A0A096NV59_PAPAN Loading...

Protein Smaug homolog 1

AlphaFold DB (A0A2K5NW91), UniProt , Accession A0A096NV59, Species PAPAN (Papio anubis, Olive baboon), Gene SAMD4A, Length 718 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57.2	Low	81.9	Confident	167 Å²	167	107.1 Å²	107.1	82%	0.823	55%	0.553	S	S	*	*				0	135.8	0	-83.1	179.4	163.6	0	0	109.2	D5 Q6 V9	M1-D5 WeakPolarHBondContact CA-OD2 3.48Å; M1-D5 HydrophobicContact CB-CB 3.97Å; M1-D5 HydrophobicContact CE-CB 4.41Å; M1-D5 HydrophobicContact CG-CB 3.76Å; M1-D5 HydrophobicContact SD-CB 4.26Å; M1-Q6 HydrophobicContact CB-CG 4.16Å; M1-Q6 HydrophobicContact SD-CG 4.24Å; M1-V9 HydrophobicContact CE-CG2 4Å
2	M	82.1	Confident	82.5	Confident	143 Å²	143	102.3 Å²	102.3	70%	0.704	55%	0.55	S	S	*	.			trans	-75.8	163.3	160.2	-60.2	-172.1	179.5	0	0	109.6	R4 D5 Q6	M2-R4 PolarHBondContact O-N 2.83Å; M2-D5 PolarHBondContact N-OD2 3.27Å; M2-D5 WeakPolarHBondContact O-CB 3.35Å; M2-D5 PolarHBondContact O-N 2.98Å; M2-Q6 PolarHBondContact O-N 3.26Å
3	F	77.7	Confident	83.1	Confident	161 Å²	161	106.4 Å²	106.4	71%	0.706	55%	0.553	S	S	*	*	H	α-helix	trans	-55.7	-37.4	175.3	174.9	-113.3	0	0	0	112.4	D5 Q6 V7	F3-D5 VanDerWaalsContact C-N 3.29Å; F3-D5 PolarHBondContact O-N 3.06Å; F3-Q6 PolarHBondContact O-N 3.32Å; F3-V7 HydrophobicContact CD1-CG2 4.38Å; F3-V7 HydrophobicContact CD2-CG2 4.32Å; F3-V7 HydrophobicContact CE1-CG2 3.94Å; F3-V7 HydrophobicContact CE2-CG2 3.87Å; F3-V7 HydrophobicContact CZ-CG2 3.66Å; F3-V7 WeakPolarHBondContact O-CG2 3.37Å; F3-V7 PolarHBondContact O-N 3.38Å
4	R	85.2	Confident	83.6	Confident	212 Å²	212	102.9 Å²	102.9	80%	0.8	53%	0.531	S	S	*	.	H	α-helix	trans	-53.3	-43.4	173.4	-176.5	-178.3	178.4	-168.4	-0.5	112.6	M2 V7 G8	M2-R4 PolarHBondContact O-N 2.83Å; R4-V7 PolarHBondContact O-N 3.01Å; R4-G8 PolarHBondContact O-N 3.38Å
5	D	85.9	Confident	84.1	Confident	64 Å²	64	108.5 Å²	108.5	34%	0.342	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-39.8	-178.3	-40.6	-18.8	0	0	0	110.7	M1 M2 F3 G8 V9	M1-D5 WeakPolarHBondContact CA-OD2 3.48Å; M1-D5 HydrophobicContact CB-CB 3.97Å; M1-D5 HydrophobicContact CE-CB 4.41Å; M1-D5 HydrophobicContact CG-CB 3.76Å; M1-D5 HydrophobicContact SD-CB 4.26Å; M2-D5 PolarHBondContact N-OD2 3.27Å; M2-D5 WeakPolarHBondContact O-CB 3.35Å; M2-D5 PolarHBondContact O-N 2.98Å; F3-D5 VanDerWaalsContact C-N 3.29Å; F3-D5 PolarHBondContact O-N 3.06Å; D5-G8 PolarHBondContact O-N 2.88Å; D5-V9 WeakPolarHBondContact O-CG2 3.48Å; D5-V9 PolarHBondContact O-N 3.04Å
6	Q	79.9	Confident	84.3	Confident	101 Å²	101	105.8 Å²	105.8	47%	0.472	56%	0.558	S	S	.	*	H	α-helix	trans	-65.5	-42.6	178.4	-63.5	176.9	-38.9	0	0	111.4	M1 M2 F3 G8 V9 L10	M1-Q6 HydrophobicContact CB-CG 4.16Å; M1-Q6 HydrophobicContact SD-CG 4.24Å; M2-Q6 PolarHBondContact O-N 3.26Å; F3-Q6 PolarHBondContact O-N 3.32Å; Q6-G8 VanDerWaalsContact C-N 3.33Å; Q6-V9 PolarHBondContact O-N 3.4Å; Q6-L10 WeakPolarHBondContact O-CG 3.34Å; Q6-L10 PolarHBondContact O-N 3.35Å; Q6-L10 VanDerWaalsContact O-N 3.07Å
7	V	84.9	Confident	84.7	Confident	68 Å²	68	105.9 Å²	105.9	41%	0.412	55%	0.549	S	S	.	.	H	α-helix	trans	-63.4	-40	172.4	174.8	0	0	0	0	110.9	F3 R4 L10 A11	F3-V7 HydrophobicContact CD1-CG2 4.38Å; F3-V7 HydrophobicContact CD2-CG2 4.32Å; F3-V7 HydrophobicContact CE1-CG2 3.94Å; F3-V7 HydrophobicContact CE2-CG2 3.87Å; F3-V7 HydrophobicContact CZ-CG2 3.66Å; F3-V7 WeakPolarHBondContact O-CG2 3.37Å; F3-V7 PolarHBondContact O-N 3.38Å; R4-V7 PolarHBondContact O-N 3.01Å; V7-L10 PolarHBondContact O-N 3.36Å; V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 2.73Å
8	G	86	Confident	85	Confident	45 Å²	45	102.4 Å²	102.4	46%	0.464	53%	0.531	S	S	.	.	H	α-helix	trans	-61	-43.3	175.7	0	0	0	0	0	113.6	R4 D5 Q6 G12	R4-G8 PolarHBondContact O-N 3.38Å; D5-G8 PolarHBondContact O-N 2.88Å; Q6-G8 VanDerWaalsContact C-N 3.33Å; G8-G12 PolarHBondContact O-N 2.93Å
9	V	89.4	Confident	85.2	Confident	56 Å²	56	104.9 Å²	104.9	34%	0.339	54%	0.54	S	S	.	.	H	α-helix	trans	-64.4	-46	175	171.9	0	0	0	0	111.2	M1 D5 Q6 A11 G12 W13	M1-V9 HydrophobicContact CE-CG2 4Å; D5-V9 WeakPolarHBondContact O-CG2 3.48Å; D5-V9 PolarHBondContact O-N 3.04Å; Q6-V9 PolarHBondContact O-N 3.4Å; V9-A11 PolarHBondContact O-N 3.09Å; V9-G12 PolarHBondContact O-N 3.33Å; V9-W13 HydrophobicContact CG1-CD2 4.11Å; V9-W13 HydrophobicContact CG1-CE3 4.48Å; V9-W13 HydrophobicContact CG1-CH2 3.99Å; V9-W13 HydrophobicContact CG1-CZ2 3.56Å; V9-W13 HydrophobicContact CG1-CZ3 4.42Å; V9-W13 PolarHBondContact O-N 2.7Å
10	L	86	Confident	85.5	Confident	103 Å²	103	99.9 Å²	99.9	54%	0.539	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-43.8	178.1	-75	166.8	0	0	0	112.2	Q6 V7 G12 W13 F14	Q6-L10 WeakPolarHBondContact O-CG 3.34Å; Q6-L10 PolarHBondContact O-N 3.35Å; Q6-L10 VanDerWaalsContact O-N 3.07Å; V7-L10 PolarHBondContact O-N 3.36Å; L10-G12 VanDerWaalsContact C-N 3.31Å; L10-G12 PolarHBondContact O-N 3.48Å; L10-W13 HydrophobicContact CD2-CE3 4.04Å; L10-W13 HydrophobicContact CD2-CZ3 4.14Å; L10-W13 PolarHBondContact O-N 3.46Å; L10-F14 VanDerWaalsContact O-CB 3.32Å; L10-F14 WeakPolarHBondContact O-CB 3.39Å; L10-F14 PolarHBondContact O-N 3.11Å
11	A	86.3	Confident	85.8	Confident	58 Å²	58	98.1 Å²	98.1	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-35.4	175.3	0	0	0	0	0	112.3	V7 V9 F14 K15	V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 2.73Å; V9-A11 PolarHBondContact O-N 3.09Å; A11-F14 PolarHBondContact O-N 3.49Å; A11-K15 WeakPolarHBondContact O-CB 3.38Å; A11-K15 PolarHBondContact O-N 3.44Å
12	G	89.9	Confident	87.4	Confident	50 Å²	50	92.7 Å²	92.7	52%	0.515	48%	0.476	S	S	.	.	H	α-helix	trans	-62.8	-43.7	173.8	0	0	0	0	0	113	G8 V9 L10	G8-G12 PolarHBondContact O-N 2.93Å; V9-G12 PolarHBondContact O-N 3.33Å; L10-G12 VanDerWaalsContact C-N 3.31Å; L10-G12 PolarHBondContact O-N 3.48Å
13	W	89.3	Confident	87.9	Confident	155 Å²	155	88.7 Å²	88.7	59%	0.587	46%	0.46	S	S	*	.	H	α-helix	trans	-67	-45	173.4	-63.6	-20.5	0	0	0	112.1	V9 L10 K15 G16 W17	V9-W13 HydrophobicContact CG1-CD2 4.11Å; V9-W13 HydrophobicContact CG1-CE3 4.48Å; V9-W13 HydrophobicContact CG1-CH2 3.99Å; V9-W13 HydrophobicContact CG1-CZ2 3.56Å; V9-W13 HydrophobicContact CG1-CZ3 4.42Å; V9-W13 PolarHBondContact O-N 2.7Å; L10-W13 HydrophobicContact CD2-CE3 4.04Å; L10-W13 HydrophobicContact CD2-CZ3 4.14Å; L10-W13 PolarHBondContact O-N 3.46Å; W13-K15 VanDerWaalsContact C-N 3.3Å; W13-K15 PolarHBondContact O-N 3.39Å; W13-G16 WeakPolarHBondContact O-CA 3.47Å; W13-G16 PolarHBondContact O-N 3.02Å; W13-W17 HydrophobicContact CB-CZ2 4.35Å
14	F	90.6	Very high	88.6	Confident	58 Å²	58	83.4 Å²	83.4	25%	0.254	44%	0.441	S	S	.	.	H	α-helix	trans	-60.3	-38.8	-177.5	-165.3	-98.3	0	0	0	112.6	L10 A11 G16 W17 Q22 L26	L10-F14 VanDerWaalsContact O-CB 3.32Å; L10-F14 WeakPolarHBondContact O-CB 3.39Å; L10-F14 PolarHBondContact O-N 3.11Å; A11-F14 PolarHBondContact O-N 3.49Å; F14-G16 PolarHBondContact O-N 3.39Å; F14-W17 AromaticContact CD2-CE3 3.72Å; F14-W17 HydrophobicContact CD2-CE3 3.72Å; F14-W17 AromaticContact CD2-CZ3 3.78Å; F14-W17 HydrophobicContact CD2-CZ3 3.78Å; F14-W17 HydrophobicContact CE2-CE3 4.31Å; F14-W17 HydrophobicContact CE2-CZ3 4.44Å; F14-W17 HydrophobicContact CG-CE3 4.47Å; F14-W17 PolarHBondContact O-N 2.94Å; F14-Q22 HydrophobicContact CD1-CG 4.09Å; F14-Q22 HydrophobicContact CD2-CG 4.27Å; F14-Q22 HydrophobicContact CE1-CB 4Å; F14-Q22 HydrophobicContact CE1-CG 3.7Å; F14-Q22 HydrophobicContact CE2-CB 3.83Å; F14-Q22 HydrophobicContact CE2-CG 3.9Å; F14-Q22 HydrophobicContact CG-CG 4.36Å; F14-Q22 HydrophobicContact CZ-CB 3.45Å; F14-Q22 VanDerWaalsContact CZ-CB 3.45Å; F14-Q22 HydrophobicContact CZ-CG 3.59Å; F14-L26 HydrophobicContact CE2-CD1 4.37Å; F14-L26 HydrophobicContact CE2-CD2 4.07Å; F14-L26 HydrophobicContact CE2-CG 3.81Å; F14-L26 HydrophobicContact CZ-CD1 3.73Å; F14-L26 HydrophobicContact CZ-CD2 4.07Å; F14-L26 HydrophobicContact CZ-CG 3.69Å
15	K	90.6	Very high	88.8	Confident	187 Å²	187	74.2 Å²	74.2	81%	0.813	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-18	173.9	-175.7	171.5	179	179.3	0	113.7	A11 W13	A11-K15 WeakPolarHBondContact O-CB 3.38Å; A11-K15 PolarHBondContact O-N 3.44Å; W13-K15 VanDerWaalsContact C-N 3.3Å; W13-K15 PolarHBondContact O-N 3.39Å
16	G	88.6	Confident	89.1	Confident	65 Å²	65	75.3 Å²	75.3	67%	0.67	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.4	177.1	0	0	0	0	0	115	W13 F14	W13-G16 WeakPolarHBondContact O-CA 3.47Å; W13-G16 PolarHBondContact O-N 3.02Å; F14-G16 PolarHBondContact O-N 3.39Å
17	W	90.3	Very high	89.6	Confident	108 Å²	108	73.1 Å²	73.1	41%	0.409	41%	0.407	S	S	.	.	S	Bend	trans	-99.4	151.6	179.8	-63.2	-21.2	0	0	0	111.6	W13 F14 E21 Q22 A25	W13-W17 HydrophobicContact CB-CZ2 4.35Å; F14-W17 AromaticContact CD2-CE3 3.72Å; F14-W17 HydrophobicContact CD2-CE3 3.72Å; F14-W17 AromaticContact CD2-CZ3 3.78Å; F14-W17 HydrophobicContact CD2-CZ3 3.78Å; F14-W17 HydrophobicContact CE2-CE3 4.31Å; F14-W17 HydrophobicContact CE2-CZ3 4.44Å; F14-W17 HydrophobicContact CG-CE3 4.47Å; F14-W17 PolarHBondContact O-N 2.94Å; W17-E21 HydrophobicContact CB-CB 3.93Å; W17-E21 HydrophobicContact CG-CB 4.47Å; W17-Q22 HydrophobicContact CB-CG 3.95Å; W17-Q22 PolarHBondContact O-NE2 2.94Å; W17-A25 HydrophobicContact CE3-CB 4.01Å; W17-A25 HydrophobicContact CH2-CB 4.36Å; W17-A25 HydrophobicContact CZ3-CB 3.5Å; W17-A25 VanDerWaalsContact CZ3-CB 3.5Å
18	N	89.9	Confident	89.8	Confident	43 Å²	43	72.7 Å²	72.7	23%	0.23	41%	0.407	C	S	.	.			trans	-72.9	165.6	172.7	72.1	49	0	0	0	111.7	C20 E21 Q22 E120 Q124	N18-C20 PolarHBondContact O-N 3.1Å; N18-C20 WeakPolarHBondContact OD1-CA 3.31Å; N18-C20 WeakPolarHBondContact OD1-CB 3.37Å; N18-C20 PolarHBondContact OD1-N 3.4Å; N18-C20 VanDerWaalsContact OD1-N 3.09Å; N18-E21 PolarHBondContact N-OE2 2.91Å; N18-E21 PolarHBondContact ND2-OE1 3.47Å; N18-E21 PolarHBondContact ND2-OE2 3Å; N18-E21 PolarHBondContact O-N 2.83Å; N18-E21 VanDerWaalsContact O-N 3.12Å; N18-E21 WeakPolarHBondContact OD1-CG 3.45Å; N18-E21 PolarHBondContact OD1-N 3.09Å; N18-Q22 WeakPolarHBondContact O-CB 3.44Å; N18-Q22 WeakPolarHBondContact O-CG 3.34Å; N18-Q22 PolarHBondContact O-N 3.14Å; N18-E120 PolarHBondContact ND2-OE1 2.89Å; N18-Q124 PolarHBondContact ND2-NE2 3.42Å
19	E	88.6	Confident	90.1	Very high	150 Å²	150	75.4 Å²	75.4	70%	0.701	41%	0.411	S	S	*	.	H	α-helix	trans	-60.8	-32.1	-174.2	-61.5	-176.2	166.9	0	0	113.3	T23	E19-T23 WeakPolarHBondContact O-CB 3.42Å; E19-T23 PolarHBondContact O-N 2.79Å; E19-T23 PolarHBondContact O-OG1 2.66Å
20	C	91.8	Very high	90.1	Very high	3 Å²	3	76 Å²	76	2%	0.02	41%	0.412	C	S	.	.	H	α-helix	trans	-69.2	-45.8	175	-170.4	0	0	0	0	111.3	N18 T23 V24 Q124 Y128	N18-C20 PolarHBondContact O-N 3.1Å; N18-C20 WeakPolarHBondContact OD1-CA 3.31Å; N18-C20 WeakPolarHBondContact OD1-CB 3.37Å; N18-C20 PolarHBondContact OD1-N 3.4Å; N18-C20 VanDerWaalsContact OD1-N 3.09Å; C20-T23 WeakPolarHBondContact O-CB 3.46Å; C20-T23 PolarHBondContact O-N 3.1Å; C20-V24 WeakPolarHBondContact O-CB 3.42Å; C20-V24 VanDerWaalsContact O-CG2 3.29Å; C20-V24 WeakPolarHBondContact O-CG2 3.46Å; C20-V24 PolarHBondContact O-N 3.16Å; C20-Q124 HydrophobicContact CB-CB 3.96Å; C20-Q124 HydrophobicContact CB-CG 3.8Å; C20-Y128 WeakPolarHBondContact CA-OH 3.36Å; C20-Y128 HydrophobicContact CB-CD2 4.36Å; C20-Y128 HydrophobicContact CB-CE1 4.45Å; C20-Y128 HydrophobicContact CB-CE2 3.68Å; C20-Y128 PolarHBondContact N-OH 3.02Å
21	E	90.9	Very high	90.2	Very high	64 Å²	64	78.5 Å²	78.5	30%	0.299	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-41.9	176.7	-72.3	168.6	168.4	0	0	112	W17 N18 T23 V24 A25 R123	W17-E21 HydrophobicContact CB-CB 3.93Å; W17-E21 HydrophobicContact CG-CB 4.47Å; N18-E21 PolarHBondContact N-OE2 2.91Å; N18-E21 PolarHBondContact ND2-OE1 3.47Å; N18-E21 PolarHBondContact ND2-OE2 3Å; N18-E21 PolarHBondContact O-N 2.83Å; N18-E21 VanDerWaalsContact O-N 3.12Å; N18-E21 WeakPolarHBondContact OD1-CG 3.45Å; N18-E21 PolarHBondContact OD1-N 3.09Å; E21-T23 VanDerWaalsContact C-N 3.34Å; E21-T23 PolarHBondContact O-N 3.37Å; E21-V24 PolarHBondContact O-N 3.13Å; E21-A25 VanDerWaalsContact O-CB 3.23Å; E21-A25 WeakPolarHBondContact O-CB 3.37Å; E21-A25 PolarHBondContact O-N 3Å; E21-R123 IonicContact OE1-CZ 3.58Å; E21-R123 IonicContact OE1-NH1 2.7Å; E21-R123 IonicContact OE1-NH2 3.48Å; E21-R123 PolarHBondContact OE1-NH2 3.4Å
22	Q	92.4	Very high	90.5	Very high	53 Å²	53	85.7 Å²	85.7	25%	0.248	43%	0.433	C	S	.	.	H	α-helix	trans	-55.9	-47.3	169.6	-74.5	-177.7	41.5	0	0	111.1	F14 W17 N18 A25 L26	F14-Q22 HydrophobicContact CD1-CG 4.09Å; F14-Q22 HydrophobicContact CD2-CG 4.27Å; F14-Q22 HydrophobicContact CE1-CB 4Å; F14-Q22 HydrophobicContact CE1-CG 3.7Å; F14-Q22 HydrophobicContact CE2-CB 3.83Å; F14-Q22 HydrophobicContact CE2-CG 3.9Å; F14-Q22 HydrophobicContact CG-CG 4.36Å; F14-Q22 HydrophobicContact CZ-CB 3.45Å; F14-Q22 VanDerWaalsContact CZ-CB 3.45Å; F14-Q22 HydrophobicContact CZ-CG 3.59Å; W17-Q22 HydrophobicContact CB-CG 3.95Å; W17-Q22 PolarHBondContact O-NE2 2.94Å; N18-Q22 WeakPolarHBondContact O-CB 3.44Å; N18-Q22 WeakPolarHBondContact O-CG 3.34Å; N18-Q22 PolarHBondContact O-N 3.14Å; Q22-A25 PolarHBondContact O-N 2.95Å; Q22-L26 WeakPolarHBondContact O-CB 3.39Å; Q22-L26 WeakPolarHBondContact O-CG 3.49Å; Q22-L26 PolarHBondContact O-N 3.31Å
23	T	92.1	Very high	90.6	Very high	59 Å²	59	85.8 Å²	85.8	36%	0.362	42%	0.423	S	S	.	.	H	α-helix	trans	-64.2	-46.6	178.5	-57.5	0	0	0	0	112.1	E19 C20 E21 A25 L26 L27 Y128 I131	E19-T23 WeakPolarHBondContact O-CB 3.42Å; E19-T23 PolarHBondContact O-N 2.79Å; E19-T23 PolarHBondContact O-OG1 2.66Å; C20-T23 WeakPolarHBondContact O-CB 3.46Å; C20-T23 PolarHBondContact O-N 3.1Å; E21-T23 VanDerWaalsContact C-N 3.34Å; E21-T23 PolarHBondContact O-N 3.37Å; T23-A25 VanDerWaalsContact C-N 3.34Å; T23-A25 PolarHBondContact O-N 3.01Å; T23-L26 PolarHBondContact O-N 2.84Å; T23-L27 VanDerWaalsContact O-CB 3.32Å; T23-L27 WeakPolarHBondContact O-CB 3.28Å; T23-L27 PolarHBondContact O-N 2.93Å; T23-Y128 HydrophobicContact CG2-CE1 4.05Å; T23-I131 HydrophobicContact CG2-CD1 4.33Å
24	V	91.4	Very high	90.8	Very high	49 Å²	49	80.4 Å²	80.4	30%	0.297	41%	0.409	S	S	.	.	H	α-helix	trans	-61.1	-42.3	177.2	169.5	0	0	0	0	111	C20 E21 S28 I131	C20-V24 WeakPolarHBondContact O-CB 3.42Å; C20-V24 VanDerWaalsContact O-CG2 3.29Å; C20-V24 WeakPolarHBondContact O-CG2 3.46Å; C20-V24 PolarHBondContact O-N 3.16Å; E21-V24 PolarHBondContact O-N 3.13Å; V24-S28 VanDerWaalsContact O-CB 3.3Å; V24-S28 WeakPolarHBondContact O-CB 3.42Å; V24-S28 PolarHBondContact O-N 3.44Å; V24-S28 PolarHBondContact O-OG 2.78Å; V24-I131 HydrophobicContact CG2-CD1 3.87Å
25	A	90.9	Very high	90.9	Very high	20 Å²	20	84.1 Å²	84.1	17%	0.165	43%	0.427	C	S	.	.	H	α-helix	trans	-67.3	-47.2	177.4	0	0	0	0	0	111.9	W17 E21 Q22 T23 L27 S28 L29	W17-A25 HydrophobicContact CE3-CB 4.01Å; W17-A25 HydrophobicContact CH2-CB 4.36Å; W17-A25 HydrophobicContact CZ3-CB 3.5Å; W17-A25 VanDerWaalsContact CZ3-CB 3.5Å; E21-A25 VanDerWaalsContact O-CB 3.23Å; E21-A25 WeakPolarHBondContact O-CB 3.37Å; E21-A25 PolarHBondContact O-N 3Å; Q22-A25 PolarHBondContact O-N 2.95Å; T23-A25 VanDerWaalsContact C-N 3.34Å; T23-A25 PolarHBondContact O-N 3.01Å; A25-L27 PolarHBondContact O-N 3.14Å; A25-S28 PolarHBondContact O-N 3.25Å; A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.32Å
26	L	91.5	Very high	91	Very high	87 Å²	87	79 Å²	79	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-59.4	-46	175.6	-75.3	178.2	0	0	0	111.6	F14 Q22 T23 S28 L29 L30	F14-L26 HydrophobicContact CE2-CD1 4.37Å; F14-L26 HydrophobicContact CE2-CD2 4.07Å; F14-L26 HydrophobicContact CE2-CG 3.81Å; F14-L26 HydrophobicContact CZ-CD1 3.73Å; F14-L26 HydrophobicContact CZ-CD2 4.07Å; F14-L26 HydrophobicContact CZ-CG 3.69Å; Q22-L26 WeakPolarHBondContact O-CB 3.39Å; Q22-L26 WeakPolarHBondContact O-CG 3.49Å; Q22-L26 PolarHBondContact O-N 3.31Å; T23-L26 PolarHBondContact O-N 2.84Å; L26-S28 VanDerWaalsContact C-N 3.28Å; L26-S28 PolarHBondContact O-N 2.82Å; L26-L29 PolarHBondContact O-N 3.18Å; L26-L29 VanDerWaalsContact O-N 3.16Å; L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 VanDerWaalsContact O-CG 3.32Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 3.18Å
27	L	90.5	Very high	91.1	Very high	54 Å²	54	80.8 Å²	80.8	28%	0.283	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-37	176.5	-176.5	62.9	0	0	0	112	T23 A25 L30 K31 I131	T23-L27 VanDerWaalsContact O-CB 3.32Å; T23-L27 WeakPolarHBondContact O-CB 3.28Å; T23-L27 PolarHBondContact O-N 2.93Å; A25-L27 PolarHBondContact O-N 3.14Å; L27-L30 PolarHBondContact O-N 3.2Å; L27-K31 VanDerWaalsContact O-CG 3.31Å; L27-K31 WeakPolarHBondContact O-CG 3.18Å; L27-K31 PolarHBondContact O-N 2.79Å; L27-K31 VanDerWaalsContact O-N 3.08Å; L27-I131 HydrophobicContact CD2-CB 3.76Å; L27-I131 HydrophobicContact CD2-CD1 3.98Å; L27-I131 HydrophobicContact CD2-CG1 4.15Å; L27-I131 HydrophobicContact CD2-CG2 4.35Å
28	S	89.4	Confident	91.2	Very high	60 Å²	60	77.1 Å²	77.1	42%	0.42	40%	0.395	S	S	.	.	H	α-helix	trans	-70.9	-29.1	176.6	-59.9	0	0	0	0	113	V24 A25 L26	V24-S28 VanDerWaalsContact O-CB 3.3Å; V24-S28 WeakPolarHBondContact O-CB 3.42Å; V24-S28 PolarHBondContact O-N 3.44Å; V24-S28 PolarHBondContact O-OG 2.78Å; A25-S28 PolarHBondContact O-N 3.25Å; L26-S28 VanDerWaalsContact C-N 3.28Å; L26-S28 PolarHBondContact O-N 2.82Å
29	L	90.8	Very high	91.3	Very high	102 Å²	102	80.8 Å²	80.8	53%	0.534	41%	0.406	S	S	.	.	H	α-helix	trans	-78.3	-40.7	171.5	-68.3	171.5	0	0	0	111.9	A25 L26 K31 R32 V33	A25-L29 WeakPolarHBondContact O-CG 3.38Å; A25-L29 PolarHBondContact O-N 3.32Å; L26-L29 PolarHBondContact O-N 3.18Å; L26-L29 VanDerWaalsContact O-N 3.16Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 2.96Å; L29-R32 WeakPolarHBondContact O-CA 3.43Å; L29-R32 WeakPolarHBondContact O-CB 3.45Å; L29-R32 PolarHBondContact O-N 3.45Å; L29-V33 PolarHBondContact O-N 3.39Å
30	L	90.6	Very high	91.6	Very high	69 Å²	69	80 Å²	80	36%	0.361	40%	0.4	S	S	.	.	H	α-helix	trans	-60.4	-37	176.1	-76.7	166.8	0	0	0	112.1	L26 L27 R32 V33 L41	L26-L30 WeakPolarHBondContact O-CB 3.49Å; L26-L30 VanDerWaalsContact O-CG 3.32Å; L26-L30 WeakPolarHBondContact O-CG 3.46Å; L26-L30 PolarHBondContact O-N 3.18Å; L27-L30 PolarHBondContact O-N 3.2Å; L30-R32 PolarHBondContact O-N 2.94Å; L30-V33 HydrophobicContact CD2-CG2 4.49Å; L30-V33 WeakPolarHBondContact O-CG2 3.37Å; L30-V33 PolarHBondContact O-N 3.19Å; L30-L41 HydrophobicContact CD2-CD1 3.72Å
31	K	88.7	Confident	91.7	Very high	154 Å²	154	82.9 Å²	82.9	67%	0.67	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-7.6	170.6	-75	170.1	-179	175.7	0	114.5	L27 L29	L27-K31 VanDerWaalsContact O-CG 3.31Å; L27-K31 WeakPolarHBondContact O-CG 3.18Å; L27-K31 PolarHBondContact O-N 2.79Å; L27-K31 VanDerWaalsContact O-N 3.08Å; L29-K31 VanDerWaalsContact C-N 3.29Å; L29-K31 PolarHBondContact O-N 2.96Å
32	R	92.1	Very high	91.7	Very high	209 Å²	209	83.8 Å²	83.8	79%	0.789	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	-6.5	-177.3	-58.9	175.9	65.8	173.1	2.2	114.3	L29 L30	L29-R32 WeakPolarHBondContact O-CA 3.43Å; L29-R32 WeakPolarHBondContact O-CB 3.45Å; L29-R32 PolarHBondContact O-N 3.45Å; L30-R32 PolarHBondContact O-N 2.94Å
33	V	92.2	Very high	91.7	Very high	52 Å²	52	85.3 Å²	85.3	32%	0.315	43%	0.429	S	S	.	.	S	Bend	trans	-84.7	161.6	175	-52.4	0	0	0	0	111.3	L29 L30 Q37 A38	L29-V33 PolarHBondContact O-N 3.39Å; L30-V33 HydrophobicContact CD2-CG2 4.49Å; L30-V33 WeakPolarHBondContact O-CG2 3.37Å; L30-V33 PolarHBondContact O-N 3.19Å; V33-Q37 HydrophobicContact CB-CB 3.93Å; V33-Q37 HydrophobicContact CG2-CB 4.06Å; V33-A38 HydrophobicContact CG2-CB 4Å
34	S	93.6	Very high	91.7	Very high	43 Å²	43	85.2 Å²	85.2	30%	0.301	43%	0.43	S	S	.	.			trans	-71.7	156.5	174	64	0	0	0	0	112.2	T36 Q37 A38	S34-T36 PolarHBondContact O-N 3.45Å; S34-T36 VanDerWaalsContact O-N 3.16Å; S34-Q37 CarbonylContact O-C 3.57Å; S34-Q37 WeakPolarHBondContact O-CA 3.4Å; S34-Q37 WeakPolarHBondContact O-CB 3.31Å; S34-Q37 PolarHBondContact O-N 2.95Å; S34-Q37 VanDerWaalsContact OG-CD 3.3Å; S34-Q37 WeakPolarHBondContact OG-CG 3.38Å; S34-Q37 PolarHBondContact OG-N 3.2Å; S34-Q37 PolarHBondContact OG-OE1 3.42Å; S34-A38 PolarHBondContact O-N 3.31Å
35	Q	92.6	Very high	91.6	Very high	136 Å²	136	87.3 Å²	87.3	64%	0.636	44%	0.439	S	S	*	.	H	α-helix	trans	-55.1	-36.2	178.9	-165.7	66.3	13.7	0	0	112.8	A38 R39 A630	Q35-A38 PolarHBondContact O-N 3.33Å; Q35-R39 WeakPolarHBondContact O-CB 3.29Å; Q35-R39 PolarHBondContact O-N 3.27Å; Q35-A630 HydrophobicContact CG-CB 4.02Å
36	T	92.2	Very high	91.6	Very high	78 Å²	78	90.9 Å²	90.9	48%	0.479	45%	0.452	S	S	.	.	H	α-helix	trans	-65	-42.1	175.8	-43.1	0	0	0	0	111.9	S34 F40	S34-T36 PolarHBondContact O-N 3.45Å; S34-T36 VanDerWaalsContact O-N 3.16Å; T36-F40 WeakPolarHBondContact O-CB 3.45Å; T36-F40 PolarHBondContact O-N 3.41Å
37	Q	91.3	Very high	91.5	Very high	104 Å²	104	93.8 Å²	93.8	49%	0.486	46%	0.463	S	S	.	.	H	α-helix	trans	-69.3	-39.9	175	-71.5	164.2	-51.5	0	0	111.6	V33 S34 F40 L41	V33-Q37 HydrophobicContact CB-CB 3.93Å; V33-Q37 HydrophobicContact CG2-CB 4.06Å; S34-Q37 CarbonylContact O-C 3.57Å; S34-Q37 WeakPolarHBondContact O-CA 3.4Å; S34-Q37 WeakPolarHBondContact O-CB 3.31Å; S34-Q37 PolarHBondContact O-N 2.95Å; S34-Q37 VanDerWaalsContact OG-CD 3.3Å; S34-Q37 WeakPolarHBondContact OG-CG 3.38Å; S34-Q37 PolarHBondContact OG-N 3.2Å; S34-Q37 PolarHBondContact OG-OE1 3.42Å; Q37-F40 PolarHBondContact O-N 3.45Å; Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 VanDerWaalsContact O-CG 3.29Å; Q37-L41 WeakPolarHBondContact O-CG 3.49Å; Q37-L41 PolarHBondContact O-N 3.43Å
38	A	91.3	Very high	91.3	Very high	30 Å²	30	94.7 Å²	94.7	25%	0.248	47%	0.474	C	S	.	.	H	α-helix	trans	-60.9	-44.5	174.9	0	0	0	0	0	111.4	V33 S34 Q35 L41 Q42	V33-A38 HydrophobicContact CG2-CB 4Å; S34-A38 PolarHBondContact O-N 3.31Å; Q35-A38 PolarHBondContact O-N 3.33Å; A38-L41 PolarHBondContact O-N 3.22Å; A38-Q42 WeakPolarHBondContact O-CB 3.28Å; A38-Q42 PolarHBondContact O-N 2.85Å
39	R	93.2	Very high	91.2	Very high	121 Å²	121	95.6 Å²	95.6	46%	0.457	47%	0.474	S	S	.	.	H	α-helix	trans	-68.1	-34.4	176.7	-174.6	58.3	-179.3	156.2	9.8	112.8	Q35 L43 E46	Q35-R39 WeakPolarHBondContact O-CB 3.29Å; Q35-R39 PolarHBondContact O-N 3.27Å; R39-L43 WeakPolarHBondContact O-CG 3.23Å; R39-L43 PolarHBondContact O-N 2.71Å; R39-L43 VanDerWaalsContact O-N 3.11Å; R39-E46 IonicContact NH1-OE1 2.72Å; R39-E46 IonicContact NH1-OE2 2.6Å
40	F	94	Very high	90.8	Very high	132 Å²	132	93.5 Å²	93.5	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-65.1	-47.9	172	173.1	-99.4	0	0	0	111.9	T36 Q37 Q42 L43 C44	T36-F40 WeakPolarHBondContact O-CB 3.45Å; T36-F40 PolarHBondContact O-N 3.41Å; Q37-F40 PolarHBondContact O-N 3.45Å; F40-Q42 VanDerWaalsContact C-N 3.32Å; F40-Q42 PolarHBondContact O-N 3.37Å; F40-L43 PolarHBondContact O-N 3.36Å; F40-C44 VanDerWaalsContact CZ-SG 3.57Å; F40-C44 PolarHBondContact O-N 3.11Å; F40-C44 PolarHBondContact O-SG 3.33Å
41	L	93.1	Very high	90.2	Very high	65 Å²	65	97.4 Å²	97.4	34%	0.34	49%	0.492	S	S	.	.	H	α-helix	trans	-62.6	-39.3	177	-71.3	169.3	0	0	0	111.6	L30 Q37 A38 C44 L45	L30-L41 HydrophobicContact CD2-CD1 3.72Å; Q37-L41 WeakPolarHBondContact O-CB 3.27Å; Q37-L41 VanDerWaalsContact O-CG 3.29Å; Q37-L41 WeakPolarHBondContact O-CG 3.49Å; Q37-L41 PolarHBondContact O-N 3.43Å; A38-L41 PolarHBondContact O-N 3.22Å; L41-C44 PolarHBondContact O-N 3.42Å; L41-L45 WeakPolarHBondContact O-CB 3.43Å; L41-L45 VanDerWaalsContact O-CG 3.29Å; L41-L45 WeakPolarHBondContact O-CG 3.29Å; L41-L45 PolarHBondContact O-N 3.04Å
42	Q	92.3	Very high	90	Very high	82 Å²	82	92.6 Å²	92.6	38%	0.383	48%	0.478	S	S	.	.	H	α-helix	trans	-56.8	-50	172.5	-179.6	-178.1	9.6	0	0	111.5	A38 F40 C44 L45 E46	A38-Q42 WeakPolarHBondContact O-CB 3.28Å; A38-Q42 PolarHBondContact O-N 2.85Å; F40-Q42 VanDerWaalsContact C-N 3.32Å; F40-Q42 PolarHBondContact O-N 3.37Å; Q42-C44 VanDerWaalsContact C-N 3.32Å; Q42-C44 PolarHBondContact O-N 3.41Å; Q42-L45 PolarHBondContact O-N 3.26Å; Q42-E46 HydrophobicContact CG-CG 4.2Å; Q42-E46 VanDerWaalsContact CG-OE1 3.26Å; Q42-E46 WeakPolarHBondContact CG-OE1 3.41Å; Q42-E46 PolarHBondContact NE2-OE1 3.02Å; Q42-E46 WeakPolarHBondContact O-CB 3.25Å; Q42-E46 VanDerWaalsContact O-CG 3.31Å; Q42-E46 WeakPolarHBondContact O-CG 3.39Å; Q42-E46 PolarHBondContact O-N 3.37Å
43	L	91.5	Very high	89.8	Confident	86 Å²	86	86.1 Å²	86.1	45%	0.45	47%	0.469	S	S	.	.	H	α-helix	trans	-63.2	-37	178.9	-71.2	167.2	0	0	0	112.5	R39 F40 H47	R39-L43 WeakPolarHBondContact O-CG 3.23Å; R39-L43 PolarHBondContact O-N 2.71Å; R39-L43 VanDerWaalsContact O-N 3.11Å; F40-L43 PolarHBondContact O-N 3.36Å; L43-H47 WeakPolarHBondContact O-CB 3.45Å; L43-H47 PolarHBondContact O-N 3.33Å
44	C	91.6	Very high	89.6	Confident	56 Å²	56	91 Å²	91	38%	0.378	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-41.9	174.4	-62.8	0	0	0	0	111.8	F40 L41 Q42 S48	F40-C44 VanDerWaalsContact CZ-SG 3.57Å; F40-C44 PolarHBondContact O-N 3.11Å; F40-C44 PolarHBondContact O-SG 3.33Å; L41-C44 PolarHBondContact O-N 3.42Å; Q42-C44 VanDerWaalsContact C-N 3.32Å; Q42-C44 PolarHBondContact O-N 3.41Å; C44-S48 WeakPolarHBondContact O-CB 3.5Å; C44-S48 PolarHBondContact O-N 3.42Å; C44-S48 PolarHBondContact O-OG 2.94Å
45	L	90.5	Very high	89.3	Confident	94 Å²	94	91.5 Å²	91.5	49%	0.492	49%	0.487	S	S	.	.	H	α-helix	trans	-67.8	-49.8	177.5	-71.5	168	0	0	0	111.3	L41 Q42 H47 S48 L49	L41-L45 WeakPolarHBondContact O-CB 3.43Å; L41-L45 VanDerWaalsContact O-CG 3.29Å; L41-L45 WeakPolarHBondContact O-CG 3.29Å; L41-L45 PolarHBondContact O-N 3.04Å; Q42-L45 PolarHBondContact O-N 3.26Å; L45-H47 VanDerWaalsContact C-N 3.26Å; L45-H47 PolarHBondContact O-N 3.21Å; L45-S48 WeakPolarHBondContact CA-OG 3.47Å; L45-S48 PolarHBondContact O-N 3.01Å; L45-S48 PolarHBondContact O-OG 2.8Å; L45-L49 VanDerWaalsContact O-CG 3.3Å; L45-L49 WeakPolarHBondContact O-CG 3.04Å; L45-L49 PolarHBondContact O-N 3.08Å
46	E	89.9	Confident	89.2	Confident	94 Å²	94	89.1 Å²	89.1	44%	0.439	48%	0.476	S	S	.	.	H	α-helix	trans	-52.8	-43.4	174.9	-75.3	170.5	174.3	0	0	111.4	R39 Q42 A50	R39-E46 IonicContact NH1-OE1 2.72Å; R39-E46 IonicContact NH1-OE2 2.6Å; Q42-E46 HydrophobicContact CG-CG 4.2Å; Q42-E46 VanDerWaalsContact CG-OE1 3.26Å; Q42-E46 WeakPolarHBondContact CG-OE1 3.41Å; Q42-E46 PolarHBondContact NE2-OE1 3.02Å; Q42-E46 WeakPolarHBondContact O-CB 3.25Å; Q42-E46 VanDerWaalsContact O-CG 3.31Å; Q42-E46 WeakPolarHBondContact O-CG 3.39Å; Q42-E46 PolarHBondContact O-N 3.37Å; E46-A50 PolarHBondContact O-N 3.1Å
47	H	89.7	Confident	89.2	Confident	148 Å²	148	88.1 Å²	88.1	69%	0.685	47%	0.469	S	S	*	.	H	α-helix	trans	-67.3	-43.5	175	-176.6	27.6	0	0	0	112.8	L43 L45 L49 A50	L43-H47 WeakPolarHBondContact O-CB 3.45Å; L43-H47 PolarHBondContact O-N 3.33Å; L45-H47 VanDerWaalsContact C-N 3.26Å; L45-H47 PolarHBondContact O-N 3.21Å; H47-L49 VanDerWaalsContact C-N 3.26Å; H47-L49 PolarHBondContact O-N 2.94Å; H47-A50 PolarHBondContact O-N 3.19Å
48	S	86.9	Confident	89.2	Confident	74 Å²	74	85.2 Å²	85.2	52%	0.517	46%	0.457	S	S	.	.	H	α-helix	trans	-69.2	-18.9	-178.6	69	0	0	0	0	114.9	C44 L45	C44-S48 WeakPolarHBondContact O-CB 3.5Å; C44-S48 PolarHBondContact O-N 3.42Å; C44-S48 PolarHBondContact O-OG 2.94Å; L45-S48 WeakPolarHBondContact CA-OG 3.47Å; L45-S48 PolarHBondContact O-N 3.01Å; L45-S48 PolarHBondContact O-OG 2.8Å
49	L	87.3	Confident	89.2	Confident	79 Å²	79	86.6 Å²	86.6	41%	0.414	46%	0.458	S	S	.	.	H	α-helix	trans	-101.5	-7.1	-178.9	-62.6	175.1	0	0	0	113.4	L45 H47 D51 C52 L55	L45-L49 VanDerWaalsContact O-CG 3.3Å; L45-L49 WeakPolarHBondContact O-CG 3.04Å; L45-L49 PolarHBondContact O-N 3.08Å; H47-L49 VanDerWaalsContact C-N 3.26Å; H47-L49 PolarHBondContact O-N 2.94Å; L49-D51 PolarHBondContact O-N 2.89Å; L49-C52 WeakPolarHBondContact O-CB 3.3Å; L49-C52 PolarHBondContact O-N 3.32Å; L49-L55 HydrophobicContact CB-CD2 4.47Å; L49-L55 HydrophobicContact CD2-CD2 3.88Å
50	A	81.5	Confident	89.2	Confident	57 Å²	57	88.6 Å²	88.6	47%	0.471	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-42	-172.1	0	0	0	0	0	113.5	E46 H47	E46-A50 PolarHBondContact O-N 3.1Å; H47-A50 PolarHBondContact O-N 3.19Å
51	D	78.3	Confident	89.2	Confident	152 Å²	152	85.7 Å²	85.7	81%	0.813	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	2.3	-175.7	-60.1	-50	0	0	0	113.7	L49 A53	L49-D51 PolarHBondContact O-N 2.89Å; D51-A53 PolarHBondContact O-N 2.96Å
52	C	85.9	Confident	89.2	Confident	53 Å²	53	82.6 Å²	82.6	36%	0.358	44%	0.438	S	S	.	.			trans	-78.1	75.5	-176	-67.3	0	0	0	0	112.3	L49 E54 L55 H56	L49-C52 WeakPolarHBondContact O-CB 3.3Å; L49-C52 PolarHBondContact O-N 3.32Å; C52-E54 VanDerWaalsContact C-N 3.3Å; C52-E54 PolarHBondContact O-N 3.04Å; C52-L55 HydrophobicContact CB-CB 3.88Å; C52-L55 HydrophobicContact CB-CD2 4.36Å; C52-L55 WeakPolarHBondContact O-CB 3.37Å; C52-L55 PolarHBondContact O-N 2.73Å; C52-L55 VanDerWaalsContact O-N 3.17Å; C52-H56 PolarHBondContact O-N 2.83Å; C52-H56 PolarHBondContact O-ND1 2.73Å
53	A	86.6	Confident	89.3	Confident	73 Å²	73	79.8 Å²	79.8	60%	0.603	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-37.9	-176	0	0	0	0	0	114.3	D51 H56 V57	D51-A53 PolarHBondContact O-N 2.96Å; A53-H56 PolarHBondContact O-N 2.81Å; A53-V57 PolarHBondContact O-N 3.27Å
54	E	88.1	Confident	89.4	Confident	154 Å²	154	77.6 Å²	77.6	72%	0.72	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-41.8	177.7	-176.8	172.7	-160.4	0	0	112.3	C52 H56 V57 L58	C52-E54 VanDerWaalsContact C-N 3.3Å; C52-E54 PolarHBondContact O-N 3.04Å; E54-H56 PolarHBondContact O-N 2.79Å; E54-V57 WeakPolarHBondContact O-CA 3.46Å; E54-V57 WeakPolarHBondContact O-CB 3.39Å; E54-V57 PolarHBondContact O-N 2.98Å; E54-L58 HydrophobicContact CG-CD1 4.44Å; E54-L58 PolarHBondContact O-N 3.41Å
55	L	88.3	Confident	89.4	Confident	54 Å²	54	77.2 Å²	77.2	28%	0.283	41%	0.414	S	S	.	.	H	α-helix	trans	-59.8	-37.8	174.4	-176.5	63.7	0	0	0	111.3	L49 C52 V57 L58 E59 L89	L49-L55 HydrophobicContact CB-CD2 4.47Å; L49-L55 HydrophobicContact CD2-CD2 3.88Å; C52-L55 HydrophobicContact CB-CB 3.88Å; C52-L55 HydrophobicContact CB-CD2 4.36Å; C52-L55 WeakPolarHBondContact O-CB 3.37Å; C52-L55 PolarHBondContact O-N 2.73Å; C52-L55 VanDerWaalsContact O-N 3.17Å; L55-V57 VanDerWaalsContact C-N 3.26Å; L55-V57 PolarHBondContact O-N 3.46Å; L55-L58 PolarHBondContact O-N 3.35Å; L55-E59 VanDerWaalsContact O-CB 3.22Å; L55-E59 WeakPolarHBondContact O-CB 3.42Å; L55-E59 PolarHBondContact O-N 3.17Å; L55-L89 HydrophobicContact CD1-CD1 4.03Å; L55-L89 HydrophobicContact CD1-CD2 3.76Å
56	H	88.9	Confident	89.5	Confident	86 Å²	86	74.8 Å²	74.8	40%	0.398	41%	0.412	S	S	.	.	H	α-helix	trans	-71.9	-13.7	174.4	-66.6	90.6	0	0	0	113.8	C52 A53 E54 R60	C52-H56 PolarHBondContact O-N 2.83Å; C52-H56 PolarHBondContact O-ND1 2.73Å; A53-H56 PolarHBondContact O-N 2.81Å; E54-H56 PolarHBondContact O-N 2.79Å; H56-R60 PolarHBondContact O-NE 3.02Å; H56-R60 PolarHBondContact O-NH2 3.07Å
57	V	92	Very high	89.6	Confident	56 Å²	56	72.6 Å²	72.6	34%	0.339	40%	0.403	S	S	.	.	H	α-helix	trans	-79.8	-57.2	166.2	178.5	0	0	0	0	109.1	A53 E54 L55 E59 R60 E61	A53-V57 PolarHBondContact O-N 3.27Å; E54-V57 WeakPolarHBondContact O-CA 3.46Å; E54-V57 WeakPolarHBondContact O-CB 3.39Å; E54-V57 PolarHBondContact O-N 2.98Å; L55-V57 VanDerWaalsContact C-N 3.26Å; L55-V57 PolarHBondContact O-N 3.46Å; V57-E59 VanDerWaalsContact C-N 3.26Å; V57-E59 PolarHBondContact O-N 3.41Å; V57-R60 WeakPolarHBondContact O-CB 3.48Å; V57-R60 PolarHBondContact O-N 2.95Å; V57-E61 HydrophobicContact CG1-CG 4.48Å; V57-E61 VanDerWaalsContact CG1-OE1 3.31Å; V57-E61 WeakPolarHBondContact CG1-OE1 3.4Å; V57-E61 PolarHBondContact O-N 2.75Å
58	L	92.7	Very high	89.8	Confident	44 Å²	44	65.6 Å²	65.6	23%	0.23	37%	0.37	C	S	.	.	H	α-helix	trans	-55.6	-39.6	-179.3	-64.2	170.6	0	0	0	112.2	E54 L55 R60 E61 A62 T85 H86 L89	E54-L58 HydrophobicContact CG-CD1 4.44Å; E54-L58 PolarHBondContact O-N 3.41Å; L55-L58 PolarHBondContact O-N 3.35Å; L58-R60 VanDerWaalsContact C-N 3.35Å; L58-R60 PolarHBondContact O-N 2.93Å; L58-E61 PolarHBondContact O-N 2.64Å; L58-A62 WeakPolarHBondContact O-CB 3.41Å; L58-A62 PolarHBondContact O-N 3.05Å; L58-T85 HydrophobicContact CD1-CG2 4.08Å; L58-T85 HydrophobicContact CD2-CG2 4.26Å; L58-H86 WeakPolarHBondContact CD2-NE2 3.26Å; L58-H86 PolarHBondContact O-CD2 2.98Å; L58-L89 HydrophobicContact CB-CD1 3.63Å
59	E	91.9	Very high	90	Very high	58 Å²	58	65.9 Å²	65.9	27%	0.271	37%	0.366	S	S	.	.	H	α-helix	trans	-66	-33.6	176.8	-164	-149.7	-144.4	0	0	112.6	L55 V57 N63 L89 K91	L55-E59 VanDerWaalsContact O-CB 3.22Å; L55-E59 WeakPolarHBondContact O-CB 3.42Å; L55-E59 PolarHBondContact O-N 3.17Å; V57-E59 VanDerWaalsContact C-N 3.26Å; V57-E59 PolarHBondContact O-N 3.41Å; E59-N63 WeakPolarHBondContact O-CB 3.37Å; E59-N63 PolarHBondContact O-N 2.88Å; E59-N63 PolarHBondContact O-ND2 3.02Å; E59-L89 HydrophobicContact CG-CB 4.37Å; E59-K91 WeakPolarHBondContact OE1-CE 3.32Å; E59-K91 IonicContact OE1-NZ 3.98Å; E59-K91 PolarHBondContact OE1-NZ 3.49Å; E59-K91 VanDerWaalsContact OE1-NZ 3.07Å; E59-K91 WeakPolarHBondContact OE2-CE 3.4Å; E59-K91 IonicContact OE2-NZ 3.49Å; E59-K91 PolarHBondContact OE2-NZ 3.44Å
60	R	92.2	Very high	90.3	Very high	163 Å²	163	67.8 Å²	67.8	62%	0.615	37%	0.373	S	S	*	.	H	α-helix	trans	-72.2	-40.5	174.2	-77.8	179.8	-71.6	148.9	0.3	111.6	H56 V57 L58 N63 S64	H56-R60 PolarHBondContact O-NE 3.02Å; H56-R60 PolarHBondContact O-NH2 3.07Å; V57-R60 WeakPolarHBondContact O-CB 3.48Å; V57-R60 PolarHBondContact O-N 2.95Å; L58-R60 VanDerWaalsContact C-N 3.35Å; L58-R60 PolarHBondContact O-N 2.93Å; R60-N63 PolarHBondContact O-N 3.23Å; R60-S64 PolarHBondContact O-N 3.48Å
61	E	93.4	Very high	90.8	Very high	72 Å²	72	66 Å²	66	34%	0.336	35%	0.354	S	S	.	.	H	α-helix	trans	-67.3	-43.8	177.9	-64.4	-175.8	-169.2	0	0	111.2	V57 L58 N63 S64 I67	V57-E61 HydrophobicContact CG1-CG 4.48Å; V57-E61 VanDerWaalsContact CG1-OE1 3.31Å; V57-E61 WeakPolarHBondContact CG1-OE1 3.4Å; V57-E61 PolarHBondContact O-N 2.75Å; L58-E61 PolarHBondContact O-N 2.64Å; E61-N63 PolarHBondContact O-N 3.19Å; E61-S64 PolarHBondContact O-N 2.96Å; E61-S64 VanDerWaalsContact O-N 3.07Å; E61-I67 HydrophobicContact CB-CD1 4.27Å; E61-I67 HydrophobicContact CG-CD1 3.97Å
62	A	93	Very high	91.3	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.4	174.4	0	0	0	0	0	114.5	L58 H86 L89 Y101	L58-A62 WeakPolarHBondContact O-CB 3.41Å; L58-A62 PolarHBondContact O-N 3.05Å; A62-H86 HydrophobicContact CB-CB 3.76Å; A62-H86 WeakPolarHBondContact CB-O 3.17Å; A62-L89 HydrophobicContact CB-CB 3.76Å; A62-Y101 WeakPolarHBondContact CA-OH 3.4Å; A62-Y101 VanDerWaalsContact O-CE2 3.31Å; A62-Y101 WeakPolarHBondContact O-CE2 3.29Å; A62-Y101 PolarHBondContact O-OH 2.96Å
63	N	94.8	Very high	91.4	Very high	22 Å²	22	67.3 Å²	67.3	12%	0.118	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	4.7	-178.5	-78.9	-81.6	0	0	0	113.5	E59 R60 E61 P65 L89 K91 N94	E59-N63 WeakPolarHBondContact O-CB 3.37Å; E59-N63 PolarHBondContact O-N 2.88Å; E59-N63 PolarHBondContact O-ND2 3.02Å; R60-N63 PolarHBondContact O-N 3.23Å; E61-N63 PolarHBondContact O-N 3.19Å; N63-P65 WeakPolarHBondContact O-CD 3.46Å; N63-L89 PolarHBondContact ND2-O 2.91Å; N63-K91 VanDerWaalsContact OD1-CB 3.32Å; N63-K91 WeakPolarHBondContact OD1-CB 3.32Å; N63-K91 PolarHBondContact OD1-N 2.95Å; N63-N94 WeakPolarHBondContact CB-ND2 3.4Å; N63-N94 PolarHBondContact O-ND2 3.2Å; N63-N94 PolarHBondContact OD1-ND2 2.77Å
64	S	94.6	Very high	91.8	Very high	40 Å²	40	67.6 Å²	67.6	28%	0.28	34%	0.338	S	S	.	.			trans	-99.9	104.8	179.3	-179.2	0	0	0	0	111.1	R60 E61 G66 I67 I68	R60-S64 PolarHBondContact O-N 3.48Å; E61-S64 PolarHBondContact O-N 2.96Å; E61-S64 VanDerWaalsContact O-N 3.07Å; S64-G66 PolarHBondContact O-N 3.36Å; S64-G66 VanDerWaalsContact O-N 3.17Å; S64-I67 PolarHBondContact O-N 3.22Å; S64-I68 WeakPolarHBondContact O-CG1 3.39Å; S64-I68 PolarHBondContact O-N 3.39Å; S64-I68 VanDerWaalsContact O-N 3.09Å
65	P	91.3	Very high	91.9	Very high	49 Å²	49	62.9 Å²	62.9	32%	0.318	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-29.3	179.5	24.2	-33.8	0	0	0	112.5	N63 I67 N69 D96 E100	N63-P65 WeakPolarHBondContact O-CD 3.46Å; P65-I67 VanDerWaalsContact C-N 3.31Å; P65-I67 PolarHBondContact O-N 3.11Å; P65-N69 VanDerWaalsContact O-CB 3.27Å; P65-N69 WeakPolarHBondContact O-CB 3.48Å; P65-N69 PolarHBondContact O-N 3.17Å; P65-D96 HydrophobicContact CB-CB 4.43Å; P65-D96 HydrophobicContact CG-CB 4.11Å; P65-E100 HydrophobicContact CB-CG 4.02Å
66	G	91.5	Very high	92	Very high	42 Å²	42	63.7 Å²	63.7	43%	0.433	32%	0.324	S	S	.	.	H	α-helix	trans	-65.7	-28.9	174.8	0	0	0	0	0	114	S64 Q70	S64-G66 PolarHBondContact O-N 3.36Å; S64-G66 VanDerWaalsContact O-N 3.17Å; G66-Q70 WeakPolarHBondContact O-CG 3.45Å; G66-Q70 PolarHBondContact O-NE2 3.25Å
67	I	92.8	Very high	92	Very high	49 Å²	49	63.5 Å²	63.5	25%	0.251	33%	0.326	S	S	.	.	H	α-helix	trans	-84.4	-46	176.6	-67	175.1	0	0	0	110.1	E61 S64 P65 N69 Q70 W71	E61-I67 HydrophobicContact CB-CD1 4.27Å; E61-I67 HydrophobicContact CG-CD1 3.97Å; S64-I67 PolarHBondContact O-N 3.22Å; P65-I67 VanDerWaalsContact C-N 3.31Å; P65-I67 PolarHBondContact O-N 3.11Å; I67-N69 PolarHBondContact O-N 2.82Å; I67-Q70 WeakPolarHBondContact O-CB 3.37Å; I67-Q70 PolarHBondContact O-N 3.35Å; I67-W71 HydrophobicContact CG2-CZ2 4.03Å; I67-W71 PolarHBondContact O-N 3.36Å
68	I	93.2	Very high	92	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-57.4	-36.7	177.8	-57.9	156.9	0	0	0	111.1	S64 W71 A97 E100 Y101 L104	S64-I68 WeakPolarHBondContact O-CG1 3.39Å; S64-I68 PolarHBondContact O-N 3.39Å; S64-I68 VanDerWaalsContact O-N 3.09Å; I68-W71 HydrophobicContact CB-CE3 4.24Å; I68-W71 HydrophobicContact CB-CZ3 4.2Å; I68-W71 HydrophobicContact CG1-CE3 4.39Å; I68-W71 HydrophobicContact CG1-CH2 3.98Å; I68-W71 HydrophobicContact CG1-CZ3 3.87Å; I68-W71 HydrophobicContact CG2-CE3 3.97Å; I68-W71 HydrophobicContact CG2-CZ3 4.01Å; I68-W71 WeakPolarHBondContact O-CB 3.42Å; I68-W71 PolarHBondContact O-N 3.04Å; I68-A97 HydrophobicContact CD1-CB 3.72Å; I68-E100 HydrophobicContact CB-CB 4.03Å; I68-E100 HydrophobicContact CG2-CB 3.6Å; I68-Y101 HydrophobicContact CD1-CD2 3.92Å; I68-Y101 HydrophobicContact CD1-CE2 3.39Å; I68-Y101 HydrophobicContact CG1-CE2 4.1Å; I68-L104 HydrophobicContact CG2-CD2 4.47Å
69	N	92.1	Very high	92.1	Very high	80 Å²	80	63.8 Å²	63.8	43%	0.428	32%	0.321	S	S	.	.	H	α-helix	trans	-70	-29.9	175.8	-170.6	32.5	0	0	0	113.5	P65 I67 W71 Q72	P65-N69 VanDerWaalsContact O-CB 3.27Å; P65-N69 WeakPolarHBondContact O-CB 3.48Å; P65-N69 PolarHBondContact O-N 3.17Å; I67-N69 PolarHBondContact O-N 2.82Å; N69-W71 VanDerWaalsContact C-N 3.31Å; N69-W71 PolarHBondContact O-N 3.03Å; N69-Q72 WeakPolarHBondContact O-CB 3.32Å; N69-Q72 WeakPolarHBondContact O-CG 3.48Å; N69-Q72 PolarHBondContact O-N 3.47Å; N69-Q72 PolarHBondContact OD1-NE2 2.92Å
70	Q	92.6	Very high	92.1	Very high	119 Å²	119	61.2 Å²	61.2	56%	0.556	31%	0.309	S	S	*	.	H	α-helix	trans	-67.6	-32.4	175.6	-73.5	167.4	60.3	0	0	111.8	G66 I67 Q72 Q73	G66-Q70 WeakPolarHBondContact O-CG 3.45Å; G66-Q70 PolarHBondContact O-NE2 3.25Å; I67-Q70 WeakPolarHBondContact O-CB 3.37Å; I67-Q70 PolarHBondContact O-N 3.35Å; Q70-Q72 PolarHBondContact O-N 3.39Å; Q70-Q73 WeakPolarHBondContact O-CB 3.35Å; Q70-Q73 PolarHBondContact O-N 2.87Å
71	W	93.3	Very high	92.2	Very high	18 Å²	18	56.8 Å²	56.8	7%	0.068	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-58.4	-19.5	175.4	-55.4	-20.1	0	0	0	113.3	I67 I68 N69 Q73 E74 V79 L82 L83 H86 Y101 L104	I67-W71 HydrophobicContact CG2-CZ2 4.03Å; I67-W71 PolarHBondContact O-N 3.36Å; I68-W71 HydrophobicContact CB-CE3 4.24Å; I68-W71 HydrophobicContact CB-CZ3 4.2Å; I68-W71 HydrophobicContact CG1-CE3 4.39Å; I68-W71 HydrophobicContact CG1-CH2 3.98Å; I68-W71 HydrophobicContact CG1-CZ3 3.87Å; I68-W71 HydrophobicContact CG2-CE3 3.97Å; I68-W71 HydrophobicContact CG2-CZ3 4.01Å; I68-W71 WeakPolarHBondContact O-CB 3.42Å; I68-W71 PolarHBondContact O-N 3.04Å; N69-W71 VanDerWaalsContact C-N 3.31Å; N69-W71 PolarHBondContact O-N 3.03Å; W71-Q73 PolarHBondContact O-N 3.41Å; W71-Q73 VanDerWaalsContact O-N 3.11Å; W71-E74 PolarHBondContact O-N 3.3Å; W71-E74 VanDerWaalsContact O-N 3.14Å; W71-V79 HydrophobicContact CB-CG2 4.36Å; W71-V79 WeakPolarHBondContact O-CG2 3.29Å; W71-L82 HydrophobicContact CD2-CB 4.32Å; W71-L82 HydrophobicContact CD2-CD1 4.36Å; W71-L82 HydrophobicContact CG-CD1 4.05Å; W71-L83 HydrophobicContact CE3-CD2 4.45Å; W71-L83 HydrophobicContact CZ3-CD2 4.33Å; W71-H86 HydrophobicContact CH2-CB 3.63Å; W71-H86 AromaticContact CH2-CG 3.65Å; W71-H86 AromaticContact CH2-ND1 3.97Å; W71-H86 HydrophobicContact CZ2-CB 4.46Å; W71-H86 AromaticContact CZ2-CG 3.99Å; W71-H86 HydrophobicContact CZ3-CB 4.38Å; W71-Y101 AromaticContact CZ3-CE1 3.89Å; W71-Y101 HydrophobicContact CZ3-CE1 3.89Å; W71-L104 HydrophobicContact CB-CD2 4.19Å; W71-L104 HydrophobicContact CE3-CD2 4.22Å
72	Q	87.3	Confident	92.2	Very high	60 Å²	60	55.6 Å²	55.6	28%	0.28	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-63.2	-15.9	173.9	-55.9	-160.6	53.4	0	0	113.7	N69 Q70 L104	N69-Q72 WeakPolarHBondContact O-CB 3.32Å; N69-Q72 WeakPolarHBondContact O-CG 3.48Å; N69-Q72 PolarHBondContact O-N 3.47Å; N69-Q72 PolarHBondContact OD1-NE2 2.92Å; Q70-Q72 PolarHBondContact O-N 3.39Å; Q72-L104 HydrophobicContact CG-CD1 4.16Å
73	Q	89.4	Confident	92.3	Very high	173 Å²	173	55.6 Å²	55.6	81%	0.808	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-95.5	-9.5	178.9	-53.7	-179.5	17.7	0	0	113.3	Q70 W71	Q70-Q73 WeakPolarHBondContact O-CB 3.35Å; Q70-Q73 PolarHBondContact O-N 2.87Å; W71-Q73 PolarHBondContact O-N 3.41Å; W71-Q73 VanDerWaalsContact O-N 3.11Å
74	E	93.6	Very high	92.3	Very high	79 Å²	79	56.1 Å²	56.1	37%	0.369	30%	0.301	S	S	.	.	S	Bend	trans	-87.5	164.3	-178.2	-81.5	-75.1	-150.7	0	0	113.3	W71 K78 V79	W71-E74 PolarHBondContact O-N 3.3Å; W71-E74 VanDerWaalsContact O-N 3.14Å; E74-K78 HydrophobicContact CB-CB 4.48Å; E74-K78 HydrophobicContact CB-CD 4.35Å; E74-K78 VanDerWaalsContact CD-CD 3.48Å; E74-K78 HydrophobicContact CG-CD 4.36Å; E74-K78 IonicContact OE1-NZ 2.71Å; E74-K78 PolarHBondContact OE1-NZ 2.87Å; E74-K78 WeakPolarHBondContact OE2-CD 3.34Å; E74-K78 WeakPolarHBondContact OE2-CE 3.48Å; E74-K78 IonicContact OE2-NZ 2.73Å; E74-K78 PolarHBondContact OE2-NZ 3.39Å; E74-V79 HydrophobicContact CB-CG2 3.86Å
75	S	91.7	Very high	92.2	Very high	56 Å²	56	57.3 Å²	57.3	39%	0.392	31%	0.307	S	S	.	.			trans	-63.6	146.9	174.8	68.4	0	0	0	0	111.6	D77 K78 V79	S75-D77 VanDerWaalsContact C-N 3.27Å; S75-D77 PolarHBondContact O-N 3.01Å; S75-K78 WeakPolarHBondContact O-CB 3.38Å; S75-K78 PolarHBondContact O-N 3.21Å; S75-K78 VanDerWaalsContact O-N 3.12Å; S75-K78 WeakPolarHBondContact OG-CG 2.92Å; S75-V79 WeakPolarHBondContact O-CG2 3.46Å; S75-V79 PolarHBondContact O-N 3.45Å
76	K	89.4	Confident	92.4	Very high	70 Å²	70	55.3 Å²	55.3	30%	0.304	29%	0.293	S	S	.	.	H	α-helix	trans	-58.1	-41	-170.5	-58.6	-57.7	-179.7	-164	0	112.5	V79 I80 I108	K76-V79 CarbonylContact O-C 3.59Å; K76-V79 WeakPolarHBondContact O-CB 3.35Å; K76-V79 PolarHBondContact O-N 3.32Å; K76-V79 VanDerWaalsContact O-N 3.12Å; K76-I80 VanDerWaalsContact O-CG1 3.28Å; K76-I80 WeakPolarHBondContact O-CG1 3.32Å; K76-I80 PolarHBondContact O-N 3.02Å; K76-I108 HydrophobicContact CD-CD1 3.73Å
77	D	89.9	Confident	92.5	Very high	83 Å²	83	53.3 Å²	53.3	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-63	-43.6	-179.9	-18.4	-29.9	0	0	0	111	S75 I80 S81 H118	S75-D77 VanDerWaalsContact C-N 3.27Å; S75-D77 PolarHBondContact O-N 3.01Å; D77-I80 PolarHBondContact O-N 2.96Å; D77-S81 PolarHBondContact O-N 3.16Å; D77-S81 VanDerWaalsContact O-N 3.07Å; D77-H118 IonicContact OD1-NE2 3.67Å
78	K	92.3	Very high	92.6	Very high	103 Å²	103	53.2 Å²	53.2	45%	0.448	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-45.4	170.9	-76.5	178.1	173	-173.9	0	111.2	E74 S75 I80 S81 L82	E74-K78 HydrophobicContact CB-CB 4.48Å; E74-K78 HydrophobicContact CB-CD 4.35Å; E74-K78 VanDerWaalsContact CD-CD 3.48Å; E74-K78 HydrophobicContact CG-CD 4.36Å; E74-K78 IonicContact OE1-NZ 2.71Å; E74-K78 PolarHBondContact OE1-NZ 2.87Å; E74-K78 WeakPolarHBondContact OE2-CD 3.34Å; E74-K78 WeakPolarHBondContact OE2-CE 3.48Å; E74-K78 IonicContact OE2-NZ 2.73Å; E74-K78 PolarHBondContact OE2-NZ 3.39Å; S75-K78 WeakPolarHBondContact O-CB 3.38Å; S75-K78 PolarHBondContact O-N 3.21Å; S75-K78 VanDerWaalsContact O-N 3.12Å; S75-K78 WeakPolarHBondContact OG-CG 2.92Å; K78-I80 VanDerWaalsContact C-N 3.29Å; K78-I80 PolarHBondContact O-N 3.45Å; K78-S81 PolarHBondContact O-N 2.86Å; K78-L82 WeakPolarHBondContact O-CB 3.39Å; K78-L82 VanDerWaalsContact O-CG 3.3Å; K78-L82 WeakPolarHBondContact O-CG 3.44Å; K78-L82 PolarHBondContact O-N 2.76Å
79	V	93.8	Very high	92.6	Very high	2 Å²	2	55 Å²	55	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-63.4	-37.6	-179.7	-179.7	0	0	0	0	111.1	W71 E74 S75 K76 L82 L83 L104 I108	W71-V79 HydrophobicContact CB-CG2 4.36Å; W71-V79 WeakPolarHBondContact O-CG2 3.29Å; E74-V79 HydrophobicContact CB-CG2 3.86Å; S75-V79 WeakPolarHBondContact O-CG2 3.46Å; S75-V79 PolarHBondContact O-N 3.45Å; K76-V79 CarbonylContact O-C 3.59Å; K76-V79 WeakPolarHBondContact O-CB 3.35Å; K76-V79 PolarHBondContact O-N 3.32Å; K76-V79 VanDerWaalsContact O-N 3.12Å; V79-L82 PolarHBondContact O-N 2.7Å; V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.1Å; V79-L83 VanDerWaalsContact O-CB 3.27Å; V79-L83 WeakPolarHBondContact O-CB 3.3Å; V79-L83 WeakPolarHBondContact O-CG 3.5Å; V79-L83 PolarHBondContact O-N 3.41Å; V79-L104 HydrophobicContact CG1-CD1 4.12Å; V79-L104 HydrophobicContact CG1-CD2 3.9Å; V79-L104 HydrophobicContact CG1-CG 4.14Å; V79-I108 HydrophobicContact CB-CD1 4.01Å; V79-I108 HydrophobicContact CG1-CD1 3.7Å; V79-I108 HydrophobicContact CG1-CG1 3.88Å
80	I	93	Very high	92.7	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-62.5	-47	174.6	-71.1	164.7	0	0	0	110.7	K76 D77 K78 L83 L84 I108 H118 E121 L125	K76-I80 VanDerWaalsContact O-CG1 3.28Å; K76-I80 WeakPolarHBondContact O-CG1 3.32Å; K76-I80 PolarHBondContact O-N 3.02Å; D77-I80 PolarHBondContact O-N 2.96Å; K78-I80 VanDerWaalsContact C-N 3.29Å; K78-I80 PolarHBondContact O-N 3.45Å; I80-L83 PolarHBondContact O-N 3.43Å; I80-L84 HydrophobicContact CG2-CD1 4.35Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 3.12Å; I80-I108 HydrophobicContact CD1-CG2 3.86Å; I80-I108 HydrophobicContact CG1-CG2 3.31Å; I80-H118 HydrophobicContact CD1-CB 3.5Å; I80-H118 HydrophobicContact CG2-CB 4.48Å; I80-E121 HydrophobicContact CG2-CB 3.48Å; I80-E121 VanDerWaalsContact CG2-CB 3.48Å; I80-E121 HydrophobicContact CG2-CG 4.2Å; I80-L125 HydrophobicContact CG2-CD1 4.37Å
81	S	93.4	Very high	92.7	Very high	71 Å²	71	50 Å²	50	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-60.5	-47.5	174.6	-172.5	0	0	0	0	112.2	D77 K78 L83 L84 T85	D77-S81 PolarHBondContact O-N 3.16Å; D77-S81 VanDerWaalsContact O-N 3.07Å; K78-S81 PolarHBondContact O-N 2.86Å; S81-L83 PolarHBondContact O-N 3.29Å; S81-L84 PolarHBondContact O-N 3.36Å; S81-T85 PolarHBondContact O-N 2.94Å; S81-T85 VanDerWaalsContact O-N 3.11Å; S81-T85 PolarHBondContact O-OG1 3.19Å
82	L	94.2	Very high	92.4	Very high	46 Å²	46	53.4 Å²	53.4	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-61.3	-45.3	178.8	-73	165.2	0	0	0	111.3	W71 K78 V79 L84 T85 H86	W71-L82 HydrophobicContact CD2-CB 4.32Å; W71-L82 HydrophobicContact CD2-CD1 4.36Å; W71-L82 HydrophobicContact CG-CD1 4.05Å; K78-L82 WeakPolarHBondContact O-CB 3.39Å; K78-L82 VanDerWaalsContact O-CG 3.3Å; K78-L82 WeakPolarHBondContact O-CG 3.44Å; K78-L82 PolarHBondContact O-N 2.76Å; V79-L82 PolarHBondContact O-N 2.7Å; L82-L84 VanDerWaalsContact C-N 3.35Å; L82-L84 PolarHBondContact O-N 3.1Å; L82-T85 PolarHBondContact O-N 3.46Å; L82-H86 WeakPolarHBondContact O-CB 3.32Å; L82-H86 PolarHBondContact O-N 3.1Å; L82-H86 PolarHBondContact O-ND1 2.98Å
83	L	94.5	Very high	92.3	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-61.5	-40.6	176.1	-73.7	171.6	0	0	0	111.8	W71 V79 I80 S81 L87 Y101 L104 L105 I108 L125	W71-L83 HydrophobicContact CE3-CD2 4.45Å; W71-L83 HydrophobicContact CZ3-CD2 4.33Å; V79-L83 HydrophobicContact CG1-CD1 3.85Å; V79-L83 HydrophobicContact CG1-CG 4.1Å; V79-L83 VanDerWaalsContact O-CB 3.27Å; V79-L83 WeakPolarHBondContact O-CB 3.3Å; V79-L83 WeakPolarHBondContact O-CG 3.5Å; V79-L83 PolarHBondContact O-N 3.41Å; I80-L83 PolarHBondContact O-N 3.43Å; S81-L83 PolarHBondContact O-N 3.29Å; L83-L87 WeakPolarHBondContact O-CB 3.5Å; L83-L87 PolarHBondContact O-N 3.04Å; L83-Y101 HydrophobicContact CD2-CD1 3.6Å; L83-Y101 HydrophobicContact CD2-CE1 3.77Å; L83-L104 HydrophobicContact CD1-CG 4.34Å; L83-L104 HydrophobicContact CD2-CD2 4.13Å; L83-L104 HydrophobicContact CD2-CG 4.45Å; L83-L105 HydrophobicContact CD1-CD2 4.18Å; L83-I108 HydrophobicContact CD1-CB 4.42Å; L83-I108 HydrophobicContact CD1-CG1 3.98Å; L83-I108 HydrophobicContact CD1-CG2 4.43Å; L83-L125 HydrophobicContact CB-CD1 4.24Å; L83-L125 HydrophobicContact CB-CD2 3.51Å; L83-L125 HydrophobicContact CD1-CD1 4.25Å
84	L	93.7	Very high	92.4	Very high	33 Å²	33	47.3 Å²	47.3	17%	0.173	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-43.3	178.5	-80.6	171.5	0	0	0	112	I80 S81 L82 P88 E121 Q124 L125 Y128	I80-L84 HydrophobicContact CG2-CD1 4.35Å; I80-L84 WeakPolarHBondContact O-CG 3.47Å; I80-L84 PolarHBondContact O-N 3.12Å; S81-L84 PolarHBondContact O-N 3.36Å; L82-L84 VanDerWaalsContact C-N 3.35Å; L82-L84 PolarHBondContact O-N 3.1Å; L84-P88 WeakPolarHBondContact O-CD 3.38Å; L84-P88 WeakPolarHBondContact O-CG 3.42Å; L84-E121 HydrophobicContact CD1-CB 3.94Å; L84-E121 HydrophobicContact CD1-CG 4.24Å; L84-Q124 HydrophobicContact CD2-CB 3.68Å; L84-L125 HydrophobicContact CB-CD2 4.41Å; L84-L125 HydrophobicContact CD2-CD2 3.75Å; L84-L125 HydrophobicContact CD2-CG 3.8Å; L84-L125 HydrophobicContact CG-CD2 3.79Å; L84-L125 HydrophobicContact CG-CG 3.98Å; L84-Y128 HydrophobicContact CD2-CD2 4.23Å; L84-Y128 HydrophobicContact CD2-CE2 4.2Å
85	T	94.2	Very high	92.3	Very high	66 Å²	66	49.1 Å²	49.1	41%	0.405	28%	0.284	S	S	.	.	H	α-helix	trans	-71.1	-38.4	178.7	-52.6	0	0	0	0	112.8	L58 S81 L82	L58-T85 HydrophobicContact CD1-CG2 4.08Å; L58-T85 HydrophobicContact CD2-CG2 4.26Å; S81-T85 PolarHBondContact O-N 2.94Å; S81-T85 VanDerWaalsContact O-N 3.11Å; S81-T85 PolarHBondContact O-OG1 3.19Å; L82-T85 PolarHBondContact O-N 3.46Å
86	H	94.4	Very high	92.3	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.028	30%	0.295	C	S	.	.	H	α-helix	trans	-97.3	-30.7	-168.8	-65.4	86.3	0	0	0	114.6	L58 A62 W71 L82 P88 L89 Y101	L58-H86 WeakPolarHBondContact CD2-NE2 3.26Å; L58-H86 PolarHBondContact O-CD2 2.98Å; A62-H86 HydrophobicContact CB-CB 3.76Å; A62-H86 WeakPolarHBondContact CB-O 3.17Å; W71-H86 HydrophobicContact CH2-CB 3.63Å; W71-H86 AromaticContact CH2-CG 3.65Å; W71-H86 AromaticContact CH2-ND1 3.97Å; W71-H86 HydrophobicContact CZ2-CB 4.46Å; W71-H86 AromaticContact CZ2-CG 3.99Å; W71-H86 HydrophobicContact CZ3-CB 4.38Å; L82-H86 WeakPolarHBondContact O-CB 3.32Å; L82-H86 PolarHBondContact O-N 3.1Å; L82-H86 PolarHBondContact O-ND1 2.98Å; H86-P88 VanDerWaalsContact C-CD 3.45Å; H86-P88 VanDerWaalsContact C-N 3.35Å; H86-L89 WeakPolarHBondContact O-CB 3.35Å; H86-L89 PolarHBondContact O-N 3.35Å; H86-Y101 WeakPolarHBondContact CB-OH 3.44Å
87	L	93.9	Very high	92.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-58.1	-36.6	-179.9	-179.5	64.2	0	0	0	113.9	L83 L89 L90 Y101 L105 L125 A129	L83-L87 WeakPolarHBondContact O-CB 3.5Å; L83-L87 PolarHBondContact O-N 3.04Å; L87-L89 PolarHBondContact O-N 3.16Å; L87-L90 PolarHBondContact O-N 3.39Å; L87-Y101 HydrophobicContact CB-CE1 4.28Å; L87-Y101 HydrophobicContact CD1-CD1 3.92Å; L87-Y101 HydrophobicContact CD1-CE1 4.26Å; L87-Y101 HydrophobicContact CD1-CG 4.18Å; L87-L105 HydrophobicContact CD2-CD1 4.36Å; L87-L125 HydrophobicContact CD2-CD2 4.34Å; L87-A129 HydrophobicContact CD2-CB 4.07Å
88	P	94.1	Very high	92.7	Very high	48 Å²	48	46 Å²	46	31%	0.312	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66.9	-13.4	173.8	-21.6	34.9	0	0	0	114.8	L84 H86 Y128	L84-P88 WeakPolarHBondContact O-CD 3.38Å; L84-P88 WeakPolarHBondContact O-CG 3.42Å; H86-P88 VanDerWaalsContact C-CD 3.45Å; H86-P88 VanDerWaalsContact C-N 3.35Å; P88-Y128 HydrophobicContact CB-CD1 4.41Å; P88-Y128 HydrophobicContact CB-CE1 4.33Å; P88-Y128 HydrophobicContact CG-CD1 3.85Å; P88-Y128 HydrophobicContact CG-CD2 4.22Å; P88-Y128 HydrophobicContact CG-CE1 3.78Å; P88-Y128 HydrophobicContact CG-CE2 4.16Å; P88-Y128 HydrophobicContact CG-CG 4.08Å
89	L	93.8	Very high	92.8	Very high	38 Å²	38	44 Å²	44	20%	0.199	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-103.5	1.6	-176	-52.6	179.9	0	0	0	113.2	L55 L58 E59 A62 N63 H86 L87 K91	L55-L89 HydrophobicContact CD1-CD1 4.03Å; L55-L89 HydrophobicContact CD1-CD2 3.76Å; L58-L89 HydrophobicContact CB-CD1 3.63Å; E59-L89 HydrophobicContact CG-CB 4.37Å; A62-L89 HydrophobicContact CB-CB 3.76Å; N63-L89 PolarHBondContact ND2-O 2.91Å; H86-L89 WeakPolarHBondContact O-CB 3.35Å; H86-L89 PolarHBondContact O-N 3.35Å; L87-L89 PolarHBondContact O-N 3.16Å; L89-K91 PolarHBondContact O-N 3.5Å
90	L	94.5	Very high	92.8	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.016	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-64.9	127.6	177.5	170.8	63.2	0	0	0	110.9	L87 P92 N94 A97 K98 Y101 H132 A134	L87-L90 PolarHBondContact O-N 3.39Å; L90-P92 WeakPolarHBondContact O-CD 3.25Å; L90-N94 HydrophobicContact CD1-CB 4.41Å; L90-A97 HydrophobicContact CD1-CB 3.72Å; L90-K98 HydrophobicContact CD2-CB 4.24Å; L90-K98 HydrophobicContact CD2-CG 4.22Å; L90-Y101 HydrophobicContact CB-CE2 4.27Å; L90-Y101 HydrophobicContact CD1-CD2 4.19Å; L90-Y101 HydrophobicContact CD1-CE2 4.01Å; L90-Y101 HydrophobicContact CD2-CD2 3.87Å; L90-Y101 HydrophobicContact CD2-CE2 4.22Å; L90-Y101 HydrophobicContact CG-CD2 4.49Å; L90-Y101 HydrophobicContact CG-CE2 4.39Å; L90-H132 PolarHBondContact O-CE1 3.12Å; L90-H132 PolarHBondContact O-NE2 2.69Å; L90-H132 VanDerWaalsContact O-NE2 3.12Å; L90-A134 HydrophobicContact CD2-CB 4.05Å; L90-A134 HydrophobicContact CG-CB 4.06Å
91	K	91.4	Very high	92.9	Very high	91 Å²	91	45 Å²	45	40%	0.396	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-78.2	128.7	-177.1	-71.7	178.6	-178.2	-174.9	0	112.1	E59 N63 L89 G93 N94	E59-K91 WeakPolarHBondContact OE1-CE 3.32Å; E59-K91 IonicContact OE1-NZ 3.98Å; E59-K91 PolarHBondContact OE1-NZ 3.49Å; E59-K91 VanDerWaalsContact OE1-NZ 3.07Å; E59-K91 WeakPolarHBondContact OE2-CE 3.4Å; E59-K91 IonicContact OE2-NZ 3.49Å; E59-K91 PolarHBondContact OE2-NZ 3.44Å; N63-K91 VanDerWaalsContact OD1-CB 3.32Å; N63-K91 WeakPolarHBondContact OD1-CB 3.32Å; N63-K91 PolarHBondContact OD1-N 2.95Å; L89-K91 PolarHBondContact O-N 3.5Å; K91-G93 PolarHBondContact O-N 3.47Å; K91-N94 HydrophobicContact CB-CB 4.36Å; K91-N94 WeakPolarHBondContact O-CB 3.46Å; K91-N94 PolarHBondContact O-N 3.16Å
92	P	88.4	Confident	92.9	Very high	89 Å²	89	43.2 Å²	43.2	58%	0.578	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	123.4	169.5	-24.9	35.9	0	0	0	110.9	L90 P133 A134	L90-P92 WeakPolarHBondContact O-CD 3.25Å; P92-P133 HydrophobicContact CG-CB 3.96Å; P92-A134 HydrophobicContact CB-CB 4.41Å; P92-A134 HydrophobicContact CG-CB 4.46Å
93	G	85.2	Confident	92.7	Very high	67 Å²	67	45.8 Å²	45.8	69%	0.691	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.6	-15	-174.4	0	0	0	0	0	115.2	K91 L95	K91-G93 PolarHBondContact O-N 3.47Å; G93-L95 VanDerWaalsContact C-N 3.34Å; G93-L95 PolarHBondContact O-N 2.63Å
94	N	91.9	Very high	92.7	Very high	39 Å²	39	46 Å²	46	21%	0.209	26%	0.26	C	S	.	.			trans	-78.6	81.9	172.5	-173.4	-7.4	0	0	0	110.6	N63 L90 K91 A97 K98	N63-N94 WeakPolarHBondContact CB-ND2 3.4Å; N63-N94 PolarHBondContact O-ND2 3.2Å; N63-N94 PolarHBondContact OD1-ND2 2.77Å; L90-N94 HydrophobicContact CD1-CB 4.41Å; K91-N94 HydrophobicContact CB-CB 4.36Å; K91-N94 WeakPolarHBondContact O-CB 3.46Å; K91-N94 PolarHBondContact O-N 3.16Å; N94-A97 HydrophobicContact CB-CB 4.49Å; N94-A97 WeakPolarHBondContact ND2-CB 3.39Å; N94-A97 WeakPolarHBondContact OD1-CB 3.36Å; N94-A97 PolarHBondContact OD1-N 3.05Å; N94-K98 WeakPolarHBondContact O-CB 3.29Å; N94-K98 PolarHBondContact O-N 2.88Å; N94-K98 VanDerWaalsContact O-N 3.14Å
95	L	90.9	Very high	92.6	Very high	116 Å²	116	44.4 Å²	44.4	61%	0.607	25%	0.252	S	S	*	.	H	α-helix	trans	-65.7	-37.3	-175.9	-62.9	-179.5	0	0	0	112.7	G93 K98 V99	G93-L95 VanDerWaalsContact C-N 3.34Å; G93-L95 PolarHBondContact O-N 2.63Å; L95-K98 WeakPolarHBondContact O-CB 3.38Å; L95-K98 PolarHBondContact O-N 3.49Å; L95-V99 WeakPolarHBondContact O-CG2 3.3Å; L95-V99 PolarHBondContact O-N 2.97Å
96	D	92.3	Very high	92.5	Very high	115 Å²	115	43.2 Å²	43.2	62%	0.615	25%	0.246	S	C	*	.	H	α-helix	trans	-66.5	-47	-176.4	-58	-50.3	0	0	0	111.6	P65 V99 E100	P65-D96 HydrophobicContact CB-CB 4.43Å; P65-D96 HydrophobicContact CG-CB 4.11Å; D96-V99 PolarHBondContact O-N 3.19Å; D96-E100 PolarHBondContact O-N 3.47Å
97	A	93.1	Very high	92.4	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-43.5	172.6	0	0	0	0	0	111.4	I68 L90 N94 V99 E100 Y101	I68-A97 HydrophobicContact CD1-CB 3.72Å; L90-A97 HydrophobicContact CD1-CB 3.72Å; N94-A97 HydrophobicContact CB-CB 4.49Å; N94-A97 WeakPolarHBondContact ND2-CB 3.39Å; N94-A97 WeakPolarHBondContact OD1-CB 3.36Å; N94-A97 PolarHBondContact OD1-N 3.05Å; A97-V99 VanDerWaalsContact C-N 3.27Å; A97-V99 PolarHBondContact O-N 2.95Å; A97-E100 PolarHBondContact O-N 3.46Å; A97-E100 VanDerWaalsContact O-N 3.15Å; A97-Y101 WeakPolarHBondContact O-CD2 3.46Å; A97-Y101 PolarHBondContact O-N 2.78Å; A97-Y101 VanDerWaalsContact O-N 3.11Å
98	K	94.4	Very high	92.3	Very high	28 Å²	28	48 Å²	48	12%	0.122	27%	0.267	C	S	.	.	H	α-helix	trans	-56.5	-40.8	177.7	-165.2	-140.7	72.3	154.1	0	111.9	L90 N94 L95 Y101 M102 A134 D139	L90-K98 HydrophobicContact CD2-CB 4.24Å; L90-K98 HydrophobicContact CD2-CG 4.22Å; N94-K98 WeakPolarHBondContact O-CB 3.29Å; N94-K98 PolarHBondContact O-N 2.88Å; N94-K98 VanDerWaalsContact O-N 3.14Å; L95-K98 WeakPolarHBondContact O-CB 3.38Å; L95-K98 PolarHBondContact O-N 3.49Å; K98-Y101 PolarHBondContact O-N 3.26Å; K98-M102 WeakPolarHBondContact O-CG 3.31Å; K98-M102 PolarHBondContact O-N 2.91Å; K98-A134 VanDerWaalsContact CD-O 3.3Å; K98-A134 WeakPolarHBondContact CD-O 3.5Å; K98-D139 WeakPolarHBondContact CD-OD2 3.35Å; K98-D139 WeakPolarHBondContact CE-OD2 3.35Å; K98-D139 IonicContact NZ-OD1 2.65Å; K98-D139 PolarHBondContact NZ-OD1 3.34Å; K98-D139 IonicContact NZ-OD2 2.64Å; K98-D139 PolarHBondContact NZ-OD2 3.36Å
99	V	93.6	Very high	92.2	Very high	62 Å²	62	45.8 Å²	45.8	38%	0.376	25%	0.252	S	S	.	.	H	α-helix	trans	-62.6	-40.8	178.5	164	0	0	0	0	111.7	L95 D96 A97 M102 K103	L95-V99 WeakPolarHBondContact O-CG2 3.3Å; L95-V99 PolarHBondContact O-N 2.97Å; D96-V99 PolarHBondContact O-N 3.19Å; A97-V99 VanDerWaalsContact C-N 3.27Å; A97-V99 PolarHBondContact O-N 2.95Å; V99-M102 PolarHBondContact O-N 3.05Å; V99-K103 HydrophobicContact CG1-CD 4.16Å; V99-K103 VanDerWaalsContact O-CG 3.32Å; V99-K103 WeakPolarHBondContact O-CG 3.48Å; V99-K103 PolarHBondContact O-N 3.02Å
100	E	94.3	Very high	92	Very high	26 Å²	26	45.7 Å²	45.7	12%	0.121	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-38.9	175.7	-61.9	-48.4	130.8	0	0	112.7	P65 I68 D96 A97 M102 K103 L104	P65-E100 HydrophobicContact CB-CG 4.02Å; I68-E100 HydrophobicContact CB-CB 4.03Å; I68-E100 HydrophobicContact CG2-CB 3.6Å; D96-E100 PolarHBondContact O-N 3.47Å; A97-E100 PolarHBondContact O-N 3.46Å; A97-E100 VanDerWaalsContact O-N 3.15Å; E100-M102 PolarHBondContact O-N 3.18Å; E100-K103 PolarHBondContact O-N 2.8Å; E100-K103 IonicContact OE1-NZ 2.62Å; E100-K103 PolarHBondContact OE1-NZ 3.03Å; E100-K103 VanDerWaalsContact OE2-CD 3.31Å; E100-K103 WeakPolarHBondContact OE2-CD 3.45Å; E100-K103 IonicContact OE2-NZ 3.64Å; E100-L104 WeakPolarHBondContact O-CB 3.29Å; E100-L104 PolarHBondContact O-N 2.72Å
101	Y	94.3	Very high	91.8	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.2	-44.1	170.8	-76.7	-75.5	0	0	0	112.4	A62 I68 W71 L83 H86 L87 L90 A97 K98 K103 L104 L105	A62-Y101 WeakPolarHBondContact CA-OH 3.4Å; A62-Y101 VanDerWaalsContact O-CE2 3.31Å; A62-Y101 WeakPolarHBondContact O-CE2 3.29Å; A62-Y101 PolarHBondContact O-OH 2.96Å; I68-Y101 HydrophobicContact CD1-CD2 3.92Å; I68-Y101 HydrophobicContact CD1-CE2 3.39Å; I68-Y101 HydrophobicContact CG1-CE2 4.1Å; W71-Y101 AromaticContact CZ3-CE1 3.89Å; W71-Y101 HydrophobicContact CZ3-CE1 3.89Å; L83-Y101 HydrophobicContact CD2-CD1 3.6Å; L83-Y101 HydrophobicContact CD2-CE1 3.77Å; H86-Y101 WeakPolarHBondContact CB-OH 3.44Å; L87-Y101 HydrophobicContact CB-CE1 4.28Å; L87-Y101 HydrophobicContact CD1-CD1 3.92Å; L87-Y101 HydrophobicContact CD1-CE1 4.26Å; L87-Y101 HydrophobicContact CD1-CG 4.18Å; L90-Y101 HydrophobicContact CB-CE2 4.27Å; L90-Y101 HydrophobicContact CD1-CD2 4.19Å; L90-Y101 HydrophobicContact CD1-CE2 4.01Å; L90-Y101 HydrophobicContact CD2-CD2 3.87Å; L90-Y101 HydrophobicContact CD2-CE2 4.22Å; L90-Y101 HydrophobicContact CG-CD2 4.49Å; L90-Y101 HydrophobicContact CG-CE2 4.39Å; A97-Y101 WeakPolarHBondContact O-CD2 3.46Å; A97-Y101 PolarHBondContact O-N 2.78Å; A97-Y101 VanDerWaalsContact O-N 3.11Å; K98-Y101 PolarHBondContact O-N 3.26Å; Y101-K103 VanDerWaalsContact C-N 3.3Å; Y101-K103 PolarHBondContact O-N 2.97Å; Y101-L104 PolarHBondContact O-N 3.02Å; Y101-L104 VanDerWaalsContact O-N 3.15Å; Y101-L105 WeakPolarHBondContact O-CB 3.44Å; Y101-L105 WeakPolarHBondContact O-CG 3.39Å; Y101-L105 PolarHBondContact O-N 3.27Å
102	M	93.1	Very high	91.7	Very high	34 Å²	34	43.4 Å²	43.4	17%	0.167	25%	0.247	C	C	.	.	H	α-helix	trans	-70.2	-24.6	179.6	-64.8	-52.5	108.4	0	0	113	K98 V99 E100 L105 P106 T135 D139 L143	K98-M102 WeakPolarHBondContact O-CG 3.31Å; K98-M102 PolarHBondContact O-N 2.91Å; V99-M102 PolarHBondContact O-N 3.05Å; E100-M102 PolarHBondContact O-N 3.18Å; M102-L105 HydrophobicContact CE-CD1 3.72Å; M102-P106 WeakPolarHBondContact O-CD 3.49Å; M102-P106 WeakPolarHBondContact O-CG 3.4Å; M102-T135 HydrophobicContact CE-CG2 3.92Å; M102-D139 HydrophobicContact SD-CB 3.88Å; M102-L143 HydrophobicContact CE-CD1 4.46Å; M102-L143 HydrophobicContact SD-CD1 4.01Å
103	K	91.5	Very high	91.7	Very high	100 Å²	100	40.3 Å²	40.3	44%	0.435	23%	0.226	S	C	.	.	H	α-helix	trans	-74.2	-31.1	168.8	-72.8	164.6	178.9	174.1	0	112.8	V99 E100 Y101 K107	V99-K103 HydrophobicContact CG1-CD 4.16Å; V99-K103 VanDerWaalsContact O-CG 3.32Å; V99-K103 WeakPolarHBondContact O-CG 3.48Å; V99-K103 PolarHBondContact O-N 3.02Å; E100-K103 PolarHBondContact O-N 2.8Å; E100-K103 IonicContact OE1-NZ 2.62Å; E100-K103 PolarHBondContact OE1-NZ 3.03Å; E100-K103 VanDerWaalsContact OE2-CD 3.31Å; E100-K103 WeakPolarHBondContact OE2-CD 3.45Å; E100-K103 IonicContact OE2-NZ 3.64Å; Y101-K103 VanDerWaalsContact C-N 3.3Å; Y101-K103 PolarHBondContact O-N 2.97Å; K103-K107 WeakPolarHBondContact O-CD 3.35Å; K103-K107 VanDerWaalsContact O-CE 3.23Å; K103-K107 WeakPolarHBondContact O-CE 3.37Å; K103-K107 WeakPolarHBondContact O-CG 3.49Å
104	L	92.9	Very high	91.8	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-89.8	-44.3	-172.4	-173.6	48.8	0	0	0	112.9	I68 W71 Q72 V79 L83 E100 Y101 K107 I108	I68-L104 HydrophobicContact CG2-CD2 4.47Å; W71-L104 HydrophobicContact CB-CD2 4.19Å; W71-L104 HydrophobicContact CE3-CD2 4.22Å; Q72-L104 HydrophobicContact CG-CD1 4.16Å; V79-L104 HydrophobicContact CG1-CD1 4.12Å; V79-L104 HydrophobicContact CG1-CD2 3.9Å; V79-L104 HydrophobicContact CG1-CG 4.14Å; L83-L104 HydrophobicContact CD1-CG 4.34Å; L83-L104 HydrophobicContact CD2-CD2 4.13Å; L83-L104 HydrophobicContact CD2-CG 4.45Å; E100-L104 WeakPolarHBondContact O-CB 3.29Å; E100-L104 PolarHBondContact O-N 2.72Å; Y101-L104 PolarHBondContact O-N 3.02Å; Y101-L104 VanDerWaalsContact O-N 3.15Å; L104-K107 WeakPolarHBondContact O-CB 3.39Å; L104-K107 PolarHBondContact O-N 3.28Å; L104-K107 VanDerWaalsContact O-N 3.1Å; L104-I108 HydrophobicContact CD1-CD1 4.33Å; L104-I108 HydrophobicContact CD1-CG1 4.04Å; L104-I108 HydrophobicContact CG-CG1 4.34Å; L104-I108 PolarHBondContact O-N 3.34Å
105	L	93.4	Very high	91.5	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-52.8	-49.7	-177.4	-79.5	164.7	0	0	0	113.5	L83 L87 Y101 M102 K107 I108 L109 L125 A129 L143	L83-L105 HydrophobicContact CD1-CD2 4.18Å; L87-L105 HydrophobicContact CD2-CD1 4.36Å; Y101-L105 WeakPolarHBondContact O-CB 3.44Å; Y101-L105 WeakPolarHBondContact O-CG 3.39Å; Y101-L105 PolarHBondContact O-N 3.27Å; M102-L105 HydrophobicContact CE-CD1 3.72Å; L105-K107 VanDerWaalsContact C-N 3.28Å; L105-K107 PolarHBondContact O-N 3.43Å; L105-I108 PolarHBondContact O-N 3Å; L105-I108 VanDerWaalsContact O-N 3.16Å; L105-L109 VanDerWaalsContact O-CG 3.28Å; L105-L109 WeakPolarHBondContact O-CG 3.39Å; L105-L109 PolarHBondContact O-N 2.98Å; L105-L125 HydrophobicContact CD2-CB 4.26Å; L105-L125 HydrophobicContact CD2-CD1 4.39Å; L105-L125 HydrophobicContact CD2-CD2 4.46Å; L105-A129 HydrophobicContact CD1-CB 4.32Å; L105-L143 HydrophobicContact CB-CD2 4.46Å
106	P	92.1	Very high	91.2	Very high	41 Å²	41	44.1 Å²	44.1	27%	0.266	22%	0.224	S	C	.	.	H	α-helix	trans	-61.6	-33.5	179.6	-23.7	35.2	0	0	0	113.5	M102 I108 A110 W146	M102-P106 WeakPolarHBondContact O-CD 3.49Å; M102-P106 WeakPolarHBondContact O-CG 3.4Å; P106-I108 VanDerWaalsContact C-N 3.34Å; P106-A110 WeakPolarHBondContact O-CB 3.29Å; P106-A110 PolarHBondContact O-N 3.38Å; P106-W146 HydrophobicContact CB-CZ2 4.08Å
107	K	91.3	Very high	91	Very high	105 Å²	105	43.4 Å²	43.4	46%	0.457	22%	0.217	S	C	.	.	H	α-helix	trans	-67.2	-37.1	178.1	-58.5	178	-176	-174.8	0	111.8	K103 L104 L105 H111	K103-K107 WeakPolarHBondContact O-CD 3.35Å; K103-K107 VanDerWaalsContact O-CE 3.23Å; K103-K107 WeakPolarHBondContact O-CE 3.37Å; K103-K107 WeakPolarHBondContact O-CG 3.49Å; L104-K107 WeakPolarHBondContact O-CB 3.39Å; L104-K107 PolarHBondContact O-N 3.28Å; L104-K107 VanDerWaalsContact O-N 3.1Å; L105-K107 VanDerWaalsContact C-N 3.28Å; L105-K107 PolarHBondContact O-N 3.43Å; K107-H111 PolarHBondContact O-N 3.32Å
108	I	92.4	Very high	90.8	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-76.8	-42.5	179.4	-63.1	-55.6	0	0	0	111	K76 V79 I80 L83 L104 L105 P106 H111 S112	K76-I108 HydrophobicContact CD-CD1 3.73Å; V79-I108 HydrophobicContact CB-CD1 4.01Å; V79-I108 HydrophobicContact CG1-CD1 3.7Å; V79-I108 HydrophobicContact CG1-CG1 3.88Å; I80-I108 HydrophobicContact CD1-CG2 3.86Å; I80-I108 HydrophobicContact CG1-CG2 3.31Å; L83-I108 HydrophobicContact CD1-CB 4.42Å; L83-I108 HydrophobicContact CD1-CG1 3.98Å; L83-I108 HydrophobicContact CD1-CG2 4.43Å; L104-I108 HydrophobicContact CD1-CD1 4.33Å; L104-I108 HydrophobicContact CD1-CG1 4.04Å; L104-I108 HydrophobicContact CG-CG1 4.34Å; L104-I108 PolarHBondContact O-N 3.34Å; L105-I108 PolarHBondContact O-N 3Å; L105-I108 VanDerWaalsContact O-N 3.16Å; P106-I108 VanDerWaalsContact C-N 3.34Å; I108-H111 PolarHBondContact O-N 2.81Å; I108-S112 WeakPolarHBondContact O-CB 3.45Å; I108-S112 PolarHBondContact O-N 3.28Å; I108-S112 PolarHBondContact O-OG 3.05Å
109	L	91.4	Very high	90.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-64.4	-42.5	176.4	-66	168.7	0	0	0	111.7	L105 S112 I113 L126 L143 W146	L105-L109 VanDerWaalsContact O-CG 3.28Å; L105-L109 WeakPolarHBondContact O-CG 3.39Å; L105-L109 PolarHBondContact O-N 2.98Å; L109-S112 PolarHBondContact O-N 2.9Å; L109-I113 WeakPolarHBondContact O-CB 3.44Å; L109-I113 WeakPolarHBondContact O-CG1 3.45Å; L109-I113 PolarHBondContact O-N 3.23Å; L109-L126 HydrophobicContact CD1-CD1 4.32Å; L109-L126 HydrophobicContact CD1-CD2 3.72Å; L109-L126 HydrophobicContact CD1-CG 4.02Å; L109-L126 HydrophobicContact CD2-CD1 3.87Å; L109-L126 HydrophobicContact CD2-CG 3.95Å; L109-L143 HydrophobicContact CD1-CD2 4.25Å; L109-W146 HydrophobicContact CB-CD2 4.17Å; L109-W146 HydrophobicContact CB-CE3 3.81Å; L109-W146 HydrophobicContact CB-CZ3 4.3Å; L109-W146 HydrophobicContact CD1-CB 4.03Å; L109-W146 HydrophobicContact CD1-CD2 4.41Å; L109-W146 HydrophobicContact CD1-CG 4.07Å
110	A	90.3	Very high	90.3	Very high	37 Å²	37	46.8 Å²	46.8	31%	0.306	23%	0.229	S	C	.	.	H	α-helix	trans	-57.1	-53.1	173.8	0	0	0	0	0	112	P106 S112 I113 E114 W146	P106-A110 WeakPolarHBondContact O-CB 3.29Å; P106-A110 PolarHBondContact O-N 3.38Å; A110-S112 VanDerWaalsContact C-N 3.32Å; A110-S112 PolarHBondContact O-N 3.11Å; A110-I113 PolarHBondContact O-N 2.86Å; A110-E114 VanDerWaalsContact O-CB 3.29Å; A110-E114 WeakPolarHBondContact O-CB 3.48Å; A110-E114 PolarHBondContact O-N 3.29Å; A110-W146 HydrophobicContact CB-CH2 3.79Å; A110-W146 HydrophobicContact CB-CZ3 4.03Å
111	H	89.3	Confident	90.2	Very high	44 Å²	44	48.4 Å²	48.4	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-57.2	-45.4	178.5	-179.8	-84.4	0	0	0	112	K107 I108 E114 H115	K107-H111 PolarHBondContact O-N 3.32Å; I108-H111 PolarHBondContact O-N 2.81Å; H111-E114 PolarHBondContact O-N 3.02Å; H111-H115 AromaticContact CD2-CE1 3.64Å; H111-H115 AromaticContact CD2-ND1 3.62Å; H111-H115 AromaticContact CE1-ND1 3.91Å; H111-H115 AromaticContact CG-ND1 3.84Å; H111-H115 AromaticContact NE2-CE1 3.77Å; H111-H115 AromaticContact NE2-ND1 3.72Å; H111-H115 WeakPolarHBondContact O-CB 3.5Å; H111-H115 PolarHBondContact O-N 2.81Å; H111-H115 PolarHBondContact O-ND1 3.2Å
112	S	89.9	Confident	90.2	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.007	24%	0.237	C	C	.	.	H	α-helix	trans	-63.5	-42	-178.9	-56.9	0	0	0	0	112	I108 L109 A110 N116 Q117 I119 S122	I108-S112 WeakPolarHBondContact O-CB 3.45Å; I108-S112 PolarHBondContact O-N 3.28Å; I108-S112 PolarHBondContact O-OG 3.05Å; L109-S112 PolarHBondContact O-N 2.9Å; A110-S112 VanDerWaalsContact C-N 3.32Å; A110-S112 PolarHBondContact O-N 3.11Å; S112-N116 CarbonylContact O-C 3.6Å; S112-N116 WeakPolarHBondContact O-CA 3.32Å; S112-N116 PolarHBondContact O-N 2.8Å; S112-Q117 WeakPolarHBondContact CA-O 3.18Å; S112-Q117 VanDerWaalsContact CB-O 3.24Å; S112-Q117 WeakPolarHBondContact CB-O 3.38Å; S112-Q117 PolarHBondContact O-N 3.04Å; S112-Q117 VanDerWaalsContact O-N 3.09Å; S112-I119 WeakPolarHBondContact O-CD1 3.45Å; S112-S122 WeakPolarHBondContact CB-OG 3.32Å; S112-S122 PolarHBondContact OG-OG 2.65Å
113	I	88.1	Confident	90.1	Very high	24 Å²	24	50.9 Å²	50.9	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-72	-37.2	177.4	-70.6	167.1	0	0	0	112.1	L109 A110 N116 W146 H149 L150 R153	L109-I113 WeakPolarHBondContact O-CB 3.44Å; L109-I113 WeakPolarHBondContact O-CG1 3.45Å; L109-I113 PolarHBondContact O-N 3.23Å; A110-I113 PolarHBondContact O-N 2.86Å; I113-N116 PolarHBondContact O-OD1 2.92Å; I113-W146 HydrophobicContact CD1-CE3 3.82Å; I113-W146 HydrophobicContact CD1-CZ3 4.16Å; I113-H149 HydrophobicContact CD1-CB 4.4Å; I113-L150 HydrophobicContact CD1-CB 4.41Å; I113-R153 HydrophobicContact CG2-CG 4.19Å; I113-R153 PolarHBondContact O-NH2 3.42Å
114	E	87.8	Confident	90.2	Very high	135 Å²	135	47.7 Å²	47.7	63%	0.631	23%	0.231	S	C	*	.	H	α-helix	trans	-65.2	-51.6	177.4	-179.1	173.3	-139.6	0	0	111.4	A110 H111 N116	A110-E114 VanDerWaalsContact O-CB 3.29Å; A110-E114 WeakPolarHBondContact O-CB 3.48Å; A110-E114 PolarHBondContact O-N 3.29Å; H111-E114 PolarHBondContact O-N 3.02Å; E114-N116 PolarHBondContact O-ND2 2.85Å
115	H	85.1	Confident	90.2	Very high	94 Å²	94	47.5 Å²	47.5	44%	0.435	23%	0.23	S	C	.	.	H	α-helix	trans	-85.2	-9.7	-176.6	-60.8	76.1	0	0	0	113.2	H111 Q117	H111-H115 AromaticContact CD2-CE1 3.64Å; H111-H115 AromaticContact CD2-ND1 3.62Å; H111-H115 AromaticContact CE1-ND1 3.91Å; H111-H115 AromaticContact CG-ND1 3.84Å; H111-H115 AromaticContact NE2-CE1 3.77Å; H111-H115 AromaticContact NE2-ND1 3.72Å; H111-H115 WeakPolarHBondContact O-CB 3.5Å; H111-H115 PolarHBondContact O-N 2.81Å; H111-H115 PolarHBondContact O-ND1 3.2Å; H115-Q117 VanDerWaalsContact C-N 3.33Å; H115-Q117 HydrophobicContact CB-CG 4.41Å
116	N	84.7	Confident	90.2	Very high	74 Å²	74	47.5 Å²	47.5	40%	0.396	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	42.9	-174.8	-53.4	-86.4	0	0	0	113.1	S112 I113 E114 R153	S112-N116 CarbonylContact O-C 3.6Å; S112-N116 WeakPolarHBondContact O-CA 3.32Å; S112-N116 PolarHBondContact O-N 2.8Å; I113-N116 PolarHBondContact O-OD1 2.92Å; E114-N116 PolarHBondContact O-ND2 2.85Å; N116-R153 PolarHBondContact ND2-NH2 3.06Å; N116-R153 PolarHBondContact OD1-NE 3.1Å; N116-R153 PolarHBondContact OD1-NH2 2.85Å
117	Q	87.6	Confident	90.2	Very high	100 Å²	100	46.9 Å²	46.9	47%	0.467	23%	0.226	S	C	.	.			trans	-121	157.4	179.8	-70.8	175.7	-16.2	0	0	110.3	S112 H115 I119	S112-Q117 WeakPolarHBondContact CA-O 3.18Å; S112-Q117 VanDerWaalsContact CB-O 3.24Å; S112-Q117 WeakPolarHBondContact CB-O 3.38Å; S112-Q117 PolarHBondContact O-N 3.04Å; S112-Q117 VanDerWaalsContact O-N 3.09Å; H115-Q117 VanDerWaalsContact C-N 3.33Å; H115-Q117 HydrophobicContact CB-CG 4.41Å; Q117-I119 PolarHBondContact O-N 3.31Å; Q117-I119 VanDerWaalsContact O-N 3.13Å
118	H	89.1	Confident	90.3	Very high	54 Å²	54	42.9 Å²	42.9	25%	0.25	21%	0.209	C	C	.	.	S	Bend	trans	48.7	39.9	177.2	-61	-64.1	0	0	0	115	D77 I80 E121 S122	D77-H118 IonicContact OD1-NE2 3.67Å; I80-H118 HydrophobicContact CD1-CB 3.5Å; I80-H118 HydrophobicContact CG2-CB 4.48Å; H118-E121 WeakPolarHBondContact CA-OE2 3.26Å; H118-E121 HydrophobicContact CB-CB 4.35Å; H118-E121 IonicContact CE1-OE1 2.94Å; H118-E121 IonicContact CG-OE1 2.71Å; H118-E121 IonicContact ND1-OE1 2.67Å; H118-E121 PolarHBondContact ND1-OE1 3.42Å; H118-S122 VanDerWaalsContact O-CB 3.22Å; H118-S122 WeakPolarHBondContact O-CB 3.14Å; H118-S122 PolarHBondContact O-N 2.91Å; H118-S122 PolarHBondContact O-OG 3.31Å
119	I	89.7	Confident	90.4	Very high	35 Å²	35	42.9 Å²	42.9	18%	0.179	21%	0.209	C	C	.	.	H	α-helix	trans	-73.7	-34.9	-172.6	-61.9	-61.8	0	0	0	112	S112 Q117 R123 L150 T154	S112-I119 WeakPolarHBondContact O-CD1 3.45Å; Q117-I119 PolarHBondContact O-N 3.31Å; Q117-I119 VanDerWaalsContact O-N 3.13Å; I119-R123 PolarHBondContact O-N 3Å; I119-L150 HydrophobicContact CG2-CD1 4.42Å; I119-L150 HydrophobicContact CG2-CD2 3.74Å; I119-L150 HydrophobicContact CG2-CG 4Å; I119-T154 HydrophobicContact CG2-CG2 3.39Å
120	E	88.8	Confident	90.4	Very high	72 Å²	72	45 Å²	45	34%	0.336	22%	0.22	S	C	.	.	H	α-helix	trans	-74.8	-41.3	178.3	171.6	51.2	-153.4	0	0	110.8	N18 S122 R123 Q124	N18-E120 PolarHBondContact ND2-OE1 2.89Å; E120-S122 VanDerWaalsContact C-N 3.31Å; E120-S122 PolarHBondContact O-N 2.83Å; E120-R123 VanDerWaalsContact CD-NH2 3.33Å; E120-R123 WeakPolarHBondContact O-CB 3.44Å; E120-R123 PolarHBondContact O-N 3.45Å; E120-R123 VanDerWaalsContact O-N 3.13Å; E120-R123 IonicContact OE1-CZ 2.72Å; E120-R123 IonicContact OE1-NE 3.91Å; E120-R123 PolarHBondContact OE1-NE 3.2Å; E120-R123 IonicContact OE1-NH2 2.74Å; E120-R123 PolarHBondContact OE1-NH2 2.78Å; E120-R123 IonicContact OE2-CZ 2.73Å; E120-R123 IonicContact OE2-NE 3.66Å; E120-R123 PolarHBondContact OE2-NE 3.48Å; E120-R123 IonicContact OE2-NH2 2.67Å; E120-R123 PolarHBondContact OE2-NH2 3.3Å; E120-Q124 WeakPolarHBondContact O-CG 3.38Å; E120-Q124 PolarHBondContact O-N 3.49Å; E120-Q124 PolarHBondContact OE1-NE2 2.67Å
121	E	92.4	Very high	90.4	Very high	60 Å²	60	45.8 Å²	45.8	28%	0.28	22%	0.218	S	C	.	.	H	α-helix	trans	-62.3	-40.2	172.5	-56.5	95.7	127.9	0	0	110.8	I80 L84 H118 Q124 L125	I80-E121 HydrophobicContact CG2-CB 3.48Å; I80-E121 VanDerWaalsContact CG2-CB 3.48Å; I80-E121 HydrophobicContact CG2-CG 4.2Å; L84-E121 HydrophobicContact CD1-CB 3.94Å; L84-E121 HydrophobicContact CD1-CG 4.24Å; H118-E121 WeakPolarHBondContact CA-OE2 3.26Å; H118-E121 HydrophobicContact CB-CB 4.35Å; H118-E121 IonicContact CE1-OE1 2.94Å; H118-E121 IonicContact CG-OE1 2.71Å; H118-E121 IonicContact ND1-OE1 2.67Å; H118-E121 PolarHBondContact ND1-OE1 3.42Å; E121-Q124 PolarHBondContact O-N 2.8Å; E121-L125 WeakPolarHBondContact O-CG 3.33Å; E121-L125 PolarHBondContact O-N 3.38Å
122	S	92.6	Very high	90.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.7	-37.9	171.6	-68	0	0	0	0	112.9	S112 H118 E120 L126	S112-S122 WeakPolarHBondContact CB-OG 3.32Å; S112-S122 PolarHBondContact OG-OG 2.65Å; H118-S122 VanDerWaalsContact O-CB 3.22Å; H118-S122 WeakPolarHBondContact O-CB 3.14Å; H118-S122 PolarHBondContact O-N 2.91Å; H118-S122 PolarHBondContact O-OG 3.31Å; E120-S122 VanDerWaalsContact C-N 3.31Å; E120-S122 PolarHBondContact O-N 2.83Å; S122-L126 WeakPolarHBondContact O-CB 3.41Å; S122-L126 WeakPolarHBondContact O-CG 3.44Å; S122-L126 PolarHBondContact O-N 3.26Å
123	R	91.4	Very high	90.5	Very high	86 Å²	86	49.1 Å²	49.1	33%	0.325	24%	0.242	S	C	.	.	H	α-helix	trans	-63.1	-41.3	172.2	-175.8	-174.1	72.2	104.3	-5.8	111.2	E21 I119 E120 S127 L150	E21-R123 IonicContact OE1-CZ 3.58Å; E21-R123 IonicContact OE1-NH1 2.7Å; E21-R123 IonicContact OE1-NH2 3.48Å; E21-R123 PolarHBondContact OE1-NH2 3.4Å; I119-R123 PolarHBondContact O-N 3Å; E120-R123 VanDerWaalsContact CD-NH2 3.33Å; E120-R123 WeakPolarHBondContact O-CB 3.44Å; E120-R123 PolarHBondContact O-N 3.45Å; E120-R123 VanDerWaalsContact O-N 3.13Å; E120-R123 IonicContact OE1-CZ 2.72Å; E120-R123 IonicContact OE1-NE 3.91Å; E120-R123 PolarHBondContact OE1-NE 3.2Å; E120-R123 IonicContact OE1-NH2 2.74Å; E120-R123 PolarHBondContact OE1-NH2 2.78Å; E120-R123 IonicContact OE2-CZ 2.73Å; E120-R123 IonicContact OE2-NE 3.66Å; E120-R123 PolarHBondContact OE2-NE 3.48Å; E120-R123 IonicContact OE2-NH2 2.67Å; E120-R123 PolarHBondContact OE2-NH2 3.3Å; R123-S127 VanDerWaalsContact O-CB 3.31Å; R123-S127 WeakPolarHBondContact O-CB 3.3Å; R123-S127 PolarHBondContact O-N 2.92Å; R123-S127 PolarHBondContact O-OG 3.33Å; R123-L150 HydrophobicContact CB-CD2 4.37Å
124	Q	93.5	Very high	90.5	Very high	33 Å²	33	48.7 Å²	48.7	15%	0.154	24%	0.242	C	C	.	.	H	α-helix	trans	-68.3	-43	177.6	-67.9	171.7	24.7	0	0	111.8	N18 C20 L84 E120 E121 L126 S127 Y128	N18-Q124 PolarHBondContact ND2-NE2 3.42Å; C20-Q124 HydrophobicContact CB-CB 3.96Å; C20-Q124 HydrophobicContact CB-CG 3.8Å; L84-Q124 HydrophobicContact CD2-CB 3.68Å; E120-Q124 WeakPolarHBondContact O-CG 3.38Å; E120-Q124 PolarHBondContact O-N 3.49Å; E120-Q124 PolarHBondContact OE1-NE2 2.67Å; E121-Q124 PolarHBondContact O-N 2.8Å; Q124-L126 PolarHBondContact O-N 2.95Å; Q124-S127 WeakPolarHBondContact O-CB 3.41Å; Q124-S127 PolarHBondContact O-N 2.73Å; Q124-Y128 VanDerWaalsContact O-CD2 3.25Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.35Å; Q124-Y128 PolarHBondContact O-N 3.25Å
125	L	93.9	Very high	90.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-57.8	-46.5	173.6	-76	176.3	0	0	0	112.4	I80 L83 L84 L87 L105 E121 A129	I80-L125 HydrophobicContact CG2-CD1 4.37Å; L83-L125 HydrophobicContact CB-CD1 4.24Å; L83-L125 HydrophobicContact CB-CD2 3.51Å; L83-L125 HydrophobicContact CD1-CD1 4.25Å; L84-L125 HydrophobicContact CB-CD2 4.41Å; L84-L125 HydrophobicContact CD2-CD2 3.75Å; L84-L125 HydrophobicContact CD2-CG 3.8Å; L84-L125 HydrophobicContact CG-CD2 3.79Å; L84-L125 HydrophobicContact CG-CG 3.98Å; L87-L125 HydrophobicContact CD2-CD2 4.34Å; L105-L125 HydrophobicContact CD2-CB 4.26Å; L105-L125 HydrophobicContact CD2-CD1 4.39Å; L105-L125 HydrophobicContact CD2-CD2 4.46Å; E121-L125 WeakPolarHBondContact O-CG 3.33Å; E121-L125 PolarHBondContact O-N 3.38Å; L125-A129 WeakPolarHBondContact O-CB 3.35Å; L125-A129 PolarHBondContact O-N 2.71Å
126	L	92.4	Very high	90.7	Very high	1 Å²	1	40 Å²	40	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-41.4	175.3	-78	166.1	0	0	0	111.9	L109 S122 Q124 A129 L130 L143 W146 L147 L150	L109-L126 HydrophobicContact CD1-CD1 4.32Å; L109-L126 HydrophobicContact CD1-CD2 3.72Å; L109-L126 HydrophobicContact CD1-CG 4.02Å; L109-L126 HydrophobicContact CD2-CD1 3.87Å; L109-L126 HydrophobicContact CD2-CG 3.95Å; S122-L126 WeakPolarHBondContact O-CB 3.41Å; S122-L126 WeakPolarHBondContact O-CG 3.44Å; S122-L126 PolarHBondContact O-N 3.26Å; Q124-L126 PolarHBondContact O-N 2.95Å; L126-A129 PolarHBondContact O-N 3.49Å; L126-L130 WeakPolarHBondContact O-CB 3.18Å; L126-L130 VanDerWaalsContact O-CG 3.22Å; L126-L130 WeakPolarHBondContact O-CG 3.4Å; L126-L130 PolarHBondContact O-N 3.06Å; L126-L143 HydrophobicContact CD2-CB 4.02Å; L126-L143 HydrophobicContact CD2-CD2 4.05Å; L126-L143 WeakPolarHBondContact CD2-O 3.49Å; L126-W146 HydrophobicContact CD1-CB 4.3Å; L126-W146 HydrophobicContact CD2-CB 4.14Å; L126-L147 HydrophobicContact CB-CD1 4.36Å; L126-L147 HydrophobicContact CD1-CB 4.09Å; L126-L150 HydrophobicContact CD1-CD1 4.26Å
127	S	92.3	Very high	90.8	Very high	27 Å²	27	43.5 Å²	43.5	19%	0.189	23%	0.225	C	C	.	.	H	α-helix	trans	-60.1	-47.2	177.1	-63.7	0	0	0	0	111.6	R123 Q124 I131	R123-S127 VanDerWaalsContact O-CB 3.31Å; R123-S127 WeakPolarHBondContact O-CB 3.3Å; R123-S127 PolarHBondContact O-N 2.92Å; R123-S127 PolarHBondContact O-OG 3.33Å; Q124-S127 WeakPolarHBondContact O-CB 3.41Å; Q124-S127 PolarHBondContact O-N 2.73Å; S127-I131 WeakPolarHBondContact O-CG1 3.33Å; S127-I131 WeakPolarHBondContact O-CG2 3.43Å; S127-I131 PolarHBondContact O-N 3.09Å
128	Y	94.4	Very high	90.8	Very high	22 Å²	22	46 Å²	46	9%	0.086	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-53.2	172.2	-76.5	-59.1	0	0	0	111.7	C20 T23 L84 P88 Q124 L130 I131 H132	C20-Y128 WeakPolarHBondContact CA-OH 3.36Å; C20-Y128 HydrophobicContact CB-CD2 4.36Å; C20-Y128 HydrophobicContact CB-CE1 4.45Å; C20-Y128 HydrophobicContact CB-CE2 3.68Å; C20-Y128 PolarHBondContact N-OH 3.02Å; T23-Y128 HydrophobicContact CG2-CE1 4.05Å; L84-Y128 HydrophobicContact CD2-CD2 4.23Å; L84-Y128 HydrophobicContact CD2-CE2 4.2Å; P88-Y128 HydrophobicContact CB-CD1 4.41Å; P88-Y128 HydrophobicContact CB-CE1 4.33Å; P88-Y128 HydrophobicContact CG-CD1 3.85Å; P88-Y128 HydrophobicContact CG-CD2 4.22Å; P88-Y128 HydrophobicContact CG-CE1 3.78Å; P88-Y128 HydrophobicContact CG-CE2 4.16Å; P88-Y128 HydrophobicContact CG-CG 4.08Å; Q124-Y128 VanDerWaalsContact O-CD2 3.25Å; Q124-Y128 WeakPolarHBondContact O-CD2 3.35Å; Q124-Y128 PolarHBondContact O-N 3.25Å; Y128-L130 VanDerWaalsContact C-N 3.27Å; Y128-L130 PolarHBondContact O-N 3.01Å; Y128-I131 WeakPolarHBondContact O-CG1 3.31Å; Y128-I131 PolarHBondContact O-N 3.02Å; Y128-H132 WeakPolarHBondContact O-CB 3.3Å; Y128-H132 PolarHBondContact O-N 3.3Å
129	A	92.9	Very high	90.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-59.1	-35.3	-175.9	0	0	0	0	0	113.6	L87 L105 L125 L126 T135 L143	L87-A129 HydrophobicContact CD2-CB 4.07Å; L105-A129 HydrophobicContact CD1-CB 4.32Å; L125-A129 WeakPolarHBondContact O-CB 3.35Å; L125-A129 PolarHBondContact O-N 2.71Å; L126-A129 PolarHBondContact O-N 3.49Å; A129-T135 WeakPolarHBondContact O-CG2 3.3Å; A129-T135 PolarHBondContact O-OG1 3.23Å; A129-L143 HydrophobicContact CB-CD1 3.69Å
130	L	91.5	Very high	90.9	Very high	46 Å²	46	46 Å²	46	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-73.8	-37.6	178.6	-70.2	170.4	0	0	0	112.8	L126 Y128 R140 L143 L147	L126-L130 WeakPolarHBondContact O-CB 3.18Å; L126-L130 VanDerWaalsContact O-CG 3.22Å; L126-L130 WeakPolarHBondContact O-CG 3.4Å; L126-L130 PolarHBondContact O-N 3.06Å; Y128-L130 VanDerWaalsContact C-N 3.27Å; Y128-L130 PolarHBondContact O-N 3.01Å; L130-R140 HydrophobicContact CD2-CB 4.02Å; L130-R140 HydrophobicContact CD2-CG 4.16Å; L130-R140 WeakPolarHBondContact CD2-O 3.23Å; L130-R140 VanDerWaalsContact O-CD 3.3Å; L130-R140 WeakPolarHBondContact O-CD 3.43Å; L130-R140 PolarHBondContact O-NE 3.11Å; L130-L143 HydrophobicContact CD2-CB 4.22Å; L130-L147 HydrophobicContact CD1-CD1 3.79Å
131	I	91.1	Very high	90.9	Very high	53 Å²	53	46 Å²	46	27%	0.272	24%	0.242	S	C	.	.	H	α-helix	trans	-83.3	-21.3	177.8	71.4	-178.2	0	0	0	113.8	T23 V24 L27 S127 Y128	T23-I131 HydrophobicContact CG2-CD1 4.33Å; V24-I131 HydrophobicContact CG2-CD1 3.87Å; L27-I131 HydrophobicContact CD2-CB 3.76Å; L27-I131 HydrophobicContact CD2-CD1 3.98Å; L27-I131 HydrophobicContact CD2-CG1 4.15Å; L27-I131 HydrophobicContact CD2-CG2 4.35Å; S127-I131 WeakPolarHBondContact O-CG1 3.33Å; S127-I131 WeakPolarHBondContact O-CG2 3.43Å; S127-I131 PolarHBondContact O-N 3.09Å; Y128-I131 WeakPolarHBondContact O-CG1 3.31Å; Y128-I131 PolarHBondContact O-N 3.02Å
132	H	91	Very high	90.7	Very high	19 Å²	19	45.2 Å²	45.2	9%	0.088	25%	0.246	C	C	.	.			trans	-64.8	136.1	-170.3	-169.5	-107.9	0	0	0	112.6	L90 Y128 A134 T135 R140	L90-H132 PolarHBondContact O-CE1 3.12Å; L90-H132 PolarHBondContact O-NE2 2.69Å; L90-H132 VanDerWaalsContact O-NE2 3.12Å; Y128-H132 WeakPolarHBondContact O-CB 3.3Å; Y128-H132 PolarHBondContact O-N 3.3Å; H132-A134 VanDerWaalsContact C-N 3.34Å; H132-A134 WeakPolarHBondContact CE1-CB 2.87Å; H132-A134 WeakPolarHBondContact ND1-CB 3.33Å; H132-A134 PolarHBondContact ND1-N 3.11Å; H132-A134 PolarHBondContact O-N 3.34Å; H132-T135 PolarHBondContact O-OG1 3.46Å; H132-R140 PolarHBondContact O-NH2 3.18Å
133	P	89.6	Confident	90.6	Very high	96 Å²	96	45.5 Å²	45.5	62%	0.623	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-26.5	-175.5	-19.9	32.5	0	0	0	114.6	P92 T135	P92-P133 HydrophobicContact CG-CB 3.96Å; P133-T135 VanDerWaalsContact C-N 3.35Å; P133-T135 PolarHBondContact O-N 3.13Å
134	A	88.3	Confident	90.4	Very high	16 Å²	16	43.1 Å²	43.1	13%	0.132	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-13.1	-176.3	0	0	0	0	0	114.8	L90 P92 K98 H132	L90-A134 HydrophobicContact CD2-CB 4.05Å; L90-A134 HydrophobicContact CG-CB 4.06Å; P92-A134 HydrophobicContact CB-CB 4.41Å; P92-A134 HydrophobicContact CG-CB 4.46Å; K98-A134 VanDerWaalsContact CD-O 3.3Å; K98-A134 WeakPolarHBondContact CD-O 3.5Å; H132-A134 VanDerWaalsContact C-N 3.34Å; H132-A134 WeakPolarHBondContact CE1-CB 2.87Å; H132-A134 WeakPolarHBondContact ND1-CB 3.33Å; H132-A134 PolarHBondContact ND1-N 3.11Å; H132-A134 PolarHBondContact O-N 3.34Å
135	T	89	Confident	90.1	Very high	6 Å²	6	47.1 Å²	47.1	4%	0.037	27%	0.266	C	S	.	.	S	Bend	trans	-76.4	144.9	173.9	51.6	0	0	0	0	110.4	M102 A129 H132 P133 D139 R140	M102-T135 HydrophobicContact CE-CG2 3.92Å; A129-T135 WeakPolarHBondContact O-CG2 3.3Å; A129-T135 PolarHBondContact O-OG1 3.23Å; H132-T135 PolarHBondContact O-OG1 3.46Å; P133-T135 VanDerWaalsContact C-N 3.35Å; P133-T135 PolarHBondContact O-N 3.13Å; T135-D139 HydrophobicContact CG2-CB 4.5Å; T135-R140 PolarHBondContact O-NH1 3.04Å; T135-R140 PolarHBondContact O-NH2 2.72Å; T135-R140 PolarHBondContact OG1-NE 3.17Å; T135-R140 PolarHBondContact OG1-NH2 3.44Å; T135-R140 VanDerWaalsContact OG1-NH2 3.1Å
136	S	88.3	Confident	89.8	Confident	40 Å²	40	50.6 Å²	50.6	28%	0.28	28%	0.279	S	S	.	.			trans	-80.6	173.2	176.2	84.4	0	0	0	0	111.2	E138 D139 R140	S136-E138 VanDerWaalsContact C-N 3.26Å; S136-E138 PolarHBondContact OG-N 3.43Å; S136-D139 WeakPolarHBondContact CB-OD2 2.94Å; S136-D139 PolarHBondContact N-OD2 2.84Å; S136-D139 PolarHBondContact OG-N 2.64Å; S136-D139 PolarHBondContact OG-OD1 2.91Å; S136-D139 PolarHBondContact OG-OD2 3.26Å; S136-R140 WeakPolarHBondContact O-CG 3.42Å; S136-R140 PolarHBondContact O-N 3.28Å; S136-R140 PolarHBondContact O-NH1 3.25Å
137	L	87.1	Confident	89.4	Confident	148 Å²	148	52.4 Å²	52.4	78%	0.775	29%	0.288	S	S	*	.	H	α-helix	trans	-66.7	-32.5	173.1	-176.1	59.9	0	0	0	111.9	S141	L137-S141 PolarHBondContact O-N 2.93Å; L137-S141 VanDerWaalsContact O-N 3.08Å
138	E	88.1	Confident	88.9	Confident	152 Å²	152	55.4 Å²	55.4	71%	0.71	30%	0.302	S	S	*	.	H	α-helix	trans	-73.6	-43	177.5	-175.1	176.2	-160.1	0	0	112	S136 R140 S141 A142	S136-E138 VanDerWaalsContact C-N 3.26Å; S136-E138 PolarHBondContact OG-N 3.43Å; E138-R140 PolarHBondContact O-N 3.17Å; E138-S141 PolarHBondContact O-N 3.03Å; E138-S141 PolarHBondContact O-OG 2.73Å; E138-A142 PolarHBondContact O-N 2.94Å; E138-A142 VanDerWaalsContact O-N 3.08Å
139	D	89.6	Confident	88.3	Confident	23 Å²	23	59.3 Å²	59.3	12%	0.123	32%	0.321	C	S	.	.	H	α-helix	trans	-56.9	-43.4	172.8	-57.6	-30.5	0	0	0	110	K98 M102 T135 S136 L143	K98-D139 WeakPolarHBondContact CD-OD2 3.35Å; K98-D139 WeakPolarHBondContact CE-OD2 3.35Å; K98-D139 IonicContact NZ-OD1 2.65Å; K98-D139 PolarHBondContact NZ-OD1 3.34Å; K98-D139 IonicContact NZ-OD2 2.64Å; K98-D139 PolarHBondContact NZ-OD2 3.36Å; M102-D139 HydrophobicContact SD-CB 3.88Å; T135-D139 HydrophobicContact CG2-CB 4.5Å; S136-D139 WeakPolarHBondContact CB-OD2 2.94Å; S136-D139 PolarHBondContact N-OD2 2.84Å; S136-D139 PolarHBondContact OG-N 2.64Å; S136-D139 PolarHBondContact OG-OD1 2.91Å; S136-D139 PolarHBondContact OG-OD2 3.26Å; D139-L143 WeakPolarHBondContact O-CB 3.49Å; D139-L143 VanDerWaalsContact O-CG 3.25Å; D139-L143 WeakPolarHBondContact O-CG 3.21Å; D139-L143 PolarHBondContact O-N 3.15Å
140	R	90.9	Very high	87.9	Confident	66 Å²	66	59.7 Å²	59.7	25%	0.249	32%	0.323	C	S	.	.	H	α-helix	trans	-68.4	-36	179.1	-71.7	-173.9	-165.6	81.6	2.7	113.3	L130 H132 T135 S136 E138 A144	L130-R140 HydrophobicContact CD2-CB 4.02Å; L130-R140 HydrophobicContact CD2-CG 4.16Å; L130-R140 WeakPolarHBondContact CD2-O 3.23Å; L130-R140 VanDerWaalsContact O-CD 3.3Å; L130-R140 WeakPolarHBondContact O-CD 3.43Å; L130-R140 PolarHBondContact O-NE 3.11Å; H132-R140 PolarHBondContact O-NH2 3.18Å; T135-R140 PolarHBondContact O-NH1 3.04Å; T135-R140 PolarHBondContact O-NH2 2.72Å; T135-R140 PolarHBondContact OG1-NE 3.17Å; T135-R140 PolarHBondContact OG1-NH2 3.44Å; T135-R140 VanDerWaalsContact OG1-NH2 3.1Å; S136-R140 WeakPolarHBondContact O-CG 3.42Å; S136-R140 PolarHBondContact O-N 3.28Å; S136-R140 PolarHBondContact O-NH1 3.25Å; E138-R140 PolarHBondContact O-N 3.17Å; R140-A144 VanDerWaalsContact O-CB 3.25Å; R140-A144 WeakPolarHBondContact O-CB 3.21Å; R140-A144 PolarHBondContact O-N 3.25Å
141	S	88.6	Confident	87.3	Confident	72 Å²	72	62.6 Å²	62.6	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-70.3	-37.5	178.1	67.1	0	0	0	0	111.6	L137 E138	L137-S141 PolarHBondContact O-N 2.93Å; L137-S141 VanDerWaalsContact O-N 3.08Å; E138-S141 PolarHBondContact O-N 3.03Å; E138-S141 PolarHBondContact O-OG 2.73Å
142	A	88.6	Confident	86.7	Confident	44 Å²	44	65 Å²	65	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-50	171.7	0	0	0	0	0	112	E138 A144 M145	E138-A142 PolarHBondContact O-N 2.94Å; E138-A142 VanDerWaalsContact O-N 3.08Å; A142-A144 VanDerWaalsContact C-N 3.33Å; A142-A144 PolarHBondContact O-N 3.4Å; A142-M145 PolarHBondContact O-N 2.95Å
143	L	89.7	Confident	85.6	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.026	36%	0.363	C	S	.	.	H	α-helix	trans	-67.6	-29.8	-179.5	-69.3	169.9	0	0	0	113.3	M102 L105 L109 L126 A129 L130 D139 M145 W146 L147	M102-L143 HydrophobicContact CE-CD1 4.46Å; M102-L143 HydrophobicContact SD-CD1 4.01Å; L105-L143 HydrophobicContact CB-CD2 4.46Å; L109-L143 HydrophobicContact CD1-CD2 4.25Å; L126-L143 HydrophobicContact CD2-CB 4.02Å; L126-L143 HydrophobicContact CD2-CD2 4.05Å; L126-L143 WeakPolarHBondContact CD2-O 3.49Å; A129-L143 HydrophobicContact CB-CD1 3.69Å; L130-L143 HydrophobicContact CD2-CB 4.22Å; D139-L143 WeakPolarHBondContact O-CB 3.49Å; D139-L143 VanDerWaalsContact O-CG 3.25Å; D139-L143 WeakPolarHBondContact O-CG 3.21Å; D139-L143 PolarHBondContact O-N 3.15Å; L143-M145 VanDerWaalsContact C-N 3.26Å; L143-M145 PolarHBondContact O-N 3.15Å; L143-W146 WeakPolarHBondContact O-CB 3.37Å; L143-W146 PolarHBondContact O-N 2.88Å; L143-L147 PolarHBondContact O-N 3.42Å
144	A	87.8	Confident	84.3	Confident	36 Å²	36	66.8 Å²	66.8	30%	0.298	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-31.8	174.9	0	0	0	0	0	112.8	R140 A142 L147 N148	R140-A144 VanDerWaalsContact O-CB 3.25Å; R140-A144 WeakPolarHBondContact O-CB 3.21Å; R140-A144 PolarHBondContact O-N 3.25Å; A142-A144 VanDerWaalsContact C-N 3.33Å; A142-A144 PolarHBondContact O-N 3.4Å; A144-L147 PolarHBondContact O-N 2.83Å; A144-N148 PolarHBondContact O-N 2.84Å; A144-N148 PolarHBondContact O-ND2 3.19Å
145	M	86.6	Confident	82.9	Confident	117 Å²	117	70.6 Å²	70.6	58%	0.576	37%	0.374	S	S	*	.	H	α-helix	trans	-66.8	-40.6	176.1	-65.9	-173.9	-73.5	0	0	111.8	A142 L143 L147 N148 H149	A142-M145 PolarHBondContact O-N 2.95Å; L143-M145 VanDerWaalsContact C-N 3.26Å; L143-M145 PolarHBondContact O-N 3.15Å; M145-L147 VanDerWaalsContact C-N 3.27Å; M145-L147 PolarHBondContact O-N 3.47Å; M145-N148 PolarHBondContact O-N 2.9Å; M145-H149 PolarHBondContact O-CD2 3.48Å; M145-H149 VanDerWaalsContact O-CD2 3.25Å; M145-H149 PolarHBondContact O-N 3.16Å
146	W	87.1	Confident	81.4	Confident	74 Å²	74	75.4 Å²	75.4	28%	0.28	40%	0.403	S	S	.	.	H	α-helix	trans	-59.9	-35.4	174.8	-71.4	97.7	0	0	0	113.2	P106 L109 A110 I113 L126 L143 H149 L150	P106-W146 HydrophobicContact CB-CZ2 4.08Å; L109-W146 HydrophobicContact CB-CD2 4.17Å; L109-W146 HydrophobicContact CB-CE3 3.81Å; L109-W146 HydrophobicContact CB-CZ3 4.3Å; L109-W146 HydrophobicContact CD1-CB 4.03Å; L109-W146 HydrophobicContact CD1-CD2 4.41Å; L109-W146 HydrophobicContact CD1-CG 4.07Å; A110-W146 HydrophobicContact CB-CH2 3.79Å; A110-W146 HydrophobicContact CB-CZ3 4.03Å; I113-W146 HydrophobicContact CD1-CE3 3.82Å; I113-W146 HydrophobicContact CD1-CZ3 4.16Å; L126-W146 HydrophobicContact CD1-CB 4.3Å; L126-W146 HydrophobicContact CD2-CB 4.14Å; L143-W146 WeakPolarHBondContact O-CB 3.37Å; L143-W146 PolarHBondContact O-N 2.88Å; W146-H149 PolarHBondContact O-N 3.36Å; W146-L150 PolarHBondContact O-N 3.17Å; W146-L150 VanDerWaalsContact O-N 3.13Å
147	L	84.1	Confident	79.5	Confident	39 Å²	39	76.6 Å²	76.6	20%	0.204	41%	0.411	C	S	.	.	H	α-helix	trans	-65	-43.2	176.8	-170.3	149.3	0	0	0	112	L126 L130 L143 A144 M145 H149 L150 E151	L126-L147 HydrophobicContact CB-CD1 4.36Å; L126-L147 HydrophobicContact CD1-CB 4.09Å; L130-L147 HydrophobicContact CD1-CD1 3.79Å; L143-L147 PolarHBondContact O-N 3.42Å; A144-L147 PolarHBondContact O-N 2.83Å; M145-L147 VanDerWaalsContact C-N 3.27Å; M145-L147 PolarHBondContact O-N 3.47Å; L147-H149 PolarHBondContact O-N 3.41Å; L147-L150 PolarHBondContact O-N 3.46Å; L147-E151 HydrophobicContact CD2-CG 4.19Å; L147-E151 WeakPolarHBondContact CD2-OE1 3.35Å; L147-E151 PolarHBondContact O-N 3.08Å
148	N	82.5	Confident	77.5	Confident	90 Å²	90	78.8 Å²	78.8	48%	0.481	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-44.7	176.3	-68.8	-95.2	0	0	0	111.2	A144 M145 L150 E151 D152	A144-N148 PolarHBondContact O-N 2.84Å; A144-N148 PolarHBondContact O-ND2 3.19Å; M145-N148 PolarHBondContact O-N 2.9Å; N148-L150 PolarHBondContact O-N 2.86Å; N148-E151 PolarHBondContact O-N 3.36Å; N148-E151 VanDerWaalsContact O-N 3.15Å; N148-D152 PolarHBondContact O-N 3.01Å
149	H	82.1	Confident	75.2	Confident	104 Å²	104	75.3 Å²	75.3	48%	0.481	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-28.1	177	-67.9	-46.4	0	0	0	113.7	I113 M145 W146 L147 R153	I113-H149 HydrophobicContact CD1-CB 4.4Å; M145-H149 PolarHBondContact O-CD2 3.48Å; M145-H149 VanDerWaalsContact O-CD2 3.25Å; M145-H149 PolarHBondContact O-N 3.16Å; W146-H149 PolarHBondContact O-N 3.36Å; L147-H149 PolarHBondContact O-N 3.41Å; H149-R153 WeakPolarHBondContact O-CB 3.1Å; H149-R153 WeakPolarHBondContact O-CG 3.22Å; H149-R153 PolarHBondContact O-N 2.92Å
150	L	83.4	Confident	72.7	Confident	8 Å²	8	77.2 Å²	77.2	4%	0.042	45%	0.445	C	S	.	.	H	α-helix	trans	-77.2	-38.2	175.2	-168.9	154.5	0	0	0	111.5	I113 I119 R123 L126 W146 L147 N148 T154	I113-L150 HydrophobicContact CD1-CB 4.41Å; I119-L150 HydrophobicContact CG2-CD1 4.42Å; I119-L150 HydrophobicContact CG2-CD2 3.74Å; I119-L150 HydrophobicContact CG2-CG 4Å; R123-L150 HydrophobicContact CB-CD2 4.37Å; L126-L150 HydrophobicContact CD1-CD1 4.26Å; W146-L150 PolarHBondContact O-N 3.17Å; W146-L150 VanDerWaalsContact O-N 3.13Å; L147-L150 PolarHBondContact O-N 3.46Å; N148-L150 PolarHBondContact O-N 2.86Å; L150-T154 HydrophobicContact CD2-CG2 4.32Å; L150-T154 WeakPolarHBondContact O-CG2 3.3Å; L150-T154 PolarHBondContact O-N 2.72Å; L150-T154 PolarHBondContact O-OG1 3Å
151	E	80.4	Confident	70.2	Confident	106 Å²	106	82.4 Å²	82.4	50%	0.495	47%	0.472	S	S	.	.	H	α-helix	trans	-66.8	-39.3	173.9	-70.8	-173.4	167.3	0	0	112.7	L147 N148 T154 S155	L147-E151 HydrophobicContact CD2-CG 4.19Å; L147-E151 WeakPolarHBondContact CD2-OE1 3.35Å; L147-E151 PolarHBondContact O-N 3.08Å; N148-E151 PolarHBondContact O-N 3.36Å; N148-E151 VanDerWaalsContact O-N 3.15Å; E151-T154 WeakPolarHBondContact CA-OG1 3.44Å; E151-T154 PolarHBondContact O-OG1 3Å; E151-S155 WeakPolarHBondContact O-CB 3.22Å; E151-S155 PolarHBondContact O-N 3Å; E151-S155 VanDerWaalsContact O-N 3.08Å; E151-S155 PolarHBondContact O-OG 3.16Å
152	D	77	Confident	67.4	Low	104 Å²	104	86.9 Å²	86.9	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-64.4	-41.7	175.2	-73.2	-29.9	0	0	0	112	N148 T156	N148-D152 PolarHBondContact O-N 3.01Å; D152-T156 PolarHBondContact O-N 3.36Å; D152-T156 VanDerWaalsContact O-N 3.15Å; D152-T156 PolarHBondContact O-OG1 3.07Å
153	R	68.6	Low	65	Low	105 Å²	105	97 Å²	97	40%	0.396	52%	0.519	S	S	.	.	H	α-helix	trans	-74	-40.5	-177.8	-72.4	-79.5	-76.5	-150.2	-10.2	112.4	I113 N116 H149 S155 T156 S157	I113-R153 HydrophobicContact CG2-CG 4.19Å; I113-R153 PolarHBondContact O-NH2 3.42Å; N116-R153 PolarHBondContact ND2-NH2 3.06Å; N116-R153 PolarHBondContact OD1-NE 3.1Å; N116-R153 PolarHBondContact OD1-NH2 2.85Å; H149-R153 WeakPolarHBondContact O-CB 3.1Å; H149-R153 WeakPolarHBondContact O-CG 3.22Å; H149-R153 PolarHBondContact O-N 2.92Å; R153-S155 VanDerWaalsContact C-N 3.34Å; R153-T156 PolarHBondContact O-N 2.96Å; R153-S157 PolarHBondContact O-N 3.37Å
154	T	63.1	Low	62.1	Low	48 Å²	48	100.1 Å²	100.1	29%	0.294	55%	0.552	S	S	.	*	H	α-helix	trans	-60.9	-43.5	171.8	41.8	0	0	0	0	111.5	I119 L150 E151 T156 S157 F158	I119-T154 HydrophobicContact CG2-CG2 3.39Å; L150-T154 HydrophobicContact CD2-CG2 4.32Å; L150-T154 WeakPolarHBondContact O-CG2 3.3Å; L150-T154 PolarHBondContact O-N 2.72Å; L150-T154 PolarHBondContact O-OG1 3Å; E151-T154 WeakPolarHBondContact CA-OG1 3.44Å; E151-T154 PolarHBondContact O-OG1 3Å; T154-T156 PolarHBondContact O-N 3.39Å; T154-S157 PolarHBondContact O-N 3.45Å; T154-F158 WeakPolarHBondContact O-CD2 3.33Å
155	S	59	Low	59.7	Low	96 Å²	96	110.6 Å²	110.6	67%	0.671	58%	0.584	S	S	*	*	H	α-helix	trans	-59.5	-31.1	175.1	-60.1	0	0	0	0	113.4	E151 R153	E151-S155 WeakPolarHBondContact O-CB 3.22Å; E151-S155 PolarHBondContact O-N 3Å; E151-S155 VanDerWaalsContact O-N 3.08Å; E151-S155 PolarHBondContact O-OG 3.16Å; R153-S155 VanDerWaalsContact C-N 3.34Å
156	T	57.4	Low	56.9	Low	106 Å²	106	110.6 Å²	110.6	65%	0.65	60%	0.596	S	S	*	*	H	α-helix	trans	-82.7	-33.7	179.7	-54.4	0	0	0	0	112.8	D152 R153 T154 F158 G159	D152-T156 PolarHBondContact O-N 3.36Å; D152-T156 VanDerWaalsContact O-N 3.15Å; D152-T156 PolarHBondContact O-OG1 3.07Å; R153-T156 PolarHBondContact O-N 2.96Å; T154-T156 PolarHBondContact O-N 3.39Å; T156-F158 PolarHBondContact O-N 2.87Å; T156-G159 PolarHBondContact O-N 3.09Å
157	S	47.9	Very low	54.2	Low	65 Å²	65	114.6 Å²	114.6	46%	0.455	62%	0.623	S	S	.	*	H	α-helix	trans	-67.2	-33.4	-168.8	-160.6	0	0	0	0	114.3	R153 T154 G159 G160	R153-S157 PolarHBondContact O-N 3.37Å; T154-S157 PolarHBondContact O-N 3.45Å; S157-G159 PolarHBondContact O-N 3.42Å; S157-G159 VanDerWaalsContact O-N 3.09Å; S157-G160 PolarHBondContact O-N 3.3Å; S157-G160 VanDerWaalsContact O-N 3.15Å
158	F	44.7	Very low	51.6	Low	195 Å²	195	118.5 Å²	118.5	86%	0.855	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-10.8	-178.5	-76.4	-77.2	0	0	0	115	T154 T156	T154-F158 WeakPolarHBondContact O-CD2 3.33Å; T156-F158 PolarHBondContact O-N 2.87Å
159	G	39.9	Very low	49.3	Very low	78 Å²	78	120.4 Å²	120.4	80%	0.804	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-9.2	174	0	0	0	0	0	115.3	T156 S157	T156-G159 PolarHBondContact O-N 3.09Å; S157-G159 PolarHBondContact O-N 3.42Å; S157-G159 VanDerWaalsContact O-N 3.09Å
160	G	37.2	Very low	46.8	Very low	64 Å²	64	122.2 Å²	122.2	66%	0.66	68%	0.681	S	S	*	*	S	Bend	trans	-102.5	-14.7	-158.9	0	0	0	0	0	118.3	S157	S157-G160 PolarHBondContact O-N 3.3Å; S157-G160 VanDerWaalsContact O-N 3.15Å
161	Q	39.5	Very low	44.3	Very low	175 Å²	175	132.3 Å²	132.3	82%	0.818	72%	0.72	S	S	*	*			trans	-128.6	86.7	-167.5	-66.2	-168.3	10.5	0	0	114.4
162	N	28.2	Very low	41.9	Very low	165 Å²	165	130.3 Å²	130.3	88%	0.882	73%	0.728	S	S	*	*			trans	-157.8	90.5	146.7	-128	-22.5	0	0	0	112.3
163	R	37.7	Very low	39.5	Very low	256 Å²	256	134.4 Å²	134.4	97%	0.966	74%	0.744	S	S	*	*			trans	-96.9	85.5	167.1	-95	-168.8	170.9	-165.7	-1.9	110.1
164	G	30.2	Very low	37.5	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	76%	0.757	S	S	*	*			trans	-75.4	139.3	162	0	0	0	0	0	110.9
165	R	36.4	Very low	35.8	Very low	256 Å²	256	139.9 Å²	139.9	97%	0.966	78%	0.778	S	S	*	*			trans	-67.8	142.8	171.7	-76.8	169.4	145.5	-162.9	-6.1	111.4
166	S	27.9	Very low	34.3	Very low	118 Å²	118	143.6 Å²	143.6	83%	0.825	78%	0.778	S	S	*	*			trans	-160.2	151.8	135.2	-165.6	0	0	0	0	110
167	D	31	Very low	32.8	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	78%	0.779	S	S	*	*			trans	-78.7	149.1	176.1	-58.2	-75.3	0	0	0	112.7
168	S	29.2	Very low	31.8	Very low	120 Å²	120	150.3 Å²	150.3	84%	0.839	79%	0.789	S	S	*	*			trans	-167.7	144.5	131.6	-170	0	0	0	0	111.8
169	V	35.3	Very low	30.9	Very low	130 Å²	130	148.3 Å²	148.3	79%	0.788	78%	0.782	S	S	*	*			trans	-71.8	152.8	167.5	-132.1	0	0	0	0	110.8
170	D	29.1	Very low	30.1	Very low	142 Å²	142	154.2 Å²	154.2	76%	0.759	78%	0.78	S	S	*	*				-173.6	-177.9	97.4	-154.6	11	0	0	0	113.6
171	Y	31.3	Very low	29.5	Very low	221 Å²	221	158.4 Å²	158.4	87%	0.867	78%	0.782	S	S	*	*			trans	-59.5	169.7	-177.7	-79.9	-142.9	0	0	0	115.6
172	G	28.4	Very low	28.8	Very low	64 Å²	64	156.8 Å²	156.8	66%	0.66	78%	0.779	S	S	*	*			cis	151.5	160	-2.8	0	0	0	0	0	113.5
173	Q	28.4	Very low	28.7	Very low	189 Å²	189	153.4 Å²	153.4	88%	0.883	77%	0.769	S	S	*	*			trans	64.3	132.6	178.2	-66.7	178.2	-23.7	0	0	116.7
174	T	25.6	Very low	28.3	Very low	109 Å²	109	147.8 Å²	147.8	67%	0.669	76%	0.758	S	S	*	*			cis	102.3	136.4	15.8	-44.3	0	0	0	0	115.1
175	H	28	Very low	28.2	Very low	159 Å²	159	149.4 Å²	149.4	74%	0.736	75%	0.75	S	S	*	*			trans	85.2	146.9	169.8	-57.3	-75	0	0	0	119.4
176	Y	26.5	Very low	27.9	Very low	175 Å²	175	145.6 Å²	145.6	69%	0.686	74%	0.74	S	S	*	*			cis	-172.5	166.6	-34.1	-134.3	-91.6	0	0	0	110.2
177	Y	25.5	Very low	28	Very low	171 Å²	171	146.4 Å²	146.4	67%	0.671	74%	0.735	S	S	*	*			trans	82.7	136.1	151.3	-85.9	-53.2	0	0	0	126.3
178	H	28.4	Very low	27.9	Very low	141 Å²	141	145.3 Å²	145.3	65%	0.653	73%	0.729	S	S	*	*			trans	57.7	135	150.7	-63.9	-54.1	0	0	0	121.3
179	Q	24.6	Very low	27.8	Very low	153 Å²	153	142.9 Å²	142.9	72%	0.715	72%	0.722	S	S	*	*			cis	100.7	115.8	19	-176.3	-170.2	6.2	0	0	115.2
180	R	23.3	Very low	27.3	Very low	201 Å²	201	148.2 Å²	148.2	76%	0.758	73%	0.729	S	S	*	*			trans	179.9	131	135.7	-97.6	177.5	-159.5	-83.7	-0.6	109.4
181	Q	25.2	Very low	27.3	Very low	152 Å²	152	148.7 Å²	148.7	71%	0.71	73%	0.726	S	S	*	*				61.8	146.7	96.2	-66.1	-178.2	-44.2	0	0	115.7
182	N	24.2	Very low	27	Very low	141 Å²	141	144.8 Å²	144.8	75%	0.754	72%	0.72	S	S	*	*			cis	-173.4	177.5	-24.6	-169	27.1	0	0	0	108
183	S	26.9	Very low	26.9	Very low	95 Å²	95	146 Å²	146	66%	0.664	72%	0.719	S	S	*	*			trans	71	149.7	161.6	75.8	0	0	0	0	117.5
184	D	29	Very low	27	Very low	138 Å²	138	148.3 Å²	148.3	74%	0.738	72%	0.719	S	S	*	*			cis	-158	176.8	-12.3	-129.4	-56.4	0	0	0	113.9
185	D	27.9	Very low	26.9	Very low	105 Å²	105	150.5 Å²	150.5	56%	0.561	73%	0.727	S	S	*	*			trans	48.8	115.3	157.5	-87.7	-39.6	0	0	0	121.6
186	K	30.4	Very low	27	Very low	176 Å²	176	148.1 Å²	148.1	77%	0.765	73%	0.728	S	S	*	*				65.6	140.2	96	-68.8	-170.2	-161.5	85.1	0	114.9
187	L	29.6	Very low	26.9	Very low	135 Å²	135	143 Å²	143	71%	0.707	73%	0.728	S	S	*	*				-171	137.2	52.4	179.1	65.8	0	0	0	113.2
188	N	29.8	Very low	27	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	74%	0.739	S	S	*	*			trans	56.2	148.9	162.9	-61.8	-14.6	0	0	0	118.8
189	G	26.9	Very low	26.8	Very low	68 Å²	68	142.1 Å²	142.1	70%	0.701	75%	0.747	S	S	*	*			cis	123.1	133.2	15.9	0	0	0	0	0	108.4
190	W	25.1	Very low	26.9	Very low	243 Å²	243	143.1 Å²	143.1	92%	0.92	76%	0.755	S	S	*	*				-152.3	177.3	56.3	-99.3	58	0	0	0	113.9
191	Q	27.8	Very low	26.9	Very low	152 Å²	152	140.6 Å²	140.6	71%	0.71	76%	0.757	S	S	*	*			trans	-105.3	155	-162.3	-159.5	80.2	23.1	0	0	114.7
192	N	26.6	Very low	26.8	Very low	138 Å²	138	137.7 Å²	137.7	74%	0.738	76%	0.758	S	S	*	*			trans	137.9	128.7	134.2	-69.7	-52.1	0	0	0	112.4
193	S	26.3	Very low	26.9	Very low	91 Å²	91	136.2 Å²	136.2	64%	0.636	76%	0.759	S	S	*	*			cis	81	100.2	26.2	-163.3	0	0	0	0	115.5
194	R	29.2	Very low	26.8	Very low	236 Å²	236	137.1 Å²	137.1	89%	0.891	76%	0.757	S	S	*	*				-173.5	140.5	108.5	-102.1	172.6	172.1	168.3	-2.8	112.1
195	D	24.8	Very low	26.8	Very low	156 Å²	156	143 Å²	143	83%	0.834	77%	0.769	S	S	*	*			trans	-122.1	161.4	161.7	-165.1	-3.4	0	0	0	107.6
196	S	28.5	Very low	26.7	Very low	108 Å²	108	145.3 Å²	145.3	76%	0.755	78%	0.776	S	S	*	*			trans	-162.9	127.5	-178.9	-73.6	0	0	0	0	111.2
197	G	25.9	Very low	26.4	Very low	67 Å²	67	143 Å²	143	69%	0.691	77%	0.772	S	S	*	*			cis	170.7	-140.7	0.8	0	0	0	0	0	110.7
198	I	27.3	Very low	26.2	Very low	176 Å²	176	144.6 Å²	144.6	90%	0.903	77%	0.773	S	S	*	*			trans	76.4	127.7	177.7	-53.9	174.9	0	0	0	114.4
199	C	23.9	Very low	25.8	Very low	119 Å²	119	143.3 Å²	143.3	80%	0.804	78%	0.775	S	S	*	*			trans	-133.9	154	175.3	52.9	0	0	0	0	109.4
200	I	26	Very low	25.7	Very low	173 Å²	173	148.8 Å²	148.8	89%	0.887	78%	0.784	S	S	*	*			trans	-129.4	144.4	165	-58.8	-177.7	0	0	0	107.2
201	N	24.1	Very low	25.7	Very low	149 Å²	149	140.4 Å²	140.4	80%	0.797	77%	0.774	S	S	*	*			trans	-116.7	137.7	-156	174.7	48.6	0	0	0	112.9
202	A	23.4	Very low	25.6	Very low	90 Å²	90	139.8 Å²	139.8	74%	0.744	78%	0.784	S	S	*	*			trans	-157.6	94.6	164.9	0	0	0	0	0	113.5
203	S	26	Very low	25.4	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	79%	0.786	S	S	*	*			trans	61.8	95.2	139.6	-53.8	0	0	0	0	120.8
204	N	25	Very low	25.4	Very low	114 Å²	114	143.7 Å²	143.7	61%	0.61	79%	0.793	S	S	*	*			trans	-39.4	151.5	154.7	-74.8	-6.1	0	0	0	115.2
205	W	27.6	Very low	25.2	Very low	262 Å²	262	135.6 Å²	135.6	99%	0.992	78%	0.782	S	S	*	*				-129.4	149.7	114.1	-86.5	91.1	0	0	0	109.5
206	Q	26	Very low	25.2	Very low	153 Å²	153	137.3 Å²	137.3	72%	0.715	79%	0.785	S	S	*	*			trans	-121.9	147.3	-176	-62.5	172.3	-37.2	0	0	110.1
207	D	24.1	Very low	25.3	Very low	126 Å²	126	138.6 Å²	138.6	67%	0.674	79%	0.788	S	S	*	*				-160.9	155.8	126.8	-144.2	-10	0	0	0	114.4
208	K	25.3	Very low	26.5	Very low	169 Å²	169	140.3 Å²	140.3	74%	0.735	79%	0.787	S	S	*	*			trans	27.7	93.4	162.2	-75.1	141.6	-158	138.5	0	121.5
209	S	22.5	Very low	26.5	Very low	108 Å²	108	138.5 Å²	138.5	76%	0.755	78%	0.779	S	S	*	*				-6.8	134.4	121.7	-176.9	0	0	0	0	118.3
210	M	24.9	Very low	26.6	Very low	184 Å²	184	142.9 Å²	142.9	91%	0.906	78%	0.78	S	S	*	*				-166.5	148.8	118.3	-96.5	-77.4	-83.1	0	0	108.7
211	G	23.7	Very low	26.5	Very low	67 Å²	67	139.3 Å²	139.3	69%	0.691	77%	0.77	S	S	*	*			trans	-153.8	165.9	-179.4	0	0	0	0	0	113.4
212	C	25.7	Very low	26.5	Very low	139 Å²	139	137.4 Å²	137.4	94%	0.939	77%	0.768	S	S	*	*			trans	-162.6	157	168.9	-103.6	0	0	0	0	110
213	E	24.3	Very low	26.8	Very low	166 Å²	166	138.4 Å²	138.4	78%	0.776	77%	0.77	S	S	*	*			trans	-120.9	168.5	-175.4	-59.3	174.9	33.9	0	0	113.9
214	N	26.1	Very low	26.8	Very low	145 Å²	145	138.9 Å²	138.9	78%	0.775	77%	0.773	S	S	*	*			trans	72.9	141	153.2	-59.8	-48.5	0	0	0	119.3
215	G	24.8	Very low	27.1	Very low	65 Å²	65	139.6 Å²	139.6	67%	0.67	78%	0.781	S	S	*	*			trans	176.6	-7.4	173.7	0	0	0	0	0	125.5
216	H	24.9	Very low	27.4	Very low	192 Å²	192	132.5 Å²	132.5	89%	0.889	77%	0.769	S	S	*	*			trans	61	-176.6	169.2	-63.9	-77.3	0	0	0	120.1
217	V	30.2	Very low	27.6	Very low	136 Å²	136	132.1 Å²	132.1	82%	0.824	78%	0.777	S	S	*	*			trans	-137.3	179.6	-164	-112	0	0	0	0	109.2
218	P	51.2	Low	28.1	Very low	103 Å²	103	131.9 Å²	131.9	67%	0.669	78%	0.781	S	S	*	*			cis	-137.2	-171.9	-3.4	27.4	-2	0	0	0	115.9
219	L	27.6	Very low	28.5	Very low	138 Å²	138	130.4 Å²	130.4	72%	0.723	78%	0.779	S	S	*	*			trans	138.1	129.1	131.9	-67.1	177	0	0	0	115.9
220	Y	24.7	Very low	28.8	Very low	211 Å²	211	132.3 Å²	132.3	83%	0.827	78%	0.781	S	S	*	*			trans	17	138	151.7	-58.8	-73.8	0	0	0	121.1
221	S	24.6	Very low	29.1	Very low	98 Å²	98	129.7 Å²	129.7	69%	0.685	78%	0.776	S	S	*	*			cis	-162.6	-163	2.8	-78.3	0	0	0	0	108.3
222	S	24.4	Very low	29.5	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	78%	0.777	S	S	*	*			cis	-157.8	154.5	17	-64.1	0	0	0	0	114.3
223	S	30.1	Very low	29.7	Very low	112 Å²	112	130.2 Å²	130.2	78%	0.783	77%	0.769	S	S	*	*			trans	8.1	113.5	157.5	60.6	0	0	0	0	123.2
224	S	25.4	Very low	30	Very low	120 Å²	120	128 Å²	128	84%	0.839	77%	0.767	S	S	*	*			trans	160.7	142.5	131.4	52.9	0	0	0	0	108.5
225	V	31.9	Very low	30.1	Very low	130 Å²	130	126.4 Å²	126.4	79%	0.788	77%	0.768	S	S	*	*			cis	-133.8	150.1	3.1	177.3	0	0	0	0	107.2
226	P	32.6	Very low	30.3	Very low	113 Å²	113	130.1 Å²	130.1	73%	0.734	78%	0.778	S	S	*	*			trans	-81.8	140.4	-171.4	31.4	-36.4	0	0	0	115.4
227	T	31.2	Very low	30.4	Very low	144 Å²	144	126.3 Å²	126.3	88%	0.883	77%	0.772	S	S	*	*			trans	-108.4	106.8	161.5	30.9	0	0	0	0	111.2
228	T	33.2	Very low	30.4	Very low	122 Å²	122	126.8 Å²	126.8	75%	0.748	78%	0.776	S	S	*	*			trans	-123.3	157.8	161	56.5	0	0	0	0	106.4
229	I	33.6	Very low	29.3	Very low	137 Å²	137	129.5 Å²	129.5	70%	0.703	78%	0.783	S	S	*	*				-149.6	132.5	62.5	-80.8	166.3	0	0	0	110.8
230	N	29.5	Very low	29.3	Very low	149 Å²	149	130.4 Å²	130.4	80%	0.797	79%	0.788	S	S	*	*	S	Bend	trans	-99.3	140.7	145.7	-109.9	-44	0	0	0	107.6
231	T	32	Very low	29.4	Very low	129 Å²	129	125.9 Å²	125.9	79%	0.791	79%	0.787	S	S	*	*			trans	33.7	105	157.6	-49.6	0	0	0	0	118.6
232	I	32.2	Very low	29.3	Very low	141 Å²	141	124.9 Å²	124.9	72%	0.723	79%	0.792	S	S	*	*			trans	-128.9	128	151.6	-63.8	-177.9	0	0	0	110.2
233	G	30	Very low	29.4	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	80%	0.801	S	S	*	*			trans	-137.3	110.9	150.3	0	0	0	0	0	107.6
234	T	29.7	Very low	29.3	Very low	120 Å²	120	128 Å²	128	74%	0.736	80%	0.797	S	S	*	*			trans	-142.2	137.2	-179.4	-40.1	0	0	0	0	111.3
235	S	28.8	Very low	29.4	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	80%	0.795	S	S	*	*			trans	-59.8	150.1	168.4	-42.6	0	0	0	0	112.1
236	T	29.3	Very low	29.2	Very low	144 Å²	144	133.1 Å²	133.1	88%	0.883	80%	0.798	S	S	*	*			trans	-120.1	127.7	165.9	30.3	0	0	0	0	110.9
237	S	25.3	Very low	28.8	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	80%	0.801	S	S	*	*			trans	-161.1	107.6	173.1	59.1	0	0	0	0	110.8
238	T	31	Very low	29.3	Very low	147 Å²	147	131.9 Å²	131.9	90%	0.902	80%	0.795	S	S	*	*			trans	-138.2	162.2	170.5	40.1	0	0	0	0	109.3
239	I	29.1	Very low	29.1	Very low	159 Å²	159	133.7 Å²	133.7	82%	0.815	80%	0.8	S	S	*	*			trans	-131.9	136	-151.3	-53.4	171.4	0	0	0	111
240	L	27	Very low	29	Very low	158 Å²	158	135.3 Å²	135.3	83%	0.827	80%	0.802	S	S	*	*			trans	178.3	144.7	130.8	-98.7	155.3	0	0	0	115.2
241	S	25.7	Very low	29	Very low	116 Å²	116	140.2 Å²	140.2	81%	0.811	81%	0.809	S	S	*	*			trans	62.5	114.6	153.7	-59.7	0	0	0	0	121.6
242	G	24.2	Very low	28.8	Very low	77 Å²	77	138.5 Å²	138.5	79%	0.794	80%	0.802	S	S	*	*			trans	-179.9	133.7	163.8	0	0	0	0	0	111.7
243	Q	25.9	Very low	28.6	Very low	202 Å²	202	139 Å²	139	94%	0.944	81%	0.812	S	S	*	*			trans	-88	173.5	-172.7	-73.6	170.7	-82.1	0	0	114.5
244	A	27.4	Very low	28.7	Very low	84 Å²	84	139.9 Å²	139.9	69%	0.694	81%	0.806	S	S	*	*			trans	99.7	127.4	153.3	0	0	0	0	0	119.8
245	H	27.7	Very low	28.7	Very low	173 Å²	173	142.6 Å²	142.6	80%	0.801	82%	0.815	S	S	*	*			trans	-2.5	146.5	157	-41.5	-83.3	0	0	0	118.4
246	H	27.4	Very low	28.9	Very low	183 Å²	183	142.9 Å²	142.9	85%	0.847	81%	0.812	S	S	*	*			cis	-165.1	162	42.9	37.8	-85.3	0	0	0	114.4
247	S	25.2	Very low	29.3	Very low	114 Å²	114	141.9 Å²	141.9	80%	0.797	81%	0.808	S	S	*	*			trans	-90.2	166.7	168.7	-81.2	0	0	0	0	110.6
248	P	41.6	Very low	29.7	Very low	117 Å²	117	141.9 Å²	141.9	76%	0.76	81%	0.805	S	S	*	*			cis	-136.5	-159.6	35	41.1	-18.7	0	0	0	113.2
249	L	28.9	Very low	29.5	Very low	160 Å²	160	142.8 Å²	142.8	84%	0.838	80%	0.802	S	S	*	*			cis	-150.1	-176.7	10.4	-167.7	46.5	0	0	0	111.6
250	K	31.9	Very low	29.4	Very low	172 Å²	172	142.1 Å²	142.1	75%	0.748	80%	0.799	S	S	*	*			trans	-104.2	153.9	-173.7	-53.1	171.2	-178.6	175.7	0	113.8
251	R	27.6	Very low	29.7	Very low	251 Å²	251	140.9 Å²	140.9	95%	0.947	80%	0.798	S	S	*	*				-140.3	148.5	121	-77.9	-160.9	178.5	78.3	1.6	109.7
252	S	29.8	Very low	30.2	Very low	94 Å²	94	140.8 Å²	140.8	66%	0.657	80%	0.795	S	S	*	*			trans	-156.7	135.6	-170.5	53	0	0	0	0	110.6
253	V	27	Very low	30.3	Very low	151 Å²	151	144.3 Å²	144.3	92%	0.915	80%	0.795	S	S	*	*			trans	-134.1	119.5	156.2	-177.6	0	0	0	0	107
254	S	31.3	Very low	30.4	Very low	94 Å²	94	142.8 Å²	142.8	66%	0.657	79%	0.789	S	S	*	*			trans	-139.9	150.9	171.8	54.1	0	0	0	0	108.4
255	L	30.3	Very low	30.6	Very low	177 Å²	177	143.1 Å²	143.1	93%	0.927	78%	0.783	S	S	*	*			trans	-118.1	124	163.7	-70.2	175	0	0	0	107.9
256	T	33.6	Very low	30.6	Very low	116 Å²	116	142 Å²	142	71%	0.712	78%	0.782	S	S	*	*			trans	-85.8	172.2	-174.6	29.2	0	0	0	0	111.1
257	P	37.5	Very low	30.6	Very low	123 Å²	123	136 Å²	136	80%	0.799	77%	0.77	S	S	*	*			cis	-135.1	167	22.4	40.3	-22.1	0	0	0	118.4
258	P	34.2	Very low	30.9	Very low	111 Å²	111	138.4 Å²	138.4	72%	0.721	77%	0.769	S	S	*	*			trans	-96.9	169.4	171.9	39.6	-35	0	0	0	113.1
259	M	25.6	Very low	30.2	Very low	167 Å²	167	134.5 Å²	134.5	82%	0.823	75%	0.749	S	S	*	*			trans	-142.8	148.5	156.5	-100.1	-61.7	-83.1	0	0	112.2
260	N	28.3	Very low	30.4	Very low	144 Å²	144	138.3 Å²	138.3	77%	0.77	75%	0.753	S	S	*	*			trans	-17.8	147.1	-174	-78.4	-5.7	0	0	0	122.4
261	V	33	Very low	30.3	Very low	133 Å²	133	138 Å²	138	81%	0.806	76%	0.756	S	S	*	*			trans	-122.8	149.2	162.7	-175.5	0	0	0	0	108.5
262	P	35.6	Very low	30.2	Very low	114 Å²	114	131.1 Å²	131.1	74%	0.74	75%	0.747	S	S	*	*			trans	-138.2	142.5	130.8	32.9	-18.9	0	0	0	114.6
263	N	26.1	Very low	30.2	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	75%	0.752	S	S	*	*			trans	16.5	140.8	145.2	-68.3	-11.6	0	0	0	119.9
264	Q	27.5	Very low	30.3	Very low	171 Å²	171	136 Å²	136	80%	0.799	75%	0.749	S	S	*	*			cis	-150.5	-140.8	18.9	-153.9	-167.4	74.8	0	0	112.8
265	P	32.5	Very low	30.1	Very low	90 Å²	90	137.8 Å²	137.8	58%	0.584	75%	0.751	S	S	*	*			trans	-111.1	-164.5	-133.8	40.9	-22.5	0	0	0	115.7
266	L	27.1	Very low	30.1	Very low	149 Å²	149	136.8 Å²	136.8	78%	0.78	75%	0.746	S	S	*	*			trans	104.8	89	161.6	-64.9	147.1	0	0	0	119.1
267	G	28.9	Very low	29.8	Very low	58 Å²	58	143.1 Å²	143.1	60%	0.598	76%	0.756	S	S	*	*			trans	40	111.3	131.6	0	0	0	0	0	120.1	G269 R571	G267-G269 PolarHBondContact O-N 2.88Å; G267-R571 PolarHBondContact O-NE 3.23Å; G267-R571 VanDerWaalsContact O-NE 3.17Å; G267-R571 PolarHBondContact O-NH2 3.48Å
268	H	29.7	Very low	29.5	Very low	165 Å²	165	141.5 Å²	141.5	76%	0.764	75%	0.753	S	S	*	*			trans	-95.3	83.3	178	-66.7	-89.4	0	0	0	113.6
269	G	28.1	Very low	29.3	Very low	34 Å²	34	148.3 Å²	148.3	35%	0.351	77%	0.765	S	S	.	*			trans	-73.5	135.8	149.6	0	0	0	0	0	109.7	G267 R571	G267-G269 PolarHBondContact O-N 2.88Å; G269-R571 PolarHBondContact O-NH1 2.63Å
270	W	32.5	Very low	29.6	Very low	240 Å²	240	142.9 Å²	142.9	91%	0.909	75%	0.752	S	S	*	*			trans	-81	124.7	-176.9	-68.8	83	0	0	0	111.6
271	M	29.9	Very low	29.9	Very low	165 Å²	165	142.2 Å²	142.2	81%	0.813	76%	0.755	S	S	*	*			trans	-150.7	135.8	172.8	-87.3	-71.6	102.2	0	0	109.9
272	S	26.7	Very low	29.6	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	76%	0.758	S	S	*	*			trans	53.5	123.4	165.8	-151.8	0	0	0	0	119.7
273	H	27.9	Very low	29.3	Very low	164 Å²	164	144.8 Å²	144.8	76%	0.759	76%	0.76	S	S	*	*			trans	-143	63.9	151.7	-167.2	-61.3	0	0	0	110	D275	H273-D275 PolarHBondContact CE1-O 3.23Å
274	E	29.7	Very low	29.5	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	76%	0.764	S	S	*	*			trans	-109.7	77.4	156.1	-75.7	-173.8	117.2	0	0	108.7
275	D	28.1	Very low	30.1	Very low	131 Å²	131	142.5 Å²	142.5	70%	0.701	76%	0.758	S	S	*	*			trans	-156	164.4	150.9	-138.4	-37.8	0	0	0	110.5	H273	H273-D275 PolarHBondContact CE1-O 3.23Å
276	L	29.1	Very low	30	Very low	155 Å²	155	143 Å²	143	81%	0.812	76%	0.764	S	S	*	*			trans	54.8	89.7	176	-55.4	-176.8	0	0	0	116.9
277	R	28.6	Very low	30	Very low	249 Å²	249	143 Å²	143	94%	0.94	76%	0.764	S	S	*	*			trans	-108.6	122.8	139.9	-148.3	-174.8	-156.3	-163.6	7.9	110
278	A	30.8	Very low	30	Very low	89 Å²	89	148.3 Å²	148.3	74%	0.736	77%	0.773	S	S	*	*			trans	36.5	93.5	157.7	0	0	0	0	0	117.9	G280	A278-G280 PolarHBondContact O-N 3.4Å; A278-G280 VanDerWaalsContact O-N 3.16Å
279	R	29.5	Very low	30.4	Very low	254 Å²	254	144.9 Å²	144.9	96%	0.958	77%	0.773	S	S	*	*			trans	-53.6	114.2	146.6	-176.2	-178.4	-168.1	163.8	2.7	108
280	G	32.1	Very low	31.6	Very low	53 Å²	53	148.7 Å²	148.7	55%	0.546	79%	0.792	S	S	.	*			trans	-70.7	159.8	-175.7	0	0	0	0	0	113.7	A278	A278-G280 PolarHBondContact O-N 3.4Å; A278-G280 VanDerWaalsContact O-N 3.16Å
281	P	34.4	Very low	31.6	Very low	130 Å²	130	145 Å²	145	84%	0.844	79%	0.789	S	S	*	*			trans	-67.1	139.1	171.1	-15.3	30.2	0	0	0	111.4
282	Q	27.6	Very low	31.9	Very low	187 Å²	187	142.6 Å²	142.6	87%	0.874	79%	0.788	S	S	*	*			trans	-108.8	143.4	163.4	-75.7	-74.9	-22.3	0	0	108
283	C	28.6	Very low	33	Very low	114 Å²	114	142.3 Å²	142.3	77%	0.77	78%	0.784	S	S	*	*			trans	-98.6	166.6	175.3	-63.7	0	0	0	0	111.2
284	L	31.2	Very low	33.2	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	79%	0.79	S	S	*	*			trans	149.9	161.8	157.3	-85.3	168.6	0	0	0	109
285	P	40.2	Very low	33.4	Very low	105 Å²	105	139.4 Å²	139.4	68%	0.682	78%	0.782	S	S	*	*			cis	-126.8	177.8	5.2	42.5	-28.6	0	0	0	115.5
286	S	28.6	Very low	33.9	Very low	100 Å²	100	138.1 Å²	138.1	70%	0.699	78%	0.783	S	S	*	*			trans	60.7	150.8	158.4	-63.8	0	0	0	0	118.8
287	D	27	Very low	34.2	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	78%	0.784	S	S	*	*			cis	-145	-176.2	23.8	-131.8	-44.4	0	0	0	114.6
288	H	30.9	Very low	34.4	Very low	171 Å²	171	130 Å²	130	79%	0.792	78%	0.777	S	S	*	*			trans	-100.6	140.9	-165.8	-75.5	-97.1	0	0	0	118.2
289	A	36.3	Very low	34.6	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	78%	0.78	S	S	*	*			trans	71.9	167.3	139.4	0	0	0	0	0	120.4
290	P	54.4	Low	34.9	Very low	115 Å²	115	124.4 Å²	124.4	75%	0.747	77%	0.771	S	S	*	*			cis	-113.9	-172.7	-14.7	30.2	-8.7	0	0	0	111.1
291	L	33.2	Very low	34.8	Very low	163 Å²	163	125.8 Å²	125.8	85%	0.853	79%	0.786	S	S	*	*			cis	-146.8	168	26.8	-75.4	161	0	0	0	112
292	S	34.3	Very low	34.8	Very low	113 Å²	113	125.4 Å²	125.4	79%	0.79	79%	0.786	S	S	*	*			trans	-104	-167.1	174.2	-47.1	0	0	0	0	110.1
293	P	49.7	Very low	35	Very low	103 Å²	103	119.6 Å²	119.6	67%	0.669	78%	0.776	S	S	*	*			cis	-144.9	-176.2	1	41.3	-19.7	0	0	0	117.8
294	Q	33.3	Very low	35.5	Very low	187 Å²	187	118 Å²	118	87%	0.874	78%	0.78	S	S	*	*			trans	72.4	149.7	162.8	-52.4	-175	-83.1	0	0	117.2
295	S	33.7	Very low	35.6	Very low	99 Å²	99	115.2 Å²	115.2	69%	0.692	77%	0.774	S	S	*	*			cis	-147.7	134.2	1.2	56.1	0	0	0	0	114.7
296	S	39.2	Very low	35.8	Very low	105 Å²	105	119 Å²	119	73%	0.734	78%	0.782	S	S	*	*				40.8	129.9	126.7	-48.9	0	0	0	0	124.6
297	V	35.5	Very low	35.9	Very low	138 Å²	138	121.6 Å²	121.6	84%	0.836	78%	0.783	S	S	*	*			trans	76.6	111.7	135.8	-60.7	0	0	0	0	125
298	A	31.7	Very low	36.7	Very low	94 Å²	94	122 Å²	122	78%	0.777	78%	0.784	S	S	*	*				75	150.9	118.4	0	0	0	0	0	123.7
299	S	34.6	Very low	37	Very low	116 Å²	116	121.4 Å²	121.4	81%	0.811	78%	0.782	S	S	*	*			trans	65.5	158.7	169.4	-87.2	0	0	0	0	117.4
300	S	35.5	Very low	37.2	Very low	110 Å²	110	123.1 Å²	123.1	77%	0.769	78%	0.778	S	S	*	*			cis	-159.7	165.5	-26.2	-102.2	0	0	0	0	108.4
301	G	30.5	Very low	36.3	Very low	82 Å²	82	125.8 Å²	125.8	85%	0.845	78%	0.781	S	S	*	*			trans	-77.7	151	-169.7	0	0	0	0	0	116.5
302	S	34	Very low	36.6	Very low	123 Å²	123	123 Å²	123	86%	0.86	77%	0.771	S	S	*	*			trans	-141	144.4	153.6	-152.5	0	0	0	0	105.3
303	G	33.1	Very low	37.4	Very low	64 Å²	64	123.8 Å²	123.8	66%	0.66	77%	0.771	S	S	*	*				88.1	101.5	55.7	0	0	0	0	0	106.7
304	G	38.8	Very low	38	Very low	82 Å²	82	122.5 Å²	122.5	85%	0.845	77%	0.769	S	S	*	*			trans	-75.6	145.5	-159.2	0	0	0	0	0	114.7
305	S	33.8	Very low	40	Very low	109 Å²	109	122.1 Å²	122.1	76%	0.762	76%	0.76	S	S	*	*			trans	-133.7	142.8	161	-58.9	0	0	0	0	108.6	H307	S305-H307 PolarHBondContact O-N 3.2Å
306	E	43.1	Very low	42.6	Very low	184 Å²	184	120.2 Å²	120.2	86%	0.86	74%	0.742	S	S	*	*			trans	-55	129.3	173.2	47.8	-97.1	59.1	0	0	113.2
307	H	32.1	Very low	45	Very low	155 Å²	155	115.8 Å²	115.8	72%	0.718	71%	0.71	S	S	*	*			trans	-133.3	134.7	157.4	-168.5	-106.1	0	0	0	110.9	S305 E309	S305-H307 PolarHBondContact O-N 3.2Å; H307-E309 WeakPolarHBondContact ND1-CG 3.28Å; H307-E309 PolarHBondContact O-N 3.11Å
308	L	43.1	Very low	47.7	Very low	156 Å²	156	110.6 Å²	110.6	82%	0.817	68%	0.677	S	S	*	*			trans	-95.3	78.9	-169.6	-172.3	81.8	0	0	0	110.4	D310	L308-D310 PolarHBondContact O-N 2.96Å
309	E	37.3	Very low	50.3	Low	160 Å²	160	113.6 Å²	113.6	75%	0.748	67%	0.674	S	S	*	*			trans	-87.7	89	169.5	-62.5	-148	142.3	0	0	110.4	H307 Q311	H307-E309 WeakPolarHBondContact ND1-CG 3.28Å; H307-E309 PolarHBondContact O-N 3.11Å; E309-Q311 PolarHBondContact O-N 3.5Å
310	D	39.6	Very low	52.8	Low	127 Å²	127	111.6 Å²	111.6	68%	0.679	65%	0.652	S	S	*	*			trans	-71.6	64.5	179.3	-171.5	27.9	0	0	0	112.3	L308 T312	L308-D310 PolarHBondContact O-N 2.96Å; D310-T312 PolarHBondContact O-N 3.15Å; D310-T312 VanDerWaalsContact OD1-CG2 3.25Å; D310-T312 WeakPolarHBondContact OD1-CG2 3.34Å
311	Q	35.3	Very low	54.9	Low	171 Å²	171	114.1 Å²	114.1	80%	0.799	65%	0.652	S	S	*	*			trans	-79.7	76.1	173.1	-165.4	135.2	121.6	0	0	109.8	E309 T313	E309-Q311 PolarHBondContact O-N 3.5Å; Q311-T313 VanDerWaalsContact C-N 3.28Å; Q311-T313 PolarHBondContact O-N 3.48Å; Q311-T313 PolarHBondContact O-OG1 3.15Å
312	T	41.1	Very low	57.3	Low	106 Å²	106	112.4 Å²	112.4	65%	0.65	63%	0.634	S	S	*	*			trans	-57.3	84.3	177.6	48.2	0	0	0	0	112.1	D310 A314	D310-T312 PolarHBondContact O-N 3.15Å; D310-T312 VanDerWaalsContact OD1-CG2 3.25Å; D310-T312 WeakPolarHBondContact OD1-CG2 3.34Å; T312-A314 PolarHBondContact O-N 3.46Å
313	T	50.9	Low	59.8	Low	129 Å²	129	107.2 Å²	107.2	79%	0.791	60%	0.598	S	S	*	*			trans	-68.6	89.1	168.1	-56.3	0	0	0	0	106.9	Q311 R315	Q311-T313 VanDerWaalsContact C-N 3.28Å; Q311-T313 PolarHBondContact O-N 3.48Å; Q311-T313 PolarHBondContact O-OG1 3.15Å; T313-R315 PolarHBondContact O-N 3.3Å
314	A	62.2	Low	62.5	Low	75 Å²	75	104.6 Å²	104.6	62%	0.62	57%	0.571	S	S	*	*			trans	-47	113.1	-165.1	0	0	0	0	0	111.7	T312 N316	T312-A314 PolarHBondContact O-N 3.46Å; A314-N316 PolarHBondContact O-N 3.03Å
315	R	75.3	Confident	65.1	Low	179 Å²	179	100.7 Å²	100.7	68%	0.675	53%	0.531	S	S	*	.			trans	-55.1	115.1	-169.3	-171.5	-172.9	-171.4	122.1	-7.3	109.5	T313 E320	T313-R315 PolarHBondContact O-N 3.3Å; R315-E320 IonicContact CZ-OE1 2.78Å; R315-E320 IonicContact CZ-OE2 3.94Å; R315-E320 VanDerWaalsContact CZ-OE2 3.31Å; R315-E320 IonicContact NE-OE1 3.74Å; R315-E320 IonicContact NE-OE2 3.31Å; R315-E320 PolarHBondContact NE-OE2 3.21Å; R315-E320 IonicContact NH2-OE1 3.49Å; R315-E320 PolarHBondContact NH2-OE1 3.12Å; R315-E320 IonicContact NH2-OE2 2.79Å; R315-E320 PolarHBondContact NH2-OE2 2.79Å
316	N	88.3	Confident	67.9	Low	60 Å²	60	99.3 Å²	99.3	32%	0.321	51%	0.511	S	S	.	.			trans	-101.7	97.1	-175.2	-167.1	-38.5	0	0	0	110	A314 F318 Q319 S345	A314-N316 PolarHBondContact O-N 3.03Å; N316-F318 PolarHBondContact O-N 3.46Å; N316-F318 VanDerWaalsContact OD1-CB 3.32Å; N316-F318 WeakPolarHBondContact OD1-CB 3.48Å; N316-F318 WeakPolarHBondContact OD1-CD2 3.29Å; N316-F318 WeakPolarHBondContact OD1-CG 3.35Å; N316-F318 PolarHBondContact OD1-N 3.26Å; N316-Q319 PolarHBondContact O-N 3.23Å; N316-S345 WeakPolarHBondContact CA-O 3.31Å; N316-S345 WeakPolarHBondContact OD1-CB 3.35Å
317	T	89.8	Confident	70.3	Confident	11 Å²	11	93.4 Å²	93.4	7%	0.067	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-59.8	-20.4	-174.4	-29.1	0	0	0	0	113.1	Q319 E320 S323 M325 S345 M347	T317-Q319 PolarHBondContact O-N 3.28Å; T317-E320 PolarHBondContact O-N 3.29Å; T317-S323 PolarHBondContact O-OG 3.42Å; T317-S323 VanDerWaalsContact O-OG 3.13Å; T317-M325 HydrophobicContact CG2-CB 3.96Å; T317-M325 HydrophobicContact CG2-CG 3.67Å; T317-S345 PolarHBondContact N-O 3.25Å; T317-S345 PolarHBondContact OG1-O 2.89Å; T317-M347 VanDerWaalsContact CB-O 3.29Å; T317-M347 WeakPolarHBondContact CB-O 3.34Å; T317-M347 WeakPolarHBondContact CG2-O 3.31Å; T317-M347 PolarHBondContact OG1-O 3.38Å
318	F	92.1	Very high	73.4	Confident	30 Å²	30	86 Å²	86	13%	0.132	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-65.2	-20.8	175	-54.8	-31.6	0	0	0	113.7	N316 M325 V328 P329 A341 F344 S345	N316-F318 PolarHBondContact O-N 3.46Å; N316-F318 VanDerWaalsContact OD1-CB 3.32Å; N316-F318 WeakPolarHBondContact OD1-CB 3.48Å; N316-F318 WeakPolarHBondContact OD1-CD2 3.29Å; N316-F318 WeakPolarHBondContact OD1-CG 3.35Å; N316-F318 PolarHBondContact OD1-N 3.26Å; F318-M325 HydrophobicContact CD1-CB 4.15Å; F318-M325 VanDerWaalsContact CD1-O 3.29Å; F318-M325 WeakPolarHBondContact CD1-O 3.48Å; F318-M325 HydrophobicContact CE1-CE 4.36Å; F318-V328 HydrophobicContact CD1-CB 4.35Å; F318-V328 HydrophobicContact CE1-CB 3.81Å; F318-V328 HydrophobicContact CE1-CG1 3.92Å; F318-V328 HydrophobicContact CZ-CG1 4.4Å; F318-P329 HydrophobicContact CB-CG 4.26Å; F318-P329 HydrophobicContact CD1-CG 3.89Å; F318-P329 HydrophobicContact CD2-CG 3.51Å; F318-P329 HydrophobicContact CE1-CG 4.01Å; F318-P329 HydrophobicContact CE2-CG 3.62Å; F318-P329 HydrophobicContact CG-CG 3.64Å; F318-P329 HydrophobicContact CZ-CG 3.86Å; F318-A341 HydrophobicContact CE2-CB 4.48Å; F318-A341 WeakPolarHBondContact CE2-O 3.36Å; F318-A341 VanDerWaalsContact CZ-O 3.23Å; F318-A341 WeakPolarHBondContact CZ-O 3.45Å; F318-F344 HydrophobicContact CE1-CB 3.95Å; F318-F344 WeakPolarHBondContact CE1-O 3.37Å; F318-F344 VanDerWaalsContact CZ-C 3.48Å; F318-F344 HydrophobicContact CZ-CB 3.78Å; F318-S345 VanDerWaalsContact CE2-CB 3.47Å; F318-S345 VanDerWaalsContact CZ-N 3.28Å
319	Q	86.6	Confident	75.9	Confident	157 Å²	157	80.2 Å²	80.2	73%	0.734	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-99.3	-10	178.8	-58.7	-174	13.1	0	0	112.8	N316 T317 E321	N316-Q319 PolarHBondContact O-N 3.23Å; T317-Q319 PolarHBondContact O-N 3.28Å; Q319-E321 PolarHBondContact O-N 3.31Å
320	E	86.5	Confident	78.7	Confident	73 Å²	73	75.6 Å²	75.6	34%	0.341	41%	0.412	S	S	.	.	S	Bend	trans	-78.8	116.3	-178.3	-173.5	164.9	170.1	0	0	110.5	R315 T317 S323	R315-E320 IonicContact CZ-OE1 2.78Å; R315-E320 IonicContact CZ-OE2 3.94Å; R315-E320 VanDerWaalsContact CZ-OE2 3.31Å; R315-E320 IonicContact NE-OE1 3.74Å; R315-E320 IonicContact NE-OE2 3.31Å; R315-E320 PolarHBondContact NE-OE2 3.21Å; R315-E320 IonicContact NH2-OE1 3.49Å; R315-E320 PolarHBondContact NH2-OE1 3.12Å; R315-E320 IonicContact NH2-OE2 2.79Å; R315-E320 PolarHBondContact NH2-OE2 2.79Å; T317-E320 PolarHBondContact O-N 3.29Å; E320-S323 WeakPolarHBondContact O-CB 3.33Å; E320-S323 PolarHBondContact O-N 3.03Å; E320-S323 PolarHBondContact O-OG 2.89Å
321	E	80.3	Confident	81.4	Confident	163 Å²	163	70.2 Å²	70.2	76%	0.762	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	142.4	-179.5	-63.7	-166.8	155	0	0	111.6	Q319 S323	Q319-E321 PolarHBondContact O-N 3.31Å; E321-S323 PolarHBondContact O-N 2.85Å
322	G	79.5	Confident	84.4	Confident	46 Å²	46	62.1 Å²	62.1	47%	0.474	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	-10.3	-177.8	0	0	0	0	0	115.9	G324	G322-G324 PolarHBondContact O-N 2.76Å; G322-G324 VanDerWaalsContact O-N 3.12Å
323	S	86.6	Confident	87.1	Confident	14 Å²	14	63 Å²	63	10%	0.098	34%	0.339	C	S	.	.	S	Bend	trans	-57.1	-28.2	-177.5	63.3	0	0	0	0	115.2	T317 E320 E321 M325 Y349	T317-S323 PolarHBondContact O-OG 3.42Å; T317-S323 VanDerWaalsContact O-OG 3.13Å; E320-S323 WeakPolarHBondContact O-CB 3.33Å; E320-S323 PolarHBondContact O-N 3.03Å; E320-S323 PolarHBondContact O-OG 2.89Å; E321-S323 PolarHBondContact O-N 2.85Å; S323-M325 VanDerWaalsContact C-N 3.26Å; S323-M325 PolarHBondContact OG-N 3.4Å; S323-M325 VanDerWaalsContact OG-N 3.11Å; S323-Y349 VanDerWaalsContact O-CB 3.29Å; S323-Y349 WeakPolarHBondContact O-CB 3.26Å
324	G	89.6	Confident	89.3	Confident	9 Å²	9	61 Å²	61	9%	0.093	33%	0.331	C	S	.	.	S	Bend	trans	79.6	0.1	-169	0	0	0	0	0	114.5	G322	G322-G324 PolarHBondContact O-N 2.76Å; G322-G324 VanDerWaalsContact O-N 3.12Å
325	M	94.3	Very high	90.9	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.31	C	S	.	.			trans	-94.9	-14	-176.4	-66	-61.3	-76.1	0	0	113.9	T317 F318 S323 D327 V328 F344 M347 Y349 M352	T317-M325 HydrophobicContact CG2-CB 3.96Å; T317-M325 HydrophobicContact CG2-CG 3.67Å; F318-M325 HydrophobicContact CD1-CB 4.15Å; F318-M325 VanDerWaalsContact CD1-O 3.29Å; F318-M325 WeakPolarHBondContact CD1-O 3.48Å; F318-M325 HydrophobicContact CE1-CE 4.36Å; S323-M325 VanDerWaalsContact C-N 3.26Å; S323-M325 PolarHBondContact OG-N 3.4Å; S323-M325 VanDerWaalsContact OG-N 3.11Å; M325-D327 VanDerWaalsContact C-N 3.28Å; M325-D327 PolarHBondContact O-N 3Å; M325-V328 HydrophobicContact CB-CG2 4.46Å; M325-V328 HydrophobicContact CE-CG2 4.01Å; M325-V328 VanDerWaalsContact O-CB 3.25Å; M325-V328 WeakPolarHBondContact O-CB 3.32Å; M325-V328 VanDerWaalsContact O-CG2 3.32Å; M325-V328 WeakPolarHBondContact O-CG2 3.33Å; M325-V328 PolarHBondContact O-N 2.7Å; M325-V328 HydrophobicContact SD-CG2 3.86Å; M325-F344 HydrophobicContact CE-CB 4.39Å; M325-F344 WeakPolarHBondContact CE-O 3.32Å; M325-M347 HydrophobicContact CE-CG 3.73Å; M325-M347 HydrophobicContact CE-SD 4.48Å; M325-Y349 VanDerWaalsContact SD-CA 3.51Å; M325-Y349 HydrophobicContact SD-CD2 4.42Å; M325-M352 HydrophobicContact CE-CB 4.27Å; M325-M352 HydrophobicContact CE-CE 4.39Å; M325-M352 HydrophobicContact CE-SD 3.94Å; M325-M352 HydrophobicContact SD-CB 4.24Å; M325-M352 HydrophobicContact SD-CE 3.58Å; M325-M352 VanDerWaalsContact SD-CE 3.58Å; M325-M352 HydrophobicContact SD-SD 3.95Å
326	K	91.9	Very high	91.9	Very high	81 Å²	81	61 Å²	61	35%	0.352	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.8	-175.6	-162.9	173	-159.2	166.3	0	114.7	P329 E532	K326-P329 WeakPolarHBondContact O-CD 3.4Å; K326-E532 WeakPolarHBondContact CD-OE2 3.5Å; K326-E532 IonicContact NZ-OE1 3.85Å; K326-E532 PolarHBondContact NZ-OE1 3.12Å; K326-E532 IonicContact NZ-OE2 3.07Å; K326-E532 PolarHBondContact NZ-OE2 3.22Å
327	D	93.8	Very high	92.4	Very high	60 Å²	60	58.5 Å²	58.5	32%	0.321	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-10.8	-178.6	-57	-75.6	0	0	0	114.1	M325 P329 A330 W331	M325-D327 VanDerWaalsContact C-N 3.28Å; M325-D327 PolarHBondContact O-N 3Å; D327-P329 VanDerWaalsContact C-CD 3.49Å; D327-A330 PolarHBondContact O-N 2.65Å; D327-W331 PolarHBondContact O-N 2.94Å
328	V	96.8	Very high	92.7	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.3	-41.2	-178.3	177.3	0	0	0	0	112.8	F318 M325 A330 W331 L332 F344 M352 P414	F318-V328 HydrophobicContact CD1-CB 4.35Å; F318-V328 HydrophobicContact CE1-CB 3.81Å; F318-V328 HydrophobicContact CE1-CG1 3.92Å; F318-V328 HydrophobicContact CZ-CG1 4.4Å; M325-V328 HydrophobicContact CB-CG2 4.46Å; M325-V328 HydrophobicContact CE-CG2 4.01Å; M325-V328 VanDerWaalsContact O-CB 3.25Å; M325-V328 WeakPolarHBondContact O-CB 3.32Å; M325-V328 VanDerWaalsContact O-CG2 3.32Å; M325-V328 WeakPolarHBondContact O-CG2 3.33Å; M325-V328 PolarHBondContact O-N 2.7Å; M325-V328 HydrophobicContact SD-CG2 3.86Å; V328-A330 VanDerWaalsContact C-N 3.32Å; V328-A330 PolarHBondContact O-N 2.88Å; V328-W331 HydrophobicContact CG1-CE3 4.39Å; V328-W331 PolarHBondContact O-N 3.31Å; V328-L332 HydrophobicContact CG1-CD1 3.7Å; V328-L332 HydrophobicContact CG1-CG 4Å; V328-L332 WeakPolarHBondContact O-CB 3.31Å; V328-L332 VanDerWaalsContact O-CG 3.26Å; V328-L332 WeakPolarHBondContact O-CG 3.45Å; V328-L332 PolarHBondContact O-N 3.22Å; V328-F344 HydrophobicContact CG1-CB 3.83Å; V328-F344 HydrophobicContact CG1-CD1 4.06Å; V328-F344 HydrophobicContact CG1-CG 4.06Å; V328-M352 HydrophobicContact CG1-SD 4.1Å; V328-M352 HydrophobicContact CG2-CE 3.69Å; V328-M352 HydrophobicContact CG2-SD 3.64Å; V328-P414 HydrophobicContact CB-CG 4.34Å; V328-P414 HydrophobicContact CG2-CB 3.77Å; V328-P414 HydrophobicContact CG2-CG 3.56Å
329	P	96.1	Very high	92.9	Very high	34 Å²	34	69.8 Å²	69.8	22%	0.221	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-36.6	174.9	-25	36.1	0	0	0	113.9	F318 K326 D327 K333	F318-P329 HydrophobicContact CB-CG 4.26Å; F318-P329 HydrophobicContact CD1-CG 3.89Å; F318-P329 HydrophobicContact CD2-CG 3.51Å; F318-P329 HydrophobicContact CE1-CG 4.01Å; F318-P329 HydrophobicContact CE2-CG 3.62Å; F318-P329 HydrophobicContact CG-CG 3.64Å; F318-P329 HydrophobicContact CZ-CG 3.86Å; K326-P329 WeakPolarHBondContact O-CD 3.4Å; D327-P329 VanDerWaalsContact C-CD 3.49Å; P329-K333 VanDerWaalsContact O-CG 3.29Å; P329-K333 WeakPolarHBondContact O-CG 3.43Å; P329-K333 PolarHBondContact O-N 2.85Å; P329-K333 VanDerWaalsContact O-N 3.11Å
330	A	95.8	Very high	93.4	Very high	63 Å²	63	64 Å²	64	52%	0.521	33%	0.325	S	S	.	.	H	α-helix	trans	-74.6	-40.8	178.5	0	0	0	0	0	111.4	D327 V328 K333 S334	D327-A330 PolarHBondContact O-N 2.65Å; V328-A330 VanDerWaalsContact C-N 3.32Å; V328-A330 PolarHBondContact O-N 2.88Å; A330-K333 WeakPolarHBondContact O-CB 3.29Å; A330-K333 PolarHBondContact O-N 3.15Å; A330-S334 PolarHBondContact O-N 2.99Å
331	W	97.2	Very high	93.9	Very high	13 Å²	13	61.5 Å²	61.5	5%	0.049	32%	0.317	C	S	.	.	H	α-helix	trans	-63.2	-44.7	173.9	179	72.1	0	0	0	112.3	D327 V328 K333 S334 L335 M352 I377 L380 P414	D327-W331 PolarHBondContact O-N 2.94Å; V328-W331 HydrophobicContact CG1-CE3 4.39Å; V328-W331 PolarHBondContact O-N 3.31Å; W331-K333 VanDerWaalsContact C-N 3.28Å; W331-K333 PolarHBondContact O-N 3.47Å; W331-S334 PolarHBondContact O-N 2.9Å; W331-S334 PolarHBondContact O-OG 3.32Å; W331-L335 HydrophobicContact CD2-CD1 3.81Å; W331-L335 VanDerWaalsContact CE2-CD1 3.49Å; W331-L335 HydrophobicContact CE3-CD1 4.22Å; W331-L335 HydrophobicContact CG-CD1 4.36Å; W331-L335 HydrophobicContact CH2-CD1 4.1Å; W331-L335 HydrophobicContact CZ2-CD1 3.66Å; W331-L335 HydrophobicContact CZ3-CD1 4.36Å; W331-L335 WeakPolarHBondContact O-CG 3.25Å; W331-L335 PolarHBondContact O-N 3.14Å; W331-M352 HydrophobicContact CZ3-SD 4.4Å; W331-I377 HydrophobicContact CH2-CG1 4.13Å; W331-L380 HydrophobicContact CH2-CD1 3.62Å; W331-L380 HydrophobicContact CH2-CG 4.29Å; W331-L380 HydrophobicContact CZ2-CD1 3.47Å; W331-L380 VanDerWaalsContact CZ2-CD1 3.47Å; W331-L380 HydrophobicContact CZ2-CD2 4.02Å; W331-L380 HydrophobicContact CZ2-CG 3.75Å; W331-L380 HydrophobicContact CZ3-CD1 4.3Å; W331-P414 HydrophobicContact CB-CG 4.01Å; W331-P414 HydrophobicContact CD2-CG 3.96Å; W331-P414 HydrophobicContact CE3-CG 4.02Å; W331-P414 HydrophobicContact CG-CG 4Å
332	L	97.8	Very high	94.5	Very high	1 Å²	1	57 Å²	57	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-30.3	173.6	-68.3	174	0	0	0	112.3	V328 R336 L337 H338 A341 F344	V328-L332 HydrophobicContact CG1-CD1 3.7Å; V328-L332 HydrophobicContact CG1-CG 4Å; V328-L332 WeakPolarHBondContact O-CB 3.31Å; V328-L332 VanDerWaalsContact O-CG 3.26Å; V328-L332 WeakPolarHBondContact O-CG 3.45Å; V328-L332 PolarHBondContact O-N 3.22Å; L332-R336 PolarHBondContact O-N 3.09Å; L332-L337 HydrophobicContact CD2-CB 3.84Å; L332-L337 CarbonylContact O-C 3.6Å; L332-L337 PolarHBondContact O-N 2.83Å; L332-H338 HydrophobicContact CB-CB 4.38Å; L332-H338 PolarHBondContact O-N 3.03Å; L332-A341 HydrophobicContact CD1-CB 4.16Å; L332-F344 HydrophobicContact CD1-CB 4.21Å; L332-F344 HydrophobicContact CD1-CD2 3.55Å; L332-F344 HydrophobicContact CD1-CE2 4.03Å; L332-F344 HydrophobicContact CD1-CG 3.9Å; L332-F344 HydrophobicContact CD2-CD2 4.43Å; L332-F344 HydrophobicContact CD2-CE2 4.08Å; L332-F344 HydrophobicContact CD2-CZ 4.31Å
333	K	97.5	Very high	95.2	Very high	124 Å²	124	56.6 Å²	56.6	54%	0.539	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-48.7	170.4	-78.6	172	-177.3	179.4	0	111.1	P329 A330 W331 L335 R336 H338	P329-K333 VanDerWaalsContact O-CG 3.29Å; P329-K333 WeakPolarHBondContact O-CG 3.43Å; P329-K333 PolarHBondContact O-N 2.85Å; P329-K333 VanDerWaalsContact O-N 3.11Å; A330-K333 WeakPolarHBondContact O-CB 3.29Å; A330-K333 PolarHBondContact O-N 3.15Å; W331-K333 VanDerWaalsContact C-N 3.28Å; W331-K333 PolarHBondContact O-N 3.47Å; K333-L335 VanDerWaalsContact C-N 3.33Å; K333-L335 PolarHBondContact O-N 3.41Å; K333-R336 PolarHBondContact O-N 3.34Å; K333-H338 HydrophobicContact CG-CB 3.79Å
334	S	96.6	Very high	95.7	Very high	89 Å²	89	55.9 Å²	55.9	62%	0.622	29%	0.29	S	S	*	.	H	α-helix	trans	-64.5	-35.7	179.4	77.5	0	0	0	0	112.8	A330 W331 R336	A330-S334 PolarHBondContact O-N 2.99Å; W331-S334 PolarHBondContact O-N 2.9Å; W331-S334 PolarHBondContact O-OG 3.32Å; S334-R336 PolarHBondContact O-N 3.12Å
335	L	96.6	Very high	95.9	Very high	35 Å²	35	56.1 Å²	56.1	18%	0.183	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-5.2	173.2	-65.4	176.5	0	0	0	114.3	W331 K333 L337 K372	W331-L335 HydrophobicContact CD2-CD1 3.81Å; W331-L335 VanDerWaalsContact CE2-CD1 3.49Å; W331-L335 HydrophobicContact CE3-CD1 4.22Å; W331-L335 HydrophobicContact CG-CD1 4.36Å; W331-L335 HydrophobicContact CH2-CD1 4.1Å; W331-L335 HydrophobicContact CZ2-CD1 3.66Å; W331-L335 HydrophobicContact CZ3-CD1 4.36Å; W331-L335 WeakPolarHBondContact O-CG 3.25Å; W331-L335 PolarHBondContact O-N 3.14Å; K333-L335 VanDerWaalsContact C-N 3.33Å; K333-L335 PolarHBondContact O-N 3.41Å; L335-L337 HydrophobicContact CB-CB 4.31Å; L335-L337 HydrophobicContact CB-CD1 3.91Å; L335-L337 HydrophobicContact CB-CG 4.16Å; L335-L337 HydrophobicContact CD1-CD1 4.17Å; L335-L337 PolarHBondContact O-N 3.23Å; L335-K372 WeakPolarHBondContact O-CE 3.38Å; L335-K372 PolarHBondContact O-NZ 3.11Å
336	R	97.3	Very high	95.8	Very high	217 Å²	217	63.2 Å²	63.2	82%	0.819	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	31.9	-171.8	-55.4	174.7	68.1	172.1	1.8	113	L332 K333 S334	L332-R336 PolarHBondContact O-N 3.09Å; K333-R336 PolarHBondContact O-N 3.34Å; S334-R336 PolarHBondContact O-N 3.12Å
337	L	97.6	Very high	95.8	Very high	9 Å²	9	60.2 Å²	60.2	5%	0.047	31%	0.31	C	S	.	.			trans	-110	2.3	179.1	-73.2	170.6	0	0	0	113.4	L332 L335 K339 Y340 A369 K372 I373	L332-L337 HydrophobicContact CD2-CB 3.84Å; L332-L337 CarbonylContact O-C 3.6Å; L332-L337 PolarHBondContact O-N 2.83Å; L335-L337 HydrophobicContact CB-CB 4.31Å; L335-L337 HydrophobicContact CB-CD1 3.91Å; L335-L337 HydrophobicContact CB-CG 4.16Å; L335-L337 HydrophobicContact CD1-CD1 4.17Å; L335-L337 PolarHBondContact O-N 3.23Å; L337-K339 PolarHBondContact O-N 3.28Å; L337-Y340 HydrophobicContact CD2-CD2 4.22Å; L337-Y340 HydrophobicContact CD2-CE2 4.27Å; L337-Y340 WeakPolarHBondContact O-CD2 3.41Å; L337-Y340 PolarHBondContact O-N 3.41Å; L337-A369 HydrophobicContact CD2-CB 3.98Å; L337-K372 HydrophobicContact CD1-CB 4.45Å; L337-K372 HydrophobicContact CD1-CD 4.13Å; L337-K372 HydrophobicContact CD1-CG 4.12Å; L337-K372 HydrophobicContact CD2-CD 4.29Å; L337-K372 HydrophobicContact CG-CD 4.25Å; L337-I373 HydrophobicContact CD1-CG1 3.7Å; L337-I373 HydrophobicContact CD2-CG1 4.29Å
338	H	96.6	Very high	95.8	Very high	107 Å²	107	60.1 Å²	60.1	50%	0.495	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-56.6	-15.9	-175.2	64.7	-98.2	0	0	0	115.9	L332 K333 Y340 A341	L332-H338 HydrophobicContact CB-CB 4.38Å; L332-H338 PolarHBondContact O-N 3.03Å; K333-H338 HydrophobicContact CG-CB 3.79Å; H338-Y340 PolarHBondContact O-N 2.94Å; H338-A341 VanDerWaalsContact O-CB 3.28Å; H338-A341 WeakPolarHBondContact O-CB 3.46Å; H338-A341 PolarHBondContact O-N 3.46Å; H338-A341 VanDerWaalsContact O-N 3.08Å
339	K	96.6	Very high	95.7	Very high	171 Å²	171	61.4 Å²	61.4	74%	0.743	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-52.3	-33.8	167.6	-179.9	177.3	177.3	-177.6	0	112	L337	L337-K339 PolarHBondContact O-N 3.28Å
340	Y	96.8	Very high	95.6	Very high	34 Å²	34	64.4 Å²	64.4	13%	0.133	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-89.5	3.7	-177.7	-56.3	-71.4	0	0	0	113.6	L337 H338 A342 L343 F344 V365 T366 A369 I373	L337-Y340 HydrophobicContact CD2-CD2 4.22Å; L337-Y340 HydrophobicContact CD2-CE2 4.27Å; L337-Y340 WeakPolarHBondContact O-CD2 3.41Å; L337-Y340 PolarHBondContact O-N 3.41Å; H338-Y340 PolarHBondContact O-N 2.94Å; Y340-A342 PolarHBondContact O-N 2.9Å; Y340-A342 VanDerWaalsContact O-N 3.1Å; Y340-L343 VanDerWaalsContact O-CB 3.29Å; Y340-L343 WeakPolarHBondContact O-CB 3.49Å; Y340-L343 PolarHBondContact O-N 3.5Å; Y340-F344 WeakPolarHBondContact O-CD2 3.46Å; Y340-V365 HydrophobicContact CD1-CG1 4.22Å; Y340-V365 HydrophobicContact CD1-CG2 3.91Å; Y340-V365 HydrophobicContact CE1-CB 4.19Å; Y340-V365 HydrophobicContact CE1-CG1 3.88Å; Y340-V365 HydrophobicContact CE1-CG2 4.05Å; Y340-V365 HydrophobicContact CE2-CG1 4.34Å; Y340-T366 PolarHBondContact OH-OG1 2.82Å; Y340-A369 HydrophobicContact CD2-CB 4.3Å; Y340-A369 HydrophobicContact CE2-CB 3.37Å; Y340-I373 HydrophobicContact CD2-CD1 4.4Å
341	A	96.1	Very high	95.5	Very high	21 Å²	21	66.3 Å²	66.3	17%	0.174	33%	0.326	C	S	.	.	H	α-helix	trans	-57.3	-31.3	-173.7	0	0	0	0	0	113.9	F318 L332 H338 L343 F344 S345	F318-A341 HydrophobicContact CE2-CB 4.48Å; F318-A341 WeakPolarHBondContact CE2-O 3.36Å; F318-A341 VanDerWaalsContact CZ-O 3.23Å; F318-A341 WeakPolarHBondContact CZ-O 3.45Å; L332-A341 HydrophobicContact CD1-CB 4.16Å; H338-A341 VanDerWaalsContact O-CB 3.28Å; H338-A341 WeakPolarHBondContact O-CB 3.46Å; H338-A341 PolarHBondContact O-N 3.46Å; H338-A341 VanDerWaalsContact O-N 3.08Å; A341-L343 PolarHBondContact O-N 2.79Å; A341-F344 PolarHBondContact O-N 3.27Å; A341-F344 VanDerWaalsContact O-N 3.11Å; A341-S345 PolarHBondContact O-N 2.83Å
342	A	93.9	Very high	95.5	Very high	69 Å²	69	65.7 Å²	65.7	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-65.3	-23.2	176.2	0	0	0	0	0	114.2	Y340 S345	Y340-A342 PolarHBondContact O-N 2.9Å; Y340-A342 VanDerWaalsContact O-N 3.1Å; A342-S345 WeakPolarHBondContact CA-OG 3.47Å; A342-S345 PolarHBondContact O-OG 3.3Å
343	L	94.7	Very high	95.4	Very high	37 Å²	37	67 Å²	67	19%	0.194	33%	0.331	C	S	.	.	H	α-helix	trans	-72	-44.6	170.5	-178.9	63.9	0	0	0	110.2	Y340 A341 S345 Q346 M347 L360 Q363 V365	Y340-L343 VanDerWaalsContact O-CB 3.29Å; Y340-L343 WeakPolarHBondContact O-CB 3.49Å; Y340-L343 PolarHBondContact O-N 3.5Å; A341-L343 PolarHBondContact O-N 2.79Å; L343-S345 VanDerWaalsContact C-N 3.32Å; L343-S345 PolarHBondContact O-N 2.92Å; L343-Q346 PolarHBondContact O-N 3.41Å; L343-M347 HydrophobicContact CG-CE 3.99Å; L343-L360 HydrophobicContact CD2-CD2 3.89Å; L343-Q363 HydrophobicContact CD1-CB 4Å; L343-Q363 HydrophobicContact CD1-CG 3.8Å; L343-Q363 HydrophobicContact CD2-CB 4.06Å; L343-V365 HydrophobicContact CD2-CG2 4.07Å
344	F	95.6	Very high	95.3	Very high	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-73.6	-18	-178.3	-68.2	-94.9	0	0	0	113.9	F318 M325 V328 L332 Y340 A341 Q346 M347 M352 L355 I373	F318-F344 HydrophobicContact CE1-CB 3.95Å; F318-F344 WeakPolarHBondContact CE1-O 3.37Å; F318-F344 VanDerWaalsContact CZ-C 3.48Å; F318-F344 HydrophobicContact CZ-CB 3.78Å; M325-F344 HydrophobicContact CE-CB 4.39Å; M325-F344 WeakPolarHBondContact CE-O 3.32Å; V328-F344 HydrophobicContact CG1-CB 3.83Å; V328-F344 HydrophobicContact CG1-CD1 4.06Å; V328-F344 HydrophobicContact CG1-CG 4.06Å; L332-F344 HydrophobicContact CD1-CB 4.21Å; L332-F344 HydrophobicContact CD1-CD2 3.55Å; L332-F344 HydrophobicContact CD1-CE2 4.03Å; L332-F344 HydrophobicContact CD1-CG 3.9Å; L332-F344 HydrophobicContact CD2-CD2 4.43Å; L332-F344 HydrophobicContact CD2-CE2 4.08Å; L332-F344 HydrophobicContact CD2-CZ 4.31Å; Y340-F344 WeakPolarHBondContact O-CD2 3.46Å; A341-F344 PolarHBondContact O-N 3.27Å; A341-F344 VanDerWaalsContact O-N 3.11Å; F344-Q346 PolarHBondContact O-N 3.26Å; F344-M347 HydrophobicContact CB-SD 4.47Å; F344-M347 HydrophobicContact CD1-CE 4.25Å; F344-M347 HydrophobicContact CD1-SD 3.55Å; F344-M347 VanDerWaalsContact CD1-SD 3.55Å; F344-M347 HydrophobicContact CE1-SD 4.09Å; F344-M347 HydrophobicContact CG-CE 4.47Å; F344-M347 HydrophobicContact CG-SD 4.19Å; F344-M352 HydrophobicContact CD1-CG 4.02Å; F344-M352 HydrophobicContact CD1-SD 3.82Å; F344-M352 HydrophobicContact CE1-CG 3.95Å; F344-M352 HydrophobicContact CE1-SD 4.09Å; F344-L355 HydrophobicContact CE1-CD1 3.72Å; F344-L355 HydrophobicContact CZ-CD1 4.16Å; F344-I373 HydrophobicContact CE2-CD1 4.23Å; F344-I373 HydrophobicContact CZ-CD1 4.2Å; F344-I373 HydrophobicContact CZ-CG1 4.37Å; F344-I373 HydrophobicContact CZ-CG2 3.86Å
345	S	94.4	Very high	95.2	Very high	14 Å²	14	60.8 Å²	60.8	10%	0.098	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.1	174.7	43.6	0	0	0	0	114.2	N316 T317 F318 A341 A342 L343	N316-S345 WeakPolarHBondContact CA-O 3.31Å; N316-S345 WeakPolarHBondContact OD1-CB 3.35Å; T317-S345 PolarHBondContact N-O 3.25Å; T317-S345 PolarHBondContact OG1-O 2.89Å; F318-S345 VanDerWaalsContact CE2-CB 3.47Å; F318-S345 VanDerWaalsContact CZ-N 3.28Å; A341-S345 PolarHBondContact O-N 2.83Å; A342-S345 WeakPolarHBondContact CA-OG 3.47Å; A342-S345 PolarHBondContact O-OG 3.3Å; L343-S345 VanDerWaalsContact C-N 3.32Å; L343-S345 PolarHBondContact O-N 2.92Å
346	Q	91.4	Very high	95.2	Very high	148 Å²	148	62.1 Å²	62.1	69%	0.692	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-2.9	-175.3	-59.1	-178.8	22.4	0	0	113.4	L343 F344	L343-Q346 PolarHBondContact O-N 3.41Å; F344-Q346 PolarHBondContact O-N 3.26Å
347	M	91.9	Very high	95.1	Very high	18 Å²	18	54.5 Å²	54.5	9%	0.089	29%	0.288	C	S	.	.	S	Bend	trans	-111.2	157.9	-179.2	68.6	-177.3	56.7	0	0	111.5	T317 M325 L343 F344 E351 M352 L355	T317-M347 VanDerWaalsContact CB-O 3.29Å; T317-M347 WeakPolarHBondContact CB-O 3.34Å; T317-M347 WeakPolarHBondContact CG2-O 3.31Å; T317-M347 PolarHBondContact OG1-O 3.38Å; M325-M347 HydrophobicContact CE-CG 3.73Å; M325-M347 HydrophobicContact CE-SD 4.48Å; L343-M347 HydrophobicContact CG-CE 3.99Å; F344-M347 HydrophobicContact CB-SD 4.47Å; F344-M347 HydrophobicContact CD1-CE 4.25Å; F344-M347 HydrophobicContact CD1-SD 3.55Å; F344-M347 VanDerWaalsContact CD1-SD 3.55Å; F344-M347 HydrophobicContact CE1-SD 4.09Å; F344-M347 HydrophobicContact CG-CE 4.47Å; F344-M347 HydrophobicContact CG-SD 4.19Å; M347-E351 HydrophobicContact CB-CB 4.1Å; M347-M352 HydrophobicContact CG-CB 4.41Å; M347-M352 HydrophobicContact SD-CB 3.77Å; M347-M352 HydrophobicContact SD-CG 4.27Å; M347-L355 HydrophobicContact CE-CD1 4.04Å; M347-L355 HydrophobicContact CE-CD2 4.15Å; M347-L355 HydrophobicContact SD-CD1 3.85Å; M347-L355 HydrophobicContact SD-CG 4.44Å
348	T	94.3	Very high	95	Very high	58 Å²	58	58.5 Å²	58.5	36%	0.356	32%	0.316	S	S	.	.			trans	-78.8	168.1	168	60.9	0	0	0	0	112	E350 E351 M352	T348-E350 VanDerWaalsContact C-N 3.29Å; T348-E350 PolarHBondContact O-N 3.43Å; T348-E351 VanDerWaalsContact CB-OE2 3.32Å; T348-E351 WeakPolarHBondContact CB-OE2 3.46Å; T348-E351 WeakPolarHBondContact CG2-OE2 3.45Å; T348-E351 PolarHBondContact N-OE2 2.87Å; T348-E351 PolarHBondContact O-N 2.9Å; T348-E351 WeakPolarHBondContact OG1-CB 3.43Å; T348-E351 VanDerWaalsContact OG1-CG 3.3Å; T348-E351 WeakPolarHBondContact OG1-CG 3.41Å; T348-E351 PolarHBondContact OG1-N 3.43Å; T348-E351 VanDerWaalsContact OG1-N 3.16Å; T348-E351 PolarHBondContact OG1-OE2 2.72Å; T348-M352 WeakPolarHBondContact O-CB 3.21Å; T348-M352 PolarHBondContact O-N 2.75Å
349	Y	94.5	Very high	94.9	Very high	27 Å²	27	58 Å²	58	11%	0.106	31%	0.314	C	S	.	.	H	α-helix	trans	-64.1	-36.1	172.8	179.7	-89	0	0	0	111.9	S323 M325 M352 M353 R383 P414 K416	S323-Y349 VanDerWaalsContact O-CB 3.29Å; S323-Y349 WeakPolarHBondContact O-CB 3.26Å; M325-Y349 VanDerWaalsContact SD-CA 3.51Å; M325-Y349 HydrophobicContact SD-CD2 4.42Å; Y349-M352 HydrophobicContact CD2-CE 3.63Å; Y349-M352 HydrophobicContact CE2-CE 3.99Å; Y349-M352 HydrophobicContact CG-CE 4.44Å; Y349-M352 WeakPolarHBondContact O-CB 3.45Å; Y349-M352 PolarHBondContact O-N 3.13Å; Y349-M353 HydrophobicContact CD1-CG 4.17Å; Y349-M353 HydrophobicContact CE1-CG 3.83Å; Y349-M353 HydrophobicContact CE1-SD 4.5Å; Y349-M353 HydrophobicContact CE2-CE 4.42Å; Y349-M353 WeakPolarHBondContact O-CG 3.35Å; Y349-M353 PolarHBondContact O-N 3.42Å; Y349-R383 PolarHBondContact OH-NH2 3.3Å; Y349-P414 HydrophobicContact CE2-CB 4.36Å; Y349-K416 HydrophobicContact CD1-CB 3.86Å; Y349-K416 HydrophobicContact CD1-CD 3.74Å; Y349-K416 HydrophobicContact CD1-CG 4.41Å; Y349-K416 HydrophobicContact CD2-CB 4.19Å; Y349-K416 HydrophobicContact CE1-CB 3.85Å; Y349-K416 HydrophobicContact CE1-CD 4.43Å; Y349-K416 HydrophobicContact CE2-CB 4.18Å; Y349-K416 HydrophobicContact CG-CB 4.04Å; Y349-K416 HydrophobicContact CG-CD 4.02Å
350	E	93.9	Very high	94.9	Very high	97 Å²	97	50 Å²	50	45%	0.453	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-48.5	175.6	-75.2	59.8	-143.3	0	0	111.6	T348 M352 M353 A354 K416	T348-E350 VanDerWaalsContact C-N 3.29Å; T348-E350 PolarHBondContact O-N 3.43Å; E350-M352 PolarHBondContact O-N 2.98Å; E350-M353 PolarHBondContact O-N 3.18Å; E350-M353 VanDerWaalsContact O-N 3.16Å; E350-A354 PolarHBondContact O-N 3.45Å; E350-K416 WeakPolarHBondContact OE1-CD 3.31Å; E350-K416 IonicContact OE1-NZ 2.67Å; E350-K416 PolarHBondContact OE1-NZ 2.8Å; E350-K416 IonicContact OE2-NZ 3.03Å; E350-K416 PolarHBondContact OE2-NZ 3.25Å
351	E	95.2	Very high	94.8	Very high	103 Å²	103	53.2 Å²	53.2	48%	0.481	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-41.2	174.4	-71.1	162.9	122.5	0	0	111.6	M347 T348 M353 A354 L355	M347-E351 HydrophobicContact CB-CB 4.1Å; T348-E351 VanDerWaalsContact CB-OE2 3.32Å; T348-E351 WeakPolarHBondContact CB-OE2 3.46Å; T348-E351 WeakPolarHBondContact CG2-OE2 3.45Å; T348-E351 PolarHBondContact N-OE2 2.87Å; T348-E351 PolarHBondContact O-N 2.9Å; T348-E351 WeakPolarHBondContact OG1-CB 3.43Å; T348-E351 VanDerWaalsContact OG1-CG 3.3Å; T348-E351 WeakPolarHBondContact OG1-CG 3.41Å; T348-E351 PolarHBondContact OG1-N 3.43Å; T348-E351 VanDerWaalsContact OG1-N 3.16Å; T348-E351 PolarHBondContact OG1-OE2 2.72Å; E351-M353 VanDerWaalsContact C-N 3.27Å; E351-M353 PolarHBondContact O-N 2.99Å; E351-A354 WeakPolarHBondContact O-CA 3.46Å; E351-A354 PolarHBondContact O-N 3.33Å; E351-L355 PolarHBondContact O-N 2.93Å; E351-L355 VanDerWaalsContact O-N 3.1Å
352	M	96.3	Very high	94.8	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-38.7	173	-177.8	176	64.3	0	0	112	M325 V328 W331 F344 M347 T348 Y349 E350 A354 L355 I377 P414	M325-M352 HydrophobicContact CE-CB 4.27Å; M325-M352 HydrophobicContact CE-CE 4.39Å; M325-M352 HydrophobicContact CE-SD 3.94Å; M325-M352 HydrophobicContact SD-CB 4.24Å; M325-M352 HydrophobicContact SD-CE 3.58Å; M325-M352 VanDerWaalsContact SD-CE 3.58Å; M325-M352 HydrophobicContact SD-SD 3.95Å; V328-M352 HydrophobicContact CG1-SD 4.1Å; V328-M352 HydrophobicContact CG2-CE 3.69Å; V328-M352 HydrophobicContact CG2-SD 3.64Å; W331-M352 HydrophobicContact CZ3-SD 4.4Å; F344-M352 HydrophobicContact CD1-CG 4.02Å; F344-M352 HydrophobicContact CD1-SD 3.82Å; F344-M352 HydrophobicContact CE1-CG 3.95Å; F344-M352 HydrophobicContact CE1-SD 4.09Å; M347-M352 HydrophobicContact CG-CB 4.41Å; M347-M352 HydrophobicContact SD-CB 3.77Å; M347-M352 HydrophobicContact SD-CG 4.27Å; T348-M352 WeakPolarHBondContact O-CB 3.21Å; T348-M352 PolarHBondContact O-N 2.75Å; Y349-M352 HydrophobicContact CD2-CE 3.63Å; Y349-M352 HydrophobicContact CE2-CE 3.99Å; Y349-M352 HydrophobicContact CG-CE 4.44Å; Y349-M352 WeakPolarHBondContact O-CB 3.45Å; Y349-M352 PolarHBondContact O-N 3.13Å; E350-M352 PolarHBondContact O-N 2.98Å; M352-A354 VanDerWaalsContact C-N 3.3Å; M352-L355 HydrophobicContact CG-CD1 4.45Å; M352-I377 WeakPolarHBondContact O-CD1 3.29Å; M352-P414 HydrophobicContact CE-CB 4.17Å; M352-P414 HydrophobicContact CE-CG 4.47Å
353	M	95.2	Very high	94.8	Very high	30 Å²	30	58.2 Å²	58.2	15%	0.148	32%	0.316	C	S	.	.	H	α-helix	trans	-70.5	-24.9	174.1	-70.8	-58.8	100.5	0	0	112.8	Y349 E350 E351 I377 L380 K381	Y349-M353 HydrophobicContact CD1-CG 4.17Å; Y349-M353 HydrophobicContact CE1-CG 3.83Å; Y349-M353 HydrophobicContact CE1-SD 4.5Å; Y349-M353 HydrophobicContact CE2-CE 4.42Å; Y349-M353 WeakPolarHBondContact O-CG 3.35Å; Y349-M353 PolarHBondContact O-N 3.42Å; E350-M353 PolarHBondContact O-N 3.18Å; E350-M353 VanDerWaalsContact O-N 3.16Å; E351-M353 VanDerWaalsContact C-N 3.27Å; E351-M353 PolarHBondContact O-N 2.99Å; M353-I377 HydrophobicContact CE-CG2 4.15Å; M353-I377 HydrophobicContact SD-CG2 4.43Å; M353-L380 HydrophobicContact CE-CB 4.04Å; M353-L380 HydrophobicContact CE-CD1 3.7Å; M353-L380 HydrophobicContact SD-CB 4.2Å; M353-K381 WeakPolarHBondContact O-CE 3.31Å; M353-K381 PolarHBondContact O-NZ 3.44Å; M353-K381 HydrophobicContact SD-CG 4.38Å
354	A	96.1	Very high	94.8	Very high	60 Å²	60	63.5 Å²	63.5	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-87.2	-12.7	-179.7	0	0	0	0	0	114.8	E350 E351 M352	E350-A354 PolarHBondContact O-N 3.45Å; E351-A354 WeakPolarHBondContact O-CA 3.46Å; E351-A354 PolarHBondContact O-N 3.33Å; M352-A354 VanDerWaalsContact C-N 3.3Å
355	L	95.2	Very high	94.9	Very high	22 Å²	22	63.7 Å²	63.7	12%	0.115	35%	0.345	C	S	.	.			trans	-53	134.8	-174	-75.9	171.8	0	0	0	115	F344 M347 E351 M352 L360 I377	F344-L355 HydrophobicContact CE1-CD1 3.72Å; F344-L355 HydrophobicContact CZ-CD1 4.16Å; M347-L355 HydrophobicContact CE-CD1 4.04Å; M347-L355 HydrophobicContact CE-CD2 4.15Å; M347-L355 HydrophobicContact SD-CD1 3.85Å; M347-L355 HydrophobicContact SD-CG 4.44Å; E351-L355 PolarHBondContact O-N 2.93Å; E351-L355 VanDerWaalsContact O-N 3.1Å; M352-L355 HydrophobicContact CG-CD1 4.45Å; L355-L360 HydrophobicContact CD1-CD2 4.34Å; L355-L360 HydrophobicContact CD2-CD2 4.25Å; L355-I377 HydrophobicContact CB-CD1 3.92Å; L355-I377 HydrophobicContact CD1-CD1 3.77Å; L355-I377 HydrophobicContact CG-CD1 4.46Å
356	T	95.5	Very high	95	Very high	63 Å²	63	67 Å²	67	39%	0.387	37%	0.365	S	S	.	.			trans	-115	162.9	175.4	63.3	0	0	0	0	112	C358 Q359 L360	T356-C358 PolarHBondContact O-N 2.82Å; T356-Q359 PolarHBondContact O-N 2.95Å; T356-Q359 WeakPolarHBondContact OG1-CG 3.21Å; T356-Q359 PolarHBondContact OG1-N 2.88Å; T356-Q359 PolarHBondContact OG1-OE1 3.1Å; T356-L360 WeakPolarHBondContact O-CG 3.45Å; T356-L360 PolarHBondContact O-N 3.39Å
357	E	95.1	Very high	95.2	Very high	56 Å²	56	67.5 Å²	67.5	26%	0.262	37%	0.365	S	S	.	.	H	α-helix	trans	-59.9	-33.9	173.6	-81.1	-157	-151.9	0	0	112.6	L360 E361 R370 H371 V374	E357-L360 PolarHBondContact O-N 3.43Å; E357-E361 WeakPolarHBondContact O-CB 2.83Å; E357-E361 PolarHBondContact O-N 2.82Å; E357-R370 HydrophobicContact CB-CG 4.41Å; E357-R370 HydrophobicContact CG-CB 4.37Å; E357-R370 HydrophobicContact CG-CG 4.01Å; E357-R370 WeakPolarHBondContact OE2-CD 3.48Å; E357-R370 IonicContact OE2-CZ 3.19Å; E357-R370 IonicContact OE2-NE 3.37Å; E357-R370 PolarHBondContact OE2-NE 3.49Å; E357-R370 IonicContact OE2-NH2 3.84Å; E357-H371 WeakPolarHBondContact OE1-CA 3.38Å; E357-H371 WeakPolarHBondContact OE1-CB 3.16Å; E357-H371 IonicContact OE1-CE1 3.25Å; E357-H371 IonicContact OE1-CG 2.66Å; E357-H371 IonicContact OE1-ND1 3.72Å; E357-H371 PolarHBondContact OE1-ND1 3.47Å; E357-V374 HydrophobicContact CG-CB 4.47Å; E357-V374 HydrophobicContact CG-CG2 3.87Å
358	C	95.3	Very high	95.5	Very high	94 Å²	94	69.6 Å²	69.6	64%	0.635	39%	0.391	S	S	*	.	H	α-helix	trans	-65.4	-44.3	-179.6	-172.9	0	0	0	0	112.3	T356 L360 E361 A362	T356-C358 PolarHBondContact O-N 2.82Å; C358-L360 VanDerWaalsContact C-N 3.3Å; C358-L360 PolarHBondContact O-N 2.9Å; C358-E361 PolarHBondContact O-N 2.72Å; C358-A362 PolarHBondContact O-N 2.94Å
359	Q	94.3	Very high	95.6	Very high	97 Å²	97	67.3 Å²	67.3	45%	0.453	38%	0.378	S	S	.	.	H	α-helix	trans	-64.2	-37.2	176.2	-71.7	159	-51.6	0	0	111.5	T356 Q363	T356-Q359 PolarHBondContact O-N 2.95Å; T356-Q359 WeakPolarHBondContact OG1-CG 3.21Å; T356-Q359 PolarHBondContact OG1-N 2.88Å; T356-Q359 PolarHBondContact OG1-OE1 3.1Å; Q359-Q363 VanDerWaalsContact O-CG 3.27Å; Q359-Q363 WeakPolarHBondContact O-CG 3.49Å; Q359-Q363 PolarHBondContact O-N 3.45Å
360	L	96.3	Very high	95.8	Very high	1 Å²	1	67.3 Å²	67.3	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-71.5	-36.1	176.7	-64.8	169	0	0	0	112	L343 L355 T356 E357 C358 Q363 N364 V365 R370 I373 V374	L343-L360 HydrophobicContact CD2-CD2 3.89Å; L355-L360 HydrophobicContact CD1-CD2 4.34Å; L355-L360 HydrophobicContact CD2-CD2 4.25Å; T356-L360 WeakPolarHBondContact O-CG 3.45Å; T356-L360 PolarHBondContact O-N 3.39Å; E357-L360 PolarHBondContact O-N 3.43Å; C358-L360 VanDerWaalsContact C-N 3.3Å; C358-L360 PolarHBondContact O-N 2.9Å; L360-Q363 CarbonylContact O-C 3.56Å; L360-Q363 PolarHBondContact O-N 3.04Å; L360-N364 PolarHBondContact O-N 3.22Å; L360-V365 HydrophobicContact CB-CB 4.02Å; L360-V365 HydrophobicContact CB-CG1 4.47Å; L360-V365 HydrophobicContact CB-CG2 4.1Å; L360-V365 HydrophobicContact CD2-CG2 4.15Å; L360-V365 WeakPolarHBondContact O-CB 3.15Å; L360-V365 VanDerWaalsContact O-CG2 3.28Å; L360-V365 WeakPolarHBondContact O-CG2 3.44Å; L360-V365 PolarHBondContact O-N 2.92Å; L360-R370 HydrophobicContact CB-CB 3.67Å; L360-R370 HydrophobicContact CD1-CB 3.97Å; L360-R370 HydrophobicContact CG-CB 4.48Å; L360-I373 HydrophobicContact CD1-CB 3.92Å; L360-I373 HydrophobicContact CD1-CD1 4.43Å; L360-I373 HydrophobicContact CD1-CG2 3.55Å; L360-I373 HydrophobicContact CD2-CD1 4.34Å; L360-I373 HydrophobicContact CD2-CG2 4.34Å; L360-V374 HydrophobicContact CD1-CG2 3.95Å
361	E	96.4	Very high	95.9	Very high	103 Å²	103	67.5 Å²	67.5	48%	0.481	38%	0.378	S	S	.	.	H	α-helix	trans	-64.3	-43.7	173.8	-179.2	151.3	-131.3	0	0	111.8	E357 C358 Q363 N364 R370	E357-E361 WeakPolarHBondContact O-CB 2.83Å; E357-E361 PolarHBondContact O-N 2.82Å; C358-E361 PolarHBondContact O-N 2.72Å; E361-Q363 PolarHBondContact O-N 2.6Å; E361-N364 PolarHBondContact O-N 2.85Å; E361-R370 VanDerWaalsContact CD-NH2 3.25Å; E361-R370 IonicContact OE1-CZ 2.75Å; E361-R370 VanDerWaalsContact OE1-CZ 3.25Å; E361-R370 IonicContact OE1-NH1 2.72Å; E361-R370 PolarHBondContact OE1-NH1 3.35Å; E361-R370 IonicContact OE1-NH2 3.1Å; E361-R370 PolarHBondContact OE1-NH2 3.26Å; E361-R370 VanDerWaalsContact OE1-NH2 3.1Å; E361-R370 IonicContact OE2-CZ 3.62Å; E361-R370 IonicContact OE2-NH1 3.53Å; E361-R370 PolarHBondContact OE2-NH1 2.77Å; E361-R370 IonicContact OE2-NH2 2.79Å; E361-R370 PolarHBondContact OE2-NH2 2.96Å
362	A	95.8	Very high	96.1	Very high	75 Å²	75	66.8 Å²	66.8	62%	0.62	37%	0.374	S	S	*	.	H	α-helix	trans	-60.4	-28	171.5	0	0	0	0	0	113.2	C358 N364	C358-A362 PolarHBondContact O-N 2.94Å; A362-N364 VanDerWaalsContact C-N 3.28Å; A362-N364 PolarHBondContact O-N 3.39Å
363	Q	93.3	Very high	96.1	Very high	119 Å²	119	66.9 Å²	66.9	56%	0.556	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	22	175.2	-65.2	-68.2	-21.1	0	0	113.1	L343 Q359 L360 E361 V365	L343-Q363 HydrophobicContact CD1-CB 4Å; L343-Q363 HydrophobicContact CD1-CG 3.8Å; L343-Q363 HydrophobicContact CD2-CB 4.06Å; Q359-Q363 VanDerWaalsContact O-CG 3.27Å; Q359-Q363 WeakPolarHBondContact O-CG 3.49Å; Q359-Q363 PolarHBondContact O-N 3.45Å; L360-Q363 CarbonylContact O-C 3.56Å; L360-Q363 PolarHBondContact O-N 3.04Å; E361-Q363 PolarHBondContact O-N 2.6Å; Q363-V365 HydrophobicContact CB-CG2 4.45Å; Q363-V365 PolarHBondContact O-N 2.67Å; Q363-V365 VanDerWaalsContact O-N 3.14Å
364	N	95.3	Very high	96.3	Very high	148 Å²	148	67.5 Å²	67.5	79%	0.791	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	25.9	176.7	-66.9	-85.6	0	0	0	114.8	L360 E361 A362	L360-N364 PolarHBondContact O-N 3.22Å; E361-N364 PolarHBondContact O-N 2.85Å; A362-N364 VanDerWaalsContact C-N 3.28Å; A362-N364 PolarHBondContact O-N 3.39Å
365	V	96.8	Very high	96.3	Very high	5 Å²	5	68.4 Å²	68.4	3%	0.03	38%	0.375	C	S	.	.			trans	-76.7	127.7	175.7	-178.1	0	0	0	0	109.9	Y340 L343 L360 Q363 A369 R370 I373	Y340-V365 HydrophobicContact CD1-CG1 4.22Å; Y340-V365 HydrophobicContact CD1-CG2 3.91Å; Y340-V365 HydrophobicContact CE1-CB 4.19Å; Y340-V365 HydrophobicContact CE1-CG1 3.88Å; Y340-V365 HydrophobicContact CE1-CG2 4.05Å; Y340-V365 HydrophobicContact CE2-CG1 4.34Å; L343-V365 HydrophobicContact CD2-CG2 4.07Å; L360-V365 HydrophobicContact CB-CB 4.02Å; L360-V365 HydrophobicContact CB-CG1 4.47Å; L360-V365 HydrophobicContact CB-CG2 4.1Å; L360-V365 HydrophobicContact CD2-CG2 4.15Å; L360-V365 WeakPolarHBondContact O-CB 3.15Å; L360-V365 VanDerWaalsContact O-CG2 3.28Å; L360-V365 WeakPolarHBondContact O-CG2 3.44Å; L360-V365 PolarHBondContact O-N 2.92Å; Q363-V365 HydrophobicContact CB-CG2 4.45Å; Q363-V365 PolarHBondContact O-N 2.67Å; Q363-V365 VanDerWaalsContact O-N 3.14Å; V365-A369 HydrophobicContact CG1-CB 3.7Å; V365-R370 HydrophobicContact CB-CB 4.33Å; V365-R370 HydrophobicContact CG1-CB 3.9Å; V365-I373 HydrophobicContact CG1-CD1 4.01Å
366	T	97.4	Very high	96.4	Very high	83 Å²	83	68 Å²	68	51%	0.509	37%	0.374	S	S	.	.			trans	-61.7	147.6	-176.4	64.9	0	0	0	0	112.2	Y340 G368 A369 R370	Y340-T366 PolarHBondContact OH-OG1 2.82Å; T366-G368 VanDerWaalsContact C-N 3.28Å; T366-G368 PolarHBondContact O-N 3.43Å; T366-G368 VanDerWaalsContact O-N 3.13Å; T366-A369 WeakPolarHBondContact O-CA 3.32Å; T366-A369 WeakPolarHBondContact O-CB 3.48Å; T366-A369 PolarHBondContact O-N 3.44Å; T366-A369 WeakPolarHBondContact OG1-CB 3.35Å; T366-R370 PolarHBondContact O-N 3.07Å
367	K	95.9	Very high	96.5	Very high	159 Å²	159	65.1 Å²	65.1	69%	0.691	36%	0.357	S	S	*	.	H	α-helix	trans	-49.5	-43.2	-175.2	-173.5	171.6	-179.2	173.9	0	114	R370 H371	K367-R370 WeakPolarHBondContact O-CG 3.49Å; K367-H371 PolarHBondContact O-N 3.34Å
368	G	96.6	Very high	96.6	Very high	62 Å²	62	66.6 Å²	66.6	64%	0.639	36%	0.363	S	S	*	.	H	α-helix	trans	-70.8	-28.7	176.1	0	0	0	0	0	114.4	T366 K372	T366-G368 VanDerWaalsContact C-N 3.28Å; T366-G368 PolarHBondContact O-N 3.43Å; T366-G368 VanDerWaalsContact O-N 3.13Å; G368-K372 WeakPolarHBondContact O-CB 3.21Å; G368-K372 PolarHBondContact O-N 2.85Å
369	A	97.8	Very high	96.7	Very high	9 Å²	9	68.5 Å²	68.5	7%	0.074	36%	0.361	C	S	.	.	H	α-helix	trans	-79.8	-43.6	178.2	0	0	0	0	0	112.4	L337 Y340 V365 T366 H371 K372 I373	L337-A369 HydrophobicContact CD2-CB 3.98Å; Y340-A369 HydrophobicContact CD2-CB 4.3Å; Y340-A369 HydrophobicContact CE2-CB 3.37Å; V365-A369 HydrophobicContact CG1-CB 3.7Å; T366-A369 WeakPolarHBondContact O-CA 3.32Å; T366-A369 WeakPolarHBondContact O-CB 3.48Å; T366-A369 PolarHBondContact O-N 3.44Å; T366-A369 WeakPolarHBondContact OG1-CB 3.35Å; A369-H371 PolarHBondContact O-N 3.12Å; A369-K372 PolarHBondContact O-N 3.21Å; A369-I373 VanDerWaalsContact O-CG1 3.31Å; A369-I373 WeakPolarHBondContact O-CG1 3.34Å; A369-I373 PolarHBondContact O-N 2.76Å
370	R	97.6	Very high	96.8	Very high	27 Å²	27	64.3 Å²	64.3	10%	0.102	34%	0.342	C	S	.	.	H	α-helix	trans	-61.6	-43.9	179.7	66.8	-178.2	-166.2	-143.1	29.4	111.9	E357 L360 E361 V365 T366 K367 K372 I373 V374	E357-R370 HydrophobicContact CB-CG 4.41Å; E357-R370 HydrophobicContact CG-CB 4.37Å; E357-R370 HydrophobicContact CG-CG 4.01Å; E357-R370 WeakPolarHBondContact OE2-CD 3.48Å; E357-R370 IonicContact OE2-CZ 3.19Å; E357-R370 IonicContact OE2-NE 3.37Å; E357-R370 PolarHBondContact OE2-NE 3.49Å; E357-R370 IonicContact OE2-NH2 3.84Å; L360-R370 HydrophobicContact CB-CB 3.67Å; L360-R370 HydrophobicContact CD1-CB 3.97Å; L360-R370 HydrophobicContact CG-CB 4.48Å; E361-R370 VanDerWaalsContact CD-NH2 3.25Å; E361-R370 IonicContact OE1-CZ 2.75Å; E361-R370 VanDerWaalsContact OE1-CZ 3.25Å; E361-R370 IonicContact OE1-NH1 2.72Å; E361-R370 PolarHBondContact OE1-NH1 3.35Å; E361-R370 IonicContact OE1-NH2 3.1Å; E361-R370 PolarHBondContact OE1-NH2 3.26Å; E361-R370 VanDerWaalsContact OE1-NH2 3.1Å; E361-R370 IonicContact OE2-CZ 3.62Å; E361-R370 IonicContact OE2-NH1 3.53Å; E361-R370 PolarHBondContact OE2-NH1 2.77Å; E361-R370 IonicContact OE2-NH2 2.79Å; E361-R370 PolarHBondContact OE2-NH2 2.96Å; V365-R370 HydrophobicContact CB-CB 4.33Å; V365-R370 HydrophobicContact CG1-CB 3.9Å; T366-R370 PolarHBondContact O-N 3.07Å; K367-R370 WeakPolarHBondContact O-CG 3.49Å; R370-K372 VanDerWaalsContact C-N 3.33Å; R370-K372 PolarHBondContact O-N 3.42Å; R370-I373 WeakPolarHBondContact O-CB 3.17Å; R370-I373 PolarHBondContact O-N 2.85Å; R370-V374 WeakPolarHBondContact O-CG2 3.17Å; R370-V374 PolarHBondContact O-N 2.96Å
371	H	97.6	Very high	96.7	Very high	101 Å²	101	69 Å²	69	47%	0.468	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-44.1	175.8	-168.5	66.2	0	0	0	111.7	E357 K367 A369 V374 I375	E357-H371 WeakPolarHBondContact OE1-CA 3.38Å; E357-H371 WeakPolarHBondContact OE1-CB 3.16Å; E357-H371 IonicContact OE1-CE1 3.25Å; E357-H371 IonicContact OE1-CG 2.66Å; E357-H371 IonicContact OE1-ND1 3.72Å; E357-H371 PolarHBondContact OE1-ND1 3.47Å; K367-H371 PolarHBondContact O-N 3.34Å; A369-H371 PolarHBondContact O-N 3.12Å; H371-V374 PolarHBondContact O-N 3.01Å; H371-I375 WeakPolarHBondContact NE2-CD1 3.45Å; H371-I375 WeakPolarHBondContact O-CG1 3.21Å; H371-I375 PolarHBondContact O-N 3.02Å
372	K	97.9	Very high	96.6	Very high	89 Å²	89	68.2 Å²	68.2	39%	0.387	36%	0.358	S	S	.	.	H	α-helix	trans	-66	-37.7	176.6	-167.1	-179.3	-174.2	-177	0	112.8	L335 L337 G368 A369 R370 S376	L335-K372 WeakPolarHBondContact O-CE 3.38Å; L335-K372 PolarHBondContact O-NZ 3.11Å; L337-K372 HydrophobicContact CD1-CB 4.45Å; L337-K372 HydrophobicContact CD1-CD 4.13Å; L337-K372 HydrophobicContact CD1-CG 4.12Å; L337-K372 HydrophobicContact CD2-CD 4.29Å; L337-K372 HydrophobicContact CG-CD 4.25Å; G368-K372 WeakPolarHBondContact O-CB 3.21Å; G368-K372 PolarHBondContact O-N 2.85Å; A369-K372 PolarHBondContact O-N 3.21Å; R370-K372 VanDerWaalsContact C-N 3.33Å; R370-K372 PolarHBondContact O-N 3.42Å; K372-S376 VanDerWaalsContact O-CB 3.3Å; K372-S376 WeakPolarHBondContact O-CB 3.19Å; K372-S376 PolarHBondContact O-N 3.18Å; K372-S376 PolarHBondContact O-OG 2.9Å
373	I	97.9	Very high	96.6	Very high	2 Å²	2	65.2 Å²	65.2	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-52	174.6	-73.8	165.5	0	0	0	109.6	L337 Y340 F344 L360 V365 A369 R370 I375 S376 I377	L337-I373 HydrophobicContact CD1-CG1 3.7Å; L337-I373 HydrophobicContact CD2-CG1 4.29Å; Y340-I373 HydrophobicContact CD2-CD1 4.4Å; F344-I373 HydrophobicContact CE2-CD1 4.23Å; F344-I373 HydrophobicContact CZ-CD1 4.2Å; F344-I373 HydrophobicContact CZ-CG1 4.37Å; F344-I373 HydrophobicContact CZ-CG2 3.86Å; L360-I373 HydrophobicContact CD1-CB 3.92Å; L360-I373 HydrophobicContact CD1-CD1 4.43Å; L360-I373 HydrophobicContact CD1-CG2 3.55Å; L360-I373 HydrophobicContact CD2-CD1 4.34Å; L360-I373 HydrophobicContact CD2-CG2 4.34Å; V365-I373 HydrophobicContact CG1-CD1 4.01Å; A369-I373 VanDerWaalsContact O-CG1 3.31Å; A369-I373 WeakPolarHBondContact O-CG1 3.34Å; A369-I373 PolarHBondContact O-N 2.76Å; R370-I373 WeakPolarHBondContact O-CB 3.17Å; R370-I373 PolarHBondContact O-N 2.85Å; I373-I375 PolarHBondContact O-N 3.29Å; I373-S376 WeakPolarHBondContact O-CB 3.1Å; I373-S376 PolarHBondContact O-N 3Å; I373-I377 HydrophobicContact CG2-CD1 3.5Å; I373-I377 HydrophobicContact CG2-CG1 4.43Å; I373-I377 WeakPolarHBondContact O-CG1 3.48Å; I373-I377 PolarHBondContact O-N 2.9Å
374	V	97.8	Very high	96.7	Very high	42 Å²	42	61.8 Å²	61.8	26%	0.255	32%	0.315	S	S	.	.	H	α-helix	trans	-60.8	-45.6	-179.4	172.3	0	0	0	0	111.7	E357 L360 R370 H371 S376 I377 Q378	E357-V374 HydrophobicContact CG-CB 4.47Å; E357-V374 HydrophobicContact CG-CG2 3.87Å; L360-V374 HydrophobicContact CD1-CG2 3.95Å; R370-V374 WeakPolarHBondContact O-CG2 3.17Å; R370-V374 PolarHBondContact O-N 2.96Å; H371-V374 PolarHBondContact O-N 3.01Å; V374-S376 VanDerWaalsContact C-N 3.28Å; V374-S376 PolarHBondContact O-N 3.21Å; V374-I377 PolarHBondContact O-N 3.18Å; V374-Q378 WeakPolarHBondContact O-CB 3.17Å; V374-Q378 PolarHBondContact O-N 2.73Å
375	I	97.2	Very high	96.6	Very high	79 Å²	79	59.6 Å²	59.6	41%	0.405	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-39.3	173.3	-72.5	174	0	0	0	111.6	H371 I373 Q378 K379	H371-I375 WeakPolarHBondContact NE2-CD1 3.45Å; H371-I375 WeakPolarHBondContact O-CG1 3.21Å; H371-I375 PolarHBondContact O-N 3.02Å; I373-I375 PolarHBondContact O-N 3.29Å; I375-Q378 PolarHBondContact O-N 2.93Å; I375-K379 WeakPolarHBondContact O-CG 3.5Å; I375-K379 PolarHBondContact O-N 3.18Å; I375-K379 VanDerWaalsContact O-N 3.1Å
376	S	97.8	Very high	96.6	Very high	14 Å²	14	62.3 Å²	62.3	10%	0.098	32%	0.317	C	S	.	.	H	α-helix	trans	-68.8	-38.6	-179.8	-56.6	0	0	0	0	111.7	K372 I373 V374 K379 L380	K372-S376 VanDerWaalsContact O-CB 3.3Å; K372-S376 WeakPolarHBondContact O-CB 3.19Å; K372-S376 PolarHBondContact O-N 3.18Å; K372-S376 PolarHBondContact O-OG 2.9Å; I373-S376 WeakPolarHBondContact O-CB 3.1Å; I373-S376 PolarHBondContact O-N 3Å; V374-S376 VanDerWaalsContact C-N 3.28Å; V374-S376 PolarHBondContact O-N 3.21Å; S376-K379 PolarHBondContact O-N 3.26Å; S376-L380 WeakPolarHBondContact O-CG 3.36Å; S376-L380 PolarHBondContact O-N 3.42Å
377	I	97.3	Very high	96.5	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-69.9	-38.5	175.4	-67.2	161.7	0	0	0	111.2	W331 M352 M353 L355 I373 V374 K379 L380 K381	W331-I377 HydrophobicContact CH2-CG1 4.13Å; M352-I377 WeakPolarHBondContact O-CD1 3.29Å; M353-I377 HydrophobicContact CE-CG2 4.15Å; M353-I377 HydrophobicContact SD-CG2 4.43Å; L355-I377 HydrophobicContact CB-CD1 3.92Å; L355-I377 HydrophobicContact CD1-CD1 3.77Å; L355-I377 HydrophobicContact CG-CD1 4.46Å; I373-I377 HydrophobicContact CG2-CD1 3.5Å; I373-I377 HydrophobicContact CG2-CG1 4.43Å; I373-I377 WeakPolarHBondContact O-CG1 3.48Å; I373-I377 PolarHBondContact O-N 2.9Å; V374-I377 PolarHBondContact O-N 3.18Å; I377-K379 VanDerWaalsContact C-N 3.29Å; I377-K379 PolarHBondContact O-N 2.91Å; I377-L380 WeakPolarHBondContact O-CA 3.05Å; I377-L380 VanDerWaalsContact O-CB 3.32Å; I377-L380 WeakPolarHBondContact O-CB 3.13Å; I377-L380 PolarHBondContact O-N 3.48Å; I377-K381 PolarHBondContact O-N 3.15Å; I377-K381 VanDerWaalsContact O-N 3.12Å
378	Q	97.1	Very high	96.4	Very high	87 Å²	87	55.2 Å²	55.2	41%	0.407	28%	0.279	S	S	.	.	H	α-helix	trans	-59	-42.8	173.9	178.4	54.2	28	0	0	111.1	V374 I375 L380 K381 E382	V374-Q378 WeakPolarHBondContact O-CB 3.17Å; V374-Q378 PolarHBondContact O-N 2.73Å; I375-Q378 PolarHBondContact O-N 2.93Å; Q378-L380 VanDerWaalsContact C-N 3.27Å; Q378-L380 PolarHBondContact O-N 2.88Å; Q378-K381 WeakPolarHBondContact O-CB 3.41Å; Q378-K381 PolarHBondContact O-N 3.2Å; Q378-E382 WeakPolarHBondContact CG-OE1 3.25Å; Q378-E382 PolarHBondContact NE2-OE1 3.18Å; Q378-E382 WeakPolarHBondContact O-CG 3.3Å; Q378-E382 PolarHBondContact O-N 3.46Å
379	K	96.2	Very high	96.3	Very high	134 Å²	134	53.9 Å²	53.9	58%	0.583	26%	0.26	S	S	*	.	H	α-helix	trans	-62.2	-29.6	170.7	-70	-173.2	177.3	-156.3	0	113.8	I375 S376 I377 K381 E382 R383	I375-K379 WeakPolarHBondContact O-CG 3.5Å; I375-K379 PolarHBondContact O-N 3.18Å; I375-K379 VanDerWaalsContact O-N 3.1Å; S376-K379 PolarHBondContact O-N 3.26Å; I377-K379 VanDerWaalsContact C-N 3.29Å; I377-K379 PolarHBondContact O-N 2.91Å; K379-K381 VanDerWaalsContact C-N 3.32Å; K379-E382 PolarHBondContact O-N 2.84Å; K379-R383 WeakPolarHBondContact O-CG 3.47Å; K379-R383 PolarHBondContact O-N 3Å
380	L	96.4	Very high	96.2	Very high	9 Å²	9	53.7 Å²	53.7	5%	0.047	26%	0.258	C	S	.	.	H	α-helix	trans	-69.8	-27.6	173.1	-62.8	-171.4	0	0	0	112.9	W331 M353 S376 I377 Q378 R383 T413	W331-L380 HydrophobicContact CH2-CD1 3.62Å; W331-L380 HydrophobicContact CH2-CG 4.29Å; W331-L380 HydrophobicContact CZ2-CD1 3.47Å; W331-L380 VanDerWaalsContact CZ2-CD1 3.47Å; W331-L380 HydrophobicContact CZ2-CD2 4.02Å; W331-L380 HydrophobicContact CZ2-CG 3.75Å; W331-L380 HydrophobicContact CZ3-CD1 4.3Å; M353-L380 HydrophobicContact CE-CB 4.04Å; M353-L380 HydrophobicContact CE-CD1 3.7Å; M353-L380 HydrophobicContact SD-CB 4.2Å; S376-L380 WeakPolarHBondContact O-CG 3.36Å; S376-L380 PolarHBondContact O-N 3.42Å; I377-L380 WeakPolarHBondContact O-CA 3.05Å; I377-L380 VanDerWaalsContact O-CB 3.32Å; I377-L380 WeakPolarHBondContact O-CB 3.13Å; I377-L380 PolarHBondContact O-N 3.48Å; Q378-L380 VanDerWaalsContact C-N 3.27Å; Q378-L380 PolarHBondContact O-N 2.88Å; L380-R383 PolarHBondContact O-NE 3.34Å; L380-R383 PolarHBondContact O-NH2 3.04Å; L380-T413 HydrophobicContact CD2-CG2 3.82Å
381	K	94.4	Very high	96	Very high	99 Å²	99	54.3 Å²	54.3	43%	0.43	26%	0.262	S	S	.	.	H	α-helix	trans	-75.2	-42.2	172.6	-62.9	172.4	-179.8	174.9	0	111.3	M353 I377 Q378 K379 R383	M353-K381 WeakPolarHBondContact O-CE 3.31Å; M353-K381 PolarHBondContact O-NZ 3.44Å; M353-K381 HydrophobicContact SD-CG 4.38Å; I377-K381 PolarHBondContact O-N 3.15Å; I377-K381 VanDerWaalsContact O-N 3.12Å; Q378-K381 WeakPolarHBondContact O-CB 3.41Å; Q378-K381 PolarHBondContact O-N 3.2Å; K379-K381 VanDerWaalsContact C-N 3.32Å; K381-R383 PolarHBondContact O-N 3.44Å; K381-R383 VanDerWaalsContact O-N 3.15Å
382	E	95.4	Very high	95.8	Very high	86 Å²	86	55.2 Å²	55.2	40%	0.402	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-18.3	-178.3	-72.1	160.8	-176.7	0	0	114.3	Q378 K379 Q384 N385 L386	Q378-E382 WeakPolarHBondContact CG-OE1 3.25Å; Q378-E382 PolarHBondContact NE2-OE1 3.18Å; Q378-E382 WeakPolarHBondContact O-CG 3.3Å; Q378-E382 PolarHBondContact O-N 3.46Å; K379-E382 PolarHBondContact O-N 2.84Å; E382-Q384 VanDerWaalsContact C-N 3.26Å; E382-Q384 PolarHBondContact O-N 3.06Å; E382-Q384 VanDerWaalsContact O-N 3.15Å; E382-N385 PolarHBondContact O-N 3.49Å; E382-L386 PolarHBondContact O-N 3.37Å
383	R	96	Very high	95.4	Very high	12 Å²	12	53.3 Å²	53.3	5%	0.045	26%	0.255	C	S	.	.	H	α-helix	trans	-50.1	-39	-179.9	-71.8	-179.5	-65.3	178.6	3.7	114.4	Y349 K379 L380 K381 L386 L387 M410 T413 P414 L493	Y349-R383 PolarHBondContact OH-NH2 3.3Å; K379-R383 WeakPolarHBondContact O-CG 3.47Å; K379-R383 PolarHBondContact O-N 3Å; L380-R383 PolarHBondContact O-NE 3.34Å; L380-R383 PolarHBondContact O-NH2 3.04Å; K381-R383 PolarHBondContact O-N 3.44Å; K381-R383 VanDerWaalsContact O-N 3.15Å; R383-L386 PolarHBondContact O-N 3.04Å; R383-L387 WeakPolarHBondContact O-CG 3.45Å; R383-L387 PolarHBondContact O-N 3.26Å; R383-M410 HydrophobicContact CB-CE 3.98Å; R383-M410 HydrophobicContact CB-CG 4.47Å; R383-M410 HydrophobicContact CB-SD 3.96Å; R383-M410 HydrophobicContact CG-CE 4.07Å; R383-M410 HydrophobicContact CG-CG 4.02Å; R383-M410 HydrophobicContact CG-SD 4.14Å; R383-T413 PolarHBondContact NH1-OG1 2.84Å; R383-P414 PolarHBondContact NH1-O 2.85Å; R383-P414 PolarHBondContact NH2-O 2.8Å; R383-L493 HydrophobicContact CB-CD1 3.9Å; R383-L493 HydrophobicContact CB-CD2 4.39Å
384	Q	93.5	Very high	95.1	Very high	48 Å²	48	53.3 Å²	53.3	22%	0.224	26%	0.255	C	S	.	.	H	α-helix	trans	-66.6	-43.3	178.7	-69.5	-178.7	-9.7	0	0	111.7	E382 L386 L387 K388 G491 L493	E382-Q384 VanDerWaalsContact C-N 3.26Å; E382-Q384 PolarHBondContact O-N 3.06Å; E382-Q384 VanDerWaalsContact O-N 3.15Å; Q384-L386 VanDerWaalsContact C-N 3.34Å; Q384-L387 PolarHBondContact O-N 3.15Å; Q384-K388 WeakPolarHBondContact O-CG 3.42Å; Q384-K388 PolarHBondContact O-N 3.06Å; Q384-G491 PolarHBondContact NE2-O 2.7Å; Q384-L493 HydrophobicContact CG-CD1 3.81Å
385	N	94.6	Very high	94.7	Very high	102 Å²	102	56 Å²	56	55%	0.545	27%	0.267	S	S	.	.	H	α-helix	trans	-70.1	-33.4	177.3	-66.9	-21.8	0	0	0	111.7	E382 K388 S389	E382-N385 PolarHBondContact O-N 3.49Å; N385-K388 PolarHBondContact O-N 2.74Å; N385-S389 PolarHBondContact O-N 2.88Å
386	L	95.5	Very high	94.2	Very high	61 Å²	61	58.7 Å²	58.7	32%	0.319	28%	0.278	S	S	.	.	H	α-helix	trans	-61.7	-48	170.2	-178.8	56.7	0	0	0	111.2	E382 R383 Q384 K388 S389 L390 E406 M410	E382-L386 PolarHBondContact O-N 3.37Å; R383-L386 PolarHBondContact O-N 3.04Å; Q384-L386 VanDerWaalsContact C-N 3.34Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.48Å; L386-S389 PolarHBondContact O-N 3.24Å; L386-S389 VanDerWaalsContact O-N 3.15Å; L386-L390 HydrophobicContact CD1-CD1 4.4Å; L386-L390 HydrophobicContact CD1-CD2 4.46Å; L386-L390 HydrophobicContact CD1-CG 4.18Å; L386-L390 HydrophobicContact CG-CD1 4.24Å; L386-L390 HydrophobicContact CG-CG 4.43Å; L386-L390 WeakPolarHBondContact O-CG 3.25Å; L386-L390 PolarHBondContact O-N 2.95Å; L386-E406 HydrophobicContact CD2-CB 4.41Å; L386-M410 HydrophobicContact CB-CE 4.34Å; L386-M410 HydrophobicContact CD2-CE 3.83Å; L386-M410 HydrophobicContact CG-CE 4.14Å
387	L	95.9	Very high	93.1	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-60	-40.9	175.3	-71.3	172.3	0	0	0	112.7	R383 Q384 S389 L390 E391 L407 M410 L493 Q496 F497 V500	R383-L387 WeakPolarHBondContact O-CG 3.45Å; R383-L387 PolarHBondContact O-N 3.26Å; Q384-L387 PolarHBondContact O-N 3.15Å; L387-S389 VanDerWaalsContact C-N 3.33Å; L387-S389 PolarHBondContact O-N 3.03Å; L387-L390 PolarHBondContact O-N 2.88Å; L387-E391 PolarHBondContact O-N 2.9Å; L387-L407 HydrophobicContact CD2-CD2 3.58Å; L387-M410 HydrophobicContact CD1-SD 3.9Å; L387-M410 HydrophobicContact CD2-CE 4Å; L387-M410 HydrophobicContact CD2-SD 3.84Å; L387-M410 HydrophobicContact CG-CE 3.9Å; L387-M410 HydrophobicContact CG-SD 3.78Å; L387-L493 HydrophobicContact CD1-CD1 3.53Å; L387-Q496 HydrophobicContact CD1-CB 3.79Å; L387-F497 HydrophobicContact CD1-CB 4.16Å; L387-F497 HydrophobicContact CD2-CB 4.5Å; L387-F497 HydrophobicContact CD2-CD2 4.24Å; L387-V500 HydrophobicContact CB-CG2 4.14Å; L387-V500 HydrophobicContact CD2-CB 4.26Å; L387-V500 HydrophobicContact CD2-CG2 3.87Å
388	K	94.2	Very high	92.1	Very high	92 Å²	92	62.4 Å²	62.4	40%	0.4	32%	0.319	S	S	.	.	H	α-helix	trans	-60.5	-39.3	174.3	-69.8	171	-174.4	174.1	0	112.1	Q384 N385 L386 E490	Q384-K388 WeakPolarHBondContact O-CG 3.42Å; Q384-K388 PolarHBondContact O-N 3.06Å; N385-K388 PolarHBondContact O-N 2.74Å; L386-K388 VanDerWaalsContact C-N 3.34Å; L386-K388 PolarHBondContact O-N 3.48Å; K388-E490 IonicContact NZ-OE1 3.94Å; K388-E490 PolarHBondContact NZ-OE1 2.77Å
389	S	94.6	Very high	91.5	Very high	34 Å²	34	62.4 Å²	62.4	24%	0.238	33%	0.329	C	S	.	.	H	α-helix	trans	-66.1	-52.1	172.2	-166.2	0	0	0	0	111.1	N385 L386 L387 E391 R392 D393	N385-S389 PolarHBondContact O-N 2.88Å; L386-S389 PolarHBondContact O-N 3.24Å; L386-S389 VanDerWaalsContact O-N 3.15Å; L387-S389 VanDerWaalsContact C-N 3.33Å; L387-S389 PolarHBondContact O-N 3.03Å; S389-E391 VanDerWaalsContact C-N 3.26Å; S389-E391 PolarHBondContact O-N 3.5Å; S389-R392 WeakPolarHBondContact O-CA 3.5Å; S389-R392 WeakPolarHBondContact O-CB 3.25Å; S389-R392 PolarHBondContact O-N 3.18Å; S389-R392 PolarHBondContact OG-NH2 3.11Å; S389-D393 PolarHBondContact O-N 2.74Å; S389-D393 PolarHBondContact OG-OD2 3.35Å
390	L	95.1	Very high	91.3	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-57.9	-37.4	-177.7	-65.6	-179.8	0	0	0	112.2	L386 L387 R392 D393 I394 P403 E406 L407 V500	L386-L390 HydrophobicContact CD1-CD1 4.4Å; L386-L390 HydrophobicContact CD1-CD2 4.46Å; L386-L390 HydrophobicContact CD1-CG 4.18Å; L386-L390 HydrophobicContact CG-CD1 4.24Å; L386-L390 HydrophobicContact CG-CG 4.43Å; L386-L390 WeakPolarHBondContact O-CG 3.25Å; L386-L390 PolarHBondContact O-N 2.95Å; L387-L390 PolarHBondContact O-N 2.88Å; L390-R392 PolarHBondContact O-N 3.15Å; L390-D393 PolarHBondContact O-N 2.98Å; L390-I394 WeakPolarHBondContact O-CB 3.34Å; L390-I394 WeakPolarHBondContact O-CD1 3.31Å; L390-I394 WeakPolarHBondContact O-CG1 3.35Å; L390-I394 PolarHBondContact O-N 2.86Å; L390-P403 HydrophobicContact CD2-CB 4.07Å; L390-P403 HydrophobicContact CD2-CG 4.07Å; L390-E406 HydrophobicContact CD1-CB 3.99Å; L390-L407 HydrophobicContact CD1-CG 4.44Å; L390-V500 HydrophobicContact CB-CG1 4.19Å
391	E	93.9	Very high	91.1	Very high	39 Å²	39	63.9 Å²	63.9	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-57.8	-46.1	172.9	178.7	153.6	-148.9	0	0	112	L387 S389 I395 R499 V500 K503	L387-E391 PolarHBondContact O-N 2.9Å; S389-E391 VanDerWaalsContact C-N 3.26Å; S389-E391 PolarHBondContact O-N 3.5Å; E391-I395 HydrophobicContact CG-CD1 3.87Å; E391-I395 WeakPolarHBondContact O-CD1 3.5Å; E391-I395 WeakPolarHBondContact O-CG1 3.44Å; E391-I395 PolarHBondContact O-N 2.89Å; E391-R499 WeakPolarHBondContact OE1-CD 3.41Å; E391-R499 WeakPolarHBondContact OE1-CG 3.45Å; E391-R499 WeakPolarHBondContact OE2-CD 3.34Å; E391-V500 HydrophobicContact CB-CG2 4.14Å; E391-K503 HydrophobicContact CG-CG 4.27Å; E391-K503 WeakPolarHBondContact OE1-CE 3.34Å; E391-K503 IonicContact OE1-NZ 2.73Å
392	R	92.3	Very high	91	Very high	120 Å²	120	63.4 Å²	63.4	45%	0.453	34%	0.336	S	S	.	.	H	α-helix	trans	-64.9	-50.3	175.7	-175	-162.7	65.3	-114.7	-13.2	111.3	S389 L390 I394 I395 E396	S389-R392 WeakPolarHBondContact O-CA 3.5Å; S389-R392 WeakPolarHBondContact O-CB 3.25Å; S389-R392 PolarHBondContact O-N 3.18Å; S389-R392 PolarHBondContact OG-NH2 3.11Å; L390-R392 PolarHBondContact O-N 3.15Å; R392-I394 PolarHBondContact O-N 3.16Å; R392-I395 WeakPolarHBondContact O-CA 3.42Å; R392-I395 PolarHBondContact O-N 3.29Å; R392-E396 WeakPolarHBondContact CD-OE1 3.49Å; R392-E396 HydrophobicContact CG-CG 4.27Å; R392-E396 WeakPolarHBondContact CG-OE1 3.4Å; R392-E396 IonicContact NE-OE1 3.37Å; R392-E396 IonicContact NE-OE2 3.18Å; R392-E396 WeakPolarHBondContact O-CG 3.38Å; R392-E396 PolarHBondContact O-N 3.43Å
393	D	90.1	Very high	91	Very high	50 Å²	50	59.7 Å²	59.7	27%	0.267	32%	0.319	S	S	.	.	H	α-helix	trans	-61.1	-29	-175.7	-56.7	-37.2	0	0	0	112.3	S389 L390 G398	S389-D393 PolarHBondContact O-N 2.74Å; S389-D393 PolarHBondContact OG-OD2 3.35Å; L390-D393 PolarHBondContact O-N 2.98Å; D393-G398 PolarHBondContact O-N 3.35Å
394	I	92.3	Very high	91	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-77.1	-38.5	172.1	-67	161.4	0	0	0	111.8	L390 R392 G397 L400 P403 V500 K503 V504 Q507	L390-I394 WeakPolarHBondContact O-CB 3.34Å; L390-I394 WeakPolarHBondContact O-CD1 3.31Å; L390-I394 WeakPolarHBondContact O-CG1 3.35Å; L390-I394 PolarHBondContact O-N 2.86Å; R392-I394 PolarHBondContact O-N 3.16Å; I394-G397 PolarHBondContact O-N 3.42Å; I394-L400 HydrophobicContact CG1-CD2 4.25Å; I394-L400 HydrophobicContact CG2-CD2 4.15Å; I394-P403 HydrophobicContact CD1-CB 3.87Å; I394-P403 HydrophobicContact CD1-CG 4.21Å; I394-P403 HydrophobicContact CG1-CB 3.97Å; I394-P403 HydrophobicContact CG1-CG 3.75Å; I394-V500 HydrophobicContact CD1-CG1 3.63Å; I394-K503 HydrophobicContact CG2-CB 3.82Å; I394-V504 HydrophobicContact CD1-CG2 3.5Å; I394-V504 VanDerWaalsContact CD1-CG2 3.5Å; I394-V504 HydrophobicContact CG1-CG2 4.42Å; I394-Q507 HydrophobicContact CG2-CB 4.37Å; I394-Q507 HydrophobicContact CG2-CG 3.6Å; I394-Q507 PolarHBondContact O-NE2 3.49Å
395	I	88.8	Confident	91.1	Very high	99 Å²	99	62.1 Å²	62.1	51%	0.508	33%	0.332	S	S	.	.	H	α-helix	trans	-68.7	-36.2	178.5	-70.7	165	0	0	0	110.9	E391 R392 G397 K503	E391-I395 HydrophobicContact CG-CD1 3.87Å; E391-I395 WeakPolarHBondContact O-CD1 3.5Å; E391-I395 WeakPolarHBondContact O-CG1 3.44Å; E391-I395 PolarHBondContact O-N 2.89Å; R392-I395 WeakPolarHBondContact O-CA 3.42Å; R392-I395 PolarHBondContact O-N 3.29Å; I395-G397 PolarHBondContact O-N 2.93Å; I395-G397 VanDerWaalsContact O-N 3.16Å; I395-K503 HydrophobicContact CD1-CD 4.31Å; I395-K503 HydrophobicContact CG1-CD 4.23Å
396	E	86.5	Confident	91.3	Very high	135 Å²	135	60 Å²	60	63%	0.631	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-2.4	176.1	-70.3	172.2	179	0	0	113.9	R392	R392-E396 WeakPolarHBondContact CD-OE1 3.49Å; R392-E396 HydrophobicContact CG-CG 4.27Å; R392-E396 WeakPolarHBondContact CG-OE1 3.4Å; R392-E396 IonicContact NE-OE1 3.37Å; R392-E396 IonicContact NE-OE2 3.18Å; R392-E396 WeakPolarHBondContact O-CG 3.38Å; R392-E396 PolarHBondContact O-N 3.43Å
397	G	74.1	Confident	91.3	Very high	52 Å²	52	57.1 Å²	57.1	54%	0.536	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	20	173.3	0	0	0	0	0	115.1	I394 I395	I394-G397 PolarHBondContact O-N 3.42Å; I395-G397 PolarHBondContact O-N 2.93Å; I395-G397 VanDerWaalsContact O-N 3.16Å
398	G	76.4	Confident	91.4	Very high	43 Å²	43	58 Å²	58	44%	0.443	31%	0.307	S	S	.	.			trans	-68.7	171.6	178.3	0	0	0	0	0	114.9	D393 L400	D393-G398 PolarHBondContact O-N 3.35Å; G398-L400 PolarHBondContact O-N 3.38Å
399	S	86.2	Confident	91.5	Very high	87 Å²	87	58.3 Å²	58.3	61%	0.608	31%	0.31	S	S	*	.			trans	-67.2	120.4	177.4	-176.9	0	0	0	0	111.8	R401 P403	S399-R401 PolarHBondContact O-N 3.17Å; S399-P403 WeakPolarHBondContact O-CD 3.43Å
400	L	91.4	Very high	91.6	Very high	13 Å²	13	57 Å²	57	7%	0.068	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.7	-179.4	-63.1	177.9	0	0	0	114.6	I394 G398 V402 P403 L404 Q507 L508	I394-L400 HydrophobicContact CG1-CD2 4.25Å; I394-L400 HydrophobicContact CG2-CD2 4.15Å; G398-L400 PolarHBondContact O-N 3.38Å; L400-V402 VanDerWaalsContact C-N 3.34Å; L400-V402 PolarHBondContact O-N 3.45Å; L400-P403 WeakPolarHBondContact O-CD 3.31Å; L400-L404 HydrophobicContact CB-CD1 4.23Å; L400-L404 VanDerWaalsContact O-CB 3.31Å; L400-L404 WeakPolarHBondContact O-CB 3.49Å; L400-L404 VanDerWaalsContact O-CG 3.29Å; L400-L404 WeakPolarHBondContact O-CG 3.47Å; L400-L404 PolarHBondContact O-N 2.9Å; L400-Q507 HydrophobicContact CD1-CB 3.97Å; L400-Q507 HydrophobicContact CD2-CB 3.87Å; L400-Q507 HydrophobicContact CD2-CG 4.35Å; L400-Q507 HydrophobicContact CG-CB 4.39Å; L400-L508 HydrophobicContact CD1-CD2 3.58Å; L400-L508 HydrophobicContact CD1-CG 3.83Å
401	R	91.7	Very high	91.6	Very high	162 Å²	162	57.2 Å²	57.2	61%	0.611	30%	0.301	S	S	*	.	H	α-helix	trans	-57.9	-42.1	-177.9	-168.3	-178.2	-168.8	-165.2	7.2	113	S399 Q405	S399-R401 PolarHBondContact O-N 3.17Å; R401-Q405 WeakPolarHBondContact O-CB 3.41Å; R401-Q405 PolarHBondContact O-N 2.89Å; R401-Q405 VanDerWaalsContact O-N 3.07Å
402	V	93.4	Very high	91.7	Very high	89 Å²	89	59.9 Å²	59.9	54%	0.539	32%	0.316	S	S	.	.	H	α-helix	trans	-73.4	-50	-179.4	175.3	0	0	0	0	111.5	L400 L404 Q405 E406	L400-V402 VanDerWaalsContact C-N 3.34Å; L400-V402 PolarHBondContact O-N 3.45Å; V402-L404 VanDerWaalsContact C-N 3.34Å; V402-L404 PolarHBondContact O-N 3.05Å; V402-Q405 PolarHBondContact O-N 2.72Å; V402-Q405 VanDerWaalsContact O-N 3.16Å; V402-E406 PolarHBondContact O-N 2.87Å
403	P	94.7	Very high	91.9	Very high	7 Å²	7	55.1 Å²	55.1	5%	0.045	30%	0.301	C	S	.	.	H	α-helix	trans	-54.1	-44.8	171.8	-25.3	30.6	0	0	0	114.1	L390 I394 S399 L400 Q405 E406 L407	L390-P403 HydrophobicContact CD2-CB 4.07Å; L390-P403 HydrophobicContact CD2-CG 4.07Å; I394-P403 HydrophobicContact CD1-CB 3.87Å; I394-P403 HydrophobicContact CD1-CG 4.21Å; I394-P403 HydrophobicContact CG1-CB 3.97Å; I394-P403 HydrophobicContact CG1-CG 3.75Å; S399-P403 WeakPolarHBondContact O-CD 3.43Å; L400-P403 WeakPolarHBondContact O-CD 3.31Å; P403-Q405 VanDerWaalsContact C-N 3.35Å; P403-Q405 PolarHBondContact O-N 3.33Å; P403-E406 PolarHBondContact O-N 3.29Å; P403-L407 WeakPolarHBondContact O-CB 3.2Å; P403-L407 WeakPolarHBondContact O-CD1 3.21Å; P403-L407 WeakPolarHBondContact O-CG 3.2Å; P403-L407 PolarHBondContact O-N 3.04Å
404	L	95.9	Very high	92.1	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-41.5	176.8	-76.8	169.9	0	0	0	112.4	L400 V402 H408 V504 N517 Y521 L524	L400-L404 HydrophobicContact CB-CD1 4.23Å; L400-L404 VanDerWaalsContact O-CB 3.31Å; L400-L404 WeakPolarHBondContact O-CB 3.49Å; L400-L404 VanDerWaalsContact O-CG 3.29Å; L400-L404 WeakPolarHBondContact O-CG 3.47Å; L400-L404 PolarHBondContact O-N 2.9Å; V402-L404 VanDerWaalsContact C-N 3.34Å; V402-L404 PolarHBondContact O-N 3.05Å; L404-H408 WeakPolarHBondContact O-CB 3.34Å; L404-H408 PolarHBondContact O-N 3Å; L404-V504 HydrophobicContact CD2-CG1 3.94Å; L404-V504 HydrophobicContact CG-CG1 4.35Å; L404-N517 HydrophobicContact CD1-CB 3.86Å; L404-Y521 HydrophobicContact CD2-CD2 3.94Å; L404-Y521 HydrophobicContact CD2-CG 4.44Å; L404-L524 HydrophobicContact CD2-CD2 4.07Å
405	Q	96.3	Very high	92.2	Very high	110 Å²	110	53 Å²	53	51%	0.514	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-47.2	177.1	-175.6	-177	-71.6	0	0	112.1	R401 V402 P403 H408 Q409	R401-Q405 WeakPolarHBondContact O-CB 3.41Å; R401-Q405 PolarHBondContact O-N 2.89Å; R401-Q405 VanDerWaalsContact O-N 3.07Å; V402-Q405 PolarHBondContact O-N 2.72Å; V402-Q405 VanDerWaalsContact O-N 3.16Å; P403-Q405 VanDerWaalsContact C-N 3.35Å; P403-Q405 PolarHBondContact O-N 3.33Å; Q405-H408 WeakPolarHBondContact O-CB 3.4Å; Q405-H408 PolarHBondContact O-N 2.93Å; Q405-Q409 PolarHBondContact O-N 3Å
406	E	97	Very high	92.4	Very high	57 Å²	57	51.3 Å²	51.3	27%	0.266	28%	0.278	S	S	.	.	H	α-helix	trans	-69.2	-40.8	-178.3	-68.8	-50.5	124.7	0	0	112	L386 L390 V402 P403 H408 Q409 M410	L386-E406 HydrophobicContact CD2-CB 4.41Å; L390-E406 HydrophobicContact CD1-CB 3.99Å; V402-E406 PolarHBondContact O-N 2.87Å; P403-E406 PolarHBondContact O-N 3.29Å; E406-H408 VanDerWaalsContact C-N 3.27Å; E406-H408 PolarHBondContact O-N 3.3Å; E406-Q409 PolarHBondContact O-N 2.95Å; E406-Q409 VanDerWaalsContact O-N 3.1Å; E406-M410 WeakPolarHBondContact O-CB 3.05Å; E406-M410 PolarHBondContact O-N 3.07Å
407	L	97.6	Very high	92.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-37.9	171	-66.8	165.7	0	0	0	111.6	L387 L390 P403 Q409 M410 I411 F497 V500 M501 V504 L524	L387-L407 HydrophobicContact CD2-CD2 3.58Å; L390-L407 HydrophobicContact CD1-CG 4.44Å; P403-L407 WeakPolarHBondContact O-CB 3.2Å; P403-L407 WeakPolarHBondContact O-CD1 3.21Å; P403-L407 WeakPolarHBondContact O-CG 3.2Å; P403-L407 PolarHBondContact O-N 3.04Å; L407-Q409 PolarHBondContact O-N 3.22Å; L407-M410 PolarHBondContact O-N 2.78Å; L407-I411 WeakPolarHBondContact O-CG2 3.36Å; L407-I411 PolarHBondContact O-N 3.46Å; L407-F497 HydrophobicContact CB-CE2 4.09Å; L407-F497 HydrophobicContact CB-CZ 3.94Å; L407-F497 HydrophobicContact CD2-CD1 4.49Å; L407-F497 HydrophobicContact CD2-CD2 3.74Å; L407-F497 HydrophobicContact CD2-CE1 4.29Å; L407-F497 HydrophobicContact CD2-CE2 3.52Å; L407-F497 HydrophobicContact CD2-CG 4.24Å; L407-F497 HydrophobicContact CD2-CZ 3.82Å; L407-F497 HydrophobicContact CG-CE2 4.43Å; L407-F497 HydrophobicContact CG-CZ 4.46Å; L407-V500 HydrophobicContact CD1-CG1 3.96Å; L407-V500 HydrophobicContact CD2-CB 4.46Å; L407-V500 HydrophobicContact CD2-CG1 4.12Å; L407-V500 HydrophobicContact CG-CG1 4.5Å; L407-M501 HydrophobicContact CD1-SD 4.12Å; L407-V504 HydrophobicContact CD1-CG2 4.21Å; L407-L524 HydrophobicContact CB-CD1 4.31Å; L407-L524 HydrophobicContact CB-CD2 3.59Å; L407-L524 HydrophobicContact CD1-CD2 4.07Å; L407-L524 HydrophobicContact CG-CD2 4.48Å
408	H	97.1	Very high	93	Very high	21 Å²	21	47.7 Å²	47.7	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-27.8	173.7	-96.1	-39.3	0	0	0	114.5	L404 Q405 E406 L412 S520 Q523 L524 K527	L404-H408 WeakPolarHBondContact O-CB 3.34Å; L404-H408 PolarHBondContact O-N 3Å; Q405-H408 WeakPolarHBondContact O-CB 3.4Å; Q405-H408 PolarHBondContact O-N 2.93Å; E406-H408 VanDerWaalsContact C-N 3.27Å; E406-H408 PolarHBondContact O-N 3.3Å; H408-L412 WeakPolarHBondContact O-CD1 3.29Å; H408-L412 WeakPolarHBondContact O-CG 3.44Å; H408-S520 PolarHBondContact CD2-OG 3.05Å; H408-S520 PolarHBondContact NE2-O 3.39Å; H408-Q523 WeakPolarHBondContact NE2-CB 3.4Å; H408-Q523 PolarHBondContact NE2-O 2.94Å; H408-L524 WeakPolarHBondContact CE1-CD1 3.46Å; H408-L524 WeakPolarHBondContact ND1-CD1 3.33Å; H408-L524 WeakPolarHBondContact NE2-CA 3.4Å; H408-L524 VanDerWaalsContact NE2-CB 3.3Å; H408-L524 WeakPolarHBondContact NE2-CB 3.41Å; H408-L524 PolarHBondContact NE2-N 3.43Å; H408-K527 WeakPolarHBondContact CE1-CD 3.34Å; H408-K527 PolarHBondContact CE1-NZ 3.15Å; H408-K527 PolarHBondContact ND1-NZ 2.97Å
409	Q	95.9	Very high	92.9	Very high	98 Å²	98	48.5 Å²	48.5	46%	0.458	26%	0.26	S	S	.	.	H	α-helix	trans	-76.7	-42.3	169.2	-61.9	-46.9	-79.7	0	0	110.6	Q405 E406 L407 I411 L412	Q405-Q409 PolarHBondContact O-N 3Å; E406-Q409 PolarHBondContact O-N 2.95Å; E406-Q409 VanDerWaalsContact O-N 3.1Å; L407-Q409 PolarHBondContact O-N 3.22Å; Q409-I411 PolarHBondContact O-N 2.99Å; Q409-L412 WeakPolarHBondContact O-CB 3.31Å; Q409-L412 PolarHBondContact O-N 3.39Å; Q409-L412 VanDerWaalsContact O-N 3.09Å
410	M	96.8	Very high	91.4	Very high	7 Å²	7	48.8 Å²	48.8	3%	0.034	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-40.6	-175.1	-168.6	177.5	-56.1	0	0	112.8	R383 L386 L387 E406 L407 L412 T413 L493 F497	R383-M410 HydrophobicContact CB-CE 3.98Å; R383-M410 HydrophobicContact CB-CG 4.47Å; R383-M410 HydrophobicContact CB-SD 3.96Å; R383-M410 HydrophobicContact CG-CE 4.07Å; R383-M410 HydrophobicContact CG-CG 4.02Å; R383-M410 HydrophobicContact CG-SD 4.14Å; L386-M410 HydrophobicContact CB-CE 4.34Å; L386-M410 HydrophobicContact CD2-CE 3.83Å; L386-M410 HydrophobicContact CG-CE 4.14Å; L387-M410 HydrophobicContact CD1-SD 3.9Å; L387-M410 HydrophobicContact CD2-CE 4Å; L387-M410 HydrophobicContact CD2-SD 3.84Å; L387-M410 HydrophobicContact CG-CE 3.9Å; L387-M410 HydrophobicContact CG-SD 3.78Å; E406-M410 WeakPolarHBondContact O-CB 3.05Å; E406-M410 PolarHBondContact O-N 3.07Å; L407-M410 PolarHBondContact O-N 2.78Å; M410-L412 PolarHBondContact O-N 2.92Å; M410-L412 VanDerWaalsContact O-N 3.11Å; M410-T413 PolarHBondContact O-N 3.3Å; M410-T413 PolarHBondContact O-OG1 3.42Å; M410-L493 HydrophobicContact SD-CD1 4.45Å; M410-F497 HydrophobicContact CB-CE2 4.15Å; M410-F497 HydrophobicContact CG-CD2 4.36Å; M410-F497 HydrophobicContact CG-CE2 4.31Å; M410-F497 HydrophobicContact SD-CD2 3.91Å; M410-F497 HydrophobicContact SD-CE2 4.31Å
411	I	96.3	Very high	89.4	Confident	9 Å²	9	52.9 Å²	52.9	5%	0.046	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-4.6	175.6	-161.9	58	0	0	0	114	L407 Q409 I415 F497 L524 K527 H531 F534	L407-I411 WeakPolarHBondContact O-CG2 3.36Å; L407-I411 PolarHBondContact O-N 3.46Å; Q409-I411 PolarHBondContact O-N 2.99Å; I411-I415 HydrophobicContact CD1-CD1 4.45Å; I411-F497 HydrophobicContact CB-CE2 4.38Å; I411-F497 HydrophobicContact CB-CZ 4.12Å; I411-F497 HydrophobicContact CD1-CZ 4.42Å; I411-L524 HydrophobicContact CB-CD1 4.34Å; I411-L524 HydrophobicContact CG2-CD1 3.83Å; I411-K527 HydrophobicContact CG1-CB 3.88Å; I411-K527 HydrophobicContact CG2-CB 4.32Å; I411-K527 HydrophobicContact CG2-CD 3.75Å; I411-H531 HydrophobicContact CD1-CB 4.27Å; I411-F534 HydrophobicContact CD1-CE2 3.49Å; I411-F534 VanDerWaalsContact CD1-CE2 3.49Å; I411-F534 HydrophobicContact CD1-CZ 3.96Å
412	L	94.9	Very high	86.8	Confident	96 Å²	96	50.1 Å²	50.1	50%	0.503	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	13.9	173.7	-58.4	175.3	0	0	0	112.2	H408 Q409 M410	H408-L412 WeakPolarHBondContact O-CD1 3.29Å; H408-L412 WeakPolarHBondContact O-CG 3.44Å; Q409-L412 WeakPolarHBondContact O-CB 3.31Å; Q409-L412 PolarHBondContact O-N 3.39Å; Q409-L412 VanDerWaalsContact O-N 3.09Å; M410-L412 PolarHBondContact O-N 2.92Å; M410-L412 VanDerWaalsContact O-N 3.11Å
413	T	96.3	Very high	83.7	Confident	20 Å²	20	52.5 Å²	52.5	12%	0.123	31%	0.31	C	S	.	.	S	Bend	trans	-113.1	155.1	176.2	65.9	0	0	0	0	110.9	L380 R383 M410 I415	L380-T413 HydrophobicContact CD2-CG2 3.82Å; R383-T413 PolarHBondContact NH1-OG1 2.84Å; M410-T413 PolarHBondContact O-N 3.3Å; M410-T413 PolarHBondContact O-OG1 3.42Å; T413-I415 WeakPolarHBondContact O-CG1 3.35Å; T413-I415 PolarHBondContact O-N 3.36Å
414	P	95.2	Very high	80.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	35%	0.346	C	S	.	.			trans	-63.4	118	-179.1	-20.2	32.7	0	0	0	111.3	V328 W331 Y349 M352 R383	V328-P414 HydrophobicContact CB-CG 4.34Å; V328-P414 HydrophobicContact CG2-CB 3.77Å; V328-P414 HydrophobicContact CG2-CG 3.56Å; W331-P414 HydrophobicContact CB-CG 4.01Å; W331-P414 HydrophobicContact CD2-CG 3.96Å; W331-P414 HydrophobicContact CE3-CG 4.02Å; W331-P414 HydrophobicContact CG-CG 4Å; Y349-P414 HydrophobicContact CE2-CB 4.36Å; M352-P414 HydrophobicContact CE-CB 4.17Å; M352-P414 HydrophobicContact CE-CG 4.47Å; R383-P414 PolarHBondContact NH1-O 2.85Å; R383-P414 PolarHBondContact NH2-O 2.8Å
415	I	94.4	Very high	77.9	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	39%	0.385	C	S	.	.			trans	-118.4	123.5	178.1	-63.3	163.2	0	0	0	107.3	I411 T413 L493 P494 A533	I411-I415 HydrophobicContact CD1-CD1 4.45Å; T413-I415 WeakPolarHBondContact O-CG1 3.35Å; T413-I415 PolarHBondContact O-N 3.36Å; I415-L493 HydrophobicContact CG1-CD2 4.07Å; I415-L493 HydrophobicContact CG2-CD2 4.23Å; I415-P494 HydrophobicContact CG2-CG 3.88Å; I415-A533 HydrophobicContact CB-CB 4.23Å; I415-A533 HydrophobicContact CG2-CB 3.73Å; I415-A533 WeakPolarHBondContact O-CB 3.39Å
416	K	91.7	Very high	74.9	Confident	64 Å²	64	68.2 Å²	68.2	28%	0.278	40%	0.403	S	S	.	.			trans	-80.2	144.9	171.5	-167.2	171.9	-178.5	178.8	0	110.4	Y349 E350	Y349-K416 HydrophobicContact CD1-CB 3.86Å; Y349-K416 HydrophobicContact CD1-CD 3.74Å; Y349-K416 HydrophobicContact CD1-CG 4.41Å; Y349-K416 HydrophobicContact CD2-CB 4.19Å; Y349-K416 HydrophobicContact CE1-CB 3.85Å; Y349-K416 HydrophobicContact CE1-CD 4.43Å; Y349-K416 HydrophobicContact CE2-CB 4.18Å; Y349-K416 HydrophobicContact CG-CB 4.04Å; Y349-K416 HydrophobicContact CG-CD 4.02Å; E350-K416 WeakPolarHBondContact OE1-CD 3.31Å; E350-K416 IonicContact OE1-NZ 2.67Å; E350-K416 PolarHBondContact OE1-NZ 2.8Å; E350-K416 IonicContact OE2-NZ 3.03Å; E350-K416 PolarHBondContact OE2-NZ 3.25Å
417	A	88.2	Confident	71.7	Confident	42 Å²	42	70 Å²	70	35%	0.347	43%	0.427	S	S	.	.			trans	-63.7	138.5	171.4	0	0	0	0	0	110	G419 A533	A417-G419 PolarHBondContact O-N 3.5Å; A417-A533 HydrophobicContact CB-CB 4.39Å
418	Y	85.1	Confident	68.6	Low	69 Å²	69	81 Å²	81	27%	0.271	47%	0.469	S	S	.	.			trans	-77.5	111	176.9	-178.8	-102.6	0	0	0	110.9	P421 P489 D492	Y418-P421 WeakPolarHBondContact OH-CD 3.36Å; Y418-P489 HydrophobicContact CE1-CG 3.76Å; Y418-P489 HydrophobicContact CE2-CG 4.32Å; Y418-P489 VanDerWaalsContact CZ-CG 3.49Å; Y418-P489 VanDerWaalsContact OH-CB 3.29Å; Y418-P489 WeakPolarHBondContact OH-CB 3.3Å; Y418-P489 WeakPolarHBondContact OH-CG 3.44Å; Y418-D492 WeakPolarHBondContact CB-OD1 3.32Å; Y418-D492 HydrophobicContact CD1-CB 3.96Å; Y418-D492 HydrophobicContact CD2-CB 3.73Å; Y418-D492 HydrophobicContact CE1-CB 4.3Å; Y418-D492 HydrophobicContact CE2-CB 4.09Å; Y418-D492 HydrophobicContact CG-CB 3.66Å
419	G	74.1	Confident	65.6	Low	60 Å²	60	86.3 Å²	86.3	62%	0.619	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-93.6	128.6	164.2	0	0	0	0	0	109.8	A417	A417-G419 PolarHBondContact O-N 3.5Å
420	S	55.8	Low	62.5	Low	94 Å²	94	93.5 Å²	93.5	66%	0.657	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-67.4	126.2	178	51.8	0	0	0	0	111.3	S422	S420-S422 PolarHBondContact O-N 3.24Å
421	P	48.3	Very low	59.2	Low	98 Å²	98	101.8 Å²	101.8	64%	0.636	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-68.4	122.6	172.9	28.1	-31.6	0	0	0	110.1	Y418	Y418-P421 WeakPolarHBondContact OH-CD 3.36Å
422	S	38	Very low	56.4	Low	104 Å²	104	107.3 Å²	107.3	73%	0.727	60%	0.603	S	S	*	*			trans	56.3	113.5	173.3	60.2	0	0	0	0	118.7	S420	S420-S422 PolarHBondContact O-N 3.24Å
423	T	27.8	Very low	53.2	Low	140 Å²	140	112.4 Å²	112.4	86%	0.859	62%	0.624	S	S	*	*	S	Bend		-105.9	165.1	95.1	48.2	0	0	0	0	109.1
424	T	28.2	Very low	50.2	Low	131 Å²	131	116 Å²	116	80%	0.804	66%	0.656	S	S	*	*			trans	-69.8	150.7	-169.3	24.5	0	0	0	0	114.2
425	P	42	Very low	47.7	Very low	125 Å²	125	122 Å²	122	81%	0.812	70%	0.695	S	S	*	*			trans	-88.6	109.5	-178.6	33.7	-32.4	0	0	0	112.5
426	E	32.3	Very low	44.5	Very low	193 Å²	193	134 Å²	134	90%	0.902	74%	0.74	S	S	*	*			trans	-150.1	166.2	161.1	-136.8	-165.9	116.2	0	0	113
427	A	30.8	Very low	41.5	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	77%	0.77	S	S	*	*			trans	65.7	123	177.3	0	0	0	0	0	118.1
428	R	31	Very low	39.5	Very low	233 Å²	233	143.7 Å²	143.7	88%	0.879	79%	0.789	S	S	*	*			trans	-70.4	154.7	173.7	-61.5	169.3	-177.8	154.9	-0.1	111.1
429	P	34.7	Very low	36.8	Very low	132 Å²	132	145.9 Å²	145.9	86%	0.857	81%	0.814	S	S	*	*			trans	-60.7	140.2	170.9	27.3	-35.2	0	0	0	111.2
430	R	30.3	Very low	34.6	Very low	248 Å²	248	150 Å²	150	94%	0.936	82%	0.822	S	S	*	*			trans	-135.7	147.8	173.6	-137.1	174.8	-173.1	164.7	1.3	109.6
431	E	29	Very low	33.3	Very low	182 Å²	182	154 Å²	154	85%	0.85	83%	0.832	S	S	*	*			trans	-71.4	155.7	-168.6	-68.8	174.3	102	0	0	114
432	P	36.9	Very low	32.2	Very low	124 Å²	124	152.6 Å²	152.6	81%	0.805	84%	0.835	S	S	*	*			trans	-80	131.7	-176.3	31.6	-34.7	0	0	0	113
433	Q	27.8	Very low	32.7	Very low	203 Å²	203	153.2 Å²	153.2	95%	0.949	84%	0.837	S	S	*	*			trans	-135.3	167.7	165	-76.3	-159.8	-15.4	0	0	112.5
434	A	31.9	Very low	32.6	Very low	97 Å²	97	154.4 Å²	154.4	80%	0.802	83%	0.833	S	S	*	*			trans	-89.7	164.5	-154.2	0	0	0	0	0	115.2
435	P	43.3	Very low	32.6	Very low	126 Å²	126	152.4 Å²	152.4	82%	0.818	82%	0.824	S	S	*	*			trans	-93.8	148.9	-164.3	35.9	-35.2	0	0	0	115
436	R	27.9	Very low	32.1	Very low	257 Å²	257	156 Å²	156	97%	0.97	83%	0.83	S	S	*	*			trans	-142.4	150.5	161.5	-74	-162.8	172.9	-177.2	-1.8	114
437	Q	29	Very low	31.9	Very low	193 Å²	193	151.9 Å²	151.9	90%	0.902	82%	0.822	S	S	*	*			trans	-64.9	176.8	-161.8	-81.2	173.9	-35.1	0	0	119.6
438	P	45.7	Very low	32.7	Very low	116 Å²	116	152.8 Å²	152.8	75%	0.753	82%	0.82	S	S	*	*			trans	-111.7	166.2	-169.7	42.3	-33.5	0	0	0	116.1
439	S	27.3	Very low	32.6	Very low	114 Å²	114	148.1 Å²	148.1	80%	0.797	81%	0.813	S	S	*	*			trans	177.9	158	165.2	-85.6	0	0	0	0	109.4
440	L	28.1	Very low	32.5	Very low	148 Å²	148	145.6 Å²	145.6	78%	0.775	80%	0.797	S	S	*	*			cis	-165.2	171.1	-24.2	-157.7	76.7	0	0	0	107.8
441	M	29.7	Very low	32.7	Very low	178 Å²	178	141.8 Å²	141.8	88%	0.877	79%	0.788	S	S	*	*			trans	74.5	142.8	167.6	-63.4	-171.4	170.3	0	0	120
442	G	24.5	Very low	32.7	Very low	67 Å²	67	139.2 Å²	139.2	69%	0.691	78%	0.78	S	S	*	*			trans	-111.1	-129.3	153.9	0	0	0	0	0	108.3
443	P	48.3	Very low	32.3	Very low	118 Å²	118	137 Å²	137	77%	0.766	78%	0.779	S	S	*	*			cis	-137.6	-158.5	-6.2	27.8	-0.9	0	0	0	113.5
444	E	27	Very low	32.6	Very low	165 Å²	165	131.7 Å²	131.7	77%	0.771	77%	0.77	S	S	*	*			trans	89.1	107.5	153	-50.4	-144	70.6	0	0	122.5
445	S	28.1	Very low	32.5	Very low	88 Å²	88	133.8 Å²	133.8	62%	0.615	77%	0.773	S	S	*	*				53.9	109.4	113.4	-45.9	0	0	0	0	121.8
446	Q	29.7	Very low	32.1	Very low	201 Å²	201	131.9 Å²	131.9	94%	0.939	77%	0.768	S	S	*	*				-173.3	151	115.7	-103.7	152.7	88	0	0	115.5
447	S	30.1	Very low	32.2	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	76%	0.764	S	S	*	*			trans	-124.2	-177.1	169.7	65.1	0	0	0	0	107.9
448	P	46.1	Very low	32.2	Very low	111 Å²	111	120.5 Å²	120.5	72%	0.721	75%	0.753	S	S	*	*			cis	-110.5	-134.1	6.5	26.9	-1.7	0	0	0	111.3
449	D	29.1	Very low	31.6	Very low	136 Å²	136	119.6 Å²	119.6	73%	0.727	76%	0.756	S	S	*	*			cis	-166.6	-178.1	5.7	-142.9	3.5	0	0	0	108.8
450	C	32.8	Very low	31.6	Very low	78 Å²	78	121 Å²	121	53%	0.527	76%	0.759	S	S	.	*			cis	-162.4	150.7	1.8	-155.2	0	0	0	0	111.2
451	K	34.3	Very low	31.7	Very low	169 Å²	169	118.1 Å²	118.1	74%	0.735	76%	0.757	S	S	*	*			trans	58.1	162.7	151.7	-77.8	167.9	157.1	-91.3	0	120.6
452	D	29.1	Very low	31.5	Very low	128 Å²	128	116 Å²	116	68%	0.684	75%	0.754	S	S	*	*			cis	-147.3	135.4	-16.4	-103.1	-40.7	0	0	0	104.8
453	G	29.5	Very low	32.1	Very low	76 Å²	76	119 Å²	119	78%	0.784	76%	0.762	S	S	*	*				96.9	158.2	82.3	0	0	0	0	0	112.2
454	A	32.3	Very low	31.1	Very low	93 Å²	93	119 Å²	119	77%	0.769	76%	0.764	S	S	*	*			cis	-170.9	142.9	-26	0	0	0	0	0	110.4
455	T	30	Very low	31.2	Very low	141 Å²	141	116 Å²	116	87%	0.865	77%	0.768	S	S	*	*			trans	165.2	113.2	152.4	26.3	0	0	0	0	109
456	A	36.5	Very low	31.1	Very low	85 Å²	85	115.1 Å²	115.1	70%	0.702	77%	0.773	S	S	*	*				85.3	132.7	83.2	0	0	0	0	0	113.2
457	T	30.1	Very low	31	Very low	146 Å²	146	110 Å²	110	90%	0.896	77%	0.765	S	S	*	*			cis	-165.8	159.5	-6.3	12.9	0	0	0	0	107.7
458	G	27.5	Very low	30.9	Very low	65 Å²	65	110.8 Å²	110.8	67%	0.67	77%	0.77	S	S	*	*			cis	154	139.1	-5.1	0	0	0	0	0	112.5
459	A	33.5	Very low	29.9	Very low	98 Å²	98	109.4 Å²	109.4	81%	0.81	78%	0.776	S	S	*	*			trans	69.2	148	178.4	0	0	0	0	0	115.9
460	T	28.6	Very low	29.7	Very low	142 Å²	142	106.5 Å²	106.5	87%	0.871	78%	0.778	S	S	*	*			cis	-151.2	170.8	7.4	-14.4	0	0	0	0	107.3
461	A	28.9	Very low	29.4	Very low	88 Å²	88	111.2 Å²	111.2	73%	0.727	80%	0.797	S	S	*	*			cis	-154.2	-162.4	12.7	0	0	0	0	0	112.9
462	T	25.1	Very low	29.1	Very low	133 Å²	133	111.6 Å²	111.6	82%	0.816	80%	0.802	S	S	*	*			trans	-127.1	174.6	179.2	5.9	0	0	0	0	109.3
463	P	37.2	Very low	29.3	Very low	131 Å²	131	110.1 Å²	110.1	85%	0.851	80%	0.799	S	S	*	*			cis	-141.6	-171.8	40.7	41.4	-19.6	0	0	0	117.5
464	S	27.4	Very low	29	Very low	117 Å²	117	114.7 Å²	114.7	82%	0.818	80%	0.8	S	S	*	*			trans	-112.5	148.5	-168.7	171.9	0	0	0	0	113.5
465	A	29	Very low	28.9	Very low	103 Å²	103	118.9 Å²	118.9	85%	0.851	80%	0.803	S	S	*	*			trans	-164.8	143.5	148.9	0	0	0	0	0	109.4
466	G	26.4	Very low	28.6	Very low	69 Å²	69	120.5 Å²	120.5	71%	0.711	81%	0.806	S	S	*	*			cis	173.6	166.1	-9.1	0	0	0	0	0	112.8
467	A	28.1	Very low	28.2	Very low	94 Å²	94	121.8 Å²	121.8	78%	0.777	81%	0.81	S	S	*	*			trans	58.3	108.7	158.8	0	0	0	0	0	121.7
468	S	27.9	Very low	27.9	Very low	124 Å²	124	120.4 Å²	120.4	87%	0.867	81%	0.806	S	S	*	*				65.7	115.1	120.4	-52.9	0	0	0	0	122.6
469	G	25.1	Very low	27.9	Very low	82 Å²	82	123 Å²	123	85%	0.845	81%	0.813	S	S	*	*				111.6	98.3	101.3	0	0	0	0	0	120.5
470	G	24	Very low	27.7	Very low	74 Å²	74	126.2 Å²	126.2	76%	0.763	82%	0.816	S	S	*	*			trans	105.1	154.8	130.3	0	0	0	0	0	120.1
471	L	26.1	Very low	27.7	Very low	177 Å²	177	122.3 Å²	122.3	93%	0.927	80%	0.804	S	S	*	*			trans	66.1	106.3	158.8	-53.8	178.4	0	0	0	119.4
472	Q	28.8	Very low	27.6	Very low	178 Å²	178	127.1 Å²	127.1	83%	0.832	81%	0.811	S	S	*	*			trans	-65.2	156.9	138.8	-115	-159.8	74.9	0	0	109.1
473	P	34.1	Very low	28.3	Very low	97 Å²	97	128.3 Å²	128.3	63%	0.63	81%	0.812	S	S	*	*				-153.3	-175.9	58.5	39.5	-17.6	0	0	0	118.2
474	H	22.2	Very low	28	Very low	172 Å²	172	126.8 Å²	126.8	80%	0.796	81%	0.81	S	S	*	*			trans	84.3	152	157.9	-75.3	-58.6	0	0	0	121
475	Q	30.5	Very low	28.9	Very low	180 Å²	180	125.9 Å²	125.9	84%	0.841	80%	0.8	S	S	*	*			trans	-83.4	148.8	-175.7	-57.1	159.8	-15.5	0	0	110.3
476	L	24	Very low	29.6	Very low	176 Å²	176	124.4 Å²	124.4	92%	0.921	79%	0.788	S	S	*	*				-164.7	152.6	127.3	-107.9	168.4	0	0	0	112.3
477	S	29	Very low	30.9	Very low	112 Å²	112	127.2 Å²	127.2	78%	0.783	79%	0.793	S	S	*	*			trans	-58.6	134	-177.9	160.4	0	0	0	0	114.6
478	S	23.8	Very low	32.7	Very low	116 Å²	116	125.5 Å²	125.5	81%	0.811	77%	0.771	S	S	*	*				-144.6	159.9	127	-161.1	0	0	0	0	110.5
479	C	26.6	Very low	34.6	Very low	121 Å²	121	122.3 Å²	122.3	82%	0.818	75%	0.747	S	S	*	*			trans	-100.8	127.5	-173.8	56.9	0	0	0	0	111.8
480	D	29.7	Very low	36.2	Very low	164 Å²	164	125.3 Å²	125.3	88%	0.877	74%	0.739	S	S	*	*			trans	-126.8	146.7	156.7	-149.9	-31.2	0	0	0	107.8
481	G	28.1	Very low	38.5	Very low	60 Å²	60	123.4 Å²	123.4	62%	0.619	72%	0.72	S	S	*	*			trans	-172.7	31.7	-151.3	0	0	0	0	0	116.7	L483	G481-L483 PolarHBondContact O-N 3.07Å
482	E	27.8	Very low	41.4	Very low	189 Å²	189	115.6 Å²	115.6	88%	0.883	68%	0.679	S	S	*	*			trans	-59.5	122.6	165.8	-134.5	-156.7	124.2	0	0	109.8	A484	E482-A484 PolarHBondContact O-N 2.97Å
483	L	38	Very low	44.5	Very low	158 Å²	158	107.7 Å²	107.7	83%	0.827	64%	0.642	S	S	*	*			trans	-80.3	82.1	-170.1	-79.2	172.6	0	0	0	111.8	G481 V485	G481-L483 PolarHBondContact O-N 3.07Å; L483-V485 WeakPolarHBondContact O-CG2 3.4Å; L483-V485 PolarHBondContact O-N 3.44Å
484	A	32.3	Very low	47.3	Very low	99 Å²	99	103.2 Å²	103.2	82%	0.818	61%	0.613	S	S	*	*			trans	-54.5	104	162.7	0	0	0	0	0	110	E482 A486	E482-A484 PolarHBondContact O-N 2.97Å; A484-A486 PolarHBondContact O-N 2.83Å; A484-A486 VanDerWaalsContact O-N 3.1Å
485	V	46.4	Very low	50.8	Low	98 Å²	98	95.3 Å²	95.3	59%	0.594	58%	0.578	S	S	*	*			trans	-75.8	102.9	-174.3	177.7	0	0	0	0	109.8	L483	L483-V485 WeakPolarHBondContact O-CG2 3.4Å; L483-V485 PolarHBondContact O-N 3.44Å
486	A	42.6	Very low	53.8	Low	73 Å²	73	87.7 Å²	87.7	60%	0.603	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-52.2	138.5	171.1	0	0	0	0	0	111.3	A484 L488 R499	A484-A486 PolarHBondContact O-N 2.83Å; A484-A486 VanDerWaalsContact O-N 3.1Å; A486-L488 PolarHBondContact O-N 2.84Å; A486-R499 PolarHBondContact O-NH2 2.92Å
487	P	53.6	Low	57.3	Low	127 Å²	127	79.3 Å²	79.3	83%	0.825	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-56	126	170.1	-24.2	34.4	0	0	0	110.1
488	L	65.7	Low	60.5	Low	59 Å²	59	74.3 Å²	74.3	31%	0.309	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-75.9	138.1	168.4	-81.4	171.9	0	0	0	108.4	A486 Q496 R499	A486-L488 PolarHBondContact O-N 2.84Å; L488-Q496 HydrophobicContact CD1-CG 4.32Å; L488-R499 HydrophobicContact CD1-CB 4.4Å
489	P	67.5	Low	63.9	Low	56 Å²	56	72.1 Å²	72.1	36%	0.364	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-63.3	140	178.3	26.4	-33.8	0	0	0	111	Y418 G491 D492	Y418-P489 HydrophobicContact CE1-CG 3.76Å; Y418-P489 HydrophobicContact CE2-CG 4.32Å; Y418-P489 VanDerWaalsContact CZ-CG 3.49Å; Y418-P489 VanDerWaalsContact OH-CB 3.29Å; Y418-P489 WeakPolarHBondContact OH-CB 3.3Å; Y418-P489 WeakPolarHBondContact OH-CG 3.44Å; P489-G491 PolarHBondContact O-N 2.9Å; P489-G491 VanDerWaalsContact O-N 3.14Å; P489-D492 HydrophobicContact CG-CB 4.24Å; P489-D492 PolarHBondContact O-N 3.1Å; P489-D492 VanDerWaalsContact O-N 3.15Å
490	E	60.5	Low	67.3	Low	146 Å²	146	66.4 Å²	66.4	68%	0.682	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	112.3	177	-171	138.3	-109.8	0	0	109.4	K388	K388-E490 IonicContact NZ-OE1 3.94Å; K388-E490 PolarHBondContact NZ-OE1 2.77Å
491	G	70.5	Confident	70.5	Confident	34 Å²	34	58.6 Å²	58.6	35%	0.351	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	135.7	-37.6	-165.6	0	0	0	0	0	113.1	Q384 P489 L493	Q384-G491 PolarHBondContact NE2-O 2.7Å; P489-G491 PolarHBondContact O-N 2.9Å; P489-G491 VanDerWaalsContact O-N 3.14Å; G491-L493 VanDerWaalsContact C-N 3.32Å; G491-L493 PolarHBondContact O-N 3.33Å
492	D	88.4	Confident	73.7	Confident	13 Å²	13	56.2 Å²	56.2	7%	0.07	33%	0.332	C	S	.	.			trans	-75.2	77.3	-175.1	-173.8	10.2	0	0	0	112.9	Y418 P489 P494 G495 Q496	Y418-D492 WeakPolarHBondContact CB-OD1 3.32Å; Y418-D492 HydrophobicContact CD1-CB 3.96Å; Y418-D492 HydrophobicContact CD2-CB 3.73Å; Y418-D492 HydrophobicContact CE1-CB 4.3Å; Y418-D492 HydrophobicContact CE2-CB 4.09Å; Y418-D492 HydrophobicContact CG-CB 3.66Å; P489-D492 HydrophobicContact CG-CB 4.24Å; P489-D492 PolarHBondContact O-N 3.1Å; P489-D492 VanDerWaalsContact O-N 3.15Å; D492-P494 WeakPolarHBondContact OD1-CD 3.02Å; D492-G495 PolarHBondContact O-N 3.34Å; D492-G495 WeakPolarHBondContact OD1-CA 3.41Å; D492-G495 PolarHBondContact OD1-N 2.89Å; D492-G495 WeakPolarHBondContact OD2-CA 3.27Å; D492-Q496 WeakPolarHBondContact O-CB 3.44Å; D492-Q496 VanDerWaalsContact O-CG 3.28Å; D492-Q496 WeakPolarHBondContact O-CG 3.32Å; D492-Q496 PolarHBondContact O-N 2.73Å
493	L	92.6	Very high	76.9	Confident	11 Å²	11	50.6 Å²	50.6	6%	0.058	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-43.8	176.6	-172.9	70.2	0	0	0	112.6	R383 Q384 L387 M410 I415 G491 G495 Q496 F497	R383-L493 HydrophobicContact CB-CD1 3.9Å; R383-L493 HydrophobicContact CB-CD2 4.39Å; Q384-L493 HydrophobicContact CG-CD1 3.81Å; L387-L493 HydrophobicContact CD1-CD1 3.53Å; M410-L493 HydrophobicContact SD-CD1 4.45Å; I415-L493 HydrophobicContact CG1-CD2 4.07Å; I415-L493 HydrophobicContact CG2-CD2 4.23Å; G491-L493 VanDerWaalsContact C-N 3.32Å; G491-L493 PolarHBondContact O-N 3.33Å; L493-G495 PolarHBondContact O-N 3.16Å; L493-Q496 PolarHBondContact O-N 2.94Å; L493-F497 VanDerWaalsContact O-CB 3.25Å; L493-F497 WeakPolarHBondContact O-CB 3.43Å; L493-F497 PolarHBondContact O-N 2.92Å
494	P	94.2	Very high	79.6	Confident	3 Å²	3	43 Å²	43	2%	0.019	27%	0.265	C	S	.	.	H	α-helix	trans	-60.5	-39.2	173.4	-23.4	34.2	0	0	0	113.7	I415 D492 T498 A533 F534	I415-P494 HydrophobicContact CG2-CG 3.88Å; D492-P494 WeakPolarHBondContact OD1-CD 3.02Å; P494-T498 WeakPolarHBondContact O-CB 3.3Å; P494-T498 PolarHBondContact O-N 2.73Å; P494-T498 PolarHBondContact O-OG1 3.26Å; P494-A533 WeakPolarHBondContact CB-O 3.5Å; P494-A533 HydrophobicContact CG-CB 4.25Å; P494-A533 VanDerWaalsContact CG-O 3.31Å; P494-A533 WeakPolarHBondContact CG-O 3.16Å; P494-F534 HydrophobicContact CB-CD1 4.31Å; P494-F534 HydrophobicContact CB-CE1 4.4Å
495	G	94.5	Very high	82.6	Confident	6 Å²	6	38.4 Å²	38.4	6%	0.062	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-43.7	177.7	0	0	0	0	0	113	D492 L493 F497 T498 R499	D492-G495 PolarHBondContact O-N 3.34Å; D492-G495 WeakPolarHBondContact OD1-CA 3.41Å; D492-G495 PolarHBondContact OD1-N 2.89Å; D492-G495 WeakPolarHBondContact OD2-CA 3.27Å; L493-G495 PolarHBondContact O-N 3.16Å; G495-F497 VanDerWaalsContact C-N 3.34Å; G495-T498 PolarHBondContact O-N 3.25Å; G495-R499 WeakPolarHBondContact O-CB 2.95Å; G495-R499 PolarHBondContact O-N 2.86Å
496	Q	94.4	Very high	84.8	Confident	20 Å²	20	37.6 Å²	37.6	9%	0.093	22%	0.222	C	C	.	.	H	α-helix	trans	-60.7	-43.9	172.4	-71.5	173.9	35	0	0	110.7	L387 L488 D492 L493 T498 R499 V500	L387-Q496 HydrophobicContact CD1-CB 3.79Å; L488-Q496 HydrophobicContact CD1-CG 4.32Å; D492-Q496 WeakPolarHBondContact O-CB 3.44Å; D492-Q496 VanDerWaalsContact O-CG 3.28Å; D492-Q496 WeakPolarHBondContact O-CG 3.32Å; D492-Q496 PolarHBondContact O-N 2.73Å; L493-Q496 PolarHBondContact O-N 2.94Å; Q496-T498 VanDerWaalsContact C-N 3.35Å; Q496-T498 PolarHBondContact O-N 2.91Å; Q496-R499 WeakPolarHBondContact O-CB 3.35Å; Q496-R499 PolarHBondContact O-N 3.04Å; Q496-V500 WeakPolarHBondContact O-CG2 3.22Å; Q496-V500 PolarHBondContact O-N 3.13Å
497	F	97.1	Very high	87.1	Confident	1 Å²	1	36.5 Å²	36.5	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-44.4	175.2	-169.6	-73.1	0	0	0	111.4	L387 L407 M410 I411 L493 G495 R499 V500 M501 L524 C528 F534	L387-F497 HydrophobicContact CD1-CB 4.16Å; L387-F497 HydrophobicContact CD2-CB 4.5Å; L387-F497 HydrophobicContact CD2-CD2 4.24Å; L407-F497 HydrophobicContact CB-CE2 4.09Å; L407-F497 HydrophobicContact CB-CZ 3.94Å; L407-F497 HydrophobicContact CD2-CD1 4.49Å; L407-F497 HydrophobicContact CD2-CD2 3.74Å; L407-F497 HydrophobicContact CD2-CE1 4.29Å; L407-F497 HydrophobicContact CD2-CE2 3.52Å; L407-F497 HydrophobicContact CD2-CG 4.24Å; L407-F497 HydrophobicContact CD2-CZ 3.82Å; L407-F497 HydrophobicContact CG-CE2 4.43Å; L407-F497 HydrophobicContact CG-CZ 4.46Å; M410-F497 HydrophobicContact CB-CE2 4.15Å; M410-F497 HydrophobicContact CG-CD2 4.36Å; M410-F497 HydrophobicContact CG-CE2 4.31Å; M410-F497 HydrophobicContact SD-CD2 3.91Å; M410-F497 HydrophobicContact SD-CE2 4.31Å; I411-F497 HydrophobicContact CB-CE2 4.38Å; I411-F497 HydrophobicContact CB-CZ 4.12Å; I411-F497 HydrophobicContact CD1-CZ 4.42Å; L493-F497 VanDerWaalsContact O-CB 3.25Å; L493-F497 WeakPolarHBondContact O-CB 3.43Å; L493-F497 PolarHBondContact O-N 2.92Å; G495-F497 VanDerWaalsContact C-N 3.34Å; F497-R499 VanDerWaalsContact C-N 3.31Å; F497-R499 PolarHBondContact O-N 2.96Å; F497-V500 PolarHBondContact O-N 2.97Å; F497-M501 HydrophobicContact CD1-CG 3.69Å; F497-M501 HydrophobicContact CE1-CG 3.53Å; F497-M501 HydrophobicContact CE1-SD 4.05Å; F497-M501 WeakPolarHBondContact O-CB 3.22Å; F497-M501 VanDerWaalsContact O-CG 3.32Å; F497-M501 WeakPolarHBondContact O-CG 3.5Å; F497-M501 PolarHBondContact O-N 3.33Å; F497-L524 HydrophobicContact CZ-CD1 4.08Å; F497-C528 VanDerWaalsContact CE1-SG 3.5Å; F497-F534 HydrophobicContact CB-CE1 4.35Å; F497-F534 HydrophobicContact CB-CZ 4.29Å; F497-F534 AromaticContact CD1-CE1 3.79Å; F497-F534 HydrophobicContact CD1-CE1 3.79Å; F497-F534 AromaticContact CD1-CZ 3.61Å; F497-F534 HydrophobicContact CD1-CZ 3.61Å; F497-F534 HydrophobicContact CE1-CE1 4.49Å; F497-F534 HydrophobicContact CE1-CZ 4.07Å; F497-F534 HydrophobicContact CG-CE1 4.31Å; F497-F534 AromaticContact CG-CZ 3.96Å; F497-F534 HydrophobicContact CG-CZ 3.96Å
498	T	96.4	Very high	88.8	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.043	17%	0.166	C	C	.	.	H	α-helix	trans	-64.3	-35	176.9	-55.7	0	0	0	0	111.8	P494 G495 Q496 M501 G502 Q538 W545	P494-T498 WeakPolarHBondContact O-CB 3.3Å; P494-T498 PolarHBondContact O-N 2.73Å; P494-T498 PolarHBondContact O-OG1 3.26Å; G495-T498 PolarHBondContact O-N 3.25Å; Q496-T498 VanDerWaalsContact C-N 3.35Å; Q496-T498 PolarHBondContact O-N 2.91Å; T498-M501 PolarHBondContact O-N 2.64Å; T498-G502 PolarHBondContact O-N 3.44Å; T498-Q538 HydrophobicContact CG2-CB 4.13Å; T498-Q538 HydrophobicContact CG2-CG 4.13Å; T498-W545 HydrophobicContact CG2-CH2 4.08Å; T498-W545 HydrophobicContact CG2-CZ3 3.98Å; T498-W545 WeakPolarHBondContact O-CH2 3.4Å; T498-W545 WeakPolarHBondContact O-CZ3 3.48Å
499	R	95.4	Very high	89.9	Confident	70 Å²	70	30.8 Å²	30.8	26%	0.264	17%	0.167	S	C	.	.	H	α-helix	trans	-63.7	-50.1	173.8	-176.3	-176.1	-72.7	-156.3	-5	111.1	E391 A486 L488 G495 Q496 F497 M501 G502 K503	E391-R499 WeakPolarHBondContact OE1-CD 3.41Å; E391-R499 WeakPolarHBondContact OE1-CG 3.45Å; E391-R499 WeakPolarHBondContact OE2-CD 3.34Å; A486-R499 PolarHBondContact O-NH2 2.92Å; L488-R499 HydrophobicContact CD1-CB 4.4Å; G495-R499 WeakPolarHBondContact O-CB 2.95Å; G495-R499 PolarHBondContact O-N 2.86Å; Q496-R499 WeakPolarHBondContact O-CB 3.35Å; Q496-R499 PolarHBondContact O-N 3.04Å; F497-R499 VanDerWaalsContact C-N 3.31Å; F497-R499 PolarHBondContact O-N 2.96Å; R499-M501 VanDerWaalsContact C-N 3.34Å; R499-M501 PolarHBondContact O-N 3.13Å; R499-G502 WeakPolarHBondContact O-CA 3.35Å; R499-G502 PolarHBondContact O-N 3.46Å; R499-K503 PolarHBondContact O-N 2.91Å
500	V	96.7	Very high	90.7	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-44.1	175.9	-179.2	0	0	0	0	110.9	L387 L390 E391 I394 L407 Q496 F497 G502 K503 V504	L387-V500 HydrophobicContact CB-CG2 4.14Å; L387-V500 HydrophobicContact CD2-CB 4.26Å; L387-V500 HydrophobicContact CD2-CG2 3.87Å; L390-V500 HydrophobicContact CB-CG1 4.19Å; E391-V500 HydrophobicContact CB-CG2 4.14Å; I394-V500 HydrophobicContact CD1-CG1 3.63Å; L407-V500 HydrophobicContact CD1-CG1 3.96Å; L407-V500 HydrophobicContact CD2-CB 4.46Å; L407-V500 HydrophobicContact CD2-CG1 4.12Å; L407-V500 HydrophobicContact CG-CG1 4.5Å; Q496-V500 WeakPolarHBondContact O-CG2 3.22Å; Q496-V500 PolarHBondContact O-N 3.13Å; F497-V500 PolarHBondContact O-N 2.97Å; V500-G502 PolarHBondContact O-N 2.78Å; V500-K503 PolarHBondContact O-N 2.98Å; V500-V504 WeakPolarHBondContact O-CG2 3.47Å; V500-V504 PolarHBondContact O-N 3.35Å
501	M	96.8	Very high	91.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-57.8	-32.8	173.9	-76	-68.2	-75.1	0	0	113.4	L407 F497 T498 R499 C505 Y521 L524 I525 L542 W545	L407-M501 HydrophobicContact CD1-SD 4.12Å; F497-M501 HydrophobicContact CD1-CG 3.69Å; F497-M501 HydrophobicContact CE1-CG 3.53Å; F497-M501 HydrophobicContact CE1-SD 4.05Å; F497-M501 WeakPolarHBondContact O-CB 3.22Å; F497-M501 VanDerWaalsContact O-CG 3.32Å; F497-M501 WeakPolarHBondContact O-CG 3.5Å; F497-M501 PolarHBondContact O-N 3.33Å; T498-M501 PolarHBondContact O-N 2.64Å; R499-M501 VanDerWaalsContact C-N 3.34Å; R499-M501 PolarHBondContact O-N 3.13Å; M501-C505 PolarHBondContact O-N 3Å; M501-Y521 HydrophobicContact CE-CD2 3.89Å; M501-Y521 HydrophobicContact CE-CE2 3.4Å; M501-Y521 VanDerWaalsContact CE-CE2 3.4Å; M501-Y521 WeakPolarHBondContact O-CE2 3.36Å; M501-Y521 PolarHBondContact O-OH 2.92Å; M501-Y521 HydrophobicContact SD-CD2 4.18Å; M501-Y521 HydrophobicContact SD-CE2 3.73Å; M501-L524 HydrophobicContact CE-CB 4.23Å; M501-L524 HydrophobicContact CE-CD2 3.98Å; M501-L524 HydrophobicContact CE-CG 3.78Å; M501-L524 HydrophobicContact SD-CD2 3.37Å; M501-L524 WeakPolarHBondContact SD-CD2 3.37Å; M501-L524 HydrophobicContact SD-CG 3.74Å; M501-I525 HydrophobicContact CE-CG1 3.56Å; M501-L542 HydrophobicContact CB-CD2 3.9Å; M501-L542 HydrophobicContact CE-CD2 3.9Å; M501-L542 HydrophobicContact CG-CD2 4.15Å; M501-W545 HydrophobicContact CB-CZ3 4.14Å
502	G	95.8	Very high	91.4	Very high	9 Å²	9	39.2 Å²	39.2	9%	0.093	20%	0.195	C	C	.	.	H	α-helix	trans	-69.4	-42.5	172.7	0	0	0	0	0	112.7	T498 R499 V500 C505 T506	T498-G502 PolarHBondContact O-N 3.44Å; R499-G502 WeakPolarHBondContact O-CA 3.35Å; R499-G502 PolarHBondContact O-N 3.46Å; V500-G502 PolarHBondContact O-N 2.78Å; G502-C505 WeakPolarHBondContact O-CA 3.48Å; G502-C505 VanDerWaalsContact O-CB 3.24Å; G502-C505 WeakPolarHBondContact O-CB 3.19Å; G502-C505 PolarHBondContact O-N 3.16Å; G502-C505 VanDerWaalsContact O-N 3.15Å; G502-T506 PolarHBondContact O-N 3.3Å; G502-T506 PolarHBondContact O-OG1 3.12Å
503	K	95.3	Very high	90.4	Very high	71 Å²	71	39.4 Å²	39.4	31%	0.309	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-41.7	174.9	-61.1	-67.9	-171.1	172	0	112	E391 I394 I395 R499 V500 C505 T506 Q507	E391-K503 HydrophobicContact CG-CG 4.27Å; E391-K503 WeakPolarHBondContact OE1-CE 3.34Å; E391-K503 IonicContact OE1-NZ 2.73Å; I394-K503 HydrophobicContact CG2-CB 3.82Å; I395-K503 HydrophobicContact CD1-CD 4.31Å; I395-K503 HydrophobicContact CG1-CD 4.23Å; R499-K503 PolarHBondContact O-N 2.91Å; V500-K503 PolarHBondContact O-N 2.98Å; K503-C505 VanDerWaalsContact C-N 3.32Å; K503-C505 PolarHBondContact O-N 2.91Å; K503-T506 PolarHBondContact O-N 2.94Å; K503-Q507 PolarHBondContact O-N 3.35Å
504	V	95.3	Very high	89.8	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.1	-43.7	171.1	178.6	0	0	0	0	110.3	I394 L404 L407 V500 Q507 L508 Y521	I394-V504 HydrophobicContact CD1-CG2 3.5Å; I394-V504 VanDerWaalsContact CD1-CG2 3.5Å; I394-V504 HydrophobicContact CG1-CG2 4.42Å; L404-V504 HydrophobicContact CD2-CG1 3.94Å; L404-V504 HydrophobicContact CG-CG1 4.35Å; L407-V504 HydrophobicContact CD1-CG2 4.21Å; V500-V504 WeakPolarHBondContact O-CG2 3.47Å; V500-V504 PolarHBondContact O-N 3.35Å; V504-Q507 PolarHBondContact O-N 3.08Å; V504-L508 HydrophobicContact CG1-CD1 3.88Å; V504-L508 HydrophobicContact CG1-CG 4.16Å; V504-L508 WeakPolarHBondContact O-CB 3.33Å; V504-L508 VanDerWaalsContact O-CG 3.25Å; V504-L508 WeakPolarHBondContact O-CG 3.22Å; V504-L508 PolarHBondContact O-N 3.33Å; V504-Y521 HydrophobicContact CB-CD2 4.18Å; V504-Y521 HydrophobicContact CB-CE2 3.91Å; V504-Y521 HydrophobicContact CG1-CD2 3.49Å; V504-Y521 VanDerWaalsContact CG1-CD2 3.49Å; V504-Y521 HydrophobicContact CG1-CE2 3.73Å; V504-Y521 HydrophobicContact CG1-CG 4.31Å
505	C	94.5	Very high	89.4	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-56.4	-53	174.5	-164.7	0	0	0	0	111.6	M501 G502 K503 Q507 L508 L509 Y521 W545	M501-C505 PolarHBondContact O-N 3Å; G502-C505 WeakPolarHBondContact O-CA 3.48Å; G502-C505 VanDerWaalsContact O-CB 3.24Å; G502-C505 WeakPolarHBondContact O-CB 3.19Å; G502-C505 PolarHBondContact O-N 3.16Å; G502-C505 VanDerWaalsContact O-N 3.15Å; K503-C505 VanDerWaalsContact C-N 3.32Å; K503-C505 PolarHBondContact O-N 2.91Å; C505-Q507 VanDerWaalsContact C-N 3.33Å; C505-Q507 PolarHBondContact O-N 3.32Å; C505-L508 CarbonylContact O-C 3.37Å; C505-L508 WeakPolarHBondContact O-CB 3.13Å; C505-L508 PolarHBondContact O-N 3.29Å; C505-L508 VanDerWaalsContact O-N 3.08Å; C505-L509 VanDerWaalsContact O-CG 3.28Å; C505-L509 WeakPolarHBondContact O-CG 3.27Å; C505-L509 PolarHBondContact O-N 3.26Å; C505-Y521 HydrophobicContact CB-CE1 4.41Å; C505-Y521 WeakPolarHBondContact CB-OH 3.44Å; C505-W545 HydrophobicContact CB-CB 4.22Å; C505-W545 HydrophobicContact CB-CD2 4.31Å; C505-W545 HydrophobicContact CB-CG 4Å; C505-W545 VanDerWaalsContact SG-CB 3.56Å
506	T	92.8	Very high	89.2	Confident	82 Å²	82	56.3 Å²	56.3	50%	0.503	28%	0.277	S	S	.	.	H	α-helix	trans	-56.6	-45	179.7	-56.3	0	0	0	0	111.8	G502 K503 L509 V510	G502-T506 PolarHBondContact O-N 3.3Å; G502-T506 PolarHBondContact O-OG1 3.12Å; K503-T506 PolarHBondContact O-N 2.94Å; T506-L509 PolarHBondContact O-N 3.03Å; T506-L509 VanDerWaalsContact O-N 3.16Å; T506-V510 HydrophobicContact CG2-CG2 4.29Å; T506-V510 WeakPolarHBondContact O-CB 3.34Å; T506-V510 WeakPolarHBondContact O-CG2 3.46Å; T506-V510 PolarHBondContact O-N 3.26Å
507	Q	90.2	Very high	89.1	Confident	49 Å²	49	56 Å²	56	23%	0.229	28%	0.277	C	S	.	.	H	α-helix	trans	-66.6	-37.4	176	-74.1	-66.7	13.9	0	0	112.9	I394 L400 K503 V504 C505 L509 V510 S511	I394-Q507 HydrophobicContact CG2-CB 4.37Å; I394-Q507 HydrophobicContact CG2-CG 3.6Å; I394-Q507 PolarHBondContact O-NE2 3.49Å; L400-Q507 HydrophobicContact CD1-CB 3.97Å; L400-Q507 HydrophobicContact CD2-CB 3.87Å; L400-Q507 HydrophobicContact CD2-CG 4.35Å; L400-Q507 HydrophobicContact CG-CB 4.39Å; K503-Q507 PolarHBondContact O-N 3.35Å; V504-Q507 PolarHBondContact O-N 3.08Å; C505-Q507 VanDerWaalsContact C-N 3.33Å; C505-Q507 PolarHBondContact O-N 3.32Å; Q507-L509 PolarHBondContact O-N 3.46Å; Q507-V510 PolarHBondContact O-N 3Å; Q507-S511 VanDerWaalsContact O-CB 3.27Å; Q507-S511 WeakPolarHBondContact O-CB 3.28Å; Q507-S511 PolarHBondContact O-N 2.96Å; Q507-S511 PolarHBondContact O-OG 3.37Å
508	L	90.8	Very high	88.9	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-24.8	172.6	-70.3	173	0	0	0	113.2	L400 V504 C505 P513 N517 Y521 V549	L400-L508 HydrophobicContact CD1-CD2 3.58Å; L400-L508 HydrophobicContact CD1-CG 3.83Å; V504-L508 HydrophobicContact CG1-CD1 3.88Å; V504-L508 HydrophobicContact CG1-CG 4.16Å; V504-L508 WeakPolarHBondContact O-CB 3.33Å; V504-L508 VanDerWaalsContact O-CG 3.25Å; V504-L508 WeakPolarHBondContact O-CG 3.22Å; V504-L508 PolarHBondContact O-N 3.33Å; C505-L508 CarbonylContact O-C 3.37Å; C505-L508 WeakPolarHBondContact O-CB 3.13Å; C505-L508 PolarHBondContact O-N 3.29Å; C505-L508 VanDerWaalsContact O-N 3.08Å; L508-P513 HydrophobicContact CB-CG 4.3Å; L508-P513 HydrophobicContact CD2-CB 3.42Å; L508-P513 VanDerWaalsContact CD2-CB 3.42Å; L508-P513 HydrophobicContact CD2-CG 3.67Å; L508-P513 WeakPolarHBondContact O-CG 3.24Å; L508-N517 HydrophobicContact CD2-CB 4.15Å; L508-Y521 HydrophobicContact CD1-CD1 3.48Å; L508-Y521 VanDerWaalsContact CD1-CD1 3.48Å; L508-Y521 HydrophobicContact CD1-CD2 3.94Å; L508-Y521 HydrophobicContact CD1-CE1 4.13Å; L508-Y521 HydrophobicContact CD1-CG 3.37Å; L508-V549 HydrophobicContact CB-CG2 4.44Å; L508-V549 HydrophobicContact CD1-CG2 4.38Å
509	L	88.3	Confident	88.8	Confident	64 Å²	64	57.9 Å²	57.9	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-88.9	-26.1	178.8	-66.1	176.7	0	0	0	113.5	C505 T506 Q507 Q548 V549 L552	C505-L509 VanDerWaalsContact O-CG 3.28Å; C505-L509 WeakPolarHBondContact O-CG 3.27Å; C505-L509 PolarHBondContact O-N 3.26Å; T506-L509 PolarHBondContact O-N 3.03Å; T506-L509 VanDerWaalsContact O-N 3.16Å; Q507-L509 PolarHBondContact O-N 3.46Å; L509-Q548 HydrophobicContact CD1-CB 4.35Å; L509-Q548 HydrophobicContact CD2-CB 4.21Å; L509-V549 HydrophobicContact CD2-CG2 4.28Å; L509-L552 HydrophobicContact CB-CD1 4.49Å; L509-L552 HydrophobicContact CD2-CD1 3.52Å; L509-L552 HydrophobicContact CD2-CG 3.82Å
510	V	84.9	Confident	88.8	Confident	116 Å²	116	55.8 Å²	55.8	70%	0.703	29%	0.286	S	S	*	.	H	α-helix	trans	-101.7	-34.9	-175.3	175	0	0	0	0	112.7	T506 Q507	T506-V510 HydrophobicContact CG2-CG2 4.29Å; T506-V510 WeakPolarHBondContact O-CB 3.34Å; T506-V510 WeakPolarHBondContact O-CG2 3.46Å; T506-V510 PolarHBondContact O-N 3.26Å; Q507-V510 PolarHBondContact O-N 3Å
511	S	77.9	Confident	88.8	Confident	52 Å²	52	55.8 Å²	55.8	36%	0.364	29%	0.286	S	S	.	.	S	Bend	trans	-80.8	178.2	171.6	73.3	0	0	0	0	111.7	Q507 P513	Q507-S511 VanDerWaalsContact O-CB 3.27Å; Q507-S511 WeakPolarHBondContact O-CB 3.28Å; Q507-S511 PolarHBondContact O-N 2.96Å; Q507-S511 PolarHBondContact O-OG 3.37Å; S511-P513 VanDerWaalsContact C-CD 3.44Å; S511-P513 WeakPolarHBondContact O-CD 3.49Å
512	R	66.1	Low	88.8	Confident	244 Å²	244	56.8 Å²	56.8	92%	0.921	29%	0.291	S	S	*	.			trans	-100.6	84.5	162.8	-69.5	-176.3	179	-177.3	0.3	108.9
513	P	68.4	Low	88.8	Confident	17 Å²	17	62.1 Å²	62.1	11%	0.11	31%	0.313	C	S	.	.			trans	-78.2	150	-176.6	33.9	-39.1	0	0	0	112.6	L508 S511 N517 I518	L508-P513 HydrophobicContact CB-CG 4.3Å; L508-P513 HydrophobicContact CD2-CB 3.42Å; L508-P513 VanDerWaalsContact CD2-CB 3.42Å; L508-P513 HydrophobicContact CD2-CG 3.67Å; L508-P513 WeakPolarHBondContact O-CG 3.24Å; S511-P513 VanDerWaalsContact C-CD 3.44Å; S511-P513 WeakPolarHBondContact O-CD 3.49Å; P513-N517 HydrophobicContact CB-CB 4.46Å; P513-I518 HydrophobicContact CG-CD1 4.17Å; P513-I518 HydrophobicContact CG-CG1 4.02Å
514	D	79.6	Confident	88.9	Confident	107 Å²	107	58.7 Å²	58.7	57%	0.572	30%	0.299	S	S	*	.			trans	-62.8	150.6	173.3	-42.1	-82	0	0	0	112.6	E516 N517 I518	D514-E516 PolarHBondContact O-N 2.99Å; D514-N517 WeakPolarHBondContact O-CB 3.48Å; D514-N517 PolarHBondContact O-N 3.28Å; D514-N517 PolarHBondContact OD2-ND2 3.47Å; D514-I518 PolarHBondContact O-N 3.12Å; D514-I518 VanDerWaalsContact O-N 3.13Å
515	E	87.1	Confident	89	Confident	126 Å²	126	58.7 Å²	58.7	59%	0.589	30%	0.299	S	S	*	.	H	α-helix	trans	-56.4	-31.1	174.8	173.2	164.7	-157.4	0	0	112.8	S519 F553	E515-S519 VanDerWaalsContact O-CB 3.22Å; E515-S519 WeakPolarHBondContact O-CB 3.35Å; E515-S519 PolarHBondContact O-N 2.97Å; E515-S519 PolarHBondContact O-OG 3.28Å; E515-F553 HydrophobicContact CG-CE2 3.87Å; E515-F553 HydrophobicContact CG-CZ 4.46Å; E515-F553 WeakPolarHBondContact OE1-CE2 3.48Å; E515-F553 VanDerWaalsContact OE1-CZ 3.31Å; E515-F553 WeakPolarHBondContact OE1-CZ 3.41Å
516	E	89.4	Confident	89.1	Confident	142 Å²	142	62.2 Å²	62.2	66%	0.664	32%	0.317	S	S	*	.	H	α-helix	trans	-62	-43.4	173.3	-64.6	-169	-179.5	0	0	112.2	D514 S519 S520	D514-E516 PolarHBondContact O-N 2.99Å; E516-S519 PolarHBondContact O-N 3.13Å; E516-S520 WeakPolarHBondContact O-CB 3.36Å; E516-S520 PolarHBondContact O-N 3.05Å
517	N	92.4	Very high	89.3	Confident	15 Å²	15	61.3 Å²	61.3	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-70.2	-41.9	-179.5	-66.4	-49.8	0	0	0	111	L404 L508 P513 D514 S520 Y521	L404-N517 HydrophobicContact CD1-CB 3.86Å; L508-N517 HydrophobicContact CD2-CB 4.15Å; P513-N517 HydrophobicContact CB-CB 4.46Å; D514-N517 WeakPolarHBondContact O-CB 3.48Å; D514-N517 PolarHBondContact O-N 3.28Å; D514-N517 PolarHBondContact OD2-ND2 3.47Å; N517-S520 PolarHBondContact O-N 2.9Å; N517-Y521 WeakPolarHBondContact O-CB 3.47Å; N517-Y521 PolarHBondContact O-N 3.11Å
518	I	92.4	Very high	89.6	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-57.9	-49.8	172.2	-67.2	174.6	0	0	0	110.2	P513 D514 Y521 L522 V549 F553 F556	P513-I518 HydrophobicContact CG-CD1 4.17Å; P513-I518 HydrophobicContact CG-CG1 4.02Å; D514-I518 PolarHBondContact O-N 3.12Å; D514-I518 VanDerWaalsContact O-N 3.13Å; I518-Y521 PolarHBondContact O-N 3.2Å; I518-L522 HydrophobicContact CG2-CD1 3.96Å; I518-L522 VanDerWaalsContact O-CG 3.31Å; I518-L522 WeakPolarHBondContact O-CG 3.39Å; I518-L522 PolarHBondContact O-N 3.09Å; I518-V549 HydrophobicContact CG2-CG1 3.87Å; I518-F553 HydrophobicContact CD1-CD2 4.29Å; I518-F553 HydrophobicContact CG2-CB 4.16Å; I518-F553 HydrophobicContact CG2-CD2 3.87Å; I518-F553 HydrophobicContact CG2-CG 4.16Å; I518-F556 HydrophobicContact CD1-CE2 3.9Å; I518-F556 HydrophobicContact CD1-CZ 4.46Å
519	S	93.7	Very high	89.8	Confident	43 Å²	43	60.8 Å²	60.8	30%	0.301	31%	0.305	S	S	.	.	H	α-helix	trans	-63.5	-43.4	-178.5	-65.3	0	0	0	0	112.3	E515 E516 L522 Q523	E515-S519 VanDerWaalsContact O-CB 3.22Å; E515-S519 WeakPolarHBondContact O-CB 3.35Å; E515-S519 PolarHBondContact O-N 2.97Å; E515-S519 PolarHBondContact O-OG 3.28Å; E516-S519 PolarHBondContact O-N 3.13Å; S519-L522 PolarHBondContact O-N 2.93Å; S519-Q523 VanDerWaalsContact O-CG 3.3Å; S519-Q523 WeakPolarHBondContact O-CG 3.48Å; S519-Q523 PolarHBondContact O-N 3.12Å
520	S	96.4	Very high	90.1	Very high	26 Å²	26	64.4 Å²	64.4	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-45.6	175.1	177.4	0	0	0	0	111.6	H408 E516 N517 L522 Q523 L524	H408-S520 PolarHBondContact CD2-OG 3.05Å; H408-S520 PolarHBondContact NE2-O 3.39Å; E516-S520 WeakPolarHBondContact O-CB 3.36Å; E516-S520 PolarHBondContact O-N 3.05Å; N517-S520 PolarHBondContact O-N 2.9Å; S520-L522 PolarHBondContact O-N 3.08Å; S520-Q523 PolarHBondContact O-N 3.13Å; S520-L524 VanDerWaalsContact O-CB 3.3Å; S520-L524 WeakPolarHBondContact O-CB 3.38Å; S520-L524 PolarHBondContact O-N 2.98Å
521	Y	97.1	Very high	90.6	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.6	-41.3	177.9	-175.3	-108.6	0	0	0	112.8	L404 M501 V504 C505 L508 N517 I518 L524 I525 V549	L404-Y521 HydrophobicContact CD2-CD2 3.94Å; L404-Y521 HydrophobicContact CD2-CG 4.44Å; M501-Y521 HydrophobicContact CE-CD2 3.89Å; M501-Y521 HydrophobicContact CE-CE2 3.4Å; M501-Y521 VanDerWaalsContact CE-CE2 3.4Å; M501-Y521 WeakPolarHBondContact O-CE2 3.36Å; M501-Y521 PolarHBondContact O-OH 2.92Å; M501-Y521 HydrophobicContact SD-CD2 4.18Å; M501-Y521 HydrophobicContact SD-CE2 3.73Å; V504-Y521 HydrophobicContact CB-CD2 4.18Å; V504-Y521 HydrophobicContact CB-CE2 3.91Å; V504-Y521 HydrophobicContact CG1-CD2 3.49Å; V504-Y521 VanDerWaalsContact CG1-CD2 3.49Å; V504-Y521 HydrophobicContact CG1-CE2 3.73Å; V504-Y521 HydrophobicContact CG1-CG 4.31Å; C505-Y521 HydrophobicContact CB-CE1 4.41Å; C505-Y521 WeakPolarHBondContact CB-OH 3.44Å; L508-Y521 HydrophobicContact CD1-CD1 3.48Å; L508-Y521 VanDerWaalsContact CD1-CD1 3.48Å; L508-Y521 HydrophobicContact CD1-CD2 3.94Å; L508-Y521 HydrophobicContact CD1-CE1 4.13Å; L508-Y521 HydrophobicContact CD1-CG 3.37Å; N517-Y521 WeakPolarHBondContact O-CB 3.47Å; N517-Y521 PolarHBondContact O-N 3.11Å; I518-Y521 PolarHBondContact O-N 3.2Å; Y521-L524 WeakPolarHBondContact O-CB 3.46Å; Y521-L524 PolarHBondContact O-N 2.98Å; Y521-I525 HydrophobicContact CD1-CD1 3.88Å; Y521-I525 HydrophobicContact CE1-CD1 3.35Å; Y521-I525 HydrophobicContact CE1-CG1 4.23Å; Y521-I525 PolarHBondContact O-N 3.36Å; Y521-V549 HydrophobicContact CD1-CB 4.46Å; Y521-V549 HydrophobicContact CD1-CG1 4.31Å; Y521-V549 HydrophobicContact CD1-CG2 4.07Å; Y521-V549 HydrophobicContact CE1-CG2 3.92Å
522	L	95.8	Very high	91.2	Very high	22 Å²	22	62.4 Å²	62.4	12%	0.115	30%	0.3	C	S	.	.	H	α-helix	trans	-66.6	-42.1	176.8	-67.5	174.3	0	0	0	112.1	I518 S519 S520 L524 I525 D526 K546 V549 Q550	I518-L522 HydrophobicContact CG2-CD1 3.96Å; I518-L522 VanDerWaalsContact O-CG 3.31Å; I518-L522 WeakPolarHBondContact O-CG 3.39Å; I518-L522 PolarHBondContact O-N 3.09Å; S519-L522 PolarHBondContact O-N 2.93Å; S520-L522 PolarHBondContact O-N 3.08Å; L522-L524 VanDerWaalsContact C-N 3.25Å; L522-L524 PolarHBondContact O-N 3.29Å; L522-I525 PolarHBondContact O-N 2.9Å; L522-D526 PolarHBondContact O-N 3.2Å; L522-D526 VanDerWaalsContact O-N 3.1Å; L522-K546 HydrophobicContact CD2-CG 3.56Å; L522-V549 HydrophobicContact CD2-CB 4.4Å; L522-V549 HydrophobicContact CD2-CG1 4.21Å; L522-V549 HydrophobicContact CG-CG1 4.35Å; L522-Q550 HydrophobicContact CD1-CG 3.93Å; L522-Q550 HydrophobicContact CD2-CG 3.8Å
523	Q	96.6	Very high	92.4	Very high	120 Å²	120	51.1 Å²	51.1	56%	0.561	26%	0.259	S	S	*	.	H	α-helix	trans	-63.1	-31.8	172.3	-71.1	176	27.9	0	0	112.6	H408 S519 S520 K527	H408-Q523 WeakPolarHBondContact NE2-CB 3.4Å; H408-Q523 PolarHBondContact NE2-O 2.94Å; S519-Q523 VanDerWaalsContact O-CG 3.3Å; S519-Q523 WeakPolarHBondContact O-CG 3.48Å; S519-Q523 PolarHBondContact O-N 3.12Å; S520-Q523 PolarHBondContact O-N 3.13Å; Q523-K527 WeakPolarHBondContact O-CG 3.21Å; Q523-K527 PolarHBondContact O-N 3.35Å
524	L	97.6	Very high	93.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71.9	-42.8	178.1	-175.8	57.3	0	0	0	111.3	L404 L407 H408 I411 F497 M501 S520 Y521 L522 D526 K527 C528	L404-L524 HydrophobicContact CD2-CD2 4.07Å; L407-L524 HydrophobicContact CB-CD1 4.31Å; L407-L524 HydrophobicContact CB-CD2 3.59Å; L407-L524 HydrophobicContact CD1-CD2 4.07Å; L407-L524 HydrophobicContact CG-CD2 4.48Å; H408-L524 WeakPolarHBondContact CE1-CD1 3.46Å; H408-L524 WeakPolarHBondContact ND1-CD1 3.33Å; H408-L524 WeakPolarHBondContact NE2-CA 3.4Å; H408-L524 VanDerWaalsContact NE2-CB 3.3Å; H408-L524 WeakPolarHBondContact NE2-CB 3.41Å; H408-L524 PolarHBondContact NE2-N 3.43Å; I411-L524 HydrophobicContact CB-CD1 4.34Å; I411-L524 HydrophobicContact CG2-CD1 3.83Å; F497-L524 HydrophobicContact CZ-CD1 4.08Å; M501-L524 HydrophobicContact CE-CB 4.23Å; M501-L524 HydrophobicContact CE-CD2 3.98Å; M501-L524 HydrophobicContact CE-CG 3.78Å; M501-L524 HydrophobicContact SD-CD2 3.37Å; M501-L524 WeakPolarHBondContact SD-CD2 3.37Å; M501-L524 HydrophobicContact SD-CG 3.74Å; S520-L524 VanDerWaalsContact O-CB 3.3Å; S520-L524 WeakPolarHBondContact O-CB 3.38Å; S520-L524 PolarHBondContact O-N 2.98Å; Y521-L524 WeakPolarHBondContact O-CB 3.46Å; Y521-L524 PolarHBondContact O-N 2.98Å; L522-L524 VanDerWaalsContact C-N 3.25Å; L522-L524 PolarHBondContact O-N 3.29Å; L524-D526 VanDerWaalsContact C-N 3.33Å; L524-D526 PolarHBondContact O-N 3.14Å; L524-K527 PolarHBondContact O-N 3.2Å; L524-C528 PolarHBondContact O-N 2.71Å; L524-C528 VanDerWaalsContact O-N 3.11Å; L524-C528 PolarHBondContact O-SG 3.39Å
525	I	97.4	Very high	94.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-57.1	-46.6	170.7	-71.9	170.1	0	0	0	110.7	M501 Y521 L522 K527 C528 L529 L542 K546	M501-I525 HydrophobicContact CE-CG1 3.56Å; Y521-I525 HydrophobicContact CD1-CD1 3.88Å; Y521-I525 HydrophobicContact CE1-CD1 3.35Å; Y521-I525 HydrophobicContact CE1-CG1 4.23Å; Y521-I525 PolarHBondContact O-N 3.36Å; L522-I525 PolarHBondContact O-N 2.9Å; I525-K527 VanDerWaalsContact C-N 3.27Å; I525-K527 PolarHBondContact O-N 2.67Å; I525-C528 WeakPolarHBondContact O-CA 3.42Å; I525-C528 PolarHBondContact O-N 2.94Å; I525-L529 HydrophobicContact CG2-CD1 3.75Å; I525-L529 HydrophobicContact CG2-CG 3.96Å; I525-L529 WeakPolarHBondContact O-CG 3.43Å; I525-L529 PolarHBondContact O-N 2.73Å; I525-L542 HydrophobicContact CG1-CD2 4.3Å; I525-L542 HydrophobicContact CG2-CB 4.3Å; I525-K546 HydrophobicContact CD1-CB 3.92Å; I525-K546 HydrophobicContact CD1-CG 4.18Å; I525-K546 HydrophobicContact CG2-CB 4.14Å; I525-K546 HydrophobicContact CG2-CD 4.01Å; I525-K546 HydrophobicContact CG2-CG 4.12Å
526	D	96.9	Very high	94.6	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	24%	0.241	S	C	.	.	H	α-helix	trans	-62.5	-32.7	-178	-79.9	-36.2	0	0	0	113.1	L522 L524 K546	L522-D526 PolarHBondContact O-N 3.2Å; L522-D526 VanDerWaalsContact O-N 3.1Å; L524-D526 VanDerWaalsContact C-N 3.33Å; L524-D526 PolarHBondContact O-N 3.14Å; D526-K546 IonicContact OD1-NZ 3.89Å; D526-K546 PolarHBondContact OD1-NZ 3.33Å; D526-K546 WeakPolarHBondContact OD2-CE 3.39Å; D526-K546 IonicContact OD2-NZ 2.78Å; D526-K546 PolarHBondContact OD2-NZ 3.27Å
527	K	95.9	Very high	94.7	Very high	64 Å²	64	45.3 Å²	45.3	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-42.7	168.6	-68.4	173.2	-178.3	175.8	0	112.2	H408 I411 Q523 L524 I525 L529 I530 H531	H408-K527 WeakPolarHBondContact CE1-CD 3.34Å; H408-K527 PolarHBondContact CE1-NZ 3.15Å; H408-K527 PolarHBondContact ND1-NZ 2.97Å; I411-K527 HydrophobicContact CG1-CB 3.88Å; I411-K527 HydrophobicContact CG2-CB 4.32Å; I411-K527 HydrophobicContact CG2-CD 3.75Å; Q523-K527 WeakPolarHBondContact O-CG 3.21Å; Q523-K527 PolarHBondContact O-N 3.35Å; L524-K527 PolarHBondContact O-N 3.2Å; I525-K527 VanDerWaalsContact C-N 3.27Å; I525-K527 PolarHBondContact O-N 2.67Å; K527-L529 PolarHBondContact O-N 3.36Å; K527-I530 WeakPolarHBondContact O-CG1 3.45Å; K527-I530 PolarHBondContact O-N 3.11Å; K527-H531 WeakPolarHBondContact O-CB 3.47Å; K527-H531 PolarHBondContact O-N 3.3Å; K527-H531 VanDerWaalsContact O-N 3.15Å
528	C	96.4	Very high	94.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.9	-32.5	-179.3	-58.8	0	0	0	0	113	F497 L524 I525 H531 F534 L542	F497-C528 VanDerWaalsContact CE1-SG 3.5Å; L524-C528 PolarHBondContact O-N 2.71Å; L524-C528 VanDerWaalsContact O-N 3.11Å; L524-C528 PolarHBondContact O-SG 3.39Å; I525-C528 WeakPolarHBondContact O-CA 3.42Å; I525-C528 PolarHBondContact O-N 2.94Å; C528-H531 PolarHBondContact O-N 3.12Å; C528-F534 HydrophobicContact CB-CE1 4.47Å; C528-F534 HydrophobicContact CB-CE2 4.4Å; C528-F534 HydrophobicContact CB-CZ 4.36Å; C528-L542 HydrophobicContact CB-CD1 3.73Å
529	L	96	Very high	95	Very high	41 Å²	41	47 Å²	47	22%	0.215	25%	0.245	C	C	.	.	H	α-helix	trans	-67.4	-36.9	177.8	-69	175.3	0	0	0	112.4	I525 K527 K539 L542 L543	I525-L529 HydrophobicContact CG2-CD1 3.75Å; I525-L529 HydrophobicContact CG2-CG 3.96Å; I525-L529 WeakPolarHBondContact O-CG 3.43Å; I525-L529 PolarHBondContact O-N 2.73Å; K527-L529 PolarHBondContact O-N 3.36Å; L529-K539 HydrophobicContact CD2-CB 3.86Å; L529-K539 HydrophobicContact CD2-CG 4.23Å; L529-K539 WeakPolarHBondContact CD2-O 3.41Å; L529-K539 WeakPolarHBondContact O-CD 3.42Å; L529-K539 WeakPolarHBondContact O-CE 3.4Å; L529-K539 PolarHBondContact O-NZ 3.42Å; L529-L542 HydrophobicContact CD2-CB 4.43Å; L529-L543 HydrophobicContact CD1-CD1 4.12Å; L529-L543 HydrophobicContact CD2-CB 4.44Å
530	I	94.6	Very high	95.2	Very high	139 Å²	139	51 Å²	51	71%	0.713	26%	0.256	S	S	*	.	H	α-helix	trans	-81.4	-21.4	175.8	65.1	174	0	0	0	113.5	K527	K527-I530 WeakPolarHBondContact O-CG1 3.45Å; K527-I530 PolarHBondContact O-N 3.11Å
531	H	93.8	Very high	95.1	Very high	18 Å²	18	57.5 Å²	57.5	8%	0.083	28%	0.277	C	S	.	.			trans	-71.9	134.6	-176.3	-167.5	-61.2	0	0	0	112	I411 K527 C528 A533 F534 K539	I411-H531 HydrophobicContact CD1-CB 4.27Å; K527-H531 WeakPolarHBondContact O-CB 3.47Å; K527-H531 PolarHBondContact O-N 3.3Å; K527-H531 VanDerWaalsContact O-N 3.15Å; C528-H531 PolarHBondContact O-N 3.12Å; H531-A533 PolarHBondContact ND1-N 2.85Å; H531-F534 HydrophobicContact CB-CD2 3.87Å; H531-F534 HydrophobicContact CB-CE2 4.23Å; H531-F534 AromaticContact CG-CD2 3.95Å; H531-F534 AromaticContact ND1-CD2 3.84Å; H531-K539 WeakPolarHBondContact O-CE 3.4Å; H531-K539 PolarHBondContact O-NZ 3.38Å
532	E	91	Very high	95.1	Very high	109 Å²	109	57.5 Å²	57.5	51%	0.509	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-31.7	-170	-73.1	171.9	-171.9	0	0	114	K326 F534	K326-E532 WeakPolarHBondContact CD-OE2 3.5Å; K326-E532 IonicContact NZ-OE1 3.85Å; K326-E532 PolarHBondContact NZ-OE1 3.12Å; K326-E532 IonicContact NZ-OE2 3.07Å; K326-E532 PolarHBondContact NZ-OE2 3.22Å; E532-F534 PolarHBondContact O-N 2.99Å; E532-F534 VanDerWaalsContact O-N 3.12Å
533	A	92.8	Very high	95.1	Very high	7 Å²	7	60.1 Å²	60.1	6%	0.058	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-9.8	177.7	0	0	0	0	0	116.2	I415 A417 P494 H531	I415-A533 HydrophobicContact CB-CB 4.23Å; I415-A533 HydrophobicContact CG2-CB 3.73Å; I415-A533 WeakPolarHBondContact O-CB 3.39Å; A417-A533 HydrophobicContact CB-CB 4.39Å; P494-A533 WeakPolarHBondContact CB-O 3.5Å; P494-A533 HydrophobicContact CG-CB 4.25Å; P494-A533 VanDerWaalsContact CG-O 3.31Å; P494-A533 WeakPolarHBondContact CG-O 3.16Å; H531-A533 PolarHBondContact ND1-N 2.85Å
534	F	94.3	Very high	95.1	Very high	6 Å²	6	57 Å²	57	3%	0.026	28%	0.282	C	S	.	.	S	Bend	trans	-89	129.1	176	-73.2	-96.5	0	0	0	110.4	I411 P494 F497 C528 H531 E532 Q538 K539 L542	I411-F534 HydrophobicContact CD1-CE2 3.49Å; I411-F534 VanDerWaalsContact CD1-CE2 3.49Å; I411-F534 HydrophobicContact CD1-CZ 3.96Å; P494-F534 HydrophobicContact CB-CD1 4.31Å; P494-F534 HydrophobicContact CB-CE1 4.4Å; F497-F534 HydrophobicContact CB-CE1 4.35Å; F497-F534 HydrophobicContact CB-CZ 4.29Å; F497-F534 AromaticContact CD1-CE1 3.79Å; F497-F534 HydrophobicContact CD1-CE1 3.79Å; F497-F534 AromaticContact CD1-CZ 3.61Å; F497-F534 HydrophobicContact CD1-CZ 3.61Å; F497-F534 HydrophobicContact CE1-CE1 4.49Å; F497-F534 HydrophobicContact CE1-CZ 4.07Å; F497-F534 HydrophobicContact CG-CE1 4.31Å; F497-F534 AromaticContact CG-CZ 3.96Å; F497-F534 HydrophobicContact CG-CZ 3.96Å; C528-F534 HydrophobicContact CB-CE1 4.47Å; C528-F534 HydrophobicContact CB-CE2 4.4Å; C528-F534 HydrophobicContact CB-CZ 4.36Å; H531-F534 HydrophobicContact CB-CD2 3.87Å; H531-F534 HydrophobicContact CB-CE2 4.23Å; H531-F534 AromaticContact CG-CD2 3.95Å; H531-F534 AromaticContact ND1-CD2 3.84Å; E532-F534 PolarHBondContact O-N 2.99Å; E532-F534 VanDerWaalsContact O-N 3.12Å; F534-Q538 VanDerWaalsContact CA-OE1 3.32Å; F534-Q538 HydrophobicContact CD1-CB 4.35Å; F534-K539 HydrophobicContact CB-CG 4.1Å; F534-K539 VanDerWaalsContact O-CE 3.26Å; F534-K539 WeakPolarHBondContact O-CE 3.47Å; F534-L542 HydrophobicContact CD1-CD1 4.17Å
535	T	93.1	Very high	95.1	Very high	57 Å²	57	59.4 Å²	59.4	35%	0.35	29%	0.291	S	S	.	.			trans	-67.5	155.3	178.6	71.4	0	0	0	0	111.3	T537 Q538 K539	T535-T537 PolarHBondContact O-N 3.15Å; T535-T537 VanDerWaalsContact O-N 3.16Å; T535-T537 PolarHBondContact OG1-OG1 3.43Å; T535-Q538 WeakPolarHBondContact O-CA 3.28Å; T535-Q538 WeakPolarHBondContact O-CB 3.25Å; T535-Q538 PolarHBondContact O-N 2.75Å; T535-Q538 VanDerWaalsContact OG1-CG 3.25Å; T535-Q538 WeakPolarHBondContact OG1-CG 3.25Å; T535-Q538 PolarHBondContact OG1-N 3.26Å; T535-Q538 VanDerWaalsContact OG1-N 3.11Å; T535-K539 WeakPolarHBondContact O-CG 3.48Å; T535-K539 PolarHBondContact O-N 3.19Å
536	E	92.6	Very high	95	Very high	109 Å²	109	60.9 Å²	60.9	51%	0.509	30%	0.298	S	S	.	.	H	α-helix	trans	-59.8	-27.5	176.1	-179.8	53.8	-158.6	0	0	112.7	K540	E536-K540 HydrophobicContact CG-CD 4.38Å; E536-K540 VanDerWaalsContact CG-NZ 3.34Å; E536-K540 WeakPolarHBondContact O-CB 3.46Å; E536-K540 WeakPolarHBondContact O-CG 3.36Å; E536-K540 PolarHBondContact O-N 3.21Å; E536-K540 WeakPolarHBondContact OE1-CE 3.28Å; E536-K540 IonicContact OE1-NZ 3.71Å; E536-K540 PolarHBondContact OE1-NZ 2.9Å
537	T	92.4	Very high	94.9	Very high	98 Å²	98	63 Å²	63	60%	0.601	31%	0.305	S	S	*	.	H	α-helix	trans	-72.9	-36.3	172.3	50	0	0	0	0	113	T535 R541	T535-T537 PolarHBondContact O-N 3.15Å; T535-T537 VanDerWaalsContact O-N 3.16Å; T535-T537 PolarHBondContact OG1-OG1 3.43Å; T537-R541 WeakPolarHBondContact O-CG 3.24Å; T537-R541 PolarHBondContact O-N 2.95Å
538	Q	94.6	Very high	94.7	Very high	18 Å²	18	63.9 Å²	63.9	8%	0.084	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-45.1	171.3	-69.5	162.9	-4.6	0	0	110.7	T498 F534 T535 K540 R541 L542	T498-Q538 HydrophobicContact CG2-CB 4.13Å; T498-Q538 HydrophobicContact CG2-CG 4.13Å; F534-Q538 VanDerWaalsContact CA-OE1 3.32Å; F534-Q538 HydrophobicContact CD1-CB 4.35Å; T535-Q538 WeakPolarHBondContact O-CA 3.28Å; T535-Q538 WeakPolarHBondContact O-CB 3.25Å; T535-Q538 PolarHBondContact O-N 2.75Å; T535-Q538 VanDerWaalsContact OG1-CG 3.25Å; T535-Q538 WeakPolarHBondContact OG1-CG 3.25Å; T535-Q538 PolarHBondContact OG1-N 3.26Å; T535-Q538 VanDerWaalsContact OG1-N 3.11Å; Q538-K540 PolarHBondContact O-N 3.43Å; Q538-R541 WeakPolarHBondContact O-CB 3.4Å; Q538-R541 PolarHBondContact O-N 2.95Å; Q538-R541 VanDerWaalsContact O-N 3.15Å; Q538-L542 WeakPolarHBondContact O-CG 3.36Å; Q538-L542 PolarHBondContact O-N 2.92Å
539	K	96.6	Very high	94.4	Very high	37 Å²	37	64 Å²	64	16%	0.161	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-42.6	177.8	-69.2	-176.3	-179.6	-168.9	0	112.6	L529 H531 F534 T535 R541 L542 L543	L529-K539 HydrophobicContact CD2-CB 3.86Å; L529-K539 HydrophobicContact CD2-CG 4.23Å; L529-K539 WeakPolarHBondContact CD2-O 3.41Å; L529-K539 WeakPolarHBondContact O-CD 3.42Å; L529-K539 WeakPolarHBondContact O-CE 3.4Å; L529-K539 PolarHBondContact O-NZ 3.42Å; H531-K539 WeakPolarHBondContact O-CE 3.4Å; H531-K539 PolarHBondContact O-NZ 3.38Å; F534-K539 HydrophobicContact CB-CG 4.1Å; F534-K539 VanDerWaalsContact O-CE 3.26Å; F534-K539 WeakPolarHBondContact O-CE 3.47Å; T535-K539 WeakPolarHBondContact O-CG 3.48Å; T535-K539 PolarHBondContact O-N 3.19Å; K539-R541 PolarHBondContact O-N 2.99Å; K539-L542 PolarHBondContact O-N 3.32Å; K539-L543 WeakPolarHBondContact O-CB 3.49Å; K539-L543 PolarHBondContact O-N 3.1Å
540	K	96.4	Very high	94.2	Very high	125 Å²	125	65 Å²	65	54%	0.543	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-38.7	173.9	-79.4	166.5	168	132.1	0	113.3	E536 Q538 S544	E536-K540 HydrophobicContact CG-CD 4.38Å; E536-K540 VanDerWaalsContact CG-NZ 3.34Å; E536-K540 WeakPolarHBondContact O-CB 3.46Å; E536-K540 WeakPolarHBondContact O-CG 3.36Å; E536-K540 PolarHBondContact O-N 3.21Å; E536-K540 WeakPolarHBondContact OE1-CE 3.28Å; E536-K540 IonicContact OE1-NZ 3.71Å; E536-K540 PolarHBondContact OE1-NZ 2.9Å; Q538-K540 PolarHBondContact O-N 3.43Å; K540-S544 PolarHBondContact O-N 3.31Å; K540-S544 VanDerWaalsContact O-N 3.13Å
541	R	94.9	Very high	93.8	Very high	164 Å²	164	66 Å²	66	62%	0.619	31%	0.314	S	S	*	.	H	α-helix	trans	-65.8	-48.6	173.7	-71.9	175.9	175.7	179.5	-1.2	111.8	T537 Q538 K539 L543 S544 W545	T537-R541 WeakPolarHBondContact O-CG 3.24Å; T537-R541 PolarHBondContact O-N 2.95Å; Q538-R541 WeakPolarHBondContact O-CB 3.4Å; Q538-R541 PolarHBondContact O-N 2.95Å; Q538-R541 VanDerWaalsContact O-N 3.15Å; K539-R541 PolarHBondContact O-N 2.99Å; R541-L543 VanDerWaalsContact C-N 3.29Å; R541-L543 PolarHBondContact O-N 3.08Å; R541-S544 WeakPolarHBondContact O-CB 3.42Å; R541-S544 PolarHBondContact O-N 3.21Å; R541-S544 VanDerWaalsContact O-N 3.12Å; R541-W545 HydrophobicContact CB-CH2 4.37Å; R541-W545 HydrophobicContact CB-CZ2 4.44Å; R541-W545 PolarHBondContact O-N 3.08Å
542	L	97.2	Very high	93.1	Very high	0 Å²	0	68 Å²	68	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-57.5	-40.2	176.2	-70.7	160.7	0	0	0	112	M501 I525 C528 L529 F534 Q538 K539 W545 K546	M501-L542 HydrophobicContact CB-CD2 3.9Å; M501-L542 HydrophobicContact CE-CD2 3.9Å; M501-L542 HydrophobicContact CG-CD2 4.15Å; I525-L542 HydrophobicContact CG1-CD2 4.3Å; I525-L542 HydrophobicContact CG2-CB 4.3Å; C528-L542 HydrophobicContact CB-CD1 3.73Å; L529-L542 HydrophobicContact CD2-CB 4.43Å; F534-L542 HydrophobicContact CD1-CD1 4.17Å; Q538-L542 WeakPolarHBondContact O-CG 3.36Å; Q538-L542 PolarHBondContact O-N 2.92Å; K539-L542 PolarHBondContact O-N 3.32Å; L542-W545 HydrophobicContact CD2-CE3 3.99Å; L542-W545 HydrophobicContact CD2-CZ3 4.04Å; L542-W545 HydrophobicContact CG-CE3 4.46Å; L542-W545 HydrophobicContact CG-CZ3 4.44Å; L542-W545 PolarHBondContact O-N 2.98Å; L542-K546 PolarHBondContact O-N 3.33Å
543	L	96.4	Very high	92.5	Very high	76 Å²	76	66 Å²	66	40%	0.398	31%	0.314	S	S	.	.	H	α-helix	trans	-67.4	-35.8	176.6	-171.4	65.6	0	0	0	112.8	L529 K539 R541 K546 Q547	L529-L543 HydrophobicContact CD1-CD1 4.12Å; L529-L543 HydrophobicContact CD2-CB 4.44Å; K539-L543 WeakPolarHBondContact O-CB 3.49Å; K539-L543 PolarHBondContact O-N 3.1Å; R541-L543 VanDerWaalsContact C-N 3.29Å; R541-L543 PolarHBondContact O-N 3.08Å; L543-K546 HydrophobicContact CD1-CD 4.45Å; L543-K546 VanDerWaalsContact O-CB 3.31Å; L543-K546 WeakPolarHBondContact O-CB 3.21Å; L543-K546 PolarHBondContact O-N 3.37Å; L543-Q547 WeakPolarHBondContact O-CG 3.44Å; L543-Q547 PolarHBondContact O-N 3.37Å; L543-Q547 VanDerWaalsContact O-N 3.17Å
544	S	96.1	Very high	91.7	Very high	54 Å²	54	74.5 Å²	74.5	38%	0.378	35%	0.345	S	S	.	.	H	α-helix	trans	-64.7	-47.8	173.6	-173.3	0	0	0	0	111.4	K540 R541 K546 Q547 Q548	K540-S544 PolarHBondContact O-N 3.31Å; K540-S544 VanDerWaalsContact O-N 3.13Å; R541-S544 WeakPolarHBondContact O-CB 3.42Å; R541-S544 PolarHBondContact O-N 3.21Å; R541-S544 VanDerWaalsContact O-N 3.12Å; S544-K546 VanDerWaalsContact C-N 3.28Å; S544-K546 PolarHBondContact O-N 3.23Å; S544-Q547 WeakPolarHBondContact O-CB 3.38Å; S544-Q547 PolarHBondContact O-N 2.76Å; S544-Q547 VanDerWaalsContact O-N 3.08Å; S544-Q548 WeakPolarHBondContact O-CG 3.05Å; S544-Q548 PolarHBondContact O-N 3.09Å
545	W	96.6	Very high	90.3	Very high	52 Å²	52	78.2 Å²	78.2	20%	0.197	37%	0.371	C	S	.	.	H	α-helix	trans	-59.6	-37.5	173.3	-64.2	-28.5	0	0	0	112.4	T498 M501 C505 R541 L542 Q547 Q548 V549	T498-W545 HydrophobicContact CG2-CH2 4.08Å; T498-W545 HydrophobicContact CG2-CZ3 3.98Å; T498-W545 WeakPolarHBondContact O-CH2 3.4Å; T498-W545 WeakPolarHBondContact O-CZ3 3.48Å; M501-W545 HydrophobicContact CB-CZ3 4.14Å; C505-W545 HydrophobicContact CB-CB 4.22Å; C505-W545 HydrophobicContact CB-CD2 4.31Å; C505-W545 HydrophobicContact CB-CG 4Å; C505-W545 VanDerWaalsContact SG-CB 3.56Å; R541-W545 HydrophobicContact CB-CH2 4.37Å; R541-W545 HydrophobicContact CB-CZ2 4.44Å; R541-W545 PolarHBondContact O-N 3.08Å; L542-W545 HydrophobicContact CD2-CE3 3.99Å; L542-W545 HydrophobicContact CD2-CZ3 4.04Å; L542-W545 HydrophobicContact CG-CE3 4.46Å; L542-W545 HydrophobicContact CG-CZ3 4.44Å; L542-W545 PolarHBondContact O-N 2.98Å; W545-Q547 VanDerWaalsContact C-N 3.31Å; W545-Q547 PolarHBondContact O-N 3.4Å; W545-Q548 PolarHBondContact O-N 3.15Å; W545-V549 PolarHBondContact O-N 2.79Å
546	K	95.6	Very high	88.5	Confident	30 Å²	30	80.4 Å²	80.4	13%	0.13	38%	0.377	C	S	.	.	H	α-helix	trans	-55.5	-46.6	172.5	-154.6	-173.2	-175.3	-177.8	0	111.6	L522 I525 D526 L542 L543 S544 Q550	L522-K546 HydrophobicContact CD2-CG 3.56Å; I525-K546 HydrophobicContact CD1-CB 3.92Å; I525-K546 HydrophobicContact CD1-CG 4.18Å; I525-K546 HydrophobicContact CG2-CB 4.14Å; I525-K546 HydrophobicContact CG2-CD 4.01Å; I525-K546 HydrophobicContact CG2-CG 4.12Å; D526-K546 IonicContact OD1-NZ 3.89Å; D526-K546 PolarHBondContact OD1-NZ 3.33Å; D526-K546 WeakPolarHBondContact OD2-CE 3.39Å; D526-K546 IonicContact OD2-NZ 2.78Å; D526-K546 PolarHBondContact OD2-NZ 3.27Å; L542-K546 PolarHBondContact O-N 3.33Å; L543-K546 HydrophobicContact CD1-CD 4.45Å; L543-K546 VanDerWaalsContact O-CB 3.31Å; L543-K546 WeakPolarHBondContact O-CB 3.21Å; L543-K546 PolarHBondContact O-N 3.37Å; S544-K546 VanDerWaalsContact C-N 3.28Å; S544-K546 PolarHBondContact O-N 3.23Å; K546-Q550 WeakPolarHBondContact O-CB 3.46Å; K546-Q550 WeakPolarHBondContact O-CG 3.33Å; K546-Q550 PolarHBondContact O-N 3.13Å
547	Q	94.8	Very high	86.2	Confident	118 Å²	118	80.7 Å²	80.7	55%	0.551	39%	0.388	S	S	*	.	H	α-helix	trans	-67.9	-39	-179.6	-66.7	171.4	28.8	0	0	112	L543 S544 W545 K551	L543-Q547 WeakPolarHBondContact O-CG 3.44Å; L543-Q547 PolarHBondContact O-N 3.37Å; L543-Q547 VanDerWaalsContact O-N 3.17Å; S544-Q547 WeakPolarHBondContact O-CB 3.38Å; S544-Q547 PolarHBondContact O-N 2.76Å; S544-Q547 VanDerWaalsContact O-N 3.08Å; W545-Q547 VanDerWaalsContact C-N 3.31Å; W545-Q547 PolarHBondContact O-N 3.4Å; Q547-K551 WeakPolarHBondContact O-CB 3.27Å; Q547-K551 PolarHBondContact O-N 3.42Å
548	Q	91.9	Very high	84	Confident	84 Å²	84	84.5 Å²	84.5	39%	0.393	39%	0.391	S	S	.	.	H	α-helix	trans	-62.6	-51.4	176.2	-67.9	172.1	-10.9	0	0	111.5	L509 S544 W545 Q550 K551 L552	L509-Q548 HydrophobicContact CD1-CB 4.35Å; L509-Q548 HydrophobicContact CD2-CB 4.21Å; S544-Q548 WeakPolarHBondContact O-CG 3.05Å; S544-Q548 PolarHBondContact O-N 3.09Å; W545-Q548 PolarHBondContact O-N 3.15Å; Q548-Q550 PolarHBondContact O-N 3.35Å; Q548-K551 WeakPolarHBondContact O-CB 3.11Å; Q548-K551 PolarHBondContact O-N 3.03Å; Q548-K551 VanDerWaalsContact O-N 3.12Å; Q548-L552 PolarHBondContact O-N 3.49Å; Q548-L552 VanDerWaalsContact O-N 3.12Å
549	V	91.3	Very high	81.3	Confident	2 Å²	2	93.3 Å²	93.3	1%	0.012	43%	0.429	C	S	.	.	H	α-helix	trans	-66.8	-37	178.4	174	0	0	0	0	111.6	L508 L509 I518 Y521 L522 W545 K551 L552 F553	L508-V549 HydrophobicContact CB-CG2 4.44Å; L508-V549 HydrophobicContact CD1-CG2 4.38Å; L509-V549 HydrophobicContact CD2-CG2 4.28Å; I518-V549 HydrophobicContact CG2-CG1 3.87Å; Y521-V549 HydrophobicContact CD1-CB 4.46Å; Y521-V549 HydrophobicContact CD1-CG1 4.31Å; Y521-V549 HydrophobicContact CD1-CG2 4.07Å; Y521-V549 HydrophobicContact CE1-CG2 3.92Å; L522-V549 HydrophobicContact CD2-CB 4.4Å; L522-V549 HydrophobicContact CD2-CG1 4.21Å; L522-V549 HydrophobicContact CG-CG1 4.35Å; W545-V549 PolarHBondContact O-N 2.79Å; V549-K551 VanDerWaalsContact C-N 3.3Å; V549-K551 PolarHBondContact O-N 3.01Å; V549-L552 PolarHBondContact O-N 3.24Å; V549-F553 PolarHBondContact O-N 3.2Å
550	Q	90.7	Very high	78.3	Confident	63 Å²	63	97.4 Å²	97.4	29%	0.294	46%	0.457	S	S	.	.	H	α-helix	trans	-66.4	-27.9	171.9	-77	-177.4	-14.1	0	0	113.4	L522 K546 Q548 R554	L522-Q550 HydrophobicContact CD1-CG 3.93Å; L522-Q550 HydrophobicContact CD2-CG 3.8Å; K546-Q550 WeakPolarHBondContact O-CB 3.46Å; K546-Q550 WeakPolarHBondContact O-CG 3.33Å; K546-Q550 PolarHBondContact O-N 3.13Å; Q548-Q550 PolarHBondContact O-N 3.35Å; Q550-R554 VanDerWaalsContact O-CG 3.29Å; Q550-R554 WeakPolarHBondContact O-CG 3.43Å; Q550-R554 PolarHBondContact O-N 3.03Å
551	K	87.5	Confident	75.4	Confident	160 Å²	160	96.2 Å²	96.2	70%	0.696	46%	0.457	S	S	*	.	H	α-helix	trans	-68.3	-45.8	172	-171.4	-178.4	177.1	-173.8	0	110.3	Q547 Q548 V549 F553 R554 S555	Q547-K551 WeakPolarHBondContact O-CB 3.27Å; Q547-K551 PolarHBondContact O-N 3.42Å; Q548-K551 WeakPolarHBondContact O-CB 3.11Å; Q548-K551 PolarHBondContact O-N 3.03Å; Q548-K551 VanDerWaalsContact O-N 3.12Å; V549-K551 VanDerWaalsContact C-N 3.3Å; V549-K551 PolarHBondContact O-N 3.01Å; K551-F553 PolarHBondContact O-N 3.25Å; K551-R554 PolarHBondContact O-N 3.19Å; K551-R554 VanDerWaalsContact O-N 3.11Å; K551-S555 PolarHBondContact O-N 3.08Å; K551-S555 PolarHBondContact O-OG 2.84Å
552	L	78.5	Confident	72.6	Confident	58 Å²	58	95.1 Å²	95.1	30%	0.304	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-45.4	173.8	-68.7	-159.4	0	0	0	112.1	L509 Q548 V549 R554 S555 F556	L509-L552 HydrophobicContact CB-CD1 4.49Å; L509-L552 HydrophobicContact CD2-CD1 3.52Å; L509-L552 HydrophobicContact CD2-CG 3.82Å; Q548-L552 PolarHBondContact O-N 3.49Å; Q548-L552 VanDerWaalsContact O-N 3.12Å; V549-L552 PolarHBondContact O-N 3.24Å; L552-R554 PolarHBondContact O-N 3.44Å; L552-R554 VanDerWaalsContact O-N 3.13Å; L552-S555 WeakPolarHBondContact CA-OG 3.38Å; L552-S555 PolarHBondContact O-N 3.19Å; L552-S555 PolarHBondContact O-OG 3.15Å; L552-F556 WeakPolarHBondContact O-CD2 3.42Å; L552-F556 PolarHBondContact O-N 3.23Å
553	F	78.1	Confident	69.7	Low	67 Å²	67	102 Å²	102	29%	0.294	50%	0.499	S	S	.	.	H	α-helix	trans	-59.2	-25.7	176.9	-169.8	-114	0	0	0	113.5	E515 I518 V549 K551	E515-F553 HydrophobicContact CG-CE2 3.87Å; E515-F553 HydrophobicContact CG-CZ 4.46Å; E515-F553 WeakPolarHBondContact OE1-CE2 3.48Å; E515-F553 VanDerWaalsContact OE1-CZ 3.31Å; E515-F553 WeakPolarHBondContact OE1-CZ 3.41Å; I518-F553 HydrophobicContact CD1-CD2 4.29Å; I518-F553 HydrophobicContact CG2-CB 4.16Å; I518-F553 HydrophobicContact CG2-CD2 3.87Å; I518-F553 HydrophobicContact CG2-CG 4.16Å; V549-F553 PolarHBondContact O-N 3.2Å; K551-F553 PolarHBondContact O-N 3.25Å
554	R	76.3	Confident	66.8	Low	187 Å²	187	105.2 Å²	105.2	71%	0.706	52%	0.515	S	S	*	.	H	α-helix	trans	-89.2	-19.2	174.5	-69.8	173.4	-171.9	-172	4.8	114.2	Q550 K551 L552	Q550-R554 VanDerWaalsContact O-CG 3.29Å; Q550-R554 WeakPolarHBondContact O-CG 3.43Å; Q550-R554 PolarHBondContact O-N 3.03Å; K551-R554 PolarHBondContact O-N 3.19Å; K551-R554 VanDerWaalsContact O-N 3.11Å; L552-R554 PolarHBondContact O-N 3.44Å; L552-R554 VanDerWaalsContact O-N 3.13Å
555	S	65.4	Low	63.8	Low	83 Å²	83	107.8 Å²	107.8	58%	0.58	53%	0.533	S	S	*	.	H	α-helix	trans	-88.5	-8.9	177.1	55	0	0	0	0	114.1	K551 L552	K551-S555 PolarHBondContact O-N 3.08Å; K551-S555 PolarHBondContact O-OG 2.84Å; L552-S555 WeakPolarHBondContact CA-OG 3.38Å; L552-S555 PolarHBondContact O-N 3.19Å; L552-S555 PolarHBondContact O-OG 3.15Å
556	F	54.9	Low	60.8	Low	104 Å²	104	108.1 Å²	108.1	46%	0.456	55%	0.552	S	S	.	*	S	Bend	trans	-60.4	127	161.8	-75	-83.7	0	0	0	109.1	I518 L552 R558	I518-F556 HydrophobicContact CD1-CE2 3.9Å; I518-F556 HydrophobicContact CD1-CZ 4.46Å; L552-F556 WeakPolarHBondContact O-CD2 3.42Å; L552-F556 PolarHBondContact O-N 3.23Å; F556-R558 PolarHBondContact O-N 2.95Å
557	P	44.9	Very low	57.8	Low	115 Å²	115	118 Å²	118	75%	0.747	59%	0.591	S	S	*	*			trans	-66.8	106.9	-179.7	26.5	-33.3	0	0	0	109.5	K559	P557-K559 PolarHBondContact O-N 2.73Å
558	R	44.6	Very low	54.7	Low	177 Å²	177	123.6 Å²	123.6	67%	0.668	61%	0.607	S	S	*	*			trans	-63.4	94.8	171.4	-70.8	-179.6	175.5	178.6	-4.2	109.2	F556 T560	F556-R558 PolarHBondContact O-N 2.95Å; R558-T560 PolarHBondContact O-N 3.15Å
559	K	38.2	Very low	51.8	Low	204 Å²	204	128 Å²	128	89%	0.887	63%	0.627	S	S	*	*			trans	-55.7	106.1	164.9	-76.2	-171.7	173.6	-176.2	0	108	P557 L561	P557-K559 PolarHBondContact O-N 2.73Å; K559-L561 PolarHBondContact O-N 3.38Å
560	T	34.1	Very low	48.9	Very low	122 Å²	122	137.3 Å²	137.3	75%	0.748	67%	0.67	S	S	*	*			trans	36	68.4	169.4	-42.7	0	0	0	0	116	R558 L562	R558-T560 PolarHBondContact O-N 3.15Å; T560-L562 HydrophobicContact CG2-CB 3.87Å; T560-L562 PolarHBondContact O-N 3.09Å
561	L	34.3	Very low	46	Very low	101 Å²	101	141 Å²	141	53%	0.529	68%	0.682	S	S	.	*			trans	-74.2	71.4	159.9	-158.1	174.8	0	0	0	108.9	K559 I564	K559-L561 PolarHBondContact O-N 3.38Å; L561-I564 HydrophobicContact CD2-CB 4.32Å; L561-I564 HydrophobicContact CD2-CG2 4.19Å
562	L	37.3	Very low	43.1	Very low	140 Å²	140	140.7 Å²	140.7	73%	0.733	69%	0.688	S	S	*	*			trans	-138.1	19.4	178.1	-122.1	172.7	0	0	0	113.1	T560	T560-L562 HydrophobicContact CG2-CB 3.87Å; T560-L562 PolarHBondContact O-N 3.09Å
563	D	36.3	Very low	40.9	Very low	145 Å²	145	149.7 Å²	149.7	78%	0.775	72%	0.718	S	S	*	*	S	Bend	trans	-139.2	44.3	165.7	-161.4	16.7	0	0	0	113.1
564	I	35.2	Very low	38.5	Very low	144 Å²	144	149.7 Å²	149.7	74%	0.738	74%	0.736	S	S	*	*			trans	-131.5	14.5	171.5	-96.3	125.9	0	0	0	112.4	L561 G566	L561-I564 HydrophobicContact CD2-CB 4.32Å; L561-I564 HydrophobicContact CD2-CG2 4.19Å; I564-G566 PolarHBondContact O-N 3.41Å
565	S	33.6	Very low	36.2	Very low	107 Å²	107	151 Å²	151	75%	0.748	75%	0.747	S	S	*	*	S	Bend	trans	-73.3	-13.2	164.7	-56.7	0	0	0	0	113
566	G	33.5	Very low	34.4	Very low	59 Å²	59	150.3 Å²	150.3	61%	0.608	75%	0.754	S	S	*	*	S	Bend	trans	-81.8	-10	-163.7	0	0	0	0	0	118.1	I564	I564-G566 PolarHBondContact O-N 3.41Å
567	Y	31.6	Very low	33.3	Very low	238 Å²	238	154 Å²	154	93%	0.933	77%	0.772	S	S	*	*			trans	-131.7	59.1	-177.2	-92.5	-79.4	0	0	0	113.9
568	R	30.3	Very low	32.5	Very low	236 Å²	236	153.1 Å²	153.1	89%	0.891	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-81.8	130.3	162.9	-158.9	178.3	-161.5	-178.9	6	109.6	Q570	R568-Q570 PolarHBondContact O-N 2.83Å
569	Q	32	Very low	31.7	Very low	175 Å²	175	152.5 Å²	152.5	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-55.7	126.3	178.3	-71.5	-175.8	-10.6	0	0	112.1
570	Q	29.1	Very low	31.3	Very low	198 Å²	198	148.3 Å²	148.3	93%	0.925	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-89.8	116.4	154.4	-96.4	-175.2	-28.4	0	0	109.3	R568	R568-Q570 PolarHBondContact O-N 2.83Å
571	R	29.6	Very low	31.2	Very low	142 Å²	142	150.2 Å²	150.2	54%	0.536	78%	0.78	S	S	.	*			trans	-137.3	143.3	161.5	-148	172.4	-176.9	-126.1	2.1	109.1	G267 G269	G267-R571 PolarHBondContact O-NE 3.23Å; G267-R571 VanDerWaalsContact O-NE 3.17Å; G267-R571 PolarHBondContact O-NH2 3.48Å; G269-R571 PolarHBondContact O-NH1 2.63Å
572	N	27.6	Very low	31.3	Very low	152 Å²	152	151.2 Å²	151.2	81%	0.813	79%	0.792	S	S	*	*			trans	-79.8	123.3	-144.9	-171.5	18.9	0	0	0	116.5
573	R	31.9	Very low	30.9	Very low	248 Å²	248	151.5 Å²	151.5	94%	0.936	80%	0.8	S	S	*	*			trans	-152	143.7	141.8	-77.1	-171.2	178.1	-180	-0.8	106
574	G	28.2	Very low	30.6	Very low	66 Å²	66	149.5 Å²	149.5	68%	0.68	80%	0.803	S	S	*	*			cis	179.5	140.1	-5.5	0	0	0	0	0	108.7
575	F	28.6	Very low	30.2	Very low	215 Å²	215	146.1 Å²	146.1	94%	0.943	81%	0.805	S	S	*	*			trans	-28.9	138.2	-175.5	-133.3	-105.5	0	0	0	118.6
576	G	27	Very low	29.9	Very low	69 Å²	69	146.4 Å²	146.4	71%	0.711	81%	0.807	S	S	*	*			trans	167.4	91.3	166.6	0	0	0	0	0	117.3
577	Q	31.7	Very low	29.6	Very low	182 Å²	182	152.4 Å²	152.4	85%	0.85	82%	0.821	S	S	*	*			trans	23.3	118.9	145.1	-64.1	165.8	6.6	0	0	118.5
578	S	27.2	Very low	29.4	Very low	95 Å²	95	145 Å²	145	66%	0.664	82%	0.817	S	S	*	*			cis	114.5	130.5	31.2	60.2	0	0	0	0	111.2
579	N	28.4	Very low	29.3	Very low	165 Å²	165	140.2 Å²	140.2	88%	0.882	82%	0.82	S	S	*	*			trans	70.9	149.1	175.8	-52.3	-17.8	0	0	0	115.2
580	S	30.3	Very low	29.2	Very low	116 Å²	116	135.7 Å²	135.7	81%	0.811	82%	0.82	S	S	*	*			cis	-135.9	175.9	11.8	55	0	0	0	0	114
581	L	32.8	Very low	29.2	Very low	162 Å²	162	135.8 Å²	135.8	85%	0.848	82%	0.823	S	S	*	*			trans	-78.9	156.9	178	-67.8	165.9	0	0	0	112.8
582	P	36.1	Very low	29.2	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	84%	0.835	S	S	*	*			trans	-82.7	139.2	170.6	33.6	-33.2	0	0	0	112.5
583	T	29.1	Very low	29.3	Very low	145 Å²	145	136.8 Å²	136.8	89%	0.89	84%	0.839	S	S	*	*			trans	-110.4	144.8	162.5	-65.5	0	0	0	0	108.6
584	A	29.7	Very low	29.2	Very low	103 Å²	103	136.8 Å²	136.8	85%	0.851	84%	0.839	S	S	*	*			trans	-77.3	157.3	-170.8	0	0	0	0	0	114.3
585	G	26.4	Very low	29.3	Very low	74 Å²	74	140.6 Å²	140.6	76%	0.763	84%	0.844	S	S	*	*			trans	145.9	126.8	148.7	0	0	0	0	0	118.2
586	S	26.6	Very low	30.2	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	83%	0.83	S	S	*	*			trans	76.8	121.8	144.6	-138.1	0	0	0	0	122.1
587	M	27.5	Very low	30.3	Very low	184 Å²	184	142.8 Å²	142.8	91%	0.906	84%	0.837	S	S	*	*				27.3	124.6	128.9	-49	-59.8	-178	0	0	119.9
588	G	28.1	Very low	30.1	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	83%	0.826	S	S	*	*			trans	-176.6	110.6	163.6	0	0	0	0	0	115.3
589	S	28.1	Very low	30.2	Very low	136 Å²	136	144.7 Å²	144.7	95%	0.951	83%	0.829	S	S	*	*			trans	-75.4	150.9	170.5	-53.2	0	0	0	0	111.8
590	G	28.8	Very low	30	Very low	79 Å²	79	144.2 Å²	144.2	81%	0.814	82%	0.822	S	S	*	*			trans	-176.4	98.9	173.6	0	0	0	0	0	117
591	M	30.6	Very low	29.9	Very low	200 Å²	200	145 Å²	145	99%	0.985	82%	0.816	S	S	*	*			trans	-78.3	136.4	165.9	-178	83.3	73.4	0	0	110.1
592	G	28.9	Very low	30.3	Very low	77 Å²	77	142.7 Å²	142.7	79%	0.794	81%	0.81	S	S	*	*			trans	-173.3	117.7	174.3	0	0	0	0	0	116.8
593	R	29.7	Very low	29.9	Very low	239 Å²	239	141.8 Å²	141.8	90%	0.902	81%	0.807	S	S	*	*			trans	-93.9	144.8	165.3	-65.3	173.2	171.5	-114.4	8.1	110.1
594	R	30.1	Very low	30	Very low	247 Å²	247	145.9 Å²	145.9	93%	0.932	81%	0.806	S	S	*	*				163.6	138.4	117.5	-91.2	168	177.8	171.6	-0.1	114.5
595	N	30.2	Very low	29.8	Very low	147 Å²	147	147 Å²	147	79%	0.786	80%	0.797	S	S	*	*			trans	-85.6	169	150.8	-139.4	15.3	0	0	0	107.4
596	P	48	Very low	29.9	Very low	100 Å²	100	149.6 Å²	149.6	65%	0.649	80%	0.798	S	S	*	*			cis	-149	-177.9	33.4	44	-23.3	0	0	0	118
597	R	29.1	Very low	30.5	Very low	229 Å²	229	149.5 Å²	149.5	86%	0.864	80%	0.795	S	S	*	*			trans	42	150.5	143.9	-69.4	178.5	176.1	-172.6	-1.3	120.2
598	Q	26.4	Very low	30.4	Very low	130 Å²	130	146.4 Å²	146.4	61%	0.607	79%	0.791	S	S	*	*				-176.1	173.3	56	-168.7	163.3	-42.3	0	0	113.3
599	Y	29.1	Very low	30.4	Very low	188 Å²	188	147.4 Å²	147.4	74%	0.737	79%	0.792	S	S	*	*			trans	80	132.9	169.2	-51.3	-75.6	0	0	0	117.2
600	Q	24.7	Very low	30.4	Very low	155 Å²	155	152.3 Å²	152.3	72%	0.724	79%	0.789	S	S	*	*			cis	111.3	107.8	4.6	-79.4	-162.8	-53.2	0	0	118.2
601	I	28	Very low	30.3	Very low	133 Å²	133	156.8 Å²	156.8	68%	0.682	79%	0.793	S	S	*	*			trans	71	158.1	138.1	-62.2	170.5	0	0	0	116
602	P	41.9	Very low	30.1	Very low	112 Å²	112	150.5 Å²	150.5	73%	0.727	78%	0.78	S	S	*	*			cis	-109.3	173.8	-8.7	12.8	12.2	0	0	0	113.4
603	S	27.9	Very low	30.3	Very low	104 Å²	104	154.2 Å²	154.2	73%	0.727	78%	0.781	S	S	*	*			cis	111.8	114.5	18.2	-57.8	0	0	0	0	113.8
604	R	29.7	Very low	30.5	Very low	231 Å²	231	150.6 Å²	150.6	87%	0.872	78%	0.779	S	S	*	*			trans	-172.2	129.9	137.9	-111.5	179.3	172.7	173.4	-1.1	116.6
605	N	25.5	Very low	30.3	Very low	126 Å²	126	141.6 Å²	141.6	67%	0.674	76%	0.763	S	S	*	*			trans	48.3	111	143.1	-63	20.7	0	0	0	121.7
606	V	29.6	Very low	30.5	Very low	129 Å²	129	141 Å²	141	78%	0.782	76%	0.764	S	S	*	*				59.8	147.7	80.5	-52.7	0	0	0	0	115.8
607	P	39.3	Very low	29.7	Very low	110 Å²	110	140.9 Å²	140.9	71%	0.714	77%	0.766	S	S	*	*			cis	-141.2	178.8	19.8	44.1	-25.5	0	0	0	118.7
608	S	25.4	Very low	29.7	Very low	120 Å²	120	132.8 Å²	132.8	84%	0.839	75%	0.754	S	S	*	*			trans	37.2	142.9	147.5	-57.3	0	0	0	0	121.8
609	A	27.4	Very low	30.1	Very low	104 Å²	104	135.5 Å²	135.5	86%	0.86	76%	0.764	S	S	*	*			cis	-158.8	-162.8	39.5	0	0	0	0	0	115.6
610	R	28.1	Very low	30.3	Very low	238 Å²	238	132.5 Å²	132.5	90%	0.898	77%	0.765	S	S	*	*			trans	-83.6	142.4	-161.4	-77.4	176.6	170.6	175.7	-4.1	117.6
611	L	27.6	Very low	30.6	Very low	173 Å²	173	130.3 Å²	130.3	91%	0.906	77%	0.767	S	S	*	*				67.5	124	123.8	-163.5	77.2	0	0	0	122.8
612	G	25.5	Very low	30.6	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	77%	0.774	S	S	*	*			trans	96.5	163.6	148	0	0	0	0	0	117.6
613	L	33.3	Very low	29.9	Very low	155 Å²	155	131.9 Å²	131.9	81%	0.812	78%	0.78	S	S	*	*			cis	-171.4	124.2	-26.5	-166.6	78.8	0	0	0	109
614	L	34.1	Very low	29.9	Very low	163 Å²	163	135.7 Å²	135.7	85%	0.853	79%	0.786	S	S	*	*			trans	58.3	157.2	168.2	-66.3	160.7	0	0	0	118.3
615	G	26	Very low	30.1	Very low	58 Å²	58	134.9 Å²	134.9	60%	0.598	78%	0.783	S	S	*	*			cis	175.6	166.4	-8.4	0	0	0	0	0	115.9
616	T	33.5	Very low	30.5	Very low	133 Å²	133	134.8 Å²	134.8	82%	0.816	78%	0.783	S	S	*	*			trans	58.5	99.2	147.5	58.6	0	0	0	0	124.7
617	S	31.3	Very low	30.6	Very low	99 Å²	99	134 Å²	134	69%	0.692	78%	0.779	S	S	*	*				66.8	128	108.9	-163	0	0	0	0	124.5
618	G	29.3	Very low	30.4	Very low	58 Å²	58	134.4 Å²	134.4	60%	0.598	78%	0.779	S	S	*	*			trans	160.2	118.4	148.3	0	0	0	0	0	114.8
619	F	35.3	Very low	31	Very low	188 Å²	188	133.2 Å²	133.2	83%	0.825	78%	0.776	S	S	*	*				71.5	140.9	69.1	-71.1	-49.5	0	0	0	113.8
620	V	33.7	Very low	31.1	Very low	124 Å²	124	131.7 Å²	131.7	75%	0.752	76%	0.763	S	S	*	*			cis	-150.7	154.2	8.1	-104.5	0	0	0	0	107.8
621	S	29.5	Very low	32.3	Very low	109 Å²	109	126.1 Å²	126.1	76%	0.762	76%	0.758	S	S	*	*				57.2	136.7	68.1	-166.5	0	0	0	0	116.9
622	S	28.5	Very low	32.7	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	76%	0.758	S	S	*	*			trans	-153.5	146.5	160.5	77.2	0	0	0	0	112
623	N	27.1	Very low	33.1	Very low	158 Å²	158	128.6 Å²	128.6	85%	0.845	76%	0.76	S	S	*	*			trans	-161	168.1	177.7	-163.1	1	0	0	0	108.9
624	Q	28.3	Very low	33.1	Very low	185 Å²	185	128.2 Å²	128.2	86%	0.864	76%	0.756	S	S	*	*			trans	-132.3	172.3	180	-79.5	-158.2	77.3	0	0	115.4
625	R	33.1	Very low	33	Very low	213 Å²	213	128.1 Å²	128.1	80%	0.804	75%	0.749	S	S	*	*			trans	-128.6	-172.5	-167.8	-58.4	178.4	167.3	166.9	-8.3	110.6
626	N	34.5	Very low	33.5	Very low	125 Å²	125	133.4 Å²	133.4	67%	0.668	76%	0.758	S	S	*	*			cis	-165.2	138.4	31.9	-125	16.7	0	0	0	109.2
627	T	32.9	Very low	33.1	Very low	113 Å²	113	130.5 Å²	130.5	69%	0.693	75%	0.754	S	S	*	*				61.2	130.4	94.4	71.2	0	0	0	0	120.5
628	T	34.9	Very low	33.1	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.724	76%	0.763	S	S	*	*			trans	-150	169.1	152.8	43.3	0	0	0	0	111.3
629	A	36.8	Very low	33.3	Very low	95 Å²	95	140.2 Å²	140.2	79%	0.785	76%	0.763	S	S	*	*			trans	-145.8	-178.4	-174.9	0	0	0	0	0	113.2
630	A	30.7	Very low	32.9	Very low	71 Å²	71	137.1 Å²	137.1	59%	0.587	76%	0.755	S	S	*	*			trans	-133.6	171.2	-166.6	0	0	0	0	0	115	Q35	Q35-A630 HydrophobicContact CG-CB 4.02Å
631	P	52.9	Low	32.9	Very low	121 Å²	121	137.7 Å²	137.7	79%	0.786	75%	0.753	S	S	*	*			trans	-123.8	179.9	-165	43.8	-31.8	0	0	0	116.7
632	T	34.9	Very low	32.9	Very low	147 Å²	147	143.7 Å²	143.7	90%	0.902	76%	0.759	S	S	*	*			trans	-147	170.6	165.3	1	0	0	0	0	112.8
633	I	34.2	Very low	33.1	Very low	148 Å²	148	146.4 Å²	146.4	76%	0.759	76%	0.756	S	S	*	*			trans	-151.3	163.3	-167.4	-132.4	-179.6	0	0	0	108.4
634	M	33.6	Very low	33.1	Very low	147 Å²	147	143.8 Å²	143.8	72%	0.724	76%	0.757	S	S	*	*			cis	-138.4	-151.6	14.5	-126.8	174.7	-167.8	0	0	107.6
635	K	32.7	Very low	33.4	Very low	161 Å²	161	142 Å²	142	70%	0.7	75%	0.753	S	S	*	*			cis	-167.9	169	-5.5	-121	-173.6	-173.6	-169.2	0	104.9
636	Q	36.7	Very low	33.9	Very low	168 Å²	168	138 Å²	138	79%	0.785	75%	0.754	S	S	*	*			cis	-163.2	153.9	-24.8	-141.6	172.9	-24.7	0	0	107.8
637	G	23.8	Very low	33.5	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	76%	0.76	S	S	*	*			trans	172.6	160.3	175.8	0	0	0	0	0	113.5
638	R	32.3	Very low	33.1	Very low	232 Å²	232	133.6 Å²	133.6	88%	0.875	76%	0.762	S	S	*	*			trans	-154.7	159	-166.3	-100	-172.4	-176.8	-147.9	14.9	110.2
639	Q	33	Very low	32.8	Very low	130 Å²	130	133.2 Å²	133.2	61%	0.607	76%	0.764	S	S	*	*			cis	-159.5	-170	1.2	-147.5	-179.8	-100.7	0	0	110.7
640	N	27.6	Very low	32.3	Very low	123 Å²	123	136.1 Å²	136.1	66%	0.658	77%	0.766	S	S	*	*			trans	76.5	127.6	168.2	-60.3	-2	0	0	0	114.9
641	L	32	Very low	32.2	Very low	135 Å²	135	138.6 Å²	138.6	71%	0.707	78%	0.779	S	S	*	*			cis	94.9	116.2	40.6	-81.1	167.7	0	0	0	113
642	W	30.6	Very low	31.1	Very low	236 Å²	236	141.4 Å²	141.4	89%	0.894	78%	0.784	S	S	*	*				176.6	172.2	125.2	-94.8	104	0	0	0	111.5
643	F	33.3	Very low	31.7	Very low	177 Å²	177	139.1 Å²	139.1	78%	0.776	77%	0.771	S	S	*	*			trans	-104.2	162.9	-159.1	-74.2	-112.2	0	0	0	115.5
644	A	26.6	Very low	31.4	Very low	103 Å²	103	138.2 Å²	138.2	85%	0.851	78%	0.779	S	S	*	*			trans	-154.1	138.7	140.9	0	0	0	0	0	112.3
645	N	33.6	Very low	31.3	Very low	148 Å²	148	141.1 Å²	141.1	79%	0.791	78%	0.782	S	S	*	*			trans	-162.4	140.1	171.7	-167.2	16.1	0	0	0	108
646	P	44.7	Very low	31.2	Very low	127 Å²	127	140.4 Å²	140.4	83%	0.825	79%	0.791	S	S	*	*				-145.2	165.6	105.1	36.6	-20.4	0	0	0	112
647	G	25.1	Very low	31	Very low	76 Å²	76	139.4 Å²	139.4	78%	0.784	79%	0.786	S	S	*	*			cis	133.7	155.8	32.5	0	0	0	0	0	107.3
648	G	25.9	Very low	31.3	Very low	71 Å²	71	141 Å²	141	73%	0.732	79%	0.786	S	S	*	*			cis	178.5	179.5	-6.4	0	0	0	0	0	112.7
649	S	28.2	Very low	31.3	Very low	110 Å²	110	135 Å²	135	77%	0.769	78%	0.78	S	S	*	*			trans	81.6	128.4	157.8	-54.6	0	0	0	0	122.5
650	N	27.1	Very low	31.2	Very low	155 Å²	155	135.6 Å²	135.6	83%	0.829	79%	0.791	S	S	*	*			trans	72.4	139.2	154	-54.6	-15.9	0	0	0	118.2
651	S	27.6	Very low	31.5	Very low	124 Å²	124	138.5 Å²	138.5	87%	0.867	80%	0.801	S	S	*	*			cis	-135.5	172.1	13.1	-68	0	0	0	0	113.4
652	M	30.7	Very low	31.6	Very low	179 Å²	179	143.1 Å²	143.1	88%	0.882	81%	0.809	S	S	*	*			trans	-112	-166.2	-175.4	-147.7	-155.1	-176	0	0	112.7
653	P	46.6	Very low	31.8	Very low	99 Å²	99	138.9 Å²	138.9	64%	0.643	81%	0.809	S	S	*	*				-107.1	-177.1	-108	40.4	-27.8	0	0	0	115.5
654	S	27.3	Very low	31.9	Very low	130 Å²	130	141.1 Å²	141.1	91%	0.909	81%	0.812	S	S	*	*			trans	-144.6	153.4	156.4	-81	0	0	0	0	111.4
655	R	32.5	Very low	32.2	Very low	208 Å²	208	141.1 Å²	141.1	79%	0.785	81%	0.807	S	S	*	*			trans	-142.1	123.2	-158.8	176.2	-169.3	-171.5	-124.9	10.9	111.2	H657	R655-H657 VanDerWaalsContact CZ-NE2 3.34Å; R655-H657 PolarHBondContact NH2-NE2 3.17Å
656	T	30.2	Very low	32	Very low	146 Å²	146	141.8 Å²	141.8	90%	0.896	81%	0.809	S	S	*	*			trans	-135.9	149.7	170.5	38.8	0	0	0	0	111
657	H	32.7	Very low	32	Very low	146 Å²	146	140.9 Å²	140.9	68%	0.676	80%	0.803	S	S	*	*			trans	-122.2	143.3	-174.5	-80.7	-93.8	0	0	0	111.3	R655	R655-H657 VanDerWaalsContact CZ-NE2 3.34Å; R655-H657 PolarHBondContact NH2-NE2 3.17Å
658	S	29.5	Very low	32.3	Very low	106 Å²	106	143.3 Å²	143.3	74%	0.741	80%	0.803	S	S	*	*			trans	-161.5	95.8	152.7	43.3	0	0	0	0	109.2
659	S	32.7	Very low	32.5	Very low	107 Å²	107	148.7 Å²	148.7	75%	0.748	81%	0.808	S	S	*	*				71.1	80.2	79.7	74.8	0	0	0	0	114.1
660	V	31.5	Very low	32.7	Very low	141 Å²	141	148.5 Å²	148.5	86%	0.855	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-74.2	124.9	167.5	177.3	0	0	0	0	109.6
661	Q	32.7	Very low	32.7	Very low	184 Å²	184	146.2 Å²	146.2	86%	0.86	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-91.2	127.6	171.8	-73.6	-172.3	-22.4	0	0	111.3
662	R	35	Very low	33.4	Very low	233 Å²	233	145.1 Å²	145.1	88%	0.879	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-86.4	134.9	160.8	-75.1	-178.3	170.2	101.7	-8.6	109.4
663	T	35.5	Very low	33.4	Very low	146 Å²	146	145 Å²	145	90%	0.896	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-85.8	155.7	153.2	45.3	0	0	0	0	109.7
664	R	33.6	Very low	32.6	Very low	224 Å²	224	148.2 Å²	148.2	85%	0.845	80%	0.798	S	S	*	*			trans	-123.8	158.3	-171.6	-76.3	174.1	148.8	177.1	-7	111.2
665	S	33.2	Very low	32.6	Very low	104 Å²	104	150.1 Å²	150.1	73%	0.727	79%	0.794	S	S	*	*			trans	64.6	156.2	146.6	45.2	0	0	0	0	118
666	L	30.7	Very low	32.6	Very low	162 Å²	162	147 Å²	147	85%	0.848	79%	0.792	S	S	*	*			cis	-170.7	-178.2	-9.5	-103.7	166.8	0	0	0	105.3
667	P	43.6	Very low	32.6	Very low	107 Å²	107	147.6 Å²	147.6	70%	0.695	79%	0.787	S	S	*	*			cis	-123.7	-175.4	-21.6	39.2	-23.8	0	0	0	112.9
668	V	32.7	Very low	32.5	Very low	128 Å²	128	149.8 Å²	149.8	78%	0.776	80%	0.795	S	S	*	*			trans	-102.4	149.2	163.1	173.6	0	0	0	0	109.3	T670	V668-T670 HydrophobicContact CG1-CG2 4.08Å
669	H	29.4	Very low	32.4	Very low	183 Å²	183	153 Å²	153	85%	0.847	80%	0.798	S	S	*	*			trans	-130.7	145.2	170	-141.3	-76.4	0	0	0	110.3
670	T	31.5	Very low	32.2	Very low	106 Å²	106	155.5 Å²	155.5	65%	0.65	80%	0.798	S	S	*	*			trans	-142.3	176.2	-175.1	57.9	0	0	0	0	112.3	V668	V668-T670 HydrophobicContact CG1-CG2 4.08Å
671	S	28.1	Very low	32.6	Very low	108 Å²	108	153.8 Å²	153.8	76%	0.755	79%	0.79	S	S	*	*			trans	77.1	160.2	171.4	85	0	0	0	0	116.6
672	P	42	Very low	32.3	Very low	101 Å²	101	152.4 Å²	152.4	66%	0.656	78%	0.783	S	S	*	*			cis	-136.7	-158.5	-49.2	34.6	-15.7	0	0	0	112.3
673	Q	30.6	Very low	31.9	Very low	175 Å²	175	149.2 Å²	149.2	82%	0.818	78%	0.776	S	S	*	*			trans	77.8	93.7	163.1	-62.9	163.4	3.4	0	0	118.4
674	N	29.6	Very low	31.7	Very low	167 Å²	167	150.6 Å²	150.6	89%	0.893	77%	0.773	S	S	*	*				-147.8	151.5	100.6	-117.4	-18.7	0	0	0	110.5
675	M	28	Very low	31.6	Very low	170 Å²	170	148 Å²	148	84%	0.837	78%	0.775	S	S	*	*			trans	-139.4	170.7	-171.3	-111.6	-74.7	-173.1	0	0	109.7
676	L	32.4	Very low	32	Very low	142 Å²	142	148.4 Å²	148.4	74%	0.743	78%	0.775	S	S	*	*			trans	76.1	135.1	-179.1	-47.5	173.2	0	0	0	114.5
677	M	30.4	Very low	32.3	Very low	159 Å²	159	146.8 Å²	146.8	78%	0.783	77%	0.771	S	S	*	*			cis	-166.9	141.8	-19.7	-129.1	178	-168.5	0	0	108.6
678	F	30.1	Very low	32.2	Very low	192 Å²	192	146.4 Å²	146.4	84%	0.842	77%	0.767	S	S	*	*				-173	163.6	123.6	-116.2	-83.8	0	0	0	112.3
679	Q	28.1	Very low	33	Very low	174 Å²	174	148 Å²	148	81%	0.813	77%	0.766	S	S	*	*			trans	-60.9	155.8	-159.8	-127.7	123.6	15.5	0	0	118.8
680	Q	26.7	Very low	34.1	Very low	160 Å²	160	143.2 Å²	143.2	75%	0.748	75%	0.751	S	S	*	*			trans	-76.5	168.4	163.3	-100.6	-120.3	1.5	0	0	111.3	E682	Q680-E682 VanDerWaalsContact OE1-N 3.16Å
681	P	40.3	Very low	35.5	Very low	104 Å²	104	142.6 Å²	142.6	68%	0.675	74%	0.744	S	S	*	*			cis	-143.8	165.3	42	42.1	-22.2	0	0	0	121.9
682	E	26.8	Very low	37.3	Very low	155 Å²	155	142.3 Å²	142.3	72%	0.724	73%	0.733	S	S	*	*			trans	87.1	144.3	141.8	-84.8	165.5	160.6	0	0	123.9	Q680	Q680-E682 VanDerWaalsContact OE1-N 3.16Å
683	F	27.8	Very low	38.2	Very low	167 Å²	167	142.6 Å²	142.6	73%	0.732	73%	0.729	S	S	*	*			trans	66	92.4	172.8	-80.5	-82.9	0	0	0	123
684	Q	29.5	Very low	39.9	Very low	175 Å²	175	138.9 Å²	138.9	82%	0.818	72%	0.715	S	S	*	*			trans	54.7	124.1	134.2	-67.7	-179.9	-28	0	0	121.6
685	L	31.5	Very low	42.1	Very low	170 Å²	170	140.4 Å²	140.4	89%	0.89	71%	0.708	S	S	*	*			trans	-122	162.4	171	-85.2	172.3	0	0	0	110.9
686	P	42.7	Very low	44.3	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-79	161.4	-166.4	31.5	-36.8	0	0	0	115.5
687	V	36.3	Very low	45.9	Very low	128 Å²	128	136.6 Å²	136.6	78%	0.776	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-63.7	140.7	178.1	-179.9	0	0	0	0	111.5
688	T	42.1	Very low	48.2	Very low	99 Å²	99	132.5 Å²	132.5	61%	0.607	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-100.3	154.7	176.6	54.5	0	0	0	0	111.4	P690	T688-P690 WeakPolarHBondContact O-CD 3.35Å
689	E	49.8	Very low	50.5	Low	161 Å²	161	128.1 Å²	128.1	75%	0.752	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-24.1	-174.2	-65.9	-166.4	126.5	0	0	118.3	D691 I692	E689-D691 PolarHBondContact O-N 3.14Å; E689-D691 VanDerWaalsContact O-N 3.1Å; E689-I692 WeakPolarHBondContact O-CB 3.31Å; E689-I692 PolarHBondContact O-N 3.02Å
690	P	52.4	Low	52.6	Low	82 Å²	82	123.4 Å²	123.4	53%	0.532	65%	0.645	S	S	.	*	H	α-helix	trans	-56.1	-30.2	-175.3	-29.7	37.3	0	0	0	115.9	T688 I692 N694	T688-P690 WeakPolarHBondContact O-CD 3.35Å; P690-I692 VanDerWaalsContact C-N 3.28Å; P690-I692 PolarHBondContact O-N 2.62Å; P690-N694 PolarHBondContact O-N 3.03Å; P690-N694 PolarHBondContact O-ND2 3.48Å
691	D	59.9	Low	54.8	Low	94 Å²	94	121.7 Å²	121.7	50%	0.503	64%	0.64	S	S	.	*	H	α-helix	trans	-66.7	-27.7	177.9	-84	-54.9	0	0	0	113.3	E689 R695	E689-D691 PolarHBondContact O-N 3.14Å; E689-D691 VanDerWaalsContact O-N 3.1Å; D691-R695 WeakPolarHBondContact O-CB 3.43Å; D691-R695 WeakPolarHBondContact O-CG 3.23Å; D691-R695 PolarHBondContact O-N 3.43Å
692	I	66.9	Low	56.3	Low	102 Å²	102	119.2 Å²	119.2	52%	0.523	63%	0.625	S	S	.	*	H	α-helix	trans	-67.7	-45.4	-177	-59.2	176.8	0	0	0	110	E689 P690 R695 L696	E689-I692 WeakPolarHBondContact O-CB 3.31Å; E689-I692 PolarHBondContact O-N 3.02Å; P690-I692 VanDerWaalsContact C-N 3.28Å; P690-I692 PolarHBondContact O-N 2.62Å; I692-R695 PolarHBondContact O-N 3.01Å; I692-L696 WeakPolarHBondContact O-CB 3.46Å; I692-L696 PolarHBondContact O-N 3.11Å
693	N	59.5	Low	58.5	Low	106 Å²	106	118 Å²	118	57%	0.567	62%	0.621	S	S	*	*	H	α-helix	trans	-67.1	-41.8	178.1	-75.4	-4.3	0	0	0	112	R695 L696 E697	N693-R695 VanDerWaalsContact C-N 3.3Å; N693-R695 PolarHBondContact O-N 3.25Å; N693-L696 PolarHBondContact O-N 2.98Å; N693-L696 VanDerWaalsContact O-N 3.09Å; N693-E697 PolarHBondContact O-N 3.01Å
694	N	68	Low	60.6	Low	98 Å²	98	114.1 Å²	114.1	52%	0.524	61%	0.611	S	S	.	*	H	α-helix	trans	-60.9	-39.7	176.4	-77.6	-84.9	0	0	0	111.9	P690 S698	P690-N694 PolarHBondContact O-N 3.03Å; P690-N694 PolarHBondContact O-ND2 3.48Å; N694-S698 WeakPolarHBondContact O-CB 3.32Å; N694-S698 PolarHBondContact O-N 3.28Å; N694-S698 VanDerWaalsContact O-N 3.09Å; N694-S698 PolarHBondContact O-OG 2.99Å
695	R	75.1	Confident	62.7	Low	198 Å²	198	112.6 Å²	112.6	75%	0.747	60%	0.604	S	S	*	*	H	α-helix	trans	-66.1	-38.5	172.1	-76.2	179.3	169.5	-143.1	-3.4	112.6	D691 I692 N693 S698 L699	D691-R695 WeakPolarHBondContact O-CB 3.43Å; D691-R695 WeakPolarHBondContact O-CG 3.23Å; D691-R695 PolarHBondContact O-N 3.43Å; I692-R695 PolarHBondContact O-N 3.01Å; N693-R695 VanDerWaalsContact C-N 3.3Å; N693-R695 PolarHBondContact O-N 3.25Å; R695-S698 PolarHBondContact O-N 2.93Å; R695-L699 WeakPolarHBondContact O-CB 3.41Å; R695-L699 PolarHBondContact O-N 3.44Å
696	L	73	Confident	64.4	Low	101 Å²	101	111 Å²	111	53%	0.529	59%	0.591	S	S	.	*	H	α-helix	trans	-67.5	-43.9	179.3	-141.3	77.6	0	0	0	112	I692 N693 L699 C700	I692-L696 WeakPolarHBondContact O-CB 3.46Å; I692-L696 PolarHBondContact O-N 3.11Å; N693-L696 PolarHBondContact O-N 2.98Å; N693-L696 VanDerWaalsContact O-N 3.09Å; L696-L699 PolarHBondContact O-N 2.72Å; L696-C700 PolarHBondContact O-N 3.16Å; L696-C700 PolarHBondContact O-SG 3.44Å; L696-C700 VanDerWaalsContact O-SG 3.42Å
697	E	66.9	Low	65.5	Low	131 Å²	131	109.6 Å²	109.6	61%	0.612	59%	0.589	S	S	*	*	H	α-helix	trans	-63.6	-42.7	175.3	-70.9	-177.6	-171.3	0	0	111.3	N693 L699 C700 L701	N693-E697 PolarHBondContact O-N 3.01Å; E697-L699 VanDerWaalsContact C-N 3.34Å; E697-L699 PolarHBondContact O-N 3.37Å; E697-C700 PolarHBondContact O-N 3.1Å; E697-L701 WeakPolarHBondContact O-CB 3.46Å; E697-L701 WeakPolarHBondContact O-CG 3.44Å; E697-L701 PolarHBondContact O-N 3.23Å
698	S	78.4	Confident	66.8	Low	74 Å²	74	110.3 Å²	110.3	52%	0.517	59%	0.588	S	S	.	*	H	α-helix	trans	-60.5	-40.9	174.5	-57.7	0	0	0	0	112.6	N694 R695 S702	N694-S698 WeakPolarHBondContact O-CB 3.32Å; N694-S698 PolarHBondContact O-N 3.28Å; N694-S698 VanDerWaalsContact O-N 3.09Å; N694-S698 PolarHBondContact O-OG 2.99Å; R695-S698 PolarHBondContact O-N 2.93Å; S698-S702 WeakPolarHBondContact O-CB 3.29Å; S698-S702 PolarHBondContact O-N 2.9Å
699	L	78.9	Confident	67.4	Low	100 Å²	100	108 Å²	108	52%	0.524	58%	0.584	S	S	.	*	H	α-helix	trans	-67.4	-44	177.1	-176.8	66.9	0	0	0	111.7	R695 L696 E697 L701 S702 M703	R695-L699 WeakPolarHBondContact O-CB 3.41Å; R695-L699 PolarHBondContact O-N 3.44Å; L696-L699 PolarHBondContact O-N 2.72Å; E697-L699 VanDerWaalsContact C-N 3.34Å; E697-L699 PolarHBondContact O-N 3.37Å; L699-L701 VanDerWaalsContact C-N 3.34Å; L699-L701 PolarHBondContact O-N 3.27Å; L699-S702 PolarHBondContact O-N 2.97Å; L699-M703 HydrophobicContact CG-SD 4.48Å; L699-M703 WeakPolarHBondContact O-CB 3.07Å; L699-M703 WeakPolarHBondContact O-CG 3.32Å; L699-M703 PolarHBondContact O-N 3.3Å
700	C	72.9	Confident	67.4	Low	75 Å²	75	108 Å²	108	51%	0.507	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-38.2	176.3	-73.9	0	0	0	0	112.5	L696 E697 T704	L696-C700 PolarHBondContact O-N 3.16Å; L696-C700 PolarHBondContact O-SG 3.44Å; L696-C700 VanDerWaalsContact O-SG 3.42Å; E697-C700 PolarHBondContact O-N 3.1Å; C700-T704 WeakPolarHBondContact O-CB 3.34Å; C700-T704 PolarHBondContact O-N 2.98Å; C700-T704 VanDerWaalsContact O-N 3.11Å; C700-T704 PolarHBondContact O-OG1 3.3Å
701	L	71.5	Confident	67.4	Low	124 Å²	124	107.1 Å²	107.1	65%	0.649	59%	0.594	S	S	*	*	H	α-helix	trans	-62.3	-53.8	172.7	-75.8	163.5	0	0	0	110.9	E697 L699 M703 T704 E705	E697-L701 WeakPolarHBondContact O-CB 3.46Å; E697-L701 WeakPolarHBondContact O-CG 3.44Å; E697-L701 PolarHBondContact O-N 3.23Å; L699-L701 VanDerWaalsContact C-N 3.34Å; L699-L701 PolarHBondContact O-N 3.27Å; L701-M703 PolarHBondContact O-N 2.94Å; L701-T704 WeakPolarHBondContact O-CB 3.2Å; L701-T704 PolarHBondContact O-N 3.25Å; L701-E705 PolarHBondContact O-N 2.91Å
702	S	71.8	Confident	66.8	Low	52 Å²	52	108.4 Å²	108.4	36%	0.364	61%	0.605	S	S	.	*	H	α-helix	trans	-60.1	-41.1	-179.5	178.5	0	0	0	0	113.2	S698 L699 T704 E705 H706	S698-S702 WeakPolarHBondContact O-CB 3.29Å; S698-S702 PolarHBondContact O-N 2.9Å; L699-S702 PolarHBondContact O-N 2.97Å; S702-T704 VanDerWaalsContact C-N 3.32Å; S702-T704 PolarHBondContact O-N 3.37Å; S702-E705 PolarHBondContact O-N 2.9Å; S702-H706 PolarHBondContact O-CD2 3.27Å; S702-H706 PolarHBondContact O-N 3.39Å
703	M	72.7	Confident	65.6	Low	129 Å²	129	110.2 Å²	110.2	64%	0.635	62%	0.616	S	S	*	*	H	α-helix	trans	-65.6	-33.7	174.3	-74.6	-171	69.3	0	0	112.9	L699 L701 A707	L699-M703 HydrophobicContact CG-SD 4.48Å; L699-M703 WeakPolarHBondContact O-CB 3.07Å; L699-M703 WeakPolarHBondContact O-CG 3.32Å; L699-M703 PolarHBondContact O-N 3.3Å; L701-M703 PolarHBondContact O-N 2.94Å; M703-A707 VanDerWaalsContact O-CB 3.31Å; M703-A707 WeakPolarHBondContact O-CB 3.42Å; M703-A707 PolarHBondContact O-N 2.77Å; M703-A707 VanDerWaalsContact O-N 3.14Å
704	T	73	Confident	64.7	Low	85 Å²	85	116.7 Å²	116.7	52%	0.521	63%	0.633	S	S	.	*	H	α-helix	trans	-73.3	-38.7	177.1	-55.6	0	0	0	0	111.2	C700 L701 S702 A707 L708	C700-T704 WeakPolarHBondContact O-CB 3.34Å; C700-T704 PolarHBondContact O-N 2.98Å; C700-T704 VanDerWaalsContact O-N 3.11Å; C700-T704 PolarHBondContact O-OG1 3.3Å; L701-T704 WeakPolarHBondContact O-CB 3.2Å; L701-T704 PolarHBondContact O-N 3.25Å; S702-T704 VanDerWaalsContact C-N 3.32Å; S702-T704 PolarHBondContact O-N 3.37Å; T704-A707 PolarHBondContact O-N 3.38Å; T704-L708 HydrophobicContact CG2-CD1 4.11Å; T704-L708 WeakPolarHBondContact O-CG 3.19Å; T704-L708 PolarHBondContact O-N 3.42Å
705	E	72.9	Confident	63.3	Low	144 Å²	144	118.3 Å²	118.3	67%	0.673	65%	0.646	S	S	*	*	H	α-helix	trans	-64.1	-48.8	176.4	-171.9	171.4	-169.8	0	0	111.3	L701 S702 A707 L708 G709	L701-E705 PolarHBondContact O-N 2.91Å; S702-E705 PolarHBondContact O-N 2.9Å; E705-A707 VanDerWaalsContact C-N 3.3Å; E705-A707 PolarHBondContact O-N 2.9Å; E705-L708 PolarHBondContact O-N 3.29Å; E705-G709 PolarHBondContact O-N 3.39Å
706	H	67.3	Low	61.5	Low	136 Å²	136	114.4 Å²	114.4	63%	0.63	65%	0.649	S	S	*	*	H	α-helix	trans	-61.9	-34.5	174.2	-85.6	-70.6	0	0	0	113.3	S702 L708	S702-H706 PolarHBondContact O-CD2 3.27Å; S702-H706 PolarHBondContact O-N 3.39Å; H706-L708 PolarHBondContact O-N 3.28Å
707	A	67	Low	59.8	Low	83 Å²	83	115.8 Å²	115.8	69%	0.686	66%	0.662	S	S	*	*	H	α-helix	trans	-70.9	-10	175.9	0	0	0	0	0	114.3	M703 T704 E705	M703-A707 VanDerWaalsContact O-CB 3.31Å; M703-A707 WeakPolarHBondContact O-CB 3.42Å; M703-A707 PolarHBondContact O-N 2.77Å; M703-A707 VanDerWaalsContact O-N 3.14Å; T704-A707 PolarHBondContact O-N 3.38Å; E705-A707 VanDerWaalsContact C-N 3.3Å; E705-A707 PolarHBondContact O-N 2.9Å
708	L	63.5	Low	58.3	Low	142 Å²	142	121 Å²	121	74%	0.743	69%	0.691	S	S	*	*	H	α-helix	trans	-116.3	-12.3	180	-65.1	172.6	0	0	0	113.5	T704 E705 H706	T704-L708 HydrophobicContact CG2-CD1 4.11Å; T704-L708 WeakPolarHBondContact O-CG 3.19Å; T704-L708 PolarHBondContact O-N 3.42Å; E705-L708 PolarHBondContact O-N 3.29Å; H706-L708 PolarHBondContact O-N 3.28Å
709	G	53.3	Low	57.3	Low	50 Å²	50	123.3 Å²	123.3	52%	0.515	70%	0.7	S	S	.	*	H	α-helix	trans	-82.8	-32	-173.4	0	0	0	0	0	116.3	E705 G711	E705-G709 PolarHBondContact O-N 3.39Å; G709-G711 PolarHBondContact O-N 2.85Å
710	D	50.9	Low	56.1	Low	163 Å²	163	124.5 Å²	124.5	87%	0.872	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	43.7	-173.7	-74.6	-15.8	0	0	0	113.5
711	G	51.9	Low	55.2	Low	62 Å²	62	127.3 Å²	127.3	64%	0.639	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	0.2	-165.1	0	0	0	0	0	117.6	G709	G709-G711 PolarHBondContact O-N 2.85Å
712	V	46.8	Very low	54.2	Low	121 Å²	121	127.5 Å²	127.5	73%	0.733	73%	0.725	S	S	*	*			trans	-143.8	153.3	-176.4	-136.3	0	0	0	0	113.6
713	D	41.6	Very low	53.1	Low	140 Å²	140	132.2 Å²	132.2	75%	0.749	75%	0.747	S	S	*	*			trans	63.8	93.6	161.7	-58.4	-34.4	0	0	0	120.1
714	R	41	Very low	51.8	Low	243 Å²	243	132.4 Å²	132.4	92%	0.917	76%	0.755	S	S	*	*				-166.3	101.7	124.1	-106.9	175.6	-169	103.9	-1.7	113
715	T	38.1	Very low	50.3	Low	132 Å²	132	135.8 Å²	135.8	81%	0.81	77%	0.771	S	S	*	*			trans	-154.3	131.8	159.6	9.4	0	0	0	0	110.4
716	S	38	Very low	48.6	Very low	116 Å²	116	135.2 Å²	135.2	81%	0.811	78%	0.779	S	S	*	*			trans	72.6	145.1	-178	-16.3	0	0	0	0	113.6
717	T	37.1	Very low	47	Very low	129 Å²	129	135.1 Å²	135.1	79%	0.791	79%	0.791	S	S	*	*			cis	-147.4	162.3	8.5	-45.7	0	0	0	0	110.2
718	I	35.3	Very low	45.2	Very low	240 Å²	240	139.8 Å²	139.8	100%	1.231	80%	0.801	S	S	*	*			trans	82.3	0	178.2	-47.6	-180	0	0	0	112.9

Retrieved 718 of 718 residues in 1182.2 ms (Link to these results)

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