 2.92Å; R351-N355 PolarHBondContact O-ND2 3.04Å; R351-N355 PolarHBondContact O-OD1 2.79Å; I352-N355 WeakPolarHBondContact O-CB 3.44Å; I352-N355 PolarHBondContact O-N 3.33Å; I352-N355 VanDerWaalsContact O-N 3.16Å; N355-A359 WeakPolarHBondContact O-CA 3.32Å; N355-A359 WeakPolarHBondContact O-CB 3.15Å; N355-A359 PolarHBondContact O-N 3.46Å
356	I	91.6	Very high	80.9	Confident	21 Å²	21	71 Å²	71	11%	0.108	33%	0.327	C	S	.	.	H	α-helix	trans	-73.8	-53.1	174.2	-66.5	166	0	0	0	110.3	I352 V353 N354 M390 F447 T448 A451	I352-I356 HydrophobicContact CG2-CD1 4.07Å; I352-I356 WeakPolarHBondContact O-CG1 3.49Å; I352-I356 PolarHBondContact O-N 3.48Å; I352-I356 VanDerWaalsContact O-N 3.07Å; V353-I356 WeakPolarHBondContact O-CB 3.47Å; V353-I356 PolarHBondContact O-N 3.19Å; N354-I356 PolarHBondContact O-N 3.17Å; I356-M390 HydrophobicContact CG2-CE 4.07Å; I356-F447 HydrophobicContact CD1-CD1 3.68Å; I356-F447 HydrophobicContact CD1-CE1 4.35Å; I356-T448 WeakPolarHBondContact CD1-OG1 3.49Å; I356-T448 HydrophobicContact CG2-CG2 4.24Å; I356-A451 HydrophobicContact CG2-CB 3.88Å
357	Y	89.9	Confident	80.5	Confident	16 Å²	16	67.2 Å²	67.2	6%	0.063	31%	0.313	C	S	.	.	H	α-helix	trans	-74.6	-27.7	-174.2	-83	-71.8	0	0	0	114.8	V353 N354 K383 Y384 F389 M390 F447 A451	V353-Y357 HydrophobicContact CG1-CD2 3.61Å; V353-Y357 HydrophobicContact CG1-CE2 3.85Å; V353-Y357 WeakPolarHBondContact O-CD2 3.36Å; V353-Y357 PolarHBondContact O-N 3.38Å; N354-Y357 PolarHBondContact O-N 2.87Å; Y357-K383 WeakPolarHBondContact CD1-O 3.19Å; Y357-K383 HydrophobicContact CG-CG 4.35Å; Y357-Y384 HydrophobicContact CD1-CD1 4.12Å; Y357-Y384 AromaticContact CD2-CD1 3.99Å; Y357-Y384 HydrophobicContact CD2-CD1 3.99Å; Y357-Y384 AromaticContact CD2-CE1 3.72Å; Y357-Y384 HydrophobicContact CD2-CE1 3.72Å; Y357-Y384 AromaticContact CE1-CD1 3.82Å; Y357-Y384 HydrophobicContact CE1-CD1 3.82Å; Y357-Y384 AromaticContact CE2-CD1 3.65Å; Y357-Y384 HydrophobicContact CE2-CD1 3.65Å; Y357-Y384 AromaticContact CE2-CE1 3.67Å; Y357-Y384 HydrophobicContact CE2-CE1 3.67Å; Y357-Y384 HydrophobicContact CG-CD1 4.21Å; Y357-Y384 HydrophobicContact CG-CE1 4.15Å; Y357-Y384 AromaticContact CZ-CD1 3.57Å; Y357-F389 CarbonylContact O-C 3.56Å; Y357-F389 WeakPolarHBondContact O-CB 3.44Å; Y357-M390 HydrophobicContact CD1-CG 3.99Å; Y357-M390 HydrophobicContact CD1-SD 3.65Å; Y357-M390 HydrophobicContact CE1-SD 3.79Å; Y357-M390 PolarHBondContact O-N 2.94Å; Y357-F447 HydrophobicContact CD2-CE1 4.47Å; Y357-F447 AromaticContact CE2-CE1 3.79Å; Y357-F447 HydrophobicContact CE2-CE1 3.79Å; Y357-F447 HydrophobicContact CE2-CZ 4.01Å; Y357-A451 HydrophobicContact CE1-CB 4Å; Y357-A451 HydrophobicContact CE2-CB 3.94Å; Y357-A451 WeakPolarHBondContact OH-CB 3.28Å
358	T	84.1	Confident	80.3	Confident	40 Å²	40	71 Å²	71	25%	0.245	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	24.4	-175.5	68.3	0	0	0	0	113.4	N354 S360 F389	N354-T358 WeakPolarHBondContact O-CA 3.43Å; N354-T358 PolarHBondContact O-N 3.29Å; N354-T358 PolarHBondContact O-OG1 3.27Å; T358-S360 PolarHBondContact O-N 3.2Å; T358-F389 HydrophobicContact CG2-CB 4.34Å
359	A	70.8	Confident	80	Confident	22 Å²	22	74 Å²	74	18%	0.182	35%	0.346	C	S	.	.			trans	-53.9	-23.4	-179.4	0	0	0	0	0	114.9	N355 N361 R391	N355-A359 WeakPolarHBondContact O-CA 3.32Å; N355-A359 WeakPolarHBondContact O-CB 3.15Å; N355-A359 PolarHBondContact O-N 3.46Å; A359-N361 VanDerWaalsContact C-N 3.31Å; A359-N361 PolarHBondContact O-N 3.23Å; A359-R391 HydrophobicContact CB-CB 4.47Å; A359-R391 HydrophobicContact CB-CG 3.77Å; A359-R391 PolarHBondContact O-NE 3.13Å; A359-R391 PolarHBondContact O-NH2 3.16Å
360	S	66.3	Low	79.8	Confident	49 Å²	49	80.1 Å²	80.1	34%	0.343	38%	0.379	S	S	.	.	S	Bend	trans	-86.7	49.9	-177.3	71.9	0	0	0	0	113.3	T358 Y362 F389	T358-S360 PolarHBondContact O-N 3.2Å; S360-Y362 PolarHBondContact O-N 3.04Å; S360-F389 WeakPolarHBondContact CB-O 3.2Å; S360-F389 PolarHBondContact N-O 3.39Å; S360-F389 PolarHBondContact OG-O 3.29Å
361	N	58.2	Low	79.7	Confident	158 Å²	158	81.1 Å²	81.1	85%	0.845	39%	0.386	S	S	*	.			trans	44.1	9.5	168.3	-82.7	-5.7	0	0	0	119.3	A359 E363	A359-N361 VanDerWaalsContact C-N 3.31Å; A359-N361 PolarHBondContact O-N 3.23Å; N361-E363 PolarHBondContact O-N 3.25Å
362	Y	53.3	Low	79.6	Confident	128 Å²	128	77.7 Å²	77.7	50%	0.502	38%	0.381	S	S	.	.	S	Bend	trans	-86.4	102.2	-175.1	-167.6	-102.6	0	0	0	108.1	S360 L366 F389	S360-Y362 PolarHBondContact O-N 3.04Å; Y362-L366 HydrophobicContact CD1-CD1 4.11Å; Y362-L366 HydrophobicContact CD1-CD2 4.02Å; Y362-L366 HydrophobicContact CD1-CG 4.48Å; Y362-L366 HydrophobicContact CE1-CD1 4.04Å; Y362-L366 HydrophobicContact CE1-CD2 3.54Å; Y362-L366 HydrophobicContact CE1-CG 4.35Å; Y362-F389 AromaticContact CD1-CD1 3.84Å; Y362-F389 HydrophobicContact CD1-CD1 3.84Å; Y362-F389 AromaticContact CD1-CE1 3.69Å; Y362-F389 HydrophobicContact CD1-CE1 3.69Å; Y362-F389 HydrophobicContact CE1-CE1 4Å; Y362-F389 HydrophobicContact CG-CD1 4.43Å
363	E	53.6	Low	79.3	Confident	126 Å²	126	81.5 Å²	81.5	59%	0.589	39%	0.392	S	S	*	.			trans	34.5	95.3	167.5	-64	-175	170.6	0	0	115.6	N361 R365 L366	N361-E363 PolarHBondContact O-N 3.25Å; E363-R365 PolarHBondContact O-N 3.45Å; E363-L366 HydrophobicContact CB-CD2 3.93Å; E363-L366 HydrophobicContact CB-CG 4.48Å; E363-L366 WeakPolarHBondContact OE2-CD2 3.29Å
364	R	58.6	Low	78.8	Confident	238 Å²	238	88.8 Å²	88.8	90%	0.898	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-16.5	-179.9	-95.5	-177.2	-170.6	-180	4.1	115.7
365	R	65.4	Low	78.6	Confident	165 Å²	165	88.3 Å²	88.3	62%	0.623	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.7	78	175.6	-68.6	-171.9	-170.6	161.3	4.4	112.9	E363 L367	E363-R365 PolarHBondContact O-N 3.45Å; R365-L367 PolarHBondContact O-N 3.14Å
366	L	75.4	Confident	78.5	Confident	58 Å²	58	84.3 Å²	84.3	30%	0.304	40%	0.403	S	S	.	.	S	Bend	trans	-59.8	-24.6	167.5	-65.9	173.5	0	0	0	113.1	Y362 E363 V379 F389	Y362-L366 HydrophobicContact CD1-CD1 4.11Å; Y362-L366 HydrophobicContact CD1-CD2 4.02Å; Y362-L366 HydrophobicContact CD1-CG 4.48Å; Y362-L366 HydrophobicContact CE1-CD1 4.04Å; Y362-L366 HydrophobicContact CE1-CD2 3.54Å; Y362-L366 HydrophobicContact CE1-CG 4.35Å; E363-L366 HydrophobicContact CB-CD2 3.93Å; E363-L366 HydrophobicContact CB-CG 4.48Å; E363-L366 WeakPolarHBondContact OE2-CD2 3.29Å; L366-V379 HydrophobicContact CB-CG1 4.2Å; L366-V379 HydrophobicContact CB-CG2 4.34Å; L366-V379 HydrophobicContact CD1-CG1 4Å; L366-F389 HydrophobicContact CD1-CE1 4.05Å; L366-F389 HydrophobicContact CD1-CE2 4.31Å; L366-F389 HydrophobicContact CD1-CZ 3.73Å
367	L	85.6	Confident	78.2	Confident	4 Å²	4	84.5 Å²	84.5	2%	0.021	40%	0.404	C	S	.	.			trans	-117	145.4	-179.5	-62.2	172.3	0	0	0	110.7	E274 C275 R365 R376 V379	E274-L367 HydrophobicContact CB-CD1 4.39Å; C275-L367 HydrophobicContact CB-CB 4.21Å; R365-L367 PolarHBondContact O-N 3.14Å; L367-R376 HydrophobicContact CD1-CB 4.1Å; L367-R376 HydrophobicContact CD1-CG 4.05Å; L367-R376 HydrophobicContact CD2-CB 4.47Å; L367-R376 HydrophobicContact CD2-CG 4.08Å; L367-V379 HydrophobicContact CD1-CB 3.95Å; L367-V379 HydrophobicContact CD1-CG1 3.96Å; L367-V379 HydrophobicContact CD2-CB 4.23Å; L367-V379 HydrophobicContact CD2-CG2 3.91Å; L367-V379 HydrophobicContact CG-CB 4.1Å; L367-V379 HydrophobicContact CG-CG1 4.1Å; L367-V379 HydrophobicContact CG-CG2 4.15Å
368	K	88.6	Confident	78	Confident	141 Å²	141	86.6 Å²	86.6	61%	0.613	43%	0.425	S	S	*	.			trans	-109.6	160.7	169.7	-65.1	-179.2	-177	177.7	0	109.4	C275 N370 S371	C275-K368 CarbonylContact O-C 3.42Å; K368-N370 VanDerWaalsContact CB-OD1 3.23Å; K368-N370 WeakPolarHBondContact CB-OD1 3.42Å; K368-N370 PolarHBondContact O-N 2.77Å; K368-S371 PolarHBondContact N-OG 3.19Å; K368-S371 VanDerWaalsContact O-CB 3.28Å; K368-S371 WeakPolarHBondContact O-CB 3.39Å; K368-S371 PolarHBondContact O-N 2.88Å; K368-S371 PolarHBondContact O-OG 3.39Å
369	P	88.5	Confident	78.2	Confident	71 Å²	71	86.3 Å²	86.3	46%	0.461	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.7	176.7	-31	39	0	0	0	115.1	C275 S277 R376	C275-P369 VanDerWaalsContact O-CD 3.26Å; C275-P369 WeakPolarHBondContact O-CD 3.36Å; S277-P369 WeakPolarHBondContact OG-CB 3.29Å; P369-R376 PolarHBondContact O-NH2 2.95Å
370	N	90.4	Very high	79	Confident	131 Å²	131	85.2 Å²	85.2	70%	0.701	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	4.2	177.7	65.2	-17.6	0	0	0	113.6	K368	K368-N370 VanDerWaalsContact CB-OD1 3.23Å; K368-N370 WeakPolarHBondContact CB-OD1 3.42Å; K368-N370 PolarHBondContact O-N 2.77Å
371	S	91.3	Very high	79.9	Confident	21 Å²	21	83.9 Å²	83.9	15%	0.147	40%	0.402	C	S	.	.			trans	-60.2	137.9	178.7	-69.2	0	0	0	0	110.8	K368 R376	K368-S371 PolarHBondContact N-OG 3.19Å; K368-S371 VanDerWaalsContact O-CB 3.28Å; K368-S371 WeakPolarHBondContact O-CB 3.39Å; K368-S371 PolarHBondContact O-N 2.88Å; K368-S371 PolarHBondContact O-OG 3.39Å; S371-R376 PolarHBondContact O-NE 3.05Å; S371-R376 PolarHBondContact O-NH2 3.04Å
372	P	90.4	Very high	81.2	Confident	65 Å²	65	77.2 Å²	77.2	42%	0.422	37%	0.369	S	S	.	.			trans	-66.5	153.3	-177.4	28.2	-35.4	0	0	0	111.5	F374 A375 R376	P372-F374 VanDerWaalsContact C-N 3.3Å; P372-F374 HydrophobicContact CB-CD1 3.76Å; P372-F374 HydrophobicContact CB-CE1 3.55Å; P372-F374 HydrophobicContact CB-CZ 4.47Å; P372-F374 HydrophobicContact CG-CD1 3.91Å; P372-F374 HydrophobicContact CG-CE1 3.32Å; P372-F374 HydrophobicContact CG-CZ 3.77Å; P372-F374 PolarHBondContact O-N 2.77Å; P372-A375 HydrophobicContact CG-CB 3.92Å; P372-A375 PolarHBondContact O-N 2.84Å; P372-A375 VanDerWaalsContact O-N 3.08Å; P372-R376 PolarHBondContact O-N 2.87Å; P372-R376 VanDerWaalsContact O-N 3.13Å
373	R	85.9	Confident	82.9	Confident	127 Å²	127	71.6 Å²	71.6	48%	0.479	35%	0.347	S	S	.	.	H	α-helix	trans	-53.4	-43.8	-174.3	-172.2	-175.3	179.9	-72.9	-3.3	113	I298 C301 A375 R376 E377	I298-R373 HydrophobicContact CD1-CG 4.07Å; I298-R373 HydrophobicContact CG1-CG 4.13Å; C301-R373 PolarHBondContact SG-NH2 3.45Å; R373-A375 VanDerWaalsContact C-N 3.33Å; R373-A375 PolarHBondContact O-N 3.19Å; R373-R376 PolarHBondContact O-N 3.08Å; R373-E377 IonicContact CZ-OE2 3.04Å; R373-E377 IonicContact NH1-OE2 2.77Å; R373-E377 PolarHBondContact NH1-OE2 3.03Å; R373-E377 WeakPolarHBondContact O-CB 3.48Å; R373-E377 PolarHBondContact O-N 2.05Å
374	F	84	Confident	84.6	Confident	154 Å²	154	66 Å²	66	68%	0.675	32%	0.321	S	S	*	.	H	α-helix	trans	-62.2	-39.8	-179	77.2	-93.2	0	0	0	112.3	P372 E377 A378	P372-F374 VanDerWaalsContact C-N 3.3Å; P372-F374 HydrophobicContact CB-CD1 3.76Å; P372-F374 HydrophobicContact CB-CE1 3.55Å; P372-F374 HydrophobicContact CB-CZ 4.47Å; P372-F374 HydrophobicContact CG-CD1 3.91Å; P372-F374 HydrophobicContact CG-CE1 3.32Å; P372-F374 HydrophobicContact CG-CZ 3.77Å; P372-F374 PolarHBondContact O-N 2.77Å; F374-E377 PolarHBondContact O-N 3.47Å; F374-A378 PolarHBondContact O-N 2.84Å
375	A	87.7	Confident	85.7	Confident	26 Å²	26	56.9 Å²	56.9	22%	0.215	29%	0.289	C	S	.	.	H	α-helix	trans	-68.3	-42.3	178.6	0	0	0	0	0	110.8	P372 R373 E377 A378 V379	P372-A375 HydrophobicContact CG-CB 3.92Å; P372-A375 PolarHBondContact O-N 2.84Å; P372-A375 VanDerWaalsContact O-N 3.08Å; R373-A375 VanDerWaalsContact C-N 3.33Å; R373-A375 PolarHBondContact O-N 3.19Å; A375-E377 VanDerWaalsContact C-N 3.33Å; A375-E377 PolarHBondContact O-N 2.96Å; A375-A378 PolarHBondContact O-N 2.72Å; A375-V379 WeakPolarHBondContact O-CG2 3.46Å; A375-V379 PolarHBondContact O-N 3.32Å; A375-V379 VanDerWaalsContact O-N 3.11Å
376	R	89	Confident	86.4	Confident	10 Å²	10	54.6 Å²	54.6	4%	0.038	28%	0.284	C	S	.	.	H	α-helix	trans	-59.2	-45.5	174.4	-63.1	-169.3	-166.8	179.4	16.6	111.6	E294 I298 L367 P369 S371 P372 R373 V379 I380	E294-R376 IonicContact OE2-CZ 2.7Å; E294-R376 IonicContact OE2-NH1 2.88Å; E294-R376 PolarHBondContact OE2-NH1 3.14Å; E294-R376 IonicContact OE2-NH2 3.79Å; E294-R376 PolarHBondContact OE2-NH2 3.07Å; I298-R376 HydrophobicContact CD1-CB 3.4Å; I298-R376 HydrophobicContact CD1-CG 4.37Å; L367-R376 HydrophobicContact CD1-CB 4.1Å; L367-R376 HydrophobicContact CD1-CG 4.05Å; L367-R376 HydrophobicContact CD2-CB 4.47Å; L367-R376 HydrophobicContact CD2-CG 4.08Å; P369-R376 PolarHBondContact O-NH2 2.95Å; S371-R376 PolarHBondContact O-NE 3.05Å; S371-R376 PolarHBondContact O-NH2 3.04Å; P372-R376 PolarHBondContact O-N 2.87Å; P372-R376 VanDerWaalsContact O-N 3.13Å; R373-R376 PolarHBondContact O-N 3.08Å; R376-V379 PolarHBondContact O-N 3.1Å; R376-I380 HydrophobicContact CB-CD1 4.47Å; R376-I380 WeakPolarHBondContact O-CB 3.46Å; R376-I380 WeakPolarHBondContact O-CD1 3.41Å; R376-I380 WeakPolarHBondContact O-CG1 3.21Å; R376-I380 PolarHBondContact O-N 3.1Å
377	E	86.2	Confident	86.9	Confident	24 Å²	24	56.1 Å²	56.1	11%	0.112	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-44.4	178.7	-172.7	179.4	143.5	0	0	112.2	I298 L303 R373 F374 A375 V379 I380 K381	I298-E377 HydrophobicContact CG2-CB 3.92Å; I298-E377 HydrophobicContact CG2-CG 3.99Å; L303-E377 WeakPolarHBondContact CD1-OE1 3.41Å; L303-E377 WeakPolarHBondContact CD2-OE1 3.47Å; R373-E377 IonicContact CZ-OE2 3.04Å; R373-E377 IonicContact NH1-OE2 2.77Å; R373-E377 PolarHBondContact NH1-OE2 3.03Å; R373-E377 WeakPolarHBondContact O-CB 3.48Å; R373-E377 PolarHBondContact O-N 2.05Å; F374-E377 PolarHBondContact O-N 3.47Å; A375-E377 VanDerWaalsContact C-N 3.33Å; A375-E377 PolarHBondContact O-N 2.96Å; E377-V379 PolarHBondContact O-N 3.12Å; E377-I380 PolarHBondContact O-N 3.08Å; E377-K381 HydrophobicContact CG-CD 4.36Å; E377-K381 WeakPolarHBondContact O-CB 3.26Å; E377-K381 VanDerWaalsContact O-CG 3.28Å; E377-K381 WeakPolarHBondContact O-CG 3.42Å; E377-K381 PolarHBondContact O-N 3.21Å; E377-K381 VanDerWaalsContact OE1-CE 3.29Å; E377-K381 WeakPolarHBondContact OE1-CE 3.11Å; E377-K381 IonicContact OE1-NZ 3.42Å; E377-K381 PolarHBondContact OE1-NZ 2.85Å
378	A	84.8	Confident	86.8	Confident	61 Å²	61	58.6 Å²	58.6	50%	0.504	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-46.3	177.1	0	0	0	0	0	112.2	F374 A375 A382	F374-A378 PolarHBondContact O-N 2.84Å; A375-A378 PolarHBondContact O-N 2.72Å; A378-A382 WeakPolarHBondContact O-CB 3.36Å; A378-A382 PolarHBondContact O-N 3.38Å
379	V	87.6	Confident	86.7	Confident	33 Å²	33	53 Å²	53	20%	0.2	28%	0.279	C	S	.	.	H	α-helix	trans	-68.4	-43.6	179.4	173.2	0	0	0	0	111.7	L366 L367 A375 R376 E377 K381 A382 K383	L366-V379 HydrophobicContact CB-CG1 4.2Å; L366-V379 HydrophobicContact CB-CG2 4.34Å; L366-V379 HydrophobicContact CD1-CG1 4Å; L367-V379 HydrophobicContact CD1-CB 3.95Å; L367-V379 HydrophobicContact CD1-CG1 3.96Å; L367-V379 HydrophobicContact CD2-CB 4.23Å; L367-V379 HydrophobicContact CD2-CG2 3.91Å; L367-V379 HydrophobicContact CG-CB 4.1Å; L367-V379 HydrophobicContact CG-CG1 4.1Å; L367-V379 HydrophobicContact CG-CG2 4.15Å; A375-V379 WeakPolarHBondContact O-CG2 3.46Å; A375-V379 PolarHBondContact O-N 3.32Å; A375-V379 VanDerWaalsContact O-N 3.11Å; R376-V379 PolarHBondContact O-N 3.1Å; E377-V379 PolarHBondContact O-N 3.12Å; V379-K381 VanDerWaalsContact C-N 3.34Å; V379-K381 PolarHBondContact O-N 3.4Å; V379-A382 PolarHBondContact O-N 2.9Å; V379-K383 WeakPolarHBondContact O-CB 3.4Å; V379-K383 PolarHBondContact O-N 2.88Å
380	I	89	Confident	86.6	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.6	-43.9	177.9	-71.4	167.2	0	0	0	110.3	E274 I298 L322 R376 E377 K383 Y384	E274-I380 HydrophobicContact CB-CD1 4.16Å; E274-I380 HydrophobicContact CB-CG1 4.18Å; E274-I380 HydrophobicContact CG-CD1 3.85Å; E274-I380 HydrophobicContact CG-CG1 3.91Å; I298-I380 HydrophobicContact CB-CD1 4.17Å; I298-I380 HydrophobicContact CD1-CD1 4.25Å; I298-I380 HydrophobicContact CG2-CD1 3.84Å; L322-I380 HydrophobicContact CD1-CG2 3.96Å; L322-I380 HydrophobicContact CD2-CG2 4.32Å; R376-I380 HydrophobicContact CB-CD1 4.47Å; R376-I380 WeakPolarHBondContact O-CB 3.46Å; R376-I380 WeakPolarHBondContact O-CD1 3.41Å; R376-I380 WeakPolarHBondContact O-CG1 3.21Å; R376-I380 PolarHBondContact O-N 3.1Å; E377-I380 PolarHBondContact O-N 3.08Å; I380-K383 PolarHBondContact O-N 2.81Å; I380-Y384 HydrophobicContact CG2-CD2 3.81Å; I380-Y384 HydrophobicContact CG2-CE2 4.08Å; I380-Y384 VanDerWaalsContact O-CD2 3.26Å; I380-Y384 WeakPolarHBondContact O-CD2 3.47Å; I380-Y384 PolarHBondContact O-N 3.18Å
381	K	85	Confident	86.3	Confident	20 Å²	20	51.3 Å²	51.3	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-42.2	174.3	-69.7	179.5	-174.8	164	0	112.2	F319 L322 E377 V379 K383 L385 K386	F319-K381 HydrophobicContact CD1-CD 4.28Å; L322-K381 HydrophobicContact CD1-CG 4.04Å; E377-K381 HydrophobicContact CG-CD 4.36Å; E377-K381 WeakPolarHBondContact O-CB 3.26Å; E377-K381 VanDerWaalsContact O-CG 3.28Å; E377-K381 WeakPolarHBondContact O-CG 3.42Å; E377-K381 PolarHBondContact O-N 3.21Å; E377-K381 VanDerWaalsContact OE1-CE 3.29Å; E377-K381 WeakPolarHBondContact OE1-CE 3.11Å; E377-K381 IonicContact OE1-NZ 3.42Å; E377-K381 PolarHBondContact OE1-NZ 2.85Å; V379-K381 VanDerWaalsContact C-N 3.34Å; V379-K381 PolarHBondContact O-N 3.4Å; K381-K383 VanDerWaalsContact C-N 3.28Å; K381-K383 PolarHBondContact O-N 3.39Å; K381-L385 HydrophobicContact CB-CD1 4.08Å; K381-L385 HydrophobicContact CG-CD1 3.85Å; K381-L385 WeakPolarHBondContact O-CA 3.46Å; K381-L385 VanDerWaalsContact O-CB 3.31Å; K381-L385 WeakPolarHBondContact O-CB 3.35Å; K381-L385 PolarHBondContact O-N 2.98Å; K381-K386 PolarHBondContact O-N 2.88Å
382	A	85.3	Confident	85.8	Confident	19 Å²	19	52.3 Å²	52.3	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-39.3	176.5	0	0	0	0	0	111.8	A378 V379 K386 R387 S388 F389	A378-A382 WeakPolarHBondContact O-CB 3.36Å; A378-A382 PolarHBondContact O-N 3.38Å; V379-A382 PolarHBondContact O-N 2.9Å; A382-K386 CarbonylContact O-C 3.51Å; A382-R387 PolarHBondContact O-N 2.84Å; A382-R387 VanDerWaalsContact O-N 3.11Å; A382-S388 PolarHBondContact O-N 3.1Å; A382-S388 PolarHBondContact O-OG 3.33Å; A382-F389 HydrophobicContact CB-CE2 3.94Å; A382-F389 HydrophobicContact CB-CZ 3.97Å
383	K	88.5	Confident	85.4	Confident	10 Å²	10	51.9 Å²	51.9	4%	0.043	25%	0.251	C	S	.	.	H	α-helix	trans	-67.8	-56.5	179.7	-174.9	177.7	175.1	-171.2	0	112.5	A273 E274 N354 Y357 V379 I380 K381 R387 F389	A273-K383 PolarHBondContact O-NZ 3.26Å; E274-K383 IonicContact OE2-NZ 2.8Å; E274-K383 PolarHBondContact OE2-NZ 2.93Å; N354-K383 WeakPolarHBondContact OD1-CE 2.95Å; N354-K383 PolarHBondContact OD1-NZ 2.88Å; Y357-K383 WeakPolarHBondContact CD1-O 3.19Å; Y357-K383 HydrophobicContact CG-CG 4.35Å; V379-K383 WeakPolarHBondContact O-CB 3.4Å; V379-K383 PolarHBondContact O-N 2.88Å; I380-K383 PolarHBondContact O-N 2.81Å; K381-K383 VanDerWaalsContact C-N 3.28Å; K381-K383 PolarHBondContact O-N 3.39Å; K383-R387 WeakPolarHBondContact O-CA 3.35Å; K383-F389 HydrophobicContact CB-CD2 4.14Å; K383-F389 HydrophobicContact CB-CE2 4.09Å; K383-F389 HydrophobicContact CG-CD2 4.47Å
384	Y	88.7	Confident	85.4	Confident	8 Å²	8	46.5 Å²	46.5	3%	0.031	23%	0.233	C	C	.	.	H	α-helix	trans	-94.3	-41.4	-170.2	-59.8	-71.8	0	0	0	114.1	E274 M287 I289 H299 L322 Y357 I380	E274-Y384 WeakPolarHBondContact OE1-CE2 3.4Å; E274-Y384 VanDerWaalsContact OE1-CZ 3.25Å; E274-Y384 PolarHBondContact OE1-OH 3.28Å; E274-Y384 PolarHBondContact OE2-OH 3.28Å; M287-Y384 HydrophobicContact CE-CD1 4.25Å; M287-Y384 HydrophobicContact CE-CG 4.16Å; M287-Y384 HydrophobicContact SD-CD1 3.98Å; M287-Y384 HydrophobicContact SD-CE1 4.12Å; M287-Y384 HydrophobicContact SD-CG 4.22Å; I289-Y384 HydrophobicContact CD1-CE1 4.37Å; I289-Y384 WeakPolarHBondContact CD1-OH 3.15Å; H299-Y384 AromaticContact CE1-CD2 3.89Å; H299-Y384 AromaticContact CE1-CE2 3.57Å; H299-Y384 AromaticContact NE2-CE2 3.81Å; L322-Y384 HydrophobicContact CD2-CD2 4.48Å; Y357-Y384 HydrophobicContact CD1-CD1 4.12Å; Y357-Y384 AromaticContact CD2-CD1 3.99Å; Y357-Y384 HydrophobicContact CD2-CD1 3.99Å; Y357-Y384 AromaticContact CD2-CE1 3.72Å; Y357-Y384 HydrophobicContact CD2-CE1 3.72Å; Y357-Y384 AromaticContact CE1-CD1 3.82Å; Y357-Y384 HydrophobicContact CE1-CD1 3.82Å; Y357-Y384 AromaticContact CE2-CD1 3.65Å; Y357-Y384 HydrophobicContact CE2-CD1 3.65Å; Y357-Y384 AromaticContact CE2-CE1 3.67Å; Y357-Y384 HydrophobicContact CE2-CE1 3.67Å; Y357-Y384 HydrophobicContact CG-CD1 4.21Å; Y357-Y384 HydrophobicContact CG-CE1 4.15Å; Y357-Y384 AromaticContact CZ-CD1 3.57Å; I380-Y384 HydrophobicContact CG2-CD2 3.81Å; I380-Y384 HydrophobicContact CG2-CE2 4.08Å; I380-Y384 VanDerWaalsContact O-CD2 3.26Å; I380-Y384 WeakPolarHBondContact O-CD2 3.47Å; I380-Y384 PolarHBondContact O-N 3.18Å
385	L	82.6	Confident	85.5	Confident	46 Å²	46	47.6 Å²	47.6	24%	0.241	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-47.5	-175.6	-58.9	176.7	0	0	0	111.7	S320 L322 V326 K381	S320-L385 WeakPolarHBondContact O-CD1 3.5Å; L322-L385 HydrophobicContact CD1-CD1 4.02Å; L322-L385 HydrophobicContact CD1-CG 4.22Å; L322-L385 HydrophobicContact CG-CD1 4.32Å; L322-L385 HydrophobicContact CG-CD2 4.17Å; L322-L385 HydrophobicContact CG-CG 4.22Å; V326-L385 HydrophobicContact CG1-CD2 4.15Å; K381-L385 HydrophobicContact CB-CD1 4.08Å; K381-L385 HydrophobicContact CG-CD1 3.85Å; K381-L385 WeakPolarHBondContact O-CA 3.46Å; K381-L385 VanDerWaalsContact O-CB 3.31Å; K381-L385 WeakPolarHBondContact O-CB 3.35Å; K381-L385 PolarHBondContact O-N 2.98Å
386	K	81.2	Confident	85.3	Confident	118 Å²	118	49.8 Å²	49.8	51%	0.513	24%	0.239	S	C	.	.	S	Bend	trans	-87.2	-11.6	-179.4	-57.5	-174.7	175.4	-174.6	0	113.2	K381 A382 S388	K381-K386 PolarHBondContact O-N 2.88Å; A382-K386 CarbonylContact O-C 3.51Å; K386-S388 VanDerWaalsContact CB-OG 3.3Å; K386-S388 WeakPolarHBondContact CB-OG 3.48Å; K386-S388 PolarHBondContact O-N 2.98Å
387	R	85.8	Confident	85	Confident	89 Å²	89	49.5 Å²	49.5	34%	0.336	24%	0.239	S	C	.	.			trans	50.4	34	179.8	-56.5	173	-177.1	152.7	2.7	112.3	A382 K383 F389 M390 A451 S452	A382-R387 PolarHBondContact O-N 2.84Å; A382-R387 VanDerWaalsContact O-N 3.11Å; K383-R387 WeakPolarHBondContact O-CA 3.35Å; R387-F389 PolarHBondContact O-N 3.27Å; R387-F389 VanDerWaalsContact O-N 3.15Å; R387-M390 HydrophobicContact CB-CB 4.41Å; R387-M390 HydrophobicContact CB-CG 4.26Å; R387-M390 HydrophobicContact CB-SD 3.94Å; R387-M390 HydrophobicContact CG-SD 4.04Å; R387-M390 PolarHBondContact O-N 3.49Å; R387-A451 WeakPolarHBondContact CD-O 3.2Å; R387-A451 PolarHBondContact NE-O 3.04Å; R387-S452 VanDerWaalsContact NH1-C 3.29Å; R387-S452 PolarHBondContact NH1-O 3.05Å
388	S	83.1	Confident	84.9	Confident	56 Å²	56	54.9 Å²	54.9	39%	0.392	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-24.3	-165.8	-60.2	0	0	0	0	113.2	A382 K386	A382-S388 PolarHBondContact O-N 3.1Å; A382-S388 PolarHBondContact O-OG 3.33Å; K386-S388 VanDerWaalsContact CB-OG 3.3Å; K386-S388 WeakPolarHBondContact CB-OG 3.48Å; K386-S388 PolarHBondContact O-N 2.98Å
389	F	85.2	Confident	84.9	Confident	25 Å²	25	54.1 Å²	54.1	11%	0.11	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	4.2	-176.8	-38.7	-69.3	0	0	0	113.2	Y357 T358 S360 Y362 L366 A382 K383 R387	Y357-F389 CarbonylContact O-C 3.56Å; Y357-F389 WeakPolarHBondContact O-CB 3.44Å; T358-F389 HydrophobicContact CG2-CB 4.34Å; S360-F389 WeakPolarHBondContact CB-O 3.2Å; S360-F389 PolarHBondContact N-O 3.39Å; S360-F389 PolarHBondContact OG-O 3.29Å; Y362-F389 AromaticContact CD1-CD1 3.84Å; Y362-F389 HydrophobicContact CD1-CD1 3.84Å; Y362-F389 AromaticContact CD1-CE1 3.69Å; Y362-F389 HydrophobicContact CD1-CE1 3.69Å; Y362-F389 HydrophobicContact CE1-CE1 4Å; Y362-F389 HydrophobicContact CG-CD1 4.43Å; L366-F389 HydrophobicContact CD1-CE1 4.05Å; L366-F389 HydrophobicContact CD1-CE2 4.31Å; L366-F389 HydrophobicContact CD1-CZ 3.73Å; A382-F389 HydrophobicContact CB-CE2 3.94Å; A382-F389 HydrophobicContact CB-CZ 3.97Å; K383-F389 HydrophobicContact CB-CD2 4.14Å; K383-F389 HydrophobicContact CB-CE2 4.09Å; K383-F389 HydrophobicContact CG-CD2 4.47Å; R387-F389 PolarHBondContact O-N 3.27Å; R387-F389 VanDerWaalsContact O-N 3.15Å
390	M	87.3	Confident	84.6	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.039	24%	0.244	C	C	.	.	S	Bend	trans	-79.3	143.3	175.2	-72	-171.2	64.1	0	0	110.7	I356 Y357 R387 R401 A451 S452	I356-M390 HydrophobicContact CG2-CE 4.07Å; Y357-M390 HydrophobicContact CD1-CG 3.99Å; Y357-M390 HydrophobicContact CD1-SD 3.65Å; Y357-M390 HydrophobicContact CE1-SD 3.79Å; Y357-M390 PolarHBondContact O-N 2.94Å; R387-M390 HydrophobicContact CB-CB 4.41Å; R387-M390 HydrophobicContact CB-CG 4.26Å; R387-M390 HydrophobicContact CB-SD 3.94Å; R387-M390 HydrophobicContact CG-SD 4.04Å; R387-M390 PolarHBondContact O-N 3.49Å; M390-R401 PolarHBondContact O-NH1 3.08Å; M390-R401 PolarHBondContact O-NH2 3.44Å; M390-A451 HydrophobicContact CE-CB 4.19Å; M390-A451 HydrophobicContact SD-CB 4.38Å; M390-S452 WeakPolarHBondContact CE-OG 3.38Å
391	R	84.2	Confident	84.2	Confident	158 Å²	158	59.3 Å²	59.3	60%	0.596	26%	0.262	S	S	*	.	P	Polyproline II helix	trans	-67	143.4	166.5	-72.7	175.4	-171.1	-166.5	3.6	109.1	A359 F393	A359-R391 HydrophobicContact CB-CB 4.47Å; A359-R391 HydrophobicContact CB-CG 3.77Å; A359-R391 PolarHBondContact O-NE 3.13Å; A359-R391 PolarHBondContact O-NH2 3.16Å; R391-F393 PolarHBondContact O-N 3.33Å
392	P	81.6	Confident	84.1	Confident	41 Å²	41	65.6 Å²	65.6	27%	0.266	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-57.7	130.6	173	-24	35.7	0	0	0	110.3	R398	P392-R398 HydrophobicContact CB-CB 4.41Å; P392-R398 HydrophobicContact CB-CG 3.58Å; P392-R398 HydrophobicContact CG-CG 3.87Å
393	F	81.7	Confident	83.7	Confident	56 Å²	56	66.9 Å²	66.9	25%	0.246	29%	0.288	C	S	.	.	S	Bend	trans	-67.1	-47	-171.4	-171.1	-98.9	0	0	0	111.4	R391 E426 Q430 E433 T448 A449 S452	R391-F393 PolarHBondContact O-N 3.33Å; F393-E426 VanDerWaalsContact CB-OE1 3.26Å; F393-E426 WeakPolarHBondContact CB-OE1 3.47Å; F393-Q430 HydrophobicContact CB-CG 4.14Å; F393-Q430 HydrophobicContact CD1-CB 4.37Å; F393-Q430 HydrophobicContact CD1-CG 3.53Å; F393-Q430 HydrophobicContact CD2-CG 4.46Å; F393-Q430 HydrophobicContact CE1-CB 4.28Å; F393-Q430 HydrophobicContact CE1-CG 3.93Å; F393-Q430 HydrophobicContact CG-CG 3.81Å; F393-Q430 HydrophobicContact CZ-CG 4.48Å; F393-E433 HydrophobicContact CE1-CB 3.77Å; F393-E433 HydrophobicContact CE1-CG 4.1Å; F393-E433 HydrophobicContact CZ-CB 3.59Å; F393-E433 HydrophobicContact CZ-CG 3.56Å; F393-T448 HydrophobicContact CE2-CG2 4.26Å; F393-A449 HydrophobicContact CE2-CB 4.32Å; F393-A449 HydrophobicContact CZ-CB 4.15Å; F393-S452 WeakPolarHBondContact CD2-OG 3.05Å
394	S	85.8	Confident	83.1	Confident	14 Å²	14	70.7 Å²	70.7	10%	0.098	31%	0.309	C	S	.	.	S	Bend	trans	-122.9	179.1	179.2	94.1	0	0	0	0	113.4	H396 G397 R398 E426	S394-H396 VanDerWaalsContact C-N 3.26Å; S394-H396 PolarHBondContact O-N 2.93Å; S394-H396 WeakPolarHBondContact OG-CB 3.26Å; S394-H396 PolarHBondContact OG-N 3.3Å; S394-G397 PolarHBondContact O-N 3.35Å; S394-G397 PolarHBondContact OG-N 3.05Å; S394-R398 PolarHBondContact O-N 3.24Å; S394-R398 VanDerWaalsContact O-N 3.13Å; S394-E426 VanDerWaalsContact CB-OE2 3.28Å; S394-E426 WeakPolarHBondContact CB-OE2 3.36Å; S394-E426 PolarHBondContact OG-OE2 3.32Å
395	R	85	Confident	82.5	Confident	177 Å²	177	75.8 Å²	75.8	67%	0.668	34%	0.335	S	S	*	.	H	α-helix	trans	-61.1	-36.8	169.4	-173.9	-177	178.6	-161.3	0.2	111.2	R398 L399	R395-R398 PolarHBondContact O-N 3.31Å; R395-L399 HydrophobicContact CG-CD1 4.32Å; R395-L399 WeakPolarHBondContact O-CG 3.22Å; R395-L399 PolarHBondContact O-N 2.81Å
396	H	83.1	Confident	82	Confident	72 Å²	72	77.6 Å²	77.6	33%	0.333	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-43.9	175.6	-57.7	99.3	0	0	0	110.4	S394 R398 L399 F400 L422 D425 E426	S394-H396 VanDerWaalsContact C-N 3.26Å; S394-H396 PolarHBondContact O-N 2.93Å; S394-H396 WeakPolarHBondContact OG-CB 3.26Å; S394-H396 PolarHBondContact OG-N 3.3Å; H396-R398 VanDerWaalsContact C-N 3.33Å; H396-R398 PolarHBondContact O-N 3.22Å; H396-L399 CarbonylContact O-C 3.48Å; H396-L399 PolarHBondContact O-N 3.14Å; H396-L399 VanDerWaalsContact O-N 3.16Å; H396-F400 VanDerWaalsContact O-CB 3.27Å; H396-F400 WeakPolarHBondContact O-CB 3.2Å; H396-F400 PolarHBondContact O-N 3.13Å; H396-L422 HydrophobicContact CB-CD2 4.39Å; H396-D425 HydrophobicContact CB-CB 4.29Å; H396-D425 IonicContact CD2-OD2 2.92Å; H396-E426 HydrophobicContact CB-CB 4.35Å
397	G	83.1	Confident	81.4	Confident	4 Å²	4	73.2 Å²	73.2	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-59.9	-37.9	173.5	0	0	0	0	0	113.8	S394 R401 E426	S394-G397 PolarHBondContact O-N 3.35Å; S394-G397 PolarHBondContact OG-N 3.05Å; G397-R401 PolarHBondContact O-N 3.16Å; G397-E426 VanDerWaalsContact CA-CD 3.41Å; G397-E426 VanDerWaalsContact CA-OE2 3.31Å; G397-E426 WeakPolarHBondContact CA-OE2 3.37Å; G397-E426 PolarHBondContact N-OE2 3.03Å
398	R	85.3	Confident	80.4	Confident	138 Å²	138	73.2 Å²	73.2	52%	0.521	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-46.1	173	-70.4	-167.6	-68.9	-81.6	7.5	111.8	P392 S394 R395 H396 R402	P392-R398 HydrophobicContact CB-CB 4.41Å; P392-R398 HydrophobicContact CB-CG 3.58Å; P392-R398 HydrophobicContact CG-CG 3.87Å; S394-R398 PolarHBondContact O-N 3.24Å; S394-R398 VanDerWaalsContact O-N 3.13Å; R395-R398 PolarHBondContact O-N 3.31Å; H396-R398 VanDerWaalsContact C-N 3.33Å; H396-R398 PolarHBondContact O-N 3.22Å; R398-R402 PolarHBondContact O-N 3.49Å; R398-R402 VanDerWaalsContact O-N 3.13Å
399	L	84.3	Confident	79.7	Confident	44 Å²	44	76 Å²	76	23%	0.23	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-43.3	177.8	-71.6	173.1	0	0	0	110.9	R395 H396 R402 H403 L422	R395-L399 HydrophobicContact CG-CD1 4.32Å; R395-L399 WeakPolarHBondContact O-CG 3.22Å; R395-L399 PolarHBondContact O-N 2.81Å; H396-L399 CarbonylContact O-C 3.48Å; H396-L399 PolarHBondContact O-N 3.14Å; H396-L399 VanDerWaalsContact O-N 3.16Å; L399-R402 PolarHBondContact O-N 3.09Å; L399-R402 VanDerWaalsContact O-N 3.16Å; L399-H403 PolarHBondContact O-N 3.01Å; L399-H403 PolarHBondContact O-ND1 2.89Å; L399-L422 HydrophobicContact CB-CD1 4.02Å; L399-L422 HydrophobicContact CB-CD2 4.1Å; L399-L422 HydrophobicContact CD1-CD2 4.45Å
400	F	81.7	Confident	78.8	Confident	41 Å²	41	76.8 Å²	76.8	18%	0.18	38%	0.375	C	S	.	.	H	α-helix	trans	-56.3	-51.8	176.3	167.5	-106.9	0	0	0	110.8	H396 R402 H403 L404 V419 L422 L423	H396-F400 VanDerWaalsContact O-CB 3.27Å; H396-F400 WeakPolarHBondContact O-CB 3.2Å; H396-F400 PolarHBondContact O-N 3.13Å; F400-R402 VanDerWaalsContact C-N 3.27Å; F400-R402 PolarHBondContact O-N 3.07Å; F400-H403 PolarHBondContact O-N 3.38Å; F400-L404 HydrophobicContact CE1-CD1 4.37Å; F400-L404 HydrophobicContact CE2-CD1 3.84Å; F400-L404 HydrophobicContact CZ-CD1 3.54Å; F400-L404 WeakPolarHBondContact O-CB 3.24Å; F400-L404 PolarHBondContact O-N 3.27Å; F400-V419 HydrophobicContact CD2-CG1 3.98Å; F400-V419 HydrophobicContact CE2-CG1 3.57Å; F400-L422 HydrophobicContact CB-CB 4Å; F400-L423 HydrophobicContact CD1-CD2 4.12Å; F400-L423 HydrophobicContact CD2-CD1 4.38Å; F400-L423 HydrophobicContact CD2-CD2 3.7Å; F400-L423 HydrophobicContact CD2-CG 3.58Å; F400-L423 HydrophobicContact CE1-CD2 3.73Å; F400-L423 HydrophobicContact CE2-CD1 3.61Å; F400-L423 HydrophobicContact CE2-CD2 3.26Å; F400-L423 HydrophobicContact CE2-CG 3.22Å; F400-L423 HydrophobicContact CG-CD2 4.12Å; F400-L423 HydrophobicContact CG-CG 4.4Å; F400-L423 HydrophobicContact CZ-CD1 4.12Å; F400-L423 HydrophobicContact CZ-CD2 3.28Å; F400-L423 HydrophobicContact CZ-CG 3.81Å
401	R	79.5	Confident	77.7	Confident	101 Å²	101	84.6 Å²	84.6	38%	0.381	42%	0.417	S	S	.	.	H	α-helix	trans	-58.4	-39.9	177	-76.4	-167.6	-176.9	-175.3	3.1	112.2	M390 G397 I405	M390-R401 PolarHBondContact O-NH1 3.08Å; M390-R401 PolarHBondContact O-NH2 3.44Å; G397-R401 PolarHBondContact O-N 3.16Å; R401-I405 WeakPolarHBondContact O-CG1 3.5Å; R401-I405 PolarHBondContact O-N 3.01Å
402	R	82.4	Confident	76.9	Confident	152 Å²	152	81.2 Å²	81.2	57%	0.574	41%	0.41	S	S	*	.	H	α-helix	trans	-68.4	-43.1	177.6	-171.4	163.6	70.9	129.5	1.1	112.4	R398 L399 F400 I405 N406	R398-R402 PolarHBondContact O-N 3.49Å; R398-R402 VanDerWaalsContact O-N 3.13Å; L399-R402 PolarHBondContact O-N 3.09Å; L399-R402 VanDerWaalsContact O-N 3.16Å; F400-R402 VanDerWaalsContact C-N 3.27Å; F400-R402 PolarHBondContact O-N 3.07Å; R402-I405 PolarHBondContact O-N 3.32Å; R402-N406 PolarHBondContact O-N 3.24Å; R402-N406 VanDerWaalsContact O-N 3.14Å
403	H	77.8	Confident	76.1	Confident	46 Å²	46	81.1 Å²	81.1	21%	0.213	42%	0.417	C	S	.	.	H	α-helix	trans	-66.7	-40.2	176.8	-74.2	84.7	0	0	0	111.1	L399 F400 I405 N406 C407 V419 L422	L399-H403 PolarHBondContact O-N 3.01Å; L399-H403 PolarHBondContact O-ND1 2.89Å; F400-H403 PolarHBondContact O-N 3.38Å; H403-I405 PolarHBondContact O-N 3.16Å; H403-N406 CarbonylContact O-C 3.45Å; H403-N406 PolarHBondContact O-N 2.81Å; H403-C407 WeakPolarHBondContact O-CB 3.3Å; H403-C407 PolarHBondContact O-N 3.12Å; H403-C407 PolarHBondContact O-SG 3.39Å; H403-V419 HydrophobicContact CB-CG2 3.95Å; H403-L422 HydrophobicContact CB-CD1 4.34Å; H403-L422 WeakPolarHBondContact ND1-CD1 3.23Å
404	L	76.7	Confident	75.8	Confident	91 Å²	91	85 Å²	85	48%	0.476	43%	0.434	S	S	.	.	H	α-helix	trans	-58.3	-38.4	177	-165.6	119.4	0	0	0	112	F400 A408	F400-L404 HydrophobicContact CE1-CD1 4.37Å; F400-L404 HydrophobicContact CE2-CD1 3.84Å; F400-L404 HydrophobicContact CZ-CD1 3.54Å; F400-L404 WeakPolarHBondContact O-CB 3.24Å; F400-L404 PolarHBondContact O-N 3.27Å; L404-A408 WeakPolarHBondContact O-CB 3.3Å; L404-A408 PolarHBondContact O-N 3.49Å; L404-A408 VanDerWaalsContact O-N 3.09Å
405	I	74.3	Confident	75.1	Confident	115 Å²	115	86.2 Å²	86.2	59%	0.59	44%	0.44	S	S	*	.	H	α-helix	trans	-65.3	-44.8	173.2	-65.6	165.5	0	0	0	110.9	R401 R402 H403 A408	R401-I405 WeakPolarHBondContact O-CG1 3.5Å; R401-I405 PolarHBondContact O-N 3.01Å; R402-I405 PolarHBondContact O-N 3.32Å; H403-I405 PolarHBondContact O-N 3.16Å; I405-A408 PolarHBondContact O-N 2.98Å
406	N	72.2	Confident	74.4	Confident	84 Å²	84	83.7 Å²	83.7	45%	0.449	44%	0.435	S	S	.	.	H	α-helix	trans	-68.5	-39	179.4	-67.8	-8	0	0	0	112.9	R402 H403 A408 C409 S410	R402-N406 PolarHBondContact O-N 3.24Å; R402-N406 VanDerWaalsContact O-N 3.14Å; H403-N406 CarbonylContact O-C 3.45Å; H403-N406 PolarHBondContact O-N 2.81Å; N406-A408 VanDerWaalsContact C-N 3.32Å; N406-A408 PolarHBondContact O-N 3.5Å; N406-C409 CarbonylContact O-C 3.56Å; N406-C409 WeakPolarHBondContact O-CA 3.46Å; N406-C409 WeakPolarHBondContact O-CB 3.45Å; N406-C409 PolarHBondContact O-N 3.1Å; N406-S410 PolarHBondContact O-N 3.5Å
407	C	69.4	Low	74.1	Confident	25 Å²	25	85.1 Å²	85.1	17%	0.169	44%	0.444	C	S	.	.	H	α-helix	trans	-66.8	-33.6	177.2	-62.1	0	0	0	0	111.2	H403 C409 S410 D415 V419	H403-C407 WeakPolarHBondContact O-CB 3.3Å; H403-C407 PolarHBondContact O-N 3.12Å; H403-C407 PolarHBondContact O-SG 3.39Å; C407-C409 PolarHBondContact O-N 3.06Å; C407-C409 VanDerWaalsContact O-N 3.08Å; C407-S410 PolarHBondContact O-N 3.23Å; C407-D415 VanDerWaalsContact SG-CB 3.58Å; C407-V419 WeakPolarHBondContact SG-CG2 3.3Å
408	A	64.8	Low	74	Confident	89 Å²	89	87.2 Å²	87.2	74%	0.736	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17	171.9	0	0	0	0	0	112.5	L404 I405 N406	L404-A408 WeakPolarHBondContact O-CB 3.3Å; L404-A408 PolarHBondContact O-N 3.49Å; L404-A408 VanDerWaalsContact O-N 3.09Å; I405-A408 PolarHBondContact O-N 2.98Å; N406-A408 VanDerWaalsContact C-N 3.32Å; N406-A408 PolarHBondContact O-N 3.5Å
409	C	67.5	Low	73.7	Confident	115 Å²	115	81.5 Å²	81.5	78%	0.777	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-4	175.5	-55.9	0	0	0	0	114	N406 C407	N406-C409 CarbonylContact O-C 3.56Å; N406-C409 WeakPolarHBondContact O-CA 3.46Å; N406-C409 WeakPolarHBondContact O-CB 3.45Å; N406-C409 PolarHBondContact O-N 3.1Å; C407-C409 PolarHBondContact O-N 3.06Å; C407-C409 VanDerWaalsContact O-N 3.08Å
410	S	67.3	Low	73.5	Confident	41 Å²	41	84.9 Å²	84.9	29%	0.287	45%	0.453	S	S	.	.			trans	-130.9	138.1	-171.2	173.8	0	0	0	0	111.4	N406 C407 D412 D415	N406-S410 PolarHBondContact O-N 3.5Å; C407-S410 PolarHBondContact O-N 3.23Å; S410-D412 PolarHBondContact OG-N 3.21Å; S410-D415 WeakPolarHBondContact CB-OD2 3.37Å; S410-D415 PolarHBondContact OG-OD2 2.79Å
411	N	63.5	Low	73.7	Confident	172 Å²	172	89.8 Å²	89.8	92%	0.92	47%	0.47	S	S	*	.			trans	-97.6	13.9	174.6	-78.5	-20.4	0	0	0	112.8
412	D	67.9	Low	74	Confident	87 Å²	87	85.9 Å²	85.9	47%	0.465	46%	0.457	S	S	.	.			trans	-73.6	132.8	-178.5	-164.2	-14.3	0	0	0	111.6	S410 K414 D415	S410-D412 PolarHBondContact OG-N 3.21Å; D412-K414 PolarHBondContact O-N 3.21Å; D412-K414 PolarHBondContact OD1-N 2.93Å; D412-D415 WeakPolarHBondContact O-CB 3.36Å; D412-D415 PolarHBondContact O-N 2.65Å
413	G	65.5	Low	74	Confident	40 Å²	40	81.5 Å²	81.5	41%	0.412	44%	0.444	S	S	.	.	H	α-helix	trans	-67.9	-24.9	175.6	0	0	0	0	0	112.9	D415 Q416 I417	G413-D415 VanDerWaalsContact C-N 3.34Å; G413-Q416 PolarHBondContact O-N 3.34Å; G413-I417 PolarHBondContact O-N 3.02Å
414	K	74	Confident	74.3	Confident	138 Å²	138	82 Å²	82	60%	0.6	45%	0.453	S	S	*	.	H	α-helix	trans	-63.4	-42.3	176.8	-168	-176.1	179.8	76.8	0	111.6	D412 Q416 I417 D418	D412-K414 PolarHBondContact O-N 3.21Å; D412-K414 PolarHBondContact OD1-N 2.93Å; K414-Q416 VanDerWaalsContact C-N 3.29Å; K414-Q416 PolarHBondContact O-N 3.36Å; K414-I417 PolarHBondContact O-N 3.16Å; K414-D418 PolarHBondContact O-N 3.06Å; K414-D418 VanDerWaalsContact O-N 3.14Å
415	D	70.9	Confident	74.8	Confident	39 Å²	39	80.5 Å²	80.5	21%	0.209	45%	0.445	C	S	.	.	H	α-helix	trans	-59	-39.7	177	-82.4	-24.3	0	0	0	111.5	C407 S410 D412 G413 D418 V419	C407-D415 VanDerWaalsContact SG-CB 3.58Å; S410-D415 WeakPolarHBondContact CB-OD2 3.37Å; S410-D415 PolarHBondContact OG-OD2 2.79Å; D412-D415 WeakPolarHBondContact O-CB 3.36Å; D412-D415 PolarHBondContact O-N 2.65Å; G413-D415 VanDerWaalsContact C-N 3.34Å; D415-D418 PolarHBondContact O-N 3.27Å; D415-V419 VanDerWaalsContact O-CG2 3.26Å; D415-V419 WeakPolarHBondContact O-CG2 3.31Å; D415-V419 PolarHBondContact O-N 3.44Å
416	Q	70.5	Confident	75.4	Confident	123 Å²	123	75.8 Å²	75.8	58%	0.575	42%	0.421	S	S	*	.	H	α-helix	trans	-66.6	-41	177.9	-62.6	-177	7.1	0	0	112.9	G413 K414 V419 L420	G413-Q416 PolarHBondContact O-N 3.34Å; K414-Q416 VanDerWaalsContact C-N 3.29Å; K414-Q416 PolarHBondContact O-N 3.36Å; Q416-V419 PolarHBondContact O-N 2.99Å; Q416-L420 WeakPolarHBondContact O-CG 3.44Å; Q416-L420 PolarHBondContact O-N 3.04Å
417	I	77.8	Confident	76	Confident	103 Å²	103	76.7 Å²	76.7	53%	0.528	42%	0.424	S	S	.	.	H	α-helix	trans	-64.2	-43.1	177.8	-66.3	171.1	0	0	0	110.5	G413 K414 V419 L420 R421	G413-I417 PolarHBondContact O-N 3.02Å; K414-I417 PolarHBondContact O-N 3.16Å; I417-V419 VanDerWaalsContact C-N 3.34Å; I417-V419 PolarHBondContact O-N 3.04Å; I417-L420 PolarHBondContact O-N 3.14Å; I417-R421 PolarHBondContact O-N 3.47Å
418	D	80.6	Confident	76.8	Confident	47 Å²	47	80 Å²	80	25%	0.251	44%	0.438	S	S	.	.	H	α-helix	trans	-65.9	-37.2	178.5	-74.5	-25	0	0	0	111.6	K414 D415 R421 L422	K414-D418 PolarHBondContact O-N 3.06Å; K414-D418 VanDerWaalsContact O-N 3.14Å; D415-D418 PolarHBondContact O-N 3.27Å; D418-R421 PolarHBondContact O-N 3.25Å; D418-R421 IonicContact OD1-NH1 3.69Å; D418-L422 WeakPolarHBondContact O-CB 3.39Å; D418-L422 VanDerWaalsContact O-CG 3.24Å; D418-L422 WeakPolarHBondContact O-CG 3.19Å; D418-L422 PolarHBondContact O-N 2.94Å
419	V	78.9	Confident	78	Confident	18 Å²	18	78 Å²	78	11%	0.109	42%	0.418	C	S	.	.	H	α-helix	trans	-61.2	-45.9	172.7	169.7	0	0	0	0	111.9	F400 H403 C407 D415 Q416 I417 L422 L423	F400-V419 HydrophobicContact CD2-CG1 3.98Å; F400-V419 HydrophobicContact CE2-CG1 3.57Å; H403-V419 HydrophobicContact CB-CG2 3.95Å; C407-V419 WeakPolarHBondContact SG-CG2 3.3Å; D415-V419 VanDerWaalsContact O-CG2 3.26Å; D415-V419 WeakPolarHBondContact O-CG2 3.31Å; D415-V419 PolarHBondContact O-N 3.44Å; Q416-V419 PolarHBondContact O-N 2.99Å; I417-V419 VanDerWaalsContact C-N 3.34Å; I417-V419 PolarHBondContact O-N 3.04Å; V419-L422 PolarHBondContact O-N 2.85Å; V419-L423 HydrophobicContact CG1-CD1 4.3Å; V419-L423 WeakPolarHBondContact O-CB 3.15Å; V419-L423 WeakPolarHBondContact O-CG 3.26Å; V419-L423 PolarHBondContact O-N 3.48Å
420	L	80.1	Confident	79.1	Confident	116 Å²	116	73.2 Å²	73.2	61%	0.607	38%	0.384	S	S	*	.	H	α-helix	trans	-64.2	-40.4	178.2	-71	174.7	0	0	0	112.1	Q416 I417 L423 S424	Q416-L420 WeakPolarHBondContact O-CG 3.44Å; Q416-L420 PolarHBondContact O-N 3.04Å; I417-L420 PolarHBondContact O-N 3.14Å; L420-L423 HydrophobicContact CD2-CD1 4.49Å; L420-L423 WeakPolarHBondContact O-CB 3.24Å; L420-L423 PolarHBondContact O-N 2.99Å; L420-S424 PolarHBondContact O-N 3.47Å; L420-S424 PolarHBondContact O-OG 2.98Å
421	R	86.1	Confident	80.3	Confident	144 Å²	144	71.4 Å²	71.4	54%	0.543	37%	0.371	S	S	.	.	H	α-helix	trans	-63.2	-46.4	174.8	-175.4	-175.5	-65.7	158.5	0.6	111.6	I417 D418 L423 S424 D425	I417-R421 PolarHBondContact O-N 3.47Å; D418-R421 PolarHBondContact O-N 3.25Å; D418-R421 IonicContact OD1-NH1 3.69Å; R421-L423 VanDerWaalsContact C-N 3.25Å; R421-L423 PolarHBondContact O-N 3.15Å; R421-S424 WeakPolarHBondContact CA-OG 3.5Å; R421-S424 PolarHBondContact O-N 3.04Å; R421-S424 PolarHBondContact O-OG 2.95Å; R421-D425 WeakPolarHBondContact O-CB 3.47Å; R421-D425 PolarHBondContact O-N 3.38Å
422	L	85.8	Confident	81.7	Confident	19 Å²	19	65.7 Å²	65.7	10%	0.099	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-32.7	178	-70.2	171.6	0	0	0	112.2	H396 L399 F400 H403 D418 V419 E426	H396-L422 HydrophobicContact CB-CD2 4.39Å; L399-L422 HydrophobicContact CB-CD1 4.02Å; L399-L422 HydrophobicContact CB-CD2 4.1Å; L399-L422 HydrophobicContact CD1-CD2 4.45Å; F400-L422 HydrophobicContact CB-CB 4Å; H403-L422 HydrophobicContact CB-CD1 4.34Å; H403-L422 WeakPolarHBondContact ND1-CD1 3.23Å; D418-L422 WeakPolarHBondContact O-CB 3.39Å; D418-L422 VanDerWaalsContact O-CG 3.24Å; D418-L422 WeakPolarHBondContact O-CG 3.19Å; D418-L422 PolarHBondContact O-N 2.94Å; V419-L422 PolarHBondContact O-N 2.85Å; L422-E426 WeakPolarHBondContact O-CB 3.22Å; L422-E426 PolarHBondContact O-N 3.02Å
423	L	82.1	Confident	82.8	Confident	59 Å²	59	64.8 Å²	64.8	31%	0.309	33%	0.334	S	S	.	.	H	α-helix	trans	-65	-48.9	171.6	-80.8	172.6	0	0	0	112	F400 V419 L420 R421 D425 E426 M427	F400-L423 HydrophobicContact CD1-CD2 4.12Å; F400-L423 HydrophobicContact CD2-CD1 4.38Å; F400-L423 HydrophobicContact CD2-CD2 3.7Å; F400-L423 HydrophobicContact CD2-CG 3.58Å; F400-L423 HydrophobicContact CE1-CD2 3.73Å; F400-L423 HydrophobicContact CE2-CD1 3.61Å; F400-L423 HydrophobicContact CE2-CD2 3.26Å; F400-L423 HydrophobicContact CE2-CG 3.22Å; F400-L423 HydrophobicContact CG-CD2 4.12Å; F400-L423 HydrophobicContact CG-CG 4.4Å; F400-L423 HydrophobicContact CZ-CD1 4.12Å; F400-L423 HydrophobicContact CZ-CD2 3.28Å; F400-L423 HydrophobicContact CZ-CG 3.81Å; V419-L423 HydrophobicContact CG1-CD1 4.3Å; V419-L423 WeakPolarHBondContact O-CB 3.15Å; V419-L423 WeakPolarHBondContact O-CG 3.26Å; V419-L423 PolarHBondContact O-N 3.48Å; L420-L423 HydrophobicContact CD2-CD1 4.49Å; L420-L423 WeakPolarHBondContact O-CB 3.24Å; L420-L423 PolarHBondContact O-N 2.99Å; R421-L423 VanDerWaalsContact C-N 3.25Å; R421-L423 PolarHBondContact O-N 3.15Å; L423-D425 VanDerWaalsContact C-N 3.33Å; L423-D425 PolarHBondContact O-N 2.96Å; L423-E426 PolarHBondContact O-N 3.22Å; L423-M427 WeakPolarHBondContact O-CG 3.4Å; L423-M427 PolarHBondContact O-N 3.23Å
424	S	85.1	Confident	84.3	Confident	56 Å²	56	62.9 Å²	62.9	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-61.9	-43.3	178.5	59.1	0	0	0	0	111.4	L420 R421 E426 M427 M428	L420-S424 PolarHBondContact O-N 3.47Å; L420-S424 PolarHBondContact O-OG 2.98Å; R421-S424 WeakPolarHBondContact CA-OG 3.5Å; R421-S424 PolarHBondContact O-N 3.04Å; R421-S424 PolarHBondContact O-OG 2.95Å; S424-E426 VanDerWaalsContact C-N 3.34Å; S424-E426 PolarHBondContact O-N 2.92Å; S424-M427 PolarHBondContact O-N 3.28Å; S424-M428 WeakPolarHBondContact O-CB 3.32Å; S424-M428 VanDerWaalsContact O-CG 3.31Å; S424-M428 WeakPolarHBondContact O-CG 3.46Å; S424-M428 PolarHBondContact O-N 3.28Å
425	D	87	Confident	85.2	Confident	60 Å²	60	56.4 Å²	56.4	32%	0.321	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-39.4	179.1	-65.8	-15.7	0	0	0	111.5	H396 R421 L423 C429	H396-D425 HydrophobicContact CB-CB 4.29Å; H396-D425 IonicContact CD2-OD2 2.92Å; R421-D425 WeakPolarHBondContact O-CB 3.47Å; R421-D425 PolarHBondContact O-N 3.38Å; L423-D425 VanDerWaalsContact C-N 3.33Å; L423-D425 PolarHBondContact O-N 2.96Å; D425-C429 VanDerWaalsContact O-CB 3.22Å; D425-C429 WeakPolarHBondContact O-CB 3.46Å; D425-C429 PolarHBondContact O-N 3.46Å
426	E	85.8	Confident	86.3	Confident	16 Å²	16	57.2 Å²	57.2	8%	0.075	29%	0.292	C	S	.	.	H	α-helix	trans	-65.6	-45.3	175	179.7	70.4	174.5	0	0	111.6	F393 S394 H396 G397 L422 L423 S424 C429 Q430	F393-E426 VanDerWaalsContact CB-OE1 3.26Å; F393-E426 WeakPolarHBondContact CB-OE1 3.47Å; S394-E426 VanDerWaalsContact CB-OE2 3.28Å; S394-E426 WeakPolarHBondContact CB-OE2 3.36Å; S394-E426 PolarHBondContact OG-OE2 3.32Å; H396-E426 HydrophobicContact CB-CB 4.35Å; G397-E426 VanDerWaalsContact CA-CD 3.41Å; G397-E426 VanDerWaalsContact CA-OE2 3.31Å; G397-E426 WeakPolarHBondContact CA-OE2 3.37Å; G397-E426 PolarHBondContact N-OE2 3.03Å; L422-E426 WeakPolarHBondContact O-CB 3.22Å; L422-E426 PolarHBondContact O-N 3.02Å; L423-E426 PolarHBondContact O-N 3.22Å; S424-E426 VanDerWaalsContact C-N 3.34Å; S424-E426 PolarHBondContact O-N 2.92Å; E426-C429 PolarHBondContact O-N 3.39Å; E426-Q430 VanDerWaalsContact O-CG 3.24Å; E426-Q430 WeakPolarHBondContact O-CG 3.28Å; E426-Q430 PolarHBondContact O-N 2.96Å; E426-Q430 PolarHBondContact OE1-NE2 3.34Å; E426-Q430 VanDerWaalsContact OE1-NE2 3.07Å
427	M	84.9	Confident	87.5	Confident	104 Å²	104	51.4 Å²	51.4	51%	0.512	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177.2	-73.4	-179.4	66.7	0	0	111.7	L423 S424 Q430 S431	L423-M427 WeakPolarHBondContact O-CG 3.4Å; L423-M427 PolarHBondContact O-N 3.23Å; S424-M427 PolarHBondContact O-N 3.28Å; M427-Q430 PolarHBondContact O-N 2.91Å; M427-S431 WeakPolarHBondContact O-CB 3.41Å; M427-S431 PolarHBondContact O-N 3.41Å; M427-S431 PolarHBondContact O-OG 2.92Å
428	M	87.4	Confident	88.4	Confident	95 Å²	95	46.6 Å²	46.6	47%	0.468	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-43.9	175.1	-72.1	-61.5	-67.2	0	0	111.3	S424 Q430 S431 N432	S424-M428 WeakPolarHBondContact O-CB 3.32Å; S424-M428 VanDerWaalsContact O-CG 3.31Å; S424-M428 WeakPolarHBondContact O-CG 3.46Å; S424-M428 PolarHBondContact O-N 3.28Å; M428-Q430 PolarHBondContact O-N 2.93Å; M428-S431 PolarHBondContact O-N 2.66Å; M428-N432 WeakPolarHBondContact O-CB 3.21Å; M428-N432 VanDerWaalsContact O-CG 3.28Å; M428-N432 PolarHBondContact O-N 3.47Å; M428-N432 PolarHBondContact O-ND2 3.47Å
429	C	89.9	Confident	89	Confident	46 Å²	46	46.3 Å²	46.3	31%	0.311	25%	0.245	S	C	.	.	H	α-helix	trans	-61.4	-43.8	177.6	-176.6	0	0	0	0	112.3	D425 E426 E433	D425-C429 VanDerWaalsContact O-CB 3.22Å; D425-C429 WeakPolarHBondContact O-CB 3.46Å; D425-C429 PolarHBondContact O-N 3.46Å; E426-C429 PolarHBondContact O-N 3.39Å; C429-E433 WeakPolarHBondContact O-CB 3.32Å; C429-E433 PolarHBondContact O-N 3.37Å
430	Q	90.7	Very high	89.7	Confident	14 Å²	14	53.3 Å²	53.3	7%	0.065	27%	0.269	C	S	.	.	H	α-helix	trans	-63.4	-43.6	177	-70.7	168.1	2.1	0	0	112	F393 E426 M427 M428 E433 L434 S452 G453 A454	F393-Q430 HydrophobicContact CB-CG 4.14Å; F393-Q430 HydrophobicContact CD1-CB 4.37Å; F393-Q430 HydrophobicContact CD1-CG 3.53Å; F393-Q430 HydrophobicContact CD2-CG 4.46Å; F393-Q430 HydrophobicContact CE1-CB 4.28Å; F393-Q430 HydrophobicContact CE1-CG 3.93Å; F393-Q430 HydrophobicContact CG-CG 3.81Å; F393-Q430 HydrophobicContact CZ-CG 4.48Å; E426-Q430 VanDerWaalsContact O-CG 3.24Å; E426-Q430 WeakPolarHBondContact O-CG 3.28Å; E426-Q430 PolarHBondContact O-N 2.96Å; E426-Q430 PolarHBondContact OE1-NE2 3.34Å; E426-Q430 VanDerWaalsContact OE1-NE2 3.07Å; M427-Q430 PolarHBondContact O-N 2.91Å; M428-Q430 PolarHBondContact O-N 2.93Å; Q430-E433 PolarHBondContact O-N 3.39Å; Q430-L434 PolarHBondContact O-N 3.43Å; Q430-S452 PolarHBondContact NE2-O 2.89Å; Q430-S452 PolarHBondContact OE1-O 3.34Å; Q430-G453 VanDerWaalsContact OE1-CA 3.27Å; Q430-A454 HydrophobicContact CB-CB 4.13Å; Q430-A454 WeakPolarHBondContact O-CB 3.26Å
431	S	91.9	Very high	90.4	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.028	26%	0.26	C	S	.	.	H	α-helix	trans	-75.4	-35.5	-175.3	-38.7	0	0	0	0	112	M427 M428 L434 I435 S455 C458	M427-S431 WeakPolarHBondContact O-CB 3.41Å; M427-S431 PolarHBondContact O-N 3.41Å; M427-S431 PolarHBondContact O-OG 2.92Å; M428-S431 PolarHBondContact O-N 2.66Å; S431-L434 WeakPolarHBondContact O-CB 3.25Å; S431-L434 PolarHBondContact O-N 3.26Å; S431-I435 WeakPolarHBondContact O-CG1 3.46Å; S431-I435 PolarHBondContact O-N 3.32Å; S431-S455 PolarHBondContact OG-N 3.44Å; S431-C458 WeakPolarHBondContact CB-SG 3.49Å
432	N	91.8	Very high	90.9	Very high	52 Å²	52	48 Å²	48	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-64	-41.4	169.7	-73.7	-21.3	0	0	0	112.2	M428 L434 I435 V436	M428-N432 WeakPolarHBondContact O-CB 3.21Å; M428-N432 VanDerWaalsContact O-CG 3.28Å; M428-N432 PolarHBondContact O-N 3.47Å; M428-N432 PolarHBondContact O-ND2 3.47Å; N432-L434 VanDerWaalsContact C-N 3.28Å; N432-L434 PolarHBondContact O-N 3.09Å; N432-I435 PolarHBondContact O-N 2.96Å; N432-V436 WeakPolarHBondContact O-CG2 3.27Å; N432-V436 PolarHBondContact O-N 3.4Å
433	E	92.8	Very high	91.5	Very high	67 Å²	67	47.5 Å²	47.5	31%	0.313	25%	0.25	S	C	.	.	H	α-helix	trans	-64.9	-33.9	176	-174	61.1	-152.6	0	0	111.7	F393 C429 Q430 I435 V436 A437 R440	F393-E433 HydrophobicContact CE1-CB 3.77Å; F393-E433 HydrophobicContact CE1-CG 4.1Å; F393-E433 HydrophobicContact CZ-CB 3.59Å; F393-E433 HydrophobicContact CZ-CG 3.56Å; C429-E433 WeakPolarHBondContact O-CB 3.32Å; C429-E433 PolarHBondContact O-N 3.37Å; Q430-E433 PolarHBondContact O-N 3.39Å; E433-I435 PolarHBondContact O-N 2.88Å; E433-V436 PolarHBondContact O-N 2.65Å; E433-A437 WeakPolarHBondContact O-CB 3.49Å; E433-A437 PolarHBondContact O-N 3.09Å; E433-R440 IonicContact OE1-NH1 3.76Å
434	L	95.5	Very high	92.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-46.2	172	177	58.7	0	0	0	111.4	Q430 S431 N432 A437 T438 M446 A449 I450 A454 V456 A468 L481	Q430-L434 PolarHBondContact O-N 3.43Å; S431-L434 WeakPolarHBondContact O-CB 3.25Å; S431-L434 PolarHBondContact O-N 3.26Å; N432-L434 VanDerWaalsContact C-N 3.28Å; N432-L434 PolarHBondContact O-N 3.09Å; L434-A437 PolarHBondContact O-N 3.37Å; L434-T438 WeakPolarHBondContact O-CB 3.32Å; L434-T438 PolarHBondContact O-N 3.24Å; L434-T438 PolarHBondContact O-OG1 3.01Å; L434-M446 HydrophobicContact CD1-CB 3.94Å; L434-M446 HydrophobicContact CD1-CG 4.26Å; L434-A449 HydrophobicContact CB-CB 3.8Å; L434-A449 HydrophobicContact CD1-CB 4.37Å; L434-I450 HydrophobicContact CD1-CD1 4.06Å; L434-I450 HydrophobicContact CD1-CG1 3.81Å; L434-I450 HydrophobicContact CD2-CG1 3.94Å; L434-A454 HydrophobicContact CB-CB 3.89Å; L434-A454 HydrophobicContact CD2-CB 3.89Å; L434-A454 HydrophobicContact CG-CB 4.5Å; L434-V456 HydrophobicContact CD2-CG2 4.48Å; L434-A468 HydrophobicContact CD2-CB 4.15Å; L434-A468 HydrophobicContact CG-CB 3.87Å; L434-L481 HydrophobicContact CD1-CD2 4.07Å; L434-L481 HydrophobicContact CD2-CD2 4.18Å; L434-L481 HydrophobicContact CG-CD2 4.37Å
435	I	94.2	Very high	92.6	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-48.9	177.7	-64.6	173.9	0	0	0	110.3	S431 N432 E433 T438 A439 A468 Q471	S431-I435 WeakPolarHBondContact O-CG1 3.46Å; S431-I435 PolarHBondContact O-N 3.32Å; N432-I435 PolarHBondContact O-N 2.96Å; E433-I435 PolarHBondContact O-N 2.88Å; I435-T438 WeakPolarHBondContact O-CB 3.45Å; I435-T438 PolarHBondContact O-N 3.34Å; I435-A439 PolarHBondContact O-N 2.91Å; I435-A468 HydrophobicContact CG1-CB 4.05Å; I435-Q471 HydrophobicContact CG2-CG 3.7Å
436	V	93.1	Very high	93.1	Very high	56 Å²	56	42.4 Å²	42.4	34%	0.339	22%	0.224	S	C	.	.	H	α-helix	trans	-63.3	-44.8	-179.7	171.5	0	0	0	0	112	N432 E433 T438 A439 R440	N432-V436 WeakPolarHBondContact O-CG2 3.27Å; N432-V436 PolarHBondContact O-N 3.4Å; E433-V436 PolarHBondContact O-N 2.65Å; V436-T438 VanDerWaalsContact C-N 3.28Å; V436-T438 PolarHBondContact O-N 3.38Å; V436-A439 PolarHBondContact O-N 3.24Å; V436-R440 VanDerWaalsContact CG1-NH2 3.25Å; V436-R440 WeakPolarHBondContact O-CG 3.47Å; V436-R440 PolarHBondContact O-N 3.41Å; V436-R440 VanDerWaalsContact O-N 3.16Å
437	A	95.9	Very high	93.7	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-63	-36.3	176.1	0	0	0	0	0	111.8	E433 L434 R440 N441 D442 A445 M446	E433-A437 WeakPolarHBondContact O-CB 3.49Å; E433-A437 PolarHBondContact O-N 3.09Å; L434-A437 PolarHBondContact O-N 3.37Å; A437-R440 CarbonylContact O-C 3.57Å; A437-R440 PolarHBondContact O-N 3.39Å; A437-N441 PolarHBondContact O-N 3.44Å; A437-N441 VanDerWaalsContact O-N 3.12Å; A437-D442 PolarHBondContact O-N 3.14Å; A437-A445 HydrophobicContact CB-CB 3.76Å; A437-M446 HydrophobicContact CB-CB 4.49Å; A437-M446 HydrophobicContact CB-CG 3.82Å
438	T	96.7	Very high	94.2	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-66.3	-44.7	176.1	-53.2	0	0	0	0	111.7	L434 I435 V436 R440 N441 M446 A468 Q471 L481	L434-T438 WeakPolarHBondContact O-CB 3.32Å; L434-T438 PolarHBondContact O-N 3.24Å; L434-T438 PolarHBondContact O-OG1 3.01Å; I435-T438 WeakPolarHBondContact O-CB 3.45Å; I435-T438 PolarHBondContact O-N 3.34Å; V436-T438 VanDerWaalsContact C-N 3.28Å; V436-T438 PolarHBondContact O-N 3.38Å; T438-R440 PolarHBondContact O-N 2.95Å; T438-N441 WeakPolarHBondContact O-CA 3.14Å; T438-N441 PolarHBondContact O-N 2.89Å; T438-M446 HydrophobicContact CG2-CE 3.9Å; T438-M446 HydrophobicContact CG2-SD 4.24Å; T438-M446 WeakPolarHBondContact OG1-CE 3.48Å; T438-A468 VanDerWaalsContact CG2-O 3.22Å; T438-A468 WeakPolarHBondContact CG2-O 3.29Å; T438-Q471 HydrophobicContact CG2-CB 4.35Å; T438-L481 HydrophobicContact CG2-CD1 4.13Å
439	A	92.8	Very high	94.5	Very high	41 Å²	41	34.3 Å²	34.3	34%	0.339	19%	0.187	S	C	.	.	H	α-helix	trans	-61.1	-29.3	176.3	0	0	0	0	0	112.8	I435 V436 N441 Q471	I435-A439 PolarHBondContact O-N 2.91Å; V436-A439 PolarHBondContact O-N 3.24Å; A439-N441 VanDerWaalsContact C-N 3.35Å; A439-Q471 HydrophobicContact CB-CB 4.24Å
440	R	94.7	Very high	94.7	Very high	166 Å²	166	33 Å²	33	63%	0.626	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.7	173.3	-65.7	174.9	-172.7	151.1	3.8	113.9	E433 V436 A437 T438 D442	E433-R440 IonicContact OE1-NH1 3.76Å; V436-R440 VanDerWaalsContact CG1-NH2 3.25Å; V436-R440 WeakPolarHBondContact O-CG 3.47Å; V436-R440 PolarHBondContact O-N 3.41Å; V436-R440 VanDerWaalsContact O-N 3.16Å; A437-R440 CarbonylContact O-C 3.57Å; A437-R440 PolarHBondContact O-N 3.39Å; T438-R440 PolarHBondContact O-N 2.95Å; R440-D442 HydrophobicContact CB-CB 4.45Å; R440-D442 PolarHBondContact O-N 2.71Å
441	N	94.9	Very high	94.8	Very high	76 Å²	76	32.4 Å²	32.4	41%	0.406	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	32.8	-173.3	-163.8	39.4	0	0	0	113.5	A437 T438 A439 I443 S474	A437-N441 PolarHBondContact O-N 3.44Å; A437-N441 VanDerWaalsContact O-N 3.12Å; T438-N441 WeakPolarHBondContact O-CA 3.14Å; T438-N441 PolarHBondContact O-N 2.89Å; A439-N441 VanDerWaalsContact C-N 3.35Å; N441-I443 PolarHBondContact O-N 3Å; N441-S474 VanDerWaalsContact OD1-CB 3.29Å; N441-S474 WeakPolarHBondContact OD1-CB 3.26Å
442	D	96.8	Very high	94.7	Very high	73 Å²	73	32.7 Å²	32.7	39%	0.39	18%	0.176	S	C	.	.			trans	-90.7	89.8	179.5	-174.3	-23.6	0	0	0	110.1	A437 R440 P444 A445 M446	A437-D442 PolarHBondContact O-N 3.14Å; R440-D442 HydrophobicContact CB-CB 4.45Å; R440-D442 PolarHBondContact O-N 2.71Å; D442-P444 VanDerWaalsContact OD1-CD 3.29Å; D442-P444 WeakPolarHBondContact OD1-CD 3.47Å; D442-A445 HydrophobicContact CB-CB 3.89Å; D442-A445 PolarHBondContact O-N 2.97Å; D442-A445 WeakPolarHBondContact OD1-CB 3.36Å; D442-A445 PolarHBondContact OD1-N 2.79Å; D442-M446 VanDerWaalsContact O-CG 3.28Å; D442-M446 WeakPolarHBondContact O-CG 3.38Å; D442-M446 PolarHBondContact O-N 2.77Å
443	I	96.6	Very high	94.5	Very high	7 Å²	7	31 Å²	31	4%	0.036	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-46.5	-175.7	-56.8	-54.8	0	0	0	112.7	L344 L347 L348 N441 A445 M446 F447 I476 A477 L480	L344-I443 HydrophobicContact CD1-CG2 3.64Å; L347-I443 HydrophobicContact CB-CB 4.44Å; L347-I443 HydrophobicContact CB-CG2 4.2Å; L347-I443 HydrophobicContact CD1-CB 4.32Å; L347-I443 HydrophobicContact CD1-CG1 3.78Å; L348-I443 HydrophobicContact CD2-CG2 4.19Å; L348-I443 HydrophobicContact CG-CG2 4.26Å; N441-I443 PolarHBondContact O-N 3Å; I443-A445 PolarHBondContact O-N 3.28Å; I443-M446 HydrophobicContact CD1-SD 3.78Å; I443-M446 PolarHBondContact O-N 3.45Å; I443-F447 WeakPolarHBondContact O-CB 3.36Å; I443-F447 PolarHBondContact O-N 3Å; I443-I476 HydrophobicContact CD1-CG2 4.36Å; I443-I476 HydrophobicContact CG1-CG2 4.43Å; I443-A477 HydrophobicContact CD1-CB 3.78Å; I443-L480 HydrophobicContact CG2-CD2 4.09Å
444	P	96.3	Very high	94.4	Very high	44 Å²	44	28.2 Å²	28.2	29%	0.286	16%	0.159	S	C	.	.	H	α-helix	trans	-59.8	-40	173.4	-27.1	36.2	0	0	0	114.4	I352 D442 F447 T448	I352-P444 HydrophobicContact CG2-CB 4.29Å; D442-P444 VanDerWaalsContact OD1-CD 3.29Å; D442-P444 WeakPolarHBondContact OD1-CD 3.47Å; P444-F447 PolarHBondContact O-N 2.73Å; P444-T448 WeakPolarHBondContact O-CB 3.39Å; P444-T448 PolarHBondContact O-N 2.68Å; P444-T448 PolarHBondContact O-OG1 3.27Å
445	A	95.9	Very high	94.2	Very high	24 Å²	24	30.9 Å²	30.9	20%	0.198	18%	0.178	C	C	.	.	H	α-helix	trans	-68.7	-42.3	177.2	0	0	0	0	0	111.8	A437 D442 I443 F447 T448 A449	A437-A445 HydrophobicContact CB-CB 3.76Å; D442-A445 HydrophobicContact CB-CB 3.89Å; D442-A445 PolarHBondContact O-N 2.97Å; D442-A445 WeakPolarHBondContact OD1-CB 3.36Å; D442-A445 PolarHBondContact OD1-N 2.79Å; I443-A445 PolarHBondContact O-N 3.28Å; A445-F447 VanDerWaalsContact C-N 3.33Å; A445-F447 PolarHBondContact O-N 3.04Å; A445-T448 WeakPolarHBondContact O-CB 3.41Å; A445-T448 PolarHBondContact O-N 2.51Å; A445-T448 VanDerWaalsContact O-N 3.15Å; A445-A449 PolarHBondContact O-N 2.78Å
446	M	97.4	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.4	-49.9	171.9	-70.2	170.8	66.5	0	0	110.8	L434 A437 T438 D442 I443 T448 A449 I450 A477 L480 L481	L434-M446 HydrophobicContact CD1-CB 3.94Å; L434-M446 HydrophobicContact CD1-CG 4.26Å; A437-M446 HydrophobicContact CB-CB 4.49Å; A437-M446 HydrophobicContact CB-CG 3.82Å; T438-M446 HydrophobicContact CG2-CE 3.9Å; T438-M446 HydrophobicContact CG2-SD 4.24Å; T438-M446 WeakPolarHBondContact OG1-CE 3.48Å; D442-M446 VanDerWaalsContact O-CG 3.28Å; D442-M446 WeakPolarHBondContact O-CG 3.38Å; D442-M446 PolarHBondContact O-N 2.77Å; I443-M446 HydrophobicContact CD1-SD 3.78Å; I443-M446 PolarHBondContact O-N 3.45Å; M446-T448 VanDerWaalsContact C-N 3.3Å; M446-T448 PolarHBondContact O-N 3.34Å; M446-A449 PolarHBondContact O-N 3.34Å; M446-I450 WeakPolarHBondContact O-CG1 3.27Å; M446-I450 PolarHBondContact O-N 3.2Å; M446-A477 HydrophobicContact CE-CB 3.84Å; M446-A477 HydrophobicContact SD-CB 3.95Å; M446-L480 HydrophobicContact CB-CD2 3.88Å; M446-L480 HydrophobicContact CE-CD2 4.25Å; M446-L481 HydrophobicContact CE-CD1 4.03Å; M446-L481 HydrophobicContact CE-CD2 4.08Å; M446-L481 HydrophobicContact CE-CG 3.79Å
447	F	96.9	Very high	94	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.013	18%	0.182	C	C	.	.	H	α-helix	trans	-60.9	-40.5	178.1	-172.5	-83.4	0	0	0	111.6	N286 M287 L348 V353 I356 Y357 I443 P444 A445 A449 I450 A451 L480	N286-F447 WeakPolarHBondContact O-CE2 3.37Å; M287-F447 WeakPolarHBondContact O-CE2 3.19Å; M287-F447 WeakPolarHBondContact O-CZ 3.26Å; L348-F447 HydrophobicContact CD1-CD2 3.6Å; L348-F447 HydrophobicContact CD1-CE2 4.08Å; L348-F447 HydrophobicContact CD1-CG 4.24Å; L348-F447 HydrophobicContact CD2-CB 3.86Å; L348-F447 HydrophobicContact CD2-CD2 4.2Å; L348-F447 HydrophobicContact CD2-CG 3.99Å; V353-F447 HydrophobicContact CB-CE1 4.32Å; V353-F447 HydrophobicContact CG1-CE1 3.79Å; V353-F447 HydrophobicContact CG1-CZ 3.85Å; V353-F447 HydrophobicContact CG2-CD1 4.47Å; V353-F447 HydrophobicContact CG2-CE1 3.93Å; V353-F447 HydrophobicContact CG2-CZ 3.95Å; I356-F447 HydrophobicContact CD1-CD1 3.68Å; I356-F447 HydrophobicContact CD1-CE1 4.35Å; Y357-F447 HydrophobicContact CD2-CE1 4.47Å; Y357-F447 AromaticContact CE2-CE1 3.79Å; Y357-F447 HydrophobicContact CE2-CE1 3.79Å; Y357-F447 HydrophobicContact CE2-CZ 4.01Å; I443-F447 WeakPolarHBondContact O-CB 3.36Å; I443-F447 PolarHBondContact O-N 3Å; P444-F447 PolarHBondContact O-N 2.73Å; A445-F447 VanDerWaalsContact C-N 3.33Å; A445-F447 PolarHBondContact O-N 3.04Å; F447-A449 VanDerWaalsContact C-N 3.34Å; F447-A449 PolarHBondContact O-N 3.38Å; F447-I450 PolarHBondContact O-N 3.42Å; F447-A451 HydrophobicContact CD1-CB 4.25Å; F447-A451 HydrophobicContact CE1-CB 4.04Å; F447-A451 WeakPolarHBondContact O-CB 3.41Å; F447-A451 PolarHBondContact O-N 3.46Å; F447-L480 HydrophobicContact CB-CD2 4.22Å; F447-L480 HydrophobicContact CD2-CD1 3.94Å
448	T	95.2	Very high	93.7	Very high	43 Å²	43	32.9 Å²	32.9	26%	0.264	19%	0.189	S	C	.	.	H	α-helix	trans	-60.3	-43	177.2	-59.1	0	0	0	0	111.7	I356 F393 P444 A445 M446 S452	I356-T448 WeakPolarHBondContact CD1-OG1 3.49Å; I356-T448 HydrophobicContact CG2-CG2 4.24Å; F393-T448 HydrophobicContact CE2-CG2 4.26Å; P444-T448 WeakPolarHBondContact O-CB 3.39Å; P444-T448 PolarHBondContact O-N 2.68Å; P444-T448 PolarHBondContact O-OG1 3.27Å; A445-T448 WeakPolarHBondContact O-CB 3.41Å; A445-T448 PolarHBondContact O-N 2.51Å; A445-T448 VanDerWaalsContact O-N 3.15Å; M446-T448 VanDerWaalsContact C-N 3.3Å; M446-T448 PolarHBondContact O-N 3.34Å; T448-S452 VanDerWaalsContact O-CB 3.32Å; T448-S452 WeakPolarHBondContact O-CB 3.2Å; T448-S452 PolarHBondContact O-N 2.95Å; T448-S452 PolarHBondContact O-OG 3.34Å
449	A	94.7	Very high	93.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-47.1	176.5	0	0	0	0	0	111.6	F393 L434 A445 M446 F447 A451 S452 G453 A454	F393-A449 HydrophobicContact CE2-CB 4.32Å; F393-A449 HydrophobicContact CZ-CB 4.15Å; L434-A449 HydrophobicContact CB-CB 3.8Å; L434-A449 HydrophobicContact CD1-CB 4.37Å; A445-A449 PolarHBondContact O-N 2.78Å; M446-A449 PolarHBondContact O-N 3.34Å; F447-A449 VanDerWaalsContact C-N 3.34Å; F447-A449 PolarHBondContact O-N 3.38Å; A449-A451 PolarHBondContact O-N 3.35Å; A449-S452 WeakPolarHBondContact O-CB 3.44Å; A449-S452 PolarHBondContact O-N 3.28Å; A449-G453 PolarHBondContact O-N 3.43Å; A449-G453 VanDerWaalsContact O-N 3.1Å; A449-A454 HydrophobicContact CB-CB 4.1Å; A449-A454 VanDerWaalsContact O-CB 3.23Å; A449-A454 WeakPolarHBondContact O-CB 3.22Å; A449-A454 PolarHBondContact O-N 2.98Å
450	I	94.3	Very high	92.9	Very high	17 Å²	17	36 Å²	36	9%	0.087	20%	0.198	C	C	.	.	H	α-helix	trans	-59.7	-49	176	-64.9	168.4	0	0	0	110.8	L434 M446 F447 S452 G453 V456 L480 L481 N484	L434-I450 HydrophobicContact CD1-CD1 4.06Å; L434-I450 HydrophobicContact CD1-CG1 3.81Å; L434-I450 HydrophobicContact CD2-CG1 3.94Å; M446-I450 WeakPolarHBondContact O-CG1 3.27Å; M446-I450 PolarHBondContact O-N 3.2Å; F447-I450 PolarHBondContact O-N 3.42Å; I450-S452 PolarHBondContact O-N 3.41Å; I450-G453 PolarHBondContact O-N 3.01Å; I450-V456 HydrophobicContact CG1-CG2 4.37Å; I450-L480 HydrophobicContact CD1-CD1 4.46Å; I450-L480 HydrophobicContact CD1-CD2 4.34Å; I450-L480 HydrophobicContact CD1-CG 4.09Å; I450-L481 HydrophobicContact CD1-CD2 4.37Å; I450-N484 HydrophobicContact CD1-CB 4.35Å; I450-N484 HydrophobicContact CG2-CB 4.13Å
451	A	92.4	Very high	92.1	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	20%	0.199	C	C	.	.	H	α-helix	trans	-58.7	-33.9	178.2	0	0	0	0	0	112.1	I356 Y357 R387 M390 F447 A449	I356-A451 HydrophobicContact CG2-CB 3.88Å; Y357-A451 HydrophobicContact CE1-CB 4Å; Y357-A451 HydrophobicContact CE2-CB 3.94Å; Y357-A451 WeakPolarHBondContact OH-CB 3.28Å; R387-A451 WeakPolarHBondContact CD-O 3.2Å; R387-A451 PolarHBondContact NE-O 3.04Å; M390-A451 HydrophobicContact CE-CB 4.19Å; M390-A451 HydrophobicContact SD-CB 4.38Å; F447-A451 HydrophobicContact CD1-CB 4.25Å; F447-A451 HydrophobicContact CE1-CB 4.04Å; F447-A451 WeakPolarHBondContact O-CB 3.41Å; F447-A451 PolarHBondContact O-N 3.46Å; A449-A451 PolarHBondContact O-N 3.35Å
452	S	89.9	Confident	91.2	Very high	10 Å²	10	32.3 Å²	32.3	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-76.5	-23.7	178.7	-59.2	0	0	0	0	113.5	R387 M390 F393 Q430 T448 A449 I450	R387-S452 VanDerWaalsContact NH1-C 3.29Å; R387-S452 PolarHBondContact NH1-O 3.05Å; M390-S452 WeakPolarHBondContact CE-OG 3.38Å; F393-S452 WeakPolarHBondContact CD2-OG 3.05Å; Q430-S452 PolarHBondContact NE2-O 2.89Å; Q430-S452 PolarHBondContact OE1-O 3.34Å; T448-S452 VanDerWaalsContact O-CB 3.32Å; T448-S452 WeakPolarHBondContact O-CB 3.2Å; T448-S452 PolarHBondContact O-N 2.95Å; T448-S452 PolarHBondContact O-OG 3.34Å; A449-S452 WeakPolarHBondContact O-CB 3.44Å; A449-S452 PolarHBondContact O-N 3.28Å; I450-S452 PolarHBondContact O-N 3.41Å
453	G	87.7	Confident	89.8	Confident	16 Å²	16	30.6 Å²	30.6	17%	0.165	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	126.2	11.8	178.2	0	0	0	0	0	117.2	Q430 A449 I450 S455	Q430-G453 VanDerWaalsContact OE1-CA 3.27Å; A449-G453 PolarHBondContact O-N 3.43Å; A449-G453 VanDerWaalsContact O-N 3.1Å; I450-G453 PolarHBondContact O-N 3.01Å; G453-S455 PolarHBondContact O-N 3.38Å
454	A	91.1	Very high	88.6	Confident	9 Å²	9	33.7 Å²	33.7	7%	0.074	22%	0.223	C	C	.	.			trans	-51.6	132.9	174.2	0	0	0	0	0	111.2	Q430 L434 A449 V456	Q430-A454 HydrophobicContact CB-CB 4.13Å; Q430-A454 WeakPolarHBondContact O-CB 3.26Å; L434-A454 HydrophobicContact CB-CB 3.89Å; L434-A454 HydrophobicContact CD2-CB 3.89Å; L434-A454 HydrophobicContact CG-CB 4.5Å; A449-A454 HydrophobicContact CB-CB 4.1Å; A449-A454 VanDerWaalsContact O-CB 3.23Å; A449-A454 WeakPolarHBondContact O-CB 3.22Å; A449-A454 PolarHBondContact O-N 2.98Å; A454-V456 PolarHBondContact O-N 3.47Å
455	S	90.8	Very high	87.5	Confident	56 Å²	56	35.4 Å²	35.4	39%	0.392	23%	0.227	S	C	.	.			trans	-73.7	115.8	168.6	179.3	0	0	0	0	108.4	S431 G453 N457 C458	S431-S455 PolarHBondContact OG-N 3.44Å; G453-S455 PolarHBondContact O-N 3.38Å; S455-N457 PolarHBondContact O-N 2.92Å; S455-C458 PolarHBondContact O-N 3.29Å; S455-C458 PolarHBondContact O-SG 2.91Å
456	V	91.2	Very high	87.1	Confident	15 Å²	15	34.3 Å²	34.3	9%	0.091	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-29.5	-175.5	-177.8	0	0	0	0	112.2	L434 I450 A454 L481 N484 A486	L434-V456 HydrophobicContact CD2-CG2 4.48Å; I450-V456 HydrophobicContact CG1-CG2 4.37Å; A454-V456 PolarHBondContact O-N 3.47Å; V456-L481 HydrophobicContact CG1-CB 4.4Å; V456-L481 HydrophobicContact CG1-CD2 3.93Å; V456-N484 HydrophobicContact CG2-CB 4.13Å; V456-A486 HydrophobicContact CG1-CB 3.58Å
457	N	92.5	Very high	86.9	Confident	65 Å²	65	34.3 Å²	34.3	35%	0.348	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	19.1	-178.9	-64.1	-41.9	0	0	0	112.9	S455 G485 A486 D487	S455-N457 PolarHBondContact O-N 2.92Å; N457-G485 PolarHBondContact ND2-O 3.45Å; N457-A486 VanDerWaalsContact OD1-CA 3.28Å; N457-A486 WeakPolarHBondContact OD1-CA 3.33Å; N457-D487 PolarHBondContact OD1-N 3.45Å
458	C	89.6	Confident	86.8	Confident	22 Å²	22	34.2 Å²	34.2	15%	0.149	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-68.1	146.3	171.8	70.3	0	0	0	0	110.7	S431 S455 T467	S431-C458 WeakPolarHBondContact CB-SG 3.49Å; S455-C458 PolarHBondContact O-N 3.29Å; S455-C458 PolarHBondContact O-SG 2.91Å; C458-T467 VanDerWaalsContact O-CA 3.24Å; C458-T467 WeakPolarHBondContact O-CA 3.41Å; C458-T467 WeakPolarHBondContact O-CB 3.34Å; C458-T467 WeakPolarHBondContact O-CG2 3.33Å
459	H	87.3	Confident	86.9	Confident	91 Å²	91	32.2 Å²	32.2	42%	0.421	21%	0.206	S	C	.	.	B	Isolated β-bridge	trans	-85.1	150	164.6	-66.1	74	0	0	0	110.4	G466 Q491	H459-G466 CarbonylContact C-O 3.56Å; H459-G466 WeakPolarHBondContact CA-O 3.45Å; H459-Q491 PolarHBondContact NE2-O 2.66Å; H459-Q491 VanDerWaalsContact NE2-O 3.15Å
460	S	84.7	Confident	86.9	Confident	17 Å²	17	32.9 Å²	32.9	12%	0.119	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-56.6	149	170.3	178.1	0	0	0	0	111	D462 G463 G466	S460-D462 WeakPolarHBondContact CB-OD1 3.26Å; S460-D462 PolarHBondContact O-N 3.48Å; S460-D462 PolarHBondContact OG-OD1 2.92Å; S460-G463 WeakPolarHBondContact O-CA 3.39Å; S460-G463 PolarHBondContact O-N 2.96Å; S460-G466 PolarHBondContact N-O 3.31Å
461	A	77.8	Confident	86.8	Confident	80 Å²	80	34 Å²	34	66%	0.661	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.9	-178.6	0	0	0	0	0	113.5	G463	A461-G463 VanDerWaalsContact C-N 3.26Å
462	D	75.2	Confident	86.8	Confident	85 Å²	85	34.1 Å²	34.1	46%	0.455	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-8.7	174.6	62.9	-3.6	0	0	0	113.3	S460 S464 Q465	S460-D462 WeakPolarHBondContact CB-OD1 3.26Å; S460-D462 PolarHBondContact O-N 3.48Å; S460-D462 PolarHBondContact OG-OD1 2.92Å; D462-S464 PolarHBondContact O-N 3.19Å; D462-S464 PolarHBondContact OD1-N 3.28Å; D462-S464 PolarHBondContact OD1-OG 3.26Å; D462-S464 PolarHBondContact OD2-OG 3.42Å; D462-Q465 PolarHBondContact OD1-N 3.3Å; D462-Q465 PolarHBondContact OD2-NE2 2.95Å
463	G	69.3	Low	86.6	Confident	36 Å²	36	40.8 Å²	40.8	37%	0.371	24%	0.242	S	C	.	.	S	Bend	trans	68.2	-20.5	-177.5	0	0	0	0	0	115	S460 A461	S460-G463 WeakPolarHBondContact O-CA 3.39Å; S460-G463 PolarHBondContact O-N 2.96Å; A461-G463 VanDerWaalsContact C-N 3.26Å
464	S	70.2	Confident	86.8	Confident	72 Å²	72	41.1 Å²	41.1	50%	0.503	24%	0.242	S	C	.	.	S	Bend	trans	-80.3	-31.7	-174.4	65.5	0	0	0	0	112.9	D462 G466	D462-S464 PolarHBondContact O-N 3.19Å; D462-S464 PolarHBondContact OD1-N 3.28Å; D462-S464 PolarHBondContact OD1-OG 3.26Å; D462-S464 PolarHBondContact OD2-OG 3.42Å; S464-G466 VanDerWaalsContact C-N 3.3Å; S464-G466 PolarHBondContact O-N 3.06Å
465	Q	73.1	Confident	86.9	Confident	81 Å²	81	41.8 Å²	41.8	38%	0.379	25%	0.247	S	C	.	.	S	Bend	trans	-83.3	-2.9	-175.9	-71.8	-175.1	13.8	0	0	114.2	D462 Q471	D462-Q465 PolarHBondContact OD1-N 3.3Å; D462-Q465 PolarHBondContact OD2-NE2 2.95Å; Q465-Q471 PolarHBondContact O-NE2 3.38Å
466	G	88.8	Confident	87.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.237	C	C	.	.			trans	64.6	-150.4	-177.9	0	0	0	0	0	112.9	H459 S460 S464	H459-G466 CarbonylContact C-O 3.56Å; H459-G466 WeakPolarHBondContact CA-O 3.45Å; S460-G466 PolarHBondContact N-O 3.31Å; S464-G466 VanDerWaalsContact C-N 3.3Å; S464-G466 PolarHBondContact O-N 3.06Å
467	T	93.3	Very high	87.4	Confident	1 Å²	1	40 Å²	40	1%	0.006	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-88.3	172.4	179.1	68.9	0	0	0	0	112.6	C458 L469 H470 Q471 A490	C458-T467 VanDerWaalsContact O-CA 3.24Å; C458-T467 WeakPolarHBondContact O-CA 3.41Å; C458-T467 WeakPolarHBondContact O-CB 3.34Å; C458-T467 WeakPolarHBondContact O-CG2 3.33Å; T467-L469 PolarHBondContact O-N 3.29Å; T467-L469 VanDerWaalsContact O-N 3.14Å; T467-L469 PolarHBondContact OG1-N 3.16Å; T467-H470 PolarHBondContact N-ND1 2.99Å; T467-H470 VanDerWaalsContact N-ND1 3.11Å; T467-H470 WeakPolarHBondContact O-CB 3.43Å; T467-H470 PolarHBondContact O-N 3.46Å; T467-H470 PolarHBondContact OG1-ND1 3.39Å; T467-Q471 PolarHBondContact O-N 2.91Å; T467-A490 HydrophobicContact CG2-CB 4.24Å
468	A	94.7	Very high	87.6	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-35.3	172.9	0	0	0	0	0	112.3	L434 I435 T438 H470 Q471 S472 L481	L434-A468 HydrophobicContact CD2-CB 4.15Å; L434-A468 HydrophobicContact CG-CB 3.87Å; I435-A468 HydrophobicContact CG1-CB 4.05Å; T438-A468 VanDerWaalsContact CG2-O 3.22Å; T438-A468 WeakPolarHBondContact CG2-O 3.29Å; A468-H470 VanDerWaalsContact C-N 3.33Å; A468-H470 PolarHBondContact O-N 3.41Å; A468-Q471 PolarHBondContact O-N 3.29Å; A468-Q471 VanDerWaalsContact O-N 3.16Å; A468-S472 PolarHBondContact O-N 3.04Å; A468-L481 HydrophobicContact CB-CD1 4.21Å; A468-L481 HydrophobicContact CB-CD2 4.03Å
469	L	96.1	Very high	87.9	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.01	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-40.2	177.2	-169.9	66	0	0	0	112	T467 Q471 S472 C478 L481 D487 L498	T467-L469 PolarHBondContact O-N 3.29Å; T467-L469 VanDerWaalsContact O-N 3.14Å; T467-L469 PolarHBondContact OG1-N 3.16Å; L469-Q471 PolarHBondContact O-N 2.93Å; L469-S472 WeakPolarHBondContact O-CB 3.24Å; L469-S472 PolarHBondContact O-N 3.49Å; L469-C478 HydrophobicContact CD1-CB 4.18Å; L469-L481 HydrophobicContact CB-CD1 4.34Å; L469-L481 HydrophobicContact CD1-CB 4.32Å; L469-L481 HydrophobicContact CD1-CD1 4.08Å; L469-D487 WeakPolarHBondContact CD2-O 3.41Å; L469-L498 HydrophobicContact CD1-CD2 3.81Å; L469-L498 HydrophobicContact CG-CB 4.33Å; L469-L498 HydrophobicContact CG-CD2 3.78Å; L469-L498 WeakPolarHBondContact O-CD1 3.42Å; L469-L498 WeakPolarHBondContact O-CD2 3.48Å
470	H	94.6	Very high	88.4	Confident	13 Å²	13	31.6 Å²	31.6	6%	0.06	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.4	177.7	-65.5	85.6	0	0	0	113	T467 A468 S472 A490 D492 K496 Y501	T467-H470 PolarHBondContact N-ND1 2.99Å; T467-H470 VanDerWaalsContact N-ND1 3.11Å; T467-H470 WeakPolarHBondContact O-CB 3.43Å; T467-H470 PolarHBondContact O-N 3.46Å; T467-H470 PolarHBondContact OG1-ND1 3.39Å; A468-H470 VanDerWaalsContact C-N 3.33Å; A468-H470 PolarHBondContact O-N 3.41Å; H470-S472 VanDerWaalsContact C-N 3.29Å; H470-A490 PolarHBondContact CE1-O 2.93Å; H470-A490 PolarHBondContact NE2-O 3.41Å; H470-D492 PolarHBondContact NE2-N 3.14Å; H470-K496 PolarHBondContact NE2-O 3.25Å; H470-Y501 AromaticContact CD2-CE2 3.82Å
471	Q	92.7	Very high	89	Confident	42 Å²	42	30.8 Å²	30.8	20%	0.196	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-8.1	176.8	-63.5	-52.4	-45.2	0	0	113.7	I435 T438 A439 Q465 T467 A468 L469 K473	I435-Q471 HydrophobicContact CG2-CG 3.7Å; T438-Q471 HydrophobicContact CG2-CB 4.35Å; A439-Q471 HydrophobicContact CB-CB 4.24Å; Q465-Q471 PolarHBondContact O-NE2 3.38Å; T467-Q471 PolarHBondContact O-N 2.91Å; A468-Q471 PolarHBondContact O-N 3.29Å; A468-Q471 VanDerWaalsContact O-N 3.16Å; L469-Q471 PolarHBondContact O-N 2.93Å; Q471-K473 PolarHBondContact O-N 3.26Å
472	S	92.8	Very high	89.9	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.021	16%	0.159	C	C	.	.			trans	-74	124.2	-177.1	-173.4	0	0	0	0	111.5	A468 L469 H470 S474 A477 C478	A468-S472 PolarHBondContact O-N 3.04Å; L469-S472 WeakPolarHBondContact O-CB 3.24Å; L469-S472 PolarHBondContact O-N 3.49Å; H470-S472 VanDerWaalsContact C-N 3.29Å; S472-S474 PolarHBondContact OG-O 3.1Å; S472-S474 VanDerWaalsContact OG-O 3.06Å; S472-A477 WeakPolarHBondContact OG-CB 3.45Å; S472-C478 VanDerWaalsContact CB-SG 3.54Å; S472-C478 PolarHBondContact OG-N 3.16Å; S472-C478 PolarHBondContact OG-SG 3.21Å
473	K	86	Confident	90.8	Very high	150 Å²	150	24.9 Å²	24.9	65%	0.652	14%	0.141	S	C	*	.			trans	-104.1	-5.8	175.5	-60.1	178.1	-176.2	174.8	0	113	Q471	Q471-K473 PolarHBondContact O-N 3.26Å
474	S	91.1	Very high	91.9	Very high	24 Å²	24	25.2 Å²	25.2	17%	0.168	13%	0.134	C	C	.	.	S	Bend	trans	-123.6	139.8	-174.9	180	0	0	0	0	111.1	N441 S472 I476 A477 C478	N441-S474 VanDerWaalsContact OD1-CB 3.29Å; N441-S474 WeakPolarHBondContact OD1-CB 3.26Å; S472-S474 PolarHBondContact OG-O 3.1Å; S472-S474 VanDerWaalsContact OG-O 3.06Å; S474-I476 PolarHBondContact O-N 3.31Å; S474-I476 PolarHBondContact OG-N 3.47Å; S474-A477 PolarHBondContact O-N 3.22Å; S474-C478 PolarHBondContact O-N 2.86Å; S474-C478 PolarHBondContact O-SG 3.42Å
475	A	93.1	Very high	92.9	Very high	23 Å²	23	23.9 Å²	23.9	19%	0.19	13%	0.131	C	C	.	.	H	α-helix	trans	-57.8	-32.2	172.1	0	0	0	0	0	112.1	E340 C478 E479 F513	E340-A475 HydrophobicContact CG-CB 3.95Å; A475-C478 WeakPolarHBondContact O-CB 3.29Å; A475-C478 PolarHBondContact O-N 3.34Å; A475-E479 WeakPolarHBondContact O-CB 3.4Å; A475-E479 PolarHBondContact O-N 2.96Å; A475-F513 HydrophobicContact CB-CB 4.11Å; A475-F513 HydrophobicContact CB-CD1 4.25Å; A475-F513 HydrophobicContact CB-CD2 3.77Å; A475-F513 HydrophobicContact CB-CE2 4.25Å; A475-F513 HydrophobicContact CB-CG 3.76Å; A475-F513 WeakPolarHBondContact O-CZ 3.48Å
476	I	94.9	Very high	93.9	Very high	34 Å²	34	20.5 Å²	20.5	17%	0.174	12%	0.117	C	C	.	.	H	α-helix	trans	-72.4	-42.1	-179.2	-55.4	154.3	0	0	0	111.2	Q343 L344 L347 I443 S474 C478 E479 L480	Q343-I476 HydrophobicContact CB-CD1 4.32Å; Q343-I476 HydrophobicContact CB-CG1 4.3Å; Q343-I476 HydrophobicContact CG-CD1 3.42Å; Q343-I476 VanDerWaalsContact CG-CD1 3.42Å; Q343-I476 HydrophobicContact CG-CG1 3.93Å; L344-I476 HydrophobicContact CB-CG2 4.17Å; L344-I476 HydrophobicContact CD1-CG2 4.25Å; L347-I476 HydrophobicContact CD1-CD1 4.41Å; L347-I476 HydrophobicContact CD1-CG2 3.87Å; I443-I476 HydrophobicContact CD1-CG2 4.36Å; I443-I476 HydrophobicContact CG1-CG2 4.43Å; S474-I476 PolarHBondContact O-N 3.31Å; S474-I476 PolarHBondContact OG-N 3.47Å; I476-C478 VanDerWaalsContact C-N 3.33Å; I476-E479 PolarHBondContact O-N 3.47Å; I476-L480 PolarHBondContact O-N 3.18Å
477	A	96.8	Very high	94.2	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.6	-42.6	173.7	0	0	0	0	0	110.8	I443 M446 S472 S474 E479 L480 L481	I443-A477 HydrophobicContact CD1-CB 3.78Å; M446-A477 HydrophobicContact CE-CB 3.84Å; M446-A477 HydrophobicContact SD-CB 3.95Å; S472-A477 WeakPolarHBondContact OG-CB 3.45Å; S474-A477 PolarHBondContact O-N 3.22Å; A477-E479 VanDerWaalsContact C-N 3.34Å; A477-E479 PolarHBondContact O-N 2.89Å; A477-L480 PolarHBondContact O-N 3.17Å; A477-L481 WeakPolarHBondContact O-CG 3.48Å; A477-L481 PolarHBondContact O-N 3.3Å
478	C	96.8	Very high	94.3	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-45.5	172.1	-59.8	0	0	0	0	111.4	L469 S472 S474 A475 I476 L480 L481 L482 L498 F513	L469-C478 HydrophobicContact CD1-CB 4.18Å; S472-C478 VanDerWaalsContact CB-SG 3.54Å; S472-C478 PolarHBondContact OG-N 3.16Å; S472-C478 PolarHBondContact OG-SG 3.21Å; S474-C478 PolarHBondContact O-N 2.86Å; S474-C478 PolarHBondContact O-SG 3.42Å; A475-C478 WeakPolarHBondContact O-CB 3.29Å; A475-C478 PolarHBondContact O-N 3.34Å; I476-C478 VanDerWaalsContact C-N 3.33Å; C478-L480 VanDerWaalsContact C-N 3.33Å; C478-L480 PolarHBondContact O-N 2.94Å; C478-L481 PolarHBondContact O-N 3Å; C478-L481 VanDerWaalsContact O-N 3.14Å; C478-L482 WeakPolarHBondContact O-CB 3.39Å; C478-L482 VanDerWaalsContact O-CG 3.26Å; C478-L482 WeakPolarHBondContact O-CG 3.42Å; C478-L482 PolarHBondContact O-N 2.84Å; C478-L498 VanDerWaalsContact SG-CD2 3.51Å; C478-F513 HydrophobicContact CB-CD1 4.2Å; C478-F513 HydrophobicContact CB-CE1 3.41Å; C478-F513 VanDerWaalsContact CB-CE1 3.41Å; C478-F513 HydrophobicContact CB-CZ 4.01Å
479	E	96.5	Very high	94.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-60.5	-42.3	-178.8	-176	61.6	-179.1	0	0	112	E340 Q341 L344 A475 I476 A477 L481 L482 L483 F513 R517	E340-E479 HydrophobicContact CB-CB 4.04Å; E340-E479 HydrophobicContact CB-CG 4.09Å; Q341-E479 HydrophobicContact CG-CG 4.08Å; Q341-E479 WeakPolarHBondContact CG-OE1 3.36Å; Q341-E479 PolarHBondContact NE2-OE1 3.37Å; L344-E479 HydrophobicContact CD2-CG 4.36Å; A475-E479 WeakPolarHBondContact O-CB 3.4Å; A475-E479 PolarHBondContact O-N 2.96Å; I476-E479 PolarHBondContact O-N 3.47Å; A477-E479 VanDerWaalsContact C-N 3.34Å; A477-E479 PolarHBondContact O-N 2.89Å; E479-L481 VanDerWaalsContact C-N 3.34Å; E479-L481 PolarHBondContact O-N 3.4Å; E479-L482 PolarHBondContact O-N 2.97Å; E479-L483 HydrophobicContact CG-CD1 3.88Å; E479-L483 HydrophobicContact CG-CG 4.31Å; E479-L483 WeakPolarHBondContact O-CB 3.18Å; E479-L483 WeakPolarHBondContact O-CG 3.36Å; E479-L483 PolarHBondContact O-N 3.47Å; E479-F513 HydrophobicContact CB-CE2 4.33Å; E479-F513 HydrophobicContact CB-CZ 4.04Å; E479-F513 WeakPolarHBondContact OE2-CZ 3.4Å; E479-R517 VanDerWaalsContact CD-CZ 3.43Å; E479-R517 VanDerWaalsContact CD-NH2 3.26Å; E479-R517 IonicContact OE1-CZ 3.84Å; E479-R517 IonicContact OE1-NH1 3.95Å; E479-R517 PolarHBondContact OE1-NH1 3.05Å; E479-R517 IonicContact OE1-NH2 2.73Å; E479-R517 PolarHBondContact OE1-NH2 3.32Å; E479-R517 IonicContact OE2-CZ 2.66Å; E479-R517 IonicContact OE2-NE 3.79Å; E479-R517 IonicContact OE2-NH1 3.67Å; E479-R517 PolarHBondContact OE2-NH1 3.26Å; E479-R517 IonicContact OE2-NH2 3.53Å; E479-R517 PolarHBondContact OE2-NH2 2.8Å
480	L	97.4	Very high	94.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-59.6	-45.5	174.9	176.4	58.2	0	0	0	111.9	L344 L348 I443 M446 F447 I450 I476 A477 C478 N484	L344-L480 HydrophobicContact CD1-CB 3.83Å; L344-L480 HydrophobicContact CD1-CD1 4.22Å; L344-L480 HydrophobicContact CD1-CD2 4.45Å; L344-L480 HydrophobicContact CD1-CG 4.38Å; L344-L480 HydrophobicContact CD2-CB 4.05Å; L344-L480 HydrophobicContact CD2-CD1 4.2Å; L348-L480 HydrophobicContact CD1-CD1 4.49Å; I443-L480 HydrophobicContact CG2-CD2 4.09Å; M446-L480 HydrophobicContact CB-CD2 3.88Å; M446-L480 HydrophobicContact CE-CD2 4.25Å; F447-L480 HydrophobicContact CB-CD2 4.22Å; F447-L480 HydrophobicContact CD2-CD1 3.94Å; I450-L480 HydrophobicContact CD1-CD1 4.46Å; I450-L480 HydrophobicContact CD1-CD2 4.34Å; I450-L480 HydrophobicContact CD1-CG 4.09Å; I476-L480 PolarHBondContact O-N 3.18Å; A477-L480 PolarHBondContact O-N 3.17Å; C478-L480 VanDerWaalsContact C-N 3.33Å; C478-L480 PolarHBondContact O-N 2.94Å; L480-N484 WeakPolarHBondContact CD1-ND2 3.26Å; L480-N484 PolarHBondContact O-N 2.98Å; L480-N484 PolarHBondContact O-ND2 3.41Å
481	L	97.4	Very high	94.3	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.9	-48.2	179.9	-68.8	172	0	0	0	111.1	L434 T438 M446 I450 V456 A468 L469 A477 C478 E479 L483 N484 G485 A486	L434-L481 HydrophobicContact CD1-CD2 4.07Å; L434-L481 HydrophobicContact CD2-CD2 4.18Å; L434-L481 HydrophobicContact CG-CD2 4.37Å; T438-L481 HydrophobicContact CG2-CD1 4.13Å; M446-L481 HydrophobicContact CE-CD1 4.03Å; M446-L481 HydrophobicContact CE-CD2 4.08Å; M446-L481 HydrophobicContact CE-CG 3.79Å; I450-L481 HydrophobicContact CD1-CD2 4.37Å; V456-L481 HydrophobicContact CG1-CB 4.4Å; V456-L481 HydrophobicContact CG1-CD2 3.93Å; A468-L481 HydrophobicContact CB-CD1 4.21Å; A468-L481 HydrophobicContact CB-CD2 4.03Å; L469-L481 HydrophobicContact CB-CD1 4.34Å; L469-L481 HydrophobicContact CD1-CB 4.32Å; L469-L481 HydrophobicContact CD1-CD1 4.08Å; A477-L481 WeakPolarHBondContact O-CG 3.48Å; A477-L481 PolarHBondContact O-N 3.3Å; C478-L481 PolarHBondContact O-N 3Å; C478-L481 VanDerWaalsContact O-N 3.14Å; E479-L481 VanDerWaalsContact C-N 3.34Å; E479-L481 PolarHBondContact O-N 3.4Å; L481-L483 PolarHBondContact O-N 2.85Å; L481-N484 CarbonylContact O-C 3.55Å; L481-N484 VanDerWaalsContact O-C 3.32Å; L481-N484 WeakPolarHBondContact O-CA 3.26Å; L481-N484 PolarHBondContact O-N 2.93Å; L481-G485 PolarHBondContact O-N 3.41Å; L481-G485 VanDerWaalsContact O-N 3.15Å; L481-A486 HydrophobicContact CB-CB 3.73Å; L481-A486 VanDerWaalsContact O-CB 3.26Å; L481-A486 WeakPolarHBondContact O-CB 3.42Å; L481-A486 PolarHBondContact O-N 3.24Å
482	L	96.2	Very high	94.3	Very high	28 Å²	28	28.4 Å²	28.4	15%	0.147	16%	0.161	C	C	.	.	H	α-helix	trans	-62.8	-40.8	178	-67.4	173.5	0	0	0	111.8	K328 C478 E479 N484 G485 A486 I488 F513 R517	K328-L482 PolarHBondContact NZ-O 3.09Å; C478-L482 WeakPolarHBondContact O-CB 3.39Å; C478-L482 VanDerWaalsContact O-CG 3.26Å; C478-L482 WeakPolarHBondContact O-CG 3.42Å; C478-L482 PolarHBondContact O-N 2.84Å; E479-L482 PolarHBondContact O-N 2.97Å; L482-N484 PolarHBondContact O-N 3.43Å; L482-G485 PolarHBondContact O-N 2.92Å; L482-G485 VanDerWaalsContact O-N 3.08Å; L482-A486 HydrophobicContact CD2-CB 4.35Å; L482-I488 HydrophobicContact CD1-CD1 4.42Å; L482-I488 HydrophobicContact CD2-CB 3.81Å; L482-I488 HydrophobicContact CD2-CD1 4.38Å; L482-I488 HydrophobicContact CD2-CG1 4.2Å; L482-F513 HydrophobicContact CD1-CE1 3.89Å; L482-F513 HydrophobicContact CD1-CZ 4Å; L482-R517 HydrophobicContact CD1-CB 4.04Å; L482-R517 HydrophobicContact CD1-CG 3.9Å
483	L	94.8	Very high	94.2	Very high	14 Å²	14	31 Å²	31	7%	0.073	19%	0.188	C	C	.	.	H	α-helix	trans	-62.2	-23.2	173.3	-76.5	173	0	0	0	112.4	L285 N286 K328 L344 E479 L481	L285-L483 HydrophobicContact CB-CD1 4.01Å; L285-L483 HydrophobicContact CB-CD2 4.22Å; N286-L483 HydrophobicContact CB-CB 3.79Å; N286-L483 WeakPolarHBondContact CB-O 3.34Å; K328-L483 HydrophobicContact CD-CD2 3.81Å; K328-L483 WeakPolarHBondContact CD-O 3.45Å; K328-L483 WeakPolarHBondContact CE-O 3.33Å; K328-L483 VanDerWaalsContact NZ-C 3.28Å; K328-L483 PolarHBondContact NZ-O 3.35Å; L344-L483 HydrophobicContact CD2-CD1 3.58Å; E479-L483 HydrophobicContact CG-CD1 3.88Å; E479-L483 HydrophobicContact CG-CG 4.31Å; E479-L483 WeakPolarHBondContact O-CB 3.18Å; E479-L483 WeakPolarHBondContact O-CG 3.36Å; E479-L483 PolarHBondContact O-N 3.47Å; L481-L483 PolarHBondContact O-N 2.85Å
484	N	93.5	Very high	94.5	Very high	42 Å²	42	27.8 Å²	27.8	23%	0.225	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	16.8	175.3	-72.4	-76.9	0	0	0	114.2	N286 I450 V456 L480 L481 L482	N286-N484 PolarHBondContact O-ND2 3Å; I450-N484 HydrophobicContact CD1-CB 4.35Å; I450-N484 HydrophobicContact CG2-CB 4.13Å; V456-N484 HydrophobicContact CG2-CB 4.13Å; L480-N484 WeakPolarHBondContact CD1-ND2 3.26Å; L480-N484 PolarHBondContact O-N 2.98Å; L480-N484 PolarHBondContact O-ND2 3.41Å; L481-N484 CarbonylContact O-C 3.55Å; L481-N484 VanDerWaalsContact O-C 3.32Å; L481-N484 WeakPolarHBondContact O-CA 3.26Å; L481-N484 PolarHBondContact O-N 2.93Å; L482-N484 PolarHBondContact O-N 3.43Å
485	G	91.1	Very high	94.6	Very high	44 Å²	44	32.6 Å²	32.6	45%	0.454	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	22.4	170.8	0	0	0	0	0	114.7	N457 L481 L482 D487	N457-G485 PolarHBondContact ND2-O 3.45Å; L481-G485 PolarHBondContact O-N 3.41Å; L481-G485 VanDerWaalsContact O-N 3.15Å; L482-G485 PolarHBondContact O-N 2.92Å; L482-G485 VanDerWaalsContact O-N 3.08Å; G485-D487 PolarHBondContact O-N 2.86Å
486	A	94.2	Very high	94.8	Very high	10 Å²	10	32.8 Å²	32.8	8%	0.083	19%	0.188	C	C	.	.			trans	-58.6	136	166.8	0	0	0	0	0	110.7	V456 N457 L481 L482 I488	V456-A486 HydrophobicContact CG1-CB 3.58Å; N457-A486 VanDerWaalsContact OD1-CA 3.28Å; N457-A486 WeakPolarHBondContact OD1-CA 3.33Å; L481-A486 HydrophobicContact CB-CB 3.73Å; L481-A486 VanDerWaalsContact O-CB 3.26Å; L481-A486 WeakPolarHBondContact O-CB 3.42Å; L481-A486 PolarHBondContact O-N 3.24Å; L482-A486 HydrophobicContact CD2-CB 4.35Å; A486-I488 PolarHBondContact O-N 2.97Å
487	D	94.6	Very high	94.8	Very high	79 Å²	79	31.2 Å²	31.2	42%	0.422	18%	0.18	S	C	.	.			trans	-77.4	113	171.3	-179.4	6.8	0	0	0	109.3	N457 L469 G485 N489 A490	N457-D487 PolarHBondContact OD1-N 3.45Å; L469-D487 WeakPolarHBondContact CD2-O 3.41Å; G485-D487 PolarHBondContact O-N 2.86Å; D487-N489 PolarHBondContact O-N 2.91Å; D487-N489 PolarHBondContact OD1-N 2.81Å; D487-A490 HydrophobicContact CB-CB 4.19Å; D487-A490 WeakPolarHBondContact O-CB 3.45Å; D487-A490 PolarHBondContact O-N 2.9Å
488	I	95.9	Very high	94.8	Very high	23 Å²	23	31.4 Å²	31.4	12%	0.118	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.4	179.6	-166.2	165.1	0	0	0	112.6	L482 A486 L514 R517 A519	L482-I488 HydrophobicContact CD1-CD1 4.42Å; L482-I488 HydrophobicContact CD2-CB 3.81Å; L482-I488 HydrophobicContact CD2-CD1 4.38Å; L482-I488 HydrophobicContact CD2-CG1 4.2Å; A486-I488 PolarHBondContact O-N 2.97Å; I488-L514 HydrophobicContact CD1-CD2 4.42Å; I488-L514 WeakPolarHBondContact CD1-O 3.39Å; I488-L514 HydrophobicContact CG1-CD2 4.35Å; I488-R517 HydrophobicContact CD1-CB 3.43Å; I488-R517 VanDerWaalsContact CD1-CB 3.43Å; I488-A519 HydrophobicContact CD1-CB 3.87Å; I488-A519 HydrophobicContact CG1-CB 3.97Å
489	N	96.5	Very high	94.8	Very high	45 Å²	45	31.5 Å²	31.5	24%	0.241	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	15.4	-177	-66.1	-32.5	0	0	0	112.3	D487 Q491 D520 L523	D487-N489 PolarHBondContact O-N 2.91Å; D487-N489 PolarHBondContact OD1-N 2.81Å; N489-Q491 PolarHBondContact O-N 3.42Å; N489-D520 PolarHBondContact OD1-N 3.21Å; N489-L523 HydrophobicContact CB-CD1 3.83Å
490	A	94.6	Very high	94.9	Very high	10 Å²	10	31.5 Å²	31.5	8%	0.083	18%	0.182	C	C	.	.			trans	-53.8	134.8	173.5	0	0	0	0	0	109.9	T467 H470 D487 T497	T467-A490 HydrophobicContact CG2-CB 4.24Å; H470-A490 PolarHBondContact CE1-O 2.93Å; H470-A490 PolarHBondContact NE2-O 3.41Å; D487-A490 HydrophobicContact CB-CB 4.19Å; D487-A490 WeakPolarHBondContact O-CB 3.45Å; D487-A490 PolarHBondContact O-N 2.9Å; A490-T497 WeakPolarHBondContact O-CA 3.43Å
491	Q	93.3	Very high	94.8	Very high	58 Å²	58	34.8 Å²	34.8	27%	0.271	19%	0.194	S	C	.	.			trans	-107.3	137.8	175	-73.8	-172.3	-55	0	0	110	H459 N489 R495 K496 T497 V524	H459-Q491 PolarHBondContact NE2-O 2.66Å; H459-Q491 VanDerWaalsContact NE2-O 3.15Å; N489-Q491 PolarHBondContact O-N 3.42Å; Q491-R495 PolarHBondContact NE2-O 3.04Å; Q491-K496 WeakPolarHBondContact CA-O 3.46Å; Q491-T497 HydrophobicContact CG-CG2 3.82Å; Q491-V524 PolarHBondContact NE2-O 3.47Å
492	D	92.9	Very high	94.7	Very high	10 Å²	10	34.9 Å²	34.9	5%	0.053	20%	0.195	C	C	.	.			trans	-84.6	-169.8	172.6	71	4.4	0	0	0	112.5	H470 L494 R495 K496 Y501	H470-D492 PolarHBondContact NE2-N 3.14Å; D492-L494 PolarHBondContact O-N 2.99Å; D492-L494 WeakPolarHBondContact OD1-CA 3.3Å; D492-L494 WeakPolarHBondContact OD1-CB 3.25Å; D492-L494 PolarHBondContact OD1-N 3.3Å; D492-R495 PolarHBondContact O-N 3.49Å; D492-R495 PolarHBondContact OD1-N 3.37Å; D492-R495 VanDerWaalsContact OD1-N 3.17Å; D492-K496 PolarHBondContact N-O 3.3Å; D492-K496 PolarHBondContact OD1-N 3.46Å; D492-Y501 VanDerWaalsContact OD2-CE2 3.26Å; D492-Y501 WeakPolarHBondContact OD2-CE2 3.46Å; D492-Y501 VanDerWaalsContact OD2-CZ 3.31Å; D492-Y501 PolarHBondContact OD2-OH 3.43Å
493	G	90.4	Very high	94.7	Very high	57 Å²	57	33.5 Å²	33.5	59%	0.588	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-19	177.6	0	0	0	0	0	114.8	R495	G493-R495 VanDerWaalsContact C-N 3.34Å
494	L	92.5	Very high	94.7	Very high	82 Å²	82	36.9 Å²	36.9	43%	0.429	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	8.4	174.7	-59.1	178.8	0	0	0	112.1	D492 K496 I526	D492-L494 PolarHBondContact O-N 2.99Å; D492-L494 WeakPolarHBondContact OD1-CA 3.3Å; D492-L494 WeakPolarHBondContact OD1-CB 3.25Å; D492-L494 PolarHBondContact OD1-N 3.3Å; L494-K496 HydrophobicContact CB-CD 4.5Å; L494-K496 HydrophobicContact CB-CG 4.2Å; L494-K496 PolarHBondContact O-N 3.14Å; L494-K496 VanDerWaalsContact O-N 3.13Å; L494-I526 WeakPolarHBondContact O-CB 3.49Å; L494-I526 PolarHBondContact O-N 3.05Å
495	R	94	Very high	94.6	Very high	126 Å²	126	38.7 Å²	38.7	48%	0.475	22%	0.224	S	C	.	.	S	Bend	trans	57.8	16.6	-170.8	-57.4	-177.1	66.6	-175.9	-2.3	113.6	Q491 D492 G493	Q491-R495 PolarHBondContact NE2-O 3.04Å; D492-R495 PolarHBondContact O-N 3.49Å; D492-R495 PolarHBondContact OD1-N 3.37Å; D492-R495 VanDerWaalsContact OD1-N 3.17Å; G493-R495 VanDerWaalsContact C-N 3.34Å
496	K	95.6	Very high	94.7	Very high	27 Å²	27	38 Å²	38	12%	0.117	22%	0.217	C	C	.	.			trans	-80.4	140.6	176.4	-74.8	-173.3	170.2	-175.2	0	109.2	H470 Q491 D492 L494 H500 Y501 E504 D525	H470-K496 PolarHBondContact NE2-O 3.25Å; Q491-K496 WeakPolarHBondContact CA-O 3.46Å; D492-K496 PolarHBondContact N-O 3.3Å; D492-K496 PolarHBondContact OD1-N 3.46Å; L494-K496 HydrophobicContact CB-CD 4.5Å; L494-K496 HydrophobicContact CB-CG 4.2Å; L494-K496 PolarHBondContact O-N 3.14Å; L494-K496 VanDerWaalsContact O-N 3.13Å; K496-H500 HydrophobicContact CB-CB 4.02Å; K496-H500 HydrophobicContact CD-CB 4.38Å; K496-H500 HydrophobicContact CG-CB 4.06Å; K496-Y501 HydrophobicContact CB-CD2 4.25Å; K496-Y501 HydrophobicContact CB-CE2 3.68Å; K496-Y501 HydrophobicContact CD-CE1 4.12Å; K496-Y501 HydrophobicContact CD-CE2 4.36Å; K496-E504 IonicContact NZ-OE1 3.73Å; K496-E504 IonicContact NZ-OE2 2.93Å; K496-E504 PolarHBondContact NZ-OE2 2.98Å; K496-D525 WeakPolarHBondContact CE-OD2 3.34Å; K496-D525 HydrophobicContact CG-CB 3.62Å
497	T	96.5	Very high	94.6	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	23%	0.228	C	C	.	.			trans	-95.4	169.1	166.6	67.5	0	0	0	0	109.8	A490 Q491 L499 H500 Y501 L523	A490-T497 WeakPolarHBondContact O-CA 3.43Å; Q491-T497 HydrophobicContact CG-CG2 3.82Å; T497-L499 PolarHBondContact O-N 3.32Å; T497-L499 VanDerWaalsContact O-N 3.15Å; T497-L499 PolarHBondContact OG1-N 2.96Å; T497-H500 PolarHBondContact N-ND1 3.38Å; T497-H500 VanDerWaalsContact N-ND1 3.15Å; T497-H500 WeakPolarHBondContact O-CB 3.24Å; T497-H500 PolarHBondContact O-N 3.41Å; T497-H500 PolarHBondContact OG1-ND1 2.78Å; T497-Y501 WeakPolarHBondContact O-CD2 3.48Å; T497-Y501 PolarHBondContact O-N 3.11Å; T497-L523 HydrophobicContact CG2-CB 4.3Å; T497-L523 HydrophobicContact CG2-CD1 3.69Å
498	L	96.7	Very high	94.4	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-57.2	-30.2	172.4	-179	61	0	0	0	112.5	L469 C478 H500 Y501 A502 L510 L514	L469-L498 HydrophobicContact CD1-CD2 3.81Å; L469-L498 HydrophobicContact CG-CB 4.33Å; L469-L498 HydrophobicContact CG-CD2 3.78Å; L469-L498 WeakPolarHBondContact O-CD1 3.42Å; L469-L498 WeakPolarHBondContact O-CD2 3.48Å; C478-L498 VanDerWaalsContact SG-CD2 3.51Å; L498-H500 VanDerWaalsContact C-N 3.33Å; L498-H500 PolarHBondContact O-N 3.42Å; L498-Y501 PolarHBondContact O-N 3.44Å; L498-A502 WeakPolarHBondContact O-CB 3.5Å; L498-A502 PolarHBondContact O-N 3.15Å; L498-L510 HydrophobicContact CD1-CD2 4.44Å; L498-L514 HydrophobicContact CB-CD1 4.35Å; L498-L514 HydrophobicContact CD2-CD1 4.05Å; L498-L514 HydrophobicContact CD2-CD2 3.65Å; L498-L514 HydrophobicContact CD2-CG 4.42Å; L498-L514 HydrophobicContact CG-CD1 3.8Å; L498-L514 HydrophobicContact CG-CD2 4.25Å
499	L	97.2	Very high	94	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-34.8	176.3	-173.9	59	0	0	0	112.3	T497 A502 C503 V511 L514 V515 A519 Q521 P531 L547	T497-L499 PolarHBondContact O-N 3.32Å; T497-L499 VanDerWaalsContact O-N 3.15Å; T497-L499 PolarHBondContact OG1-N 2.96Å; L499-A502 PolarHBondContact O-N 3.43Å; L499-C503 PolarHBondContact O-N 3.4Å; L499-C503 VanDerWaalsContact O-N 3.1Å; L499-C503 PolarHBondContact O-SG 3.15Å; L499-V511 HydrophobicContact CD1-CB 4.39Å; L499-V511 HydrophobicContact CD1-CG1 4.04Å; L499-V511 HydrophobicContact CD1-CG2 4.26Å; L499-L514 HydrophobicContact CB-CD1 4.29Å; L499-L514 HydrophobicContact CD1-CB 4.19Å; L499-L514 HydrophobicContact CD1-CD1 4.17Å; L499-V515 HydrophobicContact CD1-CG2 4.37Å; L499-A519 HydrophobicContact CB-CB 4.48Å; L499-A519 HydrophobicContact CD2-CB 4Å; L499-Q521 HydrophobicContact CD2-CG 4.06Å; L499-P531 HydrophobicContact CB-CG 4.22Å; L499-P531 HydrophobicContact CD2-CB 4.07Å; L499-P531 HydrophobicContact CD2-CG 3.87Å; L499-P531 HydrophobicContact CG-CB 3.79Å; L499-P531 HydrophobicContact CG-CG 3.82Å; L499-L547 HydrophobicContact CD1-CD2 4.42Å; L499-L547 HydrophobicContact CD2-CD2 4.38Å
500	H	97.1	Very high	93.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-49.3	172.7	-66.8	77	0	0	0	110.5	K496 T497 L498 A502 C503 E504 L523 K529 I534	K496-H500 HydrophobicContact CB-CB 4.02Å; K496-H500 HydrophobicContact CD-CB 4.38Å; K496-H500 HydrophobicContact CG-CB 4.06Å; T497-H500 PolarHBondContact N-ND1 3.38Å; T497-H500 VanDerWaalsContact N-ND1 3.15Å; T497-H500 WeakPolarHBondContact O-CB 3.24Å; T497-H500 PolarHBondContact O-N 3.41Å; T497-H500 PolarHBondContact OG1-ND1 2.78Å; L498-H500 VanDerWaalsContact C-N 3.33Å; L498-H500 PolarHBondContact O-N 3.42Å; H500-A502 VanDerWaalsContact C-N 3.34Å; H500-A502 PolarHBondContact O-N 2.91Å; H500-C503 PolarHBondContact O-N 2.92Å; H500-E504 WeakPolarHBondContact O-CB 3.44Å; H500-E504 PolarHBondContact O-N 3.01Å; H500-L523 PolarHBondContact CE1-O 2.59Å; H500-L523 PolarHBondContact NE2-O 2.82Å; H500-K529 PolarHBondContact NE2-O 3.13Å; H500-K529 VanDerWaalsContact NE2-O 3.16Å; H500-I534 HydrophobicContact CB-CD1 3.78Å
501	Y	95.1	Very high	93.8	Very high	68 Å²	68	36 Å²	36	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-62.8	-37.8	177.9	-74.4	-66.9	0	0	0	113	H470 D492 K496 T497 L498 C503 E504 A505	H470-Y501 AromaticContact CD2-CE2 3.82Å; D492-Y501 VanDerWaalsContact OD2-CE2 3.26Å; D492-Y501 WeakPolarHBondContact OD2-CE2 3.46Å; D492-Y501 VanDerWaalsContact OD2-CZ 3.31Å; D492-Y501 PolarHBondContact OD2-OH 3.43Å; K496-Y501 HydrophobicContact CB-CD2 4.25Å; K496-Y501 HydrophobicContact CB-CE2 3.68Å; K496-Y501 HydrophobicContact CD-CE1 4.12Å; K496-Y501 HydrophobicContact CD-CE2 4.36Å; T497-Y501 WeakPolarHBondContact O-CD2 3.48Å; T497-Y501 PolarHBondContact O-N 3.11Å; L498-Y501 PolarHBondContact O-N 3.44Å; Y501-C503 VanDerWaalsContact C-N 3.33Å; Y501-C503 PolarHBondContact O-N 3.32Å; Y501-E504 PolarHBondContact O-N 3.15Å; Y501-A505 VanDerWaalsContact O-CB 3.29Å; Y501-A505 WeakPolarHBondContact O-CB 3.31Å; Y501-A505 PolarHBondContact O-N 3.06Å
502	A	95.4	Very high	93.7	Very high	2 Å²	2	33.2 Å²	33.2	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-64.3	-38.5	176.2	0	0	0	0	0	112	L498 L499 H500 G506 N507 L510 V511 L514	L498-A502 WeakPolarHBondContact O-CB 3.5Å; L498-A502 PolarHBondContact O-N 3.15Å; L499-A502 PolarHBondContact O-N 3.43Å; H500-A502 VanDerWaalsContact C-N 3.34Å; H500-A502 PolarHBondContact O-N 2.91Å; A502-G506 PolarHBondContact O-N 3.34Å; A502-N507 PolarHBondContact O-N 3.14Å; A502-L510 HydrophobicContact CB-CB 4.27Å; A502-L510 HydrophobicContact CB-CD2 3.92Å; A502-L510 HydrophobicContact CB-CG 3.94Å; A502-V511 HydrophobicContact CB-CG2 3.71Å; A502-L514 HydrophobicContact CB-CD1 4.01Å
503	C	96.4	Very high	93.6	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-69.6	-43.1	174.9	-64.3	0	0	0	0	111.8	L499 H500 Y501 A505 G506 I534 A535 I543	L499-C503 PolarHBondContact O-N 3.4Å; L499-C503 VanDerWaalsContact O-N 3.1Å; L499-C503 PolarHBondContact O-SG 3.15Å; H500-C503 PolarHBondContact O-N 2.92Å; Y501-C503 VanDerWaalsContact C-N 3.33Å; Y501-C503 PolarHBondContact O-N 3.32Å; C503-A505 VanDerWaalsContact C-N 3.31Å; C503-A505 PolarHBondContact O-N 3.49Å; C503-G506 PolarHBondContact O-N 3.15Å; C503-I534 HydrophobicContact CB-CB 4.29Å; C503-I534 HydrophobicContact CB-CG2 3.94Å; C503-A535 HydrophobicContact CB-CB 4.45Å; C503-I543 HydrophobicContact CB-CG2 4.44Å
504	E	94.5	Very high	93.9	Very high	85 Å²	85	30.3 Å²	30.3	40%	0.397	17%	0.167	S	C	.	.	H	α-helix	trans	-61.9	-39	177	-172.9	171.2	179.2	0	0	112	K496 H500 Y501 G506 I534	K496-E504 IonicContact NZ-OE1 3.73Å; K496-E504 IonicContact NZ-OE2 2.93Å; K496-E504 PolarHBondContact NZ-OE2 2.98Å; H500-E504 WeakPolarHBondContact O-CB 3.44Å; H500-E504 PolarHBondContact O-N 3.01Å; Y501-E504 PolarHBondContact O-N 3.15Å; E504-G506 PolarHBondContact O-N 3.26Å; E504-I534 HydrophobicContact CB-CG2 4.02Å
505	A	92.7	Very high	93.9	Very high	79 Å²	79	27.1 Å²	27.1	65%	0.653	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-7	175.4	0	0	0	0	0	113.9	Y501 C503 N507	Y501-A505 VanDerWaalsContact O-CB 3.29Å; Y501-A505 WeakPolarHBondContact O-CB 3.31Å; Y501-A505 PolarHBondContact O-N 3.06Å; C503-A505 VanDerWaalsContact C-N 3.31Å; C503-A505 PolarHBondContact O-N 3.49Å; A505-N507 HydrophobicContact CB-CB 4.44Å; A505-N507 PolarHBondContact O-N 3.03Å
506	G	92.7	Very high	93.6	Very high	30 Å²	30	24.6 Å²	24.6	31%	0.309	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	64	22.7	-173.8	0	0	0	0	0	113.9	A502 C503 E504 T508	A502-G506 PolarHBondContact O-N 3.34Å; C503-G506 PolarHBondContact O-N 3.15Å; E504-G506 PolarHBondContact O-N 3.26Å; G506-T508 PolarHBondContact O-N 3.27Å
507	N	92.1	Very high	93.4	Very high	58 Å²	58	26.5 Å²	26.5	31%	0.31	15%	0.15	S	C	.	.			trans	-84.2	82.2	-175.1	-171.3	-19.3	0	0	0	111	A502 A505 A509 L510 V511	A502-N507 PolarHBondContact O-N 3.14Å; A505-N507 HydrophobicContact CB-CB 4.44Å; A505-N507 PolarHBondContact O-N 3.03Å; N507-A509 VanDerWaalsContact C-N 3.27Å; N507-A509 PolarHBondContact O-N 2.99Å; N507-A509 PolarHBondContact OD1-N 3.42Å; N507-L510 HydrophobicContact CB-CB 4.04Å; N507-L510 VanDerWaalsContact CG-CB 3.41Å; N507-L510 PolarHBondContact O-N 3.29Å; N507-L510 VanDerWaalsContact O-N 3.14Å; N507-L510 WeakPolarHBondContact OD1-CB 3.15Å; N507-L510 PolarHBondContact OD1-N 3.4Å; N507-V511 WeakPolarHBondContact O-CG2 3.46Å; N507-V511 PolarHBondContact O-N 3.04Å
508	T	90.3	Very high	93.1	Very high	23 Å²	23	28.8 Å²	28.8	14%	0.141	17%	0.174	C	C	.	.	H	α-helix	trans	-54.3	-39.5	-178.2	-48.7	0	0	0	0	113.3	G506 V511 C512 D542 I543 L546 F575	G506-T508 PolarHBondContact O-N 3.27Å; T508-V511 PolarHBondContact O-N 3.37Å; T508-C512 PolarHBondContact O-N 2.91Å; T508-D542 HydrophobicContact CG2-CB 4.2Å; T508-I543 HydrophobicContact CG2-CG1 4.39Å; T508-L546 HydrophobicContact CG2-CD1 3.4Å; T508-F575 HydrophobicContact CG2-CB 4.09Å; T508-F575 HydrophobicContact CG2-CD1 3.57Å; T508-F575 HydrophobicContact CG2-CD2 4.24Å; T508-F575 HydrophobicContact CG2-CE1 4Å; T508-F575 HydrophobicContact CG2-CG 3.71Å; T508-F575 HydrophobicContact CG2-CZ 4.48Å
509	A	88.5	Confident	93	Very high	35 Å²	35	29 Å²	29	29%	0.289	18%	0.176	S	C	.	.	H	α-helix	trans	-66.8	-43.5	179.1	0	0	0	0	0	111.9	N507 C512 F513	N507-A509 VanDerWaalsContact C-N 3.27Å; N507-A509 PolarHBondContact O-N 2.99Å; N507-A509 PolarHBondContact OD1-N 3.42Å; A509-C512 PolarHBondContact O-N 3.27Å; A509-F513 WeakPolarHBondContact O-CB 3.45Å; A509-F513 PolarHBondContact O-N 2.95Å
510	L	92.4	Very high	92.8	Very high	8 Å²	8	32.2 Å²	32.2	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-67.7	-38.8	176.7	-175.6	59.1	0	0	0	111.7	L498 A502 N507 F513 L514	L498-L510 HydrophobicContact CD1-CD2 4.44Å; A502-L510 HydrophobicContact CB-CB 4.27Å; A502-L510 HydrophobicContact CB-CD2 3.92Å; A502-L510 HydrophobicContact CB-CG 3.94Å; N507-L510 HydrophobicContact CB-CB 4.04Å; N507-L510 VanDerWaalsContact CG-CB 3.41Å; N507-L510 PolarHBondContact O-N 3.29Å; N507-L510 VanDerWaalsContact O-N 3.14Å; N507-L510 WeakPolarHBondContact OD1-CB 3.15Å; N507-L510 PolarHBondContact OD1-N 3.4Å; L510-F513 HydrophobicContact CD1-CD1 4.31Å; L510-F513 PolarHBondContact O-N 2.86Å; L510-L514 HydrophobicContact CD1-CD1 4.3Å; L510-L514 HydrophobicContact CD1-CG 4.24Å; L510-L514 HydrophobicContact CG-CD1 4.01Å; L510-L514 HydrophobicContact CG-CG 4.42Å; L510-L514 VanDerWaalsContact O-CG 3.25Å; L510-L514 WeakPolarHBondContact O-CG 3.26Å; L510-L514 PolarHBondContact O-N 2.8Å
511	V	93.6	Very high	92.7	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.4	-52.8	173	170.1	0	0	0	0	110.8	L499 A502 N507 T508 F513 L514 V515 I543 L547	L499-V511 HydrophobicContact CD1-CB 4.39Å; L499-V511 HydrophobicContact CD1-CG1 4.04Å; L499-V511 HydrophobicContact CD1-CG2 4.26Å; A502-V511 HydrophobicContact CB-CG2 3.71Å; N507-V511 WeakPolarHBondContact O-CG2 3.46Å; N507-V511 PolarHBondContact O-N 3.04Å; T508-V511 PolarHBondContact O-N 3.37Å; V511-F513 VanDerWaalsContact C-N 3.29Å; V511-F513 PolarHBondContact O-N 3.2Å; V511-L514 PolarHBondContact O-N 3.4Å; V511-V515 HydrophobicContact CG1-CG2 4.36Å; V511-V515 WeakPolarHBondContact O-CG2 3.48Å; V511-V515 PolarHBondContact O-N 2.76Å; V511-I543 HydrophobicContact CG1-CG2 4.22Å; V511-I543 HydrophobicContact CG2-CD1 4.09Å; V511-I543 HydrophobicContact CG2-CG1 4.37Å; V511-I543 HydrophobicContact CG2-CG2 4.21Å; V511-L547 HydrophobicContact CG1-CD2 3.98Å; V511-L547 HydrophobicContact CG1-CG 4.33Å
512	C	90.9	Very high	92.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-58.2	-42.3	178.3	166.9	0	0	0	0	111.5	T508 A509 K516 L546 C572	T508-C512 PolarHBondContact O-N 2.91Å; A509-C512 PolarHBondContact O-N 3.27Å; C512-K516 WeakPolarHBondContact O-CB 3.24Å; C512-K516 WeakPolarHBondContact O-CG 3.4Å; C512-K516 PolarHBondContact O-N 3.48Å; C512-L546 HydrophobicContact CB-CD1 4.36Å; C512-L546 HydrophobicContact CB-CD2 4.44Å; C512-C572 HydrophobicContact CB-CB 4.41Å; C512-C572 WeakPolarHBondContact CB-SG 3.41Å; C512-C572 WeakPolarHBondContact SG-CA 3.29Å; C512-C572 WeakPolarHBondContact SG-CB 3.5Å; C512-C572 CovalentContact SG-SG 2.05Å; C512-C572 PolarHBondContact SG-SG 3.2Å
513	F	92	Very high	92.6	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-57.9	-52.5	175.2	172.5	-91.1	0	0	0	111.8	E340 A475 C478 E479 L482 A509 L510 V511 V515 K516 R517	E340-F513 HydrophobicContact CB-CE2 4.14Å; E340-F513 HydrophobicContact CG-CD2 3.81Å; E340-F513 HydrophobicContact CG-CE2 3.7Å; A475-F513 HydrophobicContact CB-CB 4.11Å; A475-F513 HydrophobicContact CB-CD1 4.25Å; A475-F513 HydrophobicContact CB-CD2 3.77Å; A475-F513 HydrophobicContact CB-CE2 4.25Å; A475-F513 HydrophobicContact CB-CG 3.76Å; A475-F513 WeakPolarHBondContact O-CZ 3.48Å; C478-F513 HydrophobicContact CB-CD1 4.2Å; C478-F513 HydrophobicContact CB-CE1 3.41Å; C478-F513 VanDerWaalsContact CB-CE1 3.41Å; C478-F513 HydrophobicContact CB-CZ 4.01Å; E479-F513 HydrophobicContact CB-CE2 4.33Å; E479-F513 HydrophobicContact CB-CZ 4.04Å; E479-F513 WeakPolarHBondContact OE2-CZ 3.4Å; L482-F513 HydrophobicContact CD1-CE1 3.89Å; L482-F513 HydrophobicContact CD1-CZ 4Å; A509-F513 WeakPolarHBondContact O-CB 3.45Å; A509-F513 PolarHBondContact O-N 2.95Å; L510-F513 HydrophobicContact CD1-CD1 4.31Å; L510-F513 PolarHBondContact O-N 2.86Å; V511-F513 VanDerWaalsContact C-N 3.29Å; V511-F513 PolarHBondContact O-N 3.2Å; F513-V515 VanDerWaalsContact C-N 3.34Å; F513-V515 PolarHBondContact O-N 3Å; F513-K516 WeakPolarHBondContact O-CB 3.38Å; F513-K516 PolarHBondContact O-N 3.15Å; F513-R517 HydrophobicContact CD1-CG 4.4Å; F513-R517 HydrophobicContact CE1-CG 3.95Å; F513-R517 HydrophobicContact CE2-CG 4.14Å; F513-R517 HydrophobicContact CZ-CG 3.82Å; F513-R517 WeakPolarHBondContact O-CG 3.31Å; F513-R517 PolarHBondContact O-N 3.37Å; F513-R517 VanDerWaalsContact O-N 3.12Å
514	L	95.4	Very high	92.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-62.4	-42.1	-176.1	-68.8	167.7	0	0	0	112.1	I488 L498 L499 A502 L510 V511 R517 G518 A519	I488-L514 HydrophobicContact CD1-CD2 4.42Å; I488-L514 WeakPolarHBondContact CD1-O 3.39Å; I488-L514 HydrophobicContact CG1-CD2 4.35Å; L498-L514 HydrophobicContact CB-CD1 4.35Å; L498-L514 HydrophobicContact CD2-CD1 4.05Å; L498-L514 HydrophobicContact CD2-CD2 3.65Å; L498-L514 HydrophobicContact CD2-CG 4.42Å; L498-L514 HydrophobicContact CG-CD1 3.8Å; L498-L514 HydrophobicContact CG-CD2 4.25Å; L499-L514 HydrophobicContact CB-CD1 4.29Å; L499-L514 HydrophobicContact CD1-CB 4.19Å; L499-L514 HydrophobicContact CD1-CD1 4.17Å; A502-L514 HydrophobicContact CB-CD1 4.01Å; L510-L514 HydrophobicContact CD1-CD1 4.3Å; L510-L514 HydrophobicContact CD1-CG 4.24Å; L510-L514 HydrophobicContact CG-CD1 4.01Å; L510-L514 HydrophobicContact CG-CG 4.42Å; L510-L514 VanDerWaalsContact O-CG 3.25Å; L510-L514 WeakPolarHBondContact O-CG 3.26Å; L510-L514 PolarHBondContact O-N 2.8Å; V511-L514 PolarHBondContact O-N 3.4Å; L514-R517 CarbonylContact O-C 3.59Å; L514-R517 WeakPolarHBondContact O-CA 3.49Å; L514-R517 PolarHBondContact O-N 3.15Å; L514-R517 VanDerWaalsContact O-N 3.08Å; L514-G518 PolarHBondContact O-N 3.06Å; L514-A519 HydrophobicContact CB-CB 3.92Å; L514-A519 VanDerWaalsContact O-CB 3.27Å; L514-A519 WeakPolarHBondContact O-CB 3.48Å; L514-A519 PolarHBondContact O-N 3.23Å
515	V	92.8	Very high	92.7	Very high	15 Å²	15	33.3 Å²	33.3	9%	0.091	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-43.8	176.4	172.9	0	0	0	0	111.3	L499 V511 F513 R517 G518 L547 A550 F568	L499-V515 HydrophobicContact CD1-CG2 4.37Å; V511-V515 HydrophobicContact CG1-CG2 4.36Å; V511-V515 WeakPolarHBondContact O-CG2 3.48Å; V511-V515 PolarHBondContact O-N 2.76Å; F513-V515 VanDerWaalsContact C-N 3.34Å; F513-V515 PolarHBondContact O-N 3Å; V515-R517 PolarHBondContact O-N 2.93Å; V515-G518 PolarHBondContact O-N 3.04Å; V515-L547 HydrophobicContact CG2-CD2 3.94Å; V515-A550 HydrophobicContact CG1-CB 3.28Å; V515-F568 HydrophobicContact CB-CZ 4.28Å; V515-F568 HydrophobicContact CG1-CE1 4.41Å; V515-F568 HydrophobicContact CG1-CE2 3.93Å; V515-F568 HydrophobicContact CG1-CZ 3.47Å; V515-F568 VanDerWaalsContact CG1-CZ 3.47Å
516	K	88.9	Confident	92.9	Very high	72 Å²	72	34.6 Å²	34.6	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-58.2	-29.2	173.6	-78	177.3	174.9	176.3	0	112.9	C512 F513 G518 F568 C572	C512-K516 WeakPolarHBondContact O-CB 3.24Å; C512-K516 WeakPolarHBondContact O-CG 3.4Å; C512-K516 PolarHBondContact O-N 3.48Å; F513-K516 WeakPolarHBondContact O-CB 3.38Å; F513-K516 PolarHBondContact O-N 3.15Å; K516-G518 VanDerWaalsContact C-N 3.31Å; K516-F568 HydrophobicContact CG-CE1 4.24Å; K516-F568 HydrophobicContact CG-CZ 4.45Å; K516-C572 VanDerWaalsContact CE-CB 3.49Å
517	R	90.6	Very high	93	Very high	67 Å²	67	38.9 Å²	38.9	25%	0.253	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	4.1	177	-57.5	-50.5	175.8	132	-0.7	113.6	E340 E479 L482 I488 F513 L514 V515	E340-R517 IonicContact OE2-NH2 3.45Å; E340-R517 PolarHBondContact OE2-NH2 3.17Å; E479-R517 VanDerWaalsContact CD-CZ 3.43Å; E479-R517 VanDerWaalsContact CD-NH2 3.26Å; E479-R517 IonicContact OE1-CZ 3.84Å; E479-R517 IonicContact OE1-NH1 3.95Å; E479-R517 PolarHBondContact OE1-NH1 3.05Å; E479-R517 IonicContact OE1-NH2 2.73Å; E479-R517 PolarHBondContact OE1-NH2 3.32Å; E479-R517 IonicContact OE2-CZ 2.66Å; E479-R517 IonicContact OE2-NE 3.79Å; E479-R517 IonicContact OE2-NH1 3.67Å; E479-R517 PolarHBondContact OE2-NH1 3.26Å; E479-R517 IonicContact OE2-NH2 3.53Å; E479-R517 PolarHBondContact OE2-NH2 2.8Å; L482-R517 HydrophobicContact CD1-CB 4.04Å; L482-R517 HydrophobicContact CD1-CG 3.9Å; I488-R517 HydrophobicContact CD1-CB 3.43Å; I488-R517 VanDerWaalsContact CD1-CB 3.43Å; F513-R517 HydrophobicContact CD1-CG 4.4Å; F513-R517 HydrophobicContact CE1-CG 3.95Å; F513-R517 HydrophobicContact CE2-CG 4.14Å; F513-R517 HydrophobicContact CZ-CG 3.82Å; F513-R517 WeakPolarHBondContact O-CG 3.31Å; F513-R517 PolarHBondContact O-N 3.37Å; F513-R517 VanDerWaalsContact O-N 3.12Å; L514-R517 CarbonylContact O-C 3.59Å; L514-R517 WeakPolarHBondContact O-CA 3.49Å; L514-R517 PolarHBondContact O-N 3.15Å; L514-R517 VanDerWaalsContact O-N 3.08Å; V515-R517 PolarHBondContact O-N 2.93Å
518	G	90.1	Very high	93.2	Very high	50 Å²	50	38.3 Å²	38.3	52%	0.515	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	31.4	175.3	0	0	0	0	0	114.2	L514 V515 K516 D520	L514-G518 PolarHBondContact O-N 3.06Å; V515-G518 PolarHBondContact O-N 3.04Å; K516-G518 VanDerWaalsContact C-N 3.31Å; G518-D520 PolarHBondContact O-N 3.01Å
519	A	94.2	Very high	93.6	Very high	7 Å²	7	40.9 Å²	40.9	6%	0.058	25%	0.248	C	C	.	.			trans	-61.6	132	171.8	0	0	0	0	0	110.9	I488 L499 L514 Q521	I488-A519 HydrophobicContact CD1-CB 3.87Å; I488-A519 HydrophobicContact CG1-CB 3.97Å; L499-A519 HydrophobicContact CB-CB 4.48Å; L499-A519 HydrophobicContact CD2-CB 4Å; L514-A519 HydrophobicContact CB-CB 3.92Å; L514-A519 VanDerWaalsContact O-CB 3.27Å; L514-A519 WeakPolarHBondContact O-CB 3.48Å; L514-A519 PolarHBondContact O-N 3.23Å; A519-Q521 PolarHBondContact O-N 3.23Å
520	D	94.4	Very high	94	Very high	71 Å²	71	40.2 Å²	40.2	38%	0.38	24%	0.241	S	C	.	.			trans	-74.9	119.9	179.5	-172.5	-5.8	0	0	0	110.3	N489 G518 G522 L523	N489-D520 PolarHBondContact OD1-N 3.21Å; G518-D520 PolarHBondContact O-N 3.01Å; D520-G522 PolarHBondContact OD1-N 3.44Å; D520-L523 HydrophobicContact CB-CD1 4.06Å; D520-L523 HydrophobicContact CB-CG 4.06Å
521	Q	93.7	Very high	94.2	Very high	25 Å²	25	39.8 Å²	39.8	12%	0.117	24%	0.239	C	C	.	.	S	Bend	trans	-85.1	-10.5	179.6	-58.4	-179.5	56.1	0	0	112.8	L499 A519 P531 L547 A550	L499-Q521 HydrophobicContact CD2-CG 4.06Å; A519-Q521 PolarHBondContact O-N 3.23Å; Q521-P531 WeakPolarHBondContact O-CD 3.47Å; Q521-L547 HydrophobicContact CG-CD2 4.15Å; Q521-L547 PolarHBondContact OE1-O 3.43Å; Q521-A550 VanDerWaalsContact NE2-CB 3.31Å
522	G	92.9	Very high	94.3	Very high	57 Å²	57	41.5 Å²	41.5	59%	0.588	25%	0.248	S	C	*	.	S	Bend	trans	-90.3	-9.8	-177.8	0	0	0	0	0	114.5	D520	D520-G522 PolarHBondContact OD1-N 3.44Å
523	L	96.7	Very high	94.7	Very high	41 Å²	41	44.5 Å²	44.5	22%	0.215	26%	0.264	C	S	.	.			trans	-68.4	139.5	176	-65.8	176.3	0	0	0	110.3	N489 T497 H500 D520 C530 P531	N489-L523 HydrophobicContact CB-CD1 3.83Å; T497-L523 HydrophobicContact CG2-CB 4.3Å; T497-L523 HydrophobicContact CG2-CD1 3.69Å; H500-L523 PolarHBondContact CE1-O 2.59Å; H500-L523 PolarHBondContact NE2-O 2.82Å; D520-L523 HydrophobicContact CB-CD1 4.06Å; D520-L523 HydrophobicContact CB-CG 4.06Å; L523-C530 WeakPolarHBondContact O-CA 3.5Å; L523-P531 WeakPolarHBondContact O-CD 3.45Å
524	V	97.3	Very high	94.9	Very high	49 Å²	49	44.7 Å²	44.7	30%	0.297	27%	0.265	S	S	.	.			trans	-114.6	146	179.3	-63.2	0	0	0	0	111.1	Q491 K529 C530	Q491-V524 PolarHBondContact NE2-O 3.47Å; V524-K529 VanDerWaalsContact CA-O 3.31Å; V524-K529 WeakPolarHBondContact CA-O 3.04Å; V524-C530 HydrophobicContact CG1-CB 4.12Å
525	D	95.8	Very high	94.9	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.027	27%	0.265	C	S	.	.			trans	-76.5	-172.5	172.3	71.7	9.5	0	0	0	112.7	K496 D527 G528 K529	K496-D525 WeakPolarHBondContact CE-OD2 3.34Å; K496-D525 HydrophobicContact CG-CB 3.62Å; D525-D527 PolarHBondContact O-N 2.91Å; D525-D527 WeakPolarHBondContact OD1-CA 3.41Å; D525-D527 PolarHBondContact OD1-N 2.55Å; D525-G528 PolarHBondContact O-N 2.73Å; D525-G528 VanDerWaalsContact O-N 3.1Å; D525-G528 PolarHBondContact OD1-N 2.89Å; D525-G528 VanDerWaalsContact OD1-N 3.14Å; D525-K529 PolarHBondContact N-O 3.17Å; D525-K529 PolarHBondContact OD1-N 2.89Å
526	I	95.6	Very high	95.1	Very high	106 Å²	106	47.8 Å²	47.8	54%	0.544	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.9	-179.6	-162.3	165.8	0	0	0	113.4	L494	L494-I526 WeakPolarHBondContact O-CB 3.49Å; L494-I526 PolarHBondContact O-N 3.05Å
527	D	95.7	Very high	95.4	Very high	121 Å²	121	49 Å²	49	65%	0.647	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	1	176.4	-62.7	-42.4	0	0	0	111.8	D525 K529	D525-D527 PolarHBondContact O-N 2.91Å; D525-D527 WeakPolarHBondContact OD1-CA 3.41Å; D525-D527 PolarHBondContact OD1-N 2.55Å; D527-K529 VanDerWaalsContact C-N 3.31Å; D527-K529 HydrophobicContact CB-CG 4.33Å
528	G	96.4	Very high	95.6	Very high	46 Å²	46	50.7 Å²	50.7	47%	0.474	30%	0.301	S	S	.	.	S	Bend	trans	77.6	14.9	-178.3	0	0	0	0	0	113.7	D525	D525-G528 PolarHBondContact O-N 2.73Å; D525-G528 VanDerWaalsContact O-N 3.1Å; D525-G528 PolarHBondContact OD1-N 2.89Å; D525-G528 VanDerWaalsContact OD1-N 3.14Å
529	K	97.7	Very high	95.7	Very high	77 Å²	77	52.5 Å²	52.5	34%	0.335	31%	0.311	S	S	.	.			trans	-90.6	132.4	180	-63.6	-173.2	-179.4	-174.4	0	110.6	H500 V524 D525 D527 D533 I534 D537	H500-K529 PolarHBondContact NE2-O 3.13Å; H500-K529 VanDerWaalsContact NE2-O 3.16Å; V524-K529 VanDerWaalsContact CA-O 3.31Å; V524-K529 WeakPolarHBondContact CA-O 3.04Å; D525-K529 PolarHBondContact N-O 3.17Å; D525-K529 PolarHBondContact OD1-N 2.89Å; D527-K529 VanDerWaalsContact C-N 3.31Å; D527-K529 HydrophobicContact CB-CG 4.33Å; K529-D533 HydrophobicContact CB-CB 4.08Å; K529-D533 HydrophobicContact CG-CB 4.41Å; K529-I534 HydrophobicContact CB-CG1 4.23Å; K529-D537 WeakPolarHBondContact CE-OD2 3.44Å; K529-D537 IonicContact NZ-OD2 3.74Å; K529-D537 PolarHBondContact NZ-OD2 3.06Å
530	C	96.7	Very high	95.7	Very high	20 Å²	20	53.8 Å²	53.8	14%	0.135	32%	0.317	C	S	.	.			trans	-86.4	169.6	167.6	75.8	0	0	0	0	110.8	L523 V524 L532 D533 I534	L523-C530 WeakPolarHBondContact O-CA 3.5Å; V524-C530 HydrophobicContact CG1-CB 4.12Å; C530-L532 PolarHBondContact O-N 2.85Å; C530-L532 VanDerWaalsContact O-N 3.15Å; C530-D533 PolarHBondContact N-OD2 3.39Å; C530-D533 WeakPolarHBondContact O-CB 3.44Å; C530-D533 PolarHBondContact O-N 3.22Å; C530-D533 VanDerWaalsContact SG-CG 3.54Å; C530-D533 PolarHBondContact SG-OD2 2.9Å; C530-I534 PolarHBondContact O-N 2.66Å; C530-I534 VanDerWaalsContact O-N 3.14Å
531	P	97.1	Very high	95.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.1	-32	178.8	-26.5	35.4	0	0	0	114	L499 Q521 L523 I534 A535 L547	L499-P531 HydrophobicContact CB-CG 4.22Å; L499-P531 HydrophobicContact CD2-CB 4.07Å; L499-P531 HydrophobicContact CD2-CG 3.87Å; L499-P531 HydrophobicContact CG-CB 3.79Å; L499-P531 HydrophobicContact CG-CG 3.82Å; Q521-P531 WeakPolarHBondContact O-CD 3.47Å; L523-P531 WeakPolarHBondContact O-CD 3.45Å; P531-I534 PolarHBondContact O-N 2.99Å; P531-A535 WeakPolarHBondContact O-CB 3.42Å; P531-A535 PolarHBondContact O-N 3.19Å; P531-L547 HydrophobicContact CB-CD1 4.39Å
532	L	96.1	Very high	95.3	Very high	36 Å²	36	56.3 Å²	56.3	19%	0.188	34%	0.34	C	S	.	.	H	α-helix	trans	-67.3	-39.6	175.8	179.9	62.6	0	0	0	111.8	C530 I534 A535 I536 V544 L547 R548	C530-L532 PolarHBondContact O-N 2.85Å; C530-L532 VanDerWaalsContact O-N 3.15Å; L532-I534 VanDerWaalsContact C-N 3.34Å; L532-A535 PolarHBondContact O-N 3.19Å; L532-I536 HydrophobicContact CD1-CD1 4.4Å; L532-I536 HydrophobicContact CG-CD1 4.13Å; L532-I536 VanDerWaalsContact O-CG1 3.31Å; L532-I536 WeakPolarHBondContact O-CG1 3.34Å; L532-I536 PolarHBondContact O-N 3.01Å; L532-V544 HydrophobicContact CD1-CB 4.41Å; L532-V544 HydrophobicContact CD1-CG1 4.09Å; L532-V544 HydrophobicContact CD1-CG2 4.36Å; L532-L547 HydrophobicContact CB-CD1 4.19Å; L532-L547 HydrophobicContact CD1-CB 4.13Å; L532-L547 HydrophobicContact CD1-CD1 4.24Å; L532-R548 HydrophobicContact CD1-CG 4.4Å
533	D	97.7	Very high	95.3	Very high	63 Å²	63	53.6 Å²	53.6	34%	0.337	31%	0.312	S	S	.	.	H	α-helix	trans	-64.2	-43.2	177	-57.7	-42.4	0	0	0	110.3	K529 C530 A535 I536 D537	K529-D533 HydrophobicContact CB-CB 4.08Å; K529-D533 HydrophobicContact CG-CB 4.41Å; C530-D533 PolarHBondContact N-OD2 3.39Å; C530-D533 WeakPolarHBondContact O-CB 3.44Å; C530-D533 PolarHBondContact O-N 3.22Å; C530-D533 VanDerWaalsContact SG-CG 3.54Å; C530-D533 PolarHBondContact SG-OD2 2.9Å; D533-A535 VanDerWaalsContact C-N 3.33Å; D533-A535 PolarHBondContact O-N 2.75Å; D533-I536 PolarHBondContact O-N 3.09Å; D533-D537 PolarHBondContact O-N 2.9Å
534	I	96.4	Very high	95.1	Very high	9 Å²	9	52.5 Å²	52.5	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-59.5	-44.4	174.3	-64.3	178.4	0	0	0	110.9	H500 C503 E504 K529 C530 P531 L532 I536 D537 Q538	H500-I534 HydrophobicContact CB-CD1 3.78Å; C503-I534 HydrophobicContact CB-CB 4.29Å; C503-I534 HydrophobicContact CB-CG2 3.94Å; E504-I534 HydrophobicContact CB-CG2 4.02Å; K529-I534 HydrophobicContact CB-CG1 4.23Å; C530-I534 PolarHBondContact O-N 2.66Å; C530-I534 VanDerWaalsContact O-N 3.14Å; P531-I534 PolarHBondContact O-N 2.99Å; L532-I534 VanDerWaalsContact C-N 3.34Å; I534-I536 VanDerWaalsContact C-N 3.3Å; I534-I536 PolarHBondContact O-N 3.14Å; I534-D537 PolarHBondContact O-N 3.16Å; I534-Q538 HydrophobicContact CG2-CG 4.35Å; I534-Q538 WeakPolarHBondContact O-CB 3.31Å; I534-Q538 VanDerWaalsContact O-CG 3.29Å; I534-Q538 WeakPolarHBondContact O-CG 3.47Å; I534-Q538 PolarHBondContact O-N 2.93Å
535	A	96.1	Very high	94.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-34.9	178.7	0	0	0	0	0	113	C503 P531 L532 D533 A539 N540 I543 V544 L547	C503-A535 HydrophobicContact CB-CB 4.45Å; P531-A535 WeakPolarHBondContact O-CB 3.42Å; P531-A535 PolarHBondContact O-N 3.19Å; L532-A535 PolarHBondContact O-N 3.19Å; D533-A535 VanDerWaalsContact C-N 3.33Å; D533-A535 PolarHBondContact O-N 2.75Å; A535-A539 PolarHBondContact O-N 3.33Å; A535-N540 PolarHBondContact O-N 3.1Å; A535-I543 HydrophobicContact CB-CB 4.15Å; A535-I543 HydrophobicContact CB-CG2 3.46Å; A535-I543 VanDerWaalsContact CB-CG2 3.46Å; A535-V544 HydrophobicContact CB-CG2 3.77Å; A535-L547 HydrophobicContact CB-CD1 4.26Å
536	I	96.7	Very high	94.3	Very high	81 Å²	81	53.3 Å²	53.3	42%	0.415	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-45.1	174.6	-68.8	166.7	0	0	0	110.5	L532 D533 I534 Q538 A539 V544	L532-I536 HydrophobicContact CD1-CD1 4.4Å; L532-I536 HydrophobicContact CG-CD1 4.13Å; L532-I536 VanDerWaalsContact O-CG1 3.31Å; L532-I536 WeakPolarHBondContact O-CG1 3.34Å; L532-I536 PolarHBondContact O-N 3.01Å; D533-I536 PolarHBondContact O-N 3.09Å; I534-I536 VanDerWaalsContact C-N 3.3Å; I534-I536 PolarHBondContact O-N 3.14Å; I536-Q538 VanDerWaalsContact C-N 3.28Å; I536-Q538 PolarHBondContact O-N 3.39Å; I536-A539 WeakPolarHBondContact O-CA 3.44Å; I536-A539 PolarHBondContact O-N 3.41Å; I536-V544 HydrophobicContact CG1-CG2 3.81Å
537	D	95.9	Very high	94.1	Very high	97 Å²	97	48.3 Å²	48.3	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-61.8	-37.1	177.9	-74.2	-12.9	0	0	0	112	K529 D533 I534 A539	K529-D537 WeakPolarHBondContact CE-OD2 3.44Å; K529-D537 IonicContact NZ-OD2 3.74Å; K529-D537 PolarHBondContact NZ-OD2 3.06Å; D533-D537 PolarHBondContact O-N 2.9Å; I534-D537 PolarHBondContact O-N 3.16Å; D537-A539 PolarHBondContact O-N 2.91Å
538	Q	93.8	Very high	93.8	Very high	104 Å²	104	49.2 Å²	49.2	49%	0.486	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2.1	173.4	-64.6	-62.3	-18.8	0	0	113.4	I534 I536 N540	I534-Q538 HydrophobicContact CG2-CG 4.35Å; I534-Q538 WeakPolarHBondContact O-CB 3.31Å; I534-Q538 VanDerWaalsContact O-CG 3.29Å; I534-Q538 WeakPolarHBondContact O-CG 3.47Å; I534-Q538 PolarHBondContact O-N 2.93Å; I536-Q538 VanDerWaalsContact C-N 3.28Å; I536-Q538 PolarHBondContact O-N 3.39Å; Q538-N540 PolarHBondContact O-N 3.26Å; Q538-N540 VanDerWaalsContact O-N 3.14Å
539	A	93.9	Very high	93.3	Very high	87 Å²	87	48.9 Å²	48.9	72%	0.719	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	31.5	-175.9	0	0	0	0	0	114.1	A535 I536 D537 A541	A535-A539 PolarHBondContact O-N 3.33Å; I536-A539 WeakPolarHBondContact O-CA 3.44Å; I536-A539 PolarHBondContact O-N 3.41Å; D537-A539 PolarHBondContact O-N 2.91Å; A539-A541 PolarHBondContact O-N 3.14Å
540	N	92.2	Very high	92.7	Very high	34 Å²	34	45.3 Å²	45.3	18%	0.182	25%	0.253	C	S	.	.			trans	-88.7	91.5	-179.2	-170.2	-34.9	0	0	0	110.8	A535 Q538 D542 I543 V544	A535-N540 PolarHBondContact O-N 3.1Å; Q538-N540 PolarHBondContact O-N 3.26Å; Q538-N540 VanDerWaalsContact O-N 3.14Å; N540-D542 VanDerWaalsContact C-N 3.26Å; N540-D542 PolarHBondContact O-N 2.99Å; N540-D542 PolarHBondContact OD1-N 2.97Å; N540-I543 HydrophobicContact CB-CB 4.27Å; N540-I543 HydrophobicContact CB-CD1 4.3Å; N540-I543 HydrophobicContact CB-CG1 4.43Å; N540-I543 VanDerWaalsContact ND2-CD1 3.26Å; N540-I543 WeakPolarHBondContact ND2-CD1 3.4Å; N540-I543 PolarHBondContact O-N 2.77Å; N540-I543 PolarHBondContact OD1-N 3.37Å; N540-V544 WeakPolarHBondContact O-CG2 2.85Å; N540-V544 PolarHBondContact O-N 3.27Å
541	A	91.3	Very high	92	Very high	67 Å²	67	49.9 Å²	49.9	55%	0.554	27%	0.271	S	S	*	.	H	α-helix	trans	-58.4	-34.7	-176.2	0	0	0	0	0	113.8	A539 T545	A539-A541 PolarHBondContact O-N 3.14Å; A541-T545 WeakPolarHBondContact O-CB 3.47Å; A541-T545 PolarHBondContact O-N 3.4Å; A541-T545 PolarHBondContact O-OG1 2.9Å
542	D	89.4	Confident	91.2	Very high	82 Å²	82	53.3 Å²	53.3	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-67	-47.8	-179.3	-68.6	-25.5	0	0	0	111.1	T508 N540 T545 L546 F575	T508-D542 HydrophobicContact CG2-CB 4.2Å; N540-D542 VanDerWaalsContact C-N 3.26Å; N540-D542 PolarHBondContact O-N 2.99Å; N540-D542 PolarHBondContact OD1-N 2.97Å; D542-T545 PolarHBondContact O-N 2.96Å; D542-L546 WeakPolarHBondContact O-CB 3.45Å; D542-L546 PolarHBondContact O-N 3.29Å; D542-F575 HydrophobicContact CB-CE1 3.7Å; D542-F575 HydrophobicContact CB-CZ 3.68Å
543	I	92.2	Very high	90.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.3	-43.2	177.3	-67.2	179.9	0	0	0	110.7	C503 T508 V511 A535 N540 T545 L546 L547	C503-I543 HydrophobicContact CB-CG2 4.44Å; T508-I543 HydrophobicContact CG2-CG1 4.39Å; V511-I543 HydrophobicContact CG1-CG2 4.22Å; V511-I543 HydrophobicContact CG2-CD1 4.09Å; V511-I543 HydrophobicContact CG2-CG1 4.37Å; V511-I543 HydrophobicContact CG2-CG2 4.21Å; A535-I543 HydrophobicContact CB-CB 4.15Å; A535-I543 HydrophobicContact CB-CG2 3.46Å; A535-I543 VanDerWaalsContact CB-CG2 3.46Å; N540-I543 HydrophobicContact CB-CB 4.27Å; N540-I543 HydrophobicContact CB-CD1 4.3Å; N540-I543 HydrophobicContact CB-CG1 4.43Å; N540-I543 VanDerWaalsContact ND2-CD1 3.26Å; N540-I543 WeakPolarHBondContact ND2-CD1 3.4Å; N540-I543 PolarHBondContact O-N 2.77Å; N540-I543 PolarHBondContact OD1-N 3.37Å; I543-T545 VanDerWaalsContact C-N 3.28Å; I543-T545 PolarHBondContact O-N 3.48Å; I543-L546 PolarHBondContact O-N 3.46Å; I543-L547 HydrophobicContact CG2-CD1 3.88Å; I543-L547 HydrophobicContact CG2-CG 4.27Å; I543-L547 WeakPolarHBondContact O-CG 3.28Å; I543-L547 PolarHBondContact O-N 3.09Å
544	V	93.3	Very high	88.8	Confident	18 Å²	18	52.7 Å²	52.7	11%	0.109	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-42.4	176.4	170.9	0	0	0	0	111	L532 A535 I536 N540 R548	L532-V544 HydrophobicContact CD1-CB 4.41Å; L532-V544 HydrophobicContact CD1-CG1 4.09Å; L532-V544 HydrophobicContact CD1-CG2 4.36Å; A535-V544 HydrophobicContact CB-CG2 3.77Å; I536-V544 HydrophobicContact CG1-CG2 3.81Å; N540-V544 WeakPolarHBondContact O-CG2 2.85Å; N540-V544 PolarHBondContact O-N 3.27Å; V544-R548 WeakPolarHBondContact O-CB 3.36Å; V544-R548 VanDerWaalsContact O-CG 3.26Å; V544-R548 WeakPolarHBondContact O-CG 3.33Å; V544-R548 PolarHBondContact O-N 2.85Å; V544-R548 VanDerWaalsContact O-N 3.09Å
545	T	89.1	Confident	87.4	Confident	71 Å²	71	58.3 Å²	58.3	44%	0.436	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-45.5	178.8	-59.2	0	0	0	0	111.1	A541 D542 I543 R548 L549	A541-T545 WeakPolarHBondContact O-CB 3.47Å; A541-T545 PolarHBondContact O-N 3.4Å; A541-T545 PolarHBondContact O-OG1 2.9Å; D542-T545 PolarHBondContact O-N 2.96Å; I543-T545 VanDerWaalsContact C-N 3.28Å; I543-T545 PolarHBondContact O-N 3.48Å; T545-R548 PolarHBondContact O-N 2.75Å; T545-L549 HydrophobicContact CG2-CD1 3.99Å; T545-L549 HydrophobicContact CG2-CG 4.43Å; T545-L549 WeakPolarHBondContact O-CB 3.49Å; T545-L549 WeakPolarHBondContact O-CG 3.35Å; T545-L549 PolarHBondContact O-N 3.36Å
546	L	88	Confident	85.7	Confident	1 Å²	1	62 Å²	62	1%	0.005	33%	0.329	C	S	.	.	H	α-helix	trans	-57.1	-50.5	176.1	-86	168.5	0	0	0	112.8	T508 C512 D542 I543 L549 A550 F568 V571 F575	T508-L546 HydrophobicContact CG2-CD1 3.4Å; C512-L546 HydrophobicContact CB-CD1 4.36Å; C512-L546 HydrophobicContact CB-CD2 4.44Å; D542-L546 WeakPolarHBondContact O-CB 3.45Å; D542-L546 PolarHBondContact O-N 3.29Å; I543-L546 PolarHBondContact O-N 3.46Å; L546-L549 PolarHBondContact O-N 3.4Å; L546-A550 VanDerWaalsContact O-CB 3.29Å; L546-A550 WeakPolarHBondContact O-CB 3.23Å; L546-A550 PolarHBondContact O-N 3.08Å; L546-F568 HydrophobicContact CD2-CE2 4.42Å; L546-V571 HydrophobicContact CD2-CG1 3.74Å; L546-V571 HydrophobicContact CG-CG1 4.31Å; L546-F575 HydrophobicContact CD1-CD2 3.6Å; L546-F575 HydrophobicContact CD1-CE2 3.8Å; L546-F575 HydrophobicContact CD1-CG 4.2Å; L546-F575 HydrophobicContact CD2-CD2 3.76Å; L546-F575 HydrophobicContact CD2-CE2 3.99Å; L546-F575 HydrophobicContact CG-CD2 3.76Å; L546-F575 HydrophobicContact CG-CE2 3.64Å
547	L	90.9	Very high	83.9	Confident	1 Å²	1	65 Å²	65	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-42.3	-179.1	-69.2	175.6	0	0	0	111.4	L499 V511 V515 Q521 P531 L532 A535 I543 A550 K551	L499-L547 HydrophobicContact CD1-CD2 4.42Å; L499-L547 HydrophobicContact CD2-CD2 4.38Å; V511-L547 HydrophobicContact CG1-CD2 3.98Å; V511-L547 HydrophobicContact CG1-CG 4.33Å; V515-L547 HydrophobicContact CG2-CD2 3.94Å; Q521-L547 HydrophobicContact CG-CD2 4.15Å; Q521-L547 PolarHBondContact OE1-O 3.43Å; P531-L547 HydrophobicContact CB-CD1 4.39Å; L532-L547 HydrophobicContact CB-CD1 4.19Å; L532-L547 HydrophobicContact CD1-CB 4.13Å; L532-L547 HydrophobicContact CD1-CD1 4.24Å; A535-L547 HydrophobicContact CB-CD1 4.26Å; I543-L547 HydrophobicContact CG2-CD1 3.88Å; I543-L547 HydrophobicContact CG2-CG 4.27Å; I543-L547 WeakPolarHBondContact O-CG 3.28Å; I543-L547 PolarHBondContact O-N 3.09Å; L547-A550 PolarHBondContact O-N 2.94Å; L547-K551 WeakPolarHBondContact O-CB 3.47Å; L547-K551 PolarHBondContact O-N 2.96Å
548	R	89.9	Confident	81.7	Confident	140 Å²	140	64.1 Å²	64.1	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-45.1	176.1	-74.1	176.2	176.9	-177.9	0.9	112.3	L532 V544 T545 A550 K551 L552	L532-R548 HydrophobicContact CD1-CG 4.4Å; V544-R548 WeakPolarHBondContact O-CB 3.36Å; V544-R548 VanDerWaalsContact O-CG 3.26Å; V544-R548 WeakPolarHBondContact O-CG 3.33Å; V544-R548 PolarHBondContact O-N 2.85Å; V544-R548 VanDerWaalsContact O-N 3.09Å; T545-R548 PolarHBondContact O-N 2.75Å; R548-A550 VanDerWaalsContact C-N 3.35Å; R548-K551 PolarHBondContact O-N 3.45Å; R548-L552 WeakPolarHBondContact O-CG 3.17Å; R548-L552 PolarHBondContact O-N 3.2Å
549	L	85.6	Confident	79.6	Confident	39 Å²	39	64.3 Å²	64.3	20%	0.204	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-41.7	177.2	-73.7	174.7	0	0	0	111.9	T545 L546 L552 S553 F568 V571	T545-L549 HydrophobicContact CG2-CD1 3.99Å; T545-L549 HydrophobicContact CG2-CG 4.43Å; T545-L549 WeakPolarHBondContact O-CB 3.49Å; T545-L549 WeakPolarHBondContact O-CG 3.35Å; T545-L549 PolarHBondContact O-N 3.36Å; L546-L549 PolarHBondContact O-N 3.4Å; L549-L552 PolarHBondContact O-N 2.93Å; L549-S553 PolarHBondContact O-N 3.45Å; L549-F568 HydrophobicContact CB-CD2 4.18Å; L549-V571 HydrophobicContact CD1-CB 4.2Å; L549-V571 HydrophobicContact CD1-CG1 4.12Å; L549-V571 HydrophobicContact CD1-CG2 3.83Å
550	A	83.5	Confident	77.6	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-60.8	-47.2	176.2	0	0	0	0	0	112	V515 Q521 L546 L547 R548 L552 S553 D554 F568	V515-A550 HydrophobicContact CG1-CB 3.28Å; Q521-A550 VanDerWaalsContact NE2-CB 3.31Å; L546-A550 VanDerWaalsContact O-CB 3.29Å; L546-A550 WeakPolarHBondContact O-CB 3.23Å; L546-A550 PolarHBondContact O-N 3.08Å; L547-A550 PolarHBondContact O-N 2.94Å; R548-A550 VanDerWaalsContact C-N 3.35Å; A550-L552 PolarHBondContact O-N 3.33Å; A550-S553 WeakPolarHBondContact O-CB 3.44Å; A550-S553 PolarHBondContact O-N 2.88Å; A550-S553 VanDerWaalsContact O-N 3.09Å; A550-S553 PolarHBondContact O-OG 3.44Å; A550-D554 PolarHBondContact O-N 2.7Å; A550-F568 HydrophobicContact CB-CD2 4.01Å; A550-F568 HydrophobicContact CB-CE2 3.58Å; A550-F568 HydrophobicContact CB-CZ 4.14Å
551	K	82.9	Confident	75.6	Confident	116 Å²	116	68.5 Å²	68.5	50%	0.504	38%	0.379	S	S	.	.	H	α-helix	trans	-61	-44.3	177.6	-174.5	171.6	-177.4	172.2	0	111.9	L547 R548 S553 D554 E555	L547-K551 WeakPolarHBondContact O-CB 3.47Å; L547-K551 PolarHBondContact O-N 2.96Å; R548-K551 PolarHBondContact O-N 3.45Å; K551-S553 VanDerWaalsContact C-N 3.3Å; K551-S553 PolarHBondContact O-N 3.23Å; K551-D554 PolarHBondContact O-N 2.85Å; K551-E555 WeakPolarHBondContact O-CG 3.29Å; K551-E555 PolarHBondContact O-N 2.91Å; K551-E555 VanDerWaalsContact O-N 3.09Å
552	L	79.4	Confident	73.7	Confident	73 Å²	73	66.4 Å²	66.4	38%	0.382	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-43.1	172.8	-71.1	170.1	0	0	0	110.9	R548 L549 A550 D554 E555 F556	R548-L552 WeakPolarHBondContact O-CG 3.17Å; R548-L552 PolarHBondContact O-N 3.2Å; L549-L552 PolarHBondContact O-N 2.93Å; A550-L552 PolarHBondContact O-N 3.33Å; L552-D554 VanDerWaalsContact C-N 3.32Å; L552-D554 PolarHBondContact O-N 3.31Å; L552-E555 PolarHBondContact O-N 2.94Å; L552-F556 WeakPolarHBondContact O-CD2 3.44Å; L552-F556 PolarHBondContact O-N 2.87Å
553	S	73.5	Confident	72.1	Confident	11 Å²	11	69.3 Å²	69.3	8%	0.077	38%	0.375	C	S	.	.	H	α-helix	trans	-62	-38.8	178.3	79.5	0	0	0	0	112.6	L549 A550 K551 F556 K557	L549-S553 PolarHBondContact O-N 3.45Å; A550-S553 WeakPolarHBondContact O-CB 3.44Å; A550-S553 PolarHBondContact O-N 2.88Å; A550-S553 VanDerWaalsContact O-N 3.09Å; A550-S553 PolarHBondContact O-OG 3.44Å; K551-S553 VanDerWaalsContact C-N 3.3Å; K551-S553 PolarHBondContact O-N 3.23Å; S553-F556 PolarHBondContact O-N 3.39Å; S553-K557 WeakPolarHBondContact O-CG 3.36Å; S553-K557 PolarHBondContact O-N 3.16Å
554	D	71.2	Confident	70.4	Confident	75 Å²	75	71.7 Å²	71.7	40%	0.401	39%	0.388	S	S	.	.	H	α-helix	trans	-66.8	-39.1	177.7	-76	-30.1	0	0	0	112.4	A550 K551 L552 F556 K557	A550-D554 PolarHBondContact O-N 2.7Å; K551-D554 PolarHBondContact O-N 2.85Å; L552-D554 VanDerWaalsContact C-N 3.32Å; L552-D554 PolarHBondContact O-N 3.31Å; D554-F556 VanDerWaalsContact C-N 3.26Å; D554-F556 PolarHBondContact O-N 2.93Å; D554-K557 PolarHBondContact O-N 2.91Å; D554-K557 VanDerWaalsContact OD1-CE 3.24Å; D554-K557 WeakPolarHBondContact OD1-CE 3.45Å; D554-K557 IonicContact OD1-NZ 2.8Å; D554-K557 PolarHBondContact OD1-NZ 3.38Å
555	E	67.1	Low	68.7	Low	126 Å²	126	74.7 Å²	74.7	59%	0.589	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-30.1	176.9	-71.6	173.9	-174.1	0	0	112.4	K551 L552	K551-E555 WeakPolarHBondContact O-CG 3.29Å; K551-E555 PolarHBondContact O-N 2.91Å; K551-E555 VanDerWaalsContact O-N 3.09Å; L552-E555 PolarHBondContact O-N 2.94Å
556	F	61.1	Low	67.4	Low	78 Å²	78	75.5 Å²	75.5	34%	0.342	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	7.3	-180	-69.1	-73.4	0	0	0	114.8	L552 S553 D554 G558 D559 N564	L552-F556 WeakPolarHBondContact O-CD2 3.44Å; L552-F556 PolarHBondContact O-N 2.87Å; S553-F556 PolarHBondContact O-N 3.39Å; D554-F556 VanDerWaalsContact C-N 3.26Å; D554-F556 PolarHBondContact O-N 2.93Å; F556-G558 PolarHBondContact O-N 2.94Å; F556-D559 PolarHBondContact O-N 3.28Å; F556-N564 WeakPolarHBondContact CD2-ND2 3.38Å
557	K	57.3	Low	66.1	Low	145 Å²	145	77.3 Å²	77.3	63%	0.63	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-4.7	179.7	-90.9	176.7	-179.5	167.4	0	115.2	S553 D554	S553-K557 WeakPolarHBondContact O-CG 3.36Å; S553-K557 PolarHBondContact O-N 3.16Å; D554-K557 PolarHBondContact O-N 2.91Å; D554-K557 VanDerWaalsContact OD1-CE 3.24Å; D554-K557 WeakPolarHBondContact OD1-CE 3.45Å; D554-K557 IonicContact OD1-NZ 2.8Å; D554-K557 PolarHBondContact OD1-NZ 3.38Å
558	G	50.1	Low	64.9	Low	78 Å²	78	77.9 Å²	77.9	80%	0.804	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-17.7	173.3	0	0	0	0	0	115.4	F556	F556-G558 PolarHBondContact O-N 2.94Å
559	D	49.6	Very low	63.9	Low	107 Å²	107	74.4 Å²	74.4	57%	0.572	41%	0.411	S	S	*	.	S	Bend	trans	-95.1	147.9	-179.1	-74.8	-30.5	0	0	0	110.6	F556 V561	F556-D559 PolarHBondContact O-N 3.28Å; D559-V561 PolarHBondContact O-N 3.4Å; D559-V561 VanDerWaalsContact O-N 3.11Å
560	S	51.5	Low	63.1	Low	109 Å²	109	76.2 Å²	76.2	76%	0.762	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-41.2	119.4	177	53.2	0	0	0	0	111.5	S562	S560-S562 PolarHBondContact O-N 2.91Å
561	V	50.1	Low	62.3	Low	100 Å²	100	78 Å²	78	61%	0.606	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	2	88.1	-178.7	-175.3	0	0	0	0	112.2	D559 L563	D559-V561 PolarHBondContact O-N 3.4Å; D559-V561 VanDerWaalsContact O-N 3.11Å; V561-L563 PolarHBondContact O-N 2.96Å
562	S	52.2	Low	61.5	Low	23 Å²	23	72.4 Å²	72.4	16%	0.161	41%	0.407	C	S	.	.			trans	-62.2	135.2	179.5	-179.7	0	0	0	0	108.9	S560 N564 E565	S560-S562 PolarHBondContact O-N 2.91Å; S562-N564 PolarHBondContact O-N 3.44Å; S562-N564 VanDerWaalsContact OG-CB 3.3Å; S562-N564 WeakPolarHBondContact OG-CB 3.42Å; S562-N564 VanDerWaalsContact OG-CG 3.26Å; S562-N564 PolarHBondContact OG-N 3.19Å; S562-N564 PolarHBondContact OG-ND2 3.42Å; S562-E565 PolarHBondContact O-N 2.93Å
563	L	55.9	Low	60.9	Low	143 Å²	143	74.2 Å²	74.2	75%	0.749	41%	0.409	S	S	*	.	H	α-helix	trans	-48.5	-24.6	168.4	-73	164.7	0	0	0	111.6	V561 L566 A567	V561-L563 PolarHBondContact O-N 2.96Å; L563-L566 PolarHBondContact O-N 2.92Å; L563-A567 VanDerWaalsContact O-CB 3.3Å; L563-A567 WeakPolarHBondContact O-CB 3.24Å; L563-A567 PolarHBondContact O-N 2.91Å
564	N	56.5	Low	60.5	Low	50 Å²	50	78.6 Å²	78.6	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-64.2	-35.5	175.4	-59.8	-15.1	0	0	0	113.5	F556 S562 F568	F556-N564 WeakPolarHBondContact CD2-ND2 3.38Å; S562-N564 PolarHBondContact O-N 3.44Å; S562-N564 VanDerWaalsContact OG-CB 3.3Å; S562-N564 WeakPolarHBondContact OG-CB 3.42Å; S562-N564 VanDerWaalsContact OG-CG 3.26Å; S562-N564 PolarHBondContact OG-N 3.19Å; S562-N564 PolarHBondContact OG-ND2 3.42Å; N564-F568 VanDerWaalsContact O-CB 3.22Å; N564-F568 WeakPolarHBondContact O-CB 3.37Å; N564-F568 PolarHBondContact O-N 3.36Å
565	E	58.4	Low	60.2	Low	82 Å²	82	76.6 Å²	76.6	38%	0.383	42%	0.419	S	S	.	.	H	α-helix	trans	-70.7	-42.4	178.7	-172.8	176	-167	0	0	110.7	S562 F568 L569	S562-E565 PolarHBondContact O-N 2.93Å; E565-F568 PolarHBondContact O-N 3.39Å; E565-L569 HydrophobicContact CG-CD1 4.31Å; E565-L569 WeakPolarHBondContact O-CB 3.37Å; E565-L569 VanDerWaalsContact O-CG 3.28Å; E565-L569 WeakPolarHBondContact O-CG 3.4Å; E565-L569 PolarHBondContact O-N 3.41Å
566	L	60.8	Low	59.8	Low	88 Å²	88	72.8 Å²	72.8	46%	0.461	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-45.1	173.6	-69.8	175.3	0	0	0	111.2	L563 F568 L569 D570	L563-L566 PolarHBondContact O-N 2.92Å; L566-F568 PolarHBondContact O-N 3.46Å; L566-L569 PolarHBondContact O-N 2.75Å; L566-D570 WeakPolarHBondContact O-CB 3.41Å; L566-D570 PolarHBondContact O-N 2.96Å
567	A	61.3	Low	59.5	Low	39 Å²	39	74.1 Å²	74.1	32%	0.322	42%	0.415	S	S	.	.	H	α-helix	trans	-60.8	-43.6	175.8	0	0	0	0	0	111.6	L563 D570 V571	L563-A567 VanDerWaalsContact O-CB 3.3Å; L563-A567 WeakPolarHBondContact O-CB 3.24Å; L563-A567 PolarHBondContact O-N 2.91Å; A567-D570 PolarHBondContact O-N 3.24Å; A567-V571 WeakPolarHBondContact O-CB 3.35Å; A567-V571 WeakPolarHBondContact O-CG2 3.41Å; A567-V571 PolarHBondContact O-N 2.84Å
568	F	65.9	Low	59	Low	13 Å²	13	71.4 Å²	71.4	6%	0.057	41%	0.41	C	S	.	.	H	α-helix	trans	-60.2	-47.9	174.4	173.1	-105.2	0	0	0	111.2	V515 K516 L546 L549 A550 N564 E565 L566 D570 V571 C572	V515-F568 HydrophobicContact CB-CZ 4.28Å; V515-F568 HydrophobicContact CG1-CE1 4.41Å; V515-F568 HydrophobicContact CG1-CE2 3.93Å; V515-F568 HydrophobicContact CG1-CZ 3.47Å; V515-F568 VanDerWaalsContact CG1-CZ 3.47Å; K516-F568 HydrophobicContact CG-CE1 4.24Å; K516-F568 HydrophobicContact CG-CZ 4.45Å; L546-F568 HydrophobicContact CD2-CE2 4.42Å; L549-F568 HydrophobicContact CB-CD2 4.18Å; A550-F568 HydrophobicContact CB-CD2 4.01Å; A550-F568 HydrophobicContact CB-CE2 3.58Å; A550-F568 HydrophobicContact CB-CZ 4.14Å; N564-F568 VanDerWaalsContact O-CB 3.22Å; N564-F568 WeakPolarHBondContact O-CB 3.37Å; N564-F568 PolarHBondContact O-N 3.36Å; E565-F568 PolarHBondContact O-N 3.39Å; L566-F568 PolarHBondContact O-N 3.46Å; F568-D570 PolarHBondContact O-N 2.87Å; F568-V571 PolarHBondContact O-N 3.21Å; F568-C572 VanDerWaalsContact O-CB 3.26Å; F568-C572 WeakPolarHBondContact O-CB 3.26Å; F568-C572 PolarHBondContact O-N 3.37Å
569	L	68.7	Low	58.5	Low	66 Å²	66	69.3 Å²	69.3	35%	0.346	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-32.9	178.5	-71.9	173.5	0	0	0	113.2	E565 L566 R573	E565-L569 HydrophobicContact CG-CD1 4.31Å; E565-L569 WeakPolarHBondContact O-CB 3.37Å; E565-L569 VanDerWaalsContact O-CG 3.28Å; E565-L569 WeakPolarHBondContact O-CG 3.4Å; E565-L569 PolarHBondContact O-N 3.41Å; L566-L569 PolarHBondContact O-N 2.75Å; L569-R573 WeakPolarHBondContact O-CB 3.34Å; L569-R573 VanDerWaalsContact O-CG 3.27Å; L569-R573 WeakPolarHBondContact O-CG 3.5Å; L569-R573 PolarHBondContact O-N 3.15Å; L569-R573 PolarHBondContact O-NE 3.39Å; L569-R573 VanDerWaalsContact O-NE 3.08Å
570	D	68.2	Low	57.9	Low	78 Å²	78	68.5 Å²	68.5	42%	0.417	39%	0.392	S	S	.	.	H	α-helix	trans	-67.2	-50.7	172.5	-82	-27.9	0	0	0	110.6	L566 A567 F568 C572 R573 D574	L566-D570 WeakPolarHBondContact O-CB 3.41Å; L566-D570 PolarHBondContact O-N 2.96Å; A567-D570 PolarHBondContact O-N 3.24Å; F568-D570 PolarHBondContact O-N 2.87Å; D570-C572 VanDerWaalsContact C-N 3.35Å; D570-C572 PolarHBondContact O-N 3.13Å; D570-R573 WeakPolarHBondContact O-CA 3.32Å; D570-R573 VanDerWaalsContact O-CB 3.31Å; D570-R573 WeakPolarHBondContact O-CB 3.4Å; D570-R573 PolarHBondContact O-N 3.48Å; D570-R573 IonicContact OD1-CZ 2.77Å; D570-R573 IonicContact OD1-NE 3.5Å; D570-R573 IonicContact OD1-NH1 3.34Å; D570-R573 PolarHBondContact OD1-NH1 2.8Å; D570-R573 IonicContact OD1-NH2 2.72Å; D570-R573 PolarHBondContact OD1-NH2 3Å; D570-D574 PolarHBondContact O-N 3.47Å
571	V	66.4	Low	56.9	Low	37 Å²	37	73.5 Å²	73.5	22%	0.224	39%	0.394	C	S	.	.	H	α-helix	trans	-60.1	-46.2	178.5	171.5	0	0	0	0	110.8	L546 L549 A567 F568 R573 D574 F575	L546-V571 HydrophobicContact CD2-CG1 3.74Å; L546-V571 HydrophobicContact CG-CG1 4.31Å; L549-V571 HydrophobicContact CD1-CB 4.2Å; L549-V571 HydrophobicContact CD1-CG1 4.12Å; L549-V571 HydrophobicContact CD1-CG2 3.83Å; A567-V571 WeakPolarHBondContact O-CB 3.35Å; A567-V571 WeakPolarHBondContact O-CG2 3.41Å; A567-V571 PolarHBondContact O-N 2.84Å; F568-V571 PolarHBondContact O-N 3.21Å; V571-R573 VanDerWaalsContact C-N 3.26Å; V571-R573 PolarHBondContact O-N 3.36Å; V571-D574 PolarHBondContact O-N 3.3Å; V571-F575 HydrophobicContact CG1-CD2 3.69Å; V571-F575 HydrophobicContact CG1-CE2 3.32Å; V571-F575 HydrophobicContact CG1-CZ 4.46Å; V571-F575 WeakPolarHBondContact O-CD2 3.47Å; V571-F575 PolarHBondContact O-N 2.82Å; V571-F575 VanDerWaalsContact O-N 3.1Å
572	C	66.6	Low	55.8	Low	0 Å²	0	71.7 Å²	71.7	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-34.5	174.9	-110.2	0	0	0	0	112.7	C512 K516 F568 D570 T576	C512-C572 HydrophobicContact CB-CB 4.41Å; C512-C572 WeakPolarHBondContact CB-SG 3.41Å; C512-C572 WeakPolarHBondContact SG-CA 3.29Å; C512-C572 WeakPolarHBondContact SG-CB 3.5Å; C512-C572 CovalentContact SG-SG 2.05Å; C512-C572 PolarHBondContact SG-SG 3.2Å; K516-C572 VanDerWaalsContact CE-CB 3.49Å; F568-C572 VanDerWaalsContact O-CB 3.26Å; F568-C572 WeakPolarHBondContact O-CB 3.26Å; F568-C572 PolarHBondContact O-N 3.37Å; D570-C572 VanDerWaalsContact C-N 3.35Å; D570-C572 PolarHBondContact O-N 3.13Å; C572-T576 WeakPolarHBondContact O-CG2 3.43Å; C572-T576 PolarHBondContact O-N 2.8Å; C572-T576 VanDerWaalsContact O-N 3.07Å; C572-T576 PolarHBondContact O-OG1 2.83Å
573	R	67.3	Low	54.6	Low	110 Å²	110	77 Å²	77	42%	0.415	42%	0.42	S	S	.	.	H	α-helix	trans	-65.4	-47.3	174.6	-88.3	179.6	-80.6	162.6	-10.2	111.2	L569 D570 V571 F575 T576 L577	L569-R573 WeakPolarHBondContact O-CB 3.34Å; L569-R573 VanDerWaalsContact O-CG 3.27Å; L569-R573 WeakPolarHBondContact O-CG 3.5Å; L569-R573 PolarHBondContact O-N 3.15Å; L569-R573 PolarHBondContact O-NE 3.39Å; L569-R573 VanDerWaalsContact O-NE 3.08Å; D570-R573 WeakPolarHBondContact O-CA 3.32Å; D570-R573 VanDerWaalsContact O-CB 3.31Å; D570-R573 WeakPolarHBondContact O-CB 3.4Å; D570-R573 PolarHBondContact O-N 3.48Å; D570-R573 IonicContact OD1-CZ 2.77Å; D570-R573 IonicContact OD1-NE 3.5Å; D570-R573 IonicContact OD1-NH1 3.34Å; D570-R573 PolarHBondContact OD1-NH1 2.8Å; D570-R573 IonicContact OD1-NH2 2.72Å; D570-R573 PolarHBondContact OD1-NH2 3Å; V571-R573 VanDerWaalsContact C-N 3.26Å; V571-R573 PolarHBondContact O-N 3.36Å; R573-F575 VanDerWaalsContact C-N 3.28Å; R573-F575 PolarHBondContact O-N 2.94Å; R573-T576 WeakPolarHBondContact CA-OG1 3.42Å; R573-T576 PolarHBondContact O-N 3.12Å; R573-T576 PolarHBondContact O-OG1 3.35Å; R573-L577 WeakPolarHBondContact O-CG 3.48Å; R573-L577 PolarHBondContact O-N 3.2Å
574	D	65.1	Low	53.2	Low	104 Å²	104	74.8 Å²	74.8	56%	0.556	42%	0.416	S	S	*	.	H	α-helix	trans	-58	-41.3	178.2	-75	-11.7	0	0	0	111.6	D570 V571 L577 T578	D570-D574 PolarHBondContact O-N 3.47Å; V571-D574 PolarHBondContact O-N 3.3Å; D574-L577 PolarHBondContact O-N 3.27Å; D574-T578 WeakPolarHBondContact O-CG2 3.42Å; D574-T578 PolarHBondContact O-N 2.86Å; D574-T578 PolarHBondContact O-OG1 3.16Å; D574-T578 VanDerWaalsContact O-OG1 3.09Å
575	F	63.5	Low	51.8	Low	33 Å²	33	79.5 Å²	79.5	15%	0.145	44%	0.44	C	S	.	.	H	α-helix	trans	-71	-36	177.2	-70.4	-60.4	0	0	0	114.4	T508 D542 L546 V571 R573 L577 T578 G579	T508-F575 HydrophobicContact CG2-CB 4.09Å; T508-F575 HydrophobicContact CG2-CD1 3.57Å; T508-F575 HydrophobicContact CG2-CD2 4.24Å; T508-F575 HydrophobicContact CG2-CE1 4Å; T508-F575 HydrophobicContact CG2-CG 3.71Å; T508-F575 HydrophobicContact CG2-CZ 4.48Å; D542-F575 HydrophobicContact CB-CE1 3.7Å; D542-F575 HydrophobicContact CB-CZ 3.68Å; L546-F575 HydrophobicContact CD1-CD2 3.6Å; L546-F575 HydrophobicContact CD1-CE2 3.8Å; L546-F575 HydrophobicContact CD1-CG 4.2Å; L546-F575 HydrophobicContact CD2-CD2 3.76Å; L546-F575 HydrophobicContact CD2-CE2 3.99Å; L546-F575 HydrophobicContact CG-CD2 3.76Å; L546-F575 HydrophobicContact CG-CE2 3.64Å; V571-F575 HydrophobicContact CG1-CD2 3.69Å; V571-F575 HydrophobicContact CG1-CE2 3.32Å; V571-F575 HydrophobicContact CG1-CZ 4.46Å; V571-F575 WeakPolarHBondContact O-CD2 3.47Å; V571-F575 PolarHBondContact O-N 2.82Å; V571-F575 VanDerWaalsContact O-N 3.1Å; R573-F575 VanDerWaalsContact C-N 3.28Å; R573-F575 PolarHBondContact O-N 2.94Å; F575-L577 VanDerWaalsContact C-N 3.32Å; F575-T578 WeakPolarHBondContact CA-OG1 3.26Å; F575-T578 PolarHBondContact O-OG1 3.19Å; F575-T578 VanDerWaalsContact O-OG1 3.1Å; F575-G579 PolarHBondContact O-N 3.04Å
576	T	58.5	Low	50.4	Low	45 Å²	45	84.8 Å²	84.8	28%	0.276	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-36.3	173.5	51.5	0	0	0	0	112	C572 R573 S580	C572-T576 WeakPolarHBondContact O-CG2 3.43Å; C572-T576 PolarHBondContact O-N 2.8Å; C572-T576 VanDerWaalsContact O-N 3.07Å; C572-T576 PolarHBondContact O-OG1 2.83Å; R573-T576 WeakPolarHBondContact CA-OG1 3.42Å; R573-T576 PolarHBondContact O-N 3.12Å; R573-T576 PolarHBondContact O-OG1 3.35Å; T576-S580 PolarHBondContact O-N 3.17Å
577	L	54.7	Low	49.8	Very low	106 Å²	106	84.6 Å²	84.6	56%	0.555	49%	0.485	S	S	*	.	H	α-helix	trans	-72.9	-40.4	177.9	-69.8	171.9	0	0	0	112.4	R573 D574 F575 S580	R573-L577 WeakPolarHBondContact O-CG 3.48Å; R573-L577 PolarHBondContact O-N 3.2Å; D574-L577 PolarHBondContact O-N 3.27Å; F575-L577 VanDerWaalsContact C-N 3.32Å; L577-S580 PolarHBondContact O-N 2.61Å; L577-S580 PolarHBondContact O-OG 3.34Å
578	T	47.8	Very low	49.2	Very low	88 Å²	88	87 Å²	87	54%	0.54	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-39.8	176	51.6	0	0	0	0	111.9	D574 F575 S580 R581	D574-T578 WeakPolarHBondContact O-CG2 3.42Å; D574-T578 PolarHBondContact O-N 2.86Å; D574-T578 PolarHBondContact O-OG1 3.16Å; D574-T578 VanDerWaalsContact O-OG1 3.09Å; F575-T578 WeakPolarHBondContact CA-OG1 3.26Å; F575-T578 PolarHBondContact O-OG1 3.19Å; F575-T578 VanDerWaalsContact O-OG1 3.1Å; T578-S580 VanDerWaalsContact C-N 3.32Å; T578-S580 PolarHBondContact O-N 3.48Å; T578-R581 PolarHBondContact O-N 3.41Å; T578-R581 VanDerWaalsContact O-N 3.14Å
579	G	40	Very low	48.3	Very low	35 Å²	35	91.1 Å²	91.1	36%	0.361	52%	0.518	S	S	.	.	H	α-helix	trans	-63.8	-32.8	175.1	0	0	0	0	0	113.9	F575 R581 S582	F575-G579 PolarHBondContact O-N 3.04Å; G579-R581 PolarHBondContact O-N 3.08Å; G579-S582 PolarHBondContact O-OG 3.25Å
580	S	36.6	Very low	47.1	Very low	89 Å²	89	92.6 Å²	92.6	62%	0.622	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-13.3	175.8	72.8	0	0	0	0	114.1	T576 L577 T578	T576-S580 PolarHBondContact O-N 3.17Å; L577-S580 PolarHBondContact O-N 2.61Å; L577-S580 PolarHBondContact O-OG 3.34Å; T578-S580 VanDerWaalsContact C-N 3.32Å; T578-S580 PolarHBondContact O-N 3.48Å
581	R	31	Very low	45.8	Very low	214 Å²	214	93.5 Å²	93.5	81%	0.808	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	2.3	-179.7	-71.6	-175	179.4	-176	1.7	114.6	T578 G579 P583	T578-R581 PolarHBondContact O-N 3.41Å; T578-R581 VanDerWaalsContact O-N 3.14Å; G579-R581 PolarHBondContact O-N 3.08Å; R581-P583 WeakPolarHBondContact O-CD 3.45Å
582	S	26.7	Very low	44.4	Very low	62 Å²	62	97.3 Å²	97.3	43%	0.434	56%	0.556	S	S	.	*			trans	-103.4	100.6	169.5	54.9	0	0	0	0	110.6	G579 S584	G579-S582 PolarHBondContact O-OG 3.25Å; S582-S584 PolarHBondContact O-N 3.11Å; S582-S584 VanDerWaalsContact O-N 3.08Å
583	P	27.2	Very low	42.8	Very low	136 Å²	136	104.2 Å²	104.2	88%	0.883	60%	0.596	S	S	*	*			trans	-75.1	14	175.7	-10	27.5	0	0	0	113.6	R581	R581-P583 WeakPolarHBondContact O-CD 3.45Å
584	S	25.8	Very low	40.9	Very low	95 Å²	95	103.8 Å²	103.8	66%	0.664	61%	0.61	S	S	*	*			trans	-129.1	63.1	-168.2	63.6	0	0	0	0	111.6	S582	S582-S584 PolarHBondContact O-N 3.11Å; S582-S584 VanDerWaalsContact O-N 3.08Å
585	L	26.6	Very low	38.9	Very low	149 Å²	149	103.8 Å²	103.8	78%	0.78	61%	0.614	S	S	*	*			trans	-162.7	101	157.1	-97.8	141	0	0	0	107.3
586	C	28.5	Very low	36.7	Very low	193 Å²	193	110.2 Å²	110.2	100%	1.304	66%	0.657	S	S	*	*			trans	80	0	163.9	-44.5	0	0	0	0	117.7

Retrieved 586 of 586 residues in 163.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).