A0A096NF07_PAPAN Loading...

Solute carrier organic anion transporter family member

AlphaFold DB , UniProt , Accession A0A096NF07, Species PAPAN (Papio anubis, Olive baboon), Gene SLCO1A2, Length 670 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	40.9	Very low	34.9	Very low	208 Å²	208	135.5 Å²	135.5	100%	1.025	68%	0.676	S	S	*	*				0	-31.2	0	-81.8	173.7	81.7	0	0	113.4	E3	M1-E3 PolarHBondContact O-N 3.15Å
2	G	39.2	Very low	34.3	Very low	57 Å²	57	142 Å²	142	59%	0.588	69%	0.687	S	S	*	*	H	α-helix	trans	-72.7	-21.7	-179.3	0	0	0	0	0	117.6
3	E	32.8	Very low	34.6	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	69%	0.694	S	S	*	*	H	α-helix	trans	-83.8	-30.3	177	-78.5	-173.1	144.2	0	0	113.3	M1 R7	M1-E3 PolarHBondContact O-N 3.15Å; E3-R7 WeakPolarHBondContact O-CB 3.32Å; E3-R7 PolarHBondContact O-N 3.06Å; E3-R7 VanDerWaalsContact O-N 3.09Å
4	T	35.2	Very low	34.6	Very low	90 Å²	90	147 Å²	147	55%	0.552	70%	0.699	S	S	*	*	H	α-helix	trans	-71.7	-34.8	178.2	-14.6	0	0	0	0	111.2	R7 I8	T4-R7 PolarHBondContact O-N 3.16Å; T4-I8 WeakPolarHBondContact O-CB 3.17Å; T4-I8 WeakPolarHBondContact O-CD1 3.35Å; T4-I8 WeakPolarHBondContact O-CG1 3.2Å; T4-I8 PolarHBondContact O-N 3.1Å
5	E	35	Very low	34.8	Very low	140 Å²	140	143.9 Å²	143.9	65%	0.654	70%	0.697	S	S	*	*	H	α-helix	trans	-72.5	-42.2	178.7	-152.5	163.5	-158.8	0	0	111.8	R7 I8 E9	E5-R7 VanDerWaalsContact C-N 3.32Å; E5-R7 PolarHBondContact O-N 3.47Å; E5-I8 PolarHBondContact O-N 3.44Å; E5-E9 WeakPolarHBondContact O-CB 2.99Å; E5-E9 PolarHBondContact O-N 3.48Å
6	K	33.1	Very low	35.8	Very low	156 Å²	156	140.4 Å²	140.4	68%	0.678	68%	0.683	S	S	*	*	H	α-helix	trans	-61	-37.5	169.7	-95.2	-178.6	175.4	177.9	0	112.7	E9 T10	K6-E9 PolarHBondContact O-N 3.4Å; K6-T10 WeakPolarHBondContact O-CB 3.36Å; K6-T10 PolarHBondContact O-N 2.99Å; K6-T10 PolarHBondContact O-OG1 3.47Å
7	R	31.2	Very low	38.1	Very low	200 Å²	200	134.8 Å²	134.8	76%	0.755	66%	0.661	S	S	*	*	H	α-helix	trans	-69	-36.3	177.1	-141	177.3	-153.8	-172.6	6.7	111.9	E3 T4 E5 H11	E3-R7 WeakPolarHBondContact O-CB 3.32Å; E3-R7 PolarHBondContact O-N 3.06Å; E3-R7 VanDerWaalsContact O-N 3.09Å; T4-R7 PolarHBondContact O-N 3.16Å; E5-R7 VanDerWaalsContact C-N 3.32Å; E5-R7 PolarHBondContact O-N 3.47Å; R7-H11 WeakPolarHBondContact O-CB 3.23Å; R7-H11 PolarHBondContact O-N 2.81Å
8	I	36.8	Very low	40.4	Very low	112 Å²	112	134.4 Å²	134.4	57%	0.574	66%	0.655	S	S	*	*	H	α-helix	trans	-71	-38.5	176.3	-69.3	163.6	0	0	0	111	T4 E5 H11 R12	T4-I8 WeakPolarHBondContact O-CB 3.17Å; T4-I8 WeakPolarHBondContact O-CD1 3.35Å; T4-I8 WeakPolarHBondContact O-CG1 3.2Å; T4-I8 PolarHBondContact O-N 3.1Å; E5-I8 PolarHBondContact O-N 3.44Å; I8-H11 PolarHBondContact O-N 3.06Å; I8-R12 WeakPolarHBondContact O-CB 3.21Å; I8-R12 PolarHBondContact O-N 3.47Å
9	E	34	Very low	42.7	Very low	136 Å²	136	127.8 Å²	127.8	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-67.8	-40.6	176.5	-139.9	174.1	-166.3	0	0	111.8	E5 K6 H11 R12	E5-E9 WeakPolarHBondContact O-CB 2.99Å; E5-E9 PolarHBondContact O-N 3.48Å; K6-E9 PolarHBondContact O-N 3.4Å; E9-H11 VanDerWaalsContact C-N 3.3Å; E9-H11 PolarHBondContact O-N 2.91Å; E9-R12 PolarHBondContact O-N 2.93Å
10	T	33.4	Very low	44.8	Very low	101 Å²	101	126.7 Å²	126.7	62%	0.62	62%	0.615	S	S	*	*	H	α-helix	trans	-69.1	-27.1	174.6	-39	0	0	0	0	112.2	K6	K6-T10 WeakPolarHBondContact O-CB 3.36Å; K6-T10 PolarHBondContact O-N 2.99Å; K6-T10 PolarHBondContact O-OG1 3.47Å
11	H	31.9	Very low	46.9	Very low	117 Å²	117	124.6 Å²	124.6	54%	0.542	61%	0.605	S	S	.	*	H	α-helix	trans	-82.8	-26.6	177	-136.7	-75.3	0	0	0	113.4	R7 I8 E9 I13 R14	R7-H11 WeakPolarHBondContact O-CB 3.23Å; R7-H11 PolarHBondContact O-N 2.81Å; I8-H11 PolarHBondContact O-N 3.06Å; E9-H11 VanDerWaalsContact C-N 3.3Å; E9-H11 PolarHBondContact O-N 2.91Å; H11-I13 VanDerWaalsContact C-N 3.35Å; H11-R14 PolarHBondContact O-N 3.44Å
12	R	28.6	Very low	49.3	Very low	213 Å²	213	114.7 Å²	114.7	80%	0.804	56%	0.556	S	S	*	*	H	α-helix	trans	-70.2	-32.2	178.9	-155.7	174.7	-175.1	-177.5	0.8	112	I8 E9	I8-R12 WeakPolarHBondContact O-CB 3.21Å; I8-R12 PolarHBondContact O-N 3.47Å; E9-R12 PolarHBondContact O-N 2.93Å
13	I	37	Very low	51.7	Low	153 Å²	153	112.9 Å²	112.9	79%	0.785	53%	0.533	S	S	*	.	H	α-helix	trans	-77.2	-22.6	173.9	-59.8	172.2	0	0	0	111.7	H11 C15	H11-I13 VanDerWaalsContact C-N 3.35Å; I13-C15 VanDerWaalsContact C-N 3.3Å; I13-C15 PolarHBondContact O-N 3.25Å
14	R	34.9	Very low	54.6	Low	201 Å²	201	109.3 Å²	109.3	76%	0.758	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	1.4	179.8	-158.4	171.6	168.3	175.3	-4.2	113.9	H11	H11-R14 PolarHBondContact O-N 3.44Å
15	C	37.8	Very low	57.4	Low	100 Å²	100	105.3 Å²	105.3	68%	0.676	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	12.7	-166.5	-128.7	0	0	0	0	115.7	I13	I13-C15 VanDerWaalsContact C-N 3.3Å; I13-C15 PolarHBondContact O-N 3.25Å
16	L	51.4	Low	60.2	Low	89 Å²	89	98.7 Å²	98.7	47%	0.466	46%	0.464	S	S	.	.	S	Bend	trans	-91.5	120.3	153.4	-90.6	102.6	0	0	0	107.8	K18 K20 M21	L16-K18 PolarHBondContact O-N 2.85Å; L16-K20 HydrophobicContact CD2-CB 3.87Å; L16-M21 HydrophobicContact CB-CG 3.83Å; L16-M21 HydrophobicContact CB-SD 3.68Å; L16-M21 HydrophobicContact CD1-SD 4.37Å; L16-M21 HydrophobicContact CD2-SD 3.81Å; L16-M21 HydrophobicContact CG-SD 4.15Å
17	S	74.6	Confident	63	Low	45 Å²	45	92.5 Å²	92.5	32%	0.315	44%	0.44	S	S	.	.			trans	-47.6	136.4	166.6	168.5	0	0	0	0	108.7	L19 K20 M21	S17-L19 PolarHBondContact O-N 3.37Å; S17-L19 PolarHBondContact OG-N 2.84Å; S17-K20 WeakPolarHBondContact O-CA 3.18Å; S17-K20 WeakPolarHBondContact O-CB 3.23Å; S17-K20 PolarHBondContact O-N 2.64Å; S17-M21 PolarHBondContact O-N 2.8Å; S17-M21 VanDerWaalsContact O-N 3.1Å
18	K	80.1	Confident	66.1	Low	127 Å²	127	85.7 Å²	85.7	55%	0.552	42%	0.422	S	S	*	.	H	α-helix	trans	-53.8	-27.9	-179.6	-66.2	-178.8	-177.9	-179.9	0	112.2	L16 M21 F22 P267 L270	L16-K18 PolarHBondContact O-N 2.85Å; K18-M21 PolarHBondContact O-N 3.24Å; K18-F22 PolarHBondContact O-N 3.12Å; K18-P267 HydrophobicContact CD-CG 4.16Å; K18-L270 HydrophobicContact CB-CD1 4.32Å; K18-L270 HydrophobicContact CB-CD2 3.47Å; K18-L270 VanDerWaalsContact CB-CD2 3.47Å; K18-L270 HydrophobicContact CD-CD2 3.76Å; K18-L270 HydrophobicContact CG-CD2 4.26Å
19	L	82.9	Confident	68.9	Low	9 Å²	9	80.3 Å²	80.3	5%	0.047	39%	0.394	C	S	.	.	H	α-helix	trans	-65.7	-41.9	172	-176.9	63.4	0	0	0	112.5	S17 M21 F22 L23 F186 A187 Y195 L270 E273	S17-L19 PolarHBondContact O-N 3.37Å; S17-L19 PolarHBondContact OG-N 2.84Å; L19-M21 VanDerWaalsContact C-N 3.33Å; L19-F22 PolarHBondContact O-N 3.5Å; L19-L23 WeakPolarHBondContact O-CB 3.36Å; L19-L23 PolarHBondContact O-N 2.97Å; L19-F186 HydrophobicContact CD1-CB 3.95Å; L19-A187 HydrophobicContact CD2-CB 4.22Å; L19-Y195 HydrophobicContact CD2-CE2 4.19Å; L19-L270 HydrophobicContact CB-CD1 4.21Å; L19-L270 HydrophobicContact CD1-CD1 4.35Å; L19-E273 HydrophobicContact CD2-CB 4.08Å
20	K	85.6	Confident	71.8	Confident	106 Å²	106	74 Å²	74	46%	0.461	37%	0.365	S	S	.	.	H	α-helix	trans	-67.4	-34.2	175.3	-62.6	-178.8	179	-179.8	0	111.8	L16 S17 L23 L24	L16-K20 HydrophobicContact CD2-CB 3.87Å; S17-K20 WeakPolarHBondContact O-CA 3.18Å; S17-K20 WeakPolarHBondContact O-CB 3.23Å; S17-K20 PolarHBondContact O-N 2.64Å; K20-L23 PolarHBondContact O-N 2.74Å; K20-L24 PolarHBondContact O-N 3.27Å
21	M	88.1	Confident	74.7	Confident	83 Å²	83	70.7 Å²	70.7	41%	0.409	34%	0.344	S	S	.	.	H	α-helix	trans	-65.6	-43	171.9	-68.9	-59.1	-64.7	0	0	111.9	L16 S17 K18 L19 L23 L24 A25 L266	L16-M21 HydrophobicContact CB-CG 3.83Å; L16-M21 HydrophobicContact CB-SD 3.68Å; L16-M21 HydrophobicContact CD1-SD 4.37Å; L16-M21 HydrophobicContact CD2-SD 3.81Å; L16-M21 HydrophobicContact CG-SD 4.15Å; S17-M21 PolarHBondContact O-N 2.8Å; S17-M21 VanDerWaalsContact O-N 3.1Å; K18-M21 PolarHBondContact O-N 3.24Å; L19-M21 VanDerWaalsContact C-N 3.33Å; M21-L23 VanDerWaalsContact C-N 3.35Å; M21-L24 PolarHBondContact O-N 2.91Å; M21-A25 WeakPolarHBondContact O-CB 3.5Å; M21-A25 PolarHBondContact O-N 2.84Å; M21-L266 HydrophobicContact CB-CD2 4.4Å
22	F	91.4	Very high	77.7	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.3	-45.6	172.3	-179.3	-86.8	0	0	0	111.2	K18 L19 L24 A25 I26 P86 I89 Y182 I183 F263 L266	K18-F22 PolarHBondContact O-N 3.12Å; L19-F22 PolarHBondContact O-N 3.5Å; F22-L24 VanDerWaalsContact C-N 3.33Å; F22-L24 PolarHBondContact O-N 2.88Å; F22-A25 PolarHBondContact O-N 3.36Å; F22-I26 HydrophobicContact CD1-CG2 4.24Å; F22-I26 HydrophobicContact CE1-CB 4.1Å; F22-I26 HydrophobicContact CE1-CG1 4.46Å; F22-I26 HydrophobicContact CE1-CG2 4.05Å; F22-I26 HydrophobicContact CZ-CB 4.44Å; F22-I26 WeakPolarHBondContact O-CG2 3.29Å; F22-I26 PolarHBondContact O-N 3.3Å; F22-P86 HydrophobicContact CD2-CG 4.38Å; F22-P86 HydrophobicContact CE2-CB 4.42Å; F22-P86 HydrophobicContact CE2-CG 4.13Å; F22-I89 HydrophobicContact CE2-CD1 4.2Å; F22-I89 HydrophobicContact CZ-CD1 4Å; F22-Y182 HydrophobicContact CB-CE1 4.08Å; F22-Y182 AromaticContact CD1-CD1 3.51Å; F22-Y182 HydrophobicContact CD1-CD1 3.51Å; F22-Y182 AromaticContact CD1-CE1 3.95Å; F22-Y182 HydrophobicContact CD1-CE1 3.95Å; F22-Y182 HydrophobicContact CD1-CG 4.48Å; F22-Y182 AromaticContact CD2-CD1 3.56Å; F22-Y182 HydrophobicContact CD2-CD1 3.56Å; F22-Y182 AromaticContact CD2-CE1 3.45Å; F22-Y182 HydrophobicContact CD2-CE1 3.45Å; F22-Y182 VanDerWaalsContact CD2-CE1 3.45Å; F22-Y182 HydrophobicContact CD2-CG 4.29Å; F22-Y182 AromaticContact CE1-CD1 3.46Å; F22-Y182 HydrophobicContact CE1-CD1 3.46Å; F22-Y182 VanDerWaalsContact CE1-CD1 3.46Å; F22-Y182 HydrophobicContact CE1-CE1 4.29Å; F22-Y182 HydrophobicContact CE1-CG 4.01Å; F22-Y182 AromaticContact CE2-CD1 3.52Å; F22-Y182 HydrophobicContact CE2-CD1 3.52Å; F22-Y182 HydrophobicContact CE2-CD2 4.38Å; F22-Y182 AromaticContact CE2-CE1 3.84Å; F22-Y182 HydrophobicContact CE2-CE1 3.84Å; F22-Y182 AromaticContact CE2-CG 3.81Å; F22-Y182 HydrophobicContact CE2-CG 3.81Å; F22-Y182 AromaticContact CG-CD1 3.58Å; F22-Y182 HydrophobicContact CG-CD1 3.58Å; F22-Y182 AromaticContact CG-CE1 3.53Å; F22-Y182 HydrophobicContact CG-CE1 3.53Å; F22-Y182 AromaticContact CZ-CD1 3.46Å; F22-Y182 HydrophobicContact CZ-CD1 3.46Å; F22-Y182 VanDerWaalsContact CZ-CD1 3.46Å; F22-Y182 HydrophobicContact CZ-CE1 4.23Å; F22-Y182 AromaticContact CZ-CG 3.65Å; F22-Y182 HydrophobicContact CZ-CG 3.65Å; F22-I183 HydrophobicContact CD1-CG1 4.07Å; F22-I183 HydrophobicContact CE1-CD1 4.24Å; F22-I183 HydrophobicContact CE1-CG1 3.88Å; F22-F263 HydrophobicContact CD2-CE1 4.34Å; F22-F263 HydrophobicContact CE2-CD1 4.27Å; F22-F263 AromaticContact CE2-CE1 3.96Å; F22-F263 HydrophobicContact CE2-CE1 3.96Å; F22-L266 HydrophobicContact CB-CD1 4.08Å; F22-L266 HydrophobicContact CD2-CD1 3.76Å; F22-L266 HydrophobicContact CG-CD1 4.38Å
23	L	90.9	Very high	80.9	Confident	19 Å²	19	55.7 Å²	55.7	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-58.3	-43.7	178	-179.2	62.5	0	0	0	112.1	L19 K20 M21 I26 T27 I183 Y195 L198 I199	L19-L23 WeakPolarHBondContact O-CB 3.36Å; L19-L23 PolarHBondContact O-N 2.97Å; K20-L23 PolarHBondContact O-N 2.74Å; M21-L23 VanDerWaalsContact C-N 3.35Å; L23-I26 HydrophobicContact CD1-CG2 4.47Å; L23-I26 VanDerWaalsContact O-CG2 3.31Å; L23-I26 WeakPolarHBondContact O-CG2 3.33Å; L23-T27 WeakPolarHBondContact O-CB 3.39Å; L23-T27 PolarHBondContact O-N 3.38Å; L23-T27 PolarHBondContact O-OG1 2.94Å; L23-I183 HydrophobicContact CD1-CD1 3.98Å; L23-Y195 HydrophobicContact CD1-CG 4.29Å; L23-Y195 HydrophobicContact CD2-CD1 3.42Å; L23-Y195 VanDerWaalsContact CD2-CD1 3.42Å; L23-Y195 HydrophobicContact CD2-CE1 3.81Å; L23-Y195 HydrophobicContact CD2-CG 3.86Å; L23-L198 HydrophobicContact CD2-CD1 4.12Å; L23-I199 HydrophobicContact CD1-CD1 4.05Å; L23-I199 HydrophobicContact CD1-CG1 4.02Å
24	L	92.1	Very high	83.6	Confident	98 Å²	98	49.8 Å²	49.8	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-63.5	-48.3	175.4	-176.7	65.1	0	0	0	110.9	K20 M21 F22 I26 T27 C28	K20-L24 PolarHBondContact O-N 3.27Å; M21-L24 PolarHBondContact O-N 2.91Å; F22-L24 VanDerWaalsContact C-N 3.33Å; F22-L24 PolarHBondContact O-N 2.88Å; L24-I26 PolarHBondContact O-N 2.93Å; L24-T27 PolarHBondContact O-N 3.14Å; L24-C28 PolarHBondContact O-N 3.23Å; L24-C28 PolarHBondContact O-SG 3.35Å
25	A	94.2	Very high	86.5	Confident	7 Å²	7	40.6 Å²	40.6	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-44.7	-179.6	0	0	0	0	0	112.6	M21 F22 C28 A29 P262 F263 L266	M21-A25 WeakPolarHBondContact O-CB 3.5Å; M21-A25 PolarHBondContact O-N 2.84Å; F22-A25 PolarHBondContact O-N 3.36Å; A25-C28 PolarHBondContact O-N 2.79Å; A25-A29 PolarHBondContact O-N 3.43Å; A25-P262 HydrophobicContact CB-CB 3.94Å; A25-P262 HydrophobicContact CB-CG 4.49Å; A25-F263 HydrophobicContact CB-CE1 4.09Å; A25-F263 HydrophobicContact CB-CE2 4.15Å; A25-F263 HydrophobicContact CB-CZ 3.84Å; A25-L266 HydrophobicContact CB-CD1 4.49Å
26	I	94	Very high	89.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.3	-35.7	178.1	-164.7	64.7	0	0	0	112	F22 L23 L24 A29 F30 I89 I175 I183 I199 F263	F22-I26 HydrophobicContact CD1-CG2 4.24Å; F22-I26 HydrophobicContact CE1-CB 4.1Å; F22-I26 HydrophobicContact CE1-CG1 4.46Å; F22-I26 HydrophobicContact CE1-CG2 4.05Å; F22-I26 HydrophobicContact CZ-CB 4.44Å; F22-I26 WeakPolarHBondContact O-CG2 3.29Å; F22-I26 PolarHBondContact O-N 3.3Å; L23-I26 HydrophobicContact CD1-CG2 4.47Å; L23-I26 VanDerWaalsContact O-CG2 3.31Å; L23-I26 WeakPolarHBondContact O-CG2 3.33Å; L24-I26 PolarHBondContact O-N 2.93Å; I26-A29 HydrophobicContact CD1-CB 4.45Å; I26-A29 PolarHBondContact O-N 2.89Å; I26-F30 HydrophobicContact CD1-CD2 4.31Å; I26-F30 HydrophobicContact CD1-CE2 4.15Å; I26-F30 HydrophobicContact CG1-CD2 4.1Å; I26-F30 HydrophobicContact CG1-CE2 3.98Å; I26-F30 VanDerWaalsContact O-CD2 3.29Å; I26-F30 WeakPolarHBondContact O-CD2 3.43Å; I26-F30 PolarHBondContact O-N 3.39Å; I26-I89 HydrophobicContact CD1-CD1 4.22Å; I26-I89 HydrophobicContact CD1-CG2 4.08Å; I26-I175 HydrophobicContact CD1-CG2 3.91Å; I26-I183 HydrophobicContact CG2-CD1 4.12Å; I26-I199 HydrophobicContact CG1-CD1 4.47Å; I26-I199 HydrophobicContact CG2-CD1 3.62Å; I26-I199 HydrophobicContact CG2-CG1 4.02Å; I26-F263 HydrophobicContact CB-CE1 4.48Å; I26-F263 HydrophobicContact CB-CZ 4.29Å; I26-F263 HydrophobicContact CD1-CE1 4.32Å; I26-F263 HydrophobicContact CD1-CZ 4.08Å
27	T	93.3	Very high	91.3	Very high	27 Å²	27	32.1 Å²	32.1	17%	0.166	17%	0.172	C	C	.	.	H	α-helix	trans	-63.1	-44.6	173	-55.2	0	0	0	0	110.4	L23 L24 A29 F30 V31	L23-T27 WeakPolarHBondContact O-CB 3.39Å; L23-T27 PolarHBondContact O-N 3.38Å; L23-T27 PolarHBondContact O-OG1 2.94Å; L24-T27 PolarHBondContact O-N 3.14Å; T27-A29 VanDerWaalsContact C-N 3.34Å; T27-A29 PolarHBondContact O-N 3.26Å; T27-F30 PolarHBondContact O-N 3.19Å; T27-V31 WeakPolarHBondContact O-CG2 3Å; T27-V31 PolarHBondContact O-N 3.32Å
28	C	95.1	Very high	92.2	Very high	56 Å²	56	30.7 Å²	30.7	38%	0.378	16%	0.162	S	C	.	.	H	α-helix	trans	-61.2	-40.2	174	-68.3	0	0	0	0	112.5	L24 A25 F30 V31 S32 T259	L24-C28 PolarHBondContact O-N 3.23Å; L24-C28 PolarHBondContact O-SG 3.35Å; A25-C28 PolarHBondContact O-N 2.79Å; C28-F30 VanDerWaalsContact C-N 3.33Å; C28-F30 PolarHBondContact O-N 3.15Å; C28-V31 PolarHBondContact O-N 2.88Å; C28-S32 WeakPolarHBondContact O-CB 3.31Å; C28-S32 PolarHBondContact O-N 3.23Å; C28-T259 HydrophobicContact CB-CG2 4.03Å
29	A	95.8	Very high	92.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-38.1	175.2	0	0	0	0	0	112.1	A25 I26 T27 S32 K33 I175 F263	A25-A29 PolarHBondContact O-N 3.43Å; I26-A29 HydrophobicContact CD1-CB 4.45Å; I26-A29 PolarHBondContact O-N 2.89Å; T27-A29 VanDerWaalsContact C-N 3.34Å; T27-A29 PolarHBondContact O-N 3.26Å; A29-S32 PolarHBondContact O-N 3.35Å; A29-K33 WeakPolarHBondContact O-CB 3.45Å; A29-K33 PolarHBondContact O-N 2.96Å; A29-I175 HydrophobicContact CB-CG2 4.18Å; A29-F263 HydrophobicContact CB-CE2 4.01Å; A29-F263 HydrophobicContact CB-CZ 4.08Å
30	F	94.4	Very high	93.5	Very high	2 Å²	2	24.3 Å²	24.3	1%	0.009	13%	0.134	C	C	.	.	H	α-helix	trans	-66.4	-42.8	173.5	-92.3	-113.5	0	0	0	112.5	I26 T27 C28 S32 K33 T34 I175 L176 I199 A203	I26-F30 HydrophobicContact CD1-CD2 4.31Å; I26-F30 HydrophobicContact CD1-CE2 4.15Å; I26-F30 HydrophobicContact CG1-CD2 4.1Å; I26-F30 HydrophobicContact CG1-CE2 3.98Å; I26-F30 VanDerWaalsContact O-CD2 3.29Å; I26-F30 WeakPolarHBondContact O-CD2 3.43Å; I26-F30 PolarHBondContact O-N 3.39Å; T27-F30 PolarHBondContact O-N 3.19Å; C28-F30 VanDerWaalsContact C-N 3.33Å; C28-F30 PolarHBondContact O-N 3.15Å; F30-S32 VanDerWaalsContact C-N 3.29Å; F30-S32 PolarHBondContact O-N 3.37Å; F30-K33 HydrophobicContact CD1-CD 4.48Å; F30-K33 VanDerWaalsContact CD1-NZ 3.28Å; F30-K33 HydrophobicContact CG-CD 4.4Å; F30-K33 WeakPolarHBondContact O-CG 3.34Å; F30-K33 PolarHBondContact O-N 3.13Å; F30-T34 WeakPolarHBondContact O-CG2 3.25Å; F30-T34 PolarHBondContact O-N 2.85Å; F30-T34 PolarHBondContact O-OG1 3.42Å; F30-I175 HydrophobicContact CD2-CG2 3.82Å; F30-I175 HydrophobicContact CE2-CG2 3.77Å; F30-L176 HydrophobicContact CE1-CD1 3.87Å; F30-L176 HydrophobicContact CZ-CB 4.3Å; F30-L176 HydrophobicContact CZ-CD1 3.51Å; F30-I199 HydrophobicContact CB-CG2 4.32Å; F30-I199 HydrophobicContact CD1-CG2 3.53Å; F30-I199 HydrophobicContact CD2-CG2 3.63Å; F30-I199 HydrophobicContact CE1-CG2 3.48Å; F30-I199 VanDerWaalsContact CE1-CG2 3.48Å; F30-I199 HydrophobicContact CE2-CG2 3.59Å; F30-I199 HydrophobicContact CG-CG2 3.57Å; F30-I199 HydrophobicContact CZ-CG2 3.49Å; F30-I199 VanDerWaalsContact CZ-CG2 3.49Å; F30-A203 HydrophobicContact CD1-CB 3.97Å
31	V	95.2	Very high	93.7	Very high	32 Å²	32	21.4 Å²	21.4	19%	0.194	12%	0.123	C	C	.	.	H	α-helix	trans	-57.8	-46.2	172.6	174	0	0	0	0	109.9	T27 C28 T34 L35 G202 G206 I209	T27-V31 WeakPolarHBondContact O-CG2 3Å; T27-V31 PolarHBondContact O-N 3.32Å; C28-V31 PolarHBondContact O-N 2.88Å; V31-T34 PolarHBondContact O-OG1 3.35Å; V31-L35 WeakPolarHBondContact O-CB 3.32Å; V31-L35 PolarHBondContact O-N 3.42Å; V31-G202 WeakPolarHBondContact CG2-O 3.39Å; V31-G206 WeakPolarHBondContact O-CA 3.39Å; V31-I209 HydrophobicContact CG1-CD1 4.29Å
32	S	95.5	Very high	94	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.7	-41.7	-177.1	-161.6	0	0	0	0	113	C28 A29 F30 S36 V255 N256	C28-S32 WeakPolarHBondContact O-CB 3.31Å; C28-S32 PolarHBondContact O-N 3.23Å; A29-S32 PolarHBondContact O-N 3.35Å; F30-S32 VanDerWaalsContact C-N 3.29Å; F30-S32 PolarHBondContact O-N 3.37Å; S32-S36 WeakPolarHBondContact O-CB 3.35Å; S32-S36 PolarHBondContact O-N 3.32Å; S32-S36 PolarHBondContact O-OG 3.4Å; S32-V255 WeakPolarHBondContact OG-CG1 3.24Å; S32-N256 WeakPolarHBondContact CB-OD1 3.4Å; S32-N256 PolarHBondContact OG-N 3.49Å; S32-N256 PolarHBondContact OG-OD1 3Å
33	K	94.1	Very high	94.2	Very high	16 Å²	16	17.7 Å²	17.7	7%	0.07	11%	0.105	C	C	.	.	H	α-helix	trans	-66.2	-42.5	-179.7	89.6	-171.3	-170.4	-174.8	0	111.1	A29 F30 S36 G37 M96 R168 E172 I175	A29-K33 WeakPolarHBondContact O-CB 3.45Å; A29-K33 PolarHBondContact O-N 2.96Å; F30-K33 HydrophobicContact CD1-CD 4.48Å; F30-K33 VanDerWaalsContact CD1-NZ 3.28Å; F30-K33 HydrophobicContact CG-CD 4.4Å; F30-K33 WeakPolarHBondContact O-CG 3.34Å; F30-K33 PolarHBondContact O-N 3.13Å; K33-S36 PolarHBondContact O-N 2.92Å; K33-G37 PolarHBondContact O-N 3.26Å; K33-G37 VanDerWaalsContact O-N 3.12Å; K33-M96 HydrophobicContact CB-CE 3.92Å; K33-M96 HydrophobicContact CB-SD 3.71Å; K33-R168 PolarHBondContact O-NH1 3.49Å; K33-E172 HydrophobicContact CB-CG 4.25Å; K33-E172 HydrophobicContact CD-CG 3.97Å; K33-E172 HydrophobicContact CG-CG 4.37Å; K33-I175 HydrophobicContact CB-CD1 4.22Å; K33-I175 HydrophobicContact CD-CD1 4.43Å; K33-I175 HydrophobicContact CD-CG2 4.22Å
34	T	94.3	Very high	94.2	Very high	28 Å²	28	17.1 Å²	17.1	17%	0.172	10%	0.102	C	C	.	.	H	α-helix	trans	-79	-32.9	-177.1	56.2	0	0	0	0	112	F30 V31 G37 S38 A203 G206 P207	F30-T34 WeakPolarHBondContact O-CG2 3.25Å; F30-T34 PolarHBondContact O-N 2.85Å; F30-T34 PolarHBondContact O-OG1 3.42Å; V31-T34 PolarHBondContact O-OG1 3.35Å; T34-G37 PolarHBondContact O-N 2.89Å; T34-S38 PolarHBondContact O-N 3.13Å; T34-S38 PolarHBondContact O-OG 3.28Å; T34-A203 WeakPolarHBondContact CB-O 3.33Å; T34-A203 HydrophobicContact CG2-CB 4.33Å; T34-A203 PolarHBondContact OG1-O 2.94Å; T34-G206 WeakPolarHBondContact OG1-CA 3.44Å; T34-P207 WeakPolarHBondContact OG1-CD 3.46Å
35	L	95.8	Very high	94.2	Very high	9 Å²	9	13 Å²	13	5%	0.047	8%	0.081	C	C	.	.	H	α-helix	trans	-51.9	-54.6	164.9	171.4	78.7	0	0	0	111.3	V31 G37 S38 Y39 G206 I209 V255	V31-L35 WeakPolarHBondContact O-CB 3.32Å; V31-L35 PolarHBondContact O-N 3.42Å; L35-G37 PolarHBondContact O-N 3.5Å; L35-S38 PolarHBondContact O-N 2.67Å; L35-S38 PolarHBondContact O-OG 2.87Å; L35-S38 VanDerWaalsContact O-OG 3.12Å; L35-Y39 WeakPolarHBondContact O-CB 3.42Å; L35-Y39 PolarHBondContact O-N 3.1Å; L35-G206 WeakPolarHBondContact CA-O 3.23Å; L35-I209 HydrophobicContact CD1-CB 3.69Å; L35-I209 HydrophobicContact CD1-CG2 3.51Å; L35-V255 HydrophobicContact CD2-CG1 4.38Å
36	S	95.9	Very high	94.2	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-64.3	-28.2	-178.6	-58.7	0	0	0	0	112.2	S32 K33 M40 R168 N256	S32-S36 WeakPolarHBondContact O-CB 3.35Å; S32-S36 PolarHBondContact O-N 3.32Å; S32-S36 PolarHBondContact O-OG 3.4Å; K33-S36 PolarHBondContact O-N 2.92Å; S36-M40 PolarHBondContact O-N 2.84Å; S36-R168 VanDerWaalsContact CB-NH1 3.28Å; S36-N256 PolarHBondContact OG-ND2 3.2Å
37	G	93.3	Very high	94.1	Very high	11 Å²	11	12.7 Å²	12.7	11%	0.113	8%	0.079	C	C	.	.	H	α-helix	trans	-76.6	-46.4	178.4	0	0	0	0	0	112.6	K33 T34 L35 Y39 M40 N41 R168	K33-G37 PolarHBondContact O-N 3.26Å; K33-G37 VanDerWaalsContact O-N 3.12Å; T34-G37 PolarHBondContact O-N 2.89Å; L35-G37 PolarHBondContact O-N 3.5Å; G37-Y39 VanDerWaalsContact C-N 3.35Å; G37-M40 PolarHBondContact O-N 3.06Å; G37-N41 PolarHBondContact O-N 3.41Å; G37-N41 VanDerWaalsContact O-N 3.15Å; G37-R168 VanDerWaalsContact N-NH1 3.13Å
38	S	94.1	Very high	94	Very high	15 Å²	15	11.8 Å²	11.8	11%	0.105	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-39.9	176.3	65	0	0	0	0	111.7	T34 L35 M40 N41 S42 P207 G210	T34-S38 PolarHBondContact O-N 3.13Å; T34-S38 PolarHBondContact O-OG 3.28Å; L35-S38 PolarHBondContact O-N 2.67Å; L35-S38 PolarHBondContact O-OG 2.87Å; L35-S38 VanDerWaalsContact O-OG 3.12Å; S38-M40 VanDerWaalsContact C-N 3.35Å; S38-M40 PolarHBondContact O-N 3.07Å; S38-N41 PolarHBondContact O-N 3.35Å; S38-S42 PolarHBondContact O-N 2.89Å; S38-S42 PolarHBondContact O-OG 2.92Å; S38-S42 VanDerWaalsContact O-OG 3.14Å; S38-P207 WeakPolarHBondContact OG-CA 3.42Å; S38-P207 PolarHBondContact OG-O 2.95Å; S38-G210 WeakPolarHBondContact OG-CA 3.4Å
39	Y	96	Very high	93.7	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59	-44.6	175.5	-173	-96.1	0	0	0	112	L35 G37 S42 M43 L213 A214 C217 W245 G248 F249	L35-Y39 WeakPolarHBondContact O-CB 3.42Å; L35-Y39 PolarHBondContact O-N 3.1Å; G37-Y39 VanDerWaalsContact C-N 3.35Å; Y39-S42 PolarHBondContact O-N 3.45Å; Y39-M43 HydrophobicContact CD1-CG 4.11Å; Y39-M43 HydrophobicContact CD2-CG 4.49Å; Y39-M43 HydrophobicContact CE1-CG 3.64Å; Y39-M43 HydrophobicContact CE2-CG 4.06Å; Y39-M43 HydrophobicContact CE2-SD 4.26Å; Y39-M43 HydrophobicContact CG-CG 4.5Å; Y39-M43 WeakPolarHBondContact O-CG 3.07Å; Y39-M43 PolarHBondContact O-N 3.23Å; Y39-M43 VanDerWaalsContact O-N 3.08Å; Y39-L213 HydrophobicContact CD2-CB 4.43Å; Y39-L213 HydrophobicContact CD2-CD2 4.18Å; Y39-L213 HydrophobicContact CD2-CG 4.07Å; Y39-L213 HydrophobicContact CE2-CD2 4.38Å; Y39-L213 HydrophobicContact CE2-CG 4.02Å; Y39-A214 HydrophobicContact CD2-CB 3.78Å; Y39-A214 HydrophobicContact CE2-CB 4.1Å; Y39-C217 HydrophobicContact CE2-CB 4.17Å; Y39-C217 PolarHBondContact OH-SG 3.32Å; Y39-W245 WeakPolarHBondContact CE1-O 3.5Å; Y39-W245 PolarHBondContact OH-O 3.34Å; Y39-G248 WeakPolarHBondContact OH-CA 3.49Å; Y39-G248 PolarHBondContact OH-N 2.95Å; Y39-F249 AromaticContact CD1-CD1 3.58Å; Y39-F249 HydrophobicContact CD1-CD1 3.58Å; Y39-F249 AromaticContact CD1-CE1 3.51Å; Y39-F249 HydrophobicContact CD1-CE1 3.51Å; Y39-F249 HydrophobicContact CD1-CG 4.18Å; Y39-F249 HydrophobicContact CD1-CZ 4.09Å; Y39-F249 HydrophobicContact CE1-CB 4.45Å; Y39-F249 AromaticContact CE1-CD1 3.7Å; Y39-F249 HydrophobicContact CE1-CD1 3.7Å; Y39-F249 HydrophobicContact CE1-CD2 4.08Å; Y39-F249 AromaticContact CE1-CE1 3.82Å; Y39-F249 HydrophobicContact CE1-CE1 3.82Å; Y39-F249 HydrophobicContact CE1-CE2 4.22Å; Y39-F249 AromaticContact CE1-CG 3.81Å; Y39-F249 HydrophobicContact CE1-CG 3.81Å; Y39-F249 HydrophobicContact CE1-CZ 4.07Å
40	M	93.9	Very high	93.4	Very high	2 Å²	2	11 Å²	11	1%	0.01	6%	0.062	C	C	.	.	H	α-helix	trans	-57.8	-50.5	175.5	179.7	66.3	-168.4	0	0	111.9	S36 G37 S38 S42 M43 L44 I47 I61 K103 V161 N165 F249	S36-M40 PolarHBondContact O-N 2.84Å; G37-M40 PolarHBondContact O-N 3.06Å; S38-M40 VanDerWaalsContact C-N 3.35Å; S38-M40 PolarHBondContact O-N 3.07Å; M40-S42 VanDerWaalsContact C-N 3.28Å; M40-S42 PolarHBondContact O-N 3.12Å; M40-M43 PolarHBondContact O-N 2.9Å; M40-L44 HydrophobicContact CE-CD2 3.98Å; M40-L44 PolarHBondContact O-N 3.2Å; M40-I47 HydrophobicContact CE-CD1 4.39Å; M40-I47 HydrophobicContact SD-CD1 4.49Å; M40-I61 HydrophobicContact CE-CG2 3.63Å; M40-K103 HydrophobicContact SD-CD 3.78Å; M40-V161 HydrophobicContact CE-CG1 4.02Å; M40-N165 HydrophobicContact CE-CB 4.47Å; M40-F249 HydrophobicContact CB-CE1 4.29Å; M40-F249 HydrophobicContact SD-CE1 3.99Å; M40-F249 HydrophobicContact SD-CZ 3.6Å
41	N	91.4	Very high	93.1	Very high	44 Å²	44	12 Å²	12	24%	0.235	7%	0.067	C	C	.	.	H	α-helix	trans	-61.5	-36.9	-179.5	-77.1	-32.7	0	0	0	112.3	G37 S38 L44 N62	G37-N41 PolarHBondContact O-N 3.41Å; G37-N41 VanDerWaalsContact O-N 3.15Å; S38-N41 PolarHBondContact O-N 3.35Å; N41-L44 WeakPolarHBondContact O-CG 3.29Å; N41-N62 PolarHBondContact OD1-ND2 2.9Å; N41-N62 PolarHBondContact OD1-OD1 3.49Å
42	S	94.1	Very high	92.6	Very high	5 Å²	5	11.7 Å²	11.7	4%	0.035	6%	0.063	C	C	.	.	H	α-helix	trans	-74.8	-26.4	179.4	-64.2	0	0	0	0	114.2	S38 Y39 M40 L211 A214	S38-S42 PolarHBondContact O-N 2.89Å; S38-S42 PolarHBondContact O-OG 2.92Å; S38-S42 VanDerWaalsContact O-OG 3.14Å; Y39-S42 PolarHBondContact O-N 3.45Å; M40-S42 VanDerWaalsContact C-N 3.28Å; M40-S42 PolarHBondContact O-N 3.12Å; S42-L211 WeakPolarHBondContact OG-CD2 3.08Å; S42-A214 VanDerWaalsContact CB-CB 3.46Å
43	M	94.3	Very high	92.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.7	179.2	-64.6	-60.6	87.3	0	0	113.6	Y39 M40 T45 Q46 I47 A214 C217 A218 W245 I355	Y39-M43 HydrophobicContact CD1-CG 4.11Å; Y39-M43 HydrophobicContact CD2-CG 4.49Å; Y39-M43 HydrophobicContact CE1-CG 3.64Å; Y39-M43 HydrophobicContact CE2-CG 4.06Å; Y39-M43 HydrophobicContact CE2-SD 4.26Å; Y39-M43 HydrophobicContact CG-CG 4.5Å; Y39-M43 WeakPolarHBondContact O-CG 3.07Å; Y39-M43 PolarHBondContact O-N 3.23Å; Y39-M43 VanDerWaalsContact O-N 3.08Å; M40-M43 PolarHBondContact O-N 2.9Å; M43-T45 VanDerWaalsContact C-N 3.3Å; M43-T45 PolarHBondContact O-N 2.85Å; M43-Q46 HydrophobicContact CE-CG 4.29Å; M43-Q46 WeakPolarHBondContact O-CB 3.45Å; M43-Q46 PolarHBondContact O-N 3.28Å; M43-Q46 HydrophobicContact SD-CG 4.12Å; M43-I47 HydrophobicContact CB-CD1 4.3Å; M43-I47 WeakPolarHBondContact O-CG1 3.36Å; M43-I47 PolarHBondContact O-N 2.91Å; M43-A214 HydrophobicContact CE-CB 3.69Å; M43-A214 WeakPolarHBondContact CE-O 3.36Å; M43-C217 HydrophobicContact SD-CB 4.43Å; M43-A218 HydrophobicContact CE-CB 4.08Å; M43-W245 HydrophobicContact CB-CB 4.15Å; M43-W245 HydrophobicContact CG-CB 4.09Å; M43-W245 HydrophobicContact SD-CB 3.81Å; M43-I355 HydrophobicContact CE-CD1 3.82Å
44	L	92.2	Very high	92	Very high	8 Å²	8	13.7 Å²	13.7	4%	0.042	8%	0.077	C	C	.	.	H	α-helix	trans	-55.9	-42.6	-178.7	-70.2	178.6	0	0	0	112.6	M40 N41 Q46 I47 E48 V58 N62	M40-L44 HydrophobicContact CE-CD2 3.98Å; M40-L44 PolarHBondContact O-N 3.2Å; N41-L44 WeakPolarHBondContact O-CG 3.29Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 3.12Å; L44-I47 PolarHBondContact O-N 3.46Å; L44-E48 WeakPolarHBondContact O-CB 3.48Å; L44-E48 PolarHBondContact O-N 3.47Å; L44-V58 HydrophobicContact CB-CG1 3.7Å; L44-V58 HydrophobicContact CD1-CG1 4.47Å; L44-V58 HydrophobicContact CD2-CG1 3.75Å; L44-V58 HydrophobicContact CG-CG1 4.15Å; L44-N62 HydrophobicContact CD1-CB 4.13Å; L44-N62 HydrophobicContact CD2-CB 4.13Å
45	T	91.4	Very high	91.8	Very high	12 Å²	12	12.3 Å²	12.3	7%	0.074	7%	0.069	C	C	.	.	H	α-helix	trans	-66	-33.8	177.3	52.5	0	0	0	0	112.6	M43 E48 R49 K341 S351	M43-T45 VanDerWaalsContact C-N 3.3Å; M43-T45 PolarHBondContact O-N 2.85Å; T45-E48 WeakPolarHBondContact O-CB 3.3Å; T45-R49 VanDerWaalsContact O-CG 3.3Å; T45-R49 WeakPolarHBondContact O-CG 3.42Å; T45-R49 PolarHBondContact O-N 2.8Å; T45-R49 VanDerWaalsContact O-N 3.13Å; T45-K341 HydrophobicContact CG2-CB 3.89Å; T45-K341 HydrophobicContact CG2-CD 4.24Å; T45-K341 HydrophobicContact CG2-CG 4.18Å; T45-S351 PolarHBondContact OG1-OG 3.26Å
46	Q	93.3	Very high	91.5	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-71.9	-42.4	177.9	-53.2	-54.8	-37.9	0	0	110.9	M43 L44 E48 R49 Q50 V242 W245 S351	M43-Q46 HydrophobicContact CE-CG 4.29Å; M43-Q46 WeakPolarHBondContact O-CB 3.45Å; M43-Q46 PolarHBondContact O-N 3.28Å; M43-Q46 HydrophobicContact SD-CG 4.12Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 3.12Å; Q46-E48 VanDerWaalsContact C-N 3.35Å; Q46-R49 PolarHBondContact O-N 3.34Å; Q46-Q50 VanDerWaalsContact O-CB 3.3Å; Q46-Q50 WeakPolarHBondContact O-CB 3.01Å; Q46-Q50 PolarHBondContact O-N 3.21Å; Q46-V242 HydrophobicContact CB-CG1 4.44Å; Q46-W245 HydrophobicContact CB-CB 3.94Å; Q46-W245 HydrophobicContact CB-CG 4.35Å; Q46-S351 PolarHBondContact NE2-OG 3.13Å; Q46-S351 VanDerWaalsContact NE2-OG 3.13Å
47	I	92.3	Very high	91.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-63.3	-42.6	174.5	-68.1	162.3	0	0	0	110.3	M40 M43 L44 R49 Q50 F51 V161 W245 F249	M40-I47 HydrophobicContact CE-CD1 4.39Å; M40-I47 HydrophobicContact SD-CD1 4.49Å; M43-I47 HydrophobicContact CB-CD1 4.3Å; M43-I47 WeakPolarHBondContact O-CG1 3.36Å; M43-I47 PolarHBondContact O-N 2.91Å; L44-I47 PolarHBondContact O-N 3.46Å; I47-R49 PolarHBondContact O-N 3.18Å; I47-Q50 PolarHBondContact O-N 2.67Å; I47-F51 HydrophobicContact CG2-CD2 3.73Å; I47-F51 HydrophobicContact CG2-CE2 3.95Å; I47-F51 VanDerWaalsContact O-CD2 3.25Å; I47-F51 WeakPolarHBondContact O-CD2 3.5Å; I47-F51 PolarHBondContact O-N 2.97Å; I47-F51 VanDerWaalsContact O-N 3.09Å; I47-V161 HydrophobicContact CD1-CG1 4.05Å; I47-W245 HydrophobicContact CG1-CD2 4.31Å; I47-W245 HydrophobicContact CG1-CE3 4.22Å; I47-F249 HydrophobicContact CD1-CE2 4.37Å; I47-F249 HydrophobicContact CD1-CZ 4.45Å
48	E	91.4	Very high	91.3	Very high	8 Å²	8	14.9 Å²	14.9	4%	0.037	8%	0.083	C	C	.	.	H	α-helix	trans	-54	-51.6	174.7	-170.8	-175.1	146.5	0	0	111.8	L44 T45 Q46 N52 I53 V58 K341 A588 Y592	L44-E48 WeakPolarHBondContact O-CB 3.48Å; L44-E48 PolarHBondContact O-N 3.47Å; T45-E48 WeakPolarHBondContact O-CB 3.3Å; Q46-E48 VanDerWaalsContact C-N 3.35Å; E48-N52 VanDerWaalsContact O-CA 3.29Å; E48-N52 WeakPolarHBondContact O-CA 3.3Å; E48-N52 PolarHBondContact O-N 3.45Å; E48-I53 VanDerWaalsContact CG-O 3.24Å; E48-I53 WeakPolarHBondContact CG-O 3.33Å; E48-I53 PolarHBondContact O-N 3.31Å; E48-I53 VanDerWaalsContact O-N 3.11Å; E48-V58 HydrophobicContact CB-CG2 3.71Å; E48-V58 HydrophobicContact CG-CG2 3.86Å; E48-K341 IonicContact OE1-NZ 3.85Å; E48-K341 PolarHBondContact OE1-NZ 2.9Å; E48-K341 IonicContact OE2-NZ 3.76Å; E48-K341 PolarHBondContact OE2-NZ 3.31Å; E48-A588 HydrophobicContact CG-CB 4.12Å; E48-Y592 PolarHBondContact OE1-OH 3.06Å
49	R	89.7	Confident	91.1	Very high	25 Å²	25	14.2 Å²	14.2	9%	0.094	8%	0.078	C	C	.	.	H	α-helix	trans	-68.3	-44.3	-179.1	-70.1	172.4	-175.6	-179.9	6.7	112.2	T45 Q46 I47 F51 N52 D238 T239 W241 V242 E344	T45-R49 VanDerWaalsContact O-CG 3.3Å; T45-R49 WeakPolarHBondContact O-CG 3.42Å; T45-R49 PolarHBondContact O-N 2.8Å; T45-R49 VanDerWaalsContact O-N 3.13Å; Q46-R49 PolarHBondContact O-N 3.34Å; I47-R49 PolarHBondContact O-N 3.18Å; R49-F51 PolarHBondContact O-N 2.98Å; R49-N52 PolarHBondContact O-N 2.91Å; R49-D238 PolarHBondContact NH1-O 2.88Å; R49-T239 WeakPolarHBondContact CD-O 3.43Å; R49-T239 PolarHBondContact NE-O 3.26Å; R49-W241 VanDerWaalsContact CD-O 3.3Å; R49-W241 WeakPolarHBondContact CD-O 3.19Å; R49-W241 PolarHBondContact NH1-O 3.21Å; R49-W241 VanDerWaalsContact NH1-O 3.07Å; R49-V242 HydrophobicContact CB-CG2 3.67Å; R49-E344 IonicContact CZ-OE2 3.26Å; R49-E344 IonicContact NH2-OE2 2.69Å; R49-E344 PolarHBondContact NH2-OE2 3.11Å
50	Q	88.9	Confident	91	Very high	15 Å²	15	18 Å²	18	7%	0.07	10%	0.095	C	C	.	.	H	α-helix	trans	-58	-46.9	179.9	-179.9	66	24	0	0	112.2	Q46 I47 V242 W245	Q46-Q50 VanDerWaalsContact O-CB 3.3Å; Q46-Q50 WeakPolarHBondContact O-CB 3.01Å; Q46-Q50 PolarHBondContact O-N 3.21Å; I47-Q50 PolarHBondContact O-N 2.67Å; Q50-V242 HydrophobicContact CB-CG1 4.08Å; Q50-W245 HydrophobicContact CG-CZ2 4.24Å
51	F	87.4	Confident	91	Very high	23 Å²	23	17.9 Å²	17.9	10%	0.101	9%	0.094	C	C	.	.	H	α-helix	trans	-92.3	-3	-178.1	-62.7	-67.8	0	0	0	112.9	I47 R49 I53 P106 M110 M157 W158 V161 W245	I47-F51 HydrophobicContact CG2-CD2 3.73Å; I47-F51 HydrophobicContact CG2-CE2 3.95Å; I47-F51 VanDerWaalsContact O-CD2 3.25Å; I47-F51 WeakPolarHBondContact O-CD2 3.5Å; I47-F51 PolarHBondContact O-N 2.97Å; I47-F51 VanDerWaalsContact O-N 3.09Å; R49-F51 PolarHBondContact O-N 2.98Å; F51-I53 VanDerWaalsContact C-N 3.27Å; F51-I53 HydrophobicContact CB-CD1 4.31Å; F51-I53 HydrophobicContact CB-CG1 4.15Å; F51-I53 HydrophobicContact CB-CG2 3.89Å; F51-I53 PolarHBondContact O-N 3.47Å; F51-P106 HydrophobicContact CE1-CB 4.27Å; F51-P106 HydrophobicContact CZ-CB 3.8Å; F51-P106 HydrophobicContact CZ-CG 4.2Å; F51-M110 HydrophobicContact CD1-CE 4.21Å; F51-M110 HydrophobicContact CD1-SD 4.34Å; F51-M110 HydrophobicContact CE1-CE 3.95Å; F51-M110 HydrophobicContact CE1-SD 3.51Å; F51-M110 VanDerWaalsContact CE1-SD 3.51Å; F51-M110 HydrophobicContact CZ-SD 4.21Å; F51-M157 HydrophobicContact CE1-CB 3.76Å; F51-W158 HydrophobicContact CB-CB 4.34Å; F51-W158 HydrophobicContact CD1-CB 4.09Å; F51-W158 HydrophobicContact CD2-CB 3.92Å; F51-W158 HydrophobicContact CE1-CB 4.39Å; F51-W158 HydrophobicContact CE2-CB 4.26Å; F51-W158 HydrophobicContact CG-CB 3.85Å; F51-W158 HydrophobicContact CZ-CB 4.48Å; F51-V161 HydrophobicContact CE2-CG2 3.97Å; F51-V161 HydrophobicContact CZ-CG2 4.26Å; F51-W245 HydrophobicContact CE2-CH2 4.39Å; F51-W245 HydrophobicContact CE2-CZ2 4.27Å; F51-W245 HydrophobicContact CZ-CH2 4.29Å; F51-W245 HydrophobicContact CZ-CZ2 4.18Å
52	N	85.6	Confident	91	Very high	24 Å²	24	16.8 Å²	16.8	13%	0.128	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	47.1	-178.7	-153.7	18.9	0	0	0	111.7	E48 R49 L581 G587 A588	E48-N52 VanDerWaalsContact O-CA 3.29Å; E48-N52 WeakPolarHBondContact O-CA 3.3Å; E48-N52 PolarHBondContact O-N 3.45Å; R49-N52 PolarHBondContact O-N 2.91Å; N52-L581 HydrophobicContact CB-CD2 3.94Å; N52-L581 VanDerWaalsContact ND2-CD2 3.31Å; N52-L581 WeakPolarHBondContact ND2-CD2 3.39Å; N52-G587 CarbonylContact O-C 3.2Å; N52-G587 WeakPolarHBondContact O-CA 3.03Å; N52-G587 WeakPolarHBondContact OD1-CA 3.09Å; N52-A588 PolarHBondContact O-N 3.01Å; N52-A588 WeakPolarHBondContact OD1-CB 3.35Å; N52-A588 PolarHBondContact OD1-N 2.77Å
53	I	87.9	Confident	90.9	Very high	12 Å²	12	16.6 Å²	16.6	6%	0.062	9%	0.088	C	C	.	.			trans	-106.2	154.8	-174.6	54.1	172.9	0	0	0	112	E48 F51 L57 V58 I61	E48-I53 VanDerWaalsContact CG-O 3.24Å; E48-I53 WeakPolarHBondContact CG-O 3.33Å; E48-I53 PolarHBondContact O-N 3.31Å; E48-I53 VanDerWaalsContact O-N 3.11Å; F51-I53 VanDerWaalsContact C-N 3.27Å; F51-I53 HydrophobicContact CB-CD1 4.31Å; F51-I53 HydrophobicContact CB-CG1 4.15Å; F51-I53 HydrophobicContact CB-CG2 3.89Å; F51-I53 PolarHBondContact O-N 3.47Å; I53-L57 HydrophobicContact CB-CD2 4.05Å; I53-L57 HydrophobicContact CD1-CD2 4.31Å; I53-L57 HydrophobicContact CD1-CG 4.38Å; I53-L57 HydrophobicContact CG2-CD2 3.88Å; I53-V58 HydrophobicContact CD1-CG2 3.63Å; I53-V58 HydrophobicContact CG1-CG2 3.81Å; I53-I61 HydrophobicContact CD1-CD1 3.84Å
54	P	88.6	Confident	90.9	Very high	46 Å²	46	16.7 Å²	16.7	30%	0.299	9%	0.088	S	C	.	.			trans	-68.6	153	176.8	28.1	-35.6	0	0	0	112.6	S56 L57 V58 D572	P54-S56 PolarHBondContact O-N 2.97Å; P54-L57 HydrophobicContact CG-CB 4.03Å; P54-L57 PolarHBondContact O-N 2.87Å; P54-V58 PolarHBondContact O-N 3.43Å; P54-D572 WeakPolarHBondContact CB-OD2 3.4Å
55	T	90.5	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-59.8	-34.2	-179.4	-44.3	0	0	0	0	111.8	L57 V58 G59 F338 K341 M571 D572 Y592	T55-L57 VanDerWaalsContact C-N 3.33Å; T55-L57 PolarHBondContact O-N 3.36Å; T55-V58 WeakPolarHBondContact O-CB 3.42Å; T55-V58 PolarHBondContact O-N 3.43Å; T55-G59 PolarHBondContact O-N 2.89Å; T55-F338 HydrophobicContact CG2-CD1 4.23Å; T55-F338 HydrophobicContact CG2-CE1 3.49Å; T55-F338 VanDerWaalsContact CG2-CE1 3.49Å; T55-F338 HydrophobicContact CG2-CZ 4.24Å; T55-K341 PolarHBondContact OG1-NZ 3.45Å; T55-M571 HydrophobicContact CG2-SD 4.17Å; T55-D572 WeakPolarHBondContact CB-OD1 3.49Å; T55-D572 PolarHBondContact N-OD1 2.98Å; T55-D572 PolarHBondContact N-OD2 3.45Å; T55-D572 PolarHBondContact OG1-OD1 3.42Å; T55-Y592 PolarHBondContact OG1-OH 2.92Å
56	S	90.3	Very high	91	Very high	34 Å²	34	17.5 Å²	17.5	24%	0.238	9%	0.09	C	C	.	.	H	α-helix	trans	-57.2	-41.1	173.7	51.2	0	0	0	0	113.5	P54 G59 F60 D572	P54-S56 PolarHBondContact O-N 2.97Å; S56-G59 PolarHBondContact O-N 3.32Å; S56-F60 PolarHBondContact O-N 2.61Å; S56-F60 VanDerWaalsContact O-N 3.1Å; S56-D572 PolarHBondContact N-OD2 3.38Å; S56-D572 PolarHBondContact OG-OD2 2.83Å
57	L	91.6	Very high	90.9	Very high	39 Å²	39	20 Å²	20	20%	0.204	10%	0.104	C	C	.	.	H	α-helix	trans	-71.7	-37.7	177.3	-175.5	60.1	0	0	0	111.4	I53 P54 T55 G59 F60 I61 W158	I53-L57 HydrophobicContact CB-CD2 4.05Å; I53-L57 HydrophobicContact CD1-CD2 4.31Å; I53-L57 HydrophobicContact CD1-CG 4.38Å; I53-L57 HydrophobicContact CG2-CD2 3.88Å; P54-L57 HydrophobicContact CG-CB 4.03Å; P54-L57 PolarHBondContact O-N 2.87Å; T55-L57 VanDerWaalsContact C-N 3.33Å; T55-L57 PolarHBondContact O-N 3.36Å; L57-G59 VanDerWaalsContact C-N 3.27Å; L57-G59 PolarHBondContact O-N 3.27Å; L57-F60 HydrophobicContact CD1-CD1 4.16Å; L57-F60 WeakPolarHBondContact O-CB 3.13Å; L57-F60 PolarHBondContact O-N 3.01Å; L57-F60 VanDerWaalsContact O-N 3.11Å; L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 3.35Å; L57-W158 HydrophobicContact CD1-CH2 3.82Å; L57-W158 HydrophobicContact CD1-CZ2 4.47Å; L57-W158 HydrophobicContact CD1-CZ3 3.89Å; L57-W158 HydrophobicContact CD2-CD2 4.31Å; L57-W158 HydrophobicContact CD2-CE3 4.44Å; L57-W158 HydrophobicContact CD2-CH2 4.15Å; L57-W158 HydrophobicContact CD2-CZ2 4.01Å; L57-W158 HydrophobicContact CD2-CZ3 4.36Å; L57-W158 HydrophobicContact CG-CH2 4.47Å; L57-W158 HydrophobicContact CG-CZ3 4.38Å
58	V	91.8	Very high	90.9	Very high	1 Å²	1	20 Å²	20	1%	0.006	10%	0.104	C	C	.	.	H	α-helix	trans	-60.6	-40	171.6	177.6	0	0	0	0	110.9	L44 E48 I53 P54 T55 F60 I61 N62	L44-V58 HydrophobicContact CB-CG1 3.7Å; L44-V58 HydrophobicContact CD1-CG1 4.47Å; L44-V58 HydrophobicContact CD2-CG1 3.75Å; L44-V58 HydrophobicContact CG-CG1 4.15Å; E48-V58 HydrophobicContact CB-CG2 3.71Å; E48-V58 HydrophobicContact CG-CG2 3.86Å; I53-V58 HydrophobicContact CD1-CG2 3.63Å; I53-V58 HydrophobicContact CG1-CG2 3.81Å; P54-V58 PolarHBondContact O-N 3.43Å; T55-V58 WeakPolarHBondContact O-CB 3.42Å; T55-V58 PolarHBondContact O-N 3.43Å; V58-F60 VanDerWaalsContact C-N 3.32Å; V58-F60 PolarHBondContact O-N 3.48Å; V58-I61 WeakPolarHBondContact O-CB 3.31Å; V58-I61 PolarHBondContact O-N 3.37Å; V58-N62 PolarHBondContact O-N 3.34Å
59	G	91.1	Very high	90.8	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-57.5	-43.3	171.4	0	0	0	0	0	112.5	T55 S56 L57 N62 G63 P564	T55-G59 PolarHBondContact O-N 2.89Å; S56-G59 PolarHBondContact O-N 3.32Å; L57-G59 VanDerWaalsContact C-N 3.27Å; L57-G59 PolarHBondContact O-N 3.27Å; G59-N62 PolarHBondContact O-N 3.44Å; G59-G63 PolarHBondContact O-N 3.07Å; G59-P564 WeakPolarHBondContact CA-O 3.18Å; G59-P564 WeakPolarHBondContact O-CB 3.43Å
60	F	93.4	Very high	90.7	Very high	79 Å²	79	20.7 Å²	20.7	35%	0.346	11%	0.109	S	C	.	.	H	α-helix	trans	-64.8	-41.5	174.9	178.9	-119	0	0	0	112.7	S56 L57 V58 N62 G63 S64 I67 L162 I565	S56-F60 PolarHBondContact O-N 2.61Å; S56-F60 VanDerWaalsContact O-N 3.1Å; L57-F60 HydrophobicContact CD1-CD1 4.16Å; L57-F60 WeakPolarHBondContact O-CB 3.13Å; L57-F60 PolarHBondContact O-N 3.01Å; L57-F60 VanDerWaalsContact O-N 3.11Å; V58-F60 VanDerWaalsContact C-N 3.32Å; V58-F60 PolarHBondContact O-N 3.48Å; F60-N62 VanDerWaalsContact C-N 3.29Å; F60-N62 PolarHBondContact O-N 3.35Å; F60-G63 PolarHBondContact O-N 2.89Å; F60-S64 PolarHBondContact O-N 3.35Å; F60-I67 HydrophobicContact CE2-CD1 4.3Å; F60-L162 HydrophobicContact CD1-CD1 3.69Å; F60-L162 HydrophobicContact CE1-CD1 3.35Å; F60-L162 HydrophobicContact CZ-CD1 4.21Å; F60-I565 HydrophobicContact CB-CD1 4.32Å; F60-I565 HydrophobicContact CB-CG1 4.09Å; F60-I565 HydrophobicContact CD2-CD1 3.91Å
61	I	94.3	Very high	90.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59.1	-42.5	173.5	-66.5	170.4	0	0	0	110.5	M40 I53 L57 V58 S64 W158 V161 L162 N165	M40-I61 HydrophobicContact CE-CG2 3.63Å; I53-I61 HydrophobicContact CD1-CD1 3.84Å; L57-I61 WeakPolarHBondContact O-CG1 3.46Å; L57-I61 PolarHBondContact O-N 3.35Å; V58-I61 WeakPolarHBondContact O-CB 3.31Å; V58-I61 PolarHBondContact O-N 3.37Å; I61-S64 PolarHBondContact O-N 3.11Å; I61-S64 PolarHBondContact O-OG 3.41Å; I61-W158 HydrophobicContact CD1-CB 4.46Å; I61-W158 HydrophobicContact CD1-CE3 4.02Å; I61-W158 HydrophobicContact CG1-CE3 4.26Å; I61-V161 HydrophobicContact CG2-CG1 3.81Å; I61-L162 HydrophobicContact CG1-CB 4.42Å; I61-N165 PolarHBondContact O-ND2 3.23Å
62	N	92	Very high	90.5	Very high	20 Å²	20	26.8 Å²	26.8	11%	0.107	14%	0.142	C	C	.	.	H	α-helix	trans	-64.6	-47.6	177.1	-166.5	25.5	0	0	0	111.5	N41 L44 V58 G59 F60 S64 F65 N165 S337 P564	N41-N62 PolarHBondContact OD1-ND2 2.9Å; N41-N62 PolarHBondContact OD1-OD1 3.49Å; L44-N62 HydrophobicContact CD1-CB 4.13Å; L44-N62 HydrophobicContact CD2-CB 4.13Å; V58-N62 PolarHBondContact O-N 3.34Å; G59-N62 PolarHBondContact O-N 3.44Å; F60-N62 VanDerWaalsContact C-N 3.29Å; F60-N62 PolarHBondContact O-N 3.35Å; N62-S64 PolarHBondContact O-N 2.98Å; N62-F65 PolarHBondContact O-N 2.87Å; N62-N165 PolarHBondContact O-ND2 3.04Å; N62-S337 PolarHBondContact ND2-OG 3.13Å; N62-P564 HydrophobicContact CB-CB 4.48Å
63	G	91.1	Very high	90.3	Very high	2 Å²	2	27.4 Å²	27.4	2%	0.021	15%	0.145	C	C	.	.	H	α-helix	trans	-63.6	-21	178.6	0	0	0	0	0	114.6	G59 F60 F65 E66	G59-G63 PolarHBondContact O-N 3.07Å; F60-G63 PolarHBondContact O-N 2.89Å; G63-F65 PolarHBondContact O-N 3.35Å; G63-E66 WeakPolarHBondContact O-CB 3.49Å; G63-E66 PolarHBondContact O-N 3.2Å
64	S	94.1	Very high	89.6	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.007	17%	0.172	C	C	.	.	H	α-helix	trans	-64.6	-23.2	-179.8	83.6	0	0	0	0	113.7	F60 I61 N62 E66 I67 G68 L162 I166	F60-S64 PolarHBondContact O-N 3.35Å; I61-S64 PolarHBondContact O-N 3.11Å; I61-S64 PolarHBondContact O-OG 3.41Å; N62-S64 PolarHBondContact O-N 2.98Å; S64-E66 VanDerWaalsContact C-N 3.27Å; S64-E66 PolarHBondContact O-N 3.16Å; S64-I67 WeakPolarHBondContact O-CB 3.25Å; S64-I67 PolarHBondContact O-N 3.34Å; S64-G68 PolarHBondContact O-N 3.21Å; S64-L162 PolarHBondContact OG-O 3.22Å; S64-I166 WeakPolarHBondContact O-CG1 3.32Å
65	F	93.6	Very high	89.1	Confident	18 Å²	18	35.6 Å²	35.6	8%	0.079	18%	0.18	C	C	.	.	H	α-helix	trans	-57.1	-42.7	170.8	166.9	-100.4	0	0	0	111.8	N62 G63 I67 G68 N69 N165 G169 E172	N62-F65 PolarHBondContact O-N 2.87Å; G63-F65 PolarHBondContact O-N 3.35Å; F65-I67 VanDerWaalsContact C-N 3.33Å; F65-G68 PolarHBondContact O-N 3.06Å; F65-N69 PolarHBondContact O-N 3.14Å; F65-N165 WeakPolarHBondContact CB-ND2 3.49Å; F65-N165 PolarHBondContact N-ND2 3.43Å; F65-G169 VanDerWaalsContact CD2-CA 3.47Å; F65-G169 VanDerWaalsContact CE2-CA 3.48Å; F65-E172 HydrophobicContact CE2-CB 4.22Å; F65-E172 WeakPolarHBondContact CE2-OE2 3.37Å; F65-E172 HydrophobicContact CZ-CB 4.42Å; F65-E172 HydrophobicContact CZ-CG 4.46Å; F65-E172 WeakPolarHBondContact CZ-OE2 3.43Å
66	E	91.5	Very high	88.6	Confident	19 Å²	19	36 Å²	36	9%	0.089	18%	0.182	C	C	.	.	H	α-helix	trans	-67.1	-37.6	179.1	-60.2	-61.1	171.5	0	0	111.6	G63 S64 G68 N69 L70 R556 I561	G63-E66 WeakPolarHBondContact O-CB 3.49Å; G63-E66 PolarHBondContact O-N 3.2Å; S64-E66 VanDerWaalsContact C-N 3.27Å; S64-E66 PolarHBondContact O-N 3.16Å; E66-G68 VanDerWaalsContact C-N 3.34Å; E66-G68 PolarHBondContact O-N 3.37Å; E66-N69 PolarHBondContact O-N 2.93Å; E66-L70 WeakPolarHBondContact O-CB 3.34Å; E66-L70 VanDerWaalsContact O-CG 3.23Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 2.95Å; E66-R556 IonicContact OE1-CZ 3.31Å; E66-R556 IonicContact OE1-NE 2.65Å; E66-R556 IonicContact OE1-NH1 3.47Å; E66-R556 PolarHBondContact OE1-NH1 2.91Å; E66-R556 WeakPolarHBondContact OE2-CD 3.36Å; E66-R556 WeakPolarHBondContact OE2-CG 3.26Å; E66-R556 IonicContact OE2-CZ 3.35Å; E66-R556 IonicContact OE2-NE 2.64Å; E66-R556 IonicContact OE2-NH1 3.47Å; E66-R556 PolarHBondContact OE2-NH1 3.3Å; E66-I561 HydrophobicContact CB-CD1 4.27Å; E66-I561 HydrophobicContact CB-CG1 3.65Å; E66-I561 HydrophobicContact CG-CG1 4.43Å
67	I	91.9	Very high	87.7	Confident	54 Å²	54	37.1 Å²	37.1	28%	0.277	19%	0.19	S	C	.	.	H	α-helix	trans	-58.2	-49.1	174.1	-57.3	176.8	0	0	0	109.8	F60 S64 F65 N69 L70 L71 I561	F60-I67 HydrophobicContact CE2-CD1 4.3Å; S64-I67 WeakPolarHBondContact O-CB 3.25Å; S64-I67 PolarHBondContact O-N 3.34Å; F65-I67 VanDerWaalsContact C-N 3.33Å; I67-N69 VanDerWaalsContact C-N 3.32Å; I67-N69 PolarHBondContact O-N 3.08Å; I67-L70 PolarHBondContact O-N 2.69Å; I67-L71 WeakPolarHBondContact O-CG 3.48Å; I67-L71 PolarHBondContact O-N 3.06Å; I67-I561 HydrophobicContact CG1-CD1 3.78Å; I67-I561 HydrophobicContact CG1-CG1 4.2Å
68	G	91.7	Very high	86.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-40	177.8	0	0	0	0	0	113.6	S64 F65 E66 I166 M170	S64-G68 PolarHBondContact O-N 3.21Å; F65-G68 PolarHBondContact O-N 3.06Å; E66-G68 VanDerWaalsContact C-N 3.34Å; E66-G68 PolarHBondContact O-N 3.37Å; G68-I166 WeakPolarHBondContact CA-O 3.35Å; G68-M170 VanDerWaalsContact O-CG 3.3Å; G68-M170 WeakPolarHBondContact O-CG 3.29Å
69	N	89.6	Confident	85.7	Confident	13 Å²	13	44 Å²	44	7%	0.07	22%	0.217	C	C	.	.	H	α-helix	trans	-66.7	-47	178	-166.4	-71.7	0	0	0	112	F65 E66 I67 L71 L72 I73 T173	F65-N69 PolarHBondContact O-N 3.14Å; E66-N69 PolarHBondContact O-N 2.93Å; I67-N69 VanDerWaalsContact C-N 3.32Å; I67-N69 PolarHBondContact O-N 3.08Å; N69-L71 VanDerWaalsContact C-N 3.26Å; N69-L71 PolarHBondContact O-N 3.07Å; N69-L72 PolarHBondContact O-N 2.97Å; N69-I73 WeakPolarHBondContact O-CB 3.22Å; N69-I73 PolarHBondContact O-N 2.83Å; N69-T173 WeakPolarHBondContact CA-OG1 3.32Å; N69-T173 PolarHBondContact O-OG1 3.44Å
70	L	88.2	Confident	84.6	Confident	33 Å²	33	44 Å²	44	17%	0.173	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-32.3	-179	-72.5	170.5	0	0	0	113.2	E66 I67 L72 F553 R556 V557 I561	E66-L70 WeakPolarHBondContact O-CB 3.34Å; E66-L70 VanDerWaalsContact O-CG 3.23Å; E66-L70 WeakPolarHBondContact O-CG 3.44Å; E66-L70 PolarHBondContact O-N 2.95Å; I67-L70 PolarHBondContact O-N 2.69Å; L70-L72 VanDerWaalsContact C-N 3.26Å; L70-L72 PolarHBondContact O-N 3.32Å; L70-F553 HydrophobicContact CD2-CD2 3.53Å; L70-F553 HydrophobicContact CD2-CE2 3.87Å; L70-F553 HydrophobicContact CD2-CG 4.47Å; L70-R556 HydrophobicContact CD2-CB 4.3Å; L70-V557 HydrophobicContact CD1-CG2 3.63Å; L70-V557 HydrophobicContact CD2-CG2 4.12Å; L70-I561 HydrophobicContact CD1-CD1 3.95Å
71	L	86.4	Confident	83.3	Confident	114 Å²	114	42.9 Å²	42.9	60%	0.597	22%	0.217	S	C	*	.	H	α-helix	trans	-60.9	-33.8	178.1	-73.5	171.9	0	0	0	113	I67 N69	I67-L71 WeakPolarHBondContact O-CG 3.48Å; I67-L71 PolarHBondContact O-N 3.06Å; N69-L71 VanDerWaalsContact C-N 3.26Å; N69-L71 PolarHBondContact O-N 3.07Å
72	L	86.4	Confident	82.2	Confident	52 Å²	52	46.9 Å²	46.9	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-111.7	-18	-173.7	-65.3	-172.4	0	0	0	114.1	N69 L70 I74 F75 V76 M170 T173	N69-L72 PolarHBondContact O-N 2.97Å; L70-L72 VanDerWaalsContact C-N 3.26Å; L70-L72 PolarHBondContact O-N 3.32Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.24Å; L72-F75 PolarHBondContact O-N 3.08Å; L72-F75 VanDerWaalsContact O-N 3.13Å; L72-V76 HydrophobicContact CB-CG2 4.18Å; L72-V76 WeakPolarHBondContact O-CB 3.42Å; L72-V76 WeakPolarHBondContact O-CG2 3.16Å; L72-V76 PolarHBondContact O-N 3.49Å; L72-M170 HydrophobicContact CD1-CB 3.64Å; L72-M170 HydrophobicContact CD1-CE 3.83Å; L72-M170 HydrophobicContact CD1-CG 3.97Å; L72-M170 HydrophobicContact CG-CB 4.43Å; L72-M170 HydrophobicContact CG-CE 4.29Å; L72-M170 HydrophobicContact CG-CG 4.29Å; L72-T173 HydrophobicContact CB-CG2 3.91Å
73	I	80.5	Confident	81.6	Confident	37 Å²	37	49.7 Å²	49.7	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-59.8	-39.9	-170.3	-165.1	166.7	0	0	0	113.5	N69 S77 T173	N69-I73 WeakPolarHBondContact O-CB 3.22Å; N69-I73 PolarHBondContact O-N 2.83Å; I73-S77 WeakPolarHBondContact O-CB 3.19Å; I73-S77 PolarHBondContact O-N 3.16Å; I73-S77 PolarHBondContact O-OG 3.45Å; I73-T173 HydrophobicContact CB-CG2 3.93Å; I73-T173 HydrophobicContact CG1-CG2 4.33Å
74	I	73.9	Confident	81.3	Confident	122 Å²	122	52.1 Å²	52.1	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-66.9	-46.9	177.4	-60.2	177.3	0	0	0	110.2	L72 S77 Y78	L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.24Å; I74-S77 PolarHBondContact O-N 3.04Å; I74-Y78 WeakPolarHBondContact O-CB 3.43Å; I74-Y78 PolarHBondContact O-N 2.86Å; I74-Y78 VanDerWaalsContact O-N 3.13Å
75	F	77.6	Confident	81	Confident	109 Å²	109	53.4 Å²	53.4	48%	0.478	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-47.6	-178.9	-178.4	-94.6	0	0	0	111.6	L72 Y78 F79	L72-F75 PolarHBondContact O-N 3.08Å; L72-F75 VanDerWaalsContact O-N 3.13Å; F75-Y78 PolarHBondContact O-N 3.32Å; F75-F79 AromaticContact CD2-CD2 3.38Å; F75-F79 HydrophobicContact CD2-CD2 3.38Å; F75-F79 AromaticContact CD2-CE2 3.77Å; F75-F79 HydrophobicContact CD2-CE2 3.77Å; F75-F79 HydrophobicContact CD2-CG 4.39Å; F75-F79 HydrophobicContact CE1-CB 4.47Å; F75-F79 HydrophobicContact CE2-CB 4.47Å; F75-F79 AromaticContact CE2-CD2 3.38Å; F75-F79 HydrophobicContact CE2-CD2 3.38Å; F75-F79 AromaticContact CE2-CE2 3.78Å; F75-F79 HydrophobicContact CE2-CE2 3.78Å; F75-F79 HydrophobicContact CE2-CG 4.07Å; F75-F79 HydrophobicContact CG-CD2 4.04Å; F75-F79 HydrophobicContact CZ-CB 4.3Å; F75-F79 HydrophobicContact CZ-CD2 4.05Å; F75-F79 HydrophobicContact CZ-CG 4.34Å; F75-F79 WeakPolarHBondContact O-CB 3.32Å; F75-F79 PolarHBondContact O-N 3.02Å
76	V	80.4	Confident	80.9	Confident	7 Å²	7	52.6 Å²	52.6	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-69.3	-38.4	-178.3	173	0	0	0	0	111.7	L72 Y78 G80 T173 P174 P177 L178	L72-V76 HydrophobicContact CB-CG2 4.18Å; L72-V76 WeakPolarHBondContact O-CB 3.42Å; L72-V76 WeakPolarHBondContact O-CG2 3.16Å; L72-V76 PolarHBondContact O-N 3.49Å; V76-Y78 VanDerWaalsContact C-N 3.32Å; V76-Y78 PolarHBondContact O-N 3.38Å; V76-G80 WeakPolarHBondContact O-CA 3.34Å; V76-G80 PolarHBondContact O-N 3.33Å; V76-T173 HydrophobicContact CB-CG2 4.01Å; V76-T173 HydrophobicContact CG1-CG2 4.39Å; V76-T173 HydrophobicContact CG2-CG2 4.01Å; V76-P174 HydrophobicContact CG1-CB 3.72Å; V76-P177 HydrophobicContact CG1-CG 4.48Å; V76-L178 HydrophobicContact CG1-CD1 4.08Å; V76-L178 HydrophobicContact CG1-CG 4.17Å
77	S	71.8	Confident	81	Confident	58 Å²	58	54.3 Å²	54.3	41%	0.406	27%	0.27	S	S	.	.	H	α-helix	trans	-67.5	-33.1	178	-58.3	0	0	0	0	112.3	I73 I74	I73-S77 WeakPolarHBondContact O-CB 3.19Å; I73-S77 PolarHBondContact O-N 3.16Å; I73-S77 PolarHBondContact O-OG 3.45Å; I74-S77 PolarHBondContact O-N 3.04Å
78	Y	68.5	Low	81	Confident	94 Å²	94	53.7 Å²	53.7	37%	0.369	27%	0.266	S	S	.	.	H	α-helix	trans	-87.4	-52.3	-179.7	-176.8	-97.9	0	0	0	113.5	I74 F75 V76 T81 I301	I74-Y78 WeakPolarHBondContact O-CB 3.43Å; I74-Y78 PolarHBondContact O-N 2.86Å; I74-Y78 VanDerWaalsContact O-N 3.13Å; F75-Y78 PolarHBondContact O-N 3.32Å; V76-Y78 VanDerWaalsContact C-N 3.32Å; V76-Y78 PolarHBondContact O-N 3.38Å; Y78-T81 PolarHBondContact O-OG1 3.35Å; Y78-I301 HydrophobicContact CE2-CB 4.46Å; Y78-I301 HydrophobicContact CE2-CD1 4.15Å; Y78-I301 HydrophobicContact CE2-CG2 3.94Å
79	F	71.4	Confident	81.1	Confident	90 Å²	90	53.7 Å²	53.7	40%	0.395	27%	0.266	S	S	.	.	H	α-helix	trans	-89.2	-27.3	-175.4	-66.9	-74.7	0	0	0	112.9	F75 T81 K82 L83	F75-F79 AromaticContact CD2-CD2 3.38Å; F75-F79 HydrophobicContact CD2-CD2 3.38Å; F75-F79 AromaticContact CD2-CE2 3.77Å; F75-F79 HydrophobicContact CD2-CE2 3.77Å; F75-F79 HydrophobicContact CD2-CG 4.39Å; F75-F79 HydrophobicContact CE1-CB 4.47Å; F75-F79 HydrophobicContact CE2-CB 4.47Å; F75-F79 AromaticContact CE2-CD2 3.38Å; F75-F79 HydrophobicContact CE2-CD2 3.38Å; F75-F79 AromaticContact CE2-CE2 3.78Å; F75-F79 HydrophobicContact CE2-CE2 3.78Å; F75-F79 HydrophobicContact CE2-CG 4.07Å; F75-F79 HydrophobicContact CG-CD2 4.04Å; F75-F79 HydrophobicContact CZ-CB 4.3Å; F75-F79 HydrophobicContact CZ-CD2 4.05Å; F75-F79 HydrophobicContact CZ-CG 4.34Å; F75-F79 WeakPolarHBondContact O-CB 3.32Å; F75-F79 PolarHBondContact O-N 3.02Å; F79-T81 PolarHBondContact O-N 2.95Å; F79-K82 PolarHBondContact O-N 3.44Å; F79-K82 VanDerWaalsContact O-N 3.13Å; F79-L83 WeakPolarHBondContact O-CG 3.37Å; F79-L83 PolarHBondContact O-N 3.35Å
80	G	68.1	Low	81.4	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.9	-175.2	0	0	0	0	0	113.6	V76 K82 L83 L178	V76-G80 WeakPolarHBondContact O-CA 3.34Å; V76-G80 PolarHBondContact O-N 3.33Å; G80-K82 VanDerWaalsContact C-N 3.31Å; G80-K82 PolarHBondContact O-N 3.32Å; G80-L83 PolarHBondContact O-N 3.42Å; G80-L178 VanDerWaalsContact C-CD2 3.47Å
81	T	65.9	Low	81.8	Confident	56 Å²	56	55.2 Å²	55.2	34%	0.344	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-27.8	176	53.5	0	0	0	0	113.1	Y78 F79 R85 L178	Y78-T81 PolarHBondContact O-OG1 3.35Å; F79-T81 PolarHBondContact O-N 2.95Å; T81-R85 PolarHBondContact O-NE 3.48Å; T81-L178 HydrophobicContact CG2-CD2 4.32Å
82	K	71.1	Confident	82.2	Confident	84 Å²	84	50 Å²	50	37%	0.365	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-23.8	177.6	-58.5	-173.6	177.8	-173.9	0	113.1	F79 G80 E297	F79-K82 PolarHBondContact O-N 3.44Å; F79-K82 VanDerWaalsContact O-N 3.13Å; G80-K82 VanDerWaalsContact C-N 3.31Å; G80-K82 PolarHBondContact O-N 3.32Å; K82-E297 IonicContact NZ-OE1 3.96Å; K82-E297 PolarHBondContact NZ-OE1 2.93Å
83	L	79.1	Confident	82.7	Confident	79 Å²	79	47.5 Å²	47.5	41%	0.414	23%	0.234	S	C	.	.	S	Bend	trans	-83.5	177.2	178.5	-65.2	174.3	0	0	0	111.7	F79 G80 R85 M88	F79-L83 WeakPolarHBondContact O-CG 3.37Å; F79-L83 PolarHBondContact O-N 3.35Å; G80-L83 PolarHBondContact O-N 3.42Å; L83-R85 VanDerWaalsContact C-N 3.34Å; L83-R85 PolarHBondContact O-N 2.88Å; L83-M88 HydrophobicContact CB-CG 4Å; L83-M88 HydrophobicContact CD1-CE 4.17Å; L83-M88 HydrophobicContact CD1-CG 4.41Å; L83-M88 HydrophobicContact CD1-SD 3.97Å
84	H	86.4	Confident	83.5	Confident	53 Å²	53	48.6 Å²	48.6	25%	0.245	24%	0.242	C	C	.	.			trans	-72.3	87.7	176.3	-167.3	-51.6	0	0	0	110.5	I87 M88 L266 K268	H84-I87 HydrophobicContact CB-CB 4.28Å; H84-I87 HydrophobicContact CB-CD1 4.15Å; H84-I87 HydrophobicContact CB-CG1 4.47Å; H84-I87 WeakPolarHBondContact ND1-CG1 3.39Å; H84-I87 PolarHBondContact O-N 3.13Å; H84-M88 PolarHBondContact O-N 3.36Å; H84-M88 VanDerWaalsContact O-N 3.08Å; H84-L266 PolarHBondContact CE1-O 3.22Å; H84-K268 HydrophobicContact CB-CG 4.48Å; H84-K268 PolarHBondContact CE1-N 3.4Å; H84-K268 WeakPolarHBondContact NE2-CA 3.35Å; H84-K268 PolarHBondContact NE2-N 3.04Å
85	R	87.5	Confident	84.7	Confident	29 Å²	29	44.9 Å²	44.9	11%	0.109	23%	0.226	C	C	.	.	H	α-helix	trans	-49	-49	-169.3	-54.6	-177.2	-163.8	169	10.9	114.6	T81 L83 I87 M88 I89 L178 S181 Y182 D185	T81-R85 PolarHBondContact O-NE 3.48Å; L83-R85 VanDerWaalsContact C-N 3.34Å; L83-R85 PolarHBondContact O-N 2.88Å; R85-I87 PolarHBondContact O-N 3.47Å; R85-M88 PolarHBondContact O-N 3.39Å; R85-I89 WeakPolarHBondContact O-CG1 3.5Å; R85-I89 PolarHBondContact O-N 3.26Å; R85-L178 HydrophobicContact CB-CB 4.38Å; R85-S181 PolarHBondContact NH1-O 2.88Å; R85-S181 PolarHBondContact NH1-OG 3.06Å; R85-S181 VanDerWaalsContact NH1-OG 3.13Å; R85-Y182 HydrophobicContact CB-CD2 4.19Å; R85-D185 IonicContact CZ-OD2 2.64Å; R85-D185 IonicContact NH1-OD2 3.69Å; R85-D185 PolarHBondContact NH1-OD2 3.34Å; R85-D185 IonicContact NH2-OD2 3.15Å; R85-D185 PolarHBondContact NH2-OD2 2.66Å
86	P	91.1	Very high	85.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-55.7	-50.3	175.4	-27.3	34.3	0	0	0	113.6	F22 M88 I89 G90 Y182 F263 L266	F22-P86 HydrophobicContact CD2-CG 4.38Å; F22-P86 HydrophobicContact CE2-CB 4.42Å; F22-P86 HydrophobicContact CE2-CG 4.13Å; P86-M88 VanDerWaalsContact C-N 3.3Å; P86-M88 PolarHBondContact O-N 3.23Å; P86-I89 WeakPolarHBondContact O-CA 3.28Å; P86-I89 WeakPolarHBondContact O-CB 3.36Å; P86-I89 PolarHBondContact O-N 3.4Å; P86-G90 PolarHBondContact O-N 3.12Å; P86-Y182 HydrophobicContact CG-CD2 4.11Å; P86-Y182 HydrophobicContact CG-CE2 3.53Å; P86-F263 HydrophobicContact CB-CD1 4.33Å; P86-F263 WeakPolarHBondContact O-CB 3.22Å; P86-L266 HydrophobicContact CB-CB 3.92Å; P86-L266 HydrophobicContact CG-CB 4.23Å
87	I	93	Very high	86.4	Confident	55 Å²	55	39.5 Å²	39.5	28%	0.282	20%	0.202	S	C	.	.	H	α-helix	trans	-59.4	-40.4	178.9	-66.1	174.3	0	0	0	111.4	H84 R85 I89 G90 I91 F264	H84-I87 HydrophobicContact CB-CB 4.28Å; H84-I87 HydrophobicContact CB-CD1 4.15Å; H84-I87 HydrophobicContact CB-CG1 4.47Å; H84-I87 WeakPolarHBondContact ND1-CG1 3.39Å; H84-I87 PolarHBondContact O-N 3.13Å; R85-I87 PolarHBondContact O-N 3.47Å; I87-I89 VanDerWaalsContact C-N 3.32Å; I87-I89 PolarHBondContact O-N 3.44Å; I87-G90 PolarHBondContact O-N 3.07Å; I87-G90 VanDerWaalsContact O-N 3.16Å; I87-I91 HydrophobicContact CG2-CD1 3.9Å; I87-I91 HydrophobicContact CG2-CG1 4.33Å; I87-I91 WeakPolarHBondContact O-CG1 3.37Å; I87-I91 PolarHBondContact O-N 3.29Å; I87-F264 HydrophobicContact CG2-CD1 4.26Å; I87-F264 HydrophobicContact CG2-CE1 4.21Å
88	M	92.6	Very high	87.7	Confident	42 Å²	42	41 Å²	41	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-39	175.6	-69.9	-61.3	-64.4	0	0	112.4	L83 H84 R85 P86 I91 G92 L178	L83-M88 HydrophobicContact CB-CG 4Å; L83-M88 HydrophobicContact CD1-CE 4.17Å; L83-M88 HydrophobicContact CD1-CG 4.41Å; L83-M88 HydrophobicContact CD1-SD 3.97Å; H84-M88 PolarHBondContact O-N 3.36Å; H84-M88 VanDerWaalsContact O-N 3.08Å; R85-M88 PolarHBondContact O-N 3.39Å; P86-M88 VanDerWaalsContact C-N 3.3Å; P86-M88 PolarHBondContact O-N 3.23Å; M88-I91 HydrophobicContact SD-CD1 4.46Å; M88-G92 PolarHBondContact O-N 2.93Å; M88-L178 HydrophobicContact CB-CD1 3.66Å; M88-L178 HydrophobicContact CG-CD1 4.49Å
89	I	94.1	Very high	89	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.3	-43.7	173	-63	164.7	0	0	0	110.2	F22 I26 R85 P86 I87 G92 C93 I175 L178 F263	F22-I89 HydrophobicContact CE2-CD1 4.2Å; F22-I89 HydrophobicContact CZ-CD1 4Å; I26-I89 HydrophobicContact CD1-CD1 4.22Å; I26-I89 HydrophobicContact CD1-CG2 4.08Å; R85-I89 WeakPolarHBondContact O-CG1 3.5Å; R85-I89 PolarHBondContact O-N 3.26Å; P86-I89 WeakPolarHBondContact O-CA 3.28Å; P86-I89 WeakPolarHBondContact O-CB 3.36Å; P86-I89 PolarHBondContact O-N 3.4Å; I87-I89 VanDerWaalsContact C-N 3.32Å; I87-I89 PolarHBondContact O-N 3.44Å; I89-G92 PolarHBondContact O-N 3.16Å; I89-C93 PolarHBondContact O-N 3.48Å; I89-C93 PolarHBondContact O-SG 3.06Å; I89-I175 HydrophobicContact CG2-CG1 4.41Å; I89-L178 HydrophobicContact CD1-CB 3.93Å; I89-L178 HydrophobicContact CG1-CB 3.87Å; I89-L178 HydrophobicContact CG1-CD1 4.44Å; I89-F263 HydrophobicContact CB-CD1 4.17Å; I89-F263 HydrophobicContact CB-CE1 4.25Å; I89-F263 HydrophobicContact CB-CG 4.49Å; I89-F263 HydrophobicContact CD1-CE1 4.4Å; I89-F263 HydrophobicContact CG2-CD1 4.01Å; I89-F263 HydrophobicContact CG2-CD2 4.23Å; I89-F263 HydrophobicContact CG2-CE1 3.69Å; I89-F263 HydrophobicContact CG2-CE2 3.92Å; I89-F263 HydrophobicContact CG2-CG 4.26Å; I89-F263 HydrophobicContact CG2-CZ 3.63Å
90	G	95.4	Very high	90.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.4	-47.2	175.9	0	0	0	0	0	112.8	P86 I87 G92 C93 V94 A260	P86-G90 PolarHBondContact O-N 3.12Å; I87-G90 PolarHBondContact O-N 3.07Å; I87-G90 VanDerWaalsContact O-N 3.16Å; G90-G92 VanDerWaalsContact C-N 3.31Å; G90-G92 PolarHBondContact O-N 3.26Å; G90-C93 WeakPolarHBondContact O-CB 3.32Å; G90-C93 PolarHBondContact O-N 3.49Å; G90-V94 WeakPolarHBondContact O-CG2 3.4Å; G90-V94 PolarHBondContact O-N 3.34Å; G90-A260 WeakPolarHBondContact O-CB 2.96Å
91	I	95.6	Very high	91.7	Very high	78 Å²	78	36.7 Å²	36.7	40%	0.4	19%	0.188	S	C	.	.	H	α-helix	trans	-58.9	-44.2	173.7	-67.1	167	0	0	0	110.3	I87 M88 C93 V94 V95 F264	I87-I91 HydrophobicContact CG2-CD1 3.9Å; I87-I91 HydrophobicContact CG2-CG1 4.33Å; I87-I91 WeakPolarHBondContact O-CG1 3.37Å; I87-I91 PolarHBondContact O-N 3.29Å; M88-I91 HydrophobicContact SD-CD1 4.46Å; I91-C93 VanDerWaalsContact C-N 3.33Å; I91-C93 PolarHBondContact O-N 3.1Å; I91-V94 PolarHBondContact O-N 3.36Å; I91-V95 HydrophobicContact CG2-CG2 4.26Å; I91-V95 WeakPolarHBondContact O-CG2 3.45Å; I91-V95 PolarHBondContact O-N 3.49Å; I91-F264 HydrophobicContact CG1-CE1 4.18Å; I91-F264 HydrophobicContact CG1-CZ 4.44Å
92	G	95.6	Very high	93.2	Very high	4 Å²	4	35.9 Å²	35.9	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-56.1	-45	174.9	0	0	0	0	0	112.9	M88 I89 G90 V94 V95 M96 G171	M88-G92 PolarHBondContact O-N 2.93Å; I89-G92 PolarHBondContact O-N 3.16Å; G90-G92 VanDerWaalsContact C-N 3.31Å; G90-G92 PolarHBondContact O-N 3.26Å; G92-V94 PolarHBondContact O-N 3.13Å; G92-V95 PolarHBondContact O-N 3.16Å; G92-M96 WeakPolarHBondContact O-CB 2.99Å; G92-M96 PolarHBondContact O-N 2.93Å; G92-G171 CarbonylContact C-O 3.52Å; G92-G171 WeakPolarHBondContact CA-O 3.04Å; G92-G171 CarbonylContact O-C 3.52Å; G92-G171 WeakPolarHBondContact O-CA 3.41Å; G92-G171 VanDerWaalsContact O-O 3.11Å
93	C	97.3	Very high	94.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.4	-40.4	176.9	-63.6	0	0	0	0	112.3	I89 G90 I91 M96 G97 N256 A260	I89-C93 PolarHBondContact O-N 3.48Å; I89-C93 PolarHBondContact O-SG 3.06Å; G90-C93 WeakPolarHBondContact O-CB 3.32Å; G90-C93 PolarHBondContact O-N 3.49Å; I91-C93 VanDerWaalsContact C-N 3.33Å; I91-C93 PolarHBondContact O-N 3.1Å; C93-M96 PolarHBondContact O-N 2.94Å; C93-G97 PolarHBondContact O-N 3Å; C93-N256 WeakPolarHBondContact CB-O 3.43Å; C93-A260 HydrophobicContact CB-CB 3.66Å
94	V	98.1	Very high	95.1	Very high	59 Å²	59	28.1 Å²	28.1	36%	0.358	14%	0.144	S	C	.	.	H	α-helix	trans	-64	-45.7	174.4	175	0	0	0	0	111.4	G90 I91 G92 M96 G97 L98 A260 F264	G90-V94 WeakPolarHBondContact O-CG2 3.4Å; G90-V94 PolarHBondContact O-N 3.34Å; I91-V94 PolarHBondContact O-N 3.36Å; G92-V94 PolarHBondContact O-N 3.13Å; V94-M96 VanDerWaalsContact C-N 3.3Å; V94-M96 PolarHBondContact O-N 3.35Å; V94-G97 WeakPolarHBondContact O-CA 3.44Å; V94-G97 PolarHBondContact O-N 3.1Å; V94-G97 VanDerWaalsContact O-N 3.15Å; V94-L98 PolarHBondContact O-N 2.93Å; V94-A260 HydrophobicContact CG2-CB 3.67Å; V94-F264 HydrophobicContact CG2-CE2 4.25Å; V94-F264 HydrophobicContact CG2-CZ 4.25Å
95	V	97.6	Very high	95.4	Very high	45 Å²	45	27.5 Å²	27.5	27%	0.273	14%	0.142	S	C	.	.	H	α-helix	trans	-62.3	-40	177	172.7	0	0	0	0	110.8	I91 G92 G97 L98 G99 V167	I91-V95 HydrophobicContact CG2-CG2 4.26Å; I91-V95 WeakPolarHBondContact O-CG2 3.45Å; I91-V95 PolarHBondContact O-N 3.49Å; G92-V95 PolarHBondContact O-N 3.16Å; V95-G97 VanDerWaalsContact C-N 3.33Å; V95-G97 PolarHBondContact O-N 2.96Å; V95-L98 WeakPolarHBondContact O-CB 3.44Å; V95-L98 PolarHBondContact O-N 3.34Å; V95-G99 PolarHBondContact O-N 2.99Å; V95-V167 HydrophobicContact CG1-CG1 3.72Å; V95-V167 WeakPolarHBondContact O-CG1 3.34Å
96	M	96.7	Very high	95.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-40	174.4	-175.3	174.9	49.7	0	0	111.8	K33 G92 C93 V94 G99 C100 R168 E172 I175 N256	K33-M96 HydrophobicContact CB-CE 3.92Å; K33-M96 HydrophobicContact CB-SD 3.71Å; G92-M96 WeakPolarHBondContact O-CB 2.99Å; G92-M96 PolarHBondContact O-N 2.93Å; C93-M96 PolarHBondContact O-N 2.94Å; V94-M96 VanDerWaalsContact C-N 3.3Å; V94-M96 PolarHBondContact O-N 3.35Å; M96-G99 PolarHBondContact O-N 2.85Å; M96-C100 PolarHBondContact O-N 3.48Å; M96-C100 PolarHBondContact O-SG 2.82Å; M96-R168 HydrophobicContact CG-CG 3.76Å; M96-E172 HydrophobicContact SD-CB 4.41Å; M96-I175 HydrophobicContact CE-CD1 3.8Å; M96-I175 HydrophobicContact SD-CD1 4.42Å; M96-N256 HydrophobicContact CE-CB 4.22Å; M96-N256 WeakPolarHBondContact CE-OD1 3.09Å
97	G	97.8	Very high	95.5	Very high	2 Å²	2	27.6 Å²	27.6	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-61.7	-44.9	172.4	0	0	0	0	0	112.7	C93 V94 V95 G99 C100 F101 A253	C93-G97 PolarHBondContact O-N 3Å; V94-G97 WeakPolarHBondContact O-CA 3.44Å; V94-G97 PolarHBondContact O-N 3.1Å; V94-G97 VanDerWaalsContact O-N 3.15Å; V95-G97 VanDerWaalsContact C-N 3.33Å; V95-G97 PolarHBondContact O-N 2.96Å; G97-G99 VanDerWaalsContact C-N 3.33Å; G97-G99 PolarHBondContact O-N 2.95Å; G97-C100 PolarHBondContact O-N 3.38Å; G97-C100 VanDerWaalsContact O-N 3.15Å; G97-F101 PolarHBondContact O-N 3.08Å; G97-A253 WeakPolarHBondContact O-CB 3.25Å
98	L	98.1	Very high	95.3	Very high	91 Å²	91	30.3 Å²	30.3	48%	0.476	15%	0.154	S	C	.	.	H	α-helix	trans	-59.2	-43.5	173.6	178	63.4	0	0	0	111.6	V94 V95 C100 F101 L102	V94-L98 PolarHBondContact O-N 2.93Å; V95-L98 WeakPolarHBondContact O-CB 3.44Å; V95-L98 PolarHBondContact O-N 3.34Å; L98-C100 VanDerWaalsContact C-N 3.31Å; L98-C100 PolarHBondContact O-N 2.83Å; L98-F101 PolarHBondContact O-N 3.41Å; L98-L102 HydrophobicContact CD1-CG 4.41Å; L98-L102 HydrophobicContact CG-CD1 4.34Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.38Å
99	G	97.8	Very high	95.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-41	174.7	0	0	0	0	0	112.7	V95 M96 G97 K103 G164	V95-G99 PolarHBondContact O-N 2.99Å; M96-G99 PolarHBondContact O-N 2.85Å; G97-G99 VanDerWaalsContact C-N 3.33Å; G97-G99 PolarHBondContact O-N 2.95Å; G99-K103 WeakPolarHBondContact O-CG 3.48Å; G99-K103 PolarHBondContact O-N 3.31Å; G99-G164 CarbonylContact C-O 3.09Å; G99-G164 VanDerWaalsContact CA-O 3.27Å; G99-G164 WeakPolarHBondContact CA-O 3.46Å; G99-G164 CarbonylContact O-C 3.39Å; G99-G164 WeakPolarHBondContact O-CA 3.35Å
100	C	97.8	Very high	94.5	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.7	-41.9	175	-63.4	0	0	0	0	112.2	M96 G97 L98 K103 S104 C252 A253 N256	M96-C100 PolarHBondContact O-N 3.48Å; M96-C100 PolarHBondContact O-SG 2.82Å; G97-C100 PolarHBondContact O-N 3.38Å; G97-C100 VanDerWaalsContact O-N 3.15Å; L98-C100 VanDerWaalsContact C-N 3.31Å; L98-C100 PolarHBondContact O-N 2.83Å; C100-K103 WeakPolarHBondContact O-CB 3.32Å; C100-K103 PolarHBondContact O-N 3.48Å; C100-S104 PolarHBondContact O-N 2.86Å; C100-C252 HydrophobicContact CB-CB 4.26Å; C100-A253 HydrophobicContact CB-CB 3.91Å; C100-N256 PolarHBondContact SG-ND2 2.93Å
101	F	97.6	Very high	93.7	Very high	94 Å²	94	41.8 Å²	41.8	41%	0.412	22%	0.215	S	C	.	.	H	α-helix	trans	-60.7	-46.2	175.5	177.6	-100.6	0	0	0	112	G97 L98 K103 S104 L105 L250 A253	G97-F101 PolarHBondContact O-N 3.08Å; L98-F101 PolarHBondContact O-N 3.41Å; F101-K103 PolarHBondContact O-N 3.15Å; F101-S104 PolarHBondContact O-N 2.88Å; F101-S104 PolarHBondContact O-OG 3.46Å; F101-L105 HydrophobicContact CE1-CD1 4.47Å; F101-L105 HydrophobicContact CZ-CD1 4.48Å; F101-L105 PolarHBondContact O-N 2.96Å; F101-L250 HydrophobicContact CD2-CD2 3.84Å; F101-L250 HydrophobicContact CE2-CD2 4.19Å; F101-A253 HydrophobicContact CB-CB 4.17Å
102	L	96.7	Very high	93	Very high	39 Å²	39	43.9 Å²	43.9	20%	0.204	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-37.4	176.6	-73.5	173.8	0	0	0	112.4	L98 S104 L105 V167	L98-L102 HydrophobicContact CD1-CG 4.41Å; L98-L102 HydrophobicContact CG-CD1 4.34Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.38Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 3.08Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.98Å; L102-V167 HydrophobicContact CD1-CG2 4.21Å
103	K	95.8	Very high	92.4	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-35.3	175.7	-69.7	-172.7	-72.4	178.9	0	112.6	M40 G99 C100 F101 L105 P106 V161 N165 W245 F249	M40-K103 HydrophobicContact SD-CD 3.78Å; G99-K103 WeakPolarHBondContact O-CG 3.48Å; G99-K103 PolarHBondContact O-N 3.31Å; C100-K103 WeakPolarHBondContact O-CB 3.32Å; C100-K103 PolarHBondContact O-N 3.48Å; F101-K103 PolarHBondContact O-N 3.15Å; K103-L105 VanDerWaalsContact C-N 3.33Å; K103-P106 VanDerWaalsContact O-CD 3.22Å; K103-P106 WeakPolarHBondContact O-CD 3.36Å; K103-V161 HydrophobicContact CD-CG1 4.39Å; K103-V161 HydrophobicContact CG-CG1 4.31Å; K103-N165 HydrophobicContact CD-CB 4.27Å; K103-W245 WeakPolarHBondContact O-CZ3 3.49Å; K103-F249 HydrophobicContact CB-CD1 4.33Å; K103-F249 HydrophobicContact CB-CD2 3.89Å; K103-F249 HydrophobicContact CB-CE2 4.06Å; K103-F249 HydrophobicContact CB-CG 4.05Å; K103-F249 HydrophobicContact CB-CZ 4.39Å; K103-F249 HydrophobicContact CD-CD1 4.42Å; K103-F249 HydrophobicContact CD-CE1 4.01Å; K103-F249 HydrophobicContact CD-CZ 4.1Å; K103-F249 VanDerWaalsContact NZ-CE1 3.32Å
104	S	95.8	Very high	91.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-76.1	-18.8	178.5	69.8	0	0	0	0	114.3	C100 F101 L102 H107 W246 L250	C100-S104 PolarHBondContact O-N 2.86Å; F101-S104 PolarHBondContact O-N 2.88Å; F101-S104 PolarHBondContact O-OG 3.46Å; L102-S104 VanDerWaalsContact C-N 3.31Å; L102-S104 PolarHBondContact O-N 3.08Å; S104-H107 PolarHBondContact O-N 3.25Å; S104-W246 WeakPolarHBondContact CB-O 3.46Å; S104-L250 VanDerWaalsContact OG-CD2 3.24Å; S104-L250 WeakPolarHBondContact OG-CD2 3.35Å
105	L	92.6	Very high	90.2	Very high	39 Å²	39	50.2 Å²	50.2	20%	0.204	25%	0.245	C	C	.	.	H	α-helix	trans	-58.7	-37.6	-171.5	-164.4	66.3	0	0	0	115.2	F101 L102 K103 H107 F108 L109 Y160	F101-L105 HydrophobicContact CE1-CD1 4.47Å; F101-L105 HydrophobicContact CZ-CD1 4.48Å; F101-L105 PolarHBondContact O-N 2.96Å; L102-L105 WeakPolarHBondContact O-CB 3.4Å; L102-L105 PolarHBondContact O-N 2.98Å; K103-L105 VanDerWaalsContact C-N 3.33Å; L105-H107 PolarHBondContact O-N 3.39Å; L105-H107 VanDerWaalsContact O-N 3.17Å; L105-F108 PolarHBondContact O-N 3.35Å; L105-L109 HydrophobicContact CD2-CD1 3.97Å; L105-L109 HydrophobicContact CG-CD1 3.78Å; L105-L109 HydrophobicContact CG-CG 4.12Å; L105-L109 PolarHBondContact O-N 3.19Å; L105-Y160 HydrophobicContact CD2-CD1 3.85Å; L105-Y160 HydrophobicContact CD2-CE1 3.7Å
106	P	91.1	Very high	88.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-51.7	-39.2	178.4	-32.2	39.6	0	0	0	114.1	F51 K103 F108 L109 M110 M157 Y160 V161 W245	F51-P106 HydrophobicContact CE1-CB 4.27Å; F51-P106 HydrophobicContact CZ-CB 3.8Å; F51-P106 HydrophobicContact CZ-CG 4.2Å; K103-P106 VanDerWaalsContact O-CD 3.22Å; K103-P106 WeakPolarHBondContact O-CD 3.36Å; P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 PolarHBondContact O-N 3.31Å; P106-L109 PolarHBondContact O-N 3.46Å; P106-L109 VanDerWaalsContact O-N 3.14Å; P106-M110 HydrophobicContact CB-SD 3.98Å; P106-M110 VanDerWaalsContact O-CB 3.25Å; P106-M110 WeakPolarHBondContact O-CB 3.4Å; P106-M110 WeakPolarHBondContact O-CG 3.21Å; P106-M110 PolarHBondContact O-N 2.96Å; P106-M157 HydrophobicContact CB-CB 4.18Å; P106-M157 WeakPolarHBondContact CG-O 3.28Å; P106-Y160 HydrophobicContact CG-CG 4.42Å; P106-V161 HydrophobicContact CG-CG2 4.2Å; P106-W245 HydrophobicContact CB-CH2 4.04Å; P106-W245 HydrophobicContact CB-CZ2 4.47Å; P106-W245 HydrophobicContact CG-CH2 4.25Å
107	H	89	Confident	87.3	Confident	32 Å²	32	51.5 Å²	51.5	15%	0.148	25%	0.252	C	S	.	.	H	α-helix	trans	-60.8	-36.7	-179.2	178	69.5	0	0	0	112.4	S104 L105 V222 D223 W246	S104-H107 PolarHBondContact O-N 3.25Å; L105-H107 PolarHBondContact O-N 3.39Å; L105-H107 VanDerWaalsContact O-N 3.17Å; H107-V222 PolarHBondContact CE1-O 3.34Å; H107-V222 VanDerWaalsContact CE1-O 3.23Å; H107-D223 IonicContact CE1-OD1 2.58Å; H107-D223 PolarHBondContact CE1-OD1 3.15Å; H107-D223 VanDerWaalsContact CE1-OD1 3.26Å; H107-D223 IonicContact ND1-OD1 3.3Å; H107-W246 HydrophobicContact CB-CB 3.7Å; H107-W246 HydrophobicContact CB-CD2 4.37Å; H107-W246 HydrophobicContact CB-CG 3.66Å; H107-W246 AromaticContact CD2-CD1 3.52Å; H107-W246 AromaticContact CD2-CD2 3.43Å; H107-W246 VanDerWaalsContact CD2-CD2 3.43Å; H107-W246 AromaticContact CD2-CE2 3.33Å; H107-W246 AromaticContact CD2-CG 3.58Å; H107-W246 AromaticContact CD2-CZ2 3.91Å; H107-W246 AromaticContact CD2-NE1 3.37Å; H107-W246 PolarHBondContact CD2-NE1 3.09Å; H107-W246 AromaticContact CE1-CD1 3.74Å; H107-W246 AromaticContact CE1-CE2 3.87Å; H107-W246 AromaticContact CE1-NE1 3.28Å; H107-W246 PolarHBondContact CE1-NE1 3.27Å; H107-W246 VanDerWaalsContact CE1-NE1 3.28Å; H107-W246 AromaticContact CG-CD1 3.25Å; H107-W246 AromaticContact CG-CD2 3.89Å; H107-W246 AromaticContact CG-CE2 3.93Å; H107-W246 AromaticContact CG-CG 3.5Å; H107-W246 VanDerWaalsContact CG-CG 3.5Å; H107-W246 AromaticContact CG-NE1 3.52Å; H107-W246 AromaticContact ND1-CD1 3.41Å; H107-W246 AromaticContact ND1-NE1 3.48Å; H107-W246 PolarHBondContact ND1-NE1 3.26Å; H107-W246 AromaticContact NE2-CD1 3.82Å; H107-W246 AromaticContact NE2-CD2 3.92Å; H107-W246 AromaticContact NE2-CE2 3.28Å; H107-W246 VanDerWaalsContact NE2-CE2 3.28Å; H107-W246 AromaticContact NE2-CZ2 3.56Å; H107-W246 AromaticContact NE2-NE1 3.2Å; H107-W246 PolarHBondContact NE2-NE1 3.29Å
108	F	89.3	Confident	85.4	Confident	112 Å²	112	52.2 Å²	52.2	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-80.8	-18.4	179.5	-58.9	-70.5	0	0	0	113.9	L105 P106 W246 L250	L105-F108 PolarHBondContact O-N 3.35Å; P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 PolarHBondContact O-N 3.31Å; F108-W246 HydrophobicContact CE1-CZ3 4.4Å; F108-W246 HydrophobicContact CE2-CE3 4.31Å; F108-W246 AromaticContact CZ-CE3 3.78Å; F108-W246 HydrophobicContact CZ-CE3 3.78Å; F108-W246 AromaticContact CZ-CZ3 3.82Å; F108-W246 HydrophobicContact CZ-CZ3 3.82Å; F108-L250 HydrophobicContact CE2-CD1 4.19Å; F108-L250 HydrophobicContact CZ-CD1 3.92Å
109	L	86.9	Confident	83.5	Confident	85 Å²	85	48.9 Å²	48.9	45%	0.445	24%	0.24	S	C	.	.	H	α-helix	trans	-97.9	-22.2	-179.3	-63.1	179.9	0	0	0	112.6	L105 P106 M157 Y160	L105-L109 HydrophobicContact CD2-CD1 3.97Å; L105-L109 HydrophobicContact CG-CD1 3.78Å; L105-L109 HydrophobicContact CG-CG 4.12Å; L105-L109 PolarHBondContact O-N 3.19Å; P106-L109 PolarHBondContact O-N 3.46Å; P106-L109 VanDerWaalsContact O-N 3.14Å; L109-M157 HydrophobicContact CB-CE 3.94Å; L109-M157 HydrophobicContact CB-SD 4.27Å; L109-M157 HydrophobicContact CD1-SD 4.29Å; L109-Y160 HydrophobicContact CD1-CE2 4.32Å
110	M	82.4	Confident	81.3	Confident	45 Å²	45	52.4 Å²	52.4	22%	0.222	26%	0.264	C	S	.	.	S	Bend	trans	-87	154.1	179.8	-69.5	172.5	73	0	0	110.9	F51 P106 M157	F51-M110 HydrophobicContact CD1-CE 4.21Å; F51-M110 HydrophobicContact CD1-SD 4.34Å; F51-M110 HydrophobicContact CE1-CE 3.95Å; F51-M110 HydrophobicContact CE1-SD 3.51Å; F51-M110 VanDerWaalsContact CE1-SD 3.51Å; F51-M110 HydrophobicContact CZ-SD 4.21Å; P106-M110 HydrophobicContact CB-SD 3.98Å; P106-M110 VanDerWaalsContact O-CB 3.25Å; P106-M110 WeakPolarHBondContact O-CB 3.4Å; P106-M110 WeakPolarHBondContact O-CG 3.21Å; P106-M110 PolarHBondContact O-N 2.96Å; M110-M157 HydrophobicContact CG-CB 4.31Å; M110-M157 HydrophobicContact CG-CG 3.91Å; M110-M157 HydrophobicContact SD-CB 3.92Å; M110-M157 HydrophobicContact SD-CG 4.18Å
111	N	77.4	Confident	79	Confident	153 Å²	153	56.9 Å²	56.9	82%	0.818	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-70.4	170.4	166.4	-62.5	-37.6	0	0	0	110.1
112	Q	81.1	Confident	76.2	Confident	121 Å²	121	57.8 Å²	57.8	57%	0.565	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-48.5	140.4	175.1	-68.7	176.7	-28.4	0	0	111.5	E114	Q112-E114 PolarHBondContact O-N 3.48Å; Q112-E114 VanDerWaalsContact O-N 3.16Å
113	Y	82.8	Confident	73.2	Confident	25 Å²	25	59 Å²	59	10%	0.098	33%	0.331	C	S	.	.			trans	-67.9	110	176.9	175.6	-114.2	0	0	0	109.8	Y115 Y221 V222 D223 R240 V242	Y113-Y115 HydrophobicContact CE1-CD1 4.44Å; Y113-Y221 HydrophobicContact CD1-CE2 4.38Å; Y113-Y221 WeakPolarHBondContact CD1-OH 3.13Å; Y113-V222 HydrophobicContact CD1-CG1 3.82Å; Y113-V222 HydrophobicContact CG-CG1 3.98Å; Y113-D223 WeakPolarHBondContact CB-OD2 3.08Å; Y113-D223 PolarHBondContact N-OD2 3.25Å; Y113-R240 WeakPolarHBondContact CE1-O 3.5Å; Y113-R240 PolarHBondContact OH-O 3.27Å; Y113-V242 HydrophobicContact CD1-CB 4.34Å; Y113-V242 HydrophobicContact CD1-CG2 4.3Å; Y113-V242 HydrophobicContact CE1-CB 4.02Å; Y113-V242 HydrophobicContact CE1-CG2 3.6Å; Y113-V242 HydrophobicContact CE2-CG2 3.91Å; Y113-V242 WeakPolarHBondContact OH-CG2 2.91Å
114	E	74.8	Confident	70.1	Confident	131 Å²	131	66.2 Å²	66.2	61%	0.612	37%	0.37	S	S	*	.			trans	-92.1	120.8	171.2	-67	-178.9	171	0	0	109.2	Q112 K582	Q112-E114 PolarHBondContact O-N 3.48Å; Q112-E114 VanDerWaalsContact O-N 3.16Å; E114-K582 WeakPolarHBondContact OE2-CE 3.49Å; E114-K582 IonicContact OE2-NZ 3.7Å; E114-K582 PolarHBondContact OE2-NZ 3.02Å
115	Y	75	Confident	67.4	Low	40 Å²	40	75.4 Å²	75.4	16%	0.157	42%	0.418	C	S	.	.			trans	-100.8	154.8	170.7	61.9	-87.8	0	0	0	110.9	Y113 S117 L232 T233 I234	Y113-Y115 HydrophobicContact CE1-CD1 4.44Å; Y115-S117 PolarHBondContact O-N 3.49Å; Y115-L232 HydrophobicContact CE1-CD2 4.25Å; Y115-T233 PolarHBondContact OH-OG1 3.4Å; Y115-I234 HydrophobicContact CD1-CD1 4Å; Y115-I234 HydrophobicContact CD2-CD1 4.28Å; Y115-I234 HydrophobicContact CD2-CG2 4.21Å; Y115-I234 HydrophobicContact CE1-CD1 3.88Å; Y115-I234 HydrophobicContact CE1-CG1 4.39Å; Y115-I234 HydrophobicContact CE2-CD1 4.15Å; Y115-I234 HydrophobicContact CE2-CG1 4.34Å; Y115-I234 HydrophobicContact CE2-CG2 3.74Å; Y115-I234 HydrophobicContact CG-CD1 4.21Å
116	E	67.2	Low	64.8	Low	36 Å²	36	78.5 Å²	78.5	17%	0.168	44%	0.443	C	S	.	.			trans	-61.1	109.3	171.7	-69.6	171.2	-128.5	0	0	108.8	R240 W450 T580 R590	E116-R240 VanDerWaalsContact O-CD 3.24Å; E116-R240 WeakPolarHBondContact O-CD 3.43Å; E116-R240 PolarHBondContact O-NH1 3.29Å; E116-W450 PolarHBondContact OE2-N 3.22Å; E116-T580 PolarHBondContact OE1-N 2.84Å; E116-R590 IonicContact OE1-CZ 3.99Å; E116-R590 IonicContact OE1-NE 2.74Å; E116-R590 IonicContact OE1-NH2 3.68Å; E116-R590 PolarHBondContact OE1-NH2 2.99Å
117	S	65.7	Low	62.5	Low	36 Å²	36	80.7 Å²	80.7	25%	0.252	46%	0.459	S	S	.	.			trans	-132.5	134.9	174.8	-177	0	0	0	0	108.3	Y115 V119	Y115-S117 PolarHBondContact O-N 3.49Å; S117-V119 VanDerWaalsContact C-N 3.34Å; S117-V119 PolarHBondContact OG-N 3.03Å; S117-V119 PolarHBondContact OG-O 3.4Å; S117-V119 VanDerWaalsContact OG-O 3.07Å
118	T	58.3	Low	60.9	Low	18 Å²	18	82.8 Å²	82.8	11%	0.11	47%	0.471	C	S	.	.	S	Bend	trans	-79.8	-25.4	171	61.9	0	0	0	0	110.7	S120 F130 I449 D451	T118-S120 PolarHBondContact O-N 3.35Å; T118-F130 VanDerWaalsContact CB-CB 3.4Å; T118-F130 VanDerWaalsContact O-CB 3.22Å; T118-F130 WeakPolarHBondContact O-CB 3.23Å; T118-F130 WeakPolarHBondContact OG1-CB 3.46Å; T118-I449 HydrophobicContact CG2-CB 4.43Å; T118-I449 HydrophobicContact CG2-CD1 3.47Å; T118-I449 VanDerWaalsContact CG2-CD1 3.47Å; T118-I449 HydrophobicContact CG2-CG1 3.82Å; T118-I449 HydrophobicContact CG2-CG2 3.78Å; T118-D451 WeakPolarHBondContact CB-OD2 3.4Å; T118-D451 HydrophobicContact CG2-CB 3.97Å; T118-D451 PolarHBondContact N-OD2 2.84Å; T118-D451 PolarHBondContact OG1-OD2 3.08Å
119	V	58.5	Low	59.3	Low	21 Å²	21	81.1 Å²	81.1	13%	0.127	47%	0.473	C	S	.	.	S	Bend	trans	-84.6	112.4	179.9	-173.8	0	0	0	0	110.2	S117 F130 T233 M479	S117-V119 VanDerWaalsContact C-N 3.34Å; S117-V119 PolarHBondContact OG-N 3.03Å; S117-V119 PolarHBondContact OG-O 3.4Å; S117-V119 VanDerWaalsContact OG-O 3.07Å; V119-F130 HydrophobicContact CG2-CD2 3.99Å; V119-F130 HydrophobicContact CG2-CE2 4.17Å; V119-F130 HydrophobicContact CG2-CG 4.39Å; V119-T233 HydrophobicContact CB-CG2 4.42Å; V119-T233 HydrophobicContact CG1-CG2 4.41Å; V119-M479 HydrophobicContact CG1-CE 4.24Å; V119-M479 HydrophobicContact CG1-SD 4.28Å; V119-M479 HydrophobicContact CG2-CE 4.11Å; V119-M479 HydrophobicContact CG2-SD 4.13Å
120	S	51.4	Low	58.5	Low	74 Å²	74	78.1 Å²	78.1	52%	0.517	46%	0.456	S	S	.	.			trans	-82.7	113.5	175.4	59	0	0	0	0	111.3	T118	T118-S120 PolarHBondContact O-N 3.35Å
121	V	49.4	Very low	58.4	Low	94 Å²	94	76.2 Å²	76.2	57%	0.57	45%	0.447	S	S	*	.			trans	-82.5	-15.4	177.5	-178.9	0	0	0	0	112.4	D231	V121-D231 HydrophobicContact CG1-CB 4.21Å
122	S	38.7	Very low	58.5	Low	112 Å²	112	70 Å²	70	78%	0.783	42%	0.415	S	S	*	.	S	Bend	trans	-117.3	111.1	-179.9	55.7	0	0	0	0	113.3
123	G	33.3	Very low	58.3	Low	65 Å²	65	68 Å²	68	67%	0.67	41%	0.407	S	S	*	.	S	Bend	trans	106.4	107	158.7	0	0	0	0	0	116.3
124	N	31.2	Very low	57.5	Low	152 Å²	152	74 Å²	74	81%	0.813	44%	0.436	S	S	*	.			trans	48.4	119.5	164.1	-75.5	-13.6	0	0	0	118.6	S126	N124-S126 PolarHBondContact O-N 3.31Å
125	L	38.4	Very low	56.7	Low	192 Å²	192	75.4 Å²	75.4	100%	1.005	45%	0.448	S	S	*	.	S	Bend	trans	-51.7	38.3	174.6	-105.2	102.6	0	0	0	117.7
126	S	38	Very low	55.7	Low	105 Å²	105	75 Å²	75	73%	0.734	46%	0.455	S	S	*	.			trans	-122.5	5.2	-172.3	74.8	0	0	0	0	117.1	N124	N124-S126 PolarHBondContact O-N 3.31Å
127	S	44.6	Very low	54.9	Low	46 Å²	46	79 Å²	79	32%	0.322	48%	0.482	S	S	.	.			trans	-140.6	89.4	177.8	37.2	0	0	0	0	112.5	S129	S127-S129 PolarHBondContact O-N 3.3Å
128	N	53.8	Low	54	Low	76 Å²	76	82.5 Å²	82.5	41%	0.406	50%	0.495	S	S	.	.			trans	-67.9	38.3	166.5	-70.3	-11.2	0	0	0	112.1	F130 L131 M133	N128-F130 PolarHBondContact O-N 3.15Å; N128-F130 VanDerWaalsContact O-N 3.09Å; N128-L131 HydrophobicContact CB-CD1 4.31Å; N128-L131 PolarHBondContact O-N 2.89Å; N128-L131 VanDerWaalsContact O-N 3.16Å; N128-M133 HydrophobicContact CB-CE 3.81Å; N128-M133 HydrophobicContact CB-CG 4.38Å; N128-M133 HydrophobicContact CB-SD 3.74Å
129	S	56	Low	53.3	Low	77 Å²	77	88 Å²	88	54%	0.538	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-4.9	-175	59.5	0	0	0	0	114	S127	S127-S129 PolarHBondContact O-N 3.3Å
130	F	69.9	Low	52.4	Low	21 Å²	21	92.7 Å²	92.7	9%	0.092	55%	0.546	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-10.2	176.3	61.7	-89.1	0	0	0	114.3	T118 V119 N128 C465 M479 F481	T118-F130 VanDerWaalsContact CB-CB 3.4Å; T118-F130 VanDerWaalsContact O-CB 3.22Å; T118-F130 WeakPolarHBondContact O-CB 3.23Å; T118-F130 WeakPolarHBondContact OG1-CB 3.46Å; V119-F130 HydrophobicContact CG2-CD2 3.99Å; V119-F130 HydrophobicContact CG2-CE2 4.17Å; V119-F130 HydrophobicContact CG2-CG 4.39Å; N128-F130 PolarHBondContact O-N 3.15Å; N128-F130 VanDerWaalsContact O-N 3.09Å; F130-C465 WeakPolarHBondContact O-CB 3.41Å; F130-C465 PolarHBondContact O-N 3.11Å; F130-M479 HydrophobicContact CE2-CE 3.82Å; F130-M479 HydrophobicContact CZ-CE 4.27Å; F130-F481 HydrophobicContact CD2-CE1 4.3Å; F130-F481 HydrophobicContact CE2-CE1 4.2Å
131	L	80.3	Confident	51.8	Low	6 Å²	6	99.3 Å²	99.3	3%	0.031	56%	0.559	C	S	.	*	S	Bend	trans	-100.5	159.7	174.2	-63.8	170	0	0	0	108.5	N128 M133 C469 E470 F481	N128-L131 HydrophobicContact CB-CD1 4.31Å; N128-L131 PolarHBondContact O-N 2.89Å; N128-L131 VanDerWaalsContact O-N 3.16Å; L131-M133 PolarHBondContact O-N 3.41Å; L131-C469 WeakPolarHBondContact CA-O 3.11Å; L131-C469 WeakPolarHBondContact CB-O 3.3Å; L131-C469 HydrophobicContact CD2-CB 4.39Å; L131-E470 WeakPolarHBondContact CD1-O 3.28Å; L131-F481 HydrophobicContact CD2-CD1 3.72Å; L131-F481 HydrophobicContact CD2-CE1 4.03Å
132	C	81.2	Confident	51.2	Low	22 Å²	22	100.5 Å²	100.5	15%	0.149	57%	0.569	C	S	.	*			trans	-67.8	115.7	172.2	172	0	0	0	0	109.7	C443 C469	C132-C443 HydrophobicContact CB-CB 3.69Å; C132-C443 WeakPolarHBondContact CB-SG 3.3Å; C132-C443 WeakPolarHBondContact SG-CB 3.19Å; C132-C443 CovalentContact SG-SG 2Å; C132-C443 PolarHBondContact SG-SG 3.2Å; C132-C469 PolarHBondContact N-O 3.44Å
133	M	77	Confident	51.3	Low	79 Å²	79	101.2 Å²	101.2	39%	0.389	57%	0.569	S	S	.	*			trans	-132.8	125.5	172	-65.1	-144.8	-58.4	0	0	110.8	N128 L131 N135 G136	N128-M133 HydrophobicContact CB-CE 3.81Å; N128-M133 HydrophobicContact CB-CG 4.38Å; N128-M133 HydrophobicContact CB-SD 3.74Å; L131-M133 PolarHBondContact O-N 3.41Å; M133-N135 PolarHBondContact O-N 3.2Å; M133-G136 PolarHBondContact O-N 3.25Å
134	E	64.2	Low	51.9	Low	150 Å²	150	103 Å²	103	70%	0.701	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	4.6	-171.8	-138.8	177.9	165.9	0	0	115.2	D442	E134-D442 WeakPolarHBondContact CA-O 3.48Å; E134-D442 HydrophobicContact CG-CB 3.85Å
135	N	58.6	Low	52.8	Low	162 Å²	162	100.6 Å²	100.6	87%	0.866	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.7	26.3	-179.7	-88.4	-46.8	0	0	0	113.3	M133 T137	M133-N135 PolarHBondContact O-N 3.2Å; N135-T137 PolarHBondContact O-N 3.36Å
136	G	54.2	Low	53.6	Low	30 Å²	30	95.7 Å²	95.7	31%	0.309	53%	0.526	S	S	.	.			trans	-66.6	125.1	178.9	0	0	0	0	0	112.7	M133	M133-G136 PolarHBondContact O-N 3.25Å
137	T	49.8	Very low	54.5	Low	120 Å²	120	94.2 Å²	94.2	74%	0.736	52%	0.516	S	S	*	.			trans	-75	124.5	166.6	39.7	0	0	0	0	108.9	N135 I139	N135-T137 PolarHBondContact O-N 3.36Å; T137-I139 PolarHBondContact O-N 3.49Å
138	Q	46.4	Very low	54.9	Low	111 Å²	111	97.8 Å²	97.8	52%	0.519	53%	0.528	S	S	.	.			trans	-64.2	106.9	170.1	-76.5	-168	4.2	0	0	108.5	L140 N444	Q138-L140 PolarHBondContact O-N 3.44Å; Q138-N444 PolarHBondContact NE2-OD1 2.85Å
139	I	44.9	Very low	55.1	Low	132 Å²	132	94.6 Å²	94.6	68%	0.677	51%	0.511	S	S	*	.			trans	-76.8	79.1	163.9	-54.4	176.5	0	0	0	106.5	T137 R141	T137-I139 PolarHBondContact O-N 3.49Å; I139-R141 PolarHBondContact O-N 2.86Å
140	L	39.9	Very low	54.8	Low	121 Å²	121	93 Å²	93	63%	0.634	50%	0.499	S	S	*	.			trans	-60.9	106.9	158.7	-114.8	-77.9	0	0	0	105.8	Q138	Q138-L140 PolarHBondContact O-N 3.44Å
141	R	38.8	Very low	53.8	Low	213 Å²	213	100.2 Å²	100.2	80%	0.804	53%	0.53	S	S	*	.			trans	-53.9	129.9	163	-81.9	-177.7	173.3	167.6	-2	106.3	I139 T143	I139-R141 PolarHBondContact O-N 2.86Å; R141-T143 PolarHBondContact O-N 2.96Å
142	P	36.5	Very low	52.4	Low	118 Å²	118	106 Å²	106	77%	0.766	56%	0.557	S	S	*	*			trans	-54.7	132.9	-172.8	-19.5	29	0	0	0	109.2	Q144	P142-Q144 VanDerWaalsContact C-N 3.34Å; P142-Q144 PolarHBondContact O-N 3.3Å
143	T	40.2	Very low	50.9	Low	128 Å²	128	106.7 Å²	106.7	79%	0.785	56%	0.56	S	S	*	*			trans	-50.2	100	166.9	-8.8	0	0	0	0	107.6	R141	R141-T143 PolarHBondContact O-N 2.96Å
144	Q	45.5	Very low	49.7	Very low	101 Å²	101	109.1 Å²	109.1	47%	0.472	57%	0.569	S	S	.	*			trans	-52.9	141.2	156.6	-95.4	168.9	-41.5	0	0	106.7	P142 C149 E152	P142-Q144 VanDerWaalsContact C-N 3.34Å; P142-Q144 PolarHBondContact O-N 3.3Å; Q144-C149 HydrophobicContact CB-CB 4.29Å; Q144-E152 PolarHBondContact NE2-OE2 3.35Å; Q144-E152 PolarHBondContact OE1-OE2 2.9Å
145	D	50.6	Low	49.6	Very low	102 Å²	102	104 Å²	104	55%	0.545	55%	0.549	S	S	.	.			trans	-42.5	124.2	177	-149.1	-28	0	0	0	109.2	S147 E148 C149	D145-S147 PolarHBondContact O-N 3.05Å; D145-E148 HydrophobicContact CB-CB 4.22Å; D145-E148 PolarHBondContact O-N 2.86Å; D145-C149 PolarHBondContact O-N 3.12Å
146	P	56.3	Low	50.4	Low	89 Å²	89	101.6 Å²	101.6	58%	0.578	54%	0.536	S	S	*	.	H	α-helix	trans	-53.4	-30.6	-171.7	-27.3	32.9	0	0	0	112.9	T150	P146-T150 WeakPolarHBondContact O-CB 3.34Å; P146-T150 PolarHBondContact O-N 3.4Å; P146-T150 PolarHBondContact O-OG1 3.28Å
147	S	55.4	Low	52	Low	74 Å²	74	102.3 Å²	102.3	52%	0.517	53%	0.532	S	S	.	.	H	α-helix	trans	-72.9	-29	178.3	70.9	0	0	0	0	114.3	D145	D145-S147 PolarHBondContact O-N 3.05Å
148	E	53.8	Low	53.8	Low	122 Å²	122	98.5 Å²	98.5	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-86.9	-39.8	177.9	-142.8	168.8	-151.3	0	0	110.3	D145 T150 K151 E152	D145-E148 HydrophobicContact CB-CB 4.22Å; D145-E148 PolarHBondContact O-N 2.86Å; E148-T150 VanDerWaalsContact C-N 3.33Å; E148-T150 PolarHBondContact O-N 3.49Å; E148-K151 WeakPolarHBondContact O-CB 3.42Å; E148-K151 PolarHBondContact O-N 2.81Å; E148-K151 VanDerWaalsContact O-N 3.12Å; E148-E152 PolarHBondContact O-N 3.25Å; E148-E152 VanDerWaalsContact O-N 3.08Å
149	C	56.8	Low	56	Low	8 Å²	8	96.7 Å²	96.7	5%	0.054	50%	0.496	C	S	.	.	H	α-helix	trans	-57	-44.2	170	-173	0	0	0	0	111.6	Q144 D145 K151 E152 V153 C583	Q144-C149 HydrophobicContact CB-CB 4.29Å; D145-C149 PolarHBondContact O-N 3.12Å; C149-K151 VanDerWaalsContact C-N 3.27Å; C149-K151 PolarHBondContact O-N 3.5Å; C149-E152 PolarHBondContact O-N 3.45Å; C149-E152 VanDerWaalsContact O-N 3.17Å; C149-V153 WeakPolarHBondContact O-CB 3.18Å; C149-V153 VanDerWaalsContact O-CG2 3.26Å; C149-V153 WeakPolarHBondContact O-CG2 3.34Å; C149-V153 PolarHBondContact O-N 3.38Å; C149-C583 HydrophobicContact CB-CB 4.15Å; C149-C583 WeakPolarHBondContact CB-SG 3.39Å; C149-C583 PolarHBondContact O-SG 2.9Å; C149-C583 WeakPolarHBondContact SG-CA 3.26Å; C149-C583 WeakPolarHBondContact SG-CB 3.18Å; C149-C583 CovalentContact SG-SG 2.04Å; C149-C583 PolarHBondContact SG-SG 3.01Å
150	T	50.2	Low	58.3	Low	45 Å²	45	94.9 Å²	94.9	28%	0.276	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-30.5	178.9	-52	0	0	0	0	112.4	P146 E148 K154	P146-T150 WeakPolarHBondContact O-CB 3.34Å; P146-T150 PolarHBondContact O-N 3.4Å; P146-T150 PolarHBondContact O-OG1 3.28Å; E148-T150 VanDerWaalsContact C-N 3.33Å; E148-T150 PolarHBondContact O-N 3.49Å; T150-K154 HydrophobicContact CG2-CD 4.07Å; T150-K154 HydrophobicContact CG2-CG 4.39Å; T150-K154 WeakPolarHBondContact O-CB 3.37Å; T150-K154 PolarHBondContact O-N 2.81Å
151	K	49.9	Very low	60.9	Low	172 Å²	172	89.1 Å²	89.1	75%	0.748	45%	0.451	S	S	*	.	H	α-helix	trans	-74.8	-33.8	175.4	-73.8	175.4	-178.1	172.6	0	112.2	E148 C149	E148-K151 WeakPolarHBondContact O-CB 3.42Å; E148-K151 PolarHBondContact O-N 2.81Å; E148-K151 VanDerWaalsContact O-N 3.12Å; C149-K151 VanDerWaalsContact C-N 3.27Å; C149-K151 PolarHBondContact O-N 3.5Å
152	E	50.7	Low	63.6	Low	128 Å²	128	79.8 Å²	79.8	60%	0.598	42%	0.417	S	S	*	.	H	α-helix	trans	-75.7	-33.2	177	-155.8	171.4	179.2	0	0	111.9	Q144 E148 C149	Q144-E152 PolarHBondContact NE2-OE2 3.35Å; Q144-E152 PolarHBondContact OE1-OE2 2.9Å; E148-E152 PolarHBondContact O-N 3.25Å; E148-E152 VanDerWaalsContact O-N 3.08Å; C149-E152 PolarHBondContact O-N 3.45Å; C149-E152 VanDerWaalsContact O-N 3.17Å
153	V	50	Low	66.5	Low	36 Å²	36	77.6 Å²	77.6	22%	0.218	40%	0.402	C	S	.	.	H	α-helix	trans	-90.4	-28.9	-175.9	175.5	0	0	0	0	113.9	C149 S155 L581 K582 C583	C149-V153 WeakPolarHBondContact O-CB 3.18Å; C149-V153 VanDerWaalsContact O-CG2 3.26Å; C149-V153 WeakPolarHBondContact O-CG2 3.34Å; C149-V153 PolarHBondContact O-N 3.38Å; V153-S155 PolarHBondContact O-N 3.47Å; V153-L581 HydrophobicContact CG1-CB 3.94Å; V153-L581 HydrophobicContact CG1-CD1 4.21Å; V153-L581 HydrophobicContact CG1-CD2 3.72Å; V153-L581 HydrophobicContact CG1-CG 4.17Å; V153-K582 HydrophobicContact CG2-CB 3.92Å; V153-C583 WeakPolarHBondContact CG2-SG 3.39Å
154	K	51.8	Low	69.2	Low	130 Å²	130	71.5 Å²	71.5	57%	0.565	36%	0.364	S	S	*	.			trans	-78.9	63.6	169.3	-74.2	-176.1	-179.3	172.6	0	110.9	T150 L156	T150-K154 HydrophobicContact CG2-CD 4.07Å; T150-K154 HydrophobicContact CG2-CG 4.39Å; T150-K154 WeakPolarHBondContact O-CB 3.37Å; T150-K154 PolarHBondContact O-N 2.81Å; K154-L156 VanDerWaalsContact C-N 3.32Å; K154-L156 PolarHBondContact O-N 2.84Å
155	S	62.2	Low	71.6	Confident	42 Å²	42	66.8 Å²	66.8	29%	0.294	34%	0.342	S	S	.	.			trans	-60.5	98.7	163.9	-176.8	0	0	0	0	108	V153 M157	V153-S155 PolarHBondContact O-N 3.47Å; S155-M157 PolarHBondContact O-N 3.48Å; S155-M157 VanDerWaalsContact OG-CB 3.31Å; S155-M157 WeakPolarHBondContact OG-CB 3.4Å; S155-M157 WeakPolarHBondContact OG-CG 3.45Å
156	L	75.4	Confident	73.8	Confident	111 Å²	111	63.7 Å²	63.7	58%	0.581	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	11.3	173.3	-67.9	173.5	0	0	0	111.9	K154 W158 M159	K154-L156 VanDerWaalsContact C-N 3.32Å; K154-L156 PolarHBondContact O-N 2.84Å; L156-W158 PolarHBondContact O-N 3.31Å; L156-M159 HydrophobicContact CB-CG 4.3Å; L156-M159 HydrophobicContact CD2-CE 4.35Å; L156-M159 WeakPolarHBondContact O-CB 3.47Å; L156-M159 VanDerWaalsContact O-CG 3.25Å; L156-M159 WeakPolarHBondContact O-CG 3.3Å; L156-M159 PolarHBondContact O-N 2.9Å
157	M	86.2	Confident	75.8	Confident	46 Å²	46	60.7 Å²	60.7	23%	0.227	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-26.6	-176.3	-67.3	-65.6	-173.7	0	0	113	F51 P106 L109 M110 S155 M159 Y160	F51-M157 HydrophobicContact CE1-CB 3.76Å; P106-M157 HydrophobicContact CB-CB 4.18Å; P106-M157 WeakPolarHBondContact CG-O 3.28Å; L109-M157 HydrophobicContact CB-CE 3.94Å; L109-M157 HydrophobicContact CB-SD 4.27Å; L109-M157 HydrophobicContact CD1-SD 4.29Å; M110-M157 HydrophobicContact CG-CB 4.31Å; M110-M157 HydrophobicContact CG-CG 3.91Å; M110-M157 HydrophobicContact SD-CB 3.92Å; M110-M157 HydrophobicContact SD-CG 4.18Å; S155-M157 PolarHBondContact O-N 3.48Å; S155-M157 VanDerWaalsContact OG-CB 3.31Å; S155-M157 WeakPolarHBondContact OG-CB 3.4Å; S155-M157 WeakPolarHBondContact OG-CG 3.45Å; M157-M159 PolarHBondContact O-N 3.2Å; M157-M159 VanDerWaalsContact O-N 3.15Å; M157-Y160 WeakPolarHBondContact O-CB 3.18Å; M157-Y160 PolarHBondContact O-N 2.93Å; M157-Y160 HydrophobicContact SD-CD2 3.94Å; M157-Y160 HydrophobicContact SD-CE2 3.63Å
158	W	88.9	Confident	77.7	Confident	39 Å²	39	57.7 Å²	57.7	15%	0.148	28%	0.282	C	S	.	.	H	α-helix	trans	-60.6	-21.1	170.5	65.4	-96.7	0	0	0	112.7	F51 L57 I61 L156 Y160 V161 L162	F51-W158 HydrophobicContact CB-CB 4.34Å; F51-W158 HydrophobicContact CD1-CB 4.09Å; F51-W158 HydrophobicContact CD2-CB 3.92Å; F51-W158 HydrophobicContact CE1-CB 4.39Å; F51-W158 HydrophobicContact CE2-CB 4.26Å; F51-W158 HydrophobicContact CG-CB 3.85Å; F51-W158 HydrophobicContact CZ-CB 4.48Å; L57-W158 HydrophobicContact CD1-CH2 3.82Å; L57-W158 HydrophobicContact CD1-CZ2 4.47Å; L57-W158 HydrophobicContact CD1-CZ3 3.89Å; L57-W158 HydrophobicContact CD2-CD2 4.31Å; L57-W158 HydrophobicContact CD2-CE3 4.44Å; L57-W158 HydrophobicContact CD2-CH2 4.15Å; L57-W158 HydrophobicContact CD2-CZ2 4.01Å; L57-W158 HydrophobicContact CD2-CZ3 4.36Å; L57-W158 HydrophobicContact CG-CH2 4.47Å; L57-W158 HydrophobicContact CG-CZ3 4.38Å; I61-W158 HydrophobicContact CD1-CB 4.46Å; I61-W158 HydrophobicContact CD1-CE3 4.02Å; I61-W158 HydrophobicContact CG1-CE3 4.26Å; L156-W158 PolarHBondContact O-N 3.31Å; W158-Y160 VanDerWaalsContact C-N 3.28Å; W158-Y160 PolarHBondContact O-N 3.43Å; W158-V161 WeakPolarHBondContact O-CB 3.38Å; W158-V161 PolarHBondContact O-N 3.2Å; W158-V161 VanDerWaalsContact O-N 3.12Å; W158-L162 HydrophobicContact CZ3-CD1 3.88Å; W158-L162 PolarHBondContact O-N 2.9Å
159	M	91.8	Very high	79.7	Confident	73 Å²	73	51.9 Å²	51.9	36%	0.36	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-30.4	172.7	-65.3	-69.1	-168.3	0	0	112.3	L156 M157 V161 L162 V163	L156-M159 HydrophobicContact CB-CG 4.3Å; L156-M159 HydrophobicContact CD2-CE 4.35Å; L156-M159 WeakPolarHBondContact O-CB 3.47Å; L156-M159 VanDerWaalsContact O-CG 3.25Å; L156-M159 WeakPolarHBondContact O-CG 3.3Å; L156-M159 PolarHBondContact O-N 2.9Å; M157-M159 PolarHBondContact O-N 3.2Å; M157-M159 VanDerWaalsContact O-N 3.15Å; M159-V161 VanDerWaalsContact C-N 3.29Å; M159-V161 PolarHBondContact O-N 3.02Å; M159-L162 WeakPolarHBondContact O-CB 3.36Å; M159-L162 PolarHBondContact O-N 3.4Å; M159-V163 WeakPolarHBondContact O-CB 3.11Å; M159-V163 VanDerWaalsContact O-CG2 3.28Å; M159-V163 WeakPolarHBondContact O-CG2 3.39Å; M159-V163 PolarHBondContact O-N 3.18Å
160	Y	93.4	Very high	81.5	Confident	94 Å²	94	54.3 Å²	54.3	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-37.7	173.1	-74.3	-89.4	0	0	0	111.2	L105 P106 L109 M157 W158 L162 G164	L105-Y160 HydrophobicContact CD2-CD1 3.85Å; L105-Y160 HydrophobicContact CD2-CE1 3.7Å; P106-Y160 HydrophobicContact CG-CG 4.42Å; L109-Y160 HydrophobicContact CD1-CE2 4.32Å; M157-Y160 WeakPolarHBondContact O-CB 3.18Å; M157-Y160 PolarHBondContact O-N 2.93Å; M157-Y160 HydrophobicContact SD-CD2 3.94Å; M157-Y160 HydrophobicContact SD-CE2 3.63Å; W158-Y160 VanDerWaalsContact C-N 3.28Å; W158-Y160 PolarHBondContact O-N 3.43Å; Y160-L162 VanDerWaalsContact C-N 3.35Å; Y160-G164 WeakPolarHBondContact O-CA 3.4Å; Y160-G164 PolarHBondContact O-N 3.2Å
161	V	95.2	Very high	83.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-44.8	174.5	-174.9	0	0	0	0	110	M40 I47 F51 I61 K103 P106 W158 M159 G164 N165 W245	M40-V161 HydrophobicContact CE-CG1 4.02Å; I47-V161 HydrophobicContact CD1-CG1 4.05Å; F51-V161 HydrophobicContact CE2-CG2 3.97Å; F51-V161 HydrophobicContact CZ-CG2 4.26Å; I61-V161 HydrophobicContact CG2-CG1 3.81Å; K103-V161 HydrophobicContact CD-CG1 4.39Å; K103-V161 HydrophobicContact CG-CG1 4.31Å; P106-V161 HydrophobicContact CG-CG2 4.2Å; W158-V161 WeakPolarHBondContact O-CB 3.38Å; W158-V161 PolarHBondContact O-N 3.2Å; W158-V161 VanDerWaalsContact O-N 3.12Å; M159-V161 VanDerWaalsContact C-N 3.29Å; M159-V161 PolarHBondContact O-N 3.02Å; V161-G164 PolarHBondContact O-N 3.04Å; V161-N165 WeakPolarHBondContact O-CB 3.28Å; V161-N165 PolarHBondContact O-N 3.24Å; V161-W245 HydrophobicContact CG2-CH2 4.35Å; V161-W245 HydrophobicContact CG2-CZ3 4.38Å
162	L	95.7	Very high	85.7	Confident	18 Å²	18	45.2 Å²	45.2	9%	0.094	22%	0.224	C	C	.	.	H	α-helix	trans	-60.1	-51.9	176.8	-178.7	145.7	0	0	0	112.4	F60 I61 S64 W158 M159 Y160 N165 I166	F60-L162 HydrophobicContact CD1-CD1 3.69Å; F60-L162 HydrophobicContact CE1-CD1 3.35Å; F60-L162 HydrophobicContact CZ-CD1 4.21Å; I61-L162 HydrophobicContact CG1-CB 4.42Å; S64-L162 PolarHBondContact OG-O 3.22Å; W158-L162 HydrophobicContact CZ3-CD1 3.88Å; W158-L162 PolarHBondContact O-N 2.9Å; M159-L162 WeakPolarHBondContact O-CB 3.36Å; M159-L162 PolarHBondContact O-N 3.4Å; Y160-L162 VanDerWaalsContact C-N 3.35Å; L162-N165 PolarHBondContact O-N 2.97Å; L162-I166 HydrophobicContact CD2-CD1 3.65Å; L162-I166 WeakPolarHBondContact O-CG1 3.28Å; L162-I166 PolarHBondContact O-N 2.61Å
163	V	96.4	Very high	87.5	Confident	72 Å²	72	39.3 Å²	39.3	44%	0.436	20%	0.196	S	C	.	.	H	α-helix	trans	-64.2	-44.1	179.7	171	0	0	0	0	110.3	M159 N165 I166 V167	M159-V163 WeakPolarHBondContact O-CB 3.11Å; M159-V163 VanDerWaalsContact O-CG2 3.28Å; M159-V163 WeakPolarHBondContact O-CG2 3.39Å; M159-V163 PolarHBondContact O-N 3.18Å; V163-N165 VanDerWaalsContact C-N 3.26Å; V163-N165 PolarHBondContact O-N 2.88Å; V163-I166 WeakPolarHBondContact O-CB 3.49Å; V163-I166 PolarHBondContact O-N 3.16Å; V163-I166 VanDerWaalsContact O-N 3.16Å; V163-V167 HydrophobicContact CG1-CG2 4.3Å; V163-V167 WeakPolarHBondContact O-CG2 3.42Å; V163-V167 PolarHBondContact O-N 3.32Å
164	G	96.9	Very high	89.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-36.2	176	0	0	0	0	0	112.5	G99 Y160 V161 R168	G99-G164 CarbonylContact C-O 3.09Å; G99-G164 VanDerWaalsContact CA-O 3.27Å; G99-G164 WeakPolarHBondContact CA-O 3.46Å; G99-G164 CarbonylContact O-C 3.39Å; G99-G164 WeakPolarHBondContact O-CA 3.35Å; Y160-G164 WeakPolarHBondContact O-CA 3.4Å; Y160-G164 PolarHBondContact O-N 3.2Å; V161-G164 PolarHBondContact O-N 3.04Å; G164-R168 WeakPolarHBondContact O-CB 3.31Å; G164-R168 PolarHBondContact O-N 2.93Å
165	N	96.1	Very high	91.3	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-72	-35.3	176	-154.9	38.4	0	0	0	112.7	M40 I61 N62 F65 K103 V161 L162 V163 R168 G169	M40-N165 HydrophobicContact CE-CB 4.47Å; I61-N165 PolarHBondContact O-ND2 3.23Å; N62-N165 PolarHBondContact O-ND2 3.04Å; F65-N165 WeakPolarHBondContact CB-ND2 3.49Å; F65-N165 PolarHBondContact N-ND2 3.43Å; K103-N165 HydrophobicContact CD-CB 4.27Å; V161-N165 WeakPolarHBondContact O-CB 3.28Å; V161-N165 PolarHBondContact O-N 3.24Å; L162-N165 PolarHBondContact O-N 2.97Å; V163-N165 VanDerWaalsContact C-N 3.26Å; V163-N165 PolarHBondContact O-N 2.88Å; N165-R168 WeakPolarHBondContact O-CB 3.49Å; N165-R168 PolarHBondContact O-N 3.24Å; N165-G169 PolarHBondContact O-N 3.04Å
166	I	96.9	Very high	92.4	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.195	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-50.3	170.1	-66.9	170	0	0	0	110.5	S64 G68 L162 V163 R168 G169 M170	S64-I166 WeakPolarHBondContact O-CG1 3.32Å; G68-I166 WeakPolarHBondContact CA-O 3.35Å; L162-I166 HydrophobicContact CD2-CD1 3.65Å; L162-I166 WeakPolarHBondContact O-CG1 3.28Å; L162-I166 PolarHBondContact O-N 2.61Å; V163-I166 WeakPolarHBondContact O-CB 3.49Å; V163-I166 PolarHBondContact O-N 3.16Å; V163-I166 VanDerWaalsContact O-N 3.16Å; I166-R168 VanDerWaalsContact C-N 3.27Å; I166-R168 PolarHBondContact O-N 3.44Å; I166-G169 WeakPolarHBondContact O-CA 3.34Å; I166-G169 PolarHBondContact O-N 2.9Å; I166-M170 HydrophobicContact CG2-SD 4.26Å; I166-M170 WeakPolarHBondContact O-CG 3.39Å; I166-M170 PolarHBondContact O-N 3.03Å
167	V	97.4	Very high	92.7	Very high	25 Å²	25	30.4 Å²	30.4	15%	0.152	15%	0.153	C	C	.	.	H	α-helix	trans	-60.9	-38.1	178.9	176.4	0	0	0	0	110.9	V95 L102 V163 G169 M170 G171	V95-V167 HydrophobicContact CG1-CG1 3.72Å; V95-V167 WeakPolarHBondContact O-CG1 3.34Å; L102-V167 HydrophobicContact CD1-CG2 4.21Å; V163-V167 HydrophobicContact CG1-CG2 4.3Å; V163-V167 WeakPolarHBondContact O-CG2 3.42Å; V163-V167 PolarHBondContact O-N 3.32Å; V167-G169 PolarHBondContact O-N 2.98Å; V167-M170 WeakPolarHBondContact O-CB 3.42Å; V167-M170 PolarHBondContact O-N 3.07Å; V167-G171 PolarHBondContact O-N 2.93Å
168	R	96.1	Very high	92.7	Very high	11 Å²	11	28.2 Å²	28.2	4%	0.042	14%	0.143	C	C	.	.	H	α-helix	trans	-58.3	-46.5	171.4	-169	-165.8	105.7	85.8	6.5	111.7	K33 S36 G37 M96 G164 N165 I166 M170 G171 E172	K33-R168 PolarHBondContact O-NH1 3.49Å; S36-R168 VanDerWaalsContact CB-NH1 3.28Å; G37-R168 VanDerWaalsContact N-NH1 3.13Å; M96-R168 HydrophobicContact CG-CG 3.76Å; G164-R168 WeakPolarHBondContact O-CB 3.31Å; G164-R168 PolarHBondContact O-N 2.93Å; N165-R168 WeakPolarHBondContact O-CB 3.49Å; N165-R168 PolarHBondContact O-N 3.24Å; I166-R168 VanDerWaalsContact C-N 3.27Å; I166-R168 PolarHBondContact O-N 3.44Å; R168-M170 VanDerWaalsContact C-N 3.34Å; R168-M170 PolarHBondContact O-N 3.36Å; R168-G171 PolarHBondContact O-N 3.13Å; R168-E172 IonicContact CZ-OE2 3.99Å; R168-E172 IonicContact NH1-OE2 3.6Å; R168-E172 IonicContact NH2-OE2 3.09Å; R168-E172 PolarHBondContact NH2-OE2 3.23Å; R168-E172 PolarHBondContact O-N 2.98Å
169	G	94.9	Very high	92.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-59.3	-42.5	176.4	0	0	0	0	0	113.1	F65 N165 I166 V167 E172 T173	F65-G169 VanDerWaalsContact CD2-CA 3.47Å; F65-G169 VanDerWaalsContact CE2-CA 3.48Å; N165-G169 PolarHBondContact O-N 3.04Å; I166-G169 WeakPolarHBondContact O-CA 3.34Å; I166-G169 PolarHBondContact O-N 2.9Å; V167-G169 PolarHBondContact O-N 2.98Å; G169-E172 PolarHBondContact O-N 3.49Å; G169-T173 PolarHBondContact O-N 3.1Å; G169-T173 PolarHBondContact O-OG1 3.4Å
170	M	94.9	Very high	92.2	Very high	60 Å²	60	24.3 Å²	24.3	30%	0.296	13%	0.126	S	C	.	.	H	α-helix	trans	-60.3	-45.7	174.2	-68.3	172.9	71.2	0	0	111.7	G68 L72 I166 V167 R168 T173	G68-M170 VanDerWaalsContact O-CG 3.3Å; G68-M170 WeakPolarHBondContact O-CG 3.29Å; L72-M170 HydrophobicContact CD1-CB 3.64Å; L72-M170 HydrophobicContact CD1-CE 3.83Å; L72-M170 HydrophobicContact CD1-CG 3.97Å; L72-M170 HydrophobicContact CG-CB 4.43Å; L72-M170 HydrophobicContact CG-CE 4.29Å; L72-M170 HydrophobicContact CG-CG 4.29Å; I166-M170 HydrophobicContact CG2-SD 4.26Å; I166-M170 WeakPolarHBondContact O-CG 3.39Å; I166-M170 PolarHBondContact O-N 3.03Å; V167-M170 WeakPolarHBondContact O-CB 3.42Å; V167-M170 PolarHBondContact O-N 3.07Å; R168-M170 VanDerWaalsContact C-N 3.34Å; R168-M170 PolarHBondContact O-N 3.36Å; M170-T173 WeakPolarHBondContact O-CB 3.32Å; M170-T173 PolarHBondContact O-N 2.87Å; M170-T173 PolarHBondContact O-OG1 3.47Å
171	G	94.8	Very high	91.7	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-68	-32.3	179.6	0	0	0	0	0	114.5	G92 V167 R168 T173 P174	G92-G171 CarbonylContact C-O 3.52Å; G92-G171 WeakPolarHBondContact CA-O 3.04Å; G92-G171 CarbonylContact O-C 3.52Å; G92-G171 WeakPolarHBondContact O-CA 3.41Å; G92-G171 VanDerWaalsContact O-O 3.11Å; V167-G171 PolarHBondContact O-N 2.93Å; R168-G171 PolarHBondContact O-N 3.13Å; G171-T173 VanDerWaalsContact C-N 3.32Å; G171-T173 PolarHBondContact O-N 3.44Å; G171-P174 WeakPolarHBondContact O-CD 3.48Å
172	E	93.1	Very high	91.2	Very high	25 Å²	25	20.9 Å²	20.9	12%	0.117	12%	0.115	C	C	.	.	H	α-helix	trans	-71.7	-28.1	178.7	-172	171.2	153	0	0	112.9	K33 F65 M96 R168 G169 I175	K33-E172 HydrophobicContact CB-CG 4.25Å; K33-E172 HydrophobicContact CD-CG 3.97Å; K33-E172 HydrophobicContact CG-CG 4.37Å; F65-E172 HydrophobicContact CE2-CB 4.22Å; F65-E172 WeakPolarHBondContact CE2-OE2 3.37Å; F65-E172 HydrophobicContact CZ-CB 4.42Å; F65-E172 HydrophobicContact CZ-CG 4.46Å; F65-E172 WeakPolarHBondContact CZ-OE2 3.43Å; M96-E172 HydrophobicContact SD-CB 4.41Å; R168-E172 IonicContact CZ-OE2 3.99Å; R168-E172 IonicContact NH1-OE2 3.6Å; R168-E172 IonicContact NH2-OE2 3.09Å; R168-E172 PolarHBondContact NH2-OE2 3.23Å; R168-E172 PolarHBondContact O-N 2.98Å; G169-E172 PolarHBondContact O-N 3.49Å; E172-I175 HydrophobicContact CG-CD1 4.5Å; E172-I175 WeakPolarHBondContact O-CB 3.42Å; E172-I175 WeakPolarHBondContact O-CG1 3.43Å; E172-I175 PolarHBondContact O-N 2.94Å; E172-I175 VanDerWaalsContact O-N 3.1Å
173	T	90.4	Very high	90.6	Very high	3 Å²	3	20 Å²	20	2%	0.018	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-50.1	-173.7	-61.4	0	0	0	0	115.2	N69 L72 I73 V76 G169 M170 G171 I175 P177	N69-T173 WeakPolarHBondContact CA-OG1 3.32Å; N69-T173 PolarHBondContact O-OG1 3.44Å; L72-T173 HydrophobicContact CB-CG2 3.91Å; I73-T173 HydrophobicContact CB-CG2 3.93Å; I73-T173 HydrophobicContact CG1-CG2 4.33Å; V76-T173 HydrophobicContact CB-CG2 4.01Å; V76-T173 HydrophobicContact CG1-CG2 4.39Å; V76-T173 HydrophobicContact CG2-CG2 4.01Å; G169-T173 PolarHBondContact O-N 3.1Å; G169-T173 PolarHBondContact O-OG1 3.4Å; M170-T173 WeakPolarHBondContact O-CB 3.32Å; M170-T173 PolarHBondContact O-N 2.87Å; M170-T173 PolarHBondContact O-OG1 3.47Å; G171-T173 VanDerWaalsContact C-N 3.32Å; G171-T173 PolarHBondContact O-N 3.44Å; T173-I175 VanDerWaalsContact C-N 3.33Å; T173-I175 PolarHBondContact O-N 2.94Å; T173-P177 WeakPolarHBondContact O-CD 3.46Å; T173-P177 VanDerWaalsContact O-CG 3.3Å; T173-P177 WeakPolarHBondContact O-CG 3.35Å
174	P	90.1	Very high	89.8	Confident	7 Å²	7	22 Å²	22	5%	0.045	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-19.1	-179.4	26	-36.1	0	0	0	115.9	V76 G171 L178	V76-P174 HydrophobicContact CG1-CB 3.72Å; G171-P174 WeakPolarHBondContact O-CD 3.48Å; P174-L178 HydrophobicContact CB-CD1 3.79Å; P174-L178 HydrophobicContact CB-CG 4.38Å; P174-L178 WeakPolarHBondContact O-CB 3.49Å; P174-L178 WeakPolarHBondContact O-CG 3.25Å; P174-L178 PolarHBondContact O-N 3.11Å
175	I	91	Very high	88.9	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-66.2	-50	-167	-57	177.3	0	0	0	111.3	I26 A29 F30 K33 I89 M96 E172 T173 G179	I26-I175 HydrophobicContact CD1-CG2 3.91Å; A29-I175 HydrophobicContact CB-CG2 4.18Å; F30-I175 HydrophobicContact CD2-CG2 3.82Å; F30-I175 HydrophobicContact CE2-CG2 3.77Å; K33-I175 HydrophobicContact CB-CD1 4.22Å; K33-I175 HydrophobicContact CD-CD1 4.43Å; K33-I175 HydrophobicContact CD-CG2 4.22Å; I89-I175 HydrophobicContact CG2-CG1 4.41Å; M96-I175 HydrophobicContact CE-CD1 3.8Å; M96-I175 HydrophobicContact SD-CD1 4.42Å; E172-I175 HydrophobicContact CG-CD1 4.5Å; E172-I175 WeakPolarHBondContact O-CB 3.42Å; E172-I175 WeakPolarHBondContact O-CG1 3.43Å; E172-I175 PolarHBondContact O-N 2.94Å; E172-I175 VanDerWaalsContact O-N 3.1Å; T173-I175 VanDerWaalsContact C-N 3.33Å; T173-I175 PolarHBondContact O-N 2.94Å; I175-G179 WeakPolarHBondContact O-CA 3.09Å; I175-G179 PolarHBondContact O-N 2.81Å; I175-G179 VanDerWaalsContact O-N 3.07Å
176	L	84.6	Confident	88.1	Confident	81 Å²	81	25.8 Å²	25.8	42%	0.424	14%	0.135	S	C	.	.	H	α-helix	trans	-70.1	-59.2	-177.4	179.1	67	0	0	0	113.1	F30 I180	F30-L176 HydrophobicContact CE1-CD1 3.87Å; F30-L176 HydrophobicContact CZ-CB 4.3Å; F30-L176 HydrophobicContact CZ-CD1 3.51Å; L176-I180 HydrophobicContact CD1-CG1 4.11Å; L176-I180 VanDerWaalsContact O-CG1 3.31Å; L176-I180 WeakPolarHBondContact O-CG1 3.29Å; L176-I180 PolarHBondContact O-N 3.43Å; L176-I180 VanDerWaalsContact O-N 3.12Å
177	P	82.1	Confident	87.3	Confident	44 Å²	44	24 Å²	24	29%	0.286	13%	0.126	S	C	.	.	H	α-helix	trans	-65.7	-44.3	-174.5	25.2	-33.9	0	0	0	112.3	V76 T173 S181	V76-P177 HydrophobicContact CG1-CG 4.48Å; T173-P177 WeakPolarHBondContact O-CD 3.46Å; T173-P177 VanDerWaalsContact O-CG 3.3Å; T173-P177 WeakPolarHBondContact O-CG 3.35Å; P177-S181 VanDerWaalsContact O-CB 3.28Å; P177-S181 WeakPolarHBondContact O-CB 3.5Å; P177-S181 PolarHBondContact O-N 3.3Å; P177-S181 VanDerWaalsContact O-N 3.16Å; P177-S181 PolarHBondContact O-OG 3.45Å; P177-S181 VanDerWaalsContact O-OG 3.12Å
178	L	85.8	Confident	86.3	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-74.7	-35.9	-178.6	-54.5	-176.7	0	0	0	111.7	V76 G80 T81 R85 M88 I89 P174 S181 Y182	V76-L178 HydrophobicContact CG1-CD1 4.08Å; V76-L178 HydrophobicContact CG1-CG 4.17Å; G80-L178 VanDerWaalsContact C-CD2 3.47Å; T81-L178 HydrophobicContact CG2-CD2 4.32Å; R85-L178 HydrophobicContact CB-CB 4.38Å; M88-L178 HydrophobicContact CB-CD1 3.66Å; M88-L178 HydrophobicContact CG-CD1 4.49Å; I89-L178 HydrophobicContact CD1-CB 3.93Å; I89-L178 HydrophobicContact CG1-CB 3.87Å; I89-L178 HydrophobicContact CG1-CD1 4.44Å; P174-L178 HydrophobicContact CB-CD1 3.79Å; P174-L178 HydrophobicContact CB-CG 4.38Å; P174-L178 WeakPolarHBondContact O-CB 3.49Å; P174-L178 WeakPolarHBondContact O-CG 3.25Å; P174-L178 PolarHBondContact O-N 3.11Å; L178-S181 WeakPolarHBondContact CA-OG 3.49Å; L178-S181 PolarHBondContact O-OG 2.98Å; L178-Y182 WeakPolarHBondContact O-CB 3.36Å; L178-Y182 PolarHBondContact O-N 3.22Å
179	G	87.3	Confident	84.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-50.9	177.2	0	0	0	0	0	113.1	I175 Y182 I183	I175-G179 WeakPolarHBondContact O-CA 3.09Å; I175-G179 PolarHBondContact O-N 2.81Å; I175-G179 VanDerWaalsContact O-N 3.07Å; G179-Y182 PolarHBondContact O-N 3.22Å; G179-I183 PolarHBondContact O-N 3.43Å
180	I	83.1	Confident	83.7	Confident	30 Å²	30	39.3 Å²	39.3	15%	0.154	21%	0.206	C	C	.	.	H	α-helix	trans	-66.3	-46.3	179.6	-61.1	-64.7	0	0	0	110.5	L176 Y182 I183 E184 I196 I199	L176-I180 HydrophobicContact CD1-CG1 4.11Å; L176-I180 VanDerWaalsContact O-CG1 3.31Å; L176-I180 WeakPolarHBondContact O-CG1 3.29Å; L176-I180 PolarHBondContact O-N 3.43Å; L176-I180 VanDerWaalsContact O-N 3.12Å; I180-Y182 VanDerWaalsContact C-N 3.28Å; I180-Y182 PolarHBondContact O-N 3.3Å; I180-I183 PolarHBondContact O-N 3.33Å; I180-I183 VanDerWaalsContact O-N 3.08Å; I180-E184 HydrophobicContact CG2-CG 4.35Å; I180-E184 PolarHBondContact O-N 2.99Å; I180-I196 HydrophobicContact CD1-CG1 4.1Å; I180-I196 HydrophobicContact CD1-CG2 4.29Å; I180-I196 HydrophobicContact CG2-CD1 4.32Å; I180-I199 HydrophobicContact CD1-CD1 4.37Å
181	S	82.8	Confident	82.5	Confident	21 Å²	21	38.9 Å²	38.9	15%	0.147	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-38.3	179	70.4	0	0	0	0	113.2	R85 P177 L178 E184 D185	R85-S181 PolarHBondContact NH1-O 2.88Å; R85-S181 PolarHBondContact NH1-OG 3.06Å; R85-S181 VanDerWaalsContact NH1-OG 3.13Å; P177-S181 VanDerWaalsContact O-CB 3.28Å; P177-S181 WeakPolarHBondContact O-CB 3.5Å; P177-S181 PolarHBondContact O-N 3.3Å; P177-S181 VanDerWaalsContact O-N 3.16Å; P177-S181 PolarHBondContact O-OG 3.45Å; P177-S181 VanDerWaalsContact O-OG 3.12Å; L178-S181 WeakPolarHBondContact CA-OG 3.49Å; L178-S181 PolarHBondContact O-OG 2.98Å; S181-E184 PolarHBondContact O-N 3.05Å; S181-D185 WeakPolarHBondContact O-CB 3.4Å; S181-D185 VanDerWaalsContact O-CG 3.29Å; S181-D185 PolarHBondContact O-N 3.4Å; S181-D185 VanDerWaalsContact O-N 3.1Å
182	Y	84.2	Confident	81.4	Confident	1 Å²	1	39.4 Å²	39.4	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-67.8	-37	178.4	-168.3	-88.1	0	0	0	111.7	F22 R85 P86 L178 G179 I180 F186 P267 L270	F22-Y182 HydrophobicContact CB-CE1 4.08Å; F22-Y182 AromaticContact CD1-CD1 3.51Å; F22-Y182 HydrophobicContact CD1-CD1 3.51Å; F22-Y182 AromaticContact CD1-CE1 3.95Å; F22-Y182 HydrophobicContact CD1-CE1 3.95Å; F22-Y182 HydrophobicContact CD1-CG 4.48Å; F22-Y182 AromaticContact CD2-CD1 3.56Å; F22-Y182 HydrophobicContact CD2-CD1 3.56Å; F22-Y182 AromaticContact CD2-CE1 3.45Å; F22-Y182 HydrophobicContact CD2-CE1 3.45Å; F22-Y182 VanDerWaalsContact CD2-CE1 3.45Å; F22-Y182 HydrophobicContact CD2-CG 4.29Å; F22-Y182 AromaticContact CE1-CD1 3.46Å; F22-Y182 HydrophobicContact CE1-CD1 3.46Å; F22-Y182 VanDerWaalsContact CE1-CD1 3.46Å; F22-Y182 HydrophobicContact CE1-CE1 4.29Å; F22-Y182 HydrophobicContact CE1-CG 4.01Å; F22-Y182 AromaticContact CE2-CD1 3.52Å; F22-Y182 HydrophobicContact CE2-CD1 3.52Å; F22-Y182 HydrophobicContact CE2-CD2 4.38Å; F22-Y182 AromaticContact CE2-CE1 3.84Å; F22-Y182 HydrophobicContact CE2-CE1 3.84Å; F22-Y182 AromaticContact CE2-CG 3.81Å; F22-Y182 HydrophobicContact CE2-CG 3.81Å; F22-Y182 AromaticContact CG-CD1 3.58Å; F22-Y182 HydrophobicContact CG-CD1 3.58Å; F22-Y182 AromaticContact CG-CE1 3.53Å; F22-Y182 HydrophobicContact CG-CE1 3.53Å; F22-Y182 AromaticContact CZ-CD1 3.46Å; F22-Y182 HydrophobicContact CZ-CD1 3.46Å; F22-Y182 VanDerWaalsContact CZ-CD1 3.46Å; F22-Y182 HydrophobicContact CZ-CE1 4.23Å; F22-Y182 AromaticContact CZ-CG 3.65Å; F22-Y182 HydrophobicContact CZ-CG 3.65Å; R85-Y182 HydrophobicContact CB-CD2 4.19Å; P86-Y182 HydrophobicContact CG-CD2 4.11Å; P86-Y182 HydrophobicContact CG-CE2 3.53Å; L178-Y182 WeakPolarHBondContact O-CB 3.36Å; L178-Y182 PolarHBondContact O-N 3.22Å; G179-Y182 PolarHBondContact O-N 3.22Å; I180-Y182 VanDerWaalsContact C-N 3.28Å; I180-Y182 PolarHBondContact O-N 3.3Å; Y182-F186 AromaticContact CD1-CD2 3.76Å; Y182-F186 HydrophobicContact CD1-CD2 3.76Å; Y182-F186 HydrophobicContact CD1-CE2 4.21Å; Y182-F186 AromaticContact CD2-CD2 3.97Å; Y182-F186 HydrophobicContact CD2-CD2 3.97Å; Y182-F186 AromaticContact CD2-CE2 3.55Å; Y182-F186 HydrophobicContact CD2-CE2 3.55Å; Y182-F186 AromaticContact CE1-CD2 3.69Å; Y182-F186 HydrophobicContact CE1-CD2 3.69Å; Y182-F186 HydrophobicContact CE1-CE2 4.09Å; Y182-F186 AromaticContact CE2-CD2 3.9Å; Y182-F186 HydrophobicContact CE2-CD2 3.9Å; Y182-F186 AromaticContact CE2-CE2 3.4Å; Y182-F186 HydrophobicContact CE2-CE2 3.4Å; Y182-F186 VanDerWaalsContact CE2-CE2 3.4Å; Y182-F186 HydrophobicContact CE2-CZ 4.43Å; Y182-F186 AromaticContact CG-CD2 3.91Å; Y182-F186 HydrophobicContact CG-CD2 3.91Å; Y182-F186 AromaticContact CG-CE2 3.97Å; Y182-F186 HydrophobicContact CG-CE2 3.97Å; Y182-F186 AromaticContact CZ-CD2 3.77Å; Y182-F186 AromaticContact CZ-CE2 3.7Å; Y182-F186 WeakPolarHBondContact O-CD2 3.48Å; Y182-F186 PolarHBondContact O-N 3.12Å; Y182-P267 PolarHBondContact OH-O 3.29Å; Y182-L270 HydrophobicContact CE1-CD1 3.72Å; Y182-L270 HydrophobicContact CE1-CG 4.5Å; Y182-L270 WeakPolarHBondContact OH-CD1 3.35Å; Y182-L270 WeakPolarHBondContact OH-CG 3.49Å
183	I	84.4	Confident	80.2	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.229	C	C	.	.	H	α-helix	trans	-69	-44.6	176	-71.2	169.1	0	0	0	110.9	F22 L23 I26 G179 I180 D185 F186 A187 Y195 I199	F22-I183 HydrophobicContact CD1-CG1 4.07Å; F22-I183 HydrophobicContact CE1-CD1 4.24Å; F22-I183 HydrophobicContact CE1-CG1 3.88Å; L23-I183 HydrophobicContact CD1-CD1 3.98Å; I26-I183 HydrophobicContact CG2-CD1 4.12Å; G179-I183 PolarHBondContact O-N 3.43Å; I180-I183 PolarHBondContact O-N 3.33Å; I180-I183 VanDerWaalsContact O-N 3.08Å; I183-D185 VanDerWaalsContact C-N 3.27Å; I183-D185 PolarHBondContact O-N 3.08Å; I183-F186 PolarHBondContact O-N 2.83Å; I183-A187 HydrophobicContact CG2-CB 4.15Å; I183-A187 WeakPolarHBondContact O-CB 3.27Å; I183-A187 PolarHBondContact O-N 3.23Å; I183-Y195 HydrophobicContact CG2-CD2 4.03Å; I183-Y195 HydrophobicContact CG2-CG 4.49Å; I183-I199 HydrophobicContact CD1-CD1 3.17Å; I183-I199 HydrophobicContact CD1-CG1 4.49Å
184	E	78.3	Confident	79.4	Confident	113 Å²	113	47.4 Å²	47.4	53%	0.528	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-35.3	179.4	-70.5	-171.7	143.3	0	0	112.5	I180 S181	I180-E184 HydrophobicContact CG2-CG 4.35Å; I180-E184 PolarHBondContact O-N 2.99Å; S181-E184 PolarHBondContact O-N 3.05Å
185	D	78.5	Confident	78.9	Confident	58 Å²	58	48.1 Å²	48.1	31%	0.31	26%	0.258	S	S	.	.	H	α-helix	trans	-72.6	-32.1	-179.6	-76.3	-17.6	0	0	0	113.7	R85 S181 I183	R85-D185 IonicContact CZ-OD2 2.64Å; R85-D185 IonicContact NH1-OD2 3.69Å; R85-D185 PolarHBondContact NH1-OD2 3.34Å; R85-D185 IonicContact NH2-OD2 3.15Å; R85-D185 PolarHBondContact NH2-OD2 2.66Å; S181-D185 WeakPolarHBondContact O-CB 3.4Å; S181-D185 VanDerWaalsContact O-CG 3.29Å; S181-D185 PolarHBondContact O-N 3.4Å; S181-D185 VanDerWaalsContact O-N 3.1Å; I183-D185 VanDerWaalsContact C-N 3.27Å; I183-D185 PolarHBondContact O-N 3.08Å
186	F	80.3	Confident	78.1	Confident	22 Å²	22	50.1 Å²	50.1	10%	0.096	27%	0.268	C	S	.	.	H	α-helix	trans	-112.5	-19.2	-170.9	-60.4	-57.6	0	0	0	115	L19 Y182 I183 T269 L270 K272 E273	L19-F186 HydrophobicContact CD1-CB 3.95Å; Y182-F186 AromaticContact CD1-CD2 3.76Å; Y182-F186 HydrophobicContact CD1-CD2 3.76Å; Y182-F186 HydrophobicContact CD1-CE2 4.21Å; Y182-F186 AromaticContact CD2-CD2 3.97Å; Y182-F186 HydrophobicContact CD2-CD2 3.97Å; Y182-F186 AromaticContact CD2-CE2 3.55Å; Y182-F186 HydrophobicContact CD2-CE2 3.55Å; Y182-F186 AromaticContact CE1-CD2 3.69Å; Y182-F186 HydrophobicContact CE1-CD2 3.69Å; Y182-F186 HydrophobicContact CE1-CE2 4.09Å; Y182-F186 AromaticContact CE2-CD2 3.9Å; Y182-F186 HydrophobicContact CE2-CD2 3.9Å; Y182-F186 AromaticContact CE2-CE2 3.4Å; Y182-F186 HydrophobicContact CE2-CE2 3.4Å; Y182-F186 VanDerWaalsContact CE2-CE2 3.4Å; Y182-F186 HydrophobicContact CE2-CZ 4.43Å; Y182-F186 AromaticContact CG-CD2 3.91Å; Y182-F186 HydrophobicContact CG-CD2 3.91Å; Y182-F186 AromaticContact CG-CE2 3.97Å; Y182-F186 HydrophobicContact CG-CE2 3.97Å; Y182-F186 AromaticContact CZ-CD2 3.77Å; Y182-F186 AromaticContact CZ-CE2 3.7Å; Y182-F186 WeakPolarHBondContact O-CD2 3.48Å; Y182-F186 PolarHBondContact O-N 3.12Å; I183-F186 PolarHBondContact O-N 2.83Å; F186-T269 HydrophobicContact CZ-CG2 4.33Å; F186-L270 HydrophobicContact CB-CB 4.23Å; F186-L270 HydrophobicContact CD1-CB 3.79Å; F186-L270 WeakPolarHBondContact CD1-O 3.48Å; F186-L270 HydrophobicContact CD2-CB 4.26Å; F186-L270 HydrophobicContact CE1-CB 4.26Å; F186-L270 WeakPolarHBondContact CE1-O 3.31Å; F186-L270 HydrophobicContact CG-CB 3.82Å; F186-K272 WeakPolarHBondContact O-CA 3.44Å; F186-E273 PolarHBondContact O-N 3.27Å
187	A	79.9	Confident	77.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.008	26%	0.264	C	S	.	.	S	Bend	trans	-81.5	158.9	174.4	0	0	0	0	0	112	L19 I183 Y195	L19-A187 HydrophobicContact CD2-CB 4.22Å; I183-A187 HydrophobicContact CG2-CB 4.15Å; I183-A187 WeakPolarHBondContact O-CB 3.27Å; I183-A187 PolarHBondContact O-N 3.23Å; A187-Y195 HydrophobicContact CB-CD2 3.8Å; A187-Y195 HydrophobicContact CB-CE2 3.86Å
188	K	75.9	Confident	77.4	Confident	90 Å²	90	49.7 Å²	49.7	39%	0.391	27%	0.271	S	S	.	.			trans	-65.3	143	164.2	-71.1	-173.8	179.9	-176.1	0	109.8	E190 N191 S192 E273	K188-E190 PolarHBondContact O-N 3.44Å; K188-E190 VanDerWaalsContact O-N 3.11Å; K188-N191 HydrophobicContact CB-CB 4.42Å; K188-N191 PolarHBondContact O-N 3.34Å; K188-S192 PolarHBondContact O-N 2.91Å; K188-E273 WeakPolarHBondContact CE-O 3.29Å; K188-E273 HydrophobicContact CG-CB 4.08Å; K188-E273 HydrophobicContact CG-CG 4.21Å; K188-E273 WeakPolarHBondContact CG-O 3.34Å; K188-E273 PolarHBondContact N-OE2 3.1Å
189	S	66.5	Low	77.4	Confident	102 Å²	102	49.7 Å²	49.7	71%	0.713	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-29.6	177.6	47.9	0	0	0	0	112.9	P193	S189-P193 WeakPolarHBondContact O-CD 3.18Å
190	E	69.4	Low	76.9	Confident	166 Å²	166	54 Å²	54	78%	0.776	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-33.1	175.9	-62.8	174.1	-179.1	0	0	113.2	K188	K188-E190 PolarHBondContact O-N 3.44Å; K188-E190 VanDerWaalsContact O-N 3.11Å
191	N	71	Confident	76.6	Confident	51 Å²	51	55.6 Å²	55.6	27%	0.273	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-24.6	-176.4	-70.1	-20.9	0	0	0	113.2	K188 L194 Y195 E273	K188-N191 HydrophobicContact CB-CB 4.42Å; K188-N191 PolarHBondContact O-N 3.34Å; N191-L194 WeakPolarHBondContact O-CB 3.33Å; N191-L194 PolarHBondContact O-N 2.65Å; N191-Y195 HydrophobicContact CB-CE2 4.09Å; N191-Y195 PolarHBondContact O-N 2.94Å; N191-Y195 VanDerWaalsContact O-N 3.14Å; N191-E273 PolarHBondContact ND2-OE1 2.96Å; N191-E273 PolarHBondContact ND2-OE2 3.24Å
192	S	70.9	Confident	76.5	Confident	11 Å²	11	54.7 Å²	54.7	8%	0.077	30%	0.297	C	S	.	.	H	α-helix	trans	-52.4	-46.6	-177.9	178.7	0	0	0	0	113.6	K188 L194 Y195 I196	K188-S192 PolarHBondContact O-N 2.91Å; S192-L194 VanDerWaalsContact C-N 3.25Å; S192-L194 PolarHBondContact O-N 2.64Å; S192-Y195 PolarHBondContact O-N 2.93Å; S192-Y195 VanDerWaalsContact O-N 3.14Å; S192-I196 WeakPolarHBondContact O-CG1 3.16Å; S192-I196 PolarHBondContact O-N 3.03Å
193	P	68	Low	76.6	Confident	86 Å²	86	55.4 Å²	55.4	56%	0.558	30%	0.303	S	S	*	.	H	α-helix	trans	-61	-32.3	177.7	-23.6	34.6	0	0	0	113.9	S189 G197	S189-P193 WeakPolarHBondContact O-CD 3.18Å; P193-G197 PolarHBondContact O-N 3.22Å
194	L	73.1	Confident	76.6	Confident	110 Å²	110	56.7 Å²	56.7	58%	0.576	31%	0.309	S	S	*	.	H	α-helix	trans	-70.8	-41.3	177.5	-176.7	150	0	0	0	110.9	N191 S192 G197 L198	N191-L194 WeakPolarHBondContact O-CB 3.33Å; N191-L194 PolarHBondContact O-N 2.65Å; S192-L194 VanDerWaalsContact C-N 3.25Å; S192-L194 PolarHBondContact O-N 2.64Å; L194-G197 PolarHBondContact O-N 3.12Å; L194-L198 HydrophobicContact CD2-CD1 3.89Å; L194-L198 HydrophobicContact CD2-CG 4.41Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.04Å
195	Y	79.9	Confident	77.1	Confident	22 Å²	22	55.3 Å²	55.3	9%	0.086	31%	0.305	C	S	.	.	H	α-helix	trans	-65.9	-40.5	176.1	-65	-20.1	0	0	0	112.6	L19 L23 I183 A187 N191 S192 G197 L198 I199 E273	L19-Y195 HydrophobicContact CD2-CE2 4.19Å; L23-Y195 HydrophobicContact CD1-CG 4.29Å; L23-Y195 HydrophobicContact CD2-CD1 3.42Å; L23-Y195 VanDerWaalsContact CD2-CD1 3.42Å; L23-Y195 HydrophobicContact CD2-CE1 3.81Å; L23-Y195 HydrophobicContact CD2-CG 3.86Å; I183-Y195 HydrophobicContact CG2-CD2 4.03Å; I183-Y195 HydrophobicContact CG2-CG 4.49Å; A187-Y195 HydrophobicContact CB-CD2 3.8Å; A187-Y195 HydrophobicContact CB-CE2 3.86Å; N191-Y195 HydrophobicContact CB-CE2 4.09Å; N191-Y195 PolarHBondContact O-N 2.94Å; N191-Y195 VanDerWaalsContact O-N 3.14Å; S192-Y195 PolarHBondContact O-N 2.93Å; S192-Y195 VanDerWaalsContact O-N 3.14Å; Y195-G197 VanDerWaalsContact C-N 3.32Å; Y195-G197 PolarHBondContact O-N 3.11Å; Y195-L198 HydrophobicContact CD1-CD1 4.39Å; Y195-L198 PolarHBondContact O-N 3.14Å; Y195-I199 WeakPolarHBondContact O-CG1 3.49Å; Y195-I199 PolarHBondContact O-N 3.38Å; Y195-I199 VanDerWaalsContact O-N 3.11Å; Y195-E273 PolarHBondContact OH-OE1 3.48Å
196	I	75	Confident	77.7	Confident	43 Å²	43	52.6 Å²	52.6	22%	0.221	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-43.8	172.7	-63.9	170.5	0	0	0	110.1	I180 S192 L198 I199 E200	I180-I196 HydrophobicContact CD1-CG1 4.1Å; I180-I196 HydrophobicContact CD1-CG2 4.29Å; I180-I196 HydrophobicContact CG2-CD1 4.32Å; S192-I196 WeakPolarHBondContact O-CG1 3.16Å; S192-I196 PolarHBondContact O-N 3.03Å; I196-L198 VanDerWaalsContact C-N 3.3Å; I196-L198 PolarHBondContact O-N 3.26Å; I196-I199 WeakPolarHBondContact O-CB 3.39Å; I196-I199 PolarHBondContact O-N 2.55Å; I196-I199 VanDerWaalsContact O-N 3.14Å; I196-E200 HydrophobicContact CG2-CG 4.43Å; I196-E200 WeakPolarHBondContact O-CG 3.36Å; I196-E200 PolarHBondContact O-N 3.16Å
197	G	71.4	Confident	78.3	Confident	33 Å²	33	52.8 Å²	52.8	34%	0.34	29%	0.294	S	S	.	.	H	α-helix	trans	-59.1	-37	175.3	0	0	0	0	0	113.9	P193 L194 Y195 T201	P193-G197 PolarHBondContact O-N 3.22Å; L194-G197 PolarHBondContact O-N 3.12Å; Y195-G197 VanDerWaalsContact C-N 3.32Å; Y195-G197 PolarHBondContact O-N 3.11Å; G197-T201 WeakPolarHBondContact O-CB 3.37Å; G197-T201 PolarHBondContact O-N 3.42Å; G197-T201 PolarHBondContact O-OG1 2.98Å
198	L	80.1	Confident	78.9	Confident	83 Å²	83	55.5 Å²	55.5	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-39.9	174.5	-72.4	172.1	0	0	0	112.2	L23 L194 Y195 I196 T201 G202	L23-L198 HydrophobicContact CD2-CD1 4.12Å; L194-L198 HydrophobicContact CD2-CD1 3.89Å; L194-L198 HydrophobicContact CD2-CG 4.41Å; L194-L198 WeakPolarHBondContact O-CG 3.49Å; L194-L198 PolarHBondContact O-N 3.04Å; Y195-L198 HydrophobicContact CD1-CD1 4.39Å; Y195-L198 PolarHBondContact O-N 3.14Å; I196-L198 VanDerWaalsContact C-N 3.3Å; I196-L198 PolarHBondContact O-N 3.26Å; L198-T201 PolarHBondContact O-N 2.98Å; L198-G202 PolarHBondContact O-N 3.49Å
199	I	85.1	Confident	79.8	Confident	0 Å²	0	55 Å²	55	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-46.8	176.6	-69.6	169.7	0	0	0	110.9	L23 I26 F30 I180 I183 Y195 I196 T201 G202 A203	L23-I199 HydrophobicContact CD1-CD1 4.05Å; L23-I199 HydrophobicContact CD1-CG1 4.02Å; I26-I199 HydrophobicContact CG1-CD1 4.47Å; I26-I199 HydrophobicContact CG2-CD1 3.62Å; I26-I199 HydrophobicContact CG2-CG1 4.02Å; F30-I199 HydrophobicContact CB-CG2 4.32Å; F30-I199 HydrophobicContact CD1-CG2 3.53Å; F30-I199 HydrophobicContact CD2-CG2 3.63Å; F30-I199 HydrophobicContact CE1-CG2 3.48Å; F30-I199 VanDerWaalsContact CE1-CG2 3.48Å; F30-I199 HydrophobicContact CE2-CG2 3.59Å; F30-I199 HydrophobicContact CG-CG2 3.57Å; F30-I199 HydrophobicContact CZ-CG2 3.49Å; F30-I199 VanDerWaalsContact CZ-CG2 3.49Å; I180-I199 HydrophobicContact CD1-CD1 4.37Å; I183-I199 HydrophobicContact CD1-CD1 3.17Å; I183-I199 HydrophobicContact CD1-CG1 4.49Å; Y195-I199 WeakPolarHBondContact O-CG1 3.49Å; Y195-I199 PolarHBondContact O-N 3.38Å; Y195-I199 VanDerWaalsContact O-N 3.11Å; I196-I199 WeakPolarHBondContact O-CB 3.39Å; I196-I199 PolarHBondContact O-N 2.55Å; I196-I199 VanDerWaalsContact O-N 3.14Å; I199-T201 VanDerWaalsContact C-N 3.28Å; I199-T201 PolarHBondContact O-N 3.09Å; I199-G202 WeakPolarHBondContact O-CA 3.39Å; I199-G202 PolarHBondContact O-N 3.44Å; I199-G202 VanDerWaalsContact O-N 3.14Å; I199-A203 PolarHBondContact O-N 3.09Å
200	E	76.3	Confident	81.2	Confident	91 Å²	91	50.2 Å²	50.2	43%	0.425	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-35.3	177.1	-66.9	-59.9	160.4	0	0	111.7	I196 A203 I204	I196-E200 HydrophobicContact CG2-CG 4.43Å; I196-E200 WeakPolarHBondContact O-CG 3.36Å; I196-E200 PolarHBondContact O-N 3.16Å; E200-A203 VanDerWaalsContact O-CB 3.23Å; E200-A203 WeakPolarHBondContact O-CB 3.36Å; E200-A203 PolarHBondContact O-N 2.86Å; E200-I204 PolarHBondContact O-N 3.28Å
201	T	77.6	Confident	82.4	Confident	62 Å²	62	43 Å²	43	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-63.3	-44.5	172.6	-55	0	0	0	0	111.1	G197 L198 I199 A203 I204 I205	G197-T201 WeakPolarHBondContact O-CB 3.37Å; G197-T201 PolarHBondContact O-N 3.42Å; G197-T201 PolarHBondContact O-OG1 2.98Å; L198-T201 PolarHBondContact O-N 2.98Å; I199-T201 VanDerWaalsContact C-N 3.28Å; I199-T201 PolarHBondContact O-N 3.09Å; T201-A203 PolarHBondContact O-N 3.31Å; T201-I204 PolarHBondContact O-N 3.2Å; T201-I204 VanDerWaalsContact O-N 3.15Å; T201-I205 PolarHBondContact O-N 3.41Å
202	G	81.7	Confident	83.6	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-58.8	-36.2	172.6	0	0	0	0	0	112.7	V31 L198 I199 I204 I205 G206	V31-G202 WeakPolarHBondContact CG2-O 3.39Å; L198-G202 PolarHBondContact O-N 3.49Å; I199-G202 WeakPolarHBondContact O-CA 3.39Å; I199-G202 PolarHBondContact O-N 3.44Å; I199-G202 VanDerWaalsContact O-N 3.14Å; G202-I204 PolarHBondContact O-N 2.81Å; G202-I205 PolarHBondContact O-N 3.46Å; G202-G206 PolarHBondContact O-N 3.29Å
203	A	85.3	Confident	84.8	Confident	15 Å²	15	45 Å²	45	12%	0.124	25%	0.251	C	S	.	.	H	α-helix	trans	-59.8	-30.6	177	0	0	0	0	0	113	F30 T34 I199 E200 T201 P207	F30-A203 HydrophobicContact CD1-CB 3.97Å; T34-A203 WeakPolarHBondContact CB-O 3.33Å; T34-A203 HydrophobicContact CG2-CB 4.33Å; T34-A203 PolarHBondContact OG1-O 2.94Å; I199-A203 PolarHBondContact O-N 3.09Å; E200-A203 VanDerWaalsContact O-CB 3.23Å; E200-A203 WeakPolarHBondContact O-CB 3.36Å; E200-A203 PolarHBondContact O-N 2.86Å; T201-A203 PolarHBondContact O-N 3.31Å; A203-P207 WeakPolarHBondContact O-CD 3.34Å
204	I	83.9	Confident	86.2	Confident	29 Å²	29	41 Å²	41	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-87.2	-25.6	179.4	-49.1	164.4	0	0	0	112.7	E200 T201 G202 G206 P207 C367 Y370	E200-I204 PolarHBondContact O-N 3.28Å; T201-I204 PolarHBondContact O-N 3.2Å; T201-I204 VanDerWaalsContact O-N 3.15Å; G202-I204 PolarHBondContact O-N 2.81Å; I204-G206 VanDerWaalsContact C-N 3.35Å; I204-P207 VanDerWaalsContact O-CD 3.32Å; I204-P207 WeakPolarHBondContact O-CD 3.44Å; I204-C367 WeakPolarHBondContact CG2-SG 3.44Å; I204-Y370 HydrophobicContact CD1-CD2 3.68Å; I204-Y370 HydrophobicContact CD1-CE2 4.21Å
205	I	88.4	Confident	87.3	Confident	84 Å²	84	36.4 Å²	36.4	43%	0.431	20%	0.202	S	C	.	.	H	α-helix	trans	-66.5	-38.8	174.3	-66	171	0	0	0	110.9	T201 G202 L208 I209	T201-I205 PolarHBondContact O-N 3.41Å; G202-I205 PolarHBondContact O-N 3.46Å; I205-L208 WeakPolarHBondContact O-CB 3.36Å; I205-L208 PolarHBondContact O-N 3.09Å; I205-I209 HydrophobicContact CG2-CD1 3.84Å; I205-I209 HydrophobicContact CG2-CG1 4.36Å; I205-I209 PolarHBondContact O-N 3.33Å
206	G	92.4	Very high	88.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-54.5	-51.3	179.6	0	0	0	0	0	114.1	V31 T34 L35 G202 I204 L208 I209 G210	V31-G206 WeakPolarHBondContact O-CA 3.39Å; T34-G206 WeakPolarHBondContact OG1-CA 3.44Å; L35-G206 WeakPolarHBondContact CA-O 3.23Å; G202-G206 PolarHBondContact O-N 3.29Å; I204-G206 VanDerWaalsContact C-N 3.35Å; G206-L208 VanDerWaalsContact C-N 3.28Å; G206-L208 PolarHBondContact O-N 3.34Å; G206-I209 PolarHBondContact O-N 3.15Å; G206-G210 PolarHBondContact O-N 3.29Å
207	P	92.8	Very high	89.1	Confident	27 Å²	27	39.1 Å²	39.1	18%	0.175	21%	0.213	C	C	.	.	H	α-helix	trans	-55.6	-40	176.9	-31.4	37.2	0	0	0	113.6	T34 S38 A203 I204 G210 L211 L363	T34-P207 WeakPolarHBondContact OG1-CD 3.46Å; S38-P207 WeakPolarHBondContact OG-CA 3.42Å; S38-P207 PolarHBondContact OG-O 2.95Å; A203-P207 WeakPolarHBondContact O-CD 3.34Å; I204-P207 VanDerWaalsContact O-CD 3.32Å; I204-P207 WeakPolarHBondContact O-CD 3.44Å; P207-G210 PolarHBondContact O-N 3.08Å; P207-L211 WeakPolarHBondContact O-CB 3.48Å; P207-L211 VanDerWaalsContact O-CG 3.28Å; P207-L211 WeakPolarHBondContact O-CG 3.45Å; P207-L211 PolarHBondContact O-N 3.3Å; P207-L363 HydrophobicContact CB-CD1 3.9Å; P207-L363 HydrophobicContact CB-CD2 4.16Å
208	L	92.7	Very high	90.2	Very high	58 Å²	58	37.6 Å²	37.6	30%	0.304	20%	0.197	S	C	.	.	H	α-helix	trans	-62.2	-49.7	179.4	-179	63.9	0	0	0	111.2	I205 G206 G210 L211 L212 L363	I205-L208 WeakPolarHBondContact O-CB 3.36Å; I205-L208 PolarHBondContact O-N 3.09Å; G206-L208 VanDerWaalsContact C-N 3.28Å; G206-L208 PolarHBondContact O-N 3.34Å; L208-G210 PolarHBondContact O-N 2.67Å; L208-L211 PolarHBondContact O-N 3.13Å; L208-L212 HydrophobicContact CG-CD1 4.43Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.2Å; L208-L212 PolarHBondContact O-N 2.94Å; L208-L212 VanDerWaalsContact O-N 3.07Å; L208-L363 HydrophobicContact CB-CD1 3.72Å; L208-L363 HydrophobicContact CD1-CD1 4.11Å; L208-L363 VanDerWaalsContact N-CD1 3.29Å
209	I	94.7	Very high	90.9	Very high	80 Å²	80	37.9 Å²	37.9	41%	0.41	20%	0.199	S	C	.	.	H	α-helix	trans	-61.3	-38.2	177.2	-58.9	171.6	0	0	0	110.1	V31 L35 I205 G206 L212 L213	V31-I209 HydrophobicContact CG1-CD1 4.29Å; L35-I209 HydrophobicContact CD1-CB 3.69Å; L35-I209 HydrophobicContact CD1-CG2 3.51Å; I205-I209 HydrophobicContact CG2-CD1 3.84Å; I205-I209 HydrophobicContact CG2-CG1 4.36Å; I205-I209 PolarHBondContact O-N 3.33Å; G206-I209 PolarHBondContact O-N 3.15Å; I209-L212 PolarHBondContact O-N 3.44Å; I209-L213 WeakPolarHBondContact O-CB 3.31Å; I209-L213 PolarHBondContact O-N 3.37Å
210	G	95.8	Very high	91.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-73.6	-35.6	-176	0	0	0	0	0	113.1	S38 G206 P207 L208 A214	S38-G210 WeakPolarHBondContact OG-CA 3.4Å; G206-G210 PolarHBondContact O-N 3.29Å; P207-G210 PolarHBondContact O-N 3.08Å; L208-G210 PolarHBondContact O-N 2.67Å; G210-A214 WeakPolarHBondContact O-CB 3.09Å; G210-A214 PolarHBondContact O-N 3.33Å
211	L	94.9	Very high	92	Very high	16 Å²	16	35.8 Å²	35.8	8%	0.084	19%	0.191	C	C	.	.	H	α-helix	trans	-67.7	-40.4	172.2	-69.5	175.5	0	0	0	111.4	S42 P207 L208 A214 S215 I355 I358 L363	S42-L211 WeakPolarHBondContact OG-CD2 3.08Å; P207-L211 WeakPolarHBondContact O-CB 3.48Å; P207-L211 VanDerWaalsContact O-CG 3.28Å; P207-L211 WeakPolarHBondContact O-CG 3.45Å; P207-L211 PolarHBondContact O-N 3.3Å; L208-L211 PolarHBondContact O-N 3.13Å; L211-A214 PolarHBondContact O-N 3.21Å; L211-S215 WeakPolarHBondContact O-CB 3.18Å; L211-S215 PolarHBondContact O-N 2.64Å; L211-I355 HydrophobicContact CB-CG2 4.2Å; L211-I355 HydrophobicContact CD2-CG2 3.89Å; L211-I355 VanDerWaalsContact O-CG2 3.22Å; L211-I355 WeakPolarHBondContact O-CG2 3.46Å; L211-I358 HydrophobicContact CD1-CG2 4.35Å; L211-L363 HydrophobicContact CD1-CD1 3.66Å; L211-L363 HydrophobicContact CD1-CG 4.27Å
212	L	95.6	Very high	92.6	Very high	76 Å²	76	32.8 Å²	32.8	40%	0.398	17%	0.173	S	C	.	.	H	α-helix	trans	-64	-44.8	175	-68	174.4	0	0	0	111.5	L208 I209 A214 S215 F216 F356	L208-L212 HydrophobicContact CG-CD1 4.43Å; L208-L212 VanDerWaalsContact O-CG 3.31Å; L208-L212 WeakPolarHBondContact O-CG 3.2Å; L208-L212 PolarHBondContact O-N 2.94Å; L208-L212 VanDerWaalsContact O-N 3.07Å; I209-L212 PolarHBondContact O-N 3.44Å; L212-A214 VanDerWaalsContact C-N 3.35Å; L212-S215 PolarHBondContact O-N 3.45Å; L212-F216 PolarHBondContact O-N 3.46Å; L212-F356 HydrophobicContact CD2-CD2 3.88Å; L212-F356 HydrophobicContact CD2-CE2 3.88Å
213	L	96.6	Very high	92.9	Very high	28 Å²	28	33.2 Å²	33.2	15%	0.147	18%	0.175	C	C	.	.	H	α-helix	trans	-62.4	-42.3	174.6	179.5	61.2	0	0	0	111.7	Y39 I209 F216 C217 I251	Y39-L213 HydrophobicContact CD2-CB 4.43Å; Y39-L213 HydrophobicContact CD2-CD2 4.18Å; Y39-L213 HydrophobicContact CD2-CG 4.07Å; Y39-L213 HydrophobicContact CE2-CD2 4.38Å; Y39-L213 HydrophobicContact CE2-CG 4.02Å; I209-L213 WeakPolarHBondContact O-CB 3.31Å; I209-L213 PolarHBondContact O-N 3.37Å; L213-F216 PolarHBondContact O-N 3.4Å; L213-C217 WeakPolarHBondContact O-CB 3.05Å; L213-C217 PolarHBondContact O-N 3.36Å; L213-C217 PolarHBondContact O-SG 2.88Å; L213-I251 HydrophobicContact CD1-CD1 3.77Å; L213-I251 HydrophobicContact CD2-CB 4.21Å; L213-I251 HydrophobicContact CD2-CD1 4.4Å; L213-I251 HydrophobicContact CD2-CG2 4Å
214	A	96.6	Very high	92.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-45.8	176.9	0	0	0	0	0	112.1	Y39 S42 M43 G210 L211 L212 F216 C217 A218 I355	Y39-A214 HydrophobicContact CD2-CB 3.78Å; Y39-A214 HydrophobicContact CE2-CB 4.1Å; S42-A214 VanDerWaalsContact CB-CB 3.46Å; M43-A214 HydrophobicContact CE-CB 3.69Å; M43-A214 WeakPolarHBondContact CE-O 3.36Å; G210-A214 WeakPolarHBondContact O-CB 3.09Å; G210-A214 PolarHBondContact O-N 3.33Å; L211-A214 PolarHBondContact O-N 3.21Å; L212-A214 VanDerWaalsContact C-N 3.35Å; A214-F216 VanDerWaalsContact C-N 3.32Å; A214-F216 PolarHBondContact O-N 3.44Å; A214-C217 PolarHBondContact O-N 3.31Å; A214-A218 VanDerWaalsContact O-CB 3.28Å; A214-A218 WeakPolarHBondContact O-CB 3.37Å; A214-A218 PolarHBondContact O-N 3.26Å; A214-I355 HydrophobicContact CB-CG2 3.88Å
215	S	96.9	Very high	92.3	Very high	15 Å²	15	38.3 Å²	38.3	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-45.5	176.2	174.7	0	0	0	0	111.3	L211 L212 A218 N219 S352 F356	L211-S215 WeakPolarHBondContact O-CB 3.18Å; L211-S215 PolarHBondContact O-N 2.64Å; L212-S215 PolarHBondContact O-N 3.45Å; S215-A218 PolarHBondContact O-N 3.45Å; S215-N219 PolarHBondContact O-N 2.86Å; S215-N219 VanDerWaalsContact O-N 3.17Å; S215-S352 WeakPolarHBondContact CB-O 2.96Å; S215-S352 VanDerWaalsContact O-CB 3.25Å; S215-S352 WeakPolarHBondContact O-CB 3.46Å; S215-S352 PolarHBondContact OG-O 2.91Å; S215-F356 WeakPolarHBondContact OG-CB 3.44Å
216	F	96.5	Very high	91.6	Very high	121 Å²	121	37.6 Å²	37.6	53%	0.531	23%	0.225	S	C	.	.	H	α-helix	trans	-59.2	-50.5	174.8	175.3	-98.1	0	0	0	112	L212 L213 A214 A218 N219 V220 F247	L212-F216 PolarHBondContact O-N 3.46Å; L213-F216 PolarHBondContact O-N 3.4Å; A214-F216 VanDerWaalsContact C-N 3.32Å; A214-F216 PolarHBondContact O-N 3.44Å; F216-A218 VanDerWaalsContact C-N 3.31Å; F216-A218 PolarHBondContact O-N 3.13Å; F216-N219 PolarHBondContact O-N 2.99Å; F216-V220 HydrophobicContact CE1-CG2 4.31Å; F216-V220 HydrophobicContact CE2-CG2 4.38Å; F216-V220 HydrophobicContact CZ-CG2 4.11Å; F216-V220 WeakPolarHBondContact O-CG2 3.4Å; F216-V220 PolarHBondContact O-N 3.38Å; F216-F247 HydrophobicContact CE1-CE1 4.42Å
217	C	96.3	Very high	90.9	Very high	1 Å²	1	40 Å²	40	1%	0.007	24%	0.239	C	C	.	.	H	α-helix	trans	-64.1	-35.7	179.8	-64.3	0	0	0	0	112.4	Y39 M43 L213 A214 N219 V220 G243 A244	Y39-C217 HydrophobicContact CE2-CB 4.17Å; Y39-C217 PolarHBondContact OH-SG 3.32Å; M43-C217 HydrophobicContact SD-CB 4.43Å; L213-C217 WeakPolarHBondContact O-CB 3.05Å; L213-C217 PolarHBondContact O-N 3.36Å; L213-C217 PolarHBondContact O-SG 2.88Å; A214-C217 PolarHBondContact O-N 3.31Å; C217-N219 VanDerWaalsContact C-N 3.27Å; C217-N219 PolarHBondContact O-N 2.84Å; C217-V220 PolarHBondContact O-N 3.25Å; C217-V220 VanDerWaalsContact O-O 3.11Å; C217-G243 CarbonylContact O-C 3.56Å; C217-G243 WeakPolarHBondContact O-CA 3.37Å; C217-A244 PolarHBondContact O-N 2.92Å
218	A	94.9	Very high	90.1	Very high	1 Å²	1	44 Å²	44	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-66.2	-29.8	177.9	0	0	0	0	0	112.5	M43 A214 S215 F216 W241 I355	M43-A218 HydrophobicContact CE-CB 4.08Å; A214-A218 VanDerWaalsContact O-CB 3.28Å; A214-A218 WeakPolarHBondContact O-CB 3.37Å; A214-A218 PolarHBondContact O-N 3.26Å; S215-A218 PolarHBondContact O-N 3.45Å; F216-A218 VanDerWaalsContact C-N 3.31Å; F216-A218 PolarHBondContact O-N 3.13Å; A218-W241 PolarHBondContact O-NE1 3.43Å; A218-I355 HydrophobicContact CB-CD1 4.13Å
219	N	94.3	Very high	89.3	Confident	89 Å²	89	44.7 Å²	44.7	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-82.5	-15.5	179.2	-166.4	43.9	0	0	0	113.7	S215 F216 C217 P236 W241	S215-N219 PolarHBondContact O-N 2.86Å; S215-N219 VanDerWaalsContact O-N 3.17Å; F216-N219 PolarHBondContact O-N 2.99Å; C217-N219 VanDerWaalsContact C-N 3.27Å; C217-N219 PolarHBondContact O-N 2.84Å; N219-P236 WeakPolarHBondContact OD1-CG 3.5Å; N219-W241 WeakPolarHBondContact O-CZ2 3.36Å
220	V	92.8	Very high	88.3	Confident	38 Å²	38	47 Å²	47	23%	0.23	28%	0.279	C	S	.	.	S	Bend	trans	-96.7	129.8	178.8	176.5	0	0	0	0	109	F216 C217 T224 G243 A244	F216-V220 HydrophobicContact CE1-CG2 4.31Å; F216-V220 HydrophobicContact CE2-CG2 4.38Å; F216-V220 HydrophobicContact CZ-CG2 4.11Å; F216-V220 WeakPolarHBondContact O-CG2 3.4Å; F216-V220 PolarHBondContact O-N 3.38Å; C217-V220 PolarHBondContact O-N 3.25Å; C217-V220 VanDerWaalsContact O-O 3.11Å; V220-T224 HydrophobicContact CG1-CG2 3.73Å; V220-G243 CarbonylContact O-C 3.59Å; V220-G243 WeakPolarHBondContact O-CA 3.4Å; V220-A244 HydrophobicContact CB-CB 4.26Å; V220-A244 HydrophobicContact CG1-CB 4.16Å; V220-A244 PolarHBondContact O-N 3.27Å
221	Y	92.1	Very high	87.3	Confident	8 Å²	8	49.7 Å²	49.7	3%	0.031	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-61	143.2	-179.3	-171.5	-112.3	0	0	0	112.3	Y113 D223 T224 L232 I234 W241	Y113-Y221 HydrophobicContact CD1-CE2 4.38Å; Y113-Y221 WeakPolarHBondContact CD1-OH 3.13Å; Y221-D223 VanDerWaalsContact C-N 3.3Å; Y221-D223 HydrophobicContact CD1-CB 4.22Å; Y221-D223 HydrophobicContact CE1-CB 3.97Å; Y221-D223 PolarHBondContact O-N 3Å; Y221-T224 WeakPolarHBondContact O-CB 3.2Å; Y221-T224 PolarHBondContact O-N 3.11Å; Y221-T224 VanDerWaalsContact O-N 3.16Å; Y221-L232 HydrophobicContact CD1-CD1 4Å; Y221-L232 HydrophobicContact CD2-CD1 4.12Å; Y221-L232 HydrophobicContact CE1-CD1 4.36Å; Y221-L232 HydrophobicContact CE1-CD2 4.23Å; Y221-L232 HydrophobicContact CE2-CD1 4.48Å; Y221-L232 HydrophobicContact CG-CD1 3.86Å; Y221-I234 HydrophobicContact CE2-CD1 3.96Å; Y221-W241 HydrophobicContact CD2-CD2 4.27Å; Y221-W241 AromaticContact CD2-CE3 3.99Å; Y221-W241 HydrophobicContact CD2-CE3 3.99Å; Y221-W241 HydrophobicContact CD2-CH2 4.08Å; Y221-W241 HydrophobicContact CD2-CZ2 4.34Å; Y221-W241 AromaticContact CD2-CZ3 3.89Å; Y221-W241 HydrophobicContact CD2-CZ3 3.89Å; Y221-W241 HydrophobicContact CG-CH2 4.32Å; Y221-W241 HydrophobicContact CG-CZ3 4.47Å
222	V	90.4	Very high	86.7	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-39.9	-172.5	62.9	0	0	0	0	114.5	H107 Y113 V242 W246	H107-V222 PolarHBondContact CE1-O 3.34Å; H107-V222 VanDerWaalsContact CE1-O 3.23Å; Y113-V222 HydrophobicContact CD1-CG1 3.82Å; Y113-V222 HydrophobicContact CG-CG1 3.98Å; V222-V242 HydrophobicContact CB-CB 4.24Å; V222-V242 HydrophobicContact CB-CG1 4Å; V222-V242 WeakPolarHBondContact CB-O 3.32Å; V222-V242 HydrophobicContact CG1-CB 4.15Å; V222-V242 HydrophobicContact CG1-CG1 4.34Å; V222-V242 HydrophobicContact CG2-CG1 4.24Å; V222-V242 PolarHBondContact N-O 2.68Å; V222-W246 PolarHBondContact O-NE1 3.05Å
223	D	86.6	Confident	86.1	Confident	11 Å²	11	45.8 Å²	45.8	6%	0.059	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	28.9	-176.2	-67.8	-27.9	0	0	0	112.9	H107 Y113 Y221 G225 S226 V227	H107-D223 IonicContact CE1-OD1 2.58Å; H107-D223 PolarHBondContact CE1-OD1 3.15Å; H107-D223 VanDerWaalsContact CE1-OD1 3.26Å; H107-D223 IonicContact ND1-OD1 3.3Å; Y113-D223 WeakPolarHBondContact CB-OD2 3.08Å; Y113-D223 PolarHBondContact N-OD2 3.25Å; Y221-D223 VanDerWaalsContact C-N 3.3Å; Y221-D223 HydrophobicContact CD1-CB 4.22Å; Y221-D223 HydrophobicContact CE1-CB 3.97Å; Y221-D223 PolarHBondContact O-N 3Å; D223-G225 PolarHBondContact O-N 3.26Å; D223-S226 PolarHBondContact O-N 3.27Å; D223-S226 PolarHBondContact O-OG 3.25Å; D223-V227 HydrophobicContact CB-CG2 4.37Å; D223-V227 PolarHBondContact O-N 3.45Å
224	T	81.6	Confident	85.7	Confident	70 Å²	70	44.7 Å²	44.7	43%	0.429	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-51.7	132.1	177.9	-164.9	0	0	0	0	111.5	V220 Y221	V220-T224 HydrophobicContact CG1-CG2 3.73Å; Y221-T224 WeakPolarHBondContact O-CB 3.2Å; Y221-T224 PolarHBondContact O-N 3.11Å; Y221-T224 VanDerWaalsContact O-N 3.16Å
225	G	76.1	Confident	85.2	Confident	81 Å²	81	47 Å²	47	84%	0.835	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-14.7	-176.2	0	0	0	0	0	115.4	D223	D223-G225 PolarHBondContact O-N 3.26Å
226	S	73.9	Confident	84.8	Confident	70 Å²	70	47.9 Å²	47.9	49%	0.49	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-21.8	171.3	75	0	0	0	0	113.7	D223	D223-S226 PolarHBondContact O-N 3.27Å; D223-S226 PolarHBondContact O-OG 3.25Å
227	V	78	Confident	84.4	Confident	49 Å²	49	46 Å²	46	30%	0.297	29%	0.286	S	S	.	.	B	Isolated β-bridge	trans	-123	139.3	176.7	-178.6	0	0	0	0	109	D223 T229 L232	D223-V227 HydrophobicContact CB-CG2 4.37Å; D223-V227 PolarHBondContact O-N 3.45Å; V227-T229 PolarHBondContact O-N 3.46Å; V227-L232 HydrophobicContact CG1-CD2 4.12Å
228	N	74.9	Confident	84.1	Confident	113 Å²	113	46.4 Å²	46.4	60%	0.604	29%	0.287	S	S	*	.			trans	-70.5	120.9	171	-69.2	-31.1	0	0	0	109.2	D230 D231	N228-D230 PolarHBondContact O-N 3.05Å; N228-D231 HydrophobicContact CB-CB 4.5Å; N228-D231 WeakPolarHBondContact CB-OD2 3.39Å; N228-D231 PolarHBondContact ND2-OD2 3.16Å; N228-D231 PolarHBondContact O-N 3.28Å
229	T	75.6	Confident	83.7	Confident	72 Å²	72	47 Å²	47	44%	0.442	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-63.8	-24.9	-179.7	47.9	0	0	0	0	113.2	V227 D231 L232	V227-T229 PolarHBondContact O-N 3.46Å; T229-D231 VanDerWaalsContact C-N 3.25Å; T229-D231 PolarHBondContact O-N 3.13Å; T229-L232 HydrophobicContact CG2-CD1 4.39Å; T229-L232 WeakPolarHBondContact O-CB 2.98Å; T229-L232 PolarHBondContact O-N 2.95Å
230	D	73.1	Confident	83.5	Confident	129 Å²	129	42.8 Å²	42.8	69%	0.69	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-72.6	-21.3	-178.8	-59.1	-23.6	0	0	0	112.5	N228 L232	N228-D230 PolarHBondContact O-N 3.05Å; D230-L232 VanDerWaalsContact C-N 3.35Å
231	D	75.3	Confident	83.5	Confident	55 Å²	55	41.8 Å²	41.8	29%	0.294	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-85.9	-9.4	177.6	-61.9	-29.9	0	0	0	112.2	V121 N228 T229	V121-D231 HydrophobicContact CG1-CB 4.21Å; N228-D231 HydrophobicContact CB-CB 4.5Å; N228-D231 WeakPolarHBondContact CB-OD2 3.39Å; N228-D231 PolarHBondContact ND2-OD2 3.16Å; N228-D231 PolarHBondContact O-N 3.28Å; T229-D231 VanDerWaalsContact C-N 3.25Å; T229-D231 PolarHBondContact O-N 3.13Å
232	L	82.8	Confident	83.5	Confident	8 Å²	8	41.4 Å²	41.4	4%	0.042	26%	0.259	C	S	.	.			trans	-72.7	138.4	-178.9	-64.5	174.3	0	0	0	111.2	Y115 Y221 V227 T229 D230 W241 G476 I477	Y115-L232 HydrophobicContact CE1-CD2 4.25Å; Y221-L232 HydrophobicContact CD1-CD1 4Å; Y221-L232 HydrophobicContact CD2-CD1 4.12Å; Y221-L232 HydrophobicContact CE1-CD1 4.36Å; Y221-L232 HydrophobicContact CE1-CD2 4.23Å; Y221-L232 HydrophobicContact CE2-CD1 4.48Å; Y221-L232 HydrophobicContact CG-CD1 3.86Å; V227-L232 HydrophobicContact CG1-CD2 4.12Å; T229-L232 HydrophobicContact CG2-CD1 4.39Å; T229-L232 WeakPolarHBondContact O-CB 2.98Å; T229-L232 PolarHBondContact O-N 2.95Å; D230-L232 VanDerWaalsContact C-N 3.35Å; L232-W241 HydrophobicContact CD1-CZ3 4.39Å; L232-G476 CarbonylContact O-C 3.13Å; L232-G476 WeakPolarHBondContact O-CA 3.28Å; L232-I477 VanDerWaalsContact O-CG2 3.24Å; L232-I477 WeakPolarHBondContact O-CG2 3.03Å; L232-I477 PolarHBondContact O-N 3.42Å
233	T	82.9	Confident	83.7	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	26%	0.259	C	S	.	.			trans	-98.7	10.4	176.7	57	0	0	0	0	113	Y115 V119 L497	Y115-T233 PolarHBondContact OH-OG1 3.4Å; V119-T233 HydrophobicContact CB-CG2 4.42Å; V119-T233 HydrophobicContact CG1-CG2 4.41Å; T233-L497 WeakPolarHBondContact O-CD1 3.44Å
234	I	87.4	Confident	84.1	Confident	4 Å²	4	41 Å²	41	2%	0.021	26%	0.258	C	S	.	.			trans	-125.7	147.7	-175.5	56.2	169.6	0	0	0	110.7	Y115 Y221 D238 W241	Y115-I234 HydrophobicContact CD1-CD1 4Å; Y115-I234 HydrophobicContact CD2-CD1 4.28Å; Y115-I234 HydrophobicContact CD2-CG2 4.21Å; Y115-I234 HydrophobicContact CE1-CD1 3.88Å; Y115-I234 HydrophobicContact CE1-CG1 4.39Å; Y115-I234 HydrophobicContact CE2-CD1 4.15Å; Y115-I234 HydrophobicContact CE2-CG1 4.34Å; Y115-I234 HydrophobicContact CE2-CG2 3.74Å; Y115-I234 HydrophobicContact CG-CD1 4.21Å; Y221-I234 HydrophobicContact CE2-CD1 3.96Å; I234-D238 HydrophobicContact CB-CB 4.21Å; I234-D238 HydrophobicContact CG2-CB 4.43Å; I234-W241 HydrophobicContact CD1-CE3 4.14Å; I234-W241 HydrophobicContact CG1-CE3 4.07Å
235	T	87.7	Confident	84.7	Confident	48 Å²	48	37.7 Å²	37.7	29%	0.294	24%	0.237	S	C	.	.			trans	-113.5	165.7	178	59.3	0	0	0	0	110.4	T237 D238 W241 I477	T235-T237 PolarHBondContact O-N 3.03Å; T235-T237 PolarHBondContact OG1-OG1 3.08Å; T235-D238 VanDerWaalsContact O-CB 3.31Å; T235-D238 WeakPolarHBondContact O-CB 3.23Å; T235-D238 PolarHBondContact O-N 2.04Å; T235-W241 WeakPolarHBondContact O-CB 3.49Å; T235-I477 HydrophobicContact CG2-CG2 4.25Å
236	P	88.6	Confident	85.6	Confident	34 Å²	34	35.5 Å²	35.5	22%	0.221	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-14.9	177.2	-26.6	35.3	0	0	0	115.8	N219 W241 S350	N219-P236 WeakPolarHBondContact OD1-CG 3.5Å; P236-W241 HydrophobicContact CB-CD2 4.42Å; P236-W241 HydrophobicContact CG-CD2 4.36Å; P236-W241 HydrophobicContact CG-CH2 4.22Å; P236-W241 HydrophobicContact CG-CZ2 3.98Å; P236-S350 WeakPolarHBondContact O-CB 3.38Å
237	T	88.2	Confident	86.6	Confident	83 Å²	83	36.1 Å²	36.1	51%	0.509	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.3	173.3	51.7	0	0	0	0	112.7	T235	T235-T237 PolarHBondContact O-N 3.03Å; T235-T237 PolarHBondContact OG1-OG1 3.08Å
238	D	88.8	Confident	87.4	Confident	8 Å²	8	33.8 Å²	33.8	4%	0.043	18%	0.184	C	C	.	.	S	Bend	trans	-71.4	136.4	178.1	-164.6	-52.3	0	0	0	111	R49 I234 T235 R240 W241	R49-D238 PolarHBondContact NH1-O 2.88Å; I234-D238 HydrophobicContact CB-CB 4.21Å; I234-D238 HydrophobicContact CG2-CB 4.43Å; T235-D238 VanDerWaalsContact O-CB 3.31Å; T235-D238 WeakPolarHBondContact O-CB 3.23Å; T235-D238 PolarHBondContact O-N 2.04Å; D238-R240 PolarHBondContact O-N 3.26Å; D238-R240 WeakPolarHBondContact OD1-CB 3.48Å; D238-R240 WeakPolarHBondContact OD1-CG 3.01Å; D238-R240 IonicContact OD1-CZ 3.86Å; D238-R240 PolarHBondContact OD1-N 3.17Å; D238-R240 IonicContact OD1-NE 2.86Å; D238-R240 PolarHBondContact OD1-NE 2.88Å; D238-R240 VanDerWaalsContact OD1-NE 3.09Å; D238-R240 IonicContact OD2-CZ 2.71Å; D238-R240 IonicContact OD2-NE 2.72Å; D238-R240 PolarHBondContact OD2-NE 2.88Å; D238-R240 IonicContact OD2-NH2 3.83Å; D238-R240 PolarHBondContact OD2-NH2 3.15Å; D238-W241 WeakPolarHBondContact O-CB 3.46Å; D238-W241 PolarHBondContact O-N 3.24Å
239	T	87.8	Confident	88.5	Confident	14 Å²	14	28.4 Å²	28.4	9%	0.086	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.9	177.4	59.8	0	0	0	0	114.7	R49 W450 R590	R49-T239 WeakPolarHBondContact CD-O 3.43Å; R49-T239 PolarHBondContact NE-O 3.26Å; T239-W450 PolarHBondContact OG1-NE1 3.34Å; T239-R590 WeakPolarHBondContact CG2-O 3.32Å
240	R	89.9	Confident	89.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-16	174	-64	172.1	-70.2	176.7	-3.4	112.6	Y113 E116 D238 V242 W450 D451	Y113-R240 WeakPolarHBondContact CE1-O 3.5Å; Y113-R240 PolarHBondContact OH-O 3.27Å; E116-R240 VanDerWaalsContact O-CD 3.24Å; E116-R240 WeakPolarHBondContact O-CD 3.43Å; E116-R240 PolarHBondContact O-NH1 3.29Å; D238-R240 PolarHBondContact O-N 3.26Å; D238-R240 WeakPolarHBondContact OD1-CB 3.48Å; D238-R240 WeakPolarHBondContact OD1-CG 3.01Å; D238-R240 IonicContact OD1-CZ 3.86Å; D238-R240 PolarHBondContact OD1-N 3.17Å; D238-R240 IonicContact OD1-NE 2.86Å; D238-R240 PolarHBondContact OD1-NE 2.88Å; D238-R240 VanDerWaalsContact OD1-NE 3.09Å; D238-R240 IonicContact OD2-CZ 2.71Å; D238-R240 IonicContact OD2-NE 2.72Å; D238-R240 PolarHBondContact OD2-NE 2.88Å; D238-R240 IonicContact OD2-NH2 3.83Å; D238-R240 PolarHBondContact OD2-NH2 3.15Å; R240-V242 PolarHBondContact O-N 2.89Å; R240-W450 WeakPolarHBondContact CD-O 3.28Å; R240-W450 PolarHBondContact NH1-O 3.21Å; R240-D451 IonicContact CZ-OD1 3.45Å; R240-D451 IonicContact NH1-OD1 2.82Å; R240-D451 PolarHBondContact NH1-OD1 3.31Å; R240-D451 IonicContact NH1-OD2 3.19Å; R240-D451 IonicContact NH2-OD1 2.78Å; R240-D451 PolarHBondContact NH2-OD1 3.26Å
241	W	91.9	Very high	90.7	Very high	18 Å²	18	24.2 Å²	24.2	7%	0.068	13%	0.129	C	C	.	.			trans	-64.1	128.2	177.5	-178.5	-87.5	0	0	0	110.8	R49 A218 N219 Y221 L232 I234 T235 P236 D238	R49-W241 VanDerWaalsContact CD-O 3.3Å; R49-W241 WeakPolarHBondContact CD-O 3.19Å; R49-W241 PolarHBondContact NH1-O 3.21Å; R49-W241 VanDerWaalsContact NH1-O 3.07Å; A218-W241 PolarHBondContact O-NE1 3.43Å; N219-W241 WeakPolarHBondContact O-CZ2 3.36Å; Y221-W241 HydrophobicContact CD2-CD2 4.27Å; Y221-W241 AromaticContact CD2-CE3 3.99Å; Y221-W241 HydrophobicContact CD2-CE3 3.99Å; Y221-W241 HydrophobicContact CD2-CH2 4.08Å; Y221-W241 HydrophobicContact CD2-CZ2 4.34Å; Y221-W241 AromaticContact CD2-CZ3 3.89Å; Y221-W241 HydrophobicContact CD2-CZ3 3.89Å; Y221-W241 HydrophobicContact CG-CH2 4.32Å; Y221-W241 HydrophobicContact CG-CZ3 4.47Å; L232-W241 HydrophobicContact CD1-CZ3 4.39Å; I234-W241 HydrophobicContact CD1-CE3 4.14Å; I234-W241 HydrophobicContact CG1-CE3 4.07Å; T235-W241 WeakPolarHBondContact O-CB 3.49Å; P236-W241 HydrophobicContact CB-CD2 4.42Å; P236-W241 HydrophobicContact CG-CD2 4.36Å; P236-W241 HydrophobicContact CG-CH2 4.22Å; P236-W241 HydrophobicContact CG-CZ2 3.98Å; D238-W241 WeakPolarHBondContact O-CB 3.46Å; D238-W241 PolarHBondContact O-N 3.24Å
242	V	92.8	Very high	91.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.115	C	C	.	.			trans	-118.7	121.4	170.4	-176.9	0	0	0	0	108.5	Q46 R49 Q50 Y113 V222 R240	Q46-V242 HydrophobicContact CB-CG1 4.44Å; R49-V242 HydrophobicContact CB-CG2 3.67Å; Q50-V242 HydrophobicContact CB-CG1 4.08Å; Y113-V242 HydrophobicContact CD1-CB 4.34Å; Y113-V242 HydrophobicContact CD1-CG2 4.3Å; Y113-V242 HydrophobicContact CE1-CB 4.02Å; Y113-V242 HydrophobicContact CE1-CG2 3.6Å; Y113-V242 HydrophobicContact CE2-CG2 3.91Å; Y113-V242 WeakPolarHBondContact OH-CG2 2.91Å; V222-V242 HydrophobicContact CB-CB 4.24Å; V222-V242 HydrophobicContact CB-CG1 4Å; V222-V242 WeakPolarHBondContact CB-O 3.32Å; V222-V242 HydrophobicContact CG1-CB 4.15Å; V222-V242 HydrophobicContact CG1-CG1 4.34Å; V222-V242 HydrophobicContact CG2-CG1 4.24Å; V222-V242 PolarHBondContact N-O 2.68Å; R240-V242 PolarHBondContact O-N 2.89Å
243	G	93.6	Very high	92.5	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-76.2	164.9	174.6	0	0	0	0	0	112.7	C217 V220 W245	C217-G243 CarbonylContact O-C 3.56Å; C217-G243 WeakPolarHBondContact O-CA 3.37Å; V220-G243 CarbonylContact O-C 3.59Å; V220-G243 WeakPolarHBondContact O-CA 3.4Å; G243-W245 PolarHBondContact O-N 3.23Å
244	A	94.6	Very high	93.2	Very high	3 Å²	3	23.2 Å²	23.2	3%	0.025	13%	0.132	C	C	.	.			trans	-70.6	59.5	178.2	0	0	0	0	0	113	C217 V220 W246 F247	C217-A244 PolarHBondContact O-N 2.92Å; V220-A244 HydrophobicContact CB-CB 4.26Å; V220-A244 HydrophobicContact CG1-CB 4.16Å; V220-A244 PolarHBondContact O-N 3.27Å; A244-W246 PolarHBondContact O-N 3.41Å; A244-F247 HydrophobicContact CB-CB 4.37Å; A244-F247 WeakPolarHBondContact O-CB 3.33Å; A244-F247 PolarHBondContact O-N 3.5Å; A244-F247 VanDerWaalsContact O-N 3.15Å
245	W	94.8	Very high	93.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.4	-23.2	-176.1	63.8	-97.6	0	0	0	113.7	Y39 M43 Q46 I47 Q50 F51 K103 P106 V161 G243 F249	Y39-W245 WeakPolarHBondContact CE1-O 3.5Å; Y39-W245 PolarHBondContact OH-O 3.34Å; M43-W245 HydrophobicContact CB-CB 4.15Å; M43-W245 HydrophobicContact CG-CB 4.09Å; M43-W245 HydrophobicContact SD-CB 3.81Å; Q46-W245 HydrophobicContact CB-CB 3.94Å; Q46-W245 HydrophobicContact CB-CG 4.35Å; I47-W245 HydrophobicContact CG1-CD2 4.31Å; I47-W245 HydrophobicContact CG1-CE3 4.22Å; Q50-W245 HydrophobicContact CG-CZ2 4.24Å; F51-W245 HydrophobicContact CE2-CH2 4.39Å; F51-W245 HydrophobicContact CE2-CZ2 4.27Å; F51-W245 HydrophobicContact CZ-CH2 4.29Å; F51-W245 HydrophobicContact CZ-CZ2 4.18Å; K103-W245 WeakPolarHBondContact O-CZ3 3.49Å; P106-W245 HydrophobicContact CB-CH2 4.04Å; P106-W245 HydrophobicContact CB-CZ2 4.47Å; P106-W245 HydrophobicContact CG-CH2 4.25Å; V161-W245 HydrophobicContact CG2-CH2 4.35Å; V161-W245 HydrophobicContact CG2-CZ3 4.38Å; G243-W245 PolarHBondContact O-N 3.23Å; W245-F249 AromaticContact CE3-CD2 3.84Å; W245-F249 HydrophobicContact CE3-CD2 3.84Å; W245-F249 AromaticContact CE3-CE2 3.68Å; W245-F249 HydrophobicContact CE3-CE2 3.68Å; W245-F249 HydrophobicContact CZ3-CD2 4.05Å; W245-F249 HydrophobicContact CZ3-CE2 4.01Å; W245-F249 WeakPolarHBondContact O-CD2 3.37Å
246	W	94.8	Very high	94.1	Very high	34 Å²	34	23.1 Å²	23.1	13%	0.129	13%	0.132	C	C	.	.	H	α-helix	trans	-75.4	-31.5	178.4	60	-93.9	0	0	0	112.4	S104 H107 F108 V222 A244 F249 L250	S104-W246 WeakPolarHBondContact CB-O 3.46Å; H107-W246 HydrophobicContact CB-CB 3.7Å; H107-W246 HydrophobicContact CB-CD2 4.37Å; H107-W246 HydrophobicContact CB-CG 3.66Å; H107-W246 AromaticContact CD2-CD1 3.52Å; H107-W246 AromaticContact CD2-CD2 3.43Å; H107-W246 VanDerWaalsContact CD2-CD2 3.43Å; H107-W246 AromaticContact CD2-CE2 3.33Å; H107-W246 AromaticContact CD2-CG 3.58Å; H107-W246 AromaticContact CD2-CZ2 3.91Å; H107-W246 AromaticContact CD2-NE1 3.37Å; H107-W246 PolarHBondContact CD2-NE1 3.09Å; H107-W246 AromaticContact CE1-CD1 3.74Å; H107-W246 AromaticContact CE1-CE2 3.87Å; H107-W246 AromaticContact CE1-NE1 3.28Å; H107-W246 PolarHBondContact CE1-NE1 3.27Å; H107-W246 VanDerWaalsContact CE1-NE1 3.28Å; H107-W246 AromaticContact CG-CD1 3.25Å; H107-W246 AromaticContact CG-CD2 3.89Å; H107-W246 AromaticContact CG-CE2 3.93Å; H107-W246 AromaticContact CG-CG 3.5Å; H107-W246 VanDerWaalsContact CG-CG 3.5Å; H107-W246 AromaticContact CG-NE1 3.52Å; H107-W246 AromaticContact ND1-CD1 3.41Å; H107-W246 AromaticContact ND1-NE1 3.48Å; H107-W246 PolarHBondContact ND1-NE1 3.26Å; H107-W246 AromaticContact NE2-CD1 3.82Å; H107-W246 AromaticContact NE2-CD2 3.92Å; H107-W246 AromaticContact NE2-CE2 3.28Å; H107-W246 VanDerWaalsContact NE2-CE2 3.28Å; H107-W246 AromaticContact NE2-CZ2 3.56Å; H107-W246 AromaticContact NE2-NE1 3.2Å; H107-W246 PolarHBondContact NE2-NE1 3.29Å; F108-W246 HydrophobicContact CE1-CZ3 4.4Å; F108-W246 HydrophobicContact CE2-CE3 4.31Å; F108-W246 AromaticContact CZ-CE3 3.78Å; F108-W246 HydrophobicContact CZ-CE3 3.78Å; F108-W246 AromaticContact CZ-CZ3 3.82Å; F108-W246 HydrophobicContact CZ-CZ3 3.82Å; V222-W246 PolarHBondContact O-NE1 3.05Å; A244-W246 PolarHBondContact O-N 3.41Å; W246-F249 WeakPolarHBondContact O-CB 3.38Å; W246-F249 PolarHBondContact O-N 3.15Å; W246-L250 HydrophobicContact CE3-CD1 3.78Å; W246-L250 HydrophobicContact CZ3-CD1 3.74Å; W246-L250 PolarHBondContact O-N 2.91Å
247	F	95.1	Very high	94.5	Very high	84 Å²	84	24.6 Å²	24.6	37%	0.368	14%	0.14	S	C	.	.	H	α-helix	trans	-67.3	-46.2	-170.6	177.5	-111.1	0	0	0	112	F216 A244 F249 L250 I251	F216-F247 HydrophobicContact CE1-CE1 4.42Å; A244-F247 HydrophobicContact CB-CB 4.37Å; A244-F247 WeakPolarHBondContact O-CB 3.33Å; A244-F247 PolarHBondContact O-N 3.5Å; A244-F247 VanDerWaalsContact O-N 3.15Å; F247-F249 VanDerWaalsContact C-N 3.26Å; F247-F249 PolarHBondContact O-N 2.55Å; F247-L250 WeakPolarHBondContact O-CB 3.45Å; F247-L250 PolarHBondContact O-N 3.3Å; F247-L250 VanDerWaalsContact O-N 3.14Å; F247-I251 HydrophobicContact CD1-CD1 3.98Å; F247-I251 HydrophobicContact CE1-CD1 3.47Å; F247-I251 VanDerWaalsContact CE1-CD1 3.47Å; F247-I251 HydrophobicContact CZ-CD1 3.81Å; F247-I251 PolarHBondContact O-N 2.94Å
248	G	95.6	Very high	94.9	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69.6	-23.7	178.1	0	0	0	0	0	113	Y39 L250 I251 C252	Y39-G248 WeakPolarHBondContact OH-CA 3.49Å; Y39-G248 PolarHBondContact OH-N 2.95Å; G248-L250 VanDerWaalsContact C-N 3.34Å; G248-I251 PolarHBondContact O-N 3.29Å; G248-C252 WeakPolarHBondContact O-CB 3.29Å; G248-C252 PolarHBondContact O-N 3.39Å; G248-C252 PolarHBondContact O-SG 2.93Å
249	F	97.4	Very high	95.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-34.4	170.6	-75.2	-46.7	0	0	0	112.5	Y39 M40 I47 K103 W245 W246 F247 C252 A253	Y39-F249 AromaticContact CD1-CD1 3.58Å; Y39-F249 HydrophobicContact CD1-CD1 3.58Å; Y39-F249 AromaticContact CD1-CE1 3.51Å; Y39-F249 HydrophobicContact CD1-CE1 3.51Å; Y39-F249 HydrophobicContact CD1-CG 4.18Å; Y39-F249 HydrophobicContact CD1-CZ 4.09Å; Y39-F249 HydrophobicContact CE1-CB 4.45Å; Y39-F249 AromaticContact CE1-CD1 3.7Å; Y39-F249 HydrophobicContact CE1-CD1 3.7Å; Y39-F249 HydrophobicContact CE1-CD2 4.08Å; Y39-F249 AromaticContact CE1-CE1 3.82Å; Y39-F249 HydrophobicContact CE1-CE1 3.82Å; Y39-F249 HydrophobicContact CE1-CE2 4.22Å; Y39-F249 AromaticContact CE1-CG 3.81Å; Y39-F249 HydrophobicContact CE1-CG 3.81Å; Y39-F249 HydrophobicContact CE1-CZ 4.07Å; M40-F249 HydrophobicContact CB-CE1 4.29Å; M40-F249 HydrophobicContact SD-CE1 3.99Å; M40-F249 HydrophobicContact SD-CZ 3.6Å; I47-F249 HydrophobicContact CD1-CE2 4.37Å; I47-F249 HydrophobicContact CD1-CZ 4.45Å; K103-F249 HydrophobicContact CB-CD1 4.33Å; K103-F249 HydrophobicContact CB-CD2 3.89Å; K103-F249 HydrophobicContact CB-CE2 4.06Å; K103-F249 HydrophobicContact CB-CG 4.05Å; K103-F249 HydrophobicContact CB-CZ 4.39Å; K103-F249 HydrophobicContact CD-CD1 4.42Å; K103-F249 HydrophobicContact CD-CE1 4.01Å; K103-F249 HydrophobicContact CD-CZ 4.1Å; K103-F249 VanDerWaalsContact NZ-CE1 3.32Å; W245-F249 AromaticContact CE3-CD2 3.84Å; W245-F249 HydrophobicContact CE3-CD2 3.84Å; W245-F249 AromaticContact CE3-CE2 3.68Å; W245-F249 HydrophobicContact CE3-CE2 3.68Å; W245-F249 HydrophobicContact CZ3-CD2 4.05Å; W245-F249 HydrophobicContact CZ3-CE2 4.01Å; W245-F249 WeakPolarHBondContact O-CD2 3.37Å; W246-F249 WeakPolarHBondContact O-CB 3.38Å; W246-F249 PolarHBondContact O-N 3.15Å; F247-F249 VanDerWaalsContact C-N 3.26Å; F247-F249 PolarHBondContact O-N 2.55Å; F249-C252 PolarHBondContact O-N 3.34Å; F249-A253 WeakPolarHBondContact O-CB 3.47Å; F249-A253 PolarHBondContact O-N 2.98Å
250	L	97.4	Very high	95.6	Very high	52 Å²	52	26 Å²	26	27%	0.272	15%	0.145	S	C	.	.	H	α-helix	trans	-67.4	-41.8	173.1	-66.5	174	0	0	0	111.9	F101 S104 F108 W246 F247 G248 C252 A253 G254	F101-L250 HydrophobicContact CD2-CD2 3.84Å; F101-L250 HydrophobicContact CE2-CD2 4.19Å; S104-L250 VanDerWaalsContact OG-CD2 3.24Å; S104-L250 WeakPolarHBondContact OG-CD2 3.35Å; F108-L250 HydrophobicContact CE2-CD1 4.19Å; F108-L250 HydrophobicContact CZ-CD1 3.92Å; W246-L250 HydrophobicContact CE3-CD1 3.78Å; W246-L250 HydrophobicContact CZ3-CD1 3.74Å; W246-L250 PolarHBondContact O-N 2.91Å; F247-L250 WeakPolarHBondContact O-CB 3.45Å; F247-L250 PolarHBondContact O-N 3.3Å; F247-L250 VanDerWaalsContact O-N 3.14Å; G248-L250 VanDerWaalsContact C-N 3.34Å; L250-C252 VanDerWaalsContact C-N 3.35Å; L250-A253 WeakPolarHBondContact O-CB 3.2Å; L250-A253 PolarHBondContact O-N 2.99Å; L250-G254 PolarHBondContact O-N 3.48Å
251	I	97.8	Very high	95.8	Very high	61 Å²	61	30 Å²	30	31%	0.313	17%	0.165	S	C	.	.	H	α-helix	trans	-60.2	-48.2	173.6	-66.8	168.8	0	0	0	109.7	L213 F247 G248 A253 G254 V255	L213-I251 HydrophobicContact CD1-CD1 3.77Å; L213-I251 HydrophobicContact CD2-CB 4.21Å; L213-I251 HydrophobicContact CD2-CD1 4.4Å; L213-I251 HydrophobicContact CD2-CG2 4Å; F247-I251 HydrophobicContact CD1-CD1 3.98Å; F247-I251 HydrophobicContact CE1-CD1 3.47Å; F247-I251 VanDerWaalsContact CE1-CD1 3.47Å; F247-I251 HydrophobicContact CZ-CD1 3.81Å; F247-I251 PolarHBondContact O-N 2.94Å; G248-I251 PolarHBondContact O-N 3.29Å; I251-A253 VanDerWaalsContact C-N 3.3Å; I251-A253 PolarHBondContact O-N 3.1Å; I251-G254 PolarHBondContact O-N 3.34Å; I251-V255 HydrophobicContact CG2-CG2 4.29Å; I251-V255 VanDerWaalsContact O-CG2 3.32Å; I251-V255 WeakPolarHBondContact O-CG2 3.39Å; I251-V255 PolarHBondContact O-N 3.12Å
252	C	97.5	Very high	95.9	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-42.3	175.9	-68.6	0	0	0	0	111.7	C100 G248 F249 L250 V255 N256	C100-C252 HydrophobicContact CB-CB 4.26Å; G248-C252 WeakPolarHBondContact O-CB 3.29Å; G248-C252 PolarHBondContact O-N 3.39Å; G248-C252 PolarHBondContact O-SG 2.93Å; F249-C252 PolarHBondContact O-N 3.34Å; L250-C252 VanDerWaalsContact C-N 3.35Å; C252-V255 PolarHBondContact O-N 2.96Å; C252-N256 VanDerWaalsContact O-CB 3.31Å; C252-N256 WeakPolarHBondContact O-CB 3.43Å; C252-N256 PolarHBondContact O-N 3.43Å; C252-N256 PolarHBondContact O-ND2 3.36Å
253	A	97.9	Very high	96	Very high	10 Å²	10	31.7 Å²	31.7	8%	0.083	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-47.7	176.5	0	0	0	0	0	111.8	G97 C100 F101 F249 L250 I251 N256 V257	G97-A253 WeakPolarHBondContact O-CB 3.25Å; C100-A253 HydrophobicContact CB-CB 3.91Å; F101-A253 HydrophobicContact CB-CB 4.17Å; F249-A253 WeakPolarHBondContact O-CB 3.47Å; F249-A253 PolarHBondContact O-N 2.98Å; L250-A253 WeakPolarHBondContact O-CB 3.2Å; L250-A253 PolarHBondContact O-N 2.99Å; I251-A253 VanDerWaalsContact C-N 3.3Å; I251-A253 PolarHBondContact O-N 3.1Å; A253-N256 PolarHBondContact O-N 3.02Å; A253-V257 WeakPolarHBondContact O-CG2 3.06Å; A253-V257 PolarHBondContact O-N 3.28Å
254	G	97.6	Very high	95.9	Very high	34 Å²	34	36.1 Å²	36.1	35%	0.351	20%	0.198	S	C	.	.	H	α-helix	trans	-60.3	-48.6	176.6	0	0	0	0	0	112.7	L250 I251 N256 V257 L258	L250-G254 PolarHBondContact O-N 3.48Å; I251-G254 PolarHBondContact O-N 3.34Å; G254-N256 PolarHBondContact O-N 2.78Å; G254-V257 PolarHBondContact O-N 3.26Å; G254-L258 WeakPolarHBondContact O-CB 3.26Å; G254-L258 VanDerWaalsContact O-CG 3.26Å; G254-L258 WeakPolarHBondContact O-CG 3.32Å; G254-L258 PolarHBondContact O-N 2.89Å
255	V	97.1	Very high	95.8	Very high	50 Å²	50	44.1 Å²	44.1	30%	0.303	23%	0.232	S	C	.	.	H	α-helix	trans	-63.5	-40.9	179.6	-179.8	0	0	0	0	111.2	S32 L35 I251 C252 V257 L258 T259	S32-V255 WeakPolarHBondContact OG-CG1 3.24Å; L35-V255 HydrophobicContact CD2-CG1 4.38Å; I251-V255 HydrophobicContact CG2-CG2 4.29Å; I251-V255 VanDerWaalsContact O-CG2 3.32Å; I251-V255 WeakPolarHBondContact O-CG2 3.39Å; I251-V255 PolarHBondContact O-N 3.12Å; C252-V255 PolarHBondContact O-N 2.96Å; V255-V257 PolarHBondContact O-N 3.46Å; V255-L258 PolarHBondContact O-N 2.69Å; V255-T259 HydrophobicContact CG1-CG2 4.34Å; V255-T259 WeakPolarHBondContact O-CB 3.34Å; V255-T259 VanDerWaalsContact O-CG2 3.31Å; V255-T259 WeakPolarHBondContact O-CG2 3.39Å; V255-T259 PolarHBondContact O-N 2.94Å; V255-T259 PolarHBondContact O-OG1 3.4Å
256	N	96.8	Very high	95.5	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-39.2	176.2	-73.5	-36.7	0	0	0	112.4	S32 S36 C93 M96 C100 C252 A253 G254 T259 A260	S32-N256 WeakPolarHBondContact CB-OD1 3.4Å; S32-N256 PolarHBondContact OG-N 3.49Å; S32-N256 PolarHBondContact OG-OD1 3Å; S36-N256 PolarHBondContact OG-ND2 3.2Å; C93-N256 WeakPolarHBondContact CB-O 3.43Å; M96-N256 HydrophobicContact CE-CB 4.22Å; M96-N256 WeakPolarHBondContact CE-OD1 3.09Å; C100-N256 PolarHBondContact SG-ND2 2.93Å; C252-N256 VanDerWaalsContact O-CB 3.31Å; C252-N256 WeakPolarHBondContact O-CB 3.43Å; C252-N256 PolarHBondContact O-N 3.43Å; C252-N256 PolarHBondContact O-ND2 3.36Å; A253-N256 PolarHBondContact O-N 3.02Å; G254-N256 PolarHBondContact O-N 2.78Å; N256-T259 WeakPolarHBondContact CA-OG1 3.44Å; N256-T259 PolarHBondContact O-OG1 2.89Å; N256-A260 PolarHBondContact O-N 3.47Å
257	V	97	Very high	95	Very high	66 Å²	66	45.2 Å²	45.2	40%	0.4	24%	0.243	S	C	.	.	H	α-helix	trans	-71.8	-41.4	176.1	173.5	0	0	0	0	111.4	A253 G254 V255 T259 A260	A253-V257 WeakPolarHBondContact O-CG2 3.06Å; A253-V257 PolarHBondContact O-N 3.28Å; G254-V257 PolarHBondContact O-N 3.26Å; V255-V257 PolarHBondContact O-N 3.46Å; V257-T259 VanDerWaalsContact C-N 3.34Å; V257-T259 PolarHBondContact O-N 2.83Å; V257-A260 VanDerWaalsContact O-CB 3.24Å; V257-A260 WeakPolarHBondContact O-CB 3.46Å; V257-A260 PolarHBondContact O-N 3.33Å; V257-A260 VanDerWaalsContact O-N 3.11Å
258	L	96.4	Very high	94.3	Very high	115 Å²	115	46.6 Å²	46.6	60%	0.602	25%	0.249	S	C	*	.	H	α-helix	trans	-62.5	-41.1	177.3	-72.5	172.2	0	0	0	111.8	G254 V255 A260 I261	G254-L258 WeakPolarHBondContact O-CB 3.26Å; G254-L258 VanDerWaalsContact O-CG 3.26Å; G254-L258 WeakPolarHBondContact O-CG 3.32Å; G254-L258 PolarHBondContact O-N 2.89Å; V255-L258 PolarHBondContact O-N 2.69Å; L258-A260 PolarHBondContact O-N 2.87Å; L258-I261 HydrophobicContact CD2-CD1 4.05Å; L258-I261 PolarHBondContact O-N 3.19Å
259	T	95.2	Very high	93.4	Very high	19 Å²	19	50.8 Å²	50.8	12%	0.117	27%	0.274	C	S	.	.	H	α-helix	trans	-67.9	-18.8	176.3	51.5	0	0	0	0	113.3	C28 V255 N256 V257 P262 F263	C28-T259 HydrophobicContact CB-CG2 4.03Å; V255-T259 HydrophobicContact CG1-CG2 4.34Å; V255-T259 WeakPolarHBondContact O-CB 3.34Å; V255-T259 VanDerWaalsContact O-CG2 3.31Å; V255-T259 WeakPolarHBondContact O-CG2 3.39Å; V255-T259 PolarHBondContact O-N 2.94Å; V255-T259 PolarHBondContact O-OG1 3.4Å; N256-T259 WeakPolarHBondContact CA-OG1 3.44Å; N256-T259 PolarHBondContact O-OG1 2.89Å; V257-T259 VanDerWaalsContact C-N 3.34Å; V257-T259 PolarHBondContact O-N 2.83Å; T259-P262 WeakPolarHBondContact O-CD 3.45Å; T259-F263 VanDerWaalsContact O-CD2 3.29Å; T259-F263 WeakPolarHBondContact O-CD2 3.49Å; T259-F263 WeakPolarHBondContact O-CE2 3.39Å
260	A	96.1	Very high	92.4	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-72.3	-31.3	174.9	0	0	0	0	0	113.2	G90 C93 V94 N256 V257 L258 F263 F264	G90-A260 WeakPolarHBondContact O-CB 2.96Å; C93-A260 HydrophobicContact CB-CB 3.66Å; V94-A260 HydrophobicContact CG2-CB 3.67Å; N256-A260 PolarHBondContact O-N 3.47Å; V257-A260 VanDerWaalsContact O-CB 3.24Å; V257-A260 WeakPolarHBondContact O-CB 3.46Å; V257-A260 PolarHBondContact O-N 3.33Å; V257-A260 VanDerWaalsContact O-N 3.11Å; L258-A260 PolarHBondContact O-N 2.87Å; A260-F263 WeakPolarHBondContact O-CB 3.31Å; A260-F263 PolarHBondContact O-N 3.41Å; A260-F263 VanDerWaalsContact O-N 3.13Å; A260-F264 HydrophobicContact CB-CE2 3.98Å; A260-F264 VanDerWaalsContact O-CD2 3.29Å; A260-F264 WeakPolarHBondContact O-CD2 3.41Å
261	I	95.1	Very high	91.2	Very high	82 Å²	82	52 Å²	52	42%	0.421	28%	0.284	S	S	.	.	H	α-helix	trans	-54.1	-50.5	-170	-61.6	174	0	0	0	112.6	L258 F263 F264 F265	L258-I261 HydrophobicContact CD2-CD1 4.05Å; L258-I261 PolarHBondContact O-N 3.19Å; I261-F263 PolarHBondContact O-N 3.27Å; I261-F263 VanDerWaalsContact O-N 3.16Å; I261-F264 PolarHBondContact O-N 3.03Å; I261-F265 HydrophobicContact CG2-CD2 4.4Å; I261-F265 HydrophobicContact CG2-CE2 3.79Å; I261-F265 WeakPolarHBondContact O-CD2 3Å
262	P	93.6	Very high	89.9	Confident	55 Å²	55	52.8 Å²	52.8	36%	0.357	29%	0.285	S	S	.	.	H	α-helix	trans	-59	-32.1	-177.4	-24.3	35.6	0	0	0	113.5	A25 T259 F264 F265 L266	A25-P262 HydrophobicContact CB-CB 3.94Å; A25-P262 HydrophobicContact CB-CG 4.49Å; T259-P262 WeakPolarHBondContact O-CD 3.45Å; P262-F264 VanDerWaalsContact C-N 3.3Å; P262-F264 PolarHBondContact O-N 3.12Å; P262-F265 PolarHBondContact O-N 3.24Å; P262-L266 WeakPolarHBondContact O-CG 3.42Å; P262-L266 PolarHBondContact O-N 3.11Å
263	F	93.8	Very high	88.4	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-67.7	-27.8	-176.3	-70.1	-73.1	0	0	0	114.1	F22 A25 I26 A29 P86 I89 T259 A260 I261 F265 L266	F22-F263 HydrophobicContact CD2-CE1 4.34Å; F22-F263 HydrophobicContact CE2-CD1 4.27Å; F22-F263 AromaticContact CE2-CE1 3.96Å; F22-F263 HydrophobicContact CE2-CE1 3.96Å; A25-F263 HydrophobicContact CB-CE1 4.09Å; A25-F263 HydrophobicContact CB-CE2 4.15Å; A25-F263 HydrophobicContact CB-CZ 3.84Å; I26-F263 HydrophobicContact CB-CE1 4.48Å; I26-F263 HydrophobicContact CB-CZ 4.29Å; I26-F263 HydrophobicContact CD1-CE1 4.32Å; I26-F263 HydrophobicContact CD1-CZ 4.08Å; A29-F263 HydrophobicContact CB-CE2 4.01Å; A29-F263 HydrophobicContact CB-CZ 4.08Å; P86-F263 HydrophobicContact CB-CD1 4.33Å; P86-F263 WeakPolarHBondContact O-CB 3.22Å; I89-F263 HydrophobicContact CB-CD1 4.17Å; I89-F263 HydrophobicContact CB-CE1 4.25Å; I89-F263 HydrophobicContact CB-CG 4.49Å; I89-F263 HydrophobicContact CD1-CE1 4.4Å; I89-F263 HydrophobicContact CG2-CD1 4.01Å; I89-F263 HydrophobicContact CG2-CD2 4.23Å; I89-F263 HydrophobicContact CG2-CE1 3.69Å; I89-F263 HydrophobicContact CG2-CE2 3.92Å; I89-F263 HydrophobicContact CG2-CG 4.26Å; I89-F263 HydrophobicContact CG2-CZ 3.63Å; T259-F263 VanDerWaalsContact O-CD2 3.29Å; T259-F263 WeakPolarHBondContact O-CD2 3.49Å; T259-F263 WeakPolarHBondContact O-CE2 3.39Å; A260-F263 WeakPolarHBondContact O-CB 3.31Å; A260-F263 PolarHBondContact O-N 3.41Å; A260-F263 VanDerWaalsContact O-N 3.13Å; I261-F263 PolarHBondContact O-N 3.27Å; I261-F263 VanDerWaalsContact O-N 3.16Å; F263-F265 PolarHBondContact O-N 3.49Å; F263-L266 HydrophobicContact CD1-CD1 4.21Å; F263-L266 PolarHBondContact O-N 2.91Å
264	F	92.7	Very high	86.6	Confident	93 Å²	93	57.3 Å²	57.3	41%	0.408	32%	0.32	S	S	.	.	H	α-helix	trans	-72.7	-17.8	177.3	-66	-70.7	0	0	0	113.1	I87 I91 V94 A260 I261 P262	I87-F264 HydrophobicContact CG2-CD1 4.26Å; I87-F264 HydrophobicContact CG2-CE1 4.21Å; I91-F264 HydrophobicContact CG1-CE1 4.18Å; I91-F264 HydrophobicContact CG1-CZ 4.44Å; V94-F264 HydrophobicContact CG2-CE2 4.25Å; V94-F264 HydrophobicContact CG2-CZ 4.25Å; A260-F264 HydrophobicContact CB-CE2 3.98Å; A260-F264 VanDerWaalsContact O-CD2 3.29Å; A260-F264 WeakPolarHBondContact O-CD2 3.41Å; I261-F264 PolarHBondContact O-N 3.03Å; P262-F264 VanDerWaalsContact C-N 3.3Å; P262-F264 PolarHBondContact O-N 3.12Å
265	F	91.3	Very high	84.8	Confident	171 Å²	171	57.4 Å²	57.4	75%	0.75	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-5.1	179.2	-59	-78	0	0	0	113.5	I261 P262 F263	I261-F265 HydrophobicContact CG2-CD2 4.4Å; I261-F265 HydrophobicContact CG2-CE2 3.79Å; I261-F265 WeakPolarHBondContact O-CD2 3Å; P262-F265 PolarHBondContact O-N 3.24Å; F263-F265 PolarHBondContact O-N 3.49Å
266	L	89	Confident	82.8	Confident	18 Å²	18	61 Å²	61	9%	0.094	33%	0.326	C	S	.	.	S	Bend	trans	-83.2	140.9	179.8	-72.5	167.9	0	0	0	110.8	M21 F22 A25 H84 P86 P262 F263	M21-L266 HydrophobicContact CB-CD2 4.4Å; F22-L266 HydrophobicContact CB-CD1 4.08Å; F22-L266 HydrophobicContact CD2-CD1 3.76Å; F22-L266 HydrophobicContact CG-CD1 4.38Å; A25-L266 HydrophobicContact CB-CD1 4.49Å; H84-L266 PolarHBondContact CE1-O 3.22Å; P86-L266 HydrophobicContact CB-CB 3.92Å; P86-L266 HydrophobicContact CG-CB 4.23Å; P262-L266 WeakPolarHBondContact O-CG 3.42Å; P262-L266 PolarHBondContact O-N 3.11Å; F263-L266 HydrophobicContact CD1-CD1 4.21Å; F263-L266 PolarHBondContact O-N 2.91Å
267	P	84	Confident	80.4	Confident	38 Å²	38	68.2 Å²	68.2	25%	0.247	36%	0.364	C	S	.	.			trans	-74.8	154.9	-177.1	31.7	-36.4	0	0	0	112.7	K18 Y182 T269 L270	K18-P267 HydrophobicContact CD-CG 4.16Å; Y182-P267 PolarHBondContact OH-O 3.29Å; P267-T269 VanDerWaalsContact C-N 3.26Å; P267-T269 PolarHBondContact O-N 3.06Å; P267-L270 HydrophobicContact CG-CD2 3.44Å; P267-L270 VanDerWaalsContact CG-CD2 3.44Å; P267-L270 HydrophobicContact CG-CG 4.14Å
268	K	82	Confident	78.1	Confident	114 Å²	114	69.3 Å²	69.3	50%	0.496	37%	0.368	S	S	.	.	S	Bend	trans	-56.5	-41.5	177.4	-169.3	177	179.1	-177.1	0	112.2	H84	H84-K268 HydrophobicContact CB-CG 4.48Å; H84-K268 PolarHBondContact CE1-N 3.4Å; H84-K268 WeakPolarHBondContact NE2-CA 3.35Å; H84-K268 PolarHBondContact NE2-N 3.04Å
269	T	75.1	Confident	75.9	Confident	88 Å²	88	67.2 Å²	67.2	54%	0.54	37%	0.368	S	S	.	.			trans	-131.9	145.2	-177.1	53.4	0	0	0	0	110.3	F186 P267	F186-T269 HydrophobicContact CZ-CG2 4.33Å; P267-T269 VanDerWaalsContact C-N 3.26Å; P267-T269 PolarHBondContact O-N 3.06Å
270	L	77.3	Confident	73.8	Confident	18 Å²	18	72.7 Å²	72.7	9%	0.094	40%	0.396	C	S	.	.			trans	-116.4	152.4	172.5	-70.6	172.6	0	0	0	110.2	K18 L19 Y182 F186 P267 K272	K18-L270 HydrophobicContact CB-CD1 4.32Å; K18-L270 HydrophobicContact CB-CD2 3.47Å; K18-L270 VanDerWaalsContact CB-CD2 3.47Å; K18-L270 HydrophobicContact CD-CD2 3.76Å; K18-L270 HydrophobicContact CG-CD2 4.26Å; L19-L270 HydrophobicContact CB-CD1 4.21Å; L19-L270 HydrophobicContact CD1-CD1 4.35Å; Y182-L270 HydrophobicContact CE1-CD1 3.72Å; Y182-L270 HydrophobicContact CE1-CG 4.5Å; Y182-L270 WeakPolarHBondContact OH-CD1 3.35Å; Y182-L270 WeakPolarHBondContact OH-CG 3.49Å; F186-L270 HydrophobicContact CB-CB 4.23Å; F186-L270 HydrophobicContact CD1-CB 3.79Å; F186-L270 WeakPolarHBondContact CD1-O 3.48Å; F186-L270 HydrophobicContact CD2-CB 4.26Å; F186-L270 HydrophobicContact CE1-CB 4.26Å; F186-L270 WeakPolarHBondContact CE1-O 3.31Å; F186-L270 HydrophobicContact CG-CB 3.82Å; P267-L270 HydrophobicContact CG-CD2 3.44Å; P267-L270 VanDerWaalsContact CG-CD2 3.44Å; P267-L270 HydrophobicContact CG-CG 4.14Å; L270-K272 PolarHBondContact O-N 3.42Å
271	P	71.3	Confident	71.7	Confident	58 Å²	58	76.2 Å²	76.2	38%	0.377	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-62	137.2	163.5	27.8	-32	0	0	0	108.6	E273 E276	P271-E273 PolarHBondContact O-N 2.97Å; P271-E276 HydrophobicContact CB-CG 4.39Å; P271-E276 HydrophobicContact CG-CG 4.15Å
272	K	72.1	Confident	69.6	Low	79 Å²	79	74.9 Å²	74.9	34%	0.343	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-61.2	137.5	177.2	-164.4	171.5	-175.9	177.7	0	109.3	F186 L270 G274 L275	F186-K272 WeakPolarHBondContact O-CA 3.44Å; L270-K272 PolarHBondContact O-N 3.42Å; K272-G274 PolarHBondContact O-N 3.24Å; K272-G274 VanDerWaalsContact O-N 3.13Å; K272-L275 HydrophobicContact CB-CD1 4.06Å; K272-L275 WeakPolarHBondContact O-CB 3.41Å; K272-L275 PolarHBondContact O-N 2.91Å
273	E	66.1	Low	67.5	Low	46 Å²	46	79.1 Å²	79.1	22%	0.215	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	120	-176.4	-176.9	-177.3	-157.5	0	0	110.7	L19 F186 K188 N191 Y195 P271	L19-E273 HydrophobicContact CD2-CB 4.08Å; F186-E273 PolarHBondContact O-N 3.27Å; K188-E273 WeakPolarHBondContact CE-O 3.29Å; K188-E273 HydrophobicContact CG-CB 4.08Å; K188-E273 HydrophobicContact CG-CG 4.21Å; K188-E273 WeakPolarHBondContact CG-O 3.34Å; K188-E273 PolarHBondContact N-OE2 3.1Å; N191-E273 PolarHBondContact ND2-OE1 2.96Å; N191-E273 PolarHBondContact ND2-OE2 3.24Å; Y195-E273 PolarHBondContact OH-OE1 3.48Å; P271-E273 PolarHBondContact O-N 2.97Å
274	G	58.7	Low	65.2	Low	58 Å²	58	83.9 Å²	83.9	60%	0.598	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.5	-4.3	-176.3	0	0	0	0	0	116.6	K272	K272-G274 PolarHBondContact O-N 3.24Å; K272-G274 VanDerWaalsContact O-N 3.13Å
275	L	59.7	Low	63	Low	37 Å²	37	83 Å²	83	19%	0.194	44%	0.443	C	S	.	.			trans	-100.4	6.8	175.3	-101.7	143.1	0	0	0	113.7	K272 N277 N278 I281	K272-L275 HydrophobicContact CB-CD1 4.06Å; K272-L275 WeakPolarHBondContact O-CB 3.41Å; K272-L275 PolarHBondContact O-N 2.91Å; L275-N277 PolarHBondContact O-N 2.87Å; L275-N278 PolarHBondContact O-N 3.27Å; L275-I281 HydrophobicContact CD2-CB 4.14Å; L275-I281 HydrophobicContact CD2-CG2 3.79Å
276	E	55.7	Low	60.9	Low	124 Å²	124	78.5 Å²	78.5	58%	0.579	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-14.7	-175.3	-70	-178.5	157.8	0	0	114.7	P271	P271-E276 HydrophobicContact CB-CG 4.39Å; P271-E276 HydrophobicContact CG-CG 4.15Å
277	N	47.4	Very low	58.7	Low	152 Å²	152	82.1 Å²	82.1	81%	0.813	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-7.9	-174.2	-69.2	-14.3	0	0	0	115.8	L275	L275-N277 PolarHBondContact O-N 2.87Å
278	N	48.7	Very low	57	Low	89 Å²	89	84.7 Å²	84.7	48%	0.476	46%	0.455	S	S	.	.			trans	-123.6	81.9	-173.3	-71.7	-17.6	0	0	0	112.2	L275 D280 I281 I282	L275-N278 PolarHBondContact O-N 3.27Å; N278-D280 PolarHBondContact O-N 3.33Å; N278-D280 VanDerWaalsContact O-N 3.12Å; N278-I281 HydrophobicContact CB-CB 4.32Å; N278-I281 HydrophobicContact CB-CD1 3.83Å; N278-I281 HydrophobicContact CB-CG1 4.07Å; N278-I281 PolarHBondContact O-N 3.23Å; N278-I282 WeakPolarHBondContact O-CG1 3.37Å
279	A	50	Low	55.4	Low	72 Å²	72	83.4 Å²	83.4	60%	0.595	45%	0.449	S	S	*	.	H	α-helix	trans	-57.4	-25.2	-177.8	0	0	0	0	0	114.9
280	D	50.8	Low	54.1	Low	133 Å²	133	85 Å²	85	71%	0.711	45%	0.45	S	S	*	.	H	α-helix	trans	-84.6	-24.3	-178	-62.7	-37.2	0	0	0	113.6	N278 I282	N278-D280 PolarHBondContact O-N 3.33Å; N278-D280 VanDerWaalsContact O-N 3.12Å; D280-I282 VanDerWaalsContact C-N 3.32Å
281	I	51.8	Low	52.2	Low	75 Å²	75	90.9 Å²	90.9	39%	0.385	47%	0.471	S	S	.	.	H	α-helix	trans	-74.6	-29.5	171.9	-59.1	177.5	0	0	0	110.1	L275 N278 K283 N284 E285	L275-I281 HydrophobicContact CD2-CB 4.14Å; L275-I281 HydrophobicContact CD2-CG2 3.79Å; N278-I281 HydrophobicContact CB-CB 4.32Å; N278-I281 HydrophobicContact CB-CD1 3.83Å; N278-I281 HydrophobicContact CB-CG1 4.07Å; N278-I281 PolarHBondContact O-N 3.23Å; I281-K283 PolarHBondContact O-N 2.97Å; I281-N284 PolarHBondContact O-N 3.02Å; I281-E285 HydrophobicContact CG2-CG 4.06Å; I281-E285 WeakPolarHBondContact O-CB 3.39Å; I281-E285 PolarHBondContact O-N 3.29Å
282	I	51.7	Low	51.1	Low	54 Å²	54	94 Å²	94	28%	0.277	48%	0.48	S	S	.	.	H	α-helix	trans	-66	-34.9	-178.2	-62.7	173.6	0	0	0	112.5	N278 D280 N286	N278-I282 WeakPolarHBondContact O-CG1 3.37Å; D280-I282 VanDerWaalsContact C-N 3.32Å; I282-N286 VanDerWaalsContact O-CB 3.3Å; I282-N286 WeakPolarHBondContact O-CB 3.39Å; I282-N286 VanDerWaalsContact O-CG 3.25Å; I282-N286 PolarHBondContact O-N 2.99Å; I282-N286 PolarHBondContact O-ND2 2.97Å
283	K	47.8	Very low	50	Low	145 Å²	145	95.8 Å²	95.8	63%	0.63	49%	0.49	S	S	*	.	H	α-helix	trans	-72	-44.2	175.7	-81.8	-177.2	176.8	177.4	0	111.5	I281 E287	I281-K283 PolarHBondContact O-N 2.97Å; K283-E287 WeakPolarHBondContact O-CB 3.45Å; K283-E287 VanDerWaalsContact O-CG 3.32Å; K283-E287 WeakPolarHBondContact O-CG 3.31Å; K283-E287 PolarHBondContact O-N 3.34Å
284	N	45.4	Very low	48.8	Very low	99 Å²	99	97.8 Å²	97.8	53%	0.529	50%	0.502	S	S	.	.	H	α-helix	trans	-70.6	-41.6	-178.7	-68.9	-18.5	0	0	0	112.3	I281 E287 D288	I281-N284 PolarHBondContact O-N 3.02Å; N284-E287 PolarHBondContact O-N 3.14Å; N284-D288 VanDerWaalsContact O-CB 3.29Å; N284-D288 WeakPolarHBondContact O-CB 3.33Å; N284-D288 VanDerWaalsContact O-CG 3.27Å; N284-D288 PolarHBondContact O-N 3.14Å
285	E	47.6	Very low	47.9	Very low	75 Å²	75	102.2 Å²	102.2	35%	0.35	51%	0.505	S	S	.	.	H	α-helix	trans	-67.2	-36.3	176.3	-85	-168.5	148	0	0	113.2	I281 K289	I281-E285 HydrophobicContact CG2-CG 4.06Å; I281-E285 WeakPolarHBondContact O-CB 3.39Å; I281-E285 PolarHBondContact O-N 3.29Å; E285-K289 WeakPolarHBondContact O-CB 3.29Å; E285-K289 WeakPolarHBondContact O-CG 3.39Å; E285-K289 PolarHBondContact O-N 3.22Å
286	N	45.8	Very low	47.3	Very low	76 Å²	76	107 Å²	107	41%	0.406	52%	0.524	S	S	.	.	H	α-helix	trans	-71.4	-40.1	175.5	-75.1	-35.5	0	0	0	111.1	I282 D288 Q290	I282-N286 VanDerWaalsContact O-CB 3.3Å; I282-N286 WeakPolarHBondContact O-CB 3.39Å; I282-N286 VanDerWaalsContact O-CG 3.25Å; I282-N286 PolarHBondContact O-N 2.99Å; I282-N286 PolarHBondContact O-ND2 2.97Å; N286-D288 VanDerWaalsContact C-N 3.34Å; N286-Q290 WeakPolarHBondContact O-CB 3.33Å; N286-Q290 PolarHBondContact O-N 2.9Å
287	E	43	Very low	46.9	Very low	95 Å²	95	106.3 Å²	106.3	44%	0.444	52%	0.521	S	S	.	.	H	α-helix	trans	-65.2	-35.3	173.1	-76.5	-175.1	-163	0	0	112.6	K283 N284 R291	K283-E287 WeakPolarHBondContact O-CB 3.45Å; K283-E287 VanDerWaalsContact O-CG 3.32Å; K283-E287 WeakPolarHBondContact O-CG 3.31Å; K283-E287 PolarHBondContact O-N 3.34Å; N284-E287 PolarHBondContact O-N 3.14Å; E287-R291 VanDerWaalsContact O-CB 3.23Å; E287-R291 WeakPolarHBondContact O-CB 3.46Å; E287-R291 WeakPolarHBondContact O-CG 3.49Å; E287-R291 PolarHBondContact O-N 3.45Å; E287-R291 IonicContact OE2-NH2 3.81Å
288	D	48.3	Very low	46.4	Very low	92 Å²	92	108.2 Å²	108.2	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-75.7	-40.5	178.3	-75.9	-28.7	0	0	0	112.4	N284 N286 Q290 R291 E292	N284-D288 VanDerWaalsContact O-CB 3.29Å; N284-D288 WeakPolarHBondContact O-CB 3.33Å; N284-D288 VanDerWaalsContact O-CG 3.27Å; N284-D288 PolarHBondContact O-N 3.14Å; N286-D288 VanDerWaalsContact C-N 3.34Å; D288-Q290 VanDerWaalsContact C-N 3.34Å; D288-R291 PolarHBondContact O-N 3.41Å; D288-E292 WeakPolarHBondContact O-CB 3.45Å; D288-E292 PolarHBondContact O-N 3.36Å
289	K	50.2	Low	46.1	Very low	87 Å²	87	112.8 Å²	112.8	38%	0.378	53%	0.534	S	S	.	.	H	α-helix	trans	-63.4	-40.8	171.1	-78.1	-178.2	178.7	-175.6	0	111.8	E285 E292 E293	E285-K289 WeakPolarHBondContact O-CB 3.29Å; E285-K289 WeakPolarHBondContact O-CG 3.39Å; E285-K289 PolarHBondContact O-N 3.22Å; K289-E292 PolarHBondContact O-N 3.03Å; K289-E293 WeakPolarHBondContact O-CB 3.45Å; K289-E293 WeakPolarHBondContact O-CG 3.49Å; K289-E293 PolarHBondContact O-N 2.6Å
290	Q	46.1	Very low	45.9	Very low	120 Å²	120	110.9 Å²	110.9	56%	0.561	52%	0.522	S	S	*	.	H	α-helix	trans	-71.3	-34	178.4	-157.4	160.6	1.3	0	0	111.2	N286 D288 D294	N286-Q290 WeakPolarHBondContact O-CB 3.33Å; N286-Q290 PolarHBondContact O-N 2.9Å; D288-Q290 VanDerWaalsContact C-N 3.34Å; Q290-D294 VanDerWaalsContact O-CB 3.23Å; Q290-D294 WeakPolarHBondContact O-CB 3.43Å; Q290-D294 PolarHBondContact O-N 3.26Å
291	R	38.6	Very low	45.9	Very low	143 Å²	143	108 Å²	108	54%	0.54	51%	0.505	S	S	.	.	H	α-helix	trans	-69.7	-32.8	169.1	-79.8	174.7	-167.6	-171.1	9.2	113.6	E287 D288 K295	E287-R291 VanDerWaalsContact O-CB 3.23Å; E287-R291 WeakPolarHBondContact O-CB 3.46Å; E287-R291 WeakPolarHBondContact O-CG 3.49Å; E287-R291 PolarHBondContact O-N 3.45Å; E287-R291 IonicContact OE2-NH2 3.81Å; D288-R291 PolarHBondContact O-N 3.41Å; R291-K295 WeakPolarHBondContact O-CB 3.49Å; R291-K295 WeakPolarHBondContact O-CG 3.46Å; R291-K295 PolarHBondContact O-N 2.73Å
292	E	47.9	Very low	45.9	Very low	122 Å²	122	110 Å²	110	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-72.5	-39.3	172.9	-79.9	-160.2	168.6	0	0	112.1	D288 K289 K295 K296	D288-E292 WeakPolarHBondContact O-CB 3.45Å; D288-E292 PolarHBondContact O-N 3.36Å; K289-E292 PolarHBondContact O-N 3.03Å; E292-K295 PolarHBondContact O-N 2.98Å; E292-K296 WeakPolarHBondContact O-CB 3.47Å; E292-K296 WeakPolarHBondContact O-CG 3.4Å; E292-K296 PolarHBondContact O-N 3.28Å
293	E	48	Very low	46.1	Very low	118 Å²	118	115.4 Å²	115.4	55%	0.551	54%	0.543	S	S	*	.	H	α-helix	trans	-64.6	-44.7	171.9	-76.2	-176.6	169	0	0	111.3	K289 K295 K296 E297	K289-E293 WeakPolarHBondContact O-CB 3.45Å; K289-E293 WeakPolarHBondContact O-CG 3.49Å; K289-E293 PolarHBondContact O-N 2.6Å; E293-K295 PolarHBondContact O-N 3.22Å; E293-K296 CarbonylContact O-C 3.33Å; E293-K296 PolarHBondContact O-N 3.11Å; E293-E297 WeakPolarHBondContact O-CB 3.05Å; E293-E297 PolarHBondContact O-N 2.6Å
294	D	41.3	Very low	46.6	Very low	87 Å²	87	112 Å²	112	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-33.3	176.1	-74.7	-15.3	0	0	0	112.5	Q290 E297 K298	Q290-D294 VanDerWaalsContact O-CB 3.23Å; Q290-D294 WeakPolarHBondContact O-CB 3.43Å; Q290-D294 PolarHBondContact O-N 3.26Å; D294-E297 PolarHBondContact O-N 3.47Å; D294-K298 PolarHBondContact O-N 2.94Å
295	K	40.8	Very low	47.7	Very low	152 Å²	152	112 Å²	112	66%	0.661	53%	0.527	S	S	*	.	H	α-helix	trans	-70.5	-37.4	172.5	-82	175.1	-179.3	176.4	0	111.9	R291 E292 E293 E297 K298 Y299	R291-K295 WeakPolarHBondContact O-CB 3.49Å; R291-K295 WeakPolarHBondContact O-CG 3.46Å; R291-K295 PolarHBondContact O-N 2.73Å; E292-K295 PolarHBondContact O-N 2.98Å; E293-K295 PolarHBondContact O-N 3.22Å; K295-E297 VanDerWaalsContact C-N 3.31Å; K295-K298 PolarHBondContact O-N 3.18Å; K295-Y299 PolarHBondContact O-N 3.47Å; K295-Y299 VanDerWaalsContact O-N 3.16Å
296	K	47.4	Very low	48.8	Very low	136 Å²	136	114.5 Å²	114.5	59%	0.591	54%	0.542	S	S	*	.	H	α-helix	trans	-70.9	-25.4	171	-77.4	176.2	-179.8	170.7	0	112.5	E292 E293	E292-K296 WeakPolarHBondContact O-CB 3.47Å; E292-K296 WeakPolarHBondContact O-CG 3.4Å; E292-K296 PolarHBondContact O-N 3.28Å; E293-K296 CarbonylContact O-C 3.33Å; E293-K296 PolarHBondContact O-N 3.11Å
297	E	46.3	Very low	50.2	Low	111 Å²	111	113.1 Å²	113.1	52%	0.519	54%	0.537	S	S	.	.	H	α-helix	trans	-78.7	-31.1	174.5	-160.2	165.7	-137.3	0	0	112	K82 E293 D294 K295	K82-E297 IonicContact NZ-OE1 3.96Å; K82-E297 PolarHBondContact NZ-OE1 2.93Å; E293-E297 WeakPolarHBondContact O-CB 3.05Å; E293-E297 PolarHBondContact O-N 2.6Å; D294-E297 PolarHBondContact O-N 3.47Å; K295-E297 VanDerWaalsContact C-N 3.31Å
298	K	37.2	Very low	51.7	Low	192 Å²	192	111.9 Å²	111.9	84%	0.835	53%	0.53	S	S	*	.	H	α-helix	trans	-76.9	-21.8	171.7	-96.8	176.7	175.7	170.6	0	114.8	D294 K295	D294-K298 PolarHBondContact O-N 2.94Å; K295-K298 PolarHBondContact O-N 3.18Å
299	Y	42.8	Very low	53	Low	185 Å²	185	109.7 Å²	109.7	73%	0.725	52%	0.517	S	S	*	.	S	Bend	trans	-100.9	95.2	171.1	-124.1	-99	0	0	0	108.6	K295 I301	K295-Y299 PolarHBondContact O-N 3.47Å; K295-Y299 VanDerWaalsContact O-N 3.16Å; Y299-I301 PolarHBondContact O-N 3.41Å
300	G	45.3	Very low	54.3	Low	32 Å²	32	112 Å²	112	33%	0.33	53%	0.528	S	S	.	.			trans	-48.2	113.6	-165.2	0	0	0	0	0	114.9	T302 K303	G300-T302 PolarHBondContact O-N 3.2Å; G300-K303 WeakPolarHBondContact O-CB 3.47Å; G300-K303 PolarHBondContact O-N 3.4Å
301	I	50.9	Low	55.9	Low	72 Å²	72	107.8 Å²	107.8	37%	0.369	51%	0.511	S	S	.	.	H	α-helix	trans	-54.7	-25.5	176.2	-67.6	162.6	0	0	0	112.6	Y78 Y299 K303 F305	Y78-I301 HydrophobicContact CE2-CB 4.46Å; Y78-I301 HydrophobicContact CE2-CD1 4.15Å; Y78-I301 HydrophobicContact CE2-CG2 3.94Å; Y299-I301 PolarHBondContact O-N 3.41Å; I301-K303 VanDerWaalsContact C-N 3.33Å; I301-F305 WeakPolarHBondContact O-CB 3.31Å; I301-F305 PolarHBondContact O-N 3.46Å; I301-F305 VanDerWaalsContact O-N 3.12Å
302	T	52	Low	57.9	Low	116 Å²	116	101 Å²	101	71%	0.712	49%	0.485	S	S	*	.	H	α-helix	trans	-70.5	-23.8	172.8	43.5	0	0	0	0	114	G300	G300-T302 PolarHBondContact O-N 3.2Å
303	K	54.2	Low	59.5	Low	169 Å²	169	98 Å²	98	74%	0.735	48%	0.478	S	S	*	.	H	α-helix	trans	-75	-31	175.5	-96.5	-176.9	174.3	176.5	0	112.8	G300 I301 P307	G300-K303 WeakPolarHBondContact O-CB 3.47Å; G300-K303 PolarHBondContact O-N 3.4Å; I301-K303 VanDerWaalsContact C-N 3.33Å; K303-P307 WeakPolarHBondContact O-CD 3.42Å; K303-P307 WeakPolarHBondContact O-CG 3.27Å
304	D	59.8	Low	61.2	Low	72 Å²	72	95 Å²	95	39%	0.385	47%	0.47	S	S	.	.	H	α-helix	trans	-95	-21.3	-178.9	-61.1	-25.5	0	0	0	112.8	L306 P307 F308	D304-L306 PolarHBondContact O-N 3.29Å; D304-P307 WeakPolarHBondContact O-CD 3.34Å; D304-F308 HydrophobicContact CB-CD2 4.05Å; D304-F308 HydrophobicContact CB-CE2 3.69Å; D304-F308 WeakPolarHBondContact O-CD2 3.43Å; D304-F308 WeakPolarHBondContact O-CG 3.39Å; D304-F308 PolarHBondContact O-N 2.9Å
305	F	67.1	Low	63.2	Low	101 Å²	101	91.5 Å²	91.5	44%	0.443	45%	0.451	S	S	.	.	H	α-helix	trans	-58.7	-48.8	176.5	-179.2	-98.4	0	0	0	113.5	I301 F308 M309 L546	I301-F305 WeakPolarHBondContact O-CB 3.31Å; I301-F305 PolarHBondContact O-N 3.46Å; I301-F305 VanDerWaalsContact O-N 3.12Å; F305-F308 PolarHBondContact O-N 3.35Å; F305-M309 HydrophobicContact CD1-CG 4.1Å; F305-M309 HydrophobicContact CD2-CG 4.39Å; F305-M309 HydrophobicContact CE1-CG 3.72Å; F305-M309 HydrophobicContact CE2-CG 4.05Å; F305-M309 HydrophobicContact CE2-SD 4.42Å; F305-M309 HydrophobicContact CG-CG 4.42Å; F305-M309 HydrophobicContact CZ-CG 3.69Å; F305-M309 HydrophobicContact CZ-SD 4.1Å; F305-M309 WeakPolarHBondContact O-CB 3.08Å; F305-M309 VanDerWaalsContact O-CG 3.29Å; F305-M309 WeakPolarHBondContact O-CG 3.23Å; F305-M309 PolarHBondContact O-N 3.37Å; F305-L546 HydrophobicContact CD2-CD1 4.17Å; F305-L546 HydrophobicContact CD2-CD2 4.5Å; F305-L546 HydrophobicContact CE2-CD1 3.62Å
306	L	72	Confident	65.3	Low	126 Å²	126	86.2 Å²	86.2	66%	0.66	43%	0.432	S	S	*	.	H	α-helix	trans	-63.3	-45.7	179.2	-79.5	165.7	0	0	0	112.3	D304 K310	D304-L306 PolarHBondContact O-N 3.29Å; L306-K310 VanDerWaalsContact O-CB 3.25Å; L306-K310 WeakPolarHBondContact O-CB 3.39Å; L306-K310 PolarHBondContact O-N 3.3Å
307	P	75.9	Confident	67.1	Low	47 Å²	47	80.6 Å²	80.6	31%	0.305	41%	0.409	S	S	.	.	H	α-helix	trans	-56.5	-46.5	169.8	-27.9	33.2	0	0	0	114.2	K303 D304 K310 S311	K303-P307 WeakPolarHBondContact O-CD 3.42Å; K303-P307 WeakPolarHBondContact O-CG 3.27Å; D304-P307 WeakPolarHBondContact O-CD 3.34Å; P307-K310 PolarHBondContact O-N 3.43Å; P307-S311 WeakPolarHBondContact O-CB 3.36Å; P307-S311 PolarHBondContact O-N 3.39Å
308	F	73.3	Confident	69.1	Low	70 Å²	70	75.3 Å²	75.3	31%	0.307	38%	0.384	S	S	.	.	H	α-helix	trans	-67.7	-41.3	179.3	-69.6	-50.7	0	0	0	112.8	D304 F305 K310 S311 L312 E543 L546	D304-F308 HydrophobicContact CB-CD2 4.05Å; D304-F308 HydrophobicContact CB-CE2 3.69Å; D304-F308 WeakPolarHBondContact O-CD2 3.43Å; D304-F308 WeakPolarHBondContact O-CG 3.39Å; D304-F308 PolarHBondContact O-N 2.9Å; F305-F308 PolarHBondContact O-N 3.35Å; F308-K310 VanDerWaalsContact C-N 3.29Å; F308-K310 PolarHBondContact O-N 3.36Å; F308-S311 WeakPolarHBondContact O-CB 3.13Å; F308-S311 PolarHBondContact O-N 3.1Å; F308-L312 WeakPolarHBondContact O-CB 3.32Å; F308-L312 WeakPolarHBondContact O-CG 3.43Å; F308-L312 PolarHBondContact O-N 2.95Å; F308-E543 HydrophobicContact CD1-CG 3.78Å; F308-E543 HydrophobicContact CE1-CG 4.26Å; F308-L546 HydrophobicContact CB-CD2 3.65Å
309	M	74.9	Confident	71.6	Confident	45 Å²	45	69.9 Å²	69.9	22%	0.222	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-41.7	172.9	-77.8	-65.4	-64.1	0	0	111.4	F305 S313 L546 L550	F305-M309 HydrophobicContact CD1-CG 4.1Å; F305-M309 HydrophobicContact CD2-CG 4.39Å; F305-M309 HydrophobicContact CE1-CG 3.72Å; F305-M309 HydrophobicContact CE2-CG 4.05Å; F305-M309 HydrophobicContact CE2-SD 4.42Å; F305-M309 HydrophobicContact CG-CG 4.42Å; F305-M309 HydrophobicContact CZ-CG 3.69Å; F305-M309 HydrophobicContact CZ-SD 4.1Å; F305-M309 WeakPolarHBondContact O-CB 3.08Å; F305-M309 VanDerWaalsContact O-CG 3.29Å; F305-M309 WeakPolarHBondContact O-CG 3.23Å; F305-M309 PolarHBondContact O-N 3.37Å; M309-S313 VanDerWaalsContact O-CB 3.31Å; M309-S313 WeakPolarHBondContact O-CB 3.28Å; M309-S313 PolarHBondContact O-N 3.06Å; M309-S313 PolarHBondContact O-OG 3.24Å; M309-L546 HydrophobicContact CG-CD2 4.25Å; M309-L546 HydrophobicContact SD-CD1 4.17Å; M309-L546 HydrophobicContact SD-CD2 4.19Å; M309-L546 HydrophobicContact SD-CG 4.29Å; M309-L550 HydrophobicContact CE-CD1 3.96Å; M309-L550 HydrophobicContact CE-CD2 3.89Å; M309-L550 HydrophobicContact SD-CD2 4.07Å
310	K	79.1	Confident	73.9	Confident	137 Å²	137	62.7 Å²	62.7	60%	0.596	34%	0.336	S	S	*	.	H	α-helix	trans	-66	-44.5	175.5	-172.4	178.3	-179.1	-178.7	0	111.4	L306 P307 F308 S313 C314	L306-K310 VanDerWaalsContact O-CB 3.25Å; L306-K310 WeakPolarHBondContact O-CB 3.39Å; L306-K310 PolarHBondContact O-N 3.3Å; P307-K310 PolarHBondContact O-N 3.43Å; F308-K310 VanDerWaalsContact C-N 3.29Å; F308-K310 PolarHBondContact O-N 3.36Å; K310-S313 PolarHBondContact O-N 2.9Å; K310-C314 VanDerWaalsContact O-CB 3.23Å; K310-C314 WeakPolarHBondContact O-CB 3.35Å; K310-C314 PolarHBondContact O-N 3.37Å; K310-C314 PolarHBondContact O-SG 3.23Å
311	S	80	Confident	76	Confident	30 Å²	30	62.5 Å²	62.5	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-56.3	-51.2	175.5	179.6	0	0	0	0	111.5	P307 F308 C314 N315 E543	P307-S311 WeakPolarHBondContact O-CB 3.36Å; P307-S311 PolarHBondContact O-N 3.39Å; F308-S311 WeakPolarHBondContact O-CB 3.13Å; F308-S311 PolarHBondContact O-N 3.1Å; S311-C314 PolarHBondContact O-N 2.92Å; S311-N315 PolarHBondContact O-N 3.46Å; S311-N315 VanDerWaalsContact O-N 3.12Å; S311-E543 WeakPolarHBondContact CB-OE1 3.47Å; S311-E543 PolarHBondContact OG-OE1 2.96Å
312	L	80.4	Confident	77.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.6	-46	176.8	-75.5	167.8	0	0	0	112.3	F308 C314 N315 Y318 M539 E543 L546	F308-L312 WeakPolarHBondContact O-CB 3.32Å; F308-L312 WeakPolarHBondContact O-CG 3.43Å; F308-L312 PolarHBondContact O-N 2.95Å; L312-C314 PolarHBondContact O-N 3.21Å; L312-N315 WeakPolarHBondContact O-CB 3.29Å; L312-N315 PolarHBondContact O-N 3.16Å; L312-N315 VanDerWaalsContact O-N 3.07Å; L312-Y318 HydrophobicContact CB-CD1 4.19Å; L312-Y318 HydrophobicContact CB-CE1 4.04Å; L312-Y318 HydrophobicContact CD2-CD1 4.25Å; L312-Y318 HydrophobicContact CD2-CE1 4.19Å; L312-Y318 HydrophobicContact CD2-CE2 4.47Å; L312-Y318 HydrophobicContact CD2-CG 4.41Å; L312-Y318 WeakPolarHBondContact O-CD1 3.28Å; L312-M539 HydrophobicContact CD2-CG 4.12Å; L312-M539 HydrophobicContact CD2-SD 4.05Å; L312-E543 HydrophobicContact CD2-CB 4.22Å; L312-E543 HydrophobicContact CG-CB 4.47Å; L312-L546 HydrophobicContact CD1-CB 4.38Å; L312-L546 HydrophobicContact CD1-CD2 3.97Å; L312-L546 HydrophobicContact CD1-CG 3.97Å
313	S	80.5	Confident	79.8	Confident	60 Å²	60	58.2 Å²	58.2	42%	0.42	30%	0.299	S	S	.	.	H	α-helix	trans	-66.2	-26.6	178.6	-55.1	0	0	0	0	112.7	M309 K310 M319	M309-S313 VanDerWaalsContact O-CB 3.31Å; M309-S313 WeakPolarHBondContact O-CB 3.28Å; M309-S313 PolarHBondContact O-N 3.06Å; M309-S313 PolarHBondContact O-OG 3.24Å; K310-S313 PolarHBondContact O-N 2.9Å; S313-M319 VanDerWaalsContact O-CG 3.3Å; S313-M319 WeakPolarHBondContact O-CG 3.49Å
314	C	83.7	Confident	81.7	Confident	56 Å²	56	50.9 Å²	50.9	38%	0.378	27%	0.268	S	S	.	.	H	α-helix	trans	-83.7	-9.9	175.4	-71.5	0	0	0	0	113.2	K310 S311 L312 P316 C651	K310-C314 VanDerWaalsContact O-CB 3.23Å; K310-C314 WeakPolarHBondContact O-CB 3.35Å; K310-C314 PolarHBondContact O-N 3.37Å; K310-C314 PolarHBondContact O-SG 3.23Å; S311-C314 PolarHBondContact O-N 2.92Å; L312-C314 PolarHBondContact O-N 3.21Å; C314-P316 WeakPolarHBondContact O-CD 3.22Å; C314-C651 PolarHBondContact SG-SG 2.9Å
315	N	84.6	Confident	83.2	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.064	26%	0.255	C	S	.	.			trans	-82.3	106.1	173.9	-178.2	-17.2	0	0	0	109.7	S311 L312 I317 Y318 M319 C538 M654	S311-N315 PolarHBondContact O-N 3.46Å; S311-N315 VanDerWaalsContact O-N 3.12Å; L312-N315 WeakPolarHBondContact O-CB 3.29Å; L312-N315 PolarHBondContact O-N 3.16Å; L312-N315 VanDerWaalsContact O-N 3.07Å; N315-I317 VanDerWaalsContact C-N 3.3Å; N315-I317 PolarHBondContact O-N 3.33Å; N315-I317 PolarHBondContact OD1-N 3.49Å; N315-I317 VanDerWaalsContact OD1-N 3.16Å; N315-Y318 PolarHBondContact O-N 2.99Å; N315-Y318 PolarHBondContact OD1-N 2.81Å; N315-M319 PolarHBondContact O-N 3.49Å; N315-C538 PolarHBondContact ND2-O 3.36Å; N315-C538 VanDerWaalsContact ND2-O 3.11Å; N315-M654 HydrophobicContact CB-CE 4.24Å
316	P	84.1	Confident	84.5	Confident	42 Å²	42	44.4 Å²	44.4	27%	0.273	24%	0.24	S	C	.	.	H	α-helix	trans	-68.9	-29	-173.2	26.8	-32.3	0	0	0	112.7	C314 Y318 L320 Y655	C314-P316 WeakPolarHBondContact O-CD 3.22Å; P316-Y318 VanDerWaalsContact C-N 3.35Å; P316-L320 WeakPolarHBondContact O-CB 3.27Å; P316-L320 WeakPolarHBondContact O-CD1 3.37Å; P316-L320 WeakPolarHBondContact O-CG 3.43Å; P316-L320 PolarHBondContact O-N 2.87Å; P316-Y655 WeakPolarHBondContact CG-OH 3.33Å
317	I	85.1	Confident	85.6	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-43.4	177.1	-63.5	174.6	0	0	0	109.6	N315 F321 C538 I619 L622 L623	N315-I317 VanDerWaalsContact C-N 3.3Å; N315-I317 PolarHBondContact O-N 3.33Å; N315-I317 PolarHBondContact OD1-N 3.49Å; N315-I317 VanDerWaalsContact OD1-N 3.16Å; I317-F321 WeakPolarHBondContact O-CB 3.25Å; I317-F321 PolarHBondContact O-N 3.4Å; I317-C538 HydrophobicContact CG2-CB 4.04Å; I317-I619 HydrophobicContact CG2-CG2 4.27Å; I317-L622 HydrophobicContact CD1-CB 4.38Å; I317-L622 HydrophobicContact CG1-CB 4.22Å; I317-L622 HydrophobicContact CG1-CD1 4.13Å; I317-L623 HydrophobicContact CD1-CD2 4.16Å
318	Y	88.4	Confident	86.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66	-45.1	178.4	176.9	-102	0	0	0	111.9	L312 N315 P316 L320 F321 I322 L535 M539 G547 L550	L312-Y318 HydrophobicContact CB-CD1 4.19Å; L312-Y318 HydrophobicContact CB-CE1 4.04Å; L312-Y318 HydrophobicContact CD2-CD1 4.25Å; L312-Y318 HydrophobicContact CD2-CE1 4.19Å; L312-Y318 HydrophobicContact CD2-CE2 4.47Å; L312-Y318 HydrophobicContact CD2-CG 4.41Å; L312-Y318 WeakPolarHBondContact O-CD1 3.28Å; N315-Y318 PolarHBondContact O-N 2.99Å; N315-Y318 PolarHBondContact OD1-N 2.81Å; P316-Y318 VanDerWaalsContact C-N 3.35Å; Y318-L320 PolarHBondContact O-N 2.78Å; Y318-F321 WeakPolarHBondContact O-CB 3.28Å; Y318-F321 PolarHBondContact O-N 3.36Å; Y318-F321 VanDerWaalsContact O-N 3.13Å; Y318-I322 HydrophobicContact CD1-CD1 4.02Å; Y318-I322 HydrophobicContact CE1-CD1 3.33Å; Y318-I322 HydrophobicContact CE1-CG1 4.15Å; Y318-I322 HydrophobicContact CE2-CD1 4.42Å; Y318-I322 HydrophobicContact CE2-CG1 4.5Å; Y318-I322 PolarHBondContact O-N 3Å; Y318-L535 HydrophobicContact CD2-CD1 4.07Å; Y318-L535 HydrophobicContact CE2-CD1 3.93Å; Y318-M539 HydrophobicContact CD2-CG 3.97Å; Y318-M539 HydrophobicContact CD2-SD 3.81Å; Y318-M539 HydrophobicContact CE2-CE 4.47Å; Y318-M539 HydrophobicContact CE2-CG 4.32Å; Y318-M539 HydrophobicContact CE2-SD 3.53Å; Y318-M539 VanDerWaalsContact CE2-SD 3.53Å; Y318-G547 VanDerWaalsContact OH-CA 3.32Å; Y318-G547 WeakPolarHBondContact OH-CA 3.45Å; Y318-G547 PolarHBondContact OH-O 2.87Å; Y318-L550 HydrophobicContact CE1-CD2 4.02Å; Y318-L550 WeakPolarHBondContact OH-CB 3.5Å
319	M	90.4	Very high	87.2	Confident	78 Å²	78	39.1 Å²	39.1	38%	0.384	21%	0.209	S	C	.	.	H	α-helix	trans	-64.3	-41.1	177.6	-69.1	-55.9	-66	0	0	113	S313 N315 F321 I322 L323	S313-M319 VanDerWaalsContact O-CG 3.3Å; S313-M319 WeakPolarHBondContact O-CG 3.49Å; N315-M319 PolarHBondContact O-N 3.49Å; M319-F321 VanDerWaalsContact C-N 3.28Å; M319-F321 PolarHBondContact O-N 3.44Å; M319-I322 PolarHBondContact O-N 3.31Å; M319-I322 HydrophobicContact SD-CD1 4.27Å; M319-L323 PolarHBondContact O-N 2.92Å
320	L	90.5	Very high	88.1	Confident	34 Å²	34	37.6 Å²	37.6	18%	0.178	20%	0.202	C	C	.	.	H	α-helix	trans	-63	-36.7	172.9	-71.8	168.4	0	0	0	111.4	P316 Y318 L323 I324 P615 I618 I619 L622	P316-L320 WeakPolarHBondContact O-CB 3.27Å; P316-L320 WeakPolarHBondContact O-CD1 3.37Å; P316-L320 WeakPolarHBondContact O-CG 3.43Å; P316-L320 PolarHBondContact O-N 2.87Å; Y318-L320 PolarHBondContact O-N 2.78Å; L320-L323 WeakPolarHBondContact O-CB 3.12Å; L320-L323 PolarHBondContact O-N 2.87Å; L320-I324 VanDerWaalsContact O-CG1 3.31Å; L320-I324 WeakPolarHBondContact O-CG1 3.24Å; L320-I324 PolarHBondContact O-N 3.21Å; L320-P615 HydrophobicContact CD2-CB 3.89Å; L320-I618 HydrophobicContact CD1-CB 4.18Å; L320-I618 HydrophobicContact CD1-CG2 3.54Å; L320-I619 HydrophobicContact CB-CD1 3.79Å; L320-I619 HydrophobicContact CB-CG1 3.72Å; L320-I619 HydrophobicContact CD1-CG1 4.05Å; L320-L622 HydrophobicContact CD1-CD1 3.87Å
321	F	89.3	Confident	88.8	Confident	28 Å²	28	31.1 Å²	31.1	12%	0.123	17%	0.173	C	C	.	.	H	α-helix	trans	-68	-40.1	176.7	-167.8	-80.4	0	0	0	112.3	I317 Y318 M319 L323 I324 S325 G531 V534 L535 H551 I619	I317-F321 WeakPolarHBondContact O-CB 3.25Å; I317-F321 PolarHBondContact O-N 3.4Å; Y318-F321 WeakPolarHBondContact O-CB 3.28Å; Y318-F321 PolarHBondContact O-N 3.36Å; Y318-F321 VanDerWaalsContact O-N 3.13Å; M319-F321 VanDerWaalsContact C-N 3.28Å; M319-F321 PolarHBondContact O-N 3.44Å; F321-L323 VanDerWaalsContact C-N 3.3Å; F321-L323 PolarHBondContact O-N 3.26Å; F321-I324 PolarHBondContact O-N 2.92Å; F321-S325 WeakPolarHBondContact CD1-OG 3.34Å; F321-S325 WeakPolarHBondContact CE1-OG 3.39Å; F321-S325 WeakPolarHBondContact O-CB 3.45Å; F321-S325 PolarHBondContact O-N 3.14Å; F321-S325 PolarHBondContact O-OG 3.05Å; F321-G531 WeakPolarHBondContact CZ-O 3.13Å; F321-V534 HydrophobicContact CE2-CG1 4.48Å; F321-L535 HydrophobicContact CD1-CB 4.17Å; F321-L535 HydrophobicContact CD1-CD1 3.66Å; F321-L535 HydrophobicContact CD1-CG 4.32Å; F321-L535 HydrophobicContact CE1-CB 3.65Å; F321-L535 HydrophobicContact CE1-CD1 3.86Å; F321-L535 HydrophobicContact CE1-CD2 3.94Å; F321-L535 HydrophobicContact CE1-CG 4.01Å; F321-L535 HydrophobicContact CE2-CB 4.3Å; F321-L535 HydrophobicContact CG-CD1 4.38Å; F321-L535 HydrophobicContact CZ-CB 3.72Å; F321-H551 AromaticContact CE1-NE2 3.92Å; F321-I619 HydrophobicContact CB-CD1 4.19Å
322	I	90.8	Very high	89.3	Confident	13 Å²	13	33.1 Å²	33.1	7%	0.067	18%	0.178	C	C	.	.	H	α-helix	trans	-57.6	-47.2	171.2	-71.7	178.1	0	0	0	109.7	Y318 M319 I324 S325 V326 L550 C554	Y318-I322 HydrophobicContact CD1-CD1 4.02Å; Y318-I322 HydrophobicContact CE1-CD1 3.33Å; Y318-I322 HydrophobicContact CE1-CG1 4.15Å; Y318-I322 HydrophobicContact CE2-CD1 4.42Å; Y318-I322 HydrophobicContact CE2-CG1 4.5Å; Y318-I322 PolarHBondContact O-N 3Å; M319-I322 PolarHBondContact O-N 3.31Å; M319-I322 HydrophobicContact SD-CD1 4.27Å; I322-I324 PolarHBondContact O-N 2.87Å; I322-S325 PolarHBondContact O-N 3.29Å; I322-S325 VanDerWaalsContact O-N 3.15Å; I322-V326 HydrophobicContact CG2-CG2 4.17Å; I322-V326 WeakPolarHBondContact O-CG2 3.26Å; I322-V326 PolarHBondContact O-N 3.17Å; I322-L550 HydrophobicContact CD1-CG 4.4Å; I322-C554 HydrophobicContact CG2-CB 3.84Å
323	L	93	Very high	89.7	Confident	85 Å²	85	34 Å²	34	45%	0.445	18%	0.184	S	C	.	.	H	α-helix	trans	-59.1	-47.6	179.4	-179.5	61.9	0	0	0	111.9	M319 L320 F321 S325 V326 I327 P615	M319-L323 PolarHBondContact O-N 2.92Å; L320-L323 WeakPolarHBondContact O-CB 3.12Å; L320-L323 PolarHBondContact O-N 2.87Å; F321-L323 VanDerWaalsContact C-N 3.3Å; F321-L323 PolarHBondContact O-N 3.26Å; L323-S325 VanDerWaalsContact C-N 3.3Å; L323-S325 PolarHBondContact O-N 3.29Å; L323-V326 PolarHBondContact O-N 3.31Å; L323-I327 HydrophobicContact CD1-CD1 3.94Å; L323-I327 HydrophobicContact CD1-CG1 4.37Å; L323-I327 HydrophobicContact CG-CD1 3.99Å; L323-I327 VanDerWaalsContact O-CG1 3.28Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.35Å; L323-I327 VanDerWaalsContact O-N 3.08Å; L323-P615 HydrophobicContact CD2-CB 4.42Å; L323-P615 HydrophobicContact CD2-CG 4.39Å
324	I	92.7	Very high	90.1	Very high	14 Å²	14	31.2 Å²	31.2	7%	0.072	16%	0.164	C	C	.	.	H	α-helix	trans	-56.2	-48.1	174.2	-68.4	162.9	0	0	0	110.4	L320 F321 I322 V326 I327 Q328 P615 A616 I619	L320-I324 VanDerWaalsContact O-CG1 3.31Å; L320-I324 WeakPolarHBondContact O-CG1 3.24Å; L320-I324 PolarHBondContact O-N 3.21Å; F321-I324 PolarHBondContact O-N 2.92Å; I322-I324 PolarHBondContact O-N 2.87Å; I324-V326 PolarHBondContact O-N 3.29Å; I324-I327 PolarHBondContact O-N 2.93Å; I324-Q328 HydrophobicContact CG2-CG 4.19Å; I324-Q328 WeakPolarHBondContact O-CB 3.49Å; I324-Q328 WeakPolarHBondContact O-CG 3.48Å; I324-Q328 PolarHBondContact O-N 3.22Å; I324-P615 HydrophobicContact CD1-CB 4.17Å; I324-P615 HydrophobicContact CD1-CG 4.4Å; I324-P615 HydrophobicContact CG1-CB 3.82Å; I324-P615 HydrophobicContact CG1-CG 3.61Å; I324-A616 HydrophobicContact CD1-CB 3.93Å; I324-I619 HydrophobicContact CD1-CD1 3.44Å; I324-I619 VanDerWaalsContact CD1-CD1 3.44Å; I324-I619 HydrophobicContact CD1-CG1 4.48Å
325	S	91.9	Very high	90.4	Very high	17 Å²	17	30 Å²	30	12%	0.119	15%	0.154	C	C	.	.	H	α-helix	trans	-64.4	-41.4	-176.7	-60.8	0	0	0	0	112.1	F321 I322 L323 F329 H551	F321-S325 WeakPolarHBondContact CD1-OG 3.34Å; F321-S325 WeakPolarHBondContact CE1-OG 3.39Å; F321-S325 WeakPolarHBondContact O-CB 3.45Å; F321-S325 PolarHBondContact O-N 3.14Å; F321-S325 PolarHBondContact O-OG 3.05Å; I322-S325 PolarHBondContact O-N 3.29Å; I322-S325 VanDerWaalsContact O-N 3.15Å; L323-S325 VanDerWaalsContact C-N 3.3Å; L323-S325 PolarHBondContact O-N 3.29Å; S325-F329 WeakPolarHBondContact O-CA 3.43Å; S325-F329 WeakPolarHBondContact O-CB 3.37Å; S325-F329 PolarHBondContact O-N 3.23Å; S325-H551 WeakPolarHBondContact CB-NE2 3.06Å; S325-H551 PolarHBondContact OG-NE2 2.84Å
326	V	94.6	Very high	90.5	Very high	21 Å²	21	33.3 Å²	33.3	13%	0.127	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-48.2	175.9	168.7	0	0	0	0	110.1	I322 L323 I324 N330 C554 T555 F558 A559	I322-V326 HydrophobicContact CG2-CG2 4.17Å; I322-V326 WeakPolarHBondContact O-CG2 3.26Å; I322-V326 PolarHBondContact O-N 3.17Å; L323-V326 PolarHBondContact O-N 3.31Å; I324-V326 PolarHBondContact O-N 3.29Å; V326-N330 VanDerWaalsContact O-CB 3.23Å; V326-N330 WeakPolarHBondContact O-CB 3.31Å; V326-N330 PolarHBondContact O-N 2.88Å; V326-C554 HydrophobicContact CG2-CB 4.44Å; V326-T555 HydrophobicContact CG2-CG2 4.23Å; V326-F558 HydrophobicContact CG1-CB 3.63Å; V326-F558 HydrophobicContact CG2-CB 4.3Å; V326-A559 HydrophobicContact CG1-CB 4.43Å; V326-A559 WeakPolarHBondContact O-CB 3.42Å
327	I	94.1	Very high	90.7	Very high	29 Å²	29	31.8 Å²	31.8	15%	0.149	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-46	-179.1	-65.4	168.7	0	0	0	111.3	L323 I324 N330 A331 L608	L323-I327 HydrophobicContact CD1-CD1 3.94Å; L323-I327 HydrophobicContact CD1-CG1 4.37Å; L323-I327 HydrophobicContact CG-CD1 3.99Å; L323-I327 VanDerWaalsContact O-CG1 3.28Å; L323-I327 WeakPolarHBondContact O-CG1 3.43Å; L323-I327 PolarHBondContact O-N 3.35Å; L323-I327 VanDerWaalsContact O-N 3.08Å; I324-I327 PolarHBondContact O-N 2.93Å; I327-N330 WeakPolarHBondContact O-CB 3.47Å; I327-N330 PolarHBondContact O-N 3.37Å; I327-A331 PolarHBondContact O-N 3.42Å; I327-L608 HydrophobicContact CG2-CB 4.08Å; I327-L608 WeakPolarHBondContact CG2-O 3.17Å
328	Q	92.1	Very high	91	Very high	49 Å²	49	31.3 Å²	31.3	23%	0.229	16%	0.158	C	C	.	.	H	α-helix	trans	-70.7	-40.6	-179.6	-70.7	-172.1	0.6	0	0	112.5	I324 N330 A331 F332 S612	I324-Q328 HydrophobicContact CG2-CG 4.19Å; I324-Q328 WeakPolarHBondContact O-CB 3.49Å; I324-Q328 WeakPolarHBondContact O-CG 3.48Å; I324-Q328 PolarHBondContact O-N 3.22Å; Q328-N330 VanDerWaalsContact C-N 3.28Å; Q328-N330 PolarHBondContact O-N 3.44Å; Q328-A331 PolarHBondContact O-N 3.25Å; Q328-F332 WeakPolarHBondContact O-CB 3.3Å; Q328-F332 PolarHBondContact O-N 3.26Å; Q328-S612 PolarHBondContact NE2-OG 3.42Å; Q328-S612 VanDerWaalsContact NE2-OG 3.09Å
329	F	91.4	Very high	91.1	Very high	53 Å²	53	32 Å²	32	23%	0.232	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-35.3	177.2	-168.7	-113.5	0	0	0	111.2	S325 F332 V333 A559	S325-F329 WeakPolarHBondContact O-CA 3.43Å; S325-F329 WeakPolarHBondContact O-CB 3.37Å; S325-F329 PolarHBondContact O-N 3.23Å; F329-F332 HydrophobicContact CD2-CD1 4.21Å; F329-F332 HydrophobicContact CE2-CD1 4.18Å; F329-F332 PolarHBondContact O-N 3.14Å; F329-V333 HydrophobicContact CD1-CG2 4.04Å; F329-V333 HydrophobicContact CE1-CG2 3.74Å; F329-V333 HydrophobicContact CE2-CG2 4.28Å; F329-V333 HydrophobicContact CG-CG2 4.44Å; F329-V333 HydrophobicContact CZ-CG2 3.86Å; F329-V333 VanDerWaalsContact O-CG2 3.31Å; F329-V333 WeakPolarHBondContact O-CG2 3.39Å; F329-V333 PolarHBondContact O-N 3.44Å; F329-A559 HydrophobicContact CB-CB 4.34Å; F329-A559 HydrophobicContact CD1-CB 3.8Å
330	N	93.4	Very high	91.2	Very high	14 Å²	14	28.8 Å²	28.8	8%	0.075	15%	0.146	C	C	.	.	H	α-helix	trans	-59.7	-50.3	173.3	-165.5	-58.3	0	0	0	111.5	V326 I327 Q328 F332 V333 N334 A559 A563 Y566 L608	V326-N330 VanDerWaalsContact O-CB 3.23Å; V326-N330 WeakPolarHBondContact O-CB 3.31Å; V326-N330 PolarHBondContact O-N 2.88Å; I327-N330 WeakPolarHBondContact O-CB 3.47Å; I327-N330 PolarHBondContact O-N 3.37Å; Q328-N330 VanDerWaalsContact C-N 3.28Å; Q328-N330 PolarHBondContact O-N 3.44Å; N330-F332 VanDerWaalsContact C-N 3.3Å; N330-F332 PolarHBondContact O-N 3.35Å; N330-V333 PolarHBondContact O-N 3.37Å; N330-N334 PolarHBondContact O-N 3.45Å; N330-N334 PolarHBondContact O-ND2 2.92Å; N330-N334 PolarHBondContact OD1-ND2 3.3Å; N330-A559 HydrophobicContact CB-CB 3.74Å; N330-A563 WeakPolarHBondContact OD1-CB 3.5Å; N330-Y566 PolarHBondContact OD1-OH 3.32Å; N330-L608 HydrophobicContact CB-CD1 4.46Å
331	A	93.3	Very high	91.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.7	-41.8	175.1	0	0	0	0	0	112.4	I327 Q328 N334 M335 P605 L608 R609	I327-A331 PolarHBondContact O-N 3.42Å; Q328-A331 PolarHBondContact O-N 3.25Å; A331-N334 PolarHBondContact O-N 2.88Å; A331-M335 WeakPolarHBondContact O-CG 3.31Å; A331-M335 PolarHBondContact O-N 2.85Å; A331-P605 HydrophobicContact CB-CB 3.98Å; A331-L608 HydrophobicContact CB-CB 4.19Å; A331-L608 HydrophobicContact CB-CD1 4.44Å; A331-R609 HydrophobicContact CB-CG 3.59Å
332	F	90.7	Very high	91.4	Very high	72 Å²	72	26.2 Å²	26.2	32%	0.316	13%	0.133	S	C	.	.	H	α-helix	trans	-64.7	-46.1	179.5	178.4	-102.6	0	0	0	113	Q328 F329 N330 N334 M335 I336 Y524	Q328-F332 WeakPolarHBondContact O-CB 3.3Å; Q328-F332 PolarHBondContact O-N 3.26Å; F329-F332 HydrophobicContact CD2-CD1 4.21Å; F329-F332 HydrophobicContact CE2-CD1 4.18Å; F329-F332 PolarHBondContact O-N 3.14Å; N330-F332 VanDerWaalsContact C-N 3.3Å; N330-F332 PolarHBondContact O-N 3.35Å; F332-N334 VanDerWaalsContact C-N 3.29Å; F332-N334 PolarHBondContact O-N 3.43Å; F332-M335 PolarHBondContact O-N 2.85Å; F332-I336 HydrophobicContact CD1-CD1 4.19Å; F332-I336 HydrophobicContact CD2-CD1 4.14Å; F332-I336 HydrophobicContact CE1-CD1 3.51Å; F332-I336 HydrophobicContact CE2-CD1 3.45Å; F332-I336 VanDerWaalsContact CE2-CD1 3.45Å; F332-I336 HydrophobicContact CE2-CG1 4.24Å; F332-I336 HydrophobicContact CG-CD1 4.48Å; F332-I336 HydrophobicContact CZ-CD1 3.11Å; F332-I336 HydrophobicContact CZ-CG1 4.27Å; F332-I336 PolarHBondContact O-N 3.34Å; F332-Y524 HydrophobicContact CD2-CE1 4.21Å; F332-Y524 AromaticContact CD2-CZ 3.98Å; F332-Y524 AromaticContact CE2-CE1 3.85Å; F332-Y524 HydrophobicContact CE2-CE1 3.85Å
333	V	89.4	Confident	91.5	Very high	20 Å²	20	25.6 Å²	25.6	12%	0.121	13%	0.13	C	C	.	.	H	α-helix	trans	-60.1	-41.2	177.9	168.6	0	0	0	0	110.9	F329 N330 S337 A563 P564	F329-V333 HydrophobicContact CD1-CG2 4.04Å; F329-V333 HydrophobicContact CE1-CG2 3.74Å; F329-V333 HydrophobicContact CE2-CG2 4.28Å; F329-V333 HydrophobicContact CG-CG2 4.44Å; F329-V333 HydrophobicContact CZ-CG2 3.86Å; F329-V333 VanDerWaalsContact O-CG2 3.31Å; F329-V333 WeakPolarHBondContact O-CG2 3.39Å; F329-V333 PolarHBondContact O-N 3.44Å; N330-V333 PolarHBondContact O-N 3.37Å; V333-S337 VanDerWaalsContact O-CB 3.27Å; V333-S337 WeakPolarHBondContact O-CB 3.25Å; V333-S337 PolarHBondContact O-N 2.94Å; V333-S337 PolarHBondContact O-OG 3.43Å; V333-A563 HydrophobicContact CB-CB 4.48Å; V333-A563 HydrophobicContact CG1-CB 4.26Å; V333-P564 HydrophobicContact CG1-CG 3.73Å
334	N	88.2	Confident	91.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-48.8	177.7	-69.7	-14.7	0	0	0	112.1	N330 A331 F332 I336 F338 A563 Y566 F567 P605	N330-N334 PolarHBondContact O-N 3.45Å; N330-N334 PolarHBondContact O-ND2 2.92Å; N330-N334 PolarHBondContact OD1-ND2 3.3Å; A331-N334 PolarHBondContact O-N 2.88Å; F332-N334 VanDerWaalsContact C-N 3.29Å; F332-N334 PolarHBondContact O-N 3.43Å; N334-I336 PolarHBondContact O-N 2.9Å; N334-F338 PolarHBondContact O-N 3.09Å; N334-A563 VanDerWaalsContact OD1-C 3.32Å; N334-A563 WeakPolarHBondContact OD1-CB 3.19Å; N334-A563 PolarHBondContact OD1-O 2.69Å; N334-Y566 PolarHBondContact ND2-OH 3.4Å; N334-Y566 VanDerWaalsContact ND2-OH 3.09Å; N334-F567 HydrophobicContact CB-CD1 4.46Å; N334-F567 HydrophobicContact CB-CD2 3.9Å; N334-F567 HydrophobicContact CB-CE1 4.42Å; N334-F567 HydrophobicContact CB-CE2 3.89Å; N334-F567 HydrophobicContact CB-CG 4.15Å; N334-F567 HydrophobicContact CB-CZ 4.08Å; N334-F567 WeakPolarHBondContact ND2-CD2 3.17Å; N334-P605 HydrophobicContact CB-CG 4.41Å
335	M	89.6	Confident	91.2	Very high	32 Å²	32	22.8 Å²	22.8	16%	0.158	11%	0.114	C	C	.	.	H	α-helix	trans	-56.9	-51.2	177.6	-73.8	-176	179.9	0	0	110.5	A331 F332 M339 H402 Y601 P605	A331-M335 WeakPolarHBondContact O-CG 3.31Å; A331-M335 PolarHBondContact O-N 2.85Å; F332-M335 PolarHBondContact O-N 2.85Å; M335-M339 VanDerWaalsContact O-CB 3.24Å; M335-M339 WeakPolarHBondContact O-CB 3.15Å; M335-M339 PolarHBondContact O-N 2.95Å; M335-M339 VanDerWaalsContact O-N 3.11Å; M335-H402 WeakPolarHBondContact CE-CE1 3.43Å; M335-H402 WeakPolarHBondContact CE-NE2 3.48Å; M335-Y601 PolarHBondContact O-OH 2.84Å; M335-Y601 VanDerWaalsContact O-OH 3.1Å; M335-P605 HydrophobicContact CE-CB 3.38Å; M335-P605 HydrophobicContact CE-CG 4.31Å; M335-P605 HydrophobicContact CG-CB 4.06Å; M335-P605 HydrophobicContact CG-CG 4.15Å; M335-P605 HydrophobicContact SD-CB 4.48Å
336	I	87.8	Confident	91.2	Very high	81 Å²	81	22 Å²	22	42%	0.415	11%	0.109	S	C	.	.	H	α-helix	trans	-67.4	-45.1	-176.4	-70.5	-172.9	0	0	0	112.9	F332 N334 F338	F332-I336 HydrophobicContact CD1-CD1 4.19Å; F332-I336 HydrophobicContact CD2-CD1 4.14Å; F332-I336 HydrophobicContact CE1-CD1 3.51Å; F332-I336 HydrophobicContact CE2-CD1 3.45Å; F332-I336 VanDerWaalsContact CE2-CD1 3.45Å; F332-I336 HydrophobicContact CE2-CG1 4.24Å; F332-I336 HydrophobicContact CG-CD1 4.48Å; F332-I336 HydrophobicContact CZ-CD1 3.11Å; F332-I336 HydrophobicContact CZ-CG1 4.27Å; F332-I336 PolarHBondContact O-N 3.34Å; N334-I336 PolarHBondContact O-N 2.9Å; I336-F338 VanDerWaalsContact C-N 3.3Å; I336-F338 PolarHBondContact O-N 2.88Å
337	S	88.6	Confident	91	Very high	10 Å²	10	21.3 Å²	21.3	7%	0.07	10%	0.104	C	C	.	.	H	α-helix	trans	-67.9	-31.8	-171.1	-55.1	0	0	0	0	112.7	N62 V333	N62-S337 PolarHBondContact ND2-OG 3.13Å; V333-S337 VanDerWaalsContact O-CB 3.27Å; V333-S337 WeakPolarHBondContact O-CB 3.25Å; V333-S337 PolarHBondContact O-N 2.94Å; V333-S337 PolarHBondContact O-OG 3.43Å
338	F	90.1	Very high	90.8	Very high	7 Å²	7	21.7 Å²	21.7	3%	0.031	12%	0.115	C	C	.	.	H	α-helix	trans	-112	2.7	-174	-61.9	-72.4	0	0	0	114	T55 N334 I336 K341 Y342 P564 F567 M571 Y601	T55-F338 HydrophobicContact CG2-CD1 4.23Å; T55-F338 HydrophobicContact CG2-CE1 3.49Å; T55-F338 VanDerWaalsContact CG2-CE1 3.49Å; T55-F338 HydrophobicContact CG2-CZ 4.24Å; N334-F338 PolarHBondContact O-N 3.09Å; I336-F338 VanDerWaalsContact C-N 3.3Å; I336-F338 PolarHBondContact O-N 2.88Å; F338-K341 PolarHBondContact O-N 3.48Å; F338-Y342 PolarHBondContact O-N 2.94Å; F338-P564 HydrophobicContact CE2-CB 4.46Å; F338-F567 HydrophobicContact CB-CD1 4.43Å; F338-F567 HydrophobicContact CB-CE1 3.94Å; F338-F567 AromaticContact CD2-CD1 3.18Å; F338-F567 HydrophobicContact CD2-CD1 3.18Å; F338-F567 AromaticContact CD2-CE1 3.5Å; F338-F567 HydrophobicContact CD2-CE1 3.5Å; F338-F567 HydrophobicContact CD2-CG 4.19Å; F338-F567 HydrophobicContact CE2-CB 4.06Å; F338-F567 AromaticContact CE2-CD1 3.43Å; F338-F567 HydrophobicContact CE2-CD1 3.43Å; F338-F567 VanDerWaalsContact CE2-CD1 3.43Å; F338-F567 HydrophobicContact CE2-CE1 4.22Å; F338-F567 HydrophobicContact CE2-CG 4.14Å; F338-F567 AromaticContact CG-CD1 3.88Å; F338-F567 HydrophobicContact CG-CD1 3.88Å; F338-F567 AromaticContact CG-CE1 3.89Å; F338-F567 HydrophobicContact CG-CE1 3.89Å; F338-F567 HydrophobicContact CZ-CD1 4.29Å; F338-M571 HydrophobicContact CB-CE 3.86Å; F338-M571 HydrophobicContact CB-SD 4.02Å; F338-M571 HydrophobicContact CD1-CE 3.73Å; F338-M571 HydrophobicContact CD1-SD 3.43Å; F338-M571 WeakPolarHBondContact CD1-SD 3.04Å; F338-M571 HydrophobicContact CD2-SD 4.08Å; F338-M571 HydrophobicContact CE1-SD 3.82Å; F338-M571 HydrophobicContact CE2-SD 4.4Å; F338-M571 HydrophobicContact CG-CE 3.95Å; F338-M571 HydrophobicContact CG-SD 3.56Å; F338-M571 VanDerWaalsContact CG-SD 3.56Å; F338-M571 HydrophobicContact CZ-SD 4.27Å; F338-Y601 HydrophobicContact CB-CD2 4.31Å; F338-Y601 HydrophobicContact CB-CE2 4.09Å
339	M	91.4	Very high	90.7	Very high	16 Å²	16	22.5 Å²	22.5	8%	0.079	12%	0.118	C	C	.	.	H	α-helix	trans	-56.5	-43.9	176.8	-168.6	164.2	-179.1	0	0	113.8	M335 K341 Y342 I343 I358 N362 F513 Y601	M335-M339 VanDerWaalsContact O-CB 3.24Å; M335-M339 WeakPolarHBondContact O-CB 3.15Å; M335-M339 PolarHBondContact O-N 2.95Å; M335-M339 VanDerWaalsContact O-N 3.11Å; M339-K341 VanDerWaalsContact C-N 3.34Å; M339-K341 PolarHBondContact O-N 3.05Å; M339-Y342 PolarHBondContact O-N 3.31Å; M339-I343 HydrophobicContact CE-CD1 4.28Å; M339-I343 HydrophobicContact CG-CD1 4.28Å; M339-I343 WeakPolarHBondContact O-CG1 3.41Å; M339-I343 PolarHBondContact O-N 3.32Å; M339-I358 HydrophobicContact CB-CD1 3.96Å; M339-I358 HydrophobicContact CE-CG1 4.07Å; M339-I358 HydrophobicContact CG-CD1 3.66Å; M339-I358 HydrophobicContact CG-CG1 3.95Å; M339-I358 HydrophobicContact SD-CD1 4.32Å; M339-I358 HydrophobicContact SD-CG1 4.05Å; M339-I358 HydrophobicContact SD-CG2 4.37Å; M339-N362 WeakPolarHBondContact CE-ND2 3.36Å; M339-F513 HydrophobicContact CE-CE1 4Å; M339-F513 HydrophobicContact CE-CZ 4.43Å; M339-Y601 WeakPolarHBondContact CA-OH 3.07Å; M339-Y601 WeakPolarHBondContact CB-OH 3.4Å
340	P	92.3	Very high	90.8	Very high	9 Å²	9	20.1 Å²	20.1	6%	0.058	11%	0.108	C	C	.	.	H	α-helix	trans	-58.5	-48.4	176.5	-22.6	33.4	0	0	0	111.3	Y342 I343 E344 I355 I358	P340-Y342 VanDerWaalsContact C-N 3.32Å; P340-Y342 PolarHBondContact O-N 2.93Å; P340-I343 PolarHBondContact O-N 2.95Å; P340-I343 VanDerWaalsContact O-N 3.12Å; P340-E344 WeakPolarHBondContact O-CG 3.49Å; P340-E344 PolarHBondContact O-N 2.85Å; P340-I355 HydrophobicContact CB-CG1 4.16Å; P340-I355 HydrophobicContact CG-CG1 4.34Å; P340-I358 HydrophobicContact CB-CD1 4.22Å; P340-I358 HydrophobicContact CG-CD1 3.76Å
341	K	91.7	Very high	90.8	Very high	8 Å²	8	19.6 Å²	19.6	4%	0.035	11%	0.105	C	C	.	.	H	α-helix	trans	-61.3	-39	178.6	-164.8	169	-176.2	169.4	0	112.1	T45 E48 T55 F338 M339 E344 Q345 M571 Y592 F597	T45-K341 HydrophobicContact CG2-CB 3.89Å; T45-K341 HydrophobicContact CG2-CD 4.24Å; T45-K341 HydrophobicContact CG2-CG 4.18Å; E48-K341 IonicContact OE1-NZ 3.85Å; E48-K341 PolarHBondContact OE1-NZ 2.9Å; E48-K341 IonicContact OE2-NZ 3.76Å; E48-K341 PolarHBondContact OE2-NZ 3.31Å; T55-K341 PolarHBondContact OG1-NZ 3.45Å; F338-K341 PolarHBondContact O-N 3.48Å; M339-K341 VanDerWaalsContact C-N 3.34Å; M339-K341 PolarHBondContact O-N 3.05Å; K341-E344 PolarHBondContact O-N 3.44Å; K341-Q345 HydrophobicContact CG-CG 4.5Å; K341-Q345 VanDerWaalsContact O-CG 3.32Å; K341-Q345 WeakPolarHBondContact O-CG 3.29Å; K341-Q345 PolarHBondContact O-N 2.89Å; K341-M571 HydrophobicContact CB-CE 4.43Å; K341-M571 HydrophobicContact CD-CE 3.82Å; K341-M571 HydrophobicContact CG-CE 4.22Å; K341-Y592 VanDerWaalsContact CE-OH 3.3Å; K341-Y592 WeakPolarHBondContact CE-OH 3.42Å; K341-Y592 PolarHBondContact NZ-OH 3.31Å; K341-F597 HydrophobicContact CG-CZ 4.24Å
342	Y	92.4	Very high	90.8	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-45	174	174.6	-100.7	0	0	0	112.2	F338 M339 P340 Q345 Q346 Y347 F513 F597 R598 Y601	F338-Y342 PolarHBondContact O-N 2.94Å; M339-Y342 PolarHBondContact O-N 3.31Å; P340-Y342 VanDerWaalsContact C-N 3.32Å; P340-Y342 PolarHBondContact O-N 2.93Å; Y342-Q345 PolarHBondContact O-N 2.93Å; Y342-Q346 HydrophobicContact CD2-CB 4.41Å; Y342-Q346 HydrophobicContact CE1-CB 4.39Å; Y342-Q346 HydrophobicContact CE2-CB 4.08Å; Y342-Q346 HydrophobicContact CE2-CG 4.26Å; Y342-Q346 WeakPolarHBondContact O-CB 3.37Å; Y342-Q346 PolarHBondContact O-N 3.38Å; Y342-Y347 HydrophobicContact CE1-CE2 4.16Å; Y342-F513 HydrophobicContact CD1-CE1 4.47Å; Y342-F513 HydrophobicContact CD1-CZ 4.11Å; Y342-F513 HydrophobicContact CE1-CE1 4.15Å; Y342-F513 AromaticContact CE1-CE2 3.87Å; Y342-F513 HydrophobicContact CE1-CE2 3.87Å; Y342-F513 AromaticContact CE1-CZ 3.62Å; Y342-F513 HydrophobicContact CE1-CZ 3.62Å; Y342-F597 HydrophobicContact CD2-CD1 4.08Å; Y342-F597 AromaticContact CD2-CE1 3.9Å; Y342-F597 HydrophobicContact CD2-CE1 3.9Å; Y342-R598 HydrophobicContact CE2-CB 4.22Å; Y342-R598 HydrophobicContact CE2-CG 4.13Å; Y342-Y601 AromaticContact CD1-CD1 3.9Å; Y342-Y601 HydrophobicContact CD1-CD1 3.9Å; Y342-Y601 AromaticContact CD1-CE1 3.6Å; Y342-Y601 HydrophobicContact CD1-CE1 3.6Å; Y342-Y601 AromaticContact CD2-CD1 3.22Å; Y342-Y601 HydrophobicContact CD2-CD1 3.22Å; Y342-Y601 HydrophobicContact CD2-CD2 4.42Å; Y342-Y601 AromaticContact CD2-CE1 3.82Å; Y342-Y601 HydrophobicContact CD2-CE1 3.82Å; Y342-Y601 AromaticContact CD2-CG 3.59Å; Y342-Y601 HydrophobicContact CD2-CG 3.59Å; Y342-Y601 HydrophobicContact CE1-CD1 4.23Å; Y342-Y601 HydrophobicContact CE1-CE1 4.08Å; Y342-Y601 AromaticContact CE2-CD1 3.61Å; Y342-Y601 HydrophobicContact CE2-CD1 3.61Å; Y342-Y601 HydrophobicContact CE2-CE1 4.28Å; Y342-Y601 HydrophobicContact CE2-CG 4.26Å; Y342-Y601 AromaticContact CG-CD1 3.39Å; Y342-Y601 HydrophobicContact CG-CD1 3.39Å; Y342-Y601 HydrophobicContact CG-CD2 4.39Å; Y342-Y601 AromaticContact CG-CE1 3.44Å; Y342-Y601 HydrophobicContact CG-CE1 3.44Å; Y342-Y601 VanDerWaalsContact CG-CE1 3.44Å; Y342-Y601 HydrophobicContact CG-CE2 4.44Å; Y342-Y601 AromaticContact CG-CG 3.91Å; Y342-Y601 HydrophobicContact CG-CG 3.91Å
343	I	92.8	Very high	91	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.6	-40.7	178.3	-66.2	175.7	0	0	0	111.1	M339 P340 Y347 K349 A354 I358 L510 F513 L514	M339-I343 HydrophobicContact CE-CD1 4.28Å; M339-I343 HydrophobicContact CG-CD1 4.28Å; M339-I343 WeakPolarHBondContact O-CG1 3.41Å; M339-I343 PolarHBondContact O-N 3.32Å; P340-I343 PolarHBondContact O-N 2.95Å; P340-I343 VanDerWaalsContact O-N 3.12Å; I343-Y347 HydrophobicContact CG2-CD2 4.37Å; I343-Y347 PolarHBondContact O-N 2.79Å; I343-K349 HydrophobicContact CG2-CB 4.23Å; I343-K349 HydrophobicContact CG2-CG 4.46Å; I343-A354 HydrophobicContact CB-CB 3.86Å; I343-A354 HydrophobicContact CG2-CB 3.71Å; I343-I358 HydrophobicContact CD1-CD1 3.99Å; I343-I358 HydrophobicContact CD1-CG1 3.76Å; I343-L510 HydrophobicContact CG2-CD1 4.13Å; I343-F513 HydrophobicContact CG1-CE1 4.45Å; I343-L514 HydrophobicContact CD1-CD2 4.46Å
344	E	90.9	Very high	91.3	Very high	14 Å²	14	18.9 Å²	18.9	7%	0.065	10%	0.104	C	C	.	.	H	α-helix	trans	-57.3	-52.4	175.2	-70.5	179.8	-121.8	0	0	111.3	R49 P340 K341 G348 K349 S351 A354	R49-E344 IonicContact CZ-OE2 3.26Å; R49-E344 IonicContact NH2-OE2 2.69Å; R49-E344 PolarHBondContact NH2-OE2 3.11Å; P340-E344 WeakPolarHBondContact O-CG 3.49Å; P340-E344 PolarHBondContact O-N 2.85Å; K341-E344 PolarHBondContact O-N 3.44Å; E344-G348 WeakPolarHBondContact O-CA 3.4Å; E344-G348 PolarHBondContact O-N 2.73Å; E344-K349 WeakPolarHBondContact CA-O 3.38Å; E344-K349 WeakPolarHBondContact CG-O 3.17Å; E344-S351 VanDerWaalsContact CD-CA 3.46Å; E344-S351 VanDerWaalsContact CD-CB 3.45Å; E344-S351 WeakPolarHBondContact OE1-CA 3.45Å; E344-S351 WeakPolarHBondContact OE1-CB 3.45Å; E344-S351 PolarHBondContact OE1-OG 3.34Å; E344-A354 HydrophobicContact CG-CB 4.32Å
345	Q	89.4	Confident	91.6	Very high	26 Å²	26	18.9 Å²	18.9	12%	0.121	10%	0.104	C	C	.	.	H	α-helix	trans	-74.3	-44.9	-175.5	-62.8	-56.1	-48.7	0	0	113.1	K341 Y342 K502 Y592 F597	K341-Q345 HydrophobicContact CG-CG 4.5Å; K341-Q345 VanDerWaalsContact O-CG 3.32Å; K341-Q345 WeakPolarHBondContact O-CG 3.29Å; K341-Q345 PolarHBondContact O-N 2.89Å; Y342-Q345 PolarHBondContact O-N 2.93Å; Q345-K502 PolarHBondContact O-NZ 3.23Å; Q345-K502 VanDerWaalsContact O-NZ 3.15Å; Q345-Y592 HydrophobicContact CG-CD2 3.99Å; Q345-F597 HydrophobicContact CG-CE2 4.38Å; Q345-F597 HydrophobicContact CG-CZ 4.27Å
346	Q	90.4	Very high	91.9	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-71.6	-42.7	-175.3	-173.8	60.1	38.9	0	0	111.6	Y342 C410 K502 S594	Y342-Q346 HydrophobicContact CD2-CB 4.41Å; Y342-Q346 HydrophobicContact CE1-CB 4.39Å; Y342-Q346 HydrophobicContact CE2-CB 4.08Å; Y342-Q346 HydrophobicContact CE2-CG 4.26Å; Y342-Q346 WeakPolarHBondContact O-CB 3.37Å; Y342-Q346 PolarHBondContact O-N 3.38Å; Q346-C410 PolarHBondContact NE2-O 3.13Å; Q346-K502 PolarHBondContact O-NZ 3.02Å; Q346-S594 PolarHBondContact OE1-O 2.85Å
347	Y	91.1	Very high	92.2	Very high	7 Å²	7	19.4 Å²	19.4	3%	0.027	10%	0.104	C	C	.	.	H	α-helix	trans	-111.3	-0.7	-171.9	-57.1	-78.5	0	0	0	114.5	Y342 I343 K349 L408 C410 M509 L510 F513	Y342-Y347 HydrophobicContact CE1-CE2 4.16Å; I343-Y347 HydrophobicContact CG2-CD2 4.37Å; I343-Y347 PolarHBondContact O-N 2.79Å; Y347-K349 VanDerWaalsContact C-N 3.27Å; Y347-K349 PolarHBondContact O-N 3.46Å; Y347-L408 PolarHBondContact OH-O 2.92Å; Y347-C410 HydrophobicContact CD1-CB 4.24Å; Y347-C410 HydrophobicContact CE1-CB 4.48Å; Y347-M509 HydrophobicContact CE1-CB 4.26Å; Y347-L510 HydrophobicContact CD1-CB 3.66Å; Y347-L510 HydrophobicContact CD1-CD1 4.29Å; Y347-L510 HydrophobicContact CD2-CD1 3.61Å; Y347-L510 HydrophobicContact CE1-CB 4.03Å; Y347-L510 HydrophobicContact CE2-CD1 3.93Å; Y347-L510 HydrophobicContact CG-CB 3.94Å; Y347-L510 HydrophobicContact CG-CD1 3.8Å; Y347-L510 HydrophobicContact CG-CG 4.31Å; Y347-F513 HydrophobicContact CE2-CD1 4.16Å; Y347-F513 HydrophobicContact CE2-CG 4.27Å; Y347-F513 WeakPolarHBondContact OH-CB 3.42Å; Y347-F513 WeakPolarHBondContact OH-CG 3.46Å
348	G	88.9	Confident	92.4	Very high	37 Å²	37	19.9 Å²	19.9	38%	0.381	11%	0.106	S	C	.	.			trans	66.3	27.1	177.6	0	0	0	0	0	113.7	E344	E344-G348 WeakPolarHBondContact O-CA 3.4Å; E344-G348 PolarHBondContact O-N 2.73Å
349	K	91.5	Very high	92.5	Very high	65 Å²	65	19.5 Å²	19.5	28%	0.283	10%	0.104	S	C	.	.			trans	-87	154.9	177.1	-66.2	-59.3	-178.7	-171.5	0	111.1	I343 E344 Y347 D353 L510	I343-K349 HydrophobicContact CG2-CB 4.23Å; I343-K349 HydrophobicContact CG2-CG 4.46Å; E344-K349 WeakPolarHBondContact CA-O 3.38Å; E344-K349 WeakPolarHBondContact CG-O 3.17Å; Y347-K349 VanDerWaalsContact C-N 3.27Å; Y347-K349 PolarHBondContact O-N 3.46Å; K349-D353 HydrophobicContact CB-CB 4.46Å; K349-L510 HydrophobicContact CD-CD2 4.21Å; K349-L510 HydrophobicContact CG-CD2 3.72Å
350	S	93	Very high	92.5	Very high	4 Å²	4	22.4 Å²	22.4	3%	0.028	12%	0.119	C	C	.	.			trans	-63.6	156	171.6	70.4	0	0	0	0	110.8	P236 S352 D353 A354	P236-S350 WeakPolarHBondContact O-CB 3.38Å; S350-S352 VanDerWaalsContact C-N 3.26Å; S350-S352 PolarHBondContact O-N 3.41Å; S350-S352 PolarHBondContact OG-OG 2.95Å; S350-D353 PolarHBondContact O-N 3.3Å; S350-D353 WeakPolarHBondContact OG-CB 3.49Å; S350-D353 PolarHBondContact OG-N 3.46Å; S350-D353 VanDerWaalsContact OG-N 3.11Å; S350-D353 PolarHBondContact OG-OD2 3.45Å; S350-A354 PolarHBondContact O-N 3.05Å
351	S	92.5	Very high	92.6	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-60.3	-38.7	176.2	-157.1	0	0	0	0	111.7	T45 Q46 E344 A354 I355	T45-S351 PolarHBondContact OG1-OG 3.26Å; Q46-S351 PolarHBondContact NE2-OG 3.13Å; Q46-S351 VanDerWaalsContact NE2-OG 3.13Å; E344-S351 VanDerWaalsContact CD-CA 3.46Å; E344-S351 VanDerWaalsContact CD-CB 3.45Å; E344-S351 WeakPolarHBondContact OE1-CA 3.45Å; E344-S351 WeakPolarHBondContact OE1-CB 3.45Å; E344-S351 PolarHBondContact OE1-OG 3.34Å; S351-A354 PolarHBondContact O-N 3.26Å; S351-I355 VanDerWaalsContact O-CD1 3.29Å; S351-I355 WeakPolarHBondContact O-CD1 3.5Å; S351-I355 WeakPolarHBondContact O-CG1 3.38Å; S351-I355 PolarHBondContact O-N 2.89Å
352	S	94.8	Very high	92.5	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-43.2	177.2	46.3	0	0	0	0	113	S215 S350 F356	S215-S352 WeakPolarHBondContact CB-O 2.96Å; S215-S352 VanDerWaalsContact O-CB 3.25Å; S215-S352 WeakPolarHBondContact O-CB 3.46Å; S215-S352 PolarHBondContact OG-O 2.91Å; S350-S352 VanDerWaalsContact C-N 3.26Å; S350-S352 PolarHBondContact O-N 3.41Å; S350-S352 PolarHBondContact OG-OG 2.95Å; S352-F356 WeakPolarHBondContact O-CB 3.49Å; S352-F356 PolarHBondContact O-N 3.27Å
353	D	94.5	Very high	92.4	Very high	74 Å²	74	27.3 Å²	27.3	40%	0.396	14%	0.14	S	C	.	.	H	α-helix	trans	-67.9	-42.2	178.6	-65.8	-31.3	0	0	0	111	K349 S350 I355 F356 L357	K349-D353 HydrophobicContact CB-CB 4.46Å; S350-D353 PolarHBondContact O-N 3.3Å; S350-D353 WeakPolarHBondContact OG-CB 3.49Å; S350-D353 PolarHBondContact OG-N 3.46Å; S350-D353 VanDerWaalsContact OG-N 3.11Å; S350-D353 PolarHBondContact OG-OD2 3.45Å; D353-I355 PolarHBondContact O-N 3.36Å; D353-F356 PolarHBondContact O-N 3.15Å; D353-L357 WeakPolarHBondContact O-CB 3.41Å; D353-L357 WeakPolarHBondContact O-CD1 3.49Å; D353-L357 WeakPolarHBondContact O-CG 3.21Å; D353-L357 PolarHBondContact O-N 3.08Å
354	A	94.7	Very high	92.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-57.7	-49.5	176.7	0	0	0	0	0	111.4	I343 E344 S350 S351 F356 L357 I358	I343-A354 HydrophobicContact CB-CB 3.86Å; I343-A354 HydrophobicContact CG2-CB 3.71Å; E344-A354 HydrophobicContact CG-CB 4.32Å; S350-A354 PolarHBondContact O-N 3.05Å; S351-A354 PolarHBondContact O-N 3.26Å; A354-F356 PolarHBondContact O-N 3.42Å; A354-L357 PolarHBondContact O-N 3.03Å; A354-I358 WeakPolarHBondContact O-CD1 3.37Å; A354-I358 WeakPolarHBondContact O-CG1 3.24Å; A354-I358 PolarHBondContact O-N 3.14Å
355	I	95.6	Very high	92.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-43.6	178.4	-65.8	161.1	0	0	0	111.1	M43 L211 A214 A218 P340 S351 D353 I358 G359	M43-I355 HydrophobicContact CE-CD1 3.82Å; L211-I355 HydrophobicContact CB-CG2 4.2Å; L211-I355 HydrophobicContact CD2-CG2 3.89Å; L211-I355 VanDerWaalsContact O-CG2 3.22Å; L211-I355 WeakPolarHBondContact O-CG2 3.46Å; A214-I355 HydrophobicContact CB-CG2 3.88Å; A218-I355 HydrophobicContact CB-CD1 4.13Å; P340-I355 HydrophobicContact CB-CG1 4.16Å; P340-I355 HydrophobicContact CG-CG1 4.34Å; S351-I355 VanDerWaalsContact O-CD1 3.29Å; S351-I355 WeakPolarHBondContact O-CD1 3.5Å; S351-I355 WeakPolarHBondContact O-CG1 3.38Å; S351-I355 PolarHBondContact O-N 2.89Å; D353-I355 PolarHBondContact O-N 3.36Å; I355-I358 PolarHBondContact O-N 3.33Å; I355-G359 PolarHBondContact O-N 2.98Å; I355-G359 VanDerWaalsContact O-N 3.12Å
356	F	95.8	Very high	92.3	Very high	89 Å²	89	31 Å²	31	39%	0.39	16%	0.164	S	C	.	.	H	α-helix	trans	-60.7	-49.1	178.4	-177.2	-107.9	0	0	0	112.2	L212 S215 S352 D353 A354 I358 G359 I360	L212-F356 HydrophobicContact CD2-CD2 3.88Å; L212-F356 HydrophobicContact CD2-CE2 3.88Å; S215-F356 WeakPolarHBondContact OG-CB 3.44Å; S352-F356 WeakPolarHBondContact O-CB 3.49Å; S352-F356 PolarHBondContact O-N 3.27Å; D353-F356 PolarHBondContact O-N 3.15Å; A354-F356 PolarHBondContact O-N 3.42Å; F356-I358 PolarHBondContact O-N 3.36Å; F356-G359 PolarHBondContact O-N 3.41Å; F356-I360 HydrophobicContact CD1-CD1 4.06Å; F356-I360 HydrophobicContact CD2-CD1 4.16Å; F356-I360 HydrophobicContact CE1-CD1 3.44Å; F356-I360 VanDerWaalsContact CE1-CD1 3.44Å; F356-I360 HydrophobicContact CE2-CD1 3.55Å; F356-I360 HydrophobicContact CG-CD1 4.39Å; F356-I360 HydrophobicContact CZ-CD1 3.16Å; F356-I360 HydrophobicContact CZ-CG1 4.46Å; F356-I360 PolarHBondContact O-N 3.27Å; F356-I360 VanDerWaalsContact O-N 3.11Å
357	L	94.5	Very high	92.1	Very high	36 Å²	36	32.8 Å²	32.8	19%	0.188	18%	0.177	C	C	.	.	H	α-helix	trans	-63.2	-42.1	-179.2	-68.9	167.9	0	0	0	111.4	D353 A354 G359 I360 Y361 L510 L514	D353-L357 WeakPolarHBondContact O-CB 3.41Å; D353-L357 WeakPolarHBondContact O-CD1 3.49Å; D353-L357 WeakPolarHBondContact O-CG 3.21Å; D353-L357 PolarHBondContact O-N 3.08Å; A354-L357 PolarHBondContact O-N 3.03Å; L357-G359 VanDerWaalsContact C-N 3.31Å; L357-G359 PolarHBondContact O-N 2.91Å; L357-I360 PolarHBondContact O-N 3.22Å; L357-Y361 HydrophobicContact CD2-CD2 4.4Å; L357-Y361 HydrophobicContact CD2-CE2 4.08Å; L357-Y361 WeakPolarHBondContact O-CB 3.32Å; L357-Y361 WeakPolarHBondContact O-CD2 3.31Å; L357-Y361 PolarHBondContact O-N 3.12Å; L357-L510 HydrophobicContact CD1-CD2 4.28Å; L357-L514 HydrophobicContact CB-CD1 4.13Å; L357-L514 HydrophobicContact CB-CD2 4.19Å; L357-L514 HydrophobicContact CD1-CD1 4.1Å; L357-L514 HydrophobicContact CD2-CD1 4.01Å; L357-L514 HydrophobicContact CG-CD1 4.3Å
358	I	92.8	Very high	92	Very high	19 Å²	19	36.7 Å²	36.7	10%	0.097	20%	0.197	C	C	.	.	H	α-helix	trans	-58	-45.3	174.8	-67.8	161.9	0	0	0	110.6	L211 M339 P340 I343 A354 I355 F356 N362	L211-I358 HydrophobicContact CD1-CG2 4.35Å; M339-I358 HydrophobicContact CB-CD1 3.96Å; M339-I358 HydrophobicContact CE-CG1 4.07Å; M339-I358 HydrophobicContact CG-CD1 3.66Å; M339-I358 HydrophobicContact CG-CG1 3.95Å; M339-I358 HydrophobicContact SD-CD1 4.32Å; M339-I358 HydrophobicContact SD-CG1 4.05Å; M339-I358 HydrophobicContact SD-CG2 4.37Å; P340-I358 HydrophobicContact CB-CD1 4.22Å; P340-I358 HydrophobicContact CG-CD1 3.76Å; I343-I358 HydrophobicContact CD1-CD1 3.99Å; I343-I358 HydrophobicContact CD1-CG1 3.76Å; A354-I358 WeakPolarHBondContact O-CD1 3.37Å; A354-I358 WeakPolarHBondContact O-CG1 3.24Å; A354-I358 PolarHBondContact O-N 3.14Å; I355-I358 PolarHBondContact O-N 3.33Å; F356-I358 PolarHBondContact O-N 3.36Å; I358-N362 WeakPolarHBondContact O-CB 3.23Å; I358-N362 PolarHBondContact O-N 3.43Å
359	G	91.7	Very high	92	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.4	-43.3	-178.3	0	0	0	0	0	113.6	I355 F356 L357 L363	I355-G359 PolarHBondContact O-N 2.98Å; I355-G359 VanDerWaalsContact O-N 3.12Å; F356-G359 PolarHBondContact O-N 3.41Å; L357-G359 VanDerWaalsContact C-N 3.31Å; L357-G359 PolarHBondContact O-N 2.91Å; G359-L363 WeakPolarHBondContact O-CB 2.94Å
360	I	92.1	Very high	91.6	Very high	76 Å²	76	35.9 Å²	35.9	39%	0.39	18%	0.182	S	C	.	.	H	α-helix	trans	-77.9	-40.4	-177.4	-69.5	178.2	0	0	0	112.3	F356 L357 P364	F356-I360 HydrophobicContact CD1-CD1 4.06Å; F356-I360 HydrophobicContact CD2-CD1 4.16Å; F356-I360 HydrophobicContact CE1-CD1 3.44Å; F356-I360 VanDerWaalsContact CE1-CD1 3.44Å; F356-I360 HydrophobicContact CE2-CD1 3.55Å; F356-I360 HydrophobicContact CG-CD1 4.39Å; F356-I360 HydrophobicContact CZ-CD1 3.16Å; F356-I360 HydrophobicContact CZ-CG1 4.46Å; F356-I360 PolarHBondContact O-N 3.27Å; F356-I360 VanDerWaalsContact O-N 3.11Å; L357-I360 PolarHBondContact O-N 3.22Å; I360-P364 WeakPolarHBondContact O-CD 3.42Å; I360-P364 WeakPolarHBondContact O-CG 3.27Å
361	Y	92.9	Very high	91.2	Very high	82 Å²	82	40.4 Å²	40.4	32%	0.322	20%	0.204	S	C	.	.	H	α-helix	trans	-82	-36.5	-174.9	-82.5	-99.1	0	0	0	113.3	L357 P365 L514 V515 A518	L357-Y361 HydrophobicContact CD2-CD2 4.4Å; L357-Y361 HydrophobicContact CD2-CE2 4.08Å; L357-Y361 WeakPolarHBondContact O-CB 3.32Å; L357-Y361 WeakPolarHBondContact O-CD2 3.31Å; L357-Y361 PolarHBondContact O-N 3.12Å; Y361-P365 VanDerWaalsContact O-CD 3.26Å; Y361-P365 WeakPolarHBondContact O-CD 2.97Å; Y361-P365 VanDerWaalsContact O-CG 3.23Å; Y361-P365 WeakPolarHBondContact O-CG 3.25Å; Y361-L514 HydrophobicContact CD1-CB 3.71Å; Y361-L514 HydrophobicContact CD2-CB 4.4Å; Y361-L514 HydrophobicContact CD2-CD1 4.25Å; Y361-L514 HydrophobicContact CE1-CB 3.93Å; Y361-L514 HydrophobicContact CE2-CD1 4.15Å; Y361-L514 HydrophobicContact CG-CB 3.95Å; Y361-V515 HydrophobicContact CE1-CG2 4.47Å; Y361-A518 WeakPolarHBondContact O-CB 3.2Å
362	N	90.9	Very high	91	Very high	14 Å²	14	43.2 Å²	43.2	8%	0.075	22%	0.219	C	C	.	.	H	α-helix	trans	-95.5	-38	-171.4	-68.6	-9	0	0	0	113.9	M339 I358 P365 I366 S517	M339-N362 WeakPolarHBondContact CE-ND2 3.36Å; I358-N362 WeakPolarHBondContact O-CB 3.23Å; I358-N362 PolarHBondContact O-N 3.43Å; N362-P365 WeakPolarHBondContact O-CD 3.48Å; N362-I366 WeakPolarHBondContact O-CD1 3.3Å; N362-I366 VanDerWaalsContact O-CG1 3.22Å; N362-I366 WeakPolarHBondContact O-CG1 2.98Å; N362-I366 PolarHBondContact O-N 2.86Å; N362-S517 VanDerWaalsContact CG-OG 3.3Å; N362-S517 PolarHBondContact ND2-OG 2.96Å; N362-S517 VanDerWaalsContact ND2-OG 3.15Å; N362-S517 PolarHBondContact OD1-OG 3.26Å
363	L	89.6	Confident	90.5	Very high	25 Å²	25	43.2 Å²	43.2	13%	0.131	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-45.3	-171.8	-66.2	179.4	0	0	0	114.7	P207 L208 L211 G359 I366 C367	P207-L363 HydrophobicContact CB-CD1 3.9Å; P207-L363 HydrophobicContact CB-CD2 4.16Å; L208-L363 HydrophobicContact CB-CD1 3.72Å; L208-L363 HydrophobicContact CD1-CD1 4.11Å; L208-L363 VanDerWaalsContact N-CD1 3.29Å; L211-L363 HydrophobicContact CD1-CD1 3.66Å; L211-L363 HydrophobicContact CD1-CG 4.27Å; G359-L363 WeakPolarHBondContact O-CB 2.94Å; L363-I366 WeakPolarHBondContact O-CB 3.42Å; L363-I366 PolarHBondContact O-N 3.17Å; L363-I366 VanDerWaalsContact O-N 3.16Å; L363-C367 PolarHBondContact O-N 3.35Å; L363-C367 VanDerWaalsContact O-N 3.11Å
364	P	90.2	Very high	89.9	Confident	54 Å²	54	41.1 Å²	41.1	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-60.4	-43.8	179.1	-20.3	31.5	0	0	0	113.5	I360 I366 C367 I368	I360-P364 WeakPolarHBondContact O-CD 3.42Å; I360-P364 WeakPolarHBondContact O-CG 3.27Å; P364-I366 VanDerWaalsContact C-N 3.29Å; P364-I366 PolarHBondContact O-N 3.18Å; P364-C367 WeakPolarHBondContact O-CB 3.27Å; P364-C367 PolarHBondContact O-N 2.91Å; P364-I368 WeakPolarHBondContact O-CG1 3.46Å; P364-I368 PolarHBondContact O-N 3.14Å; P364-I368 VanDerWaalsContact O-N 3.08Å
365	P	92.1	Very high	89.2	Confident	25 Å²	25	46 Å²	46	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-59.9	-35.7	173.8	-26	35.8	0	0	0	113.7	Y361 N362 I368 G369 A518 F522	Y361-P365 VanDerWaalsContact O-CD 3.26Å; Y361-P365 WeakPolarHBondContact O-CD 2.97Å; Y361-P365 VanDerWaalsContact O-CG 3.23Å; Y361-P365 WeakPolarHBondContact O-CG 3.25Å; N362-P365 WeakPolarHBondContact O-CD 3.48Å; P365-I368 PolarHBondContact O-N 2.99Å; P365-G369 PolarHBondContact O-N 3.14Å; P365-A518 HydrophobicContact CG-CB 4.15Å; P365-F522 HydrophobicContact CB-CB 4Å
366	I	89.1	Confident	88.7	Confident	37 Å²	37	48.9 Å²	48.9	19%	0.19	26%	0.255	C	S	.	.	H	α-helix	trans	-62.5	-45.8	175.4	-68.9	166.7	0	0	0	111	N362 L363 P364 I368 G369 Y370 S525	N362-I366 WeakPolarHBondContact O-CD1 3.3Å; N362-I366 VanDerWaalsContact O-CG1 3.22Å; N362-I366 WeakPolarHBondContact O-CG1 2.98Å; N362-I366 PolarHBondContact O-N 2.86Å; L363-I366 WeakPolarHBondContact O-CB 3.42Å; L363-I366 PolarHBondContact O-N 3.17Å; L363-I366 VanDerWaalsContact O-N 3.16Å; P364-I366 VanDerWaalsContact C-N 3.29Å; P364-I366 PolarHBondContact O-N 3.18Å; I366-I368 PolarHBondContact O-N 3.41Å; I366-G369 PolarHBondContact O-N 3.35Å; I366-Y370 HydrophobicContact CG2-CD2 3.7Å; I366-Y370 HydrophobicContact CG2-CE2 3.45Å; I366-Y370 VanDerWaalsContact CG2-CE2 3.45Å; I366-Y370 VanDerWaalsContact O-CD2 3.27Å; I366-Y370 WeakPolarHBondContact O-CD2 3.38Å; I366-Y370 PolarHBondContact O-N 2.86Å; I366-S525 WeakPolarHBondContact O-CB 3.2Å; I366-S525 PolarHBondContact O-OG 2.92Å
367	C	85.8	Confident	87.9	Confident	39 Å²	39	45.6 Å²	45.6	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-56.4	-50	175.1	-69.9	0	0	0	0	111.8	I204 L363 P364 G369 Y370 I371	I204-C367 WeakPolarHBondContact CG2-SG 3.44Å; L363-C367 PolarHBondContact O-N 3.35Å; L363-C367 VanDerWaalsContact O-N 3.11Å; P364-C367 WeakPolarHBondContact O-CB 3.27Å; P364-C367 PolarHBondContact O-N 2.91Å; C367-G369 VanDerWaalsContact C-N 3.35Å; C367-G369 PolarHBondContact O-N 3.22Å; C367-Y370 PolarHBondContact O-N 3.24Å; C367-I371 WeakPolarHBondContact O-CG1 3.43Å; C367-I371 PolarHBondContact O-N 3.32Å; C367-I371 VanDerWaalsContact O-N 3.14Å
368	I	88.8	Confident	87.1	Confident	89 Å²	89	52.1 Å²	52.1	46%	0.456	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-42.9	-177	-62.6	167.6	0	0	0	109.9	P364 P365 I366 I371 I372 F522	P364-I368 WeakPolarHBondContact O-CG1 3.46Å; P364-I368 PolarHBondContact O-N 3.14Å; P364-I368 VanDerWaalsContact O-N 3.08Å; P365-I368 PolarHBondContact O-N 2.99Å; I366-I368 PolarHBondContact O-N 3.41Å; I368-I371 PolarHBondContact O-N 2.81Å; I368-I372 HydrophobicContact CG2-CD1 3.57Å; I368-I372 HydrophobicContact CG2-CG1 4.22Å; I368-I372 WeakPolarHBondContact O-CB 3.47Å; I368-I372 VanDerWaalsContact O-CG1 3.29Å; I368-I372 WeakPolarHBondContact O-CG1 3.27Å; I368-I372 PolarHBondContact O-N 2.85Å; I368-F522 HydrophobicContact CB-CE2 4.49Å; I368-F522 HydrophobicContact CG2-CE2 3.99Å
369	G	89.6	Confident	86.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-39.2	179.6	0	0	0	0	0	113.3	P365 I366 C367 G373 S525	P365-G369 PolarHBondContact O-N 3.14Å; I366-G369 PolarHBondContact O-N 3.35Å; C367-G369 VanDerWaalsContact C-N 3.35Å; C367-G369 PolarHBondContact O-N 3.22Å; G369-G373 PolarHBondContact O-N 2.69Å; G369-S525 WeakPolarHBondContact CA-OG 3.18Å
370	Y	84	Confident	86.1	Confident	86 Å²	86	65.7 Å²	65.7	34%	0.337	33%	0.327	S	S	.	.	H	α-helix	trans	-63	-46.4	172.4	-80.6	-54.5	0	0	0	112.4	I204 I366 C367 I372 G373 G374 A528 I529	I204-Y370 HydrophobicContact CD1-CD2 3.68Å; I204-Y370 HydrophobicContact CD1-CE2 4.21Å; I366-Y370 HydrophobicContact CG2-CD2 3.7Å; I366-Y370 HydrophobicContact CG2-CE2 3.45Å; I366-Y370 VanDerWaalsContact CG2-CE2 3.45Å; I366-Y370 VanDerWaalsContact O-CD2 3.27Å; I366-Y370 WeakPolarHBondContact O-CD2 3.38Å; I366-Y370 PolarHBondContact O-N 2.86Å; C367-Y370 PolarHBondContact O-N 3.24Å; Y370-I372 PolarHBondContact O-N 2.69Å; Y370-G373 PolarHBondContact O-N 3.49Å; Y370-G374 PolarHBondContact O-N 2.76Å; Y370-A528 HydrophobicContact CE1-CB 3.7Å; Y370-I529 HydrophobicContact CD1-CD1 3.96Å; Y370-I529 HydrophobicContact CD1-CG1 3.89Å; Y370-I529 HydrophobicContact CE1-CG1 4.43Å; Y370-I529 WeakPolarHBondContact O-CD1 3.26Å
371	I	83.2	Confident	85.6	Confident	98 Å²	98	70.9 Å²	70.9	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-48.2	179.1	-66.4	168.6	0	0	0	110.3	C367 I368 G374 L375	C367-I371 WeakPolarHBondContact O-CG1 3.43Å; C367-I371 PolarHBondContact O-N 3.32Å; C367-I371 VanDerWaalsContact O-N 3.14Å; I368-I371 PolarHBondContact O-N 2.81Å; I371-G374 PolarHBondContact O-N 2.98Å; I371-L375 HydrophobicContact CG2-CD1 3.98Å; I371-L375 HydrophobicContact CG2-CG 4.45Å; I371-L375 WeakPolarHBondContact O-CB 3.28Å; I371-L375 VanDerWaalsContact O-CG 3.28Å; I371-L375 WeakPolarHBondContact O-CG 2.93Å; I371-L375 PolarHBondContact O-N 3.17Å
372	I	87.8	Confident	85	Confident	62 Å²	62	67.6 Å²	67.6	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-43.7	179.8	-67.7	178	0	0	0	111.1	I368 Y370 G374 L375 I376 F522 L526	I368-I372 HydrophobicContact CG2-CD1 3.57Å; I368-I372 HydrophobicContact CG2-CG1 4.22Å; I368-I372 WeakPolarHBondContact O-CB 3.47Å; I368-I372 VanDerWaalsContact O-CG1 3.29Å; I368-I372 WeakPolarHBondContact O-CG1 3.27Å; I368-I372 PolarHBondContact O-N 2.85Å; Y370-I372 PolarHBondContact O-N 2.69Å; I372-G374 VanDerWaalsContact C-N 3.32Å; I372-G374 PolarHBondContact O-N 3.03Å; I372-L375 PolarHBondContact O-N 3.23Å; I372-I376 HydrophobicContact CG2-CD1 3.67Å; I372-I376 HydrophobicContact CG2-CG1 4.24Å; I372-I376 WeakPolarHBondContact O-CB 3.4Å; I372-I376 VanDerWaalsContact O-CG1 3.31Å; I372-I376 WeakPolarHBondContact O-CG1 3.24Å; I372-I376 PolarHBondContact O-N 3.32Å; I372-F522 HydrophobicContact CD1-CE2 4.08Å; I372-F522 HydrophobicContact CD1-CZ 4.12Å; I372-L526 HydrophobicContact CB-CD1 4.35Å; I372-L526 HydrophobicContact CG2-CD1 3.9Å
373	G	85.9	Confident	84.7	Confident	3 Å²	3	70.3 Å²	70.3	3%	0.031	35%	0.351	C	S	.	.	H	α-helix	trans	-60	-42.2	177.7	0	0	0	0	0	112.3	G369 Y370 I376 M377	G369-G373 PolarHBondContact O-N 2.69Å; Y370-G373 PolarHBondContact O-N 3.49Å; G373-I376 PolarHBondContact O-N 3.38Å; G373-M377 VanDerWaalsContact O-CG 3.28Å; G373-M377 WeakPolarHBondContact O-CG 3.25Å; G373-M377 PolarHBondContact O-N 3.15Å; G373-M377 VanDerWaalsContact O-N 3.09Å
374	G	80.3	Confident	84.1	Confident	29 Å²	29	70.3 Å²	70.3	30%	0.299	35%	0.352	S	S	.	.	H	α-helix	trans	-65.2	-43.6	174.7	0	0	0	0	0	112.6	Y370 I371 I372 M377 K378 I529	Y370-G374 PolarHBondContact O-N 2.76Å; I371-G374 PolarHBondContact O-N 2.98Å; I372-G374 VanDerWaalsContact C-N 3.32Å; I372-G374 PolarHBondContact O-N 3.03Å; G374-M377 PolarHBondContact O-N 2.02Å; G374-K378 WeakPolarHBondContact O-CB 3.41Å; G374-K378 PolarHBondContact O-N 3.36Å; G374-I529 VanDerWaalsContact N-CD1 3.27Å
375	L	80.9	Confident	83.7	Confident	104 Å²	104	70.9 Å²	70.9	55%	0.545	35%	0.349	S	S	.	.	H	α-helix	trans	-63.8	-40.9	176.9	-72.9	174.7	0	0	0	112.4	I371 I372 K378 K379	I371-L375 HydrophobicContact CG2-CD1 3.98Å; I371-L375 HydrophobicContact CG2-CG 4.45Å; I371-L375 WeakPolarHBondContact O-CB 3.28Å; I371-L375 VanDerWaalsContact O-CG 3.28Å; I371-L375 WeakPolarHBondContact O-CG 2.93Å; I371-L375 PolarHBondContact O-N 3.17Å; I372-L375 PolarHBondContact O-N 3.23Å; L375-K378 PolarHBondContact O-N 3.1Å; L375-K379 VanDerWaalsContact O-CB 3.23Å; L375-K379 WeakPolarHBondContact O-CB 3.46Å; L375-K379 PolarHBondContact O-N 3.23Å
376	I	85.2	Confident	83.4	Confident	59 Å²	59	74.5 Å²	74.5	30%	0.303	36%	0.364	S	S	.	.	H	α-helix	trans	-62.1	-49.4	176.7	-74.5	171.6	0	0	0	110.1	I372 G373 K378 K379 F380 I382 L526	I372-I376 HydrophobicContact CG2-CD1 3.67Å; I372-I376 HydrophobicContact CG2-CG1 4.24Å; I372-I376 WeakPolarHBondContact O-CB 3.4Å; I372-I376 VanDerWaalsContact O-CG1 3.31Å; I372-I376 WeakPolarHBondContact O-CG1 3.24Å; I372-I376 PolarHBondContact O-N 3.32Å; G373-I376 PolarHBondContact O-N 3.38Å; I376-K378 VanDerWaalsContact C-N 3.29Å; I376-K378 PolarHBondContact O-N 2.91Å; I376-K379 PolarHBondContact O-N 3.37Å; I376-F380 HydrophobicContact CG2-CD2 4.09Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 3.46Å; I376-F380 VanDerWaalsContact O-N 3.09Å; I376-I382 HydrophobicContact CG2-CD1 3.67Å; I376-L526 HydrophobicContact CD1-CD1 4.15Å
377	M	79.8	Confident	83.2	Confident	21 Å²	21	72.8 Å²	72.8	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-58.9	-40.8	177.8	-71.8	-65.6	-66.7	0	0	112.1	G373 G374 K381 I382 A387 I529 P530 M533	G373-M377 VanDerWaalsContact O-CG 3.28Å; G373-M377 WeakPolarHBondContact O-CG 3.25Å; G373-M377 PolarHBondContact O-N 3.15Å; G373-M377 VanDerWaalsContact O-N 3.09Å; G374-M377 PolarHBondContact O-N 2.02Å; M377-K381 PolarHBondContact O-N 3Å; M377-I382 HydrophobicContact CE-CB 4.15Å; M377-I382 HydrophobicContact CE-CG2 4.35Å; M377-I382 PolarHBondContact O-N 3.11Å; M377-I382 HydrophobicContact SD-CB 3.77Å; M377-I382 HydrophobicContact SD-CD1 3.79Å; M377-I382 HydrophobicContact SD-CG1 4.26Å; M377-I382 HydrophobicContact SD-CG2 3.95Å; M377-A387 HydrophobicContact CE-CB 3.86Å; M377-A387 HydrophobicContact SD-CB 4.3Å; M377-I529 HydrophobicContact CG-CG2 4.03Å; M377-P530 HydrophobicContact CG-CG 4.48Å; M377-P530 HydrophobicContact SD-CB 4.39Å; M377-P530 HydrophobicContact SD-CG 4.12Å; M377-M533 HydrophobicContact CE-CB 4.1Å; M377-M533 HydrophobicContact CE-CG 4.03Å
378	K	77.1	Confident	83.2	Confident	173 Å²	173	71.6 Å²	71.6	75%	0.752	35%	0.348	S	S	*	.	H	α-helix	trans	-70.3	-51.1	178.6	-176.4	178.3	179.9	178.6	0	112.6	G374 L375 I376	G374-K378 WeakPolarHBondContact O-CB 3.41Å; G374-K378 PolarHBondContact O-N 3.36Å; L375-K378 PolarHBondContact O-N 3.1Å; I376-K378 VanDerWaalsContact C-N 3.29Å; I376-K378 PolarHBondContact O-N 2.91Å
379	K	81.6	Confident	83.1	Confident	169 Å²	169	71.8 Å²	71.8	74%	0.735	35%	0.347	S	S	*	.	H	α-helix	trans	-68.1	-40.5	-172.3	-173.2	176.7	179.5	179.2	0	112	L375 I376	L375-K379 VanDerWaalsContact O-CB 3.23Å; L375-K379 WeakPolarHBondContact O-CB 3.46Å; L375-K379 PolarHBondContact O-N 3.23Å; I376-K379 PolarHBondContact O-N 3.37Å
380	F	81.5	Confident	83.1	Confident	135 Å²	135	74.8 Å²	74.8	59%	0.592	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	2.1	-176.3	-64.2	-73.5	0	0	0	113.9	I376 I382	I376-F380 HydrophobicContact CG2-CD2 4.09Å; I376-F380 WeakPolarHBondContact O-CD2 3.45Å; I376-F380 PolarHBondContact O-N 3.46Å; I376-F380 VanDerWaalsContact O-N 3.09Å; F380-I382 HydrophobicContact CB-CD1 4.25Å; F380-I382 HydrophobicContact CB-CG1 3.8Å; F380-I382 PolarHBondContact O-N 3.45Å
381	K	82.4	Confident	83.3	Confident	184 Å²	184	71.1 Å²	71.1	80%	0.8	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	48.9	179.9	-62.9	-176.5	178.4	179.8	0	112.4	M377 T383	M377-K381 PolarHBondContact O-N 3Å; K381-T383 PolarHBondContact O-N 3.02Å
382	I	80.2	Confident	83.6	Confident	13 Å²	13	67.8 Å²	67.8	7%	0.067	34%	0.336	C	S	.	.			trans	-62.7	128.3	-170.1	-61.4	-179.9	0	0	0	110.6	I376 M377 F380 Q386 A387 I390 R537	I376-I382 HydrophobicContact CG2-CD1 3.67Å; M377-I382 HydrophobicContact CE-CB 4.15Å; M377-I382 HydrophobicContact CE-CG2 4.35Å; M377-I382 PolarHBondContact O-N 3.11Å; M377-I382 HydrophobicContact SD-CB 3.77Å; M377-I382 HydrophobicContact SD-CD1 3.79Å; M377-I382 HydrophobicContact SD-CG1 4.26Å; M377-I382 HydrophobicContact SD-CG2 3.95Å; F380-I382 HydrophobicContact CB-CD1 4.25Å; F380-I382 HydrophobicContact CB-CG1 3.8Å; F380-I382 PolarHBondContact O-N 3.45Å; I382-Q386 HydrophobicContact CG2-CB 3.61Å; I382-A387 HydrophobicContact CG2-CB 3.97Å; I382-I390 HydrophobicContact CD1-CD1 3.78Å; I382-I390 HydrophobicContact CG2-CD1 4.05Å; I382-R537 PolarHBondContact O-NH1 2.96Å
383	T	83.3	Confident	83.7	Confident	72 Å²	72	73.1 Å²	73.1	44%	0.442	35%	0.352	S	S	.	.			trans	-72.6	163.1	176.6	63	0	0	0	0	111.3	K381 K385 Q386 A387	K381-T383 PolarHBondContact O-N 3.02Å; T383-K385 VanDerWaalsContact C-N 3.32Å; T383-K385 PolarHBondContact O-N 2.97Å; T383-Q386 PolarHBondContact O-N 3.04Å; T383-Q386 WeakPolarHBondContact OG1-CB 3.18Å; T383-Q386 VanDerWaalsContact OG1-CG 3.25Å; T383-Q386 WeakPolarHBondContact OG1-CG 3.24Å; T383-Q386 PolarHBondContact OG1-N 3.43Å; T383-Q386 PolarHBondContact OG1-OE1 3.45Å; T383-A387 WeakPolarHBondContact O-CB 3.07Å; T383-A387 PolarHBondContact O-N 3.08Å
384	V	78	Confident	84.1	Confident	25 Å²	25	74.6 Å²	74.6	15%	0.152	36%	0.359	C	S	.	.	H	α-helix	trans	-61.1	-41.6	-177.8	-163.9	0	0	0	0	112.1	A387 A388 V534 R537 L628	V384-A387 PolarHBondContact O-N 3.46Å; V384-A388 WeakPolarHBondContact O-CB 3.27Å; V384-A388 PolarHBondContact O-N 3.22Å; V384-V534 HydrophobicContact CG1-CG2 4.24Å; V384-R537 HydrophobicContact CG1-CB 4.14Å; V384-R537 HydrophobicContact CG2-CB 3.92Å; V384-R537 HydrophobicContact CG2-CG 4.26Å; V384-L628 HydrophobicContact CB-CD1 3.7Å; V384-L628 HydrophobicContact CG1-CD1 3.68Å; V384-L628 HydrophobicContact CG2-CD1 4.11Å
385	K	81.9	Confident	84.6	Confident	65 Å²	65	74 Å²	74	28%	0.283	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-45	178.4	-66.2	172.9	-178.3	155.2	0	110.7	T383 A388 H389 L623 E631	T383-K385 VanDerWaalsContact C-N 3.32Å; T383-K385 PolarHBondContact O-N 2.97Å; K385-A388 PolarHBondContact O-N 3Å; K385-H389 PolarHBondContact O-CD2 2.62Å; K385-H389 VanDerWaalsContact O-CD2 3.26Å; K385-H389 PolarHBondContact O-N 3.41Å; K385-H389 VanDerWaalsContact O-N 3.13Å; K385-L623 WeakPolarHBondContact CE-O 3.46Å; K385-E631 IonicContact NZ-OE1 2.66Å; K385-E631 PolarHBondContact NZ-OE1 3.39Å; K385-E631 IonicContact NZ-OE2 3.03Å; K385-E631 PolarHBondContact NZ-OE2 3.43Å
386	Q	85.3	Confident	85.1	Confident	102 Å²	102	71.5 Å²	71.5	48%	0.477	34%	0.338	S	S	.	.	H	α-helix	trans	-65	-41.8	175.4	-71	166.5	-29.3	0	0	112	I382 T383 A388 H389 I390	I382-Q386 HydrophobicContact CG2-CB 3.61Å; T383-Q386 PolarHBondContact O-N 3.04Å; T383-Q386 WeakPolarHBondContact OG1-CB 3.18Å; T383-Q386 VanDerWaalsContact OG1-CG 3.25Å; T383-Q386 WeakPolarHBondContact OG1-CG 3.24Å; T383-Q386 PolarHBondContact OG1-N 3.43Å; T383-Q386 PolarHBondContact OG1-OE1 3.45Å; Q386-A388 VanDerWaalsContact C-N 3.34Å; Q386-A388 PolarHBondContact O-N 3.43Å; Q386-H389 PolarHBondContact O-N 2.81Å; Q386-I390 WeakPolarHBondContact O-CB 3.45Å; Q386-I390 VanDerWaalsContact O-CG1 3.27Å; Q386-I390 WeakPolarHBondContact O-CG1 3.36Å; Q386-I390 PolarHBondContact O-N 3.49Å
387	A	85.2	Confident	85.6	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.008	34%	0.343	C	S	.	.	H	α-helix	trans	-62	-41.3	177.5	0	0	0	0	0	111.9	M377 I382 T383 V384 I390 G391 P530 V534	M377-A387 HydrophobicContact CE-CB 3.86Å; M377-A387 HydrophobicContact SD-CB 4.3Å; I382-A387 HydrophobicContact CG2-CB 3.97Å; T383-A387 WeakPolarHBondContact O-CB 3.07Å; T383-A387 PolarHBondContact O-N 3.08Å; V384-A387 PolarHBondContact O-N 3.46Å; A387-I390 PolarHBondContact O-N 2.95Å; A387-G391 PolarHBondContact O-N 3.37Å; A387-P530 HydrophobicContact CB-CB 4.27Å; A387-P530 WeakPolarHBondContact O-CB 3.19Å; A387-V534 HydrophobicContact CB-CG2 4.32Å
388	A	84.9	Confident	86.2	Confident	14 Å²	14	72 Å²	72	12%	0.116	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-43.2	175.3	0	0	0	0	0	111.9	V384 K385 Q386 C392 V534 L620 L623	V384-A388 WeakPolarHBondContact O-CB 3.27Å; V384-A388 PolarHBondContact O-N 3.22Å; K385-A388 PolarHBondContact O-N 3Å; Q386-A388 VanDerWaalsContact C-N 3.34Å; Q386-A388 PolarHBondContact O-N 3.43Å; A388-C392 VanDerWaalsContact O-CB 3.28Å; A388-C392 WeakPolarHBondContact O-CB 3.32Å; A388-C392 PolarHBondContact O-N 2.81Å; A388-V534 HydrophobicContact CB-CG2 3.87Å; A388-L620 HydrophobicContact CB-CD2 3.94Å; A388-L623 HydrophobicContact CB-CD1 3.88Å
389	H	87.6	Confident	87	Confident	93 Å²	93	65.7 Å²	65.7	43%	0.431	31%	0.312	S	S	.	.	H	α-helix	trans	-64.3	-47	174.5	-83.6	-71.1	0	0	0	112.4	K385 Q386 C392 W393	K385-H389 PolarHBondContact O-CD2 2.62Å; K385-H389 VanDerWaalsContact O-CD2 3.26Å; K385-H389 PolarHBondContact O-N 3.41Å; K385-H389 VanDerWaalsContact O-N 3.13Å; Q386-H389 PolarHBondContact O-N 2.81Å; H389-C392 PolarHBondContact O-N 3.25Å; H389-W393 PolarHBondContact O-N 3.44Å
390	I	89.4	Confident	87.6	Confident	62 Å²	62	62.5 Å²	62.5	32%	0.318	30%	0.303	S	S	.	.	H	α-helix	trans	-60.4	-48.4	179.2	-69.6	166.9	0	0	0	110.4	I382 Q386 A387 C392 W393 L394 P530	I382-I390 HydrophobicContact CD1-CD1 3.78Å; I382-I390 HydrophobicContact CG2-CD1 4.05Å; Q386-I390 WeakPolarHBondContact O-CB 3.45Å; Q386-I390 VanDerWaalsContact O-CG1 3.27Å; Q386-I390 WeakPolarHBondContact O-CG1 3.36Å; Q386-I390 PolarHBondContact O-N 3.49Å; A387-I390 PolarHBondContact O-N 2.95Å; I390-C392 VanDerWaalsContact C-N 3.34Å; I390-C392 PolarHBondContact O-N 3.37Å; I390-W393 PolarHBondContact O-N 3.17Å; I390-L394 HydrophobicContact CG2-CD1 3.66Å; I390-L394 HydrophobicContact CG2-CG 4.26Å; I390-L394 WeakPolarHBondContact O-CB 3.23Å; I390-L394 VanDerWaalsContact O-CG 3.3Å; I390-L394 WeakPolarHBondContact O-CG 3.27Å; I390-L394 PolarHBondContact O-N 2.86Å; I390-P530 HydrophobicContact CG2-CG 4.32Å
391	G	88.1	Confident	88.1	Confident	10 Å²	10	58.1 Å²	58.1	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-42.9	177.8	0	0	0	0	0	112.4	A387 S395	A387-G391 PolarHBondContact O-N 3.37Å; G391-S395 WeakPolarHBondContact O-CB 3.27Å; G391-S395 PolarHBondContact O-N 2.97Å
392	C	89.1	Confident	88.6	Confident	27 Å²	27	50 Å²	50	18%	0.182	25%	0.25	C	S	.	.	H	α-helix	trans	-64.9	-45	177.9	-170.3	0	0	0	0	112.3	A388 H389 I390 S395 L396 L620	A388-C392 VanDerWaalsContact O-CB 3.28Å; A388-C392 WeakPolarHBondContact O-CB 3.32Å; A388-C392 PolarHBondContact O-N 2.81Å; H389-C392 PolarHBondContact O-N 3.25Å; I390-C392 VanDerWaalsContact C-N 3.34Å; I390-C392 PolarHBondContact O-N 3.37Å; C392-S395 PolarHBondContact O-N 2.58Å; C392-L396 WeakPolarHBondContact O-CB 3.39Å; C392-L396 PolarHBondContact O-N 2.86Å; C392-L620 HydrophobicContact CB-CD1 4.24Å
393	W	91	Very high	89.2	Confident	174 Å²	174	53.5 Å²	53.5	66%	0.659	27%	0.265	S	S	*	.	H	α-helix	trans	-68.7	-41.2	179.7	-76.5	120.1	0	0	0	112.6	H389 I390 L396 L397	H389-W393 PolarHBondContact O-N 3.44Å; I390-W393 PolarHBondContact O-N 3.17Å; W393-L396 HydrophobicContact CE3-CD2 3.83Å; W393-L396 HydrophobicContact CZ3-CD2 3.67Å; W393-L396 PolarHBondContact O-N 2.72Å; W393-L397 WeakPolarHBondContact O-CB 3.46Å; W393-L397 PolarHBondContact O-N 3.39Å
394	L	92.7	Very high	89.6	Confident	34 Å²	34	54 Å²	54	18%	0.178	26%	0.264	C	S	.	.	H	α-helix	trans	-65.7	-41.2	175.1	-70.1	174.5	0	0	0	111.6	I390 L396 L397 E398 I523 L526 A527	I390-L394 HydrophobicContact CG2-CD1 3.66Å; I390-L394 HydrophobicContact CG2-CG 4.26Å; I390-L394 WeakPolarHBondContact O-CB 3.23Å; I390-L394 VanDerWaalsContact O-CG 3.3Å; I390-L394 WeakPolarHBondContact O-CG 3.27Å; I390-L394 PolarHBondContact O-N 2.86Å; L394-L396 VanDerWaalsContact C-N 3.3Å; L394-L396 PolarHBondContact O-N 3.13Å; L394-L397 PolarHBondContact O-N 2.86Å; L394-E398 PolarHBondContact O-N 3Å; L394-I523 HydrophobicContact CB-CG2 4.28Å; L394-I523 HydrophobicContact CD2-CG2 4.31Å; L394-I523 WeakPolarHBondContact O-CG2 3.45Å; L394-L526 HydrophobicContact CD1-CB 4.33Å; L394-L526 HydrophobicContact CD1-CD2 3.83Å; L394-L526 HydrophobicContact CD1-CG 3.86Å; L394-L526 HydrophobicContact CD2-CD2 4.09Å; L394-A527 HydrophobicContact CB-CB 3.77Å; L394-A527 HydrophobicContact CD1-CB 4.44Å
395	S	91.4	Very high	90.3	Very high	16 Å²	16	53 Å²	53	11%	0.112	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-34.4	174	-179	0	0	0	0	112.4	G391 C392 Y399	G391-S395 WeakPolarHBondContact O-CB 3.27Å; G391-S395 PolarHBondContact O-N 2.97Å; C392-S395 PolarHBondContact O-N 2.58Å; S395-Y399 VanDerWaalsContact O-CB 3.27Å; S395-Y399 WeakPolarHBondContact O-CB 3.38Å; S395-Y399 PolarHBondContact O-N 3.04Å
396	L	92.4	Very high	90.7	Very high	53 Å²	53	51.8 Å²	51.8	28%	0.277	25%	0.254	S	S	.	.	H	α-helix	trans	-69.9	-42.1	175.2	-178.4	64.7	0	0	0	111.1	C392 W393 L394 Y399 L400 F613	C392-L396 WeakPolarHBondContact O-CB 3.39Å; C392-L396 PolarHBondContact O-N 2.86Å; W393-L396 HydrophobicContact CE3-CD2 3.83Å; W393-L396 HydrophobicContact CZ3-CD2 3.67Å; W393-L396 PolarHBondContact O-N 2.72Å; L394-L396 VanDerWaalsContact C-N 3.3Å; L394-L396 PolarHBondContact O-N 3.13Å; L396-Y399 HydrophobicContact CD1-CD1 4.31Å; L396-Y399 PolarHBondContact O-N 3.09Å; L396-L400 HydrophobicContact CG-CD1 4.27Å; L396-L400 VanDerWaalsContact O-CG 3.3Å; L396-L400 WeakPolarHBondContact O-CG 3.46Å; L396-L400 PolarHBondContact O-N 3.37Å; L396-F613 HydrophobicContact CB-CE1 4.17Å; L396-F613 HydrophobicContact CB-CZ 4.37Å; L396-F613 HydrophobicContact CD1-CE1 4.29Å; L396-F613 HydrophobicContact CD1-CZ 4.15Å
397	L	94.1	Very high	90.9	Very high	80 Å²	80	52.9 Å²	52.9	42%	0.419	26%	0.262	S	S	.	.	H	α-helix	trans	-59.4	-48.2	176.4	177	62	0	0	0	111.1	W393 L394 Y399 L400 L401 I523	W393-L397 WeakPolarHBondContact O-CB 3.46Å; W393-L397 PolarHBondContact O-N 3.39Å; L394-L397 PolarHBondContact O-N 2.86Å; L397-Y399 VanDerWaalsContact C-N 3.34Å; L397-Y399 PolarHBondContact O-N 3.5Å; L397-L400 PolarHBondContact O-N 2.86Å; L397-L401 HydrophobicContact CD1-CD1 4.39Å; L397-L401 HydrophobicContact CD1-CG 4.48Å; L397-L401 HydrophobicContact CG-CD1 4.22Å; L397-L401 WeakPolarHBondContact O-CG 3.44Å; L397-L401 PolarHBondContact O-N 3.09Å; L397-I523 HydrophobicContact CD2-CD1 4.14Å; L397-I523 HydrophobicContact CG-CD1 4.32Å
398	E	94.1	Very high	91.2	Very high	11 Å²	11	54 Å²	54	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-64.8	-38.7	177.7	-177.1	-82	179.1	0	0	111.7	L394 L400 L401 H402 I523 R609	L394-E398 PolarHBondContact O-N 3Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 3.29Å; E398-L401 PolarHBondContact O-N 3.46Å; E398-H402 PolarHBondContact O-N 2.85Å; E398-I523 HydrophobicContact CB-CB 4.12Å; E398-I523 HydrophobicContact CB-CG2 3.73Å; E398-I523 HydrophobicContact CG-CB 4.47Å; E398-R609 IonicContact OE1-CZ 3.03Å; E398-R609 IonicContact OE1-NH1 3.62Å; E398-R609 PolarHBondContact OE1-NH1 3.45Å; E398-R609 IonicContact OE1-NH2 2.69Å; E398-R609 IonicContact OE2-CZ 3.59Å; E398-R609 IonicContact OE2-NH1 2.99Å; E398-R609 PolarHBondContact OE2-NH1 3.26Å; E398-R609 IonicContact OE2-NH2 2.69Å; E398-R609 PolarHBondContact OE2-NH2 3.37Å
399	Y	93	Very high	91.2	Very high	40 Å²	40	56.2 Å²	56.2	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-41.3	174.6	175.4	-112.7	0	0	0	112.3	S395 L396 L397 H402 F403 A606 R609 F613	S395-Y399 VanDerWaalsContact O-CB 3.27Å; S395-Y399 WeakPolarHBondContact O-CB 3.38Å; S395-Y399 PolarHBondContact O-N 3.04Å; L396-Y399 HydrophobicContact CD1-CD1 4.31Å; L396-Y399 PolarHBondContact O-N 3.09Å; L397-Y399 VanDerWaalsContact C-N 3.34Å; L397-Y399 PolarHBondContact O-N 3.5Å; Y399-H402 WeakPolarHBondContact O-CB 3.3Å; Y399-H402 PolarHBondContact O-N 3.34Å; Y399-F403 HydrophobicContact CD1-CE2 4.14Å; Y399-F403 HydrophobicContact CD2-CE2 4.26Å; Y399-F403 AromaticContact CE1-CE2 3.62Å; Y399-F403 HydrophobicContact CE1-CE2 3.62Å; Y399-F403 HydrophobicContact CE1-CZ 4.3Å; Y399-F403 AromaticContact CE2-CE2 3.73Å; Y399-F403 HydrophobicContact CE2-CE2 3.73Å; Y399-F403 HydrophobicContact CE2-CZ 4.1Å; Y399-F403 HydrophobicContact CG-CE2 4.45Å; Y399-F403 AromaticContact CZ-CE2 3.39Å; Y399-F403 AromaticContact CZ-CZ 3.71Å; Y399-F403 VanDerWaalsContact O-CD2 3.27Å; Y399-F403 WeakPolarHBondContact O-CD2 3.38Å; Y399-F403 WeakPolarHBondContact OH-CZ 3.3Å; Y399-A606 HydrophobicContact CE2-CB 4.31Å; Y399-A606 VanDerWaalsContact CE2-O 3.29Å; Y399-A606 WeakPolarHBondContact CE2-O 3.48Å; Y399-R609 HydrophobicContact CD2-CB 4.16Å; Y399-R609 HydrophobicContact CE2-CB 4.31Å; Y399-F613 AromaticContact CD1-CE2 3.69Å; Y399-F613 HydrophobicContact CD1-CE2 3.69Å; Y399-F613 HydrophobicContact CD1-CZ 4.27Å; Y399-F613 HydrophobicContact CD2-CE2 4.22Å; Y399-F613 HydrophobicContact CE1-CE2 4.15Å; Y399-F613 AromaticContact CG-CE2 3.71Å; Y399-F613 HydrophobicContact CG-CE2 3.71Å; Y399-F613 HydrophobicContact CG-CZ 4.16Å
400	L	93.8	Very high	91.2	Very high	102 Å²	102	52.4 Å²	52.4	53%	0.534	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-40.9	175.9	-69.3	171.9	0	0	0	111.9	L396 L397 E398 H402 F403	L396-L400 HydrophobicContact CG-CD1 4.27Å; L396-L400 VanDerWaalsContact O-CG 3.3Å; L396-L400 WeakPolarHBondContact O-CG 3.46Å; L396-L400 PolarHBondContact O-N 3.37Å; L397-L400 PolarHBondContact O-N 2.86Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 3.29Å; L400-H402 VanDerWaalsContact C-N 3.28Å; L400-H402 PolarHBondContact O-N 2.82Å; L400-F403 PolarHBondContact O-N 3.49Å
401	L	93.4	Very high	90.9	Very high	42 Å²	42	57.6 Å²	57.6	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-63.7	-34.8	175.7	-72.5	171.3	0	0	0	112.1	L397 E398 F403 L404 L516 I523	L397-L401 HydrophobicContact CD1-CD1 4.39Å; L397-L401 HydrophobicContact CD1-CG 4.48Å; L397-L401 HydrophobicContact CG-CD1 4.22Å; L397-L401 WeakPolarHBondContact O-CG 3.44Å; L397-L401 PolarHBondContact O-N 3.09Å; E398-L401 PolarHBondContact O-N 3.46Å; L401-F403 PolarHBondContact O-N 3.29Å; L401-L404 HydrophobicContact CD2-CD1 3.9Å; L401-L404 VanDerWaalsContact O-CB 3.3Å; L401-L404 WeakPolarHBondContact O-CB 3.44Å; L401-L404 PolarHBondContact O-N 2.98Å; L401-L516 HydrophobicContact CB-CD1 4.36Å; L401-L516 HydrophobicContact CD2-CD1 4.5Å; L401-I523 HydrophobicContact CD1-CD1 3.29Å
402	H	91.7	Very high	90.6	Very high	15 Å²	15	59.5 Å²	59.5	7%	0.069	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-30.6	177.2	-172.3	66.9	0	0	0	113	M335 E398 Y399 L400 L404 S405	M335-H402 WeakPolarHBondContact CE-CE1 3.43Å; M335-H402 WeakPolarHBondContact CE-NE2 3.48Å; E398-H402 PolarHBondContact O-N 2.85Å; Y399-H402 WeakPolarHBondContact O-CB 3.3Å; Y399-H402 PolarHBondContact O-N 3.34Å; L400-H402 VanDerWaalsContact C-N 3.28Å; L400-H402 PolarHBondContact O-N 2.82Å; H402-L404 VanDerWaalsContact C-N 3.25Å; H402-L404 PolarHBondContact O-N 3.45Å; H402-S405 VanDerWaalsContact O-CB 3.22Å; H402-S405 WeakPolarHBondContact O-CB 3.34Å; H402-S405 PolarHBondContact O-N 3.4Å; H402-S405 VanDerWaalsContact O-N 3.12Å; H402-S405 PolarHBondContact O-OG 3.29Å
403	F	92.4	Very high	90.2	Very high	86 Å²	86	59.3 Å²	59.3	38%	0.377	29%	0.293	S	S	.	.	H	α-helix	trans	-66	-26.8	175.5	-77.9	-80	0	0	0	113.4	Y399 L400 L401 S405 F406 A606	Y399-F403 HydrophobicContact CD1-CE2 4.14Å; Y399-F403 HydrophobicContact CD2-CE2 4.26Å; Y399-F403 AromaticContact CE1-CE2 3.62Å; Y399-F403 HydrophobicContact CE1-CE2 3.62Å; Y399-F403 HydrophobicContact CE1-CZ 4.3Å; Y399-F403 AromaticContact CE2-CE2 3.73Å; Y399-F403 HydrophobicContact CE2-CE2 3.73Å; Y399-F403 HydrophobicContact CE2-CZ 4.1Å; Y399-F403 HydrophobicContact CG-CE2 4.45Å; Y399-F403 AromaticContact CZ-CE2 3.39Å; Y399-F403 AromaticContact CZ-CZ 3.71Å; Y399-F403 VanDerWaalsContact O-CD2 3.27Å; Y399-F403 WeakPolarHBondContact O-CD2 3.38Å; Y399-F403 WeakPolarHBondContact OH-CZ 3.3Å; L400-F403 PolarHBondContact O-N 3.49Å; L401-F403 PolarHBondContact O-N 3.29Å; F403-S405 PolarHBondContact O-N 3.03Å; F403-F406 HydrophobicContact CD1-CD2 4.25Å; F403-F406 HydrophobicContact CD1-CE2 4.21Å; F403-F406 WeakPolarHBondContact O-CB 3.38Å; F403-F406 PolarHBondContact O-N 2.9Å; F403-F406 VanDerWaalsContact O-N 3.09Å; F403-A606 HydrophobicContact CZ-CB 4.29Å
404	L	93.1	Very high	89.9	Confident	82 Å²	82	52.6 Å²	52.6	43%	0.429	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-25.8	175.3	-60.5	175	0	0	0	111.3	L401 H402 F406 L407 L516	L401-L404 HydrophobicContact CD2-CD1 3.9Å; L401-L404 VanDerWaalsContact O-CB 3.3Å; L401-L404 WeakPolarHBondContact O-CB 3.44Å; L401-L404 PolarHBondContact O-N 2.98Å; H402-L404 VanDerWaalsContact C-N 3.25Å; H402-L404 PolarHBondContact O-N 3.45Å; L404-F406 PolarHBondContact O-N 3.49Å; L404-L407 HydrophobicContact CD2-CD1 4.34Å; L404-L407 WeakPolarHBondContact O-CB 3.36Å; L404-L407 PolarHBondContact O-N 3.32Å; L404-L516 HydrophobicContact CB-CD1 4.39Å; L404-L516 HydrophobicContact CB-CD2 3.67Å; L404-L516 HydrophobicContact CD1-CD1 4.27Å
405	S	91.1	Very high	89.7	Confident	5 Å²	5	51 Å²	51	4%	0.035	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-61.9	-24.5	175.6	-58	0	0	0	0	113.2	H402 F403 L407 L408 L516	H402-S405 VanDerWaalsContact O-CB 3.22Å; H402-S405 WeakPolarHBondContact O-CB 3.34Å; H402-S405 PolarHBondContact O-N 3.4Å; H402-S405 VanDerWaalsContact O-N 3.12Å; H402-S405 PolarHBondContact O-OG 3.29Å; F403-S405 PolarHBondContact O-N 3.03Å; S405-L407 PolarHBondContact O-N 2.92Å; S405-L408 PolarHBondContact O-N 3.37Å; S405-L516 VanDerWaalsContact OG-CD2 3.32Å; S405-L516 WeakPolarHBondContact OG-CD2 3.43Å
406	F	91	Very high	89.5	Confident	39 Å²	39	50.2 Å²	50.2	17%	0.171	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-68.5	-22.8	174.9	-79.2	-93.1	0	0	0	113.5	F403 L404 T409 Y599 L602	F403-F406 HydrophobicContact CD1-CD2 4.25Å; F403-F406 HydrophobicContact CD1-CE2 4.21Å; F403-F406 WeakPolarHBondContact O-CB 3.38Å; F403-F406 PolarHBondContact O-N 2.9Å; F403-F406 VanDerWaalsContact O-N 3.09Å; L404-F406 PolarHBondContact O-N 3.49Å; F406-T409 WeakPolarHBondContact O-CG2 3.49Å; F406-Y599 HydrophobicContact CD1-CD1 4.33Å; F406-Y599 HydrophobicContact CD1-CE1 4.24Å; F406-Y599 AromaticContact CE1-CD1 3.86Å; F406-Y599 HydrophobicContact CE1-CD1 3.86Å; F406-Y599 HydrophobicContact CE1-CE1 4.19Å; F406-L602 HydrophobicContact CD1-CB 4.46Å; F406-L602 HydrophobicContact CD1-CD1 4.28Å; F406-L602 HydrophobicContact CD2-CB 4.22Å; F406-L602 HydrophobicContact CD2-CD1 4.18Å; F406-L602 HydrophobicContact CE1-CB 3.85Å; F406-L602 HydrophobicContact CE1-CD1 4.46Å; F406-L602 HydrophobicContact CE2-CB 3.58Å; F406-L602 HydrophobicContact CE2-CD1 4.38Å; F406-L602 HydrophobicContact CG-CD1 4.16Å; F406-L602 HydrophobicContact CZ-CB 3.38Å
407	L	90.3	Very high	88.9	Confident	125 Å²	125	47.7 Å²	47.7	65%	0.654	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-83.7	-18.5	179.1	-57	177.3	0	0	0	112.2	L404 S405 T409	L404-L407 HydrophobicContact CD2-CD1 4.34Å; L404-L407 WeakPolarHBondContact O-CB 3.36Å; L404-L407 PolarHBondContact O-N 3.32Å; S405-L407 PolarHBondContact O-N 2.92Å; L407-T409 PolarHBondContact O-N 2.89Å
408	L	91	Very high	88.4	Confident	25 Å²	25	44 Å²	44	13%	0.131	23%	0.226	C	C	.	.	S	Bend	trans	-86.5	64.5	-174.5	-56.7	178.6	0	0	0	110.4	Y347 S405 M509 F513 L516	Y347-L408 PolarHBondContact OH-O 2.92Å; S405-L408 PolarHBondContact O-N 3.37Å; L408-M509 HydrophobicContact CD2-SD 4.32Å; L408-F513 HydrophobicContact CB-CB 4.28Å; L408-F513 VanDerWaalsContact CD1-CA 3.44Å; L408-F513 HydrophobicContact CD1-CB 3.92Å; L408-F513 HydrophobicContact CD1-CD2 4.43Å; L408-L516 HydrophobicContact CD1-CB 4.31Å; L408-L516 HydrophobicContact CD1-CD2 3.73Å
409	T	85.8	Confident	87.9	Confident	59 Å²	59	44.5 Å²	44.5	36%	0.362	23%	0.229	S	C	.	.			trans	-98.5	157.5	-169.5	74.2	0	0	0	0	112.3	F406 L407 R598	F406-T409 WeakPolarHBondContact O-CG2 3.49Å; L407-T409 PolarHBondContact O-N 2.89Å; T409-R598 VanDerWaalsContact CB-NH1 3.29Å
410	C	86.8	Confident	87.4	Confident	14 Å²	14	43.1 Å²	43.1	10%	0.095	23%	0.225	C	C	.	.			trans	-139.5	144.3	172.3	179.7	0	0	0	0	107.1	Q346 Y347 K502 C506	Q346-C410 PolarHBondContact NE2-O 3.13Å; Y347-C410 HydrophobicContact CD1-CB 4.24Å; Y347-C410 HydrophobicContact CE1-CB 4.48Å; C410-K502 WeakPolarHBondContact SG-CD 3.48Å; C410-C506 HydrophobicContact CB-CB 4.1Å; C410-C506 WeakPolarHBondContact CB-SG 3.33Å; C410-C506 WeakPolarHBondContact SG-CB 3.39Å; C410-C506 CovalentContact SG-SG 2.04Å; C410-C506 PolarHBondContact SG-SG 3.25Å
411	E	82	Confident	87	Confident	170 Å²	170	39 Å²	39	79%	0.794	21%	0.205	S	C	*	.	P	Polyproline II helix	trans	-64.5	156.9	-175	-64.7	-175	168.6	0	0	111.8	K502	E411-K502 PolarHBondContact O-NZ 3.24Å
412	N	81.8	Confident	86.5	Confident	51 Å²	51	38.5 Å²	38.5	27%	0.273	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-64.2	143.4	174.4	-74.7	-0.5	0	0	0	109	S414 D593 S594	N412-S414 PolarHBondContact O-N 2.62Å; N412-D593 PolarHBondContact ND2-OD1 3.15Å; N412-S594 WeakPolarHBondContact OD1-CB 3.37Å; N412-S594 PolarHBondContact OD1-OG 3.25Å
413	S	81.6	Confident	85.9	Confident	22 Å²	22	45 Å²	45	15%	0.154	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-62.3	120	171.8	-64	0	0	0	0	108.9	V415 N419 K502	S413-V415 PolarHBondContact O-N 3Å; S413-N419 PolarHBondContact O-ND2 3.41Å; S413-K502 WeakPolarHBondContact OG-CE 3.49Å
414	S	85	Confident	85.1	Confident	33 Å²	33	42.6 Å²	42.6	23%	0.231	23%	0.23	C	C	.	.			trans	-71.4	107.7	179.1	48.5	0	0	0	0	110.1	N412 S460	N412-S414 PolarHBondContact O-N 2.62Å; S414-S460 WeakPolarHBondContact O-CA 3.48Å; S414-S460 WeakPolarHBondContact O-CB 3.34Å; S414-S460 PolarHBondContact O-N 3.48Å; S414-S460 PolarHBondContact O-OG 3.28Å
415	V	87.7	Confident	84.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-117.2	114.8	177.1	-172.8	0	0	0	0	109.4	S413 G417 I418 N419 T420 W450 S460 L462 L499 I591	S413-V415 PolarHBondContact O-N 3Å; V415-G417 PolarHBondContact O-N 3.09Å; V415-I418 HydrophobicContact CB-CB 4.42Å; V415-I418 HydrophobicContact CB-CD1 4.47Å; V415-I418 HydrophobicContact CG1-CB 4.5Å; V415-I418 HydrophobicContact CG1-CD1 3.9Å; V415-I418 HydrophobicContact CG1-CG1 4.43Å; V415-I418 PolarHBondContact O-N 3.39Å; V415-I418 VanDerWaalsContact O-N 3.16Å; V415-N419 PolarHBondContact N-OD1 3.28Å; V415-N419 PolarHBondContact O-N 3.4Å; V415-N419 VanDerWaalsContact O-N 3.09Å; V415-N419 PolarHBondContact O-OD1 3.04Å; V415-T420 PolarHBondContact O-N 3.49Å; V415-W450 HydrophobicContact CG1-CH2 4.5Å; V415-W450 HydrophobicContact CG1-CZ3 4.44Å; V415-S460 CarbonylContact C-O 3.52Å; V415-S460 WeakPolarHBondContact CA-O 3.41Å; V415-L462 HydrophobicContact CG1-CD1 3.83Å; V415-L462 HydrophobicContact CG1-CG 4.41Å; V415-L499 HydrophobicContact CG2-CD2 3.93Å; V415-I591 HydrophobicContact CB-CD1 4.5Å; V415-I591 HydrophobicContact CG2-CD1 3.54Å
416	V	86.8	Confident	83.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-63.3	130.6	-178	177.7	0	0	0	0	110.4	I418 T420 Y422 L459 S460 Y461 L462	V416-I418 VanDerWaalsContact C-N 3.31Å; V416-T420 CarbonylContact C-O 3.4Å; V416-T420 VanDerWaalsContact CA-O 3.28Å; V416-T420 WeakPolarHBondContact CA-O 3.21Å; V416-Y422 HydrophobicContact CG1-CD1 3.61Å; V416-Y422 HydrophobicContact CG1-CD2 3.43Å; V416-Y422 VanDerWaalsContact CG1-CD2 3.43Å; V416-Y422 HydrophobicContact CG1-CE1 3.59Å; V416-Y422 HydrophobicContact CG1-CE2 3.43Å; V416-Y422 VanDerWaalsContact CG1-CE2 3.43Å; V416-Y422 HydrophobicContact CG1-CG 3.52Å; V416-Y422 VanDerWaalsContact CG1-CZ 3.48Å; V416-L459 HydrophobicContact CG2-CB 4Å; V416-L459 HydrophobicContact CG2-CD1 4.1Å; V416-S460 PolarHBondContact N-O 3.36Å; V416-Y461 HydrophobicContact CB-CD1 3.84Å; V416-Y461 HydrophobicContact CB-CE1 4Å; V416-Y461 HydrophobicContact CG1-CD1 4.16Å; V416-Y461 HydrophobicContact CG1-CE1 4.11Å; V416-Y461 HydrophobicContact CG2-CD1 4Å; V416-Y461 HydrophobicContact CG2-CE1 3.74Å; V416-L462 WeakPolarHBondContact O-CD1 3.46Å
417	G	80.5	Confident	82.7	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	3.5	-177.6	0	0	0	0	0	114.6	V415 T420 N433	V415-G417 PolarHBondContact O-N 3.09Å; G417-T420 PolarHBondContact N-O 3.39Å; G417-N433 WeakPolarHBondContact O-CB 3.4Å; G417-N433 VanDerWaalsContact O-CG 3.31Å; G417-N433 PolarHBondContact O-ND2 2.97Å
418	I	83.6	Confident	81.2	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-57.4	170.3	-66.5	171.5	0	0	0	111	V415 V416 W450 L462 L576 H577 I591	V415-I418 HydrophobicContact CB-CB 4.42Å; V415-I418 HydrophobicContact CB-CD1 4.47Å; V415-I418 HydrophobicContact CG1-CB 4.5Å; V415-I418 HydrophobicContact CG1-CD1 3.9Å; V415-I418 HydrophobicContact CG1-CG1 4.43Å; V415-I418 PolarHBondContact O-N 3.39Å; V415-I418 VanDerWaalsContact O-N 3.16Å; V416-I418 VanDerWaalsContact C-N 3.31Å; I418-W450 HydrophobicContact CD1-CZ3 3.78Å; I418-L462 HydrophobicContact CD1-CD1 4.07Å; I418-L462 HydrophobicContact CD1-CD2 4.27Å; I418-L462 HydrophobicContact CD1-CG 4.21Å; I418-L462 HydrophobicContact CG1-CD1 4.15Å; I418-L576 HydrophobicContact CG2-CB 3.82Å; I418-L576 HydrophobicContact CG2-CD1 4.09Å; I418-L576 HydrophobicContact CG2-CG 4.48Å; I418-H577 HydrophobicContact CD1-CB 3.91Å; I418-I591 HydrophobicContact CD1-CG2 4.22Å
419	N	83.4	Confident	79.5	Confident	22 Å²	22	53.9 Å²	53.9	12%	0.118	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-10	-177	67.2	8.3	0	0	0	113.6	S413 V415 Q427	S413-N419 PolarHBondContact O-ND2 3.41Å; V415-N419 PolarHBondContact N-OD1 3.28Å; V415-N419 PolarHBondContact O-N 3.4Å; V415-N419 VanDerWaalsContact O-N 3.09Å; V415-N419 PolarHBondContact O-OD1 3.04Å; N419-Q427 PolarHBondContact O-N 2.71Å
420	T	84	Confident	77.6	Confident	12 Å²	12	62.1 Å²	62.1	7%	0.074	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-134.5	142	-178.2	-47.9	0	0	0	0	108.5	V415 V416 G417 I425 L459	V415-T420 PolarHBondContact O-N 3.49Å; V416-T420 CarbonylContact C-O 3.4Å; V416-T420 VanDerWaalsContact CA-O 3.28Å; V416-T420 WeakPolarHBondContact CA-O 3.21Å; G417-T420 PolarHBondContact N-O 3.39Å; T420-I425 WeakPolarHBondContact CA-O 3.32Å; T420-L459 HydrophobicContact CG2-CD2 4.39Å
421	S	84.8	Confident	75.6	Confident	15 Å²	15	69 Å²	69	11%	0.105	35%	0.354	C	S	.	.			trans	-75.9	167.6	171.6	74.3	0	0	0	0	111.5	E423 G424 I425	S421-E423 PolarHBondContact O-N 2.96Å; S421-E423 VanDerWaalsContact O-N 3.16Å; S421-E423 PolarHBondContact OG-N 3.23Å; S421-G424 PolarHBondContact O-N 3.2Å; S421-I425 PolarHBondContact N-O 3.37Å; S421-I425 PolarHBondContact OG-N 3.26Å; S421-I425 PolarHBondContact OG-O 3.06Å
422	Y	82.6	Confident	74	Confident	32 Å²	32	63.7 Å²	63.7	13%	0.125	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.3	171.8	-78.6	-93.3	0	0	0	113.4	V416 G424 V435 A437 N440 Y461 L466 C486	V416-Y422 HydrophobicContact CG1-CD1 3.61Å; V416-Y422 HydrophobicContact CG1-CD2 3.43Å; V416-Y422 VanDerWaalsContact CG1-CD2 3.43Å; V416-Y422 HydrophobicContact CG1-CE1 3.59Å; V416-Y422 HydrophobicContact CG1-CE2 3.43Å; V416-Y422 VanDerWaalsContact CG1-CE2 3.43Å; V416-Y422 HydrophobicContact CG1-CG 3.52Å; V416-Y422 VanDerWaalsContact CG1-CZ 3.48Å; Y422-G424 VanDerWaalsContact C-N 3.32Å; Y422-V435 WeakPolarHBondContact CE2-O 3.43Å; Y422-V435 PolarHBondContact OH-O 3.17Å; Y422-A437 HydrophobicContact CD1-CB 4.14Å; Y422-A437 HydrophobicContact CD2-CB 3.54Å; Y422-A437 HydrophobicContact CE1-CB 4.37Å; Y422-A437 HydrophobicContact CE2-CB 3.8Å; Y422-A437 HydrophobicContact CG-CB 3.74Å; Y422-N440 PolarHBondContact OH-ND2 2.88Å; Y422-Y461 HydrophobicContact CD1-CE1 4.14Å; Y422-Y461 HydrophobicContact CE1-CD1 4.12Å; Y422-Y461 AromaticContact CE1-CE1 3.94Å; Y422-Y461 HydrophobicContact CE1-CE1 3.94Å; Y422-L466 PolarHBondContact OH-O 3.28Å; Y422-C486 HydrophobicContact CD1-CB 3.84Å; Y422-C486 HydrophobicContact CE1-CB 3.77Å
423	E	78.5	Confident	72.9	Confident	152 Å²	152	64.4 Å²	64.4	71%	0.71	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	1.8	175.4	-61	-179.8	170.9	0	0	112.7	S421 I425	S421-E423 PolarHBondContact O-N 2.96Å; S421-E423 VanDerWaalsContact O-N 3.16Å; S421-E423 PolarHBondContact OG-N 3.23Å; E423-I425 VanDerWaalsContact C-N 3.34Å; E423-I425 HydrophobicContact CB-CD1 4.25Å; E423-I425 HydrophobicContact CB-CG1 4.27Å
424	G	76.4	Confident	72.3	Confident	35 Å²	35	69.2 Å²	69.2	36%	0.361	37%	0.373	S	S	.	.	S	Bend	trans	79.2	14.4	-178.5	0	0	0	0	0	114.2	S421 Y422	S421-G424 PolarHBondContact O-N 3.2Å; Y422-G424 VanDerWaalsContact C-N 3.32Å
425	I	79.9	Confident	72.1	Confident	94 Å²	94	68.5 Å²	68.5	48%	0.482	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-92	129.1	179.8	-55.2	173.1	0	0	0	108.9	T420 S421 E423 Q427	T420-I425 WeakPolarHBondContact CA-O 3.32Å; S421-I425 PolarHBondContact N-O 3.37Å; S421-I425 PolarHBondContact OG-N 3.26Å; S421-I425 PolarHBondContact OG-O 3.06Å; E423-I425 VanDerWaalsContact C-N 3.34Å; E423-I425 HydrophobicContact CB-CD1 4.25Å; E423-I425 HydrophobicContact CB-CG1 4.27Å; I425-Q427 PolarHBondContact O-N 3.16Å
426	P	75.8	Confident	71.9	Confident	110 Å²	110	72.7 Å²	72.7	71%	0.714	39%	0.386	S	S	*	.	B	Isolated β-bridge	trans	-56.6	127.1	172.8	-23.1	33.1	0	0	0	110.8
427	Q	69.3	Low	71.8	Confident	72 Å²	72	73.9 Å²	73.9	34%	0.336	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-102.1	133.1	177.2	-80.6	-176.7	-33	0	0	110.6	N419 I425	N419-Q427 PolarHBondContact O-N 2.71Å; I425-Q427 PolarHBondContact O-N 3.16Å
428	D	59.2	Low	72	Confident	141 Å²	141	81.4 Å²	81.4	75%	0.754	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-71.2	131.7	169.3	-78	-32.3	0	0	0	110.1	Y430 M431	D428-Y430 PolarHBondContact O-N 2.72Å; D428-M431 PolarHBondContact O-N 3.48Å
429	L	53.9	Low	72.1	Confident	96 Å²	96	83.1 Å²	83.1	50%	0.503	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-7.7	-176.1	-71.5	161.3	0	0	0	115.9	L576	L429-L576 HydrophobicContact CD1-CD2 3.9Å; L429-L576 HydrophobicContact CD2-CD2 3.46Å; L429-L576 VanDerWaalsContact CD2-CD2 3.46Å; L429-L576 HydrophobicContact CG-CD2 4.33Å
430	Y	45.5	Very low	72.4	Confident	231 Å²	231	82 Å²	82	91%	0.906	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-14.7	-176.9	-73.6	-86	0	0	0	114.3	D428	D428-Y430 PolarHBondContact O-N 2.72Å
431	M	45.2	Very low	72.4	Confident	158 Å²	158	85.2 Å²	85.2	78%	0.778	46%	0.461	S	S	*	.	S	Bend	trans	-97.1	116.6	167.2	-79	-171.6	-168.6	0	0	108.2	D428	D428-M431 PolarHBondContact O-N 3.48Å
432	G	48.7	Very low	72.4	Confident	60 Å²	60	89.2 Å²	89.2	62%	0.619	48%	0.481	S	S	*	.			trans	-44.7	140	-172.1	0	0	0	0	0	114.6	N434	G432-N434 PolarHBondContact O-N 3.15Å
433	N	59.7	Low	72.3	Confident	66 Å²	66	88.1 Å²	88.1	35%	0.353	48%	0.478	S	S	.	.			trans	-57.4	92.5	179.3	-71.7	10.9	0	0	0	111.6	G417 V435	G417-N433 WeakPolarHBondContact O-CB 3.4Å; G417-N433 VanDerWaalsContact O-CG 3.31Å; G417-N433 PolarHBondContact O-ND2 2.97Å; N433-V435 VanDerWaalsContact C-N 3.3Å; N433-V435 HydrophobicContact CB-CG2 4.43Å; N433-V435 PolarHBondContact O-N 3.26Å
434	N	68.7	Low	72.4	Confident	123 Å²	123	84.6 Å²	84.6	66%	0.658	46%	0.464	S	S	*	.			trans	-77.4	86	169.4	-79.3	-12.8	0	0	0	108.7	G432 F436	G432-N434 PolarHBondContact O-N 3.15Å; N434-F436 PolarHBondContact O-N 3.35Å
435	V	79.6	Confident	72.7	Confident	17 Å²	17	83.1 Å²	83.1	10%	0.103	45%	0.448	C	S	.	.			trans	-65.2	-23	176.7	-176.1	0	0	0	0	111.3	Y422 N433 N440 L466	Y422-V435 WeakPolarHBondContact CE2-O 3.43Å; Y422-V435 PolarHBondContact OH-O 3.17Å; N433-V435 VanDerWaalsContact C-N 3.3Å; N433-V435 HydrophobicContact CB-CG2 4.43Å; N433-V435 PolarHBondContact O-N 3.26Å; V435-N440 PolarHBondContact O-ND2 3.46Å; V435-L466 HydrophobicContact CG1-CD1 3.46Å; V435-L466 VanDerWaalsContact CG1-CD1 3.46Å; V435-L466 HydrophobicContact CG1-CD2 3.71Å; V435-L466 HydrophobicContact CG1-CG 4.2Å
436	F	83.8	Confident	72.7	Confident	89 Å²	89	81.3 Å²	81.3	39%	0.39	44%	0.443	S	S	.	.			trans	-98.4	142.7	177.8	-59.7	-74.9	0	0	0	112.7	N434 N440 C445 L466	N434-F436 PolarHBondContact O-N 3.35Å; F436-N440 VanDerWaalsContact CA-OD1 3.28Å; F436-N440 WeakPolarHBondContact CA-OD1 3.44Å; F436-C445 HydrophobicContact CE1-CB 4.34Å; F436-C445 WeakPolarHBondContact CZ-O 3.13Å; F436-L466 HydrophobicContact CD1-CD2 4.3Å; F436-L466 HydrophobicContact CE1-CD2 4.16Å
437	A	84	Confident	72.8	Confident	25 Å²	25	78.6 Å²	78.6	21%	0.207	43%	0.426	C	S	.	.			trans	-138.6	170.8	175.2	0	0	0	0	0	109.9	Y422 C439 N440 V441	Y422-A437 HydrophobicContact CD1-CB 4.14Å; Y422-A437 HydrophobicContact CD2-CB 3.54Å; Y422-A437 HydrophobicContact CE1-CB 4.37Å; Y422-A437 HydrophobicContact CE2-CB 3.8Å; Y422-A437 HydrophobicContact CG-CB 3.74Å; A437-C439 PolarHBondContact O-N 3.36Å; A437-N440 PolarHBondContact N-OD1 3.13Å; A437-N440 PolarHBondContact O-N 3.03Å; A437-N440 PolarHBondContact O-OD1 3.24Å; A437-V441 WeakPolarHBondContact O-CB 3.3Å; A437-V441 PolarHBondContact O-N 2.91Å
438	N	85.5	Confident	73.1	Confident	157 Å²	157	81.5 Å²	81.5	84%	0.84	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-24.9	-179.2	-64.8	-16.8	0	0	0	113.7
439	C	86.8	Confident	74.1	Confident	38 Å²	38	76.5 Å²	76.5	26%	0.257	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-18.3	179.9	58.1	0	0	0	0	114	A437 S485 C486	A437-C439 PolarHBondContact O-N 3.36Å; C439-S485 PolarHBondContact O-OG 2.92Å; C439-C486 HydrophobicContact CB-CB 3.96Å; C439-C486 WeakPolarHBondContact CB-SG 3.5Å; C439-C486 WeakPolarHBondContact SG-CA 3.42Å; C439-C486 WeakPolarHBondContact SG-CB 3.3Å; C439-C486 CovalentContact SG-SG 2.03Å; C439-C486 PolarHBondContact SG-SG 2.92Å
440	N	87.7	Confident	75.6	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-1.5	-175.4	69.7	14.2	0	0	0	115.7	Y422 V435 F436 A437 D442 C443 L466	Y422-N440 PolarHBondContact OH-ND2 2.88Å; V435-N440 PolarHBondContact O-ND2 3.46Å; F436-N440 VanDerWaalsContact CA-OD1 3.28Å; F436-N440 WeakPolarHBondContact CA-OD1 3.44Å; A437-N440 PolarHBondContact N-OD1 3.13Å; A437-N440 PolarHBondContact O-N 3.03Å; A437-N440 PolarHBondContact O-OD1 3.24Å; N440-D442 PolarHBondContact O-N 3.49Å; N440-C443 WeakPolarHBondContact CA-SG 3.44Å; N440-C443 VanDerWaalsContact O-CB 3.26Å; N440-C443 WeakPolarHBondContact O-CB 3.34Å; N440-C443 PolarHBondContact O-N 3.32Å; N440-C443 VanDerWaalsContact O-N 3.13Å; N440-C443 PolarHBondContact O-SG 2.86Å; N440-C443 VanDerWaalsContact O-SG 3.4Å; N440-L466 PolarHBondContact ND2-O 2.74Å
441	V	84.4	Confident	77.6	Confident	79 Å²	79	61.1 Å²	61.1	48%	0.479	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-61.8	-34.2	-177.4	65.3	0	0	0	0	112.1	A437 C443	A437-V441 WeakPolarHBondContact O-CB 3.3Å; A437-V441 PolarHBondContact O-N 2.91Å; V441-C443 VanDerWaalsContact C-N 3.27Å; V441-C443 PolarHBondContact O-N 3.35Å
442	D	84.8	Confident	79.9	Confident	98 Å²	98	53.7 Å²	53.7	52%	0.524	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-81.3	-7.4	-179	-56.1	-48.9	0	0	0	112.9	E134 N440	E134-D442 WeakPolarHBondContact CA-O 3.48Å; E134-D442 HydrophobicContact CG-CB 3.85Å; N440-D442 PolarHBondContact O-N 3.49Å
443	C	80.9	Confident	81.9	Confident	9 Å²	9	50.9 Å²	50.9	6%	0.061	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-83.6	-10.2	-176.7	-50.2	0	0	0	0	114.3	C132 N440 V441 C445	C132-C443 HydrophobicContact CB-CB 3.69Å; C132-C443 WeakPolarHBondContact CB-SG 3.3Å; C132-C443 WeakPolarHBondContact SG-CB 3.19Å; C132-C443 CovalentContact SG-SG 2Å; C132-C443 PolarHBondContact SG-SG 3.2Å; N440-C443 WeakPolarHBondContact CA-SG 3.44Å; N440-C443 VanDerWaalsContact O-CB 3.26Å; N440-C443 WeakPolarHBondContact O-CB 3.34Å; N440-C443 PolarHBondContact O-N 3.32Å; N440-C443 VanDerWaalsContact O-N 3.13Å; N440-C443 PolarHBondContact O-SG 2.86Å; N440-C443 VanDerWaalsContact O-SG 3.4Å; V441-C443 VanDerWaalsContact C-N 3.27Å; V441-C443 PolarHBondContact O-N 3.35Å; C443-C445 WeakPolarHBondContact CB-SG 3.36Å; C443-C445 PolarHBondContact O-N 3.03Å
444	N	81.8	Confident	83.5	Confident	79 Å²	79	48.8 Å²	48.8	42%	0.422	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	39.3	-176.1	-158.8	6.8	0	0	0	114.4	Q138	Q138-N444 PolarHBondContact NE2-OD1 2.85Å
445	C	82.1	Confident	84.7	Confident	4 Å²	4	43 Å²	43	3%	0.027	24%	0.239	C	C	.	.			trans	-68.8	144.3	-174.7	-57.9	0	0	0	0	113.2	F436 C443 S447 C465 L466	F436-C445 HydrophobicContact CE1-CB 4.34Å; F436-C445 WeakPolarHBondContact CZ-O 3.13Å; C443-C445 WeakPolarHBondContact CB-SG 3.36Å; C443-C445 PolarHBondContact O-N 3.03Å; C445-S447 PolarHBondContact O-N 2.82Å; C445-C465 VanDerWaalsContact CA-SG 3.53Å; C445-C465 HydrophobicContact CB-CB 3.84Å; C445-C465 WeakPolarHBondContact CB-SG 3.21Å; C445-C465 WeakPolarHBondContact SG-CB 3.4Å; C445-C465 PolarHBondContact SG-O 3.42Å; C445-C465 CovalentContact SG-SG 2.04Å; C445-C465 PolarHBondContact SG-SG 3.46Å; C445-L466 HydrophobicContact CB-CD2 3.63Å; C445-L466 HydrophobicContact CB-CG 3.96Å
446	P	79.3	Confident	85.3	Confident	56 Å²	56	45.8 Å²	45.8	36%	0.364	25%	0.253	S	S	.	.			trans	-65.7	122.5	170.2	25.9	-32.4	0	0	0	111.1	I449	P446-I449 HydrophobicContact CB-CB 4.34Å; P446-I449 HydrophobicContact CB-CG2 4.21Å; P446-I449 HydrophobicContact CG-CB 4.26Å; P446-I449 HydrophobicContact CG-CG2 3.73Å
447	S	77.6	Confident	85.5	Confident	53 Å²	53	44 Å²	44	37%	0.371	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.3	-174.9	58.1	0	0	0	0	115.2	C445	C445-S447 PolarHBondContact O-N 2.82Å
448	K	75.9	Confident	85.7	Confident	132 Å²	132	44.7 Å²	44.7	57%	0.574	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-2.8	-176.8	-65.5	-171.7	178.7	-175.5	0	114.3
449	I	79.6	Confident	85.9	Confident	37 Å²	37	38.4 Å²	38.4	19%	0.19	22%	0.224	C	C	.	.			trans	-79.7	135.7	-177.9	-158.7	146.1	0	0	0	110.1	T118 P446	T118-I449 HydrophobicContact CG2-CB 4.43Å; T118-I449 HydrophobicContact CG2-CD1 3.47Å; T118-I449 VanDerWaalsContact CG2-CD1 3.47Å; T118-I449 HydrophobicContact CG2-CG1 3.82Å; T118-I449 HydrophobicContact CG2-CG2 3.78Å; P446-I449 HydrophobicContact CB-CB 4.34Å; P446-I449 HydrophobicContact CB-CG2 4.21Å; P446-I449 HydrophobicContact CG-CB 4.26Å; P446-I449 HydrophobicContact CG-CG2 3.73Å
450	W	86.2	Confident	86.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.212	C	C	.	.			trans	-104.8	98.2	174.4	-175	-97	0	0	0	110.4	E116 T239 R240 V415 I418 P452 L462 L499 H577 R590 I591	E116-W450 PolarHBondContact OE2-N 3.22Å; T239-W450 PolarHBondContact OG1-NE1 3.34Å; R240-W450 WeakPolarHBondContact CD-O 3.28Å; R240-W450 PolarHBondContact NH1-O 3.21Å; V415-W450 HydrophobicContact CG1-CH2 4.5Å; V415-W450 HydrophobicContact CG1-CZ3 4.44Å; I418-W450 HydrophobicContact CD1-CZ3 3.78Å; W450-P452 HydrophobicContact CZ2-CB 4.5Å; W450-P452 HydrophobicContact CZ2-CG 4.25Å; W450-L462 HydrophobicContact CE3-CG 4.44Å; W450-L462 HydrophobicContact CZ3-CG 4.38Å; W450-L499 HydrophobicContact CZ2-CD2 4.42Å; W450-H577 AromaticContact CE3-CD2 3.42Å; W450-H577 VanDerWaalsContact CE3-CD2 3.42Å; W450-H577 AromaticContact CE3-NE2 3.9Å; W450-H577 HydrophobicContact CZ3-CB 4.39Å; W450-R590 HydrophobicContact CB-CG 4.09Å; W450-R590 HydrophobicContact CD2-CB 3.69Å; W450-R590 HydrophobicContact CD2-CG 4.05Å; W450-R590 HydrophobicContact CE3-CB 4.25Å; W450-R590 HydrophobicContact CG-CB 3.88Å; W450-R590 HydrophobicContact CG-CG 3.7Å; W450-R590 HydrophobicContact CZ2-CB 4.14Å; W450-I591 HydrophobicContact CH2-CB 3.88Å; W450-I591 HydrophobicContact CH2-CD1 4.19Å; W450-I591 HydrophobicContact CH2-CG2 3.82Å; W450-I591 HydrophobicContact CZ2-CB 4.29Å; W450-I591 HydrophobicContact CZ3-CG2 4.09Å
451	D	88.5	Confident	86.4	Confident	3 Å²	3	36.7 Å²	36.7	2%	0.016	21%	0.212	C	C	.	.			trans	-140.4	66.2	177.2	-166.1	6.1	0	0	0	110.8	T118 R240 L462 S463	T118-D451 WeakPolarHBondContact CB-OD2 3.4Å; T118-D451 HydrophobicContact CG2-CB 3.97Å; T118-D451 PolarHBondContact N-OD2 2.84Å; T118-D451 PolarHBondContact OG1-OD2 3.08Å; R240-D451 IonicContact CZ-OD1 3.45Å; R240-D451 IonicContact NH1-OD1 2.82Å; R240-D451 PolarHBondContact NH1-OD1 3.31Å; R240-D451 IonicContact NH1-OD2 3.19Å; R240-D451 IonicContact NH2-OD1 2.78Å; R240-D451 PolarHBondContact NH2-OD1 3.26Å; D451-L462 CarbonylContact C-O 3.56Å; D451-L462 WeakPolarHBondContact CA-O 3.48Å; D451-L462 PolarHBondContact N-O 2.96Å; D451-S463 VanDerWaalsContact O-CA 3.31Å; D451-S463 WeakPolarHBondContact O-CA 3.44Å
452	P	91.6	Very high	86.6	Confident	2 Å²	2	33 Å²	33	1%	0.013	19%	0.189	C	C	.	.			trans	-65.2	143.8	-161.2	25	-35.1	0	0	0	113.3	W450 Y461 G498 L499	W450-P452 HydrophobicContact CZ2-CB 4.5Å; W450-P452 HydrophobicContact CZ2-CG 4.25Å; P452-Y461 WeakPolarHBondContact CA-O 3.36Å; P452-G498 WeakPolarHBondContact O-CA 3.39Å; P452-G498 PolarHBondContact O-N 3.24Å; P452-L499 HydrophobicContact CB-CD2 3.79Å; P452-L499 HydrophobicContact CB-CG 4.24Å; P452-L499 HydrophobicContact CG-CD2 4.39Å; P452-L499 HydrophobicContact CG-CG 4.39Å
453	V	92.3	Very high	86.8	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	143	172.7	-61.6	0	0	0	0	111	S460 Y461 A464 A467 F481 A495 V496 G498	V453-S460 CarbonylContact O-C 3.55Å; V453-S460 WeakPolarHBondContact O-CA 3.34Å; V453-Y461 PolarHBondContact N-O 3Å; V453-Y461 PolarHBondContact O-N 2.87Å; V453-A464 HydrophobicContact CG1-CB 4.21Å; V453-A467 HydrophobicContact CG2-CB 4.09Å; V453-F481 HydrophobicContact CG1-CD2 3.99Å; V453-F481 HydrophobicContact CG1-CE2 3.8Å; V453-A495 HydrophobicContact CB-CB 4.09Å; V453-A495 HydrophobicContact CG2-CB 4.06Å; V453-V496 CarbonylContact C-O 3.46Å; V453-V496 VanDerWaalsContact CA-O 3.23Å; V453-V496 WeakPolarHBondContact CA-O 3.5Å; V453-V496 WeakPolarHBondContact CB-O 3.19Å; V453-G498 CarbonylContact C-O 3.12Å; V453-G498 VanDerWaalsContact CA-O 3.32Å; V453-G498 WeakPolarHBondContact CA-O 3.09Å
454	C	93.4	Very high	87.3	Confident	22 Å²	22	28 Å²	28	15%	0.149	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	117.2	176.1	177.7	0	0	0	0	109.7	A495 V496 G498 C500	C454-A495 CarbonylContact O-C 3.52Å; C454-A495 WeakPolarHBondContact O-CA 3.17Å; C454-A495 WeakPolarHBondContact O-CB 3.5Å; C454-V496 HydrophobicContact CB-CG2 4Å; C454-V496 PolarHBondContact N-O 3.29Å; C454-V496 PolarHBondContact O-N 3.22Å; C454-G498 PolarHBondContact N-O 3.22Å; C454-C500 WeakPolarHBondContact CA-SG 3.24Å; C454-C500 HydrophobicContact CB-CB 4Å; C454-C500 WeakPolarHBondContact CB-SG 3.47Å; C454-C500 WeakPolarHBondContact SG-CA 3.42Å; C454-C500 WeakPolarHBondContact SG-CB 3.35Å; C454-C500 CovalentContact SG-SG 2.04Å; C454-C500 PolarHBondContact SG-SG 3.33Å
455	G	92.9	Very high	87.6	Confident	3 Å²	3	24.3 Å²	24.3	3%	0.031	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	153.4	174.1	0	0	0	0	0	112.4	N457 G458 L459	G455-N457 PolarHBondContact O-N 2.84Å; G455-G458 PolarHBondContact O-N 3.22Å; G455-L459 PolarHBondContact N-O 3.15Å
456	N	91.4	Very high	88	Confident	74 Å²	74	24.1 Å²	24.1	40%	0.396	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-9.8	173.1	70.6	-7.1	0	0	0	114.1	G458 I487 T489 N492 S494	N456-G458 VanDerWaalsContact C-N 3.29Å; N456-I487 WeakPolarHBondContact OD1-CG2 3.35Å; N456-T489 PolarHBondContact ND2-OG1 3.45Å; N456-T489 VanDerWaalsContact OD1-CG2 3.27Å; N456-T489 WeakPolarHBondContact OD1-CG2 3.47Å; N456-T489 PolarHBondContact OD1-OG1 2.92Å; N456-N492 PolarHBondContact ND2-O 3.34Å; N456-N492 VanDerWaalsContact ND2-O 3.09Å; N456-S494 PolarHBondContact N-O 3.07Å
457	N	88.5	Confident	88.5	Confident	52 Å²	52	21.5 Å²	21.5	28%	0.278	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	0.3	170.5	67.6	-22.1	0	0	0	113.9	G455 L459 Y461 I487 T489	G455-N457 PolarHBondContact O-N 2.84Å; N457-L459 VanDerWaalsContact C-N 3.29Å; N457-L459 WeakPolarHBondContact ND2-CD1 3.32Å; N457-L459 PolarHBondContact O-N 3.31Å; N457-L459 PolarHBondContact OD1-N 3.35Å; N457-Y461 PolarHBondContact ND2-OH 3.42Å; N457-I487 HydrophobicContact CB-CG2 4.1Å; N457-T489 HydrophobicContact CB-CG2 3.78Å
458	G	88.8	Confident	89.1	Confident	40 Å²	40	19 Å²	19	41%	0.412	11%	0.107	S	C	.	.	S	Bend	trans	77.3	11.1	-178.8	0	0	0	0	0	114.5	G455 N456 C500	G455-G458 PolarHBondContact O-N 3.22Å; N456-G458 VanDerWaalsContact C-N 3.29Å; G458-C500 VanDerWaalsContact C-SG 3.52Å
459	L	90.3	Very high	89.8	Confident	25 Å²	25	12.7 Å²	12.7	13%	0.131	8%	0.079	C	C	.	.			trans	-103.3	140.8	173.9	-59.3	-177.2	0	0	0	110.4	V416 T420 G455 N457 Y461 C500	V416-L459 HydrophobicContact CG2-CB 4Å; V416-L459 HydrophobicContact CG2-CD1 4.1Å; T420-L459 HydrophobicContact CG2-CD2 4.39Å; G455-L459 PolarHBondContact N-O 3.15Å; N457-L459 VanDerWaalsContact C-N 3.29Å; N457-L459 WeakPolarHBondContact ND2-CD1 3.32Å; N457-L459 PolarHBondContact O-N 3.31Å; N457-L459 PolarHBondContact OD1-N 3.35Å; L459-Y461 HydrophobicContact CB-CE2 4.27Å; L459-Y461 WeakPolarHBondContact O-CE2 3.32Å; L459-C500 VanDerWaalsContact C-SG 3.53Å; L459-C500 PolarHBondContact O-SG 2.86Å
460	S	92.6	Very high	90.2	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	144.3	174.3	-47.8	0	0	0	0	110.7	S414 V415 V416 V453 C500	S414-S460 WeakPolarHBondContact O-CA 3.48Å; S414-S460 WeakPolarHBondContact O-CB 3.34Å; S414-S460 PolarHBondContact O-N 3.48Å; S414-S460 PolarHBondContact O-OG 3.28Å; V415-S460 CarbonylContact C-O 3.52Å; V415-S460 WeakPolarHBondContact CA-O 3.41Å; V416-S460 PolarHBondContact N-O 3.36Å; V453-S460 CarbonylContact O-C 3.55Å; V453-S460 WeakPolarHBondContact O-CA 3.34Å; S460-C500 PolarHBondContact OG-N 3.22Å
461	Y	91.4	Very high	90.2	Very high	1 Å²	1	18.6 Å²	18.6	0%	0.004	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	152.3	177.8	-59.4	-97.6	0	0	0	109.5	V416 Y422 P452 V453 N457 L459 S463 A467 C486 I487	V416-Y461 HydrophobicContact CB-CD1 3.84Å; V416-Y461 HydrophobicContact CB-CE1 4Å; V416-Y461 HydrophobicContact CG1-CD1 4.16Å; V416-Y461 HydrophobicContact CG1-CE1 4.11Å; V416-Y461 HydrophobicContact CG2-CD1 4Å; V416-Y461 HydrophobicContact CG2-CE1 3.74Å; Y422-Y461 HydrophobicContact CD1-CE1 4.14Å; Y422-Y461 HydrophobicContact CE1-CD1 4.12Å; Y422-Y461 AromaticContact CE1-CE1 3.94Å; Y422-Y461 HydrophobicContact CE1-CE1 3.94Å; P452-Y461 WeakPolarHBondContact CA-O 3.36Å; V453-Y461 PolarHBondContact N-O 3Å; V453-Y461 PolarHBondContact O-N 2.87Å; N457-Y461 PolarHBondContact ND2-OH 3.42Å; L459-Y461 HydrophobicContact CB-CE2 4.27Å; L459-Y461 WeakPolarHBondContact O-CE2 3.32Å; Y461-S463 VanDerWaalsContact C-N 3.26Å; Y461-S463 PolarHBondContact O-N 3.23Å; Y461-A467 HydrophobicContact CD1-CB 4.03Å; Y461-A467 HydrophobicContact CD2-CB 3.99Å; Y461-A467 HydrophobicContact CG-CB 3.7Å; Y461-C486 HydrophobicContact CE1-CB 4.23Å; Y461-C486 PolarHBondContact OH-O 3.46Å; Y461-I487 HydrophobicContact CE2-CD1 4.21Å; Y461-I487 HydrophobicContact CE2-CG1 3.89Å
462	L	89	Confident	90.2	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	12%	0.124	C	C	.	.	S	Bend	trans	-64.4	-29.5	-179.4	-79.2	82	0	0	0	113.2	V415 V416 I418 W450 D451 L466	V415-L462 HydrophobicContact CG1-CD1 3.83Å; V415-L462 HydrophobicContact CG1-CG 4.41Å; V416-L462 WeakPolarHBondContact O-CD1 3.46Å; I418-L462 HydrophobicContact CD1-CD1 4.07Å; I418-L462 HydrophobicContact CD1-CD2 4.27Å; I418-L462 HydrophobicContact CD1-CG 4.21Å; I418-L462 HydrophobicContact CG1-CD1 4.15Å; W450-L462 HydrophobicContact CE3-CG 4.44Å; W450-L462 HydrophobicContact CZ3-CG 4.38Å; D451-L462 CarbonylContact C-O 3.56Å; D451-L462 WeakPolarHBondContact CA-O 3.48Å; D451-L462 PolarHBondContact N-O 2.96Å; L462-L466 HydrophobicContact CB-CD1 3.68Å
463	S	89.6	Confident	89.9	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.146	C	C	.	.			trans	-156.6	161.5	176.8	67.7	0	0	0	0	111.8	D451 Y461 C465 L466 A467	D451-S463 VanDerWaalsContact O-CA 3.31Å; D451-S463 WeakPolarHBondContact O-CA 3.44Å; Y461-S463 VanDerWaalsContact C-N 3.26Å; Y461-S463 PolarHBondContact O-N 3.23Å; S463-C465 VanDerWaalsContact C-N 3.26Å; S463-C465 PolarHBondContact O-N 3.38Å; S463-L466 PolarHBondContact O-N 3.38Å; S463-L466 WeakPolarHBondContact OG-CG 3.11Å; S463-L466 PolarHBondContact OG-N 3.22Å; S463-L466 VanDerWaalsContact OG-N 3.15Å; S463-A467 PolarHBondContact O-N 3.01Å
464	A	90	Very high	89.5	Confident	1 Å²	1	26.8 Å²	26.8	1%	0.008	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-36.7	172.1	0	0	0	0	0	112.6	V453 A467 G468 C469 F481	V453-A464 HydrophobicContact CG1-CB 4.21Å; A464-A467 PolarHBondContact O-N 3.14Å; A464-G468 PolarHBondContact O-N 3.5Å; A464-C469 HydrophobicContact CB-CB 4.46Å; A464-C469 WeakPolarHBondContact O-CB 3.22Å; A464-C469 PolarHBondContact O-N 2.89Å; A464-C469 PolarHBondContact O-SG 3.16Å; A464-F481 HydrophobicContact CB-CD1 3.58Å; A464-F481 HydrophobicContact CB-CD2 4.16Å; A464-F481 HydrophobicContact CB-CE1 3.58Å; A464-F481 HydrophobicContact CB-CE2 4.17Å; A464-F481 HydrophobicContact CB-CG 3.87Å; A464-F481 HydrophobicContact CB-CZ 3.89Å
465	C	89.3	Confident	88.9	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.02	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-46.7	174.1	-169.7	0	0	0	0	111.6	F130 C445 S463 A467 G468	F130-C465 WeakPolarHBondContact O-CB 3.41Å; F130-C465 PolarHBondContact O-N 3.11Å; C445-C465 VanDerWaalsContact CA-SG 3.53Å; C445-C465 HydrophobicContact CB-CB 3.84Å; C445-C465 WeakPolarHBondContact CB-SG 3.21Å; C445-C465 WeakPolarHBondContact SG-CB 3.4Å; C445-C465 PolarHBondContact SG-O 3.42Å; C445-C465 CovalentContact SG-SG 2.04Å; C445-C465 PolarHBondContact SG-SG 3.46Å; S463-C465 VanDerWaalsContact C-N 3.26Å; S463-C465 PolarHBondContact O-N 3.38Å; C465-A467 PolarHBondContact O-N 3.08Å; C465-G468 WeakPolarHBondContact O-CA 3.36Å; C465-G468 PolarHBondContact O-N 2.86Å
466	L	89.3	Confident	88.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-23.9	179.4	-70.9	169.7	0	0	0	112.7	Y422 V435 F436 N440 C445 L462 S463 G468 C486	Y422-L466 PolarHBondContact OH-O 3.28Å; V435-L466 HydrophobicContact CG1-CD1 3.46Å; V435-L466 VanDerWaalsContact CG1-CD1 3.46Å; V435-L466 HydrophobicContact CG1-CD2 3.71Å; V435-L466 HydrophobicContact CG1-CG 4.2Å; F436-L466 HydrophobicContact CD1-CD2 4.3Å; F436-L466 HydrophobicContact CE1-CD2 4.16Å; N440-L466 PolarHBondContact ND2-O 2.74Å; C445-L466 HydrophobicContact CB-CD2 3.63Å; C445-L466 HydrophobicContact CB-CG 3.96Å; L462-L466 HydrophobicContact CB-CD1 3.68Å; S463-L466 PolarHBondContact O-N 3.38Å; S463-L466 WeakPolarHBondContact OG-CG 3.11Å; S463-L466 PolarHBondContact OG-N 3.22Å; S463-L466 VanDerWaalsContact OG-N 3.15Å; L466-G468 PolarHBondContact O-N 3.48Å; L466-C486 PolarHBondContact O-SG 3.09Å
467	A	90.2	Very high	87.9	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-6.3	166.6	0	0	0	0	0	113.4	V453 Y461 S463 A464 C465 C484 C486 I487	V453-A467 HydrophobicContact CG2-CB 4.09Å; Y461-A467 HydrophobicContact CD1-CB 4.03Å; Y461-A467 HydrophobicContact CD2-CB 3.99Å; Y461-A467 HydrophobicContact CG-CB 3.7Å; S463-A467 PolarHBondContact O-N 3.01Å; A464-A467 PolarHBondContact O-N 3.14Å; C465-A467 PolarHBondContact O-N 3.08Å; A467-C484 WeakPolarHBondContact O-CB 3.49Å; A467-C486 VanDerWaalsContact O-CB 3.29Å; A467-C486 WeakPolarHBondContact O-CB 3.35Å; A467-C486 PolarHBondContact O-N 3.44Å; A467-C486 VanDerWaalsContact O-N 3.16Å; A467-I487 HydrophobicContact CB-CD1 4.47Å
468	G	90.2	Very high	87.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	25.9	178.4	0	0	0	0	0	113.9	A464 C465 L466 C484 S485	A464-G468 PolarHBondContact O-N 3.5Å; C465-G468 WeakPolarHBondContact O-CA 3.36Å; C465-G468 PolarHBondContact O-N 2.86Å; L466-G468 PolarHBondContact O-N 3.48Å; G468-C484 WeakPolarHBondContact O-CA 3.41Å; G468-S485 WeakPolarHBondContact CA-OG 3.3Å; G468-S485 PolarHBondContact O-N 3.14Å
469	C	90.7	Very high	87.6	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	132.2	-176.7	-55.1	0	0	0	0	112.3	L131 C132 A464 F481 C484	L131-C469 WeakPolarHBondContact CA-O 3.11Å; L131-C469 WeakPolarHBondContact CB-O 3.3Å; L131-C469 HydrophobicContact CD2-CB 4.39Å; C132-C469 PolarHBondContact N-O 3.44Å; A464-C469 HydrophobicContact CB-CB 4.46Å; A464-C469 WeakPolarHBondContact O-CB 3.22Å; A464-C469 PolarHBondContact O-N 2.89Å; A464-C469 PolarHBondContact O-SG 3.16Å; C469-F481 HydrophobicContact CB-CB 3.89Å; C469-C484 HydrophobicContact CB-CB 4.08Å; C469-C484 WeakPolarHBondContact CB-SG 3.31Å; C469-C484 WeakPolarHBondContact SG-CB 3.36Å; C469-C484 CovalentContact SG-SG 2.04Å; C469-C484 PolarHBondContact SG-SG 3.22Å
470	E	88.4	Confident	87.6	Confident	106 Å²	106	36.2 Å²	36.2	50%	0.495	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-27	-177	-64.5	176.2	176.9	0	0	113.8	L131 Q482 N483	L131-E470 WeakPolarHBondContact CD1-O 3.28Å; E470-Q482 PolarHBondContact N-O 3.39Å; E470-N483 HydrophobicContact CB-CB 4.22Å; E470-N483 HydrophobicContact CG-CB 4.47Å; E470-N483 PolarHBondContact N-O 3.15Å
471	T	86.9	Confident	87.5	Confident	56 Å²	56	36.3 Å²	36.3	34%	0.344	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	156.4	-174	58.1	0	0	0	0	111.7	F481 Q482	T471-F481 CarbonylContact O-C 3.59Å; T471-F481 WeakPolarHBondContact O-CA 3.37Å; T471-Q482 PolarHBondContact N-O 2.75Å; T471-Q482 PolarHBondContact O-N 3.04Å; T471-Q482 WeakPolarHBondContact OG1-CB 3.22Å; T471-Q482 PolarHBondContact OG1-O 3.39Å
472	S	86.9	Confident	87.5	Confident	44 Å²	44	40 Å²	40	31%	0.308	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.4	175.3	60.4	0	0	0	0	111	M479 V480	S472-M479 VanDerWaalsContact OG-CE 3.27Å; S472-M479 WeakPolarHBondContact OG-CE 3.42Å; S472-V480 CarbonylContact C-O 3.54Å; S472-V480 WeakPolarHBondContact CA-O 3.29Å
473	V	86.8	Confident	87.6	Confident	78 Å²	78	43.6 Å²	43.6	47%	0.473	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	139.6	179.8	-177	0	0	0	0	109.1	M479 V480	V473-M479 WeakPolarHBondContact O-CA 3.11Å; V473-V480 PolarHBondContact N-O 3.15Å; V473-V480 PolarHBondContact O-N 3.02Å
474	G	83.3	Confident	87.6	Confident	55 Å²	55	43.7 Å²	43.7	57%	0.567	25%	0.248	S	C	*	.	S	Bend	trans	94.5	-176.2	-177.6	0	0	0	0	0	113.1
475	M	79.6	Confident	87.7	Confident	138 Å²	138	46.4 Å²	46.4	68%	0.68	27%	0.267	S	S	*	.	S	Bend	trans	-141.6	149.6	-178.3	-175.1	-178.8	-71.1	0	0	109.2	N478	M475-N478 PolarHBondContact O-N 3.34Å
476	G	82	Confident	87.7	Confident	4 Å²	4	46.4 Å²	46.4	4%	0.041	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	58.8	-136.7	177.9	0	0	0	0	0	112.6	L232 N478 M479 L497	L232-G476 CarbonylContact O-C 3.13Å; L232-G476 WeakPolarHBondContact O-CA 3.28Å; G476-N478 PolarHBondContact O-N 2.9Å; G476-M479 VanDerWaalsContact O-CB 3.23Å; G476-M479 WeakPolarHBondContact O-CB 3.19Å; G476-M479 PolarHBondContact O-N 3.49Å; G476-M479 VanDerWaalsContact O-N 3.17Å; G476-L497 VanDerWaalsContact O-CD1 3.27Å; G476-L497 WeakPolarHBondContact O-CD1 3.47Å
477	I	82.9	Confident	87.7	Confident	89 Å²	89	46.7 Å²	46.7	46%	0.456	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.2	-178.1	61.8	173.1	0	0	0	114.3	L232 T235 M479	L232-I477 VanDerWaalsContact O-CG2 3.24Å; L232-I477 WeakPolarHBondContact O-CG2 3.03Å; L232-I477 PolarHBondContact O-N 3.42Å; T235-I477 HydrophobicContact CG2-CG2 4.25Å; I477-M479 VanDerWaalsContact C-N 3.31Å
478	N	84.6	Confident	87.1	Confident	125 Å²	125	54.4 Å²	54.4	67%	0.668	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-94.2	12.7	-179.2	-64	-47.9	0	0	0	112.4	M475 G476	M475-N478 PolarHBondContact O-N 3.34Å; G476-N478 PolarHBondContact O-N 2.9Å
479	M	86.2	Confident	86.4	Confident	13 Å²	13	56.9 Å²	56.9	6%	0.064	32%	0.319	C	S	.	.			trans	-70	129.3	177.8	-168.5	174.8	-174.4	0	0	110.7	V119 F130 S472 V473 G476 I477 F481 L497	V119-M479 HydrophobicContact CG1-CE 4.24Å; V119-M479 HydrophobicContact CG1-SD 4.28Å; V119-M479 HydrophobicContact CG2-CE 4.11Å; V119-M479 HydrophobicContact CG2-SD 4.13Å; F130-M479 HydrophobicContact CE2-CE 3.82Å; F130-M479 HydrophobicContact CZ-CE 4.27Å; S472-M479 VanDerWaalsContact OG-CE 3.27Å; S472-M479 WeakPolarHBondContact OG-CE 3.42Å; V473-M479 WeakPolarHBondContact O-CA 3.11Å; G476-M479 VanDerWaalsContact O-CB 3.23Å; G476-M479 WeakPolarHBondContact O-CB 3.19Å; G476-M479 PolarHBondContact O-N 3.49Å; G476-M479 VanDerWaalsContact O-N 3.17Å; I477-M479 VanDerWaalsContact C-N 3.31Å; M479-F481 HydrophobicContact CE-CE1 3.72Å; M479-F481 HydrophobicContact CE-CZ 3.93Å; M479-F481 HydrophobicContact CG-CZ 4.26Å; M479-F481 HydrophobicContact SD-CE1 4.35Å; M479-F481 HydrophobicContact SD-CZ 3.96Å; M479-L497 HydrophobicContact CB-CD1 3.91Å
480	V	90.2	Very high	85.2	Confident	46 Å²	46	63.7 Å²	63.7	28%	0.279	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.8	178.5	-177.6	0	0	0	0	108.8	S472 V473 V496	S472-V480 CarbonylContact C-O 3.54Å; S472-V480 WeakPolarHBondContact CA-O 3.29Å; V473-V480 PolarHBondContact N-O 3.15Å; V473-V480 PolarHBondContact O-N 3.02Å; V480-V496 HydrophobicContact CG2-CG1 4.36Å
481	F	90.5	Very high	84.4	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.009	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	140.5	175.7	-57.9	-84.8	0	0	0	110.1	F130 L131 V453 A464 C469 T471 M479 S494 A495 L497	F130-F481 HydrophobicContact CD2-CE1 4.3Å; F130-F481 HydrophobicContact CE2-CE1 4.2Å; L131-F481 HydrophobicContact CD2-CD1 3.72Å; L131-F481 HydrophobicContact CD2-CE1 4.03Å; V453-F481 HydrophobicContact CG1-CD2 3.99Å; V453-F481 HydrophobicContact CG1-CE2 3.8Å; A464-F481 HydrophobicContact CB-CD1 3.58Å; A464-F481 HydrophobicContact CB-CD2 4.16Å; A464-F481 HydrophobicContact CB-CE1 3.58Å; A464-F481 HydrophobicContact CB-CE2 4.17Å; A464-F481 HydrophobicContact CB-CG 3.87Å; A464-F481 HydrophobicContact CB-CZ 3.89Å; C469-F481 HydrophobicContact CB-CB 3.89Å; T471-F481 CarbonylContact O-C 3.59Å; T471-F481 WeakPolarHBondContact O-CA 3.37Å; M479-F481 HydrophobicContact CE-CE1 3.72Å; M479-F481 HydrophobicContact CE-CZ 3.93Å; M479-F481 HydrophobicContact CG-CZ 4.26Å; M479-F481 HydrophobicContact SD-CE1 4.35Å; M479-F481 HydrophobicContact SD-CZ 3.96Å; F481-S494 CarbonylContact O-C 3.54Å; F481-S494 WeakPolarHBondContact O-CA 3.49Å; F481-S494 WeakPolarHBondContact O-CB 3.32Å; F481-A495 HydrophobicContact CB-CB 4.33Å; F481-A495 PolarHBondContact N-O 2.88Å; F481-A495 PolarHBondContact O-N 3.09Å; F481-L497 HydrophobicContact CE2-CD2 3.8Å; F481-L497 HydrophobicContact CE2-CG 4.28Å; F481-L497 HydrophobicContact CZ-CD2 4.25Å
482	Q	90.7	Very high	84	Confident	79 Å²	79	65.2 Å²	65.2	37%	0.369	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	160.1	-175.4	-64.5	-176.8	-11.5	0	0	111	E470 T471	E470-Q482 PolarHBondContact N-O 3.39Å; T471-Q482 PolarHBondContact N-O 2.75Å; T471-Q482 PolarHBondContact O-N 3.04Å; T471-Q482 WeakPolarHBondContact OG1-CB 3.22Å; T471-Q482 PolarHBondContact OG1-O 3.39Å
483	N	90.4	Very high	84.1	Confident	77 Å²	77	64.2 Å²	64.2	41%	0.412	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.9	54.8	-176.5	-61.6	-12.7	0	0	0	111.3	E470 S493	E470-N483 HydrophobicContact CB-CB 4.22Å; E470-N483 HydrophobicContact CG-CB 4.47Å; E470-N483 PolarHBondContact N-O 3.15Å; N483-S493 PolarHBondContact N-O 2.92Å
484	C	91.3	Very high	84.3	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	110.7	178.6	-52.2	0	0	0	0	110.2	A467 G468 C469 C486 I487 S493	A467-C484 WeakPolarHBondContact O-CB 3.49Å; G468-C484 WeakPolarHBondContact O-CA 3.41Å; C469-C484 HydrophobicContact CB-CB 4.08Å; C469-C484 WeakPolarHBondContact CB-SG 3.31Å; C469-C484 WeakPolarHBondContact SG-CB 3.36Å; C469-C484 CovalentContact SG-SG 2.04Å; C469-C484 PolarHBondContact SG-SG 3.22Å; C484-C486 VanDerWaalsContact C-N 3.34Å; C484-C486 PolarHBondContact O-N 3.22Å; C484-I487 HydrophobicContact CB-CB 4.19Å; C484-I487 HydrophobicContact CB-CD1 3.41Å; C484-I487 VanDerWaalsContact CB-CD1 3.41Å; C484-I487 HydrophobicContact CB-CG1 3.65Å; C484-I487 PolarHBondContact O-N 2.91Å; C484-S493 PolarHBondContact N-OG 2.86Å; C484-S493 WeakPolarHBondContact O-CB 3.46Å; C484-S493 PolarHBondContact O-OG 3.32Å
485	S	90.4	Very high	84.7	Confident	58 Å²	58	59.7 Å²	59.7	41%	0.406	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-30.3	-174.2	64.5	0	0	0	0	113.8	C439 G468 I487	C439-S485 PolarHBondContact O-OG 2.92Å; G468-S485 WeakPolarHBondContact CA-OG 3.3Å; G468-S485 PolarHBondContact O-N 3.14Å; S485-I487 VanDerWaalsContact C-N 3.3Å; S485-I487 PolarHBondContact O-N 2.8Å
486	C	89.4	Confident	85.3	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.027	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-8.1	-179.1	-62.8	0	0	0	0	113.7	Y422 C439 Y461 L466 A467 C484 Q488	Y422-C486 HydrophobicContact CD1-CB 3.84Å; Y422-C486 HydrophobicContact CE1-CB 3.77Å; C439-C486 HydrophobicContact CB-CB 3.96Å; C439-C486 WeakPolarHBondContact CB-SG 3.5Å; C439-C486 WeakPolarHBondContact SG-CA 3.42Å; C439-C486 WeakPolarHBondContact SG-CB 3.3Å; C439-C486 CovalentContact SG-SG 2.03Å; C439-C486 PolarHBondContact SG-SG 2.92Å; Y461-C486 HydrophobicContact CE1-CB 4.23Å; Y461-C486 PolarHBondContact OH-O 3.46Å; L466-C486 PolarHBondContact O-SG 3.09Å; A467-C486 VanDerWaalsContact O-CB 3.29Å; A467-C486 WeakPolarHBondContact O-CB 3.35Å; A467-C486 PolarHBondContact O-N 3.44Å; A467-C486 VanDerWaalsContact O-N 3.16Å; C484-C486 VanDerWaalsContact C-N 3.34Å; C484-C486 PolarHBondContact O-N 3.22Å; C486-Q488 PolarHBondContact O-N 3.14Å
487	I	90.6	Very high	85.7	Confident	6 Å²	6	57.7 Å²	57.7	3%	0.031	34%	0.338	C	S	.	.			trans	-95.6	91.7	-178.8	-53.1	-177.1	0	0	0	108.8	N456 N457 Y461 A467 C484 S485 T489 A495	N456-I487 WeakPolarHBondContact OD1-CG2 3.35Å; N457-I487 HydrophobicContact CB-CG2 4.1Å; Y461-I487 HydrophobicContact CE2-CD1 4.21Å; Y461-I487 HydrophobicContact CE2-CG1 3.89Å; A467-I487 HydrophobicContact CB-CD1 4.47Å; C484-I487 HydrophobicContact CB-CB 4.19Å; C484-I487 HydrophobicContact CB-CD1 3.41Å; C484-I487 VanDerWaalsContact CB-CD1 3.41Å; C484-I487 HydrophobicContact CB-CG1 3.65Å; C484-I487 PolarHBondContact O-N 2.91Å; S485-I487 VanDerWaalsContact C-N 3.3Å; S485-I487 PolarHBondContact O-N 2.8Å; I487-T489 HydrophobicContact CG2-CG2 4.35Å; I487-T489 PolarHBondContact O-N 3.46Å; I487-A495 HydrophobicContact CD1-CB 3.9Å
488	Q	77.3	Confident	86.1	Confident	161 Å²	161	53.8 Å²	53.8	75%	0.752	32%	0.32	S	S	*	.			trans	-76.4	84.5	-177.9	-62.9	-175.8	5.3	0	0	111.4	C486	C486-Q488 PolarHBondContact O-N 3.14Å
489	T	75.8	Confident	86.4	Confident	52 Å²	52	50.5 Å²	50.5	32%	0.319	30%	0.302	S	S	.	.			trans	-123.6	152.6	170.1	53	0	0	0	0	111	N456 N457 I487 G491	N456-T489 PolarHBondContact ND2-OG1 3.45Å; N456-T489 VanDerWaalsContact OD1-CG2 3.27Å; N456-T489 WeakPolarHBondContact OD1-CG2 3.47Å; N456-T489 PolarHBondContact OD1-OG1 2.92Å; N457-T489 HydrophobicContact CB-CG2 3.78Å; I487-T489 HydrophobicContact CG2-CG2 4.35Å; I487-T489 PolarHBondContact O-N 3.46Å; T489-G491 PolarHBondContact O-N 3.26Å
490	S	64.2	Low	86.6	Confident	143 Å²	143	50.7 Å²	50.7	100%	1	30%	0.304	S	S	*	.	S	Bend	trans	-73.1	12.6	-177.8	32.9	0	0	0	0	114.7
491	G	71.6	Confident	86.4	Confident	52 Å²	52	56 Å²	56	54%	0.536	33%	0.331	S	S	.	.	S	Bend	trans	-140.9	-160.5	-179.9	0	0	0	0	0	112.4	T489 S493	T489-G491 PolarHBondContact O-N 3.26Å; G491-S493 PolarHBondContact O-N 2.81Å
492	N	78.9	Confident	86	Confident	143 Å²	143	58.1 Å²	58.1	77%	0.765	34%	0.34	S	S	*	.			trans	-64.5	109.9	177.1	-74.9	3.2	0	0	0	110.3	N456 S494	N456-N492 PolarHBondContact ND2-O 3.34Å; N456-N492 VanDerWaalsContact ND2-O 3.09Å; N492-S494 PolarHBondContact O-N 3.24Å
493	S	88.7	Confident	85.7	Confident	22 Å²	22	56 Å²	56	15%	0.154	34%	0.341	C	S	.	.			trans	-65.5	119.3	175.4	50.7	0	0	0	0	110	N483 C484 G491	N483-S493 PolarHBondContact N-O 2.92Å; C484-S493 PolarHBondContact N-OG 2.86Å; C484-S493 WeakPolarHBondContact O-CB 3.46Å; C484-S493 PolarHBondContact O-OG 3.32Å; G491-S493 PolarHBondContact O-N 2.81Å
494	S	92	Very high	85.4	Confident	37 Å²	37	57.3 Å²	57.3	26%	0.259	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.3	-179.8	49.6	0	0	0	0	110.8	N456 F481 N492	N456-S494 PolarHBondContact N-O 3.07Å; F481-S494 CarbonylContact O-C 3.54Å; F481-S494 WeakPolarHBondContact O-CA 3.49Å; F481-S494 WeakPolarHBondContact O-CB 3.32Å; N492-S494 PolarHBondContact O-N 3.24Å
495	A	91.9	Very high	85.2	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.008	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	148.4	174.6	0	0	0	0	0	111.1	V453 C454 F481 I487	V453-A495 HydrophobicContact CB-CB 4.09Å; V453-A495 HydrophobicContact CG2-CB 4.06Å; C454-A495 CarbonylContact O-C 3.52Å; C454-A495 WeakPolarHBondContact O-CA 3.17Å; C454-A495 WeakPolarHBondContact O-CB 3.5Å; F481-A495 HydrophobicContact CB-CB 4.33Å; F481-A495 PolarHBondContact N-O 2.88Å; F481-A495 PolarHBondContact O-N 3.09Å; I487-A495 HydrophobicContact CD1-CB 3.9Å
496	V	92.1	Very high	85.2	Confident	71 Å²	71	60.4 Å²	60.4	43%	0.43	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	159.5	176	-61.6	0	0	0	0	110.1	V453 C454 V480	V453-V496 CarbonylContact C-O 3.46Å; V453-V496 VanDerWaalsContact CA-O 3.23Å; V453-V496 WeakPolarHBondContact CA-O 3.5Å; V453-V496 WeakPolarHBondContact CB-O 3.19Å; C454-V496 HydrophobicContact CB-CG2 4Å; C454-V496 PolarHBondContact N-O 3.29Å; C454-V496 PolarHBondContact O-N 3.22Å; V480-V496 HydrophobicContact CG2-CG1 4.36Å
497	L	90.6	Very high	85.2	Confident	30 Å²	30	62.5 Å²	62.5	16%	0.157	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	144.2	179.2	-67.4	163.2	0	0	0	112.1	T233 G476 M479 F481	T233-L497 WeakPolarHBondContact O-CD1 3.44Å; G476-L497 VanDerWaalsContact O-CD1 3.27Å; G476-L497 WeakPolarHBondContact O-CD1 3.47Å; M479-L497 HydrophobicContact CB-CD1 3.91Å; F481-L497 HydrophobicContact CE2-CD2 3.8Å; F481-L497 HydrophobicContact CE2-CG 4.28Å; F481-L497 HydrophobicContact CZ-CD2 4.25Å
498	G	90.3	Very high	85.2	Confident	7 Å²	7	65.7 Å²	65.7	7%	0.072	40%	0.396	C	S	.	.	S	Bend	trans	93.3	178.9	175.2	0	0	0	0	0	114.4	P452 V453 C454	P452-G498 WeakPolarHBondContact O-CA 3.39Å; P452-G498 PolarHBondContact O-N 3.24Å; V453-G498 CarbonylContact C-O 3.12Å; V453-G498 VanDerWaalsContact CA-O 3.32Å; V453-G498 WeakPolarHBondContact CA-O 3.09Å; C454-G498 PolarHBondContact N-O 3.22Å
499	L	90.6	Very high	86	Confident	55 Å²	55	60.7 Å²	60.7	29%	0.288	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-77.5	151.9	174.3	-66.1	171.7	0	0	0	110.4	V415 W450 P452	V415-L499 HydrophobicContact CG2-CD2 3.93Å; W450-L499 HydrophobicContact CZ2-CD2 4.42Å; P452-L499 HydrophobicContact CB-CD2 3.79Å; P452-L499 HydrophobicContact CB-CG 4.24Å; P452-L499 HydrophobicContact CG-CD2 4.39Å; P452-L499 HydrophobicContact CG-CG 4.39Å
500	C	90.1	Very high	86.8	Confident	17 Å²	17	58.6 Å²	58.6	12%	0.115	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-64.4	142	174.1	-64.5	0	0	0	0	112.1	C454 G458 L459 S460	C454-C500 WeakPolarHBondContact CA-SG 3.24Å; C454-C500 HydrophobicContact CB-CB 4Å; C454-C500 WeakPolarHBondContact CB-SG 3.47Å; C454-C500 WeakPolarHBondContact SG-CA 3.42Å; C454-C500 WeakPolarHBondContact SG-CB 3.35Å; C454-C500 CovalentContact SG-SG 2.04Å; C454-C500 PolarHBondContact SG-SG 3.33Å; G458-C500 VanDerWaalsContact C-SG 3.52Å; L459-C500 VanDerWaalsContact C-SG 3.53Å; L459-C500 PolarHBondContact O-SG 2.86Å; S460-C500 PolarHBondContact OG-N 3.22Å
501	D	86.1	Confident	88.2	Confident	157 Å²	157	57.3 Å²	57.3	84%	0.84	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-63.2	138.3	175.2	-77.3	-29.4	0	0	0	111.2	G503	D501-G503 PolarHBondContact O-N 3.27Å
502	K	83.6	Confident	89.3	Confident	47 Å²	47	60.7 Å²	60.7	20%	0.204	34%	0.335	C	S	.	.			trans	-76	12.4	179.5	-58.1	-163.7	-179.6	-168	0	114.6	Q345 Q346 C410 E411 S413 C506	Q345-K502 PolarHBondContact O-NZ 3.23Å; Q345-K502 VanDerWaalsContact O-NZ 3.15Å; Q346-K502 PolarHBondContact O-NZ 3.02Å; C410-K502 WeakPolarHBondContact SG-CD 3.48Å; E411-K502 PolarHBondContact O-NZ 3.24Å; S413-K502 WeakPolarHBondContact OG-CE 3.49Å; K502-C506 HydrophobicContact CB-CB 3.8Å; K502-C506 WeakPolarHBondContact O-CB 3.13Å
503	G	83.6	Confident	90	Very high	36 Å²	36	54.2 Å²	54.2	37%	0.371	30%	0.301	S	S	.	.	H	α-helix	trans	74.6	177.2	177.7	0	0	0	0	0	116.3	D501	D501-G503 PolarHBondContact O-N 3.27Å
504	P	84.1	Confident	90.3	Very high	104 Å²	104	53.3 Å²	53.3	68%	0.675	29%	0.294	S	S	*	.	H	α-helix	trans	-71.8	-32.7	-175.3	27.8	-34	0	0	0	113.4	C506 S507 M508	P504-C506 VanDerWaalsContact C-N 3.28Å; P504-C506 PolarHBondContact O-N 3.12Å; P504-S507 WeakPolarHBondContact O-CB 3.48Å; P504-S507 PolarHBondContact O-N 2.96Å; P504-S507 VanDerWaalsContact O-N 3.08Å; P504-M508 PolarHBondContact O-N 3.5Å; P504-M508 VanDerWaalsContact O-N 3.08Å
505	D	87.3	Confident	90.5	Very high	116 Å²	116	55.3 Å²	55.3	62%	0.62	31%	0.305	S	S	*	.	H	α-helix	trans	-61.4	-38.6	179.9	-65.1	-34.3	0	0	0	111.6	S507 M508 M509	D505-S507 VanDerWaalsContact C-N 3.33Å; D505-S507 PolarHBondContact O-N 3.43Å; D505-M508 WeakPolarHBondContact O-CB 3.17Å; D505-M508 PolarHBondContact O-N 3.22Å; D505-M509 WeakPolarHBondContact O-CG 3.46Å; D505-M509 PolarHBondContact O-N 2.91Å
506	C	89.8	Confident	90.6	Very high	8 Å²	8	56.3 Å²	56.3	5%	0.054	31%	0.31	C	S	.	.	H	α-helix	trans	-63.9	-37.9	175.6	-165.7	0	0	0	0	112.3	C410 K502 P504 M508 M509 L510	C410-C506 HydrophobicContact CB-CB 4.1Å; C410-C506 WeakPolarHBondContact CB-SG 3.33Å; C410-C506 WeakPolarHBondContact SG-CB 3.39Å; C410-C506 CovalentContact SG-SG 2.04Å; C410-C506 PolarHBondContact SG-SG 3.25Å; K502-C506 HydrophobicContact CB-CB 3.8Å; K502-C506 WeakPolarHBondContact O-CB 3.13Å; P504-C506 VanDerWaalsContact C-N 3.28Å; P504-C506 PolarHBondContact O-N 3.12Å; C506-M508 VanDerWaalsContact C-N 3.34Å; C506-M509 PolarHBondContact O-N 2.91Å; C506-L510 PolarHBondContact O-N 3.43Å
507	S	89.7	Confident	90.7	Very high	47 Å²	47	53.7 Å²	53.7	33%	0.329	29%	0.294	S	S	.	.	H	α-helix	trans	-67.3	-36.2	176.3	-67.9	0	0	0	0	111.7	P504 D505 L510 Q511	P504-S507 WeakPolarHBondContact O-CB 3.48Å; P504-S507 PolarHBondContact O-N 2.96Å; P504-S507 VanDerWaalsContact O-N 3.08Å; D505-S507 VanDerWaalsContact C-N 3.33Å; D505-S507 PolarHBondContact O-N 3.43Å; S507-L510 PolarHBondContact O-N 3.3Å; S507-Q511 WeakPolarHBondContact O-CG 3.34Å; S507-Q511 PolarHBondContact O-N 3.16Å; S507-Q511 VanDerWaalsContact O-N 3.13Å
508	M	91.3	Very high	90.9	Very high	74 Å²	74	53 Å²	53	37%	0.365	29%	0.293	S	S	.	.	H	α-helix	trans	-66.2	-43.8	173	-172.8	178.7	64.4	0	0	111.6	P504 D505 C506 L510 Q511 Y512	P504-M508 PolarHBondContact O-N 3.5Å; P504-M508 VanDerWaalsContact O-N 3.08Å; D505-M508 WeakPolarHBondContact O-CB 3.17Å; D505-M508 PolarHBondContact O-N 3.22Å; C506-M508 VanDerWaalsContact C-N 3.34Å; M508-L510 VanDerWaalsContact C-N 3.33Å; M508-L510 PolarHBondContact O-N 3.03Å; M508-Q511 WeakPolarHBondContact O-CB 3.28Å; M508-Q511 PolarHBondContact O-N 3.22Å; M508-Q511 VanDerWaalsContact O-N 3.15Å; M508-Y512 HydrophobicContact CE-CE2 4.2Å; M508-Y512 HydrophobicContact CG-CD2 4.28Å; M508-Y512 HydrophobicContact CG-CE2 3.64Å; M508-Y512 PolarHBondContact O-N 3.01Å; M508-Y512 HydrophobicContact SD-CE2 4.05Å
509	M	92.9	Very high	91.1	Very high	56 Å²	56	57.5 Å²	57.5	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-62.6	-38.3	176.1	-69.1	-62.3	169.5	0	0	112.5	Y347 L408 D505 C506 Y512 F513	Y347-M509 HydrophobicContact CE1-CB 4.26Å; L408-M509 HydrophobicContact CD2-SD 4.32Å; D505-M509 WeakPolarHBondContact O-CG 3.46Å; D505-M509 PolarHBondContact O-N 2.91Å; C506-M509 PolarHBondContact O-N 2.91Å; M509-Y512 PolarHBondContact O-N 3Å; M509-Y512 HydrophobicContact SD-CD2 4.19Å; M509-F513 WeakPolarHBondContact O-CB 3.37Å; M509-F513 PolarHBondContact O-N 2.9Å
510	L	93.4	Very high	91.3	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.037	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-45.6	172.1	174	62	0	0	0	111.4	I343 Y347 K349 L357 C506 S507 M508 Y512 F513 L514	I343-L510 HydrophobicContact CG2-CD1 4.13Å; Y347-L510 HydrophobicContact CD1-CB 3.66Å; Y347-L510 HydrophobicContact CD1-CD1 4.29Å; Y347-L510 HydrophobicContact CD2-CD1 3.61Å; Y347-L510 HydrophobicContact CE1-CB 4.03Å; Y347-L510 HydrophobicContact CE2-CD1 3.93Å; Y347-L510 HydrophobicContact CG-CB 3.94Å; Y347-L510 HydrophobicContact CG-CD1 3.8Å; Y347-L510 HydrophobicContact CG-CG 4.31Å; K349-L510 HydrophobicContact CD-CD2 4.21Å; K349-L510 HydrophobicContact CG-CD2 3.72Å; L357-L510 HydrophobicContact CD1-CD2 4.28Å; C506-L510 PolarHBondContact O-N 3.43Å; S507-L510 PolarHBondContact O-N 3.3Å; M508-L510 VanDerWaalsContact C-N 3.33Å; M508-L510 PolarHBondContact O-N 3.03Å; L510-Y512 VanDerWaalsContact C-N 3.35Å; L510-Y512 PolarHBondContact O-N 3.36Å; L510-F513 WeakPolarHBondContact O-CB 3.29Å; L510-F513 PolarHBondContact O-N 3.43Å; L510-F513 VanDerWaalsContact O-N 3.15Å; L510-L514 HydrophobicContact CD1-CD1 4.16Å; L510-L514 HydrophobicContact CD1-CG 4.11Å; L510-L514 HydrophobicContact CG-CD1 4.09Å; L510-L514 HydrophobicContact CG-CG 4.46Å; L510-L514 WeakPolarHBondContact O-CG 3.43Å; L510-L514 PolarHBondContact O-N 2.77Å
511	Q	93.3	Very high	91.4	Very high	116 Å²	116	55.4 Å²	55.4	54%	0.542	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-43.7	177.9	-73.2	-176.6	-2.6	0	0	111.8	S507 M508 F513 L514 V515	S507-Q511 WeakPolarHBondContact O-CG 3.34Å; S507-Q511 PolarHBondContact O-N 3.16Å; S507-Q511 VanDerWaalsContact O-N 3.13Å; M508-Q511 WeakPolarHBondContact O-CB 3.28Å; M508-Q511 PolarHBondContact O-N 3.22Å; M508-Q511 VanDerWaalsContact O-N 3.15Å; Q511-F513 VanDerWaalsContact C-N 3.3Å; Q511-F513 PolarHBondContact O-N 2.74Å; Q511-L514 PolarHBondContact O-N 2.88Å; Q511-V515 WeakPolarHBondContact O-CG2 3.25Å; Q511-V515 PolarHBondContact O-N 2.94Å
512	Y	94.3	Very high	91.8	Very high	123 Å²	123	50.6 Å²	50.6	48%	0.482	28%	0.275	S	S	.	.	H	α-helix	trans	-61.4	-39.3	174.2	-65.1	-32.8	0	0	0	112.4	M508 M509 L510 V515 L516	M508-Y512 HydrophobicContact CE-CE2 4.2Å; M508-Y512 HydrophobicContact CG-CD2 4.28Å; M508-Y512 HydrophobicContact CG-CE2 3.64Å; M508-Y512 PolarHBondContact O-N 3.01Å; M508-Y512 HydrophobicContact SD-CE2 4.05Å; M509-Y512 PolarHBondContact O-N 3Å; M509-Y512 HydrophobicContact SD-CD2 4.19Å; L510-Y512 VanDerWaalsContact C-N 3.35Å; L510-Y512 PolarHBondContact O-N 3.36Å; Y512-V515 PolarHBondContact O-N 3.03Å; Y512-L516 WeakPolarHBondContact O-CB 3.31Å; Y512-L516 PolarHBondContact O-N 2.81Å
513	F	94.8	Very high	92.3	Very high	8 Å²	8	49 Å²	49	4%	0.035	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-42.2	176.9	175.4	-95.4	0	0	0	111.9	M339 Y342 I343 Y347 L408 M509 L510 Q511 L516 S517	M339-F513 HydrophobicContact CE-CE1 4Å; M339-F513 HydrophobicContact CE-CZ 4.43Å; Y342-F513 HydrophobicContact CD1-CE1 4.47Å; Y342-F513 HydrophobicContact CD1-CZ 4.11Å; Y342-F513 HydrophobicContact CE1-CE1 4.15Å; Y342-F513 AromaticContact CE1-CE2 3.87Å; Y342-F513 HydrophobicContact CE1-CE2 3.87Å; Y342-F513 AromaticContact CE1-CZ 3.62Å; Y342-F513 HydrophobicContact CE1-CZ 3.62Å; I343-F513 HydrophobicContact CG1-CE1 4.45Å; Y347-F513 HydrophobicContact CE2-CD1 4.16Å; Y347-F513 HydrophobicContact CE2-CG 4.27Å; Y347-F513 WeakPolarHBondContact OH-CB 3.42Å; Y347-F513 WeakPolarHBondContact OH-CG 3.46Å; L408-F513 HydrophobicContact CB-CB 4.28Å; L408-F513 VanDerWaalsContact CD1-CA 3.44Å; L408-F513 HydrophobicContact CD1-CB 3.92Å; L408-F513 HydrophobicContact CD1-CD2 4.43Å; M509-F513 WeakPolarHBondContact O-CB 3.37Å; M509-F513 PolarHBondContact O-N 2.9Å; L510-F513 WeakPolarHBondContact O-CB 3.29Å; L510-F513 PolarHBondContact O-N 3.43Å; L510-F513 VanDerWaalsContact O-N 3.15Å; Q511-F513 VanDerWaalsContact C-N 3.3Å; Q511-F513 PolarHBondContact O-N 2.74Å; F513-L516 PolarHBondContact O-N 3.4Å; F513-S517 VanDerWaalsContact O-CB 3.28Å; F513-S517 WeakPolarHBondContact O-CB 3.38Å; F513-S517 PolarHBondContact O-N 2.88Å
514	L	94.6	Very high	92.7	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-66.5	-41.3	177.7	-68.2	171.8	0	0	0	112.4	I343 L357 Y361 L510 Q511 S517 A518	I343-L514 HydrophobicContact CD1-CD2 4.46Å; L357-L514 HydrophobicContact CB-CD1 4.13Å; L357-L514 HydrophobicContact CB-CD2 4.19Å; L357-L514 HydrophobicContact CD1-CD1 4.1Å; L357-L514 HydrophobicContact CD2-CD1 4.01Å; L357-L514 HydrophobicContact CG-CD1 4.3Å; Y361-L514 HydrophobicContact CD1-CB 3.71Å; Y361-L514 HydrophobicContact CD2-CB 4.4Å; Y361-L514 HydrophobicContact CD2-CD1 4.25Å; Y361-L514 HydrophobicContact CE1-CB 3.93Å; Y361-L514 HydrophobicContact CE2-CD1 4.15Å; Y361-L514 HydrophobicContact CG-CB 3.95Å; L510-L514 HydrophobicContact CD1-CD1 4.16Å; L510-L514 HydrophobicContact CD1-CG 4.11Å; L510-L514 HydrophobicContact CG-CD1 4.09Å; L510-L514 HydrophobicContact CG-CG 4.46Å; L510-L514 WeakPolarHBondContact O-CG 3.43Å; L510-L514 PolarHBondContact O-N 2.77Å; Q511-L514 PolarHBondContact O-N 2.88Å; L514-S517 PolarHBondContact O-N 3.4Å; L514-A518 WeakPolarHBondContact O-CB 3.2Å; L514-A518 PolarHBondContact O-N 3.44Å
515	V	95.2	Very high	93	Very high	79 Å²	79	45.4 Å²	45.4	48%	0.479	23%	0.231	S	C	.	.	H	α-helix	trans	-63.2	-45.1	174.8	172.2	0	0	0	0	110.6	Y361 Q511 Y512 S517 A518 M519	Y361-V515 HydrophobicContact CE1-CG2 4.47Å; Q511-V515 WeakPolarHBondContact O-CG2 3.25Å; Q511-V515 PolarHBondContact O-N 2.94Å; Y512-V515 PolarHBondContact O-N 3.03Å; V515-S517 VanDerWaalsContact C-N 3.35Å; V515-S517 PolarHBondContact O-N 3.42Å; V515-A518 PolarHBondContact O-N 2.89Å; V515-M519 WeakPolarHBondContact O-CG 3.22Å; V515-M519 PolarHBondContact O-N 3.36Å
516	L	94.9	Very high	93.1	Very high	22 Å²	22	41.1 Å²	41.1	12%	0.115	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-40.5	176.7	-179.1	63.7	0	0	0	112.1	L401 L404 S405 L408 Y512 F513 M519 S520	L401-L516 HydrophobicContact CB-CD1 4.36Å; L401-L516 HydrophobicContact CD2-CD1 4.5Å; L404-L516 HydrophobicContact CB-CD1 4.39Å; L404-L516 HydrophobicContact CB-CD2 3.67Å; L404-L516 HydrophobicContact CD1-CD1 4.27Å; S405-L516 VanDerWaalsContact OG-CD2 3.32Å; S405-L516 WeakPolarHBondContact OG-CD2 3.43Å; L408-L516 HydrophobicContact CD1-CB 4.31Å; L408-L516 HydrophobicContact CD1-CD2 3.73Å; Y512-L516 WeakPolarHBondContact O-CB 3.31Å; Y512-L516 PolarHBondContact O-N 2.81Å; F513-L516 PolarHBondContact O-N 3.4Å; L516-M519 PolarHBondContact O-N 3.34Å; L516-S520 WeakPolarHBondContact O-CB 3.5Å; L516-S520 PolarHBondContact O-N 3.38Å; L516-S520 PolarHBondContact O-OG 3.09Å
517	S	93.8	Very high	93.1	Very high	15 Å²	15	41.3 Å²	41.3	11%	0.105	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-42	175	178.2	0	0	0	0	111.9	N362 F513 L514 V515 S520 S521	N362-S517 VanDerWaalsContact CG-OG 3.3Å; N362-S517 PolarHBondContact ND2-OG 2.96Å; N362-S517 VanDerWaalsContact ND2-OG 3.15Å; N362-S517 PolarHBondContact OD1-OG 3.26Å; F513-S517 VanDerWaalsContact O-CB 3.28Å; F513-S517 WeakPolarHBondContact O-CB 3.38Å; F513-S517 PolarHBondContact O-N 2.88Å; L514-S517 PolarHBondContact O-N 3.4Å; V515-S517 VanDerWaalsContact C-N 3.35Å; V515-S517 PolarHBondContact O-N 3.42Å; S517-S520 PolarHBondContact O-N 3.13Å; S517-S521 VanDerWaalsContact O-CB 3.3Å; S517-S521 WeakPolarHBondContact O-CB 3.37Å; S517-S521 PolarHBondContact O-N 2.93Å; S517-S521 PolarHBondContact O-OG 2.8Å
518	A	95.1	Very high	93	Very high	16 Å²	16	40.4 Å²	40.4	13%	0.132	21%	0.205	C	C	.	.	H	α-helix	trans	-62.4	-45	176.4	0	0	0	0	0	111.8	Y361 P365 L514 V515 S521 F522	Y361-A518 WeakPolarHBondContact O-CB 3.2Å; P365-A518 HydrophobicContact CG-CB 4.15Å; L514-A518 WeakPolarHBondContact O-CB 3.2Å; L514-A518 PolarHBondContact O-N 3.44Å; V515-A518 PolarHBondContact O-N 2.89Å; A518-S521 PolarHBondContact O-N 2.85Å; A518-F522 PolarHBondContact O-N 3.07Å
519	M	95.3	Very high	92.5	Very high	102 Å²	102	38.7 Å²	38.7	50%	0.502	20%	0.197	S	C	.	.	H	α-helix	trans	-63.2	-43.6	175.7	-67.7	-55.6	-63	0	0	112.1	V515 L516 F522 I523	V515-M519 WeakPolarHBondContact O-CG 3.22Å; V515-M519 PolarHBondContact O-N 3.36Å; L516-M519 PolarHBondContact O-N 3.34Å; M519-F522 WeakPolarHBondContact O-CB 3.18Å; M519-F522 PolarHBondContact O-N 3.03Å; M519-I523 WeakPolarHBondContact O-CG1 3.42Å; M519-I523 PolarHBondContact O-N 3.43Å
520	S	94	Very high	92.1	Very high	9 Å²	9	36.2 Å²	36.2	6%	0.063	19%	0.185	C	C	.	.	H	α-helix	trans	-63.2	-42.7	177.4	-56.9	0	0	0	0	111.3	L516 S517 F522 I523 Y524	L516-S520 WeakPolarHBondContact O-CB 3.5Å; L516-S520 PolarHBondContact O-N 3.38Å; L516-S520 PolarHBondContact O-OG 3.09Å; S517-S520 PolarHBondContact O-N 3.13Å; S520-F522 VanDerWaalsContact C-N 3.34Å; S520-F522 PolarHBondContact O-N 3.19Å; S520-I523 PolarHBondContact O-N 3.13Å; S520-Y524 VanDerWaalsContact O-CB 3.32Å; S520-Y524 WeakPolarHBondContact O-CB 2.97Å; S520-Y524 PolarHBondContact O-N 3.36Å
521	S	93	Very high	91.6	Very high	18 Å²	18	37 Å²	37	13%	0.126	20%	0.196	C	C	.	.	H	α-helix	trans	-62.8	-38	177.4	-59.9	0	0	0	0	112.5	S517 A518 S525	S517-S521 VanDerWaalsContact O-CB 3.3Å; S517-S521 WeakPolarHBondContact O-CB 3.37Å; S517-S521 PolarHBondContact O-N 2.93Å; S517-S521 PolarHBondContact O-OG 2.8Å; A518-S521 PolarHBondContact O-N 2.85Å; S521-S525 PolarHBondContact O-N 3.44Å; S521-S525 VanDerWaalsContact O-N 3.08Å; S521-S525 PolarHBondContact O-OG 3.3Å
522	F	94.4	Very high	90.9	Very high	56 Å²	56	37.1 Å²	37.1	25%	0.246	19%	0.192	C	C	.	.	H	α-helix	trans	-63.8	-47.8	172.8	178.5	-104.9	0	0	0	112.3	P365 I368 I372 A518 M519 S520 S525 L526	P365-F522 HydrophobicContact CB-CB 4Å; I368-F522 HydrophobicContact CB-CE2 4.49Å; I368-F522 HydrophobicContact CG2-CE2 3.99Å; I372-F522 HydrophobicContact CD1-CE2 4.08Å; I372-F522 HydrophobicContact CD1-CZ 4.12Å; A518-F522 PolarHBondContact O-N 3.07Å; M519-F522 WeakPolarHBondContact O-CB 3.18Å; M519-F522 PolarHBondContact O-N 3.03Å; S520-F522 VanDerWaalsContact C-N 3.34Å; S520-F522 PolarHBondContact O-N 3.19Å; F522-S525 PolarHBondContact O-N 2.82Å; F522-S525 PolarHBondContact O-OG 3.42Å; F522-L526 WeakPolarHBondContact O-CB 3.38Å; F522-L526 PolarHBondContact O-N 3.07Å
523	I	94.3	Very high	90.1	Very high	15 Å²	15	33.7 Å²	33.7	8%	0.077	18%	0.181	C	C	.	.	H	α-helix	trans	-67.5	-39.6	-179	-62.1	164.1	0	0	0	110.7	L394 L397 E398 L401 M519 S520 L526 A527	L394-I523 HydrophobicContact CB-CG2 4.28Å; L394-I523 HydrophobicContact CD2-CG2 4.31Å; L394-I523 WeakPolarHBondContact O-CG2 3.45Å; L397-I523 HydrophobicContact CD2-CD1 4.14Å; L397-I523 HydrophobicContact CG-CD1 4.32Å; E398-I523 HydrophobicContact CB-CB 4.12Å; E398-I523 HydrophobicContact CB-CG2 3.73Å; E398-I523 HydrophobicContact CG-CB 4.47Å; L401-I523 HydrophobicContact CD1-CD1 3.29Å; M519-I523 WeakPolarHBondContact O-CG1 3.42Å; M519-I523 PolarHBondContact O-N 3.43Å; S520-I523 PolarHBondContact O-N 3.13Å; I523-L526 WeakPolarHBondContact O-CB 3.45Å; I523-L526 PolarHBondContact O-N 3.31Å; I523-A527 PolarHBondContact O-N 2.9Å
524	Y	91.4	Very high	89.5	Confident	64 Å²	64	33.7 Å²	33.7	25%	0.251	18%	0.181	S	C	.	.	H	α-helix	trans	-58.7	-49.8	175.5	176.9	-98.9	0	0	0	112	F332 S520 L526 A527 A528	F332-Y524 HydrophobicContact CD2-CE1 4.21Å; F332-Y524 AromaticContact CD2-CZ 3.98Å; F332-Y524 AromaticContact CE2-CE1 3.85Å; F332-Y524 HydrophobicContact CE2-CE1 3.85Å; S520-Y524 VanDerWaalsContact O-CB 3.32Å; S520-Y524 WeakPolarHBondContact O-CB 2.97Å; S520-Y524 PolarHBondContact O-N 3.36Å; Y524-L526 VanDerWaalsContact C-N 3.3Å; Y524-L526 PolarHBondContact O-N 3.44Å; Y524-A527 PolarHBondContact O-N 3.06Å; Y524-A527 VanDerWaalsContact O-N 3.13Å; Y524-A528 PolarHBondContact O-N 2.74Å
525	S	89.9	Confident	88.8	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.7	-33.3	178.1	52	0	0	0	0	112.7	I366 G369 S521 F522 A528	I366-S525 WeakPolarHBondContact O-CB 3.2Å; I366-S525 PolarHBondContact O-OG 2.92Å; G369-S525 WeakPolarHBondContact CA-OG 3.18Å; S521-S525 PolarHBondContact O-N 3.44Å; S521-S525 VanDerWaalsContact O-N 3.08Å; S521-S525 PolarHBondContact O-OG 3.3Å; F522-S525 PolarHBondContact O-N 2.82Å; F522-S525 PolarHBondContact O-OG 3.42Å; S525-A528 PolarHBondContact O-N 3.35Å
526	L	90.6	Very high	87.9	Confident	26 Å²	26	31.9 Å²	31.9	14%	0.136	17%	0.169	C	C	.	.	H	α-helix	trans	-64.7	-38.2	172.4	-166.5	70.1	0	0	0	112.5	I372 I376 L394 F522 I523 Y524 P530	I372-L526 HydrophobicContact CB-CD1 4.35Å; I372-L526 HydrophobicContact CG2-CD1 3.9Å; I376-L526 HydrophobicContact CD1-CD1 4.15Å; L394-L526 HydrophobicContact CD1-CB 4.33Å; L394-L526 HydrophobicContact CD1-CD2 3.83Å; L394-L526 HydrophobicContact CD1-CG 3.86Å; L394-L526 HydrophobicContact CD2-CD2 4.09Å; F522-L526 WeakPolarHBondContact O-CB 3.38Å; F522-L526 PolarHBondContact O-N 3.07Å; I523-L526 WeakPolarHBondContact O-CB 3.45Å; I523-L526 PolarHBondContact O-N 3.31Å; Y524-L526 VanDerWaalsContact C-N 3.3Å; Y524-L526 PolarHBondContact O-N 3.44Å; L526-P530 WeakPolarHBondContact O-CD 3.33Å
527	A	89.8	Confident	87.1	Confident	12 Å²	12	35.6 Å²	35.6	10%	0.099	18%	0.181	C	C	.	.	H	α-helix	trans	-75.7	-27.9	178.9	0	0	0	0	0	113.5	L394 I523 Y524 I529 P530 G531	L394-A527 HydrophobicContact CB-CB 3.77Å; L394-A527 HydrophobicContact CD1-CB 4.44Å; I523-A527 PolarHBondContact O-N 2.9Å; Y524-A527 PolarHBondContact O-N 3.06Å; Y524-A527 VanDerWaalsContact O-N 3.13Å; A527-I529 PolarHBondContact O-N 3.03Å; A527-P530 WeakPolarHBondContact O-CD 3.45Å; A527-G531 PolarHBondContact O-N 3.06Å; A527-G531 VanDerWaalsContact O-N 3.16Å
528	A	85.9	Confident	86.2	Confident	28 Å²	28	35.2 Å²	35.2	23%	0.231	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-42.1	-175	0	0	0	0	0	113.3	Y370 Y524 S525 G531 Y532	Y370-A528 HydrophobicContact CE1-CB 3.7Å; Y524-A528 PolarHBondContact O-N 2.74Å; S525-A528 PolarHBondContact O-N 3.35Å; A528-G531 PolarHBondContact O-N 2.65Å; A528-Y532 WeakPolarHBondContact O-CB 3.41Å; A528-Y532 PolarHBondContact O-N 3.45Å
529	I	82.5	Confident	85.4	Confident	38 Å²	38	34.7 Å²	34.7	20%	0.195	17%	0.173	C	C	.	.	H	α-helix	trans	-66.7	-51.2	-178.5	-66.6	173.8	0	0	0	112.1	Y370 G374 M377 A527 G531 Y532 M533	Y370-I529 HydrophobicContact CD1-CD1 3.96Å; Y370-I529 HydrophobicContact CD1-CG1 3.89Å; Y370-I529 HydrophobicContact CE1-CG1 4.43Å; Y370-I529 WeakPolarHBondContact O-CD1 3.26Å; G374-I529 VanDerWaalsContact N-CD1 3.27Å; M377-I529 HydrophobicContact CG-CG2 4.03Å; A527-I529 PolarHBondContact O-N 3.03Å; I529-G531 VanDerWaalsContact C-N 3.26Å; I529-G531 PolarHBondContact O-N 3.29Å; I529-Y532 PolarHBondContact O-N 3.49Å; I529-M533 HydrophobicContact CG2-CG 4.42Å; I529-M533 WeakPolarHBondContact O-CB 3.33Å; I529-M533 WeakPolarHBondContact O-CG 3.28Å; I529-M533 PolarHBondContact O-N 3.11Å
530	P	83.8	Confident	84.3	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-53.4	-42.9	172	-26.7	32.8	0	0	0	112.8	M377 A387 I390 L526 A527 M533 V534	M377-P530 HydrophobicContact CG-CG 4.48Å; M377-P530 HydrophobicContact SD-CB 4.39Å; M377-P530 HydrophobicContact SD-CG 4.12Å; A387-P530 HydrophobicContact CB-CB 4.27Å; A387-P530 WeakPolarHBondContact O-CB 3.19Å; I390-P530 HydrophobicContact CG2-CG 4.32Å; L526-P530 WeakPolarHBondContact O-CD 3.33Å; A527-P530 WeakPolarHBondContact O-CD 3.45Å; P530-M533 PolarHBondContact O-N 3.42Å; P530-V534 WeakPolarHBondContact O-CG2 3.37Å; P530-V534 PolarHBondContact O-N 3.19Å; P530-V534 VanDerWaalsContact O-N 3.09Å
531	G	82.3	Confident	82.9	Confident	24 Å²	24	38.6 Å²	38.6	25%	0.247	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-48.4	177.2	0	0	0	0	0	112.9	F321 A527 A528 I529 M533 V534 L535	F321-G531 WeakPolarHBondContact CZ-O 3.13Å; A527-G531 PolarHBondContact O-N 3.06Å; A527-G531 VanDerWaalsContact O-N 3.16Å; A528-G531 PolarHBondContact O-N 2.65Å; I529-G531 VanDerWaalsContact C-N 3.26Å; I529-G531 PolarHBondContact O-N 3.29Å; G531-M533 VanDerWaalsContact C-N 3.31Å; G531-M533 PolarHBondContact O-N 3.03Å; G531-V534 WeakPolarHBondContact O-CB 3.14Å; G531-V534 PolarHBondContact O-N 3.46Å; G531-L535 PolarHBondContact O-N 3.41Å
532	Y	80.1	Confident	81.5	Confident	117 Å²	117	45.4 Å²	45.4	46%	0.459	23%	0.228	S	C	.	.	H	α-helix	trans	-64	-35.8	177.5	-169.7	-108.2	0	0	0	112.6	A528 I529 V534 L535 L536	A528-Y532 WeakPolarHBondContact O-CB 3.41Å; A528-Y532 PolarHBondContact O-N 3.45Å; I529-Y532 PolarHBondContact O-N 3.49Å; Y532-V534 VanDerWaalsContact C-N 3.33Å; Y532-V534 PolarHBondContact O-N 3.12Å; Y532-L535 HydrophobicContact CD2-CD2 4.28Å; Y532-L535 HydrophobicContact CE2-CD2 4.25Å; Y532-L535 WeakPolarHBondContact O-CB 3.23Å; Y532-L535 PolarHBondContact O-N 3.47Å; Y532-L536 HydrophobicContact CD1-CD1 3.96Å; Y532-L536 HydrophobicContact CD1-CG 4.35Å; Y532-L536 HydrophobicContact CE1-CD1 3.57Å; Y532-L536 HydrophobicContact CE1-CD2 4.46Å; Y532-L536 HydrophobicContact CE1-CG 4.03Å; Y532-L536 PolarHBondContact O-N 3.48Å; Y532-L536 VanDerWaalsContact O-N 3.08Å
533	M	77.5	Confident	80.3	Confident	51 Å²	51	43.1 Å²	43.1	25%	0.251	22%	0.219	S	C	.	.	H	α-helix	trans	-66.7	-32.8	175.4	-73.7	-61.2	-60.6	0	0	113.1	M377 I529 P530 G531 R537	M377-M533 HydrophobicContact CE-CB 4.1Å; M377-M533 HydrophobicContact CE-CG 4.03Å; I529-M533 HydrophobicContact CG2-CG 4.42Å; I529-M533 WeakPolarHBondContact O-CB 3.33Å; I529-M533 WeakPolarHBondContact O-CG 3.28Å; I529-M533 PolarHBondContact O-N 3.11Å; P530-M533 PolarHBondContact O-N 3.42Å; G531-M533 VanDerWaalsContact C-N 3.31Å; G531-M533 PolarHBondContact O-N 3.03Å; M533-R537 WeakPolarHBondContact O-CB 3.42Å; M533-R537 WeakPolarHBondContact O-CG 3.33Å; M533-R537 PolarHBondContact O-N 3.32Å; M533-R537 VanDerWaalsContact O-N 3.15Å
534	V	80.6	Confident	79.1	Confident	9 Å²	9	45.9 Å²	45.9	6%	0.055	23%	0.23	C	C	.	.	H	α-helix	trans	-65.5	-43.2	173.5	172.1	0	0	0	0	110.6	F321 V384 A387 A388 P530 G531 Y532 R537 C538	F321-V534 HydrophobicContact CE2-CG1 4.48Å; V384-V534 HydrophobicContact CG1-CG2 4.24Å; A387-V534 HydrophobicContact CB-CG2 4.32Å; A388-V534 HydrophobicContact CB-CG2 3.87Å; P530-V534 WeakPolarHBondContact O-CG2 3.37Å; P530-V534 PolarHBondContact O-N 3.19Å; P530-V534 VanDerWaalsContact O-N 3.09Å; G531-V534 WeakPolarHBondContact O-CB 3.14Å; G531-V534 PolarHBondContact O-N 3.46Å; Y532-V534 VanDerWaalsContact C-N 3.33Å; Y532-V534 PolarHBondContact O-N 3.12Å; V534-R537 PolarHBondContact O-N 3Å; V534-C538 PolarHBondContact O-N 2.93Å; V534-C538 VanDerWaalsContact O-N 3.09Å
535	L	81.7	Confident	77.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-56.6	-52.4	174.2	174.3	62.8	0	0	0	111.5	Y318 F321 G531 Y532 R537 C538 M539	Y318-L535 HydrophobicContact CD2-CD1 4.07Å; Y318-L535 HydrophobicContact CE2-CD1 3.93Å; F321-L535 HydrophobicContact CD1-CB 4.17Å; F321-L535 HydrophobicContact CD1-CD1 3.66Å; F321-L535 HydrophobicContact CD1-CG 4.32Å; F321-L535 HydrophobicContact CE1-CB 3.65Å; F321-L535 HydrophobicContact CE1-CD1 3.86Å; F321-L535 HydrophobicContact CE1-CD2 3.94Å; F321-L535 HydrophobicContact CE1-CG 4.01Å; F321-L535 HydrophobicContact CE2-CB 4.3Å; F321-L535 HydrophobicContact CG-CD1 4.38Å; F321-L535 HydrophobicContact CZ-CB 3.72Å; G531-L535 PolarHBondContact O-N 3.41Å; Y532-L535 HydrophobicContact CD2-CD2 4.28Å; Y532-L535 HydrophobicContact CE2-CD2 4.25Å; Y532-L535 WeakPolarHBondContact O-CB 3.23Å; Y532-L535 PolarHBondContact O-N 3.47Å; L535-R537 VanDerWaalsContact C-N 3.26Å; L535-R537 PolarHBondContact O-N 3.45Å; L535-C538 PolarHBondContact O-N 3.06Å; L535-C538 PolarHBondContact O-SG 3.12Å; L535-M539 HydrophobicContact CD1-CE 3.99Å; L535-M539 HydrophobicContact CG-CE 4.03Å; L535-M539 WeakPolarHBondContact O-CE 3.49Å
536	L	74.9	Confident	77	Confident	43 Å²	43	50 Å²	50	23%	0.225	26%	0.264	C	S	.	.	H	α-helix	trans	-63.9	-31.4	-177.2	-70	-179.8	0	0	0	113.2	Y532 K544 V548	Y532-L536 HydrophobicContact CD1-CD1 3.96Å; Y532-L536 HydrophobicContact CD1-CG 4.35Å; Y532-L536 HydrophobicContact CE1-CD1 3.57Å; Y532-L536 HydrophobicContact CE1-CD2 4.46Å; Y532-L536 HydrophobicContact CE1-CG 4.03Å; Y532-L536 PolarHBondContact O-N 3.48Å; Y532-L536 VanDerWaalsContact O-N 3.08Å; L536-K544 WeakPolarHBondContact O-CE 3.04Å; L536-V548 HydrophobicContact CD2-CG2 3.78Å
537	R	78.1	Confident	76.3	Confident	99 Å²	99	48.8 Å²	48.8	37%	0.374	26%	0.258	S	S	.	.	H	α-helix	trans	-91.7	-8.3	-175.7	-67.8	-175	176.1	175.6	-2.6	114.2	I382 V384 M533 V534 L535 M539	I382-R537 PolarHBondContact O-NH1 2.96Å; V384-R537 HydrophobicContact CG1-CB 4.14Å; V384-R537 HydrophobicContact CG2-CB 3.92Å; V384-R537 HydrophobicContact CG2-CG 4.26Å; M533-R537 WeakPolarHBondContact O-CB 3.42Å; M533-R537 WeakPolarHBondContact O-CG 3.33Å; M533-R537 PolarHBondContact O-N 3.32Å; M533-R537 VanDerWaalsContact O-N 3.15Å; V534-R537 PolarHBondContact O-N 3Å; L535-R537 VanDerWaalsContact C-N 3.26Å; L535-R537 PolarHBondContact O-N 3.45Å; R537-M539 VanDerWaalsContact C-N 3.31Å
538	C	74.8	Confident	75.7	Confident	7 Å²	7	49.9 Å²	49.9	5%	0.047	26%	0.263	C	S	.	.	S	Bend	trans	-85.4	-4.5	173.3	74.1	0	0	0	0	113.7	N315 I317 V534 L535 L628	N315-C538 PolarHBondContact ND2-O 3.36Å; N315-C538 VanDerWaalsContact ND2-O 3.11Å; I317-C538 HydrophobicContact CG2-CB 4.04Å; V534-C538 PolarHBondContact O-N 2.93Å; V534-C538 VanDerWaalsContact O-N 3.09Å; L535-C538 PolarHBondContact O-N 3.06Å; L535-C538 PolarHBondContact O-SG 3.12Å; C538-L628 HydrophobicContact CB-CD2 4.39Å
539	M	77.9	Confident	75.2	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.025	27%	0.271	C	S	.	.	S	Bend	trans	-111.9	146.6	-179.8	-60.5	-178.6	-78	0	0	111.4	L312 Y318 L535 R537 K544 V548	L312-M539 HydrophobicContact CD2-CG 4.12Å; L312-M539 HydrophobicContact CD2-SD 4.05Å; Y318-M539 HydrophobicContact CD2-CG 3.97Å; Y318-M539 HydrophobicContact CD2-SD 3.81Å; Y318-M539 HydrophobicContact CE2-CE 4.47Å; Y318-M539 HydrophobicContact CE2-CG 4.32Å; Y318-M539 HydrophobicContact CE2-SD 3.53Å; Y318-M539 VanDerWaalsContact CE2-SD 3.53Å; L535-M539 HydrophobicContact CD1-CE 3.99Å; L535-M539 HydrophobicContact CG-CE 4.03Å; L535-M539 WeakPolarHBondContact O-CE 3.49Å; R537-M539 VanDerWaalsContact C-N 3.31Å; M539-K544 HydrophobicContact CB-CG 4.1Å; M539-V548 HydrophobicContact CE-CG2 4.24Å
540	K	72.6	Confident	75.1	Confident	98 Å²	98	50 Å²	50	43%	0.426	27%	0.269	S	S	.	.			trans	-63.6	149.6	171.2	-64.6	176	-174.8	167.1	0	109.7	E542 E543 K544	K540-E542 PolarHBondContact O-N 3.03Å; K540-E542 VanDerWaalsContact O-N 3.1Å; K540-E543 HydrophobicContact CB-CB 4.48Å; K540-E543 HydrophobicContact CB-CG 4.3Å; K540-E543 PolarHBondContact O-N 3.06Å; K540-K544 WeakPolarHBondContact O-CG 3.38Å; K540-K544 PolarHBondContact O-N 3.35Å
541	S	64.8	Low	75.2	Confident	96 Å²	96	51.1 Å²	51.1	67%	0.671	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-30.6	-176.1	-154.1	0	0	0	0	113.5	E543	S541-E543 VanDerWaalsContact C-N 3.35Å
542	E	64.9	Low	75.2	Confident	160 Å²	160	51.9 Å²	51.9	75%	0.748	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-23.2	177.7	-64.7	163.8	-164	0	0	113	K540	K540-E542 PolarHBondContact O-N 3.03Å; K540-E542 VanDerWaalsContact O-N 3.1Å
543	E	68.7	Low	75.4	Confident	9 Å²	9	50.3 Å²	50.3	4%	0.042	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-10.7	-174.7	-64.4	171.9	161.6	0	0	113.2	F308 S311 L312 K540 S541 S545 L546 G547	F308-E543 HydrophobicContact CD1-CG 3.78Å; F308-E543 HydrophobicContact CE1-CG 4.26Å; S311-E543 WeakPolarHBondContact CB-OE1 3.47Å; S311-E543 PolarHBondContact OG-OE1 2.96Å; L312-E543 HydrophobicContact CD2-CB 4.22Å; L312-E543 HydrophobicContact CG-CB 4.47Å; K540-E543 HydrophobicContact CB-CB 4.48Å; K540-E543 HydrophobicContact CB-CG 4.3Å; K540-E543 PolarHBondContact O-N 3.06Å; S541-E543 VanDerWaalsContact C-N 3.35Å; E543-S545 PolarHBondContact O-N 3.16Å; E543-L546 PolarHBondContact O-N 3.09Å; E543-G547 PolarHBondContact O-N 2.74Å
544	K	69.2	Low	75.9	Confident	73 Å²	73	48.7 Å²	48.7	32%	0.317	26%	0.263	S	S	.	.	H	α-helix	trans	-57.4	-46.5	-171.6	-77.9	172.6	-172.6	166.2	0	114	L536 M539 K540 G547 V548	L536-K544 WeakPolarHBondContact O-CE 3.04Å; M539-K544 HydrophobicContact CB-CG 4.1Å; K540-K544 WeakPolarHBondContact O-CG 3.38Å; K540-K544 PolarHBondContact O-N 3.35Å; K544-G547 PolarHBondContact O-N 3.37Å; K544-V548 WeakPolarHBondContact O-CG2 3.34Å; K544-V548 PolarHBondContact O-N 2.9Å
545	S	65.6	Low	76.4	Confident	104 Å²	104	48.7 Å²	48.7	73%	0.727	26%	0.263	S	S	*	.	H	α-helix	trans	-63.4	-47.1	-178	174.6	0	0	0	0	111.2	E543 G547 V548 G549	E543-S545 PolarHBondContact O-N 3.16Å; S545-G547 PolarHBondContact O-N 3.15Å; S545-V548 PolarHBondContact O-N 3.3Å; S545-G549 PolarHBondContact O-N 2.7Å
546	L	70.4	Confident	76.7	Confident	47 Å²	47	51.3 Å²	51.3	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-42.3	176.1	-180	63.2	0	0	0	111.5	F305 F308 M309 L312 E543 G549 L550	F305-L546 HydrophobicContact CD2-CD1 4.17Å; F305-L546 HydrophobicContact CD2-CD2 4.5Å; F305-L546 HydrophobicContact CE2-CD1 3.62Å; F308-L546 HydrophobicContact CB-CD2 3.65Å; M309-L546 HydrophobicContact CG-CD2 4.25Å; M309-L546 HydrophobicContact SD-CD1 4.17Å; M309-L546 HydrophobicContact SD-CD2 4.19Å; M309-L546 HydrophobicContact SD-CG 4.29Å; L312-L546 HydrophobicContact CD1-CB 4.38Å; L312-L546 HydrophobicContact CD1-CD2 3.97Å; L312-L546 HydrophobicContact CD1-CG 3.97Å; E543-L546 PolarHBondContact O-N 3.09Å; L546-G549 PolarHBondContact O-N 3.36Å; L546-L550 WeakPolarHBondContact O-CB 3.22Å; L546-L550 PolarHBondContact O-N 3.38Å
547	G	76.7	Confident	77.4	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.2	-34.9	179.5	0	0	0	0	0	114.2	Y318 E543 K544 S545 H551	Y318-G547 VanDerWaalsContact OH-CA 3.32Å; Y318-G547 WeakPolarHBondContact OH-CA 3.45Å; Y318-G547 PolarHBondContact OH-O 2.87Å; E543-G547 PolarHBondContact O-N 2.74Å; K544-G547 PolarHBondContact O-N 3.37Å; S545-G547 PolarHBondContact O-N 3.15Å; G547-H551 VanDerWaalsContact O-CB 3.25Å; G547-H551 WeakPolarHBondContact O-CB 3.4Å; G547-H551 PolarHBondContact O-N 3.03Å
548	V	77.1	Confident	78.1	Confident	35 Å²	35	52.6 Å²	52.6	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-67.1	-40.1	170.2	172.4	0	0	0	0	110.7	L536 M539 K544 S545 H551 T552	L536-V548 HydrophobicContact CD2-CG2 3.78Å; M539-V548 HydrophobicContact CE-CG2 4.24Å; K544-V548 WeakPolarHBondContact O-CG2 3.34Å; K544-V548 PolarHBondContact O-N 2.9Å; S545-V548 PolarHBondContact O-N 3.3Å; V548-H551 PolarHBondContact O-N 2.83Å; V548-T552 WeakPolarHBondContact O-CB 3.09Å; V548-T552 PolarHBondContact O-N 3.4Å; V548-T552 PolarHBondContact O-OG1 3.48Å
549	G	74.3	Confident	78.9	Confident	39 Å²	39	52.3 Å²	52.3	40%	0.402	28%	0.281	S	S	.	.	H	α-helix	trans	-61.3	-47.4	175.1	0	0	0	0	0	112.8	S545 L546 T552 F553	S545-G549 PolarHBondContact O-N 2.7Å; L546-G549 PolarHBondContact O-N 3.36Å; G549-T552 PolarHBondContact O-N 2.86Å; G549-F553 WeakPolarHBondContact O-CB 3.39Å; G549-F553 PolarHBondContact O-N 3.37Å
550	L	82.1	Confident	79.4	Confident	28 Å²	28	52.2 Å²	52.2	15%	0.147	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-40.8	177.1	177.7	61.3	0	0	0	112.1	M309 Y318 I322 L546 F553 C554	M309-L550 HydrophobicContact CE-CD1 3.96Å; M309-L550 HydrophobicContact CE-CD2 3.89Å; M309-L550 HydrophobicContact SD-CD2 4.07Å; Y318-L550 HydrophobicContact CE1-CD2 4.02Å; Y318-L550 WeakPolarHBondContact OH-CB 3.5Å; I322-L550 HydrophobicContact CD1-CG 4.4Å; L546-L550 WeakPolarHBondContact O-CB 3.22Å; L546-L550 PolarHBondContact O-N 3.38Å; L550-F553 PolarHBondContact O-N 2.91Å; L550-C554 WeakPolarHBondContact O-CB 3.49Å; L550-C554 PolarHBondContact O-N 3.34Å; L550-C554 PolarHBondContact O-SG 3.29Å; L550-C554 VanDerWaalsContact O-SG 3.32Å
551	H	85.6	Confident	80.2	Confident	29 Å²	29	49.2 Å²	49.2	13%	0.134	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-46.7	174.1	170.1	-87.9	0	0	0	111.7	F321 S325 G547 V548 C554 T555	F321-H551 AromaticContact CE1-NE2 3.92Å; S325-H551 WeakPolarHBondContact CB-NE2 3.06Å; S325-H551 PolarHBondContact OG-NE2 2.84Å; G547-H551 VanDerWaalsContact O-CB 3.25Å; G547-H551 WeakPolarHBondContact O-CB 3.4Å; G547-H551 PolarHBondContact O-N 3.03Å; V548-H551 PolarHBondContact O-N 2.83Å; H551-C554 PolarHBondContact O-N 3.39Å; H551-T555 WeakPolarHBondContact O-CG2 3.33Å; H551-T555 PolarHBondContact O-N 3.39Å; H551-T555 PolarHBondContact O-OG1 3.29Å
552	T	82.1	Confident	81.5	Confident	40 Å²	40	46.8 Å²	46.8	25%	0.245	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-45.9	177	-55.7	0	0	0	0	110.9	V548 G549 C554 T555 R556	V548-T552 WeakPolarHBondContact O-CB 3.09Å; V548-T552 PolarHBondContact O-N 3.4Å; V548-T552 PolarHBondContact O-OG1 3.48Å; G549-T552 PolarHBondContact O-N 2.86Å; T552-C554 PolarHBondContact O-N 3.05Å; T552-T555 WeakPolarHBondContact CA-OG1 3.35Å; T552-T555 PolarHBondContact O-N 3.49Å; T552-T555 PolarHBondContact O-OG1 3.4Å; T552-R556 HydrophobicContact CG2-CG 4.38Å; T552-R556 WeakPolarHBondContact O-CG 3.37Å; T552-R556 PolarHBondContact O-N 3.09Å
553	F	84.1	Confident	82.8	Confident	83 Å²	83	39.1 Å²	39.1	36%	0.364	22%	0.217	S	C	.	.	H	α-helix	trans	-56.4	-51.8	176.4	175.1	-93.3	0	0	0	111.7	L70 G549 L550 T555 R556 V557	L70-F553 HydrophobicContact CD2-CD2 3.53Å; L70-F553 HydrophobicContact CD2-CE2 3.87Å; L70-F553 HydrophobicContact CD2-CG 4.47Å; G549-F553 WeakPolarHBondContact O-CB 3.39Å; G549-F553 PolarHBondContact O-N 3.37Å; L550-F553 PolarHBondContact O-N 2.91Å; F553-T555 PolarHBondContact O-N 3.41Å; F553-R556 PolarHBondContact O-N 2.95Å; F553-V557 HydrophobicContact CD1-CG2 4.4Å; F553-V557 HydrophobicContact CD2-CG2 4.31Å; F553-V557 HydrophobicContact CE1-CG2 4.06Å; F553-V557 HydrophobicContact CE2-CG2 3.97Å; F553-V557 HydrophobicContact CZ-CG2 3.83Å; F553-V557 WeakPolarHBondContact O-CB 3.31Å; F553-V557 VanDerWaalsContact O-CG2 3.31Å; F553-V557 WeakPolarHBondContact O-CG2 3.2Å; F553-V557 PolarHBondContact O-N 3.04Å
554	C	88.8	Confident	83.9	Confident	17 Å²	17	38.8 Å²	38.8	12%	0.115	22%	0.215	C	C	.	.	H	α-helix	trans	-61	-42.8	179.5	-72.5	0	0	0	0	112.3	I322 V326 L550 H551 T552 V557 F558	I322-C554 HydrophobicContact CG2-CB 3.84Å; V326-C554 HydrophobicContact CG2-CB 4.44Å; L550-C554 WeakPolarHBondContact O-CB 3.49Å; L550-C554 PolarHBondContact O-N 3.34Å; L550-C554 PolarHBondContact O-SG 3.29Å; L550-C554 VanDerWaalsContact O-SG 3.32Å; H551-C554 PolarHBondContact O-N 3.39Å; T552-C554 PolarHBondContact O-N 3.05Å; C554-V557 PolarHBondContact O-N 3.39Å; C554-F558 HydrophobicContact CB-CD2 4.2Å; C554-F558 WeakPolarHBondContact O-CB 3.39Å; C554-F558 VanDerWaalsContact O-CD2 3.28Å; C554-F558 WeakPolarHBondContact O-CD2 3.44Å; C554-F558 PolarHBondContact O-N 3.21Å
555	T	89.4	Confident	85	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.055	21%	0.213	C	C	.	.	H	α-helix	trans	-67.4	-37.1	178.9	50.6	0	0	0	0	112.4	V326 H551 T552 F553 A559 G560	V326-T555 HydrophobicContact CG2-CG2 4.23Å; H551-T555 WeakPolarHBondContact O-CG2 3.33Å; H551-T555 PolarHBondContact O-N 3.39Å; H551-T555 PolarHBondContact O-OG1 3.29Å; T552-T555 WeakPolarHBondContact CA-OG1 3.35Å; T552-T555 PolarHBondContact O-N 3.49Å; T552-T555 PolarHBondContact O-OG1 3.4Å; F553-T555 PolarHBondContact O-N 3.41Å; T555-A559 WeakPolarHBondContact O-CA 3.31Å; T555-A559 VanDerWaalsContact O-CB 3.3Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 3.17Å; T555-A559 VanDerWaalsContact O-N 3.1Å; T555-G560 PolarHBondContact O-N 3.07Å
556	R	88.7	Confident	86.4	Confident	56 Å²	56	36.2 Å²	36.2	21%	0.211	19%	0.191	C	C	.	.	I	π-helix	trans	-68.7	-43.3	174.5	-61.9	-36.9	-177.3	101.6	-12.5	112.5	E66 L70 T552 F553 G560 I561	E66-R556 IonicContact OE1-CZ 3.31Å; E66-R556 IonicContact OE1-NE 2.65Å; E66-R556 IonicContact OE1-NH1 3.47Å; E66-R556 PolarHBondContact OE1-NH1 2.91Å; E66-R556 WeakPolarHBondContact OE2-CD 3.36Å; E66-R556 WeakPolarHBondContact OE2-CG 3.26Å; E66-R556 IonicContact OE2-CZ 3.35Å; E66-R556 IonicContact OE2-NE 2.64Å; E66-R556 IonicContact OE2-NH1 3.47Å; E66-R556 PolarHBondContact OE2-NH1 3.3Å; L70-R556 HydrophobicContact CD2-CB 4.3Å; T552-R556 HydrophobicContact CG2-CG 4.38Å; T552-R556 WeakPolarHBondContact O-CG 3.37Å; T552-R556 PolarHBondContact O-N 3.09Å; F553-R556 PolarHBondContact O-N 2.95Å; R556-G560 WeakPolarHBondContact O-CA 3.47Å; R556-G560 PolarHBondContact O-N 3.21Å; R556-G560 VanDerWaalsContact O-N 3.16Å; R556-I561 PolarHBondContact O-N 3.2Å; R556-I561 VanDerWaalsContact O-N 3.13Å
557	V	90.6	Very high	87.4	Confident	46 Å²	46	34 Å²	34	28%	0.279	18%	0.179	S	C	.	.	I	π-helix	trans	-69.6	-49.2	-178.3	172.5	0	0	0	0	112.3	L70 F553 C554 P562	L70-V557 HydrophobicContact CD1-CG2 3.63Å; L70-V557 HydrophobicContact CD2-CG2 4.12Å; F553-V557 HydrophobicContact CD1-CG2 4.4Å; F553-V557 HydrophobicContact CD2-CG2 4.31Å; F553-V557 HydrophobicContact CE1-CG2 4.06Å; F553-V557 HydrophobicContact CE2-CG2 3.97Å; F553-V557 HydrophobicContact CZ-CG2 3.83Å; F553-V557 WeakPolarHBondContact O-CB 3.31Å; F553-V557 VanDerWaalsContact O-CG2 3.31Å; F553-V557 WeakPolarHBondContact O-CG2 3.2Å; F553-V557 PolarHBondContact O-N 3.04Å; C554-V557 PolarHBondContact O-N 3.39Å; V557-P562 VanDerWaalsContact O-CD 3.26Å; V557-P562 WeakPolarHBondContact O-CD 3.38Å
558	F	91.9	Very high	88.1	Confident	124 Å²	124	34 Å²	34	54%	0.544	18%	0.179	S	C	.	.	I	π-helix	trans	-92.9	-14.6	-171.4	-64.4	-65.5	0	0	0	114.5	V326 C554 P562	V326-F558 HydrophobicContact CG1-CB 3.63Å; V326-F558 HydrophobicContact CG2-CB 4.3Å; C554-F558 HydrophobicContact CB-CD2 4.2Å; C554-F558 WeakPolarHBondContact O-CB 3.39Å; C554-F558 VanDerWaalsContact O-CD2 3.28Å; C554-F558 WeakPolarHBondContact O-CD2 3.44Å; C554-F558 PolarHBondContact O-N 3.21Å; F558-P562 WeakPolarHBondContact O-CG 3.34Å
559	A	90.5	Very high	88.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.188	C	C	.	.	I	π-helix	trans	-123.2	-52.4	177.4	0	0	0	0	0	112	V326 F329 N330 T555 I561 A563	V326-A559 HydrophobicContact CG1-CB 4.43Å; V326-A559 WeakPolarHBondContact O-CB 3.42Å; F329-A559 HydrophobicContact CB-CB 4.34Å; F329-A559 HydrophobicContact CD1-CB 3.8Å; N330-A559 HydrophobicContact CB-CB 3.74Å; T555-A559 WeakPolarHBondContact O-CA 3.31Å; T555-A559 VanDerWaalsContact O-CB 3.3Å; T555-A559 WeakPolarHBondContact O-CB 3.35Å; T555-A559 PolarHBondContact O-N 3.17Å; T555-A559 VanDerWaalsContact O-N 3.1Å; A559-I561 PolarHBondContact O-N 2.04Å; A559-A563 WeakPolarHBondContact O-CB 3.39Å; A559-A563 PolarHBondContact O-N 2.59Å
560	G	88.4	Confident	89.8	Confident	4 Å²	4	35.8 Å²	35.8	4%	0.041	19%	0.185	C	C	.	.	I	π-helix	trans	-55	-48.7	-175.6	0	0	0	0	0	114.9	T555 R556 P564	T555-G560 PolarHBondContact O-N 3.07Å; R556-G560 WeakPolarHBondContact O-CA 3.47Å; R556-G560 PolarHBondContact O-N 3.21Å; R556-G560 VanDerWaalsContact O-N 3.16Å; G560-P564 WeakPolarHBondContact O-CD 3.28Å
561	I	90.9	Very high	90.2	Very high	35 Å²	35	34.5 Å²	34.5	18%	0.179	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-55.3	-179.4	-61	167.7	0	0	0	112.9	E66 I67 L70 R556 A559 I565	E66-I561 HydrophobicContact CB-CD1 4.27Å; E66-I561 HydrophobicContact CB-CG1 3.65Å; E66-I561 HydrophobicContact CG-CG1 4.43Å; I67-I561 HydrophobicContact CG1-CD1 3.78Å; I67-I561 HydrophobicContact CG1-CG1 4.2Å; L70-I561 HydrophobicContact CD1-CD1 3.95Å; R556-I561 PolarHBondContact O-N 3.2Å; R556-I561 VanDerWaalsContact O-N 3.13Å; A559-I561 PolarHBondContact O-N 2.04Å; I561-I565 HydrophobicContact CG2-CD1 4.25Å; I561-I565 WeakPolarHBondContact O-CD1 3.34Å; I561-I565 WeakPolarHBondContact O-CG1 3.48Å
562	P	92.1	Very high	90.5	Very high	44 Å²	44	33.8 Å²	33.8	29%	0.286	18%	0.176	S	C	.	.	H	α-helix	trans	-73.1	-31.2	-172.5	27.2	-35.4	0	0	0	113.2	V557 F558 I565 Y566	V557-P562 VanDerWaalsContact O-CD 3.26Å; V557-P562 WeakPolarHBondContact O-CD 3.38Å; F558-P562 WeakPolarHBondContact O-CG 3.34Å; P562-I565 PolarHBondContact O-N 2.78Å; P562-I565 VanDerWaalsContact O-N 3.16Å; P562-Y566 HydrophobicContact CB-CD1 4.48Å; P562-Y566 WeakPolarHBondContact O-CD1 3.43Å; P562-Y566 PolarHBondContact O-N 3.42Å; P562-Y566 VanDerWaalsContact O-N 3.14Å
563	A	91.8	Very high	91	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.9	-52.6	-170.9	0	0	0	0	0	113.7	N330 V333 N334 A559 I565 Y566 F567	N330-A563 WeakPolarHBondContact OD1-CB 3.5Å; V333-A563 HydrophobicContact CB-CB 4.48Å; V333-A563 HydrophobicContact CG1-CB 4.26Å; N334-A563 VanDerWaalsContact OD1-C 3.32Å; N334-A563 WeakPolarHBondContact OD1-CB 3.19Å; N334-A563 PolarHBondContact OD1-O 2.69Å; A559-A563 WeakPolarHBondContact O-CB 3.39Å; A559-A563 PolarHBondContact O-N 2.59Å; A563-I565 VanDerWaalsContact C-N 3.27Å; A563-I565 PolarHBondContact O-N 2.89Å; A563-Y566 VanDerWaalsContact CA-CE1 3.41Å; A563-Y566 HydrophobicContact CB-CE1 4.14Å; A563-F567 WeakPolarHBondContact O-CB 3.46Å; A563-F567 PolarHBondContact O-N 2.82Å; A563-F567 VanDerWaalsContact O-N 3.12Å
564	P	91.4	Very high	91.3	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-31.3	178.1	-22.9	35.3	0	0	0	113.9	G59 N62 V333 F338 G560 G568	G59-P564 WeakPolarHBondContact CA-O 3.18Å; G59-P564 WeakPolarHBondContact O-CB 3.43Å; N62-P564 HydrophobicContact CB-CB 4.48Å; V333-P564 HydrophobicContact CG1-CG 3.73Å; F338-P564 HydrophobicContact CE2-CB 4.46Å; G560-P564 WeakPolarHBondContact O-CD 3.28Å; P564-G568 PolarHBondContact O-N 3.21Å
565	I	93.3	Very high	91.5	Very high	53 Å²	53	32.5 Å²	32.5	27%	0.272	18%	0.178	S	C	.	.	H	α-helix	trans	-70.1	-57	-175.8	-58.3	170.8	0	0	0	110.7	F60 I561 P562 A563 F567 G568 A569	F60-I565 HydrophobicContact CB-CD1 4.32Å; F60-I565 HydrophobicContact CB-CG1 4.09Å; F60-I565 HydrophobicContact CD2-CD1 3.91Å; I561-I565 HydrophobicContact CG2-CD1 4.25Å; I561-I565 WeakPolarHBondContact O-CD1 3.34Å; I561-I565 WeakPolarHBondContact O-CG1 3.48Å; P562-I565 PolarHBondContact O-N 2.78Å; P562-I565 VanDerWaalsContact O-N 3.16Å; A563-I565 VanDerWaalsContact C-N 3.27Å; A563-I565 PolarHBondContact O-N 2.89Å; I565-F567 VanDerWaalsContact C-N 3.3Å; I565-F567 PolarHBondContact O-N 3.03Å; I565-G568 PolarHBondContact O-N 3.01Å; I565-A569 PolarHBondContact O-N 2.76Å
566	Y	93.6	Very high	91.4	Very high	70 Å²	70	33.6 Å²	33.6	28%	0.275	18%	0.183	S	C	.	.	H	α-helix	trans	-71.4	-32.1	-176	80.2	-107.7	0	0	0	110.7	N330 N334 P562 A563 A569 L570 L604	N330-Y566 PolarHBondContact OD1-OH 3.32Å; N334-Y566 PolarHBondContact ND2-OH 3.4Å; N334-Y566 VanDerWaalsContact ND2-OH 3.09Å; P562-Y566 HydrophobicContact CB-CD1 4.48Å; P562-Y566 WeakPolarHBondContact O-CD1 3.43Å; P562-Y566 PolarHBondContact O-N 3.42Å; P562-Y566 VanDerWaalsContact O-N 3.14Å; A563-Y566 VanDerWaalsContact CA-CE1 3.41Å; A563-Y566 HydrophobicContact CB-CE1 4.14Å; Y566-A569 PolarHBondContact O-N 2.99Å; Y566-L570 HydrophobicContact CD2-CD1 4.06Å; Y566-L570 HydrophobicContact CE2-CD1 4.35Å; Y566-L570 WeakPolarHBondContact O-CG 3.21Å; Y566-L570 PolarHBondContact O-N 3.13Å; Y566-L604 HydrophobicContact CE2-CD2 3.61Å
567	F	91.4	Very high	91.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-68.6	-41.5	175.5	-163.2	-93.7	0	0	0	111.4	N334 F338 A563 I565 A569 L570 M571 I600 Y601 L604 P605	N334-F567 HydrophobicContact CB-CD1 4.46Å; N334-F567 HydrophobicContact CB-CD2 3.9Å; N334-F567 HydrophobicContact CB-CE1 4.42Å; N334-F567 HydrophobicContact CB-CE2 3.89Å; N334-F567 HydrophobicContact CB-CG 4.15Å; N334-F567 HydrophobicContact CB-CZ 4.08Å; N334-F567 WeakPolarHBondContact ND2-CD2 3.17Å; F338-F567 HydrophobicContact CB-CD1 4.43Å; F338-F567 HydrophobicContact CB-CE1 3.94Å; F338-F567 AromaticContact CD2-CD1 3.18Å; F338-F567 HydrophobicContact CD2-CD1 3.18Å; F338-F567 AromaticContact CD2-CE1 3.5Å; F338-F567 HydrophobicContact CD2-CE1 3.5Å; F338-F567 HydrophobicContact CD2-CG 4.19Å; F338-F567 HydrophobicContact CE2-CB 4.06Å; F338-F567 AromaticContact CE2-CD1 3.43Å; F338-F567 HydrophobicContact CE2-CD1 3.43Å; F338-F567 VanDerWaalsContact CE2-CD1 3.43Å; F338-F567 HydrophobicContact CE2-CE1 4.22Å; F338-F567 HydrophobicContact CE2-CG 4.14Å; F338-F567 AromaticContact CG-CD1 3.88Å; F338-F567 HydrophobicContact CG-CD1 3.88Å; F338-F567 AromaticContact CG-CE1 3.89Å; F338-F567 HydrophobicContact CG-CE1 3.89Å; F338-F567 HydrophobicContact CZ-CD1 4.29Å; A563-F567 WeakPolarHBondContact O-CB 3.46Å; A563-F567 PolarHBondContact O-N 2.82Å; A563-F567 VanDerWaalsContact O-N 3.12Å; I565-F567 VanDerWaalsContact C-N 3.3Å; I565-F567 PolarHBondContact O-N 3.03Å; F567-A569 VanDerWaalsContact C-N 3.3Å; F567-A569 PolarHBondContact O-N 3.34Å; F567-L570 PolarHBondContact O-N 3.06Å; F567-M571 HydrophobicContact CD1-CG 4.05Å; F567-M571 HydrophobicContact CD1-SD 3.47Å; F567-M571 WeakPolarHBondContact CD1-SD 3.33Å; F567-M571 HydrophobicContact CE1-CG 4.14Å; F567-M571 HydrophobicContact CE1-SD 3.59Å; F567-M571 VanDerWaalsContact CE1-SD 3.59Å; F567-M571 WeakPolarHBondContact O-CG 3.28Å; F567-M571 PolarHBondContact O-N 2.86Å; F567-I600 HydrophobicContact CE2-CG2 4.44Å; F567-Y601 AromaticContact CE1-CD2 3.96Å; F567-Y601 HydrophobicContact CE1-CD2 3.96Å; F567-Y601 AromaticContact CZ-CD2 3.78Å; F567-Y601 HydrophobicContact CZ-CD2 3.78Å; F567-Y601 HydrophobicContact CZ-CG 4.44Å; F567-L604 HydrophobicContact CD2-CD2 3.53Å; F567-L604 HydrophobicContact CE2-CB 4.48Å; F567-L604 HydrophobicContact CE2-CD2 3.86Å; F567-P605 HydrophobicContact CE2-CG 4.31Å
568	G	91.6	Very high	91.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.9	-42.7	171.5	0	0	0	0	0	112.3	P564 I565 L570 M571 D572	P564-G568 PolarHBondContact O-N 3.21Å; I565-G568 PolarHBondContact O-N 3.01Å; G568-L570 PolarHBondContact O-N 3.15Å; G568-M571 PolarHBondContact O-N 3.21Å; G568-D572 WeakPolarHBondContact O-CB 3.48Å; G568-D572 VanDerWaalsContact O-CG 3.26Å; G568-D572 PolarHBondContact O-N 2.73Å
569	A	93.2	Very high	90.7	Very high	47 Å²	47	27.9 Å²	27.9	39%	0.388	15%	0.154	S	C	.	.	H	α-helix	trans	-64	-38.1	175.6	0	0	0	0	0	113	I565 Y566 F567 D572 S573	I565-A569 PolarHBondContact O-N 2.76Å; Y566-A569 PolarHBondContact O-N 2.99Å; F567-A569 VanDerWaalsContact C-N 3.3Å; F567-A569 PolarHBondContact O-N 3.34Å; A569-D572 PolarHBondContact O-N 3.11Å; A569-S573 PolarHBondContact O-N 2.96Å; A569-S573 VanDerWaalsContact O-N 3.11Å
570	L	93.9	Very high	90	Very high	66 Å²	66	29.9 Å²	29.9	35%	0.346	17%	0.166	S	C	.	.	H	α-helix	trans	-66	-39.5	174.3	-73.6	172.3	0	0	0	111.7	Y566 F567 G568 S573 I600 L604	Y566-L570 HydrophobicContact CD2-CD1 4.06Å; Y566-L570 HydrophobicContact CE2-CD1 4.35Å; Y566-L570 WeakPolarHBondContact O-CG 3.21Å; Y566-L570 PolarHBondContact O-N 3.13Å; F567-L570 PolarHBondContact O-N 3.06Å; G568-L570 PolarHBondContact O-N 3.15Å; L570-S573 WeakPolarHBondContact O-CB 3.39Å; L570-S573 PolarHBondContact O-N 2.98Å; L570-S573 PolarHBondContact O-OG 3.02Å; L570-I600 HydrophobicContact CB-CD1 4.26Å; L570-I600 HydrophobicContact CB-CG2 3.77Å; L570-I600 HydrophobicContact CD1-CG2 4.42Å; L570-I600 WeakPolarHBondContact O-CD1 3.39Å; L570-L604 HydrophobicContact CD1-CD2 3.68Å
571	M	91.7	Very high	89.1	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-66	-42.9	174.5	-64.9	167.8	84.1	0	0	111.7	T55 F338 K341 F567 G568 S573 T574 Y592 F597	T55-M571 HydrophobicContact CG2-SD 4.17Å; F338-M571 HydrophobicContact CB-CE 3.86Å; F338-M571 HydrophobicContact CB-SD 4.02Å; F338-M571 HydrophobicContact CD1-CE 3.73Å; F338-M571 HydrophobicContact CD1-SD 3.43Å; F338-M571 WeakPolarHBondContact CD1-SD 3.04Å; F338-M571 HydrophobicContact CD2-SD 4.08Å; F338-M571 HydrophobicContact CE1-SD 3.82Å; F338-M571 HydrophobicContact CE2-SD 4.4Å; F338-M571 HydrophobicContact CG-CE 3.95Å; F338-M571 HydrophobicContact CG-SD 3.56Å; F338-M571 VanDerWaalsContact CG-SD 3.56Å; F338-M571 HydrophobicContact CZ-SD 4.27Å; K341-M571 HydrophobicContact CB-CE 4.43Å; K341-M571 HydrophobicContact CD-CE 3.82Å; K341-M571 HydrophobicContact CG-CE 4.22Å; F567-M571 HydrophobicContact CD1-CG 4.05Å; F567-M571 HydrophobicContact CD1-SD 3.47Å; F567-M571 WeakPolarHBondContact CD1-SD 3.33Å; F567-M571 HydrophobicContact CE1-CG 4.14Å; F567-M571 HydrophobicContact CE1-SD 3.59Å; F567-M571 VanDerWaalsContact CE1-SD 3.59Å; F567-M571 WeakPolarHBondContact O-CG 3.28Å; F567-M571 PolarHBondContact O-N 2.86Å; G568-M571 PolarHBondContact O-N 3.21Å; M571-S573 PolarHBondContact O-N 2.99Å; M571-T574 PolarHBondContact O-N 2.79Å; M571-T574 PolarHBondContact O-OG1 2.87Å; M571-T574 VanDerWaalsContact O-OG1 3.04Å; M571-Y592 WeakPolarHBondContact O-CD1 3.03Å; M571-Y592 VanDerWaalsContact O-CE1 3.27Å; M571-Y592 WeakPolarHBondContact O-CE1 3.29Å; M571-F597 HydrophobicContact CB-CE2 4.19Å; M571-F597 HydrophobicContact CE-CD2 4.47Å; M571-F597 HydrophobicContact CE-CE1 3.95Å; M571-F597 HydrophobicContact CE-CE2 3.35Å; M571-F597 HydrophobicContact CE-CZ 3.04Å; M571-F597 HydrophobicContact CG-CE2 4.2Å
572	D	91.6	Very high	88	Confident	14 Å²	14	37 Å²	37	8%	0.075	20%	0.196	C	C	.	.	H	α-helix	trans	-56.9	-32.7	174.8	-74.8	-23.3	0	0	0	111.7	P54 T55 S56 G568 A569 T574 C575 W578	P54-D572 WeakPolarHBondContact CB-OD2 3.4Å; T55-D572 WeakPolarHBondContact CB-OD1 3.49Å; T55-D572 PolarHBondContact N-OD1 2.98Å; T55-D572 PolarHBondContact N-OD2 3.45Å; T55-D572 PolarHBondContact OG1-OD1 3.42Å; S56-D572 PolarHBondContact N-OD2 3.38Å; S56-D572 PolarHBondContact OG-OD2 2.83Å; G568-D572 WeakPolarHBondContact O-CB 3.48Å; G568-D572 VanDerWaalsContact O-CG 3.26Å; G568-D572 PolarHBondContact O-N 2.73Å; A569-D572 PolarHBondContact O-N 3.11Å; D572-T574 PolarHBondContact O-N 3.3Å; D572-C575 VanDerWaalsContact O-CB 3.25Å; D572-C575 WeakPolarHBondContact O-CB 3.17Å; D572-C575 PolarHBondContact O-N 2.91Å; D572-C575 VanDerWaalsContact O-N 3.17Å; D572-W578 HydrophobicContact CB-CH2 3.88Å; D572-W578 WeakPolarHBondContact O-CZ2 3.48Å
573	S	91.8	Very high	86.8	Confident	86 Å²	86	37 Å²	37	60%	0.601	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-17.9	177.1	81.4	0	0	0	0	114.6	A569 L570 M571	A569-S573 PolarHBondContact O-N 2.96Å; A569-S573 VanDerWaalsContact O-N 3.11Å; L570-S573 WeakPolarHBondContact O-CB 3.39Å; L570-S573 PolarHBondContact O-N 2.98Å; L570-S573 PolarHBondContact O-OG 3.02Å; M571-S573 PolarHBondContact O-N 2.99Å
574	T	91.9	Very high	85.6	Confident	8 Å²	8	39.2 Å²	39.2	5%	0.049	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	10.4	177.4	78.1	0	0	0	0	112.7	M571 D572 L576 Y592 D593 T596 I600	M571-T574 PolarHBondContact O-N 2.79Å; M571-T574 PolarHBondContact O-OG1 2.87Å; M571-T574 VanDerWaalsContact O-OG1 3.04Å; D572-T574 PolarHBondContact O-N 3.3Å; T574-L576 PolarHBondContact O-N 3.46Å; T574-Y592 WeakPolarHBondContact O-CA 3.37Å; T574-Y592 WeakPolarHBondContact OG1-CD1 3.02Å; T574-D593 PolarHBondContact O-N 2.82Å; T574-T596 HydrophobicContact CG2-CG2 3.56Å; T574-I600 HydrophobicContact CG2-CD1 3.4Å
575	C	91.2	Very high	84.7	Confident	19 Å²	19	44 Å²	44	13%	0.128	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	127.3	179.1	-173.5	0	0	0	0	111.2	D572 H577 W578 C589 Y592	D572-C575 VanDerWaalsContact O-CB 3.25Å; D572-C575 WeakPolarHBondContact O-CB 3.17Å; D572-C575 PolarHBondContact O-N 2.91Å; D572-C575 VanDerWaalsContact O-N 3.17Å; C575-H577 VanDerWaalsContact SG-C 3.51Å; C575-H577 PolarHBondContact SG-O 2.72Å; C575-H577 VanDerWaalsContact SG-O 3.36Å; C575-W578 HydrophobicContact CB-CD2 4.22Å; C575-W578 HydrophobicContact CB-CH2 4.21Å; C575-W578 HydrophobicContact CB-CZ2 3.6Å; C575-W578 VanDerWaalsContact SG-CD2 3.56Å; C575-W578 VanDerWaalsContact SG-CE2 3.56Å; C575-C589 WeakPolarHBondContact CA-SG 3.36Å; C575-C589 HydrophobicContact CB-CB 3.86Å; C575-C589 WeakPolarHBondContact CB-SG 3.24Å; C575-C589 WeakPolarHBondContact SG-CB 3.45Å; C575-C589 CovalentContact SG-SG 2.02Å; C575-C589 PolarHBondContact SG-SG 3.31Å; C575-Y592 HydrophobicContact CB-CD1 4.34Å; C575-Y592 HydrophobicContact CB-CE1 4.31Å
576	L	88.1	Confident	83.9	Confident	32 Å²	32	45.3 Å²	45.3	17%	0.168	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-34.7	176	-65.7	-179.9	0	0	0	112.1	I418 L429 T574 I591 D593	I418-L576 HydrophobicContact CG2-CB 3.82Å; I418-L576 HydrophobicContact CG2-CD1 4.09Å; I418-L576 HydrophobicContact CG2-CG 4.48Å; L429-L576 HydrophobicContact CD1-CD2 3.9Å; L429-L576 HydrophobicContact CD2-CD2 3.46Å; L429-L576 VanDerWaalsContact CD2-CD2 3.46Å; L429-L576 HydrophobicContact CG-CD2 4.33Å; T574-L576 PolarHBondContact O-N 3.46Å; L576-I591 HydrophobicContact CB-CG2 3.93Å; L576-I591 WeakPolarHBondContact CB-O 3.23Å; L576-I591 PolarHBondContact N-O 3.03Å; L576-D593 HydrophobicContact CD1-CB 4.07Å; L576-D593 HydrophobicContact CD2-CB 4.02Å; L576-D593 HydrophobicContact CG-CB 4.04Å
577	H	87.6	Confident	83.4	Confident	25 Å²	25	42 Å²	42	12%	0.116	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	118.3	178.8	-170.2	80.4	0	0	0	111.3	I418 W450 C575 C589 R590 I591	I418-H577 HydrophobicContact CD1-CB 3.91Å; W450-H577 AromaticContact CE3-CD2 3.42Å; W450-H577 VanDerWaalsContact CE3-CD2 3.42Å; W450-H577 AromaticContact CE3-NE2 3.9Å; W450-H577 HydrophobicContact CZ3-CB 4.39Å; C575-H577 VanDerWaalsContact SG-C 3.51Å; C575-H577 PolarHBondContact SG-O 2.72Å; C575-H577 VanDerWaalsContact SG-O 3.36Å; H577-C589 PolarHBondContact O-SG 3.19Å; H577-R590 PolarHBondContact O-N 3.17Å; H577-I591 HydrophobicContact CB-CG2 3.68Å; H577-I591 PolarHBondContact N-O 2.86Å
578	W	87.2	Confident	83.2	Confident	81 Å²	81	42.1 Å²	42.1	31%	0.307	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	137.1	176.3	-67	94.7	0	0	0	110.3	D572 C575 G587 C589	D572-W578 HydrophobicContact CB-CH2 3.88Å; D572-W578 WeakPolarHBondContact O-CZ2 3.48Å; C575-W578 HydrophobicContact CB-CD2 4.22Å; C575-W578 HydrophobicContact CB-CH2 4.21Å; C575-W578 HydrophobicContact CB-CZ2 3.6Å; C575-W578 VanDerWaalsContact SG-CD2 3.56Å; C575-W578 VanDerWaalsContact SG-CE2 3.56Å; W578-G587 VanDerWaalsContact CZ3-O 3.31Å; W578-G587 WeakPolarHBondContact CZ3-O 3.34Å; W578-C589 HydrophobicContact CE3-CB 4.26Å; W578-C589 HydrophobicContact CZ3-CB 4.31Å
579	G	81.3	Confident	83.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	149.6	165.5	0	0	0	0	0	110.2	G587 A588	G579-G587 PolarHBondContact O-N 3.46Å; G579-A588 WeakPolarHBondContact CA-O 3.43Å; G579-A588 PolarHBondContact N-O 3.36Å
580	T	75.3	Confident	82.9	Confident	41 Å²	41	40.9 Å²	40.9	25%	0.252	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	122.2	-177	-55.6	0	0	0	0	109.5	E116	E116-T580 PolarHBondContact OE1-N 2.84Å
581	L	71	Confident	82.7	Confident	34 Å²	34	38.2 Å²	38.2	18%	0.178	22%	0.217	C	C	.	.			trans	-68	161.4	173	-70.3	161.6	0	0	0	110.6	N52 V153 C583 G584 E585	N52-L581 HydrophobicContact CB-CD2 3.94Å; N52-L581 VanDerWaalsContact ND2-CD2 3.31Å; N52-L581 WeakPolarHBondContact ND2-CD2 3.39Å; V153-L581 HydrophobicContact CG1-CB 3.94Å; V153-L581 HydrophobicContact CG1-CD1 4.21Å; V153-L581 HydrophobicContact CG1-CD2 3.72Å; V153-L581 HydrophobicContact CG1-CG 4.17Å; L581-C583 PolarHBondContact O-N 3.16Å; L581-G584 PolarHBondContact O-N 3.36Å; L581-E585 HydrophobicContact CB-CB 4.48Å; L581-E585 WeakPolarHBondContact CB-O 3.45Å; L581-E585 HydrophobicContact CD1-CB 3.86Å; L581-E585 PolarHBondContact N-O 2.9Å
582	K	66.4	Low	82.6	Confident	155 Å²	155	38.3 Å²	38.3	67%	0.674	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.7	179.3	-66.5	-175.8	176.7	-178.5	0	113.6	E114 V153	E114-K582 WeakPolarHBondContact OE2-CE 3.49Å; E114-K582 IonicContact OE2-NZ 3.7Å; E114-K582 PolarHBondContact OE2-NZ 3.02Å; V153-K582 HydrophobicContact CG2-CB 3.92Å
583	C	67.9	Low	82.5	Confident	43 Å²	43	38.7 Å²	38.7	29%	0.291	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	6.8	177.8	-41.9	0	0	0	0	114.7	C149 V153 L581	C149-C583 HydrophobicContact CB-CB 4.15Å; C149-C583 WeakPolarHBondContact CB-SG 3.39Å; C149-C583 PolarHBondContact O-SG 2.9Å; C149-C583 WeakPolarHBondContact SG-CA 3.26Å; C149-C583 WeakPolarHBondContact SG-CB 3.18Å; C149-C583 CovalentContact SG-SG 2.04Å; C149-C583 PolarHBondContact SG-SG 3.01Å; V153-C583 WeakPolarHBondContact CG2-SG 3.39Å; L581-C583 PolarHBondContact O-N 3.16Å
584	G	66.7	Low	82.3	Confident	47 Å²	47	34.9 Å²	34.9	49%	0.485	19%	0.193	S	C	.	.	S	Bend	trans	84.5	1.3	178.8	0	0	0	0	0	116	L581	L581-G584 PolarHBondContact O-N 3.36Å
585	E	72.1	Confident	82.1	Confident	101 Å²	101	37.1 Å²	37.1	47%	0.472	21%	0.207	S	C	.	.			trans	-74.4	152	170.8	-69.3	-169.8	162.2	0	0	111.5	L581	L581-E585 HydrophobicContact CB-CB 4.48Å; L581-E585 WeakPolarHBondContact CB-O 3.45Å; L581-E585 HydrophobicContact CD1-CB 3.86Å; L581-E585 PolarHBondContact N-O 2.9Å
586	S	76.4	Confident	82.1	Confident	82 Å²	82	39.3 Å²	39.3	57%	0.573	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	132	175.9	-58.5	0	0	0	0	111.6
587	G	83.1	Confident	82.3	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.01	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	-136.6	176.9	0	0	0	0	0	113.6	N52 W578 G579	N52-G587 CarbonylContact O-C 3.2Å; N52-G587 WeakPolarHBondContact O-CA 3.03Å; N52-G587 WeakPolarHBondContact OD1-CA 3.09Å; W578-G587 VanDerWaalsContact CZ3-O 3.31Å; W578-G587 WeakPolarHBondContact CZ3-O 3.34Å; G579-G587 PolarHBondContact O-N 3.46Å
588	A	86.3	Confident	82.5	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	146.1	171.5	0	0	0	0	0	110.9	E48 N52 G579	E48-A588 HydrophobicContact CG-CB 4.12Å; N52-A588 PolarHBondContact O-N 3.01Å; N52-A588 WeakPolarHBondContact OD1-CB 3.35Å; N52-A588 PolarHBondContact OD1-N 2.77Å; G579-A588 WeakPolarHBondContact CA-O 3.43Å; G579-A588 PolarHBondContact N-O 3.36Å
589	C	90.4	Very high	82.7	Confident	12 Å²	12	40 Å²	40	8%	0.081	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	137.8	179.1	-171.1	0	0	0	0	111.4	C575 H577 W578 I591 Y592	C575-C589 WeakPolarHBondContact CA-SG 3.36Å; C575-C589 HydrophobicContact CB-CB 3.86Å; C575-C589 WeakPolarHBondContact CB-SG 3.24Å; C575-C589 WeakPolarHBondContact SG-CB 3.45Å; C575-C589 CovalentContact SG-SG 2.02Å; C575-C589 PolarHBondContact SG-SG 3.31Å; H577-C589 PolarHBondContact O-SG 3.19Å; W578-C589 HydrophobicContact CE3-CB 4.26Å; W578-C589 HydrophobicContact CZ3-CB 4.31Å; C589-I591 PolarHBondContact SG-O 2.88Å; C589-Y592 HydrophobicContact CB-CD2 4.45Å; C589-Y592 HydrophobicContact CB-CE1 3.78Å; C589-Y592 HydrophobicContact CB-CE2 3.69Å; C589-Y592 VanDerWaalsContact CB-OH 3.27Å; C589-Y592 WeakPolarHBondContact CB-OH 3.39Å
590	R	88.6	Confident	83.3	Confident	9 Å²	9	41.2 Å²	41.2	3%	0.034	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-38.3	179	-57.8	-59.5	-172.5	-168.3	-2.9	112.6	E116 T239 W450 H577	E116-R590 IonicContact OE1-CZ 3.99Å; E116-R590 IonicContact OE1-NE 2.74Å; E116-R590 IonicContact OE1-NH2 3.68Å; E116-R590 PolarHBondContact OE1-NH2 2.99Å; T239-R590 WeakPolarHBondContact CG2-O 3.32Å; W450-R590 HydrophobicContact CB-CG 4.09Å; W450-R590 HydrophobicContact CD2-CB 3.69Å; W450-R590 HydrophobicContact CD2-CG 4.05Å; W450-R590 HydrophobicContact CE3-CB 4.25Å; W450-R590 HydrophobicContact CG-CB 3.88Å; W450-R590 HydrophobicContact CG-CG 3.7Å; W450-R590 HydrophobicContact CZ2-CB 4.14Å; H577-R590 PolarHBondContact O-N 3.17Å
591	I	89.1	Confident	84.1	Confident	10 Å²	10	39.6 Å²	39.6	5%	0.051	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	136.3	179	-166.9	170.5	0	0	0	110.9	V415 I418 W450 L576 H577 C589	V415-I591 HydrophobicContact CB-CD1 4.5Å; V415-I591 HydrophobicContact CG2-CD1 3.54Å; I418-I591 HydrophobicContact CD1-CG2 4.22Å; W450-I591 HydrophobicContact CH2-CB 3.88Å; W450-I591 HydrophobicContact CH2-CD1 4.19Å; W450-I591 HydrophobicContact CH2-CG2 3.82Å; W450-I591 HydrophobicContact CZ2-CB 4.29Å; W450-I591 HydrophobicContact CZ3-CG2 4.09Å; L576-I591 HydrophobicContact CB-CG2 3.93Å; L576-I591 WeakPolarHBondContact CB-O 3.23Å; L576-I591 PolarHBondContact N-O 3.03Å; H577-I591 HydrophobicContact CB-CG2 3.68Å; H577-I591 PolarHBondContact N-O 2.86Å; C589-I591 PolarHBondContact SG-O 2.88Å
592	Y	90.3	Very high	85.2	Confident	4 Å²	4	38 Å²	38	2%	0.016	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	155.9	179.1	-64.4	-95.1	0	0	0	110.4	E48 T55 K341 Q345 M571 T574 C575 C589 S594 F597	E48-Y592 PolarHBondContact OE1-OH 3.06Å; T55-Y592 PolarHBondContact OG1-OH 2.92Å; K341-Y592 VanDerWaalsContact CE-OH 3.3Å; K341-Y592 WeakPolarHBondContact CE-OH 3.42Å; K341-Y592 PolarHBondContact NZ-OH 3.31Å; Q345-Y592 HydrophobicContact CG-CD2 3.99Å; M571-Y592 WeakPolarHBondContact O-CD1 3.03Å; M571-Y592 VanDerWaalsContact O-CE1 3.27Å; M571-Y592 WeakPolarHBondContact O-CE1 3.29Å; T574-Y592 WeakPolarHBondContact O-CA 3.37Å; T574-Y592 WeakPolarHBondContact OG1-CD1 3.02Å; C575-Y592 HydrophobicContact CB-CD1 4.34Å; C575-Y592 HydrophobicContact CB-CE1 4.31Å; C589-Y592 HydrophobicContact CB-CD2 4.45Å; C589-Y592 HydrophobicContact CB-CE1 3.78Å; C589-Y592 HydrophobicContact CB-CE2 3.69Å; C589-Y592 VanDerWaalsContact CB-OH 3.27Å; C589-Y592 WeakPolarHBondContact CB-OH 3.39Å; Y592-S594 PolarHBondContact O-N 2.04Å; Y592-S594 VanDerWaalsContact O-N 3.14Å; Y592-F597 AromaticContact CD1-CD2 3.92Å; Y592-F597 HydrophobicContact CD1-CD2 3.92Å; Y592-F597 HydrophobicContact CD1-CE2 4.13Å; Y592-F597 HydrophobicContact CD2-CE2 4.47Å; Y592-F597 HydrophobicContact CE1-CE2 4.45Å; Y592-F597 AromaticContact CG-CD2 3.94Å; Y592-F597 HydrophobicContact CG-CD2 3.94Å; Y592-F597 HydrophobicContact CG-CE2 4.12Å
593	D	89.7	Confident	86.6	Confident	22 Å²	22	31.8 Å²	31.8	12%	0.118	19%	0.186	C	C	.	.			trans	-73	103.5	164.1	171.4	24.8	0	0	0	108.9	N412 T574 L576 T595 T596 F597	N412-D593 PolarHBondContact ND2-OD1 3.15Å; T574-D593 PolarHBondContact O-N 2.82Å; L576-D593 HydrophobicContact CD1-CB 4.07Å; L576-D593 HydrophobicContact CD2-CB 4.02Å; L576-D593 HydrophobicContact CG-CB 4.04Å; D593-T595 PolarHBondContact O-N 3.3Å; D593-T595 VanDerWaalsContact O-N 3.15Å; D593-T595 PolarHBondContact OD1-N 3.45Å; D593-T595 VanDerWaalsContact OD1-N 3.09Å; D593-T596 PolarHBondContact O-N 3.15Å; D593-T596 VanDerWaalsContact OD2-CB 3.25Å; D593-T596 WeakPolarHBondContact OD2-CB 3.04Å; D593-T596 PolarHBondContact OD2-N 3.4Å; D593-T596 PolarHBondContact OD2-OG1 3.04Å; D593-F597 WeakPolarHBondContact O-CB 3.43Å; D593-F597 PolarHBondContact O-N 3.13Å
594	S	87.6	Confident	87.8	Confident	6 Å²	6	31.8 Å²	31.8	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-26.1	-176.5	-39.3	0	0	0	0	112.8	Q346 N412 Y592 R598	Q346-S594 PolarHBondContact OE1-O 2.85Å; N412-S594 WeakPolarHBondContact OD1-CB 3.37Å; N412-S594 PolarHBondContact OD1-OG 3.25Å; Y592-S594 PolarHBondContact O-N 2.04Å; Y592-S594 VanDerWaalsContact O-N 3.14Å; S594-R598 WeakPolarHBondContact O-CB 3.35Å; S594-R598 PolarHBondContact O-N 3.22Å
595	T	88.8	Confident	89	Confident	55 Å²	55	29.6 Å²	29.6	34%	0.337	16%	0.16	S	C	.	.	H	α-helix	trans	-69.7	-57	179	-62.4	0	0	0	0	110.8	D593 F597 R598 Y599	D593-T595 PolarHBondContact O-N 3.3Å; D593-T595 VanDerWaalsContact O-N 3.15Å; D593-T595 PolarHBondContact OD1-N 3.45Å; D593-T595 VanDerWaalsContact OD1-N 3.09Å; T595-F597 VanDerWaalsContact C-N 3.31Å; T595-F597 PolarHBondContact O-N 2.99Å; T595-R598 PolarHBondContact O-N 3.43Å; T595-Y599 HydrophobicContact CG2-CD2 4.04Å; T595-Y599 HydrophobicContact CG2-CE2 3.68Å; T595-Y599 WeakPolarHBondContact O-CD2 3.48Å; T595-Y599 PolarHBondContact O-N 2.94Å; T595-Y599 VanDerWaalsContact O-N 3.14Å
596	T	90.2	Very high	90.1	Very high	64 Å²	64	25 Å²	25	39%	0.393	14%	0.139	S	C	.	.	H	α-helix	trans	-63.6	-40.3	177.5	-54.1	0	0	0	0	110.9	T574 D593 R598 Y599 I600	T574-T596 HydrophobicContact CG2-CG2 3.56Å; D593-T596 PolarHBondContact O-N 3.15Å; D593-T596 VanDerWaalsContact OD2-CB 3.25Å; D593-T596 WeakPolarHBondContact OD2-CB 3.04Å; D593-T596 PolarHBondContact OD2-N 3.4Å; D593-T596 PolarHBondContact OD2-OG1 3.04Å; T596-R598 VanDerWaalsContact C-N 3.32Å; T596-R598 PolarHBondContact O-N 3.36Å; T596-Y599 PolarHBondContact O-N 3.43Å; T596-Y599 VanDerWaalsContact O-N 3.17Å; T596-I600 HydrophobicContact CG2-CD1 4.25Å; T596-I600 WeakPolarHBondContact O-CG1 3.5Å; T596-I600 PolarHBondContact O-N 3.44Å
597	F	91.4	Very high	91	Very high	2 Å²	2	24 Å²	24	1%	0.009	14%	0.136	C	C	.	.	H	α-helix	trans	-57.1	-44.1	175.7	-172	-76.3	0	0	0	111.7	K341 Y342 Q345 M571 Y592 D593 T595 I600 Y601	K341-F597 HydrophobicContact CG-CZ 4.24Å; Y342-F597 HydrophobicContact CD2-CD1 4.08Å; Y342-F597 AromaticContact CD2-CE1 3.9Å; Y342-F597 HydrophobicContact CD2-CE1 3.9Å; Q345-F597 HydrophobicContact CG-CE2 4.38Å; Q345-F597 HydrophobicContact CG-CZ 4.27Å; M571-F597 HydrophobicContact CB-CE2 4.19Å; M571-F597 HydrophobicContact CE-CD2 4.47Å; M571-F597 HydrophobicContact CE-CE1 3.95Å; M571-F597 HydrophobicContact CE-CE2 3.35Å; M571-F597 HydrophobicContact CE-CZ 3.04Å; M571-F597 HydrophobicContact CG-CE2 4.2Å; Y592-F597 AromaticContact CD1-CD2 3.92Å; Y592-F597 HydrophobicContact CD1-CD2 3.92Å; Y592-F597 HydrophobicContact CD1-CE2 4.13Å; Y592-F597 HydrophobicContact CD2-CE2 4.47Å; Y592-F597 HydrophobicContact CE1-CE2 4.45Å; Y592-F597 AromaticContact CG-CD2 3.94Å; Y592-F597 HydrophobicContact CG-CD2 3.94Å; Y592-F597 HydrophobicContact CG-CE2 4.12Å; D593-F597 WeakPolarHBondContact O-CB 3.43Å; D593-F597 PolarHBondContact O-N 3.13Å; T595-F597 VanDerWaalsContact C-N 3.31Å; T595-F597 PolarHBondContact O-N 2.99Å; F597-I600 PolarHBondContact O-N 2.7Å; F597-Y601 VanDerWaalsContact O-CB 3.28Å; F597-Y601 WeakPolarHBondContact O-CB 3.34Å; F597-Y601 PolarHBondContact O-N 2.87Å
598	R	92.2	Very high	91.5	Very high	24 Å²	24	25.7 Å²	25.7	9%	0.091	15%	0.145	C	C	.	.	H	α-helix	trans	-62.9	-44	176	-179.8	-175.1	73.1	-147.3	6.3	112.2	Y342 T409 S594 T595 T596 I600 Y601 L602	Y342-R598 HydrophobicContact CE2-CB 4.22Å; Y342-R598 HydrophobicContact CE2-CG 4.13Å; T409-R598 VanDerWaalsContact CB-NH1 3.29Å; S594-R598 WeakPolarHBondContact O-CB 3.35Å; S594-R598 PolarHBondContact O-N 3.22Å; T595-R598 PolarHBondContact O-N 3.43Å; T596-R598 VanDerWaalsContact C-N 3.32Å; T596-R598 PolarHBondContact O-N 3.36Å; R598-I600 VanDerWaalsContact C-N 3.29Å; R598-I600 PolarHBondContact O-N 3.41Å; R598-Y601 PolarHBondContact O-N 3.29Å; R598-L602 HydrophobicContact CG-CD1 3.75Å; R598-L602 HydrophobicContact CG-CG 4.28Å; R598-L602 WeakPolarHBondContact O-CB 3.04Å; R598-L602 PolarHBondContact O-N 3.42Å
599	Y	92.1	Very high	91.8	Very high	127 Å²	127	26.2 Å²	26.2	50%	0.498	15%	0.147	S	C	.	.	H	α-helix	trans	-63	-37.8	178	-77.7	-67.6	0	0	0	112.1	F406 T595 T596 G603	F406-Y599 HydrophobicContact CD1-CD1 4.33Å; F406-Y599 HydrophobicContact CD1-CE1 4.24Å; F406-Y599 AromaticContact CE1-CD1 3.86Å; F406-Y599 HydrophobicContact CE1-CD1 3.86Å; F406-Y599 HydrophobicContact CE1-CE1 4.19Å; T595-Y599 HydrophobicContact CG2-CD2 4.04Å; T595-Y599 HydrophobicContact CG2-CE2 3.68Å; T595-Y599 WeakPolarHBondContact O-CD2 3.48Å; T595-Y599 PolarHBondContact O-N 2.94Å; T595-Y599 VanDerWaalsContact O-N 3.14Å; T596-Y599 PolarHBondContact O-N 3.43Å; T596-Y599 VanDerWaalsContact O-N 3.17Å; Y599-G603 WeakPolarHBondContact O-CA 3.3Å; Y599-G603 PolarHBondContact O-N 2.95Å
600	I	93.1	Very high	92	Very high	26 Å²	26	26.7 Å²	26.7	13%	0.133	15%	0.153	C	C	.	.	H	α-helix	trans	-67.6	-48.8	172.7	-66.4	176.5	0	0	0	110	F567 L570 T574 T596 F597 R598 L604	F567-I600 HydrophobicContact CE2-CG2 4.44Å; L570-I600 HydrophobicContact CB-CD1 4.26Å; L570-I600 HydrophobicContact CB-CG2 3.77Å; L570-I600 HydrophobicContact CD1-CG2 4.42Å; L570-I600 WeakPolarHBondContact O-CD1 3.39Å; T574-I600 HydrophobicContact CG2-CD1 3.4Å; T596-I600 HydrophobicContact CG2-CD1 4.25Å; T596-I600 WeakPolarHBondContact O-CG1 3.5Å; T596-I600 PolarHBondContact O-N 3.44Å; F597-I600 PolarHBondContact O-N 2.7Å; R598-I600 VanDerWaalsContact C-N 3.29Å; R598-I600 PolarHBondContact O-N 3.41Å; I600-L604 VanDerWaalsContact O-CB 3.28Å; I600-L604 WeakPolarHBondContact O-CB 3.46Å; I600-L604 PolarHBondContact O-N 3.22Å
601	Y	93.3	Very high	92.3	Very high	7 Å²	7	28.9 Å²	28.9	3%	0.027	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-44.6	-172.9	177.3	-97.5	0	0	0	113.7	M335 F338 M339 Y342 F567 F597 R598 P605	M335-Y601 PolarHBondContact O-OH 2.84Å; M335-Y601 VanDerWaalsContact O-OH 3.1Å; F338-Y601 HydrophobicContact CB-CD2 4.31Å; F338-Y601 HydrophobicContact CB-CE2 4.09Å; M339-Y601 WeakPolarHBondContact CA-OH 3.07Å; M339-Y601 WeakPolarHBondContact CB-OH 3.4Å; Y342-Y601 AromaticContact CD1-CD1 3.9Å; Y342-Y601 HydrophobicContact CD1-CD1 3.9Å; Y342-Y601 AromaticContact CD1-CE1 3.6Å; Y342-Y601 HydrophobicContact CD1-CE1 3.6Å; Y342-Y601 AromaticContact CD2-CD1 3.22Å; Y342-Y601 HydrophobicContact CD2-CD1 3.22Å; Y342-Y601 HydrophobicContact CD2-CD2 4.42Å; Y342-Y601 AromaticContact CD2-CE1 3.82Å; Y342-Y601 HydrophobicContact CD2-CE1 3.82Å; Y342-Y601 AromaticContact CD2-CG 3.59Å; Y342-Y601 HydrophobicContact CD2-CG 3.59Å; Y342-Y601 HydrophobicContact CE1-CD1 4.23Å; Y342-Y601 HydrophobicContact CE1-CE1 4.08Å; Y342-Y601 AromaticContact CE2-CD1 3.61Å; Y342-Y601 HydrophobicContact CE2-CD1 3.61Å; Y342-Y601 HydrophobicContact CE2-CE1 4.28Å; Y342-Y601 HydrophobicContact CE2-CG 4.26Å; Y342-Y601 AromaticContact CG-CD1 3.39Å; Y342-Y601 HydrophobicContact CG-CD1 3.39Å; Y342-Y601 HydrophobicContact CG-CD2 4.39Å; Y342-Y601 AromaticContact CG-CE1 3.44Å; Y342-Y601 HydrophobicContact CG-CE1 3.44Å; Y342-Y601 VanDerWaalsContact CG-CE1 3.44Å; Y342-Y601 HydrophobicContact CG-CE2 4.44Å; Y342-Y601 AromaticContact CG-CG 3.91Å; Y342-Y601 HydrophobicContact CG-CG 3.91Å; F567-Y601 AromaticContact CE1-CD2 3.96Å; F567-Y601 HydrophobicContact CE1-CD2 3.96Å; F567-Y601 AromaticContact CZ-CD2 3.78Å; F567-Y601 HydrophobicContact CZ-CD2 3.78Å; F567-Y601 HydrophobicContact CZ-CG 4.44Å; F597-Y601 VanDerWaalsContact O-CB 3.28Å; F597-Y601 WeakPolarHBondContact O-CB 3.34Å; F597-Y601 PolarHBondContact O-N 2.87Å; R598-Y601 PolarHBondContact O-N 3.29Å; Y601-P605 WeakPolarHBondContact O-CD 3.49Å; Y601-P605 WeakPolarHBondContact O-CG 3.47Å
602	L	93.9	Very high	92.5	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-89.5	-39.4	178.6	-61.5	178.7	0	0	0	111.9	F406 R598 A606	F406-L602 HydrophobicContact CD1-CB 4.46Å; F406-L602 HydrophobicContact CD1-CD1 4.28Å; F406-L602 HydrophobicContact CD2-CB 4.22Å; F406-L602 HydrophobicContact CD2-CD1 4.18Å; F406-L602 HydrophobicContact CE1-CB 3.85Å; F406-L602 HydrophobicContact CE1-CD1 4.46Å; F406-L602 HydrophobicContact CE2-CB 3.58Å; F406-L602 HydrophobicContact CE2-CD1 4.38Å; F406-L602 HydrophobicContact CG-CD1 4.16Å; F406-L602 HydrophobicContact CZ-CB 3.38Å; R598-L602 HydrophobicContact CG-CD1 3.75Å; R598-L602 HydrophobicContact CG-CG 4.28Å; R598-L602 WeakPolarHBondContact O-CB 3.04Å; R598-L602 PolarHBondContact O-N 3.42Å; L602-A606 VanDerWaalsContact O-CB 3.24Å; L602-A606 WeakPolarHBondContact O-CB 2.97Å; L602-A606 PolarHBondContact O-N 3.19Å; L602-A606 VanDerWaalsContact O-N 3.1Å
603	G	94.3	Very high	92.6	Very high	23 Å²	23	29.6 Å²	29.6	24%	0.237	17%	0.173	C	C	.	.	H	α-helix	trans	-74.5	-39	-170.2	0	0	0	0	0	113.9	Y599 A606 A607	Y599-G603 WeakPolarHBondContact O-CA 3.3Å; Y599-G603 PolarHBondContact O-N 2.95Å; G603-A606 PolarHBondContact O-N 2.85Å; G603-A607 WeakPolarHBondContact O-CB 3.27Å; G603-A607 PolarHBondContact O-N 3.4Å
604	L	93.1	Very high	92.7	Very high	44 Å²	44	33.1 Å²	33.1	23%	0.23	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-48.3	179.1	174.6	68.3	0	0	0	112.1	Y566 F567 L570 I600 A606 A607 L608	Y566-L604 HydrophobicContact CE2-CD2 3.61Å; F567-L604 HydrophobicContact CD2-CD2 3.53Å; F567-L604 HydrophobicContact CE2-CB 4.48Å; F567-L604 HydrophobicContact CE2-CD2 3.86Å; L570-L604 HydrophobicContact CD1-CD2 3.68Å; I600-L604 VanDerWaalsContact O-CB 3.28Å; I600-L604 WeakPolarHBondContact O-CB 3.46Å; I600-L604 PolarHBondContact O-N 3.22Å; L604-A606 VanDerWaalsContact C-N 3.28Å; L604-A606 PolarHBondContact O-N 3.29Å; L604-A607 PolarHBondContact O-N 3.23Å; L604-L608 HydrophobicContact CD1-CD1 4.41Å; L604-L608 HydrophobicContact CD1-CG 4.34Å; L604-L608 HydrophobicContact CG-CD1 4.28Å; L604-L608 WeakPolarHBondContact O-CG 3.35Å; L604-L608 PolarHBondContact O-N 3.16Å
605	P	93.6	Very high	92.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-58.8	-38.7	171.3	-28.2	39.3	0	0	0	112.7	A331 N334 M335 F567 Y601 L608 R609	A331-P605 HydrophobicContact CB-CB 3.98Å; N334-P605 HydrophobicContact CB-CG 4.41Å; M335-P605 HydrophobicContact CE-CB 3.38Å; M335-P605 HydrophobicContact CE-CG 4.31Å; M335-P605 HydrophobicContact CG-CB 4.06Å; M335-P605 HydrophobicContact CG-CG 4.15Å; M335-P605 HydrophobicContact SD-CB 4.48Å; F567-P605 HydrophobicContact CE2-CG 4.31Å; Y601-P605 WeakPolarHBondContact O-CD 3.49Å; Y601-P605 WeakPolarHBondContact O-CG 3.47Å; P605-L608 PolarHBondContact O-N 2.91Å; P605-R609 WeakPolarHBondContact O-CB 3.45Å; P605-R609 VanDerWaalsContact O-CG 3.23Å; P605-R609 WeakPolarHBondContact O-CG 3.44Å; P605-R609 PolarHBondContact O-N 2.9Å
606	A	94.4	Very high	92.8	Very high	4 Å²	4	31.5 Å²	31.5	3%	0.033	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-45.9	174.1	0	0	0	0	0	111.9	Y399 F403 L602 G603 L604 L608 R609 G610	Y399-A606 HydrophobicContact CE2-CB 4.31Å; Y399-A606 VanDerWaalsContact CE2-O 3.29Å; Y399-A606 WeakPolarHBondContact CE2-O 3.48Å; F403-A606 HydrophobicContact CZ-CB 4.29Å; L602-A606 VanDerWaalsContact O-CB 3.24Å; L602-A606 WeakPolarHBondContact O-CB 2.97Å; L602-A606 PolarHBondContact O-N 3.19Å; L602-A606 VanDerWaalsContact O-N 3.1Å; G603-A606 PolarHBondContact O-N 2.85Å; L604-A606 VanDerWaalsContact C-N 3.28Å; L604-A606 PolarHBondContact O-N 3.29Å; A606-L608 PolarHBondContact O-N 2Å; A606-R609 PolarHBondContact O-N 2.84Å; A606-G610 PolarHBondContact O-N 3.34Å
607	A	94.9	Very high	92.8	Very high	61 Å²	61	33.1 Å²	33.1	50%	0.504	19%	0.193	S	C	.	.	H	α-helix	trans	-62.3	-44.5	177.7	0	0	0	0	0	112.1	G603 L604 G610 S611	G603-A607 WeakPolarHBondContact O-CB 3.27Å; G603-A607 PolarHBondContact O-N 3.4Å; L604-A607 PolarHBondContact O-N 3.23Å; A607-G610 PolarHBondContact O-N 2.95Å; A607-S611 PolarHBondContact O-N 3.49Å
608	L	94.2	Very high	92.7	Very high	37 Å²	37	36.6 Å²	36.6	19%	0.194	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-53.6	174.7	-71.9	171.6	0	0	0	110.2	I327 N330 A331 L604 P605 A606 G610 S611 S612	I327-L608 HydrophobicContact CG2-CB 4.08Å; I327-L608 WeakPolarHBondContact CG2-O 3.17Å; N330-L608 HydrophobicContact CB-CD1 4.46Å; A331-L608 HydrophobicContact CB-CB 4.19Å; A331-L608 HydrophobicContact CB-CD1 4.44Å; L604-L608 HydrophobicContact CD1-CD1 4.41Å; L604-L608 HydrophobicContact CD1-CG 4.34Å; L604-L608 HydrophobicContact CG-CD1 4.28Å; L604-L608 WeakPolarHBondContact O-CG 3.35Å; L604-L608 PolarHBondContact O-N 3.16Å; P605-L608 PolarHBondContact O-N 2.91Å; A606-L608 PolarHBondContact O-N 2Å; L608-G610 VanDerWaalsContact C-N 3.33Å; L608-G610 PolarHBondContact O-N 3.06Å; L608-S611 PolarHBondContact O-N 2.94Å; L608-S611 VanDerWaalsContact O-N 3.13Å; L608-S611 PolarHBondContact O-OG 2.03Å; L608-S612 PolarHBondContact O-N 3.16Å; L608-S612 VanDerWaalsContact O-N 3.15Å
609	R	92.8	Very high	92.3	Very high	13 Å²	13	35.9 Å²	35.9	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-62.5	-39.6	179.9	-67.9	-175.9	73.5	179.7	-0.3	112.5	A331 E398 Y399 P605 A606 S611 S612 F613	A331-R609 HydrophobicContact CB-CG 3.59Å; E398-R609 IonicContact OE1-CZ 3.03Å; E398-R609 IonicContact OE1-NH1 3.62Å; E398-R609 PolarHBondContact OE1-NH1 3.45Å; E398-R609 IonicContact OE1-NH2 2.69Å; E398-R609 IonicContact OE2-CZ 3.59Å; E398-R609 IonicContact OE2-NH1 2.99Å; E398-R609 PolarHBondContact OE2-NH1 3.26Å; E398-R609 IonicContact OE2-NH2 2.69Å; E398-R609 PolarHBondContact OE2-NH2 3.37Å; Y399-R609 HydrophobicContact CD2-CB 4.16Å; Y399-R609 HydrophobicContact CE2-CB 4.31Å; P605-R609 WeakPolarHBondContact O-CB 3.45Å; P605-R609 VanDerWaalsContact O-CG 3.23Å; P605-R609 WeakPolarHBondContact O-CG 3.44Å; P605-R609 PolarHBondContact O-N 2.9Å; A606-R609 PolarHBondContact O-N 2.84Å; R609-S611 VanDerWaalsContact C-N 3.34Å; R609-S611 PolarHBondContact O-N 2.79Å; R609-S612 WeakPolarHBondContact O-CB 3.27Å; R609-S612 PolarHBondContact O-N 3.34Å; R609-S612 VanDerWaalsContact O-N 3.08Å; R609-S612 PolarHBondContact O-OG 2.93Å; R609-F613 WeakPolarHBondContact O-CD2 3.23Å
610	G	94.1	Very high	92	Very high	21 Å²	21	31.3 Å²	31.3	22%	0.216	19%	0.192	C	C	.	.	H	α-helix	trans	-53.9	-48.4	171.9	0	0	0	0	0	112.1	A606 A607 L608 S612 F613	A606-G610 PolarHBondContact O-N 3.34Å; A607-G610 PolarHBondContact O-N 2.95Å; L608-G610 VanDerWaalsContact C-N 3.33Å; L608-G610 PolarHBondContact O-N 3.06Å; G610-S612 PolarHBondContact O-N 3Å; G610-F613 PolarHBondContact O-N 3.47Å
611	S	94.5	Very high	91.7	Very high	55 Å²	55	35.5 Å²	35.5	39%	0.385	21%	0.214	S	C	.	.	H	α-helix	trans	-63.6	-28.3	177.7	77.7	0	0	0	0	113.3	A607 L608 R609 F613 V614 P615	A607-S611 PolarHBondContact O-N 3.49Å; L608-S611 PolarHBondContact O-N 2.94Å; L608-S611 VanDerWaalsContact O-N 3.13Å; L608-S611 PolarHBondContact O-OG 2.03Å; R609-S611 VanDerWaalsContact C-N 3.34Å; R609-S611 PolarHBondContact O-N 2.79Å; S611-F613 PolarHBondContact O-N 2.77Å; S611-V614 PolarHBondContact O-N 3.43Å; S611-P615 VanDerWaalsContact O-CD 3.28Å; S611-P615 WeakPolarHBondContact O-CD 3.11Å
612	S	93.9	Very high	91.2	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-19.5	178.3	82.6	0	0	0	0	113.8	Q328 L608 R609 G610 V614 P615 A616	Q328-S612 PolarHBondContact NE2-OG 3.42Å; Q328-S612 VanDerWaalsContact NE2-OG 3.09Å; L608-S612 PolarHBondContact O-N 3.16Å; L608-S612 VanDerWaalsContact O-N 3.15Å; R609-S612 WeakPolarHBondContact O-CB 3.27Å; R609-S612 PolarHBondContact O-N 3.34Å; R609-S612 VanDerWaalsContact O-N 3.08Å; R609-S612 PolarHBondContact O-OG 2.93Å; G610-S612 PolarHBondContact O-N 3Å; S612-V614 VanDerWaalsContact C-N 3.31Å; S612-V614 PolarHBondContact O-N 2.93Å; S612-P615 VanDerWaalsContact O-CD 3.32Å; S612-P615 WeakPolarHBondContact O-CD 3.43Å; S612-P615 WeakPolarHBondContact O-CG 3.11Å; S612-A616 PolarHBondContact O-N 3.26Å
613	F	92.4	Very high	90.6	Very high	29 Å²	29	37 Å²	37	13%	0.127	22%	0.222	C	C	.	.	H	α-helix	trans	-71.1	-25.7	177.3	-71.2	-73.8	0	0	0	113	L396 Y399 R609 G610 S611 A616 L617	L396-F613 HydrophobicContact CB-CE1 4.17Å; L396-F613 HydrophobicContact CB-CZ 4.37Å; L396-F613 HydrophobicContact CD1-CE1 4.29Å; L396-F613 HydrophobicContact CD1-CZ 4.15Å; Y399-F613 AromaticContact CD1-CE2 3.69Å; Y399-F613 HydrophobicContact CD1-CE2 3.69Å; Y399-F613 HydrophobicContact CD1-CZ 4.27Å; Y399-F613 HydrophobicContact CD2-CE2 4.22Å; Y399-F613 HydrophobicContact CE1-CE2 4.15Å; Y399-F613 AromaticContact CG-CE2 3.71Å; Y399-F613 HydrophobicContact CG-CE2 3.71Å; Y399-F613 HydrophobicContact CG-CZ 4.16Å; R609-F613 WeakPolarHBondContact O-CD2 3.23Å; G610-F613 PolarHBondContact O-N 3.47Å; S611-F613 PolarHBondContact O-N 2.77Å; F613-A616 PolarHBondContact O-N 3.47Å; F613-L617 VanDerWaalsContact O-CG 3.29Å; F613-L617 WeakPolarHBondContact O-CG 3.39Å; F613-L617 PolarHBondContact O-N 2.04Å
614	V	92.1	Very high	89.8	Confident	95 Å²	95	47 Å²	47	58%	0.576	25%	0.253	S	S	*	.	H	α-helix	trans	-60.3	-57.9	176.5	176.6	0	0	0	0	111.3	S611 S612 A616 L617 I618	S611-V614 PolarHBondContact O-N 3.43Å; S612-V614 VanDerWaalsContact C-N 3.31Å; S612-V614 PolarHBondContact O-N 2.93Å; V614-A616 VanDerWaalsContact C-N 3.26Å; V614-A616 PolarHBondContact O-N 3.06Å; V614-L617 PolarHBondContact O-N 2.96Å; V614-I618 HydrophobicContact CG1-CD1 4.44Å; V614-I618 WeakPolarHBondContact O-CG1 3.37Å; V614-I618 PolarHBondContact O-N 3.4Å
615	P	91.2	Very high	88.8	Confident	9 Å²	9	52.2 Å²	52.2	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-30.3	174.5	22.3	-30.5	0	0	0	112.9	L320 L323 I324 S611 S612 I618 I619	L320-P615 HydrophobicContact CD2-CB 3.89Å; L323-P615 HydrophobicContact CD2-CB 4.42Å; L323-P615 HydrophobicContact CD2-CG 4.39Å; I324-P615 HydrophobicContact CD1-CB 4.17Å; I324-P615 HydrophobicContact CD1-CG 4.4Å; I324-P615 HydrophobicContact CG1-CB 3.82Å; I324-P615 HydrophobicContact CG1-CG 3.61Å; S611-P615 VanDerWaalsContact O-CD 3.28Å; S611-P615 WeakPolarHBondContact O-CD 3.11Å; S612-P615 VanDerWaalsContact O-CD 3.32Å; S612-P615 WeakPolarHBondContact O-CD 3.43Å; S612-P615 WeakPolarHBondContact O-CG 3.11Å; P615-I618 PolarHBondContact O-N 3.44Å; P615-I619 WeakPolarHBondContact O-CG1 3.16Å; P615-I619 PolarHBondContact O-N 3.35Å
616	A	88.1	Confident	87.4	Confident	18 Å²	18	56 Å²	56	15%	0.149	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-42.4	175.8	0	0	0	0	0	112.5	I324 S612 F613 V614 I618 I619 L620	I324-A616 HydrophobicContact CD1-CB 3.93Å; S612-A616 PolarHBondContact O-N 3.26Å; F613-A616 PolarHBondContact O-N 3.47Å; V614-A616 VanDerWaalsContact C-N 3.26Å; V614-A616 PolarHBondContact O-N 3.06Å; A616-I618 VanDerWaalsContact C-N 3.34Å; A616-I619 WeakPolarHBondContact O-CB 3.16Å; A616-I619 PolarHBondContact O-N 2.95Å; A616-L620 PolarHBondContact O-N 3.17Å
617	L	88.6	Confident	85.8	Confident	99 Å²	99	62.6 Å²	62.6	52%	0.518	32%	0.318	S	S	.	.	H	α-helix	trans	-63.7	-40.1	174.5	-71.7	171.9	0	0	0	111.5	F613 V614 I619 L620 I621	F613-L617 VanDerWaalsContact O-CG 3.29Å; F613-L617 WeakPolarHBondContact O-CG 3.39Å; F613-L617 PolarHBondContact O-N 2.04Å; V614-L617 PolarHBondContact O-N 2.96Å; L617-I619 VanDerWaalsContact C-N 3.32Å; L617-I619 PolarHBondContact O-N 3.24Å; L617-L620 PolarHBondContact O-N 3.5Å; L617-I621 WeakPolarHBondContact O-CG1 3.46Å; L617-I621 PolarHBondContact O-N 3.08Å
618	I	88.9	Confident	84.1	Confident	74 Å²	74	60.8 Å²	60.8	38%	0.379	30%	0.3	S	S	.	.	H	α-helix	trans	-60.8	-42.9	174.8	-62.4	169.9	0	0	0	110.4	L320 V614 P615 A616 L620 I621 L622	L320-I618 HydrophobicContact CD1-CB 4.18Å; L320-I618 HydrophobicContact CD1-CG2 3.54Å; V614-I618 HydrophobicContact CG1-CD1 4.44Å; V614-I618 WeakPolarHBondContact O-CG1 3.37Å; V614-I618 PolarHBondContact O-N 3.4Å; P615-I618 PolarHBondContact O-N 3.44Å; A616-I618 VanDerWaalsContact C-N 3.34Å; I618-L620 PolarHBondContact O-N 3.36Å; I618-I621 PolarHBondContact O-N 2.94Å; I618-L622 HydrophobicContact CG2-CD1 4.08Å; I618-L622 HydrophobicContact CG2-CG 4.39Å; I618-L622 WeakPolarHBondContact O-CG 2.98Å; I618-L622 PolarHBondContact O-N 3.25Å
619	I	85.6	Confident	81.9	Confident	10 Å²	10	63.2 Å²	63.2	5%	0.051	32%	0.318	C	S	.	.	H	α-helix	trans	-59.9	-45.6	175.1	-70.6	176.5	0	0	0	111.1	I317 L320 F321 I324 P615 A616 L617 I621 L622 L623	I317-I619 HydrophobicContact CG2-CG2 4.27Å; L320-I619 HydrophobicContact CB-CD1 3.79Å; L320-I619 HydrophobicContact CB-CG1 3.72Å; L320-I619 HydrophobicContact CD1-CG1 4.05Å; F321-I619 HydrophobicContact CB-CD1 4.19Å; I324-I619 HydrophobicContact CD1-CD1 3.44Å; I324-I619 VanDerWaalsContact CD1-CD1 3.44Å; I324-I619 HydrophobicContact CD1-CG1 4.48Å; P615-I619 WeakPolarHBondContact O-CG1 3.16Å; P615-I619 PolarHBondContact O-N 3.35Å; A616-I619 WeakPolarHBondContact O-CB 3.16Å; A616-I619 PolarHBondContact O-N 2.95Å; L617-I619 VanDerWaalsContact C-N 3.32Å; L617-I619 PolarHBondContact O-N 3.24Å; I619-I621 VanDerWaalsContact C-N 3.31Å; I619-I621 PolarHBondContact O-N 3.08Å; I619-L622 PolarHBondContact O-N 3.3Å; I619-L623 HydrophobicContact CG2-CD1 3.67Å; I619-L623 HydrophobicContact CG2-CG 4.1Å; I619-L623 WeakPolarHBondContact O-CB 3.38Å; I619-L623 VanDerWaalsContact O-CG 3.29Å; I619-L623 WeakPolarHBondContact O-CG 3.15Å; I619-L623 PolarHBondContact O-N 2.85Å
620	L	85.5	Confident	79.5	Confident	30 Å²	30	65.8 Å²	65.8	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-39.3	178.1	-69.6	176.1	0	0	0	112.2	A388 C392 A616 L617 I618 L623 R624	A388-L620 HydrophobicContact CB-CD2 3.94Å; C392-L620 HydrophobicContact CB-CD1 4.24Å; A616-L620 PolarHBondContact O-N 3.17Å; L617-L620 PolarHBondContact O-N 3.5Å; I618-L620 PolarHBondContact O-N 3.36Å; L620-L623 PolarHBondContact O-N 2.82Å; L620-R624 PolarHBondContact O-N 3.17Å; L620-R624 VanDerWaalsContact O-N 3.08Å
621	I	86	Confident	77.1	Confident	114 Å²	114	69.3 Å²	69.3	59%	0.585	36%	0.359	S	S	*	.	H	α-helix	trans	-64.7	-43.9	175.1	-66.3	164.8	0	0	0	110.8	L617 I618 I619 R624 K625	L617-I621 WeakPolarHBondContact O-CG1 3.46Å; L617-I621 PolarHBondContact O-N 3.08Å; I618-I621 PolarHBondContact O-N 2.94Å; I619-I621 VanDerWaalsContact C-N 3.31Å; I619-I621 PolarHBondContact O-N 3.08Å; I621-R624 PolarHBondContact O-N 3.33Å; I621-K625 PolarHBondContact O-N 3Å
622	L	84	Confident	74.2	Confident	32 Å²	32	73.7 Å²	73.7	17%	0.168	38%	0.378	C	S	.	.	H	α-helix	trans	-64.9	-42.2	177.5	-70.7	174.3	0	0	0	111.9	I317 L320 I618 I619 R624 K625 Y626	I317-L622 HydrophobicContact CD1-CB 4.38Å; I317-L622 HydrophobicContact CG1-CB 4.22Å; I317-L622 HydrophobicContact CG1-CD1 4.13Å; L320-L622 HydrophobicContact CD1-CD1 3.87Å; I618-L622 HydrophobicContact CG2-CD1 4.08Å; I618-L622 HydrophobicContact CG2-CG 4.39Å; I618-L622 WeakPolarHBondContact O-CG 2.98Å; I618-L622 PolarHBondContact O-N 3.25Å; I619-L622 PolarHBondContact O-N 3.3Å; L622-R624 PolarHBondContact O-N 3.34Å; L622-K625 PolarHBondContact O-N 3.32Å; L622-K625 VanDerWaalsContact O-N 3.08Å; L622-Y626 HydrophobicContact CD2-CD2 4.13Å; L622-Y626 HydrophobicContact CD2-CE2 3.82Å; L622-Y626 WeakPolarHBondContact O-CD2 3.27Å; L622-Y626 PolarHBondContact O-N 2.04Å
623	L	80.4	Confident	71.3	Confident	8 Å²	8	78.4 Å²	78.4	4%	0.042	42%	0.417	C	S	.	.	H	α-helix	trans	-65.9	-25.6	176.8	-72.6	173.6	0	0	0	113.2	I317 K385 A388 I619 L620 L628	I317-L623 HydrophobicContact CD1-CD2 4.16Å; K385-L623 WeakPolarHBondContact CE-O 3.46Å; A388-L623 HydrophobicContact CB-CD1 3.88Å; I619-L623 HydrophobicContact CG2-CD1 3.67Å; I619-L623 HydrophobicContact CG2-CG 4.1Å; I619-L623 WeakPolarHBondContact O-CB 3.38Å; I619-L623 VanDerWaalsContact O-CG 3.29Å; I619-L623 WeakPolarHBondContact O-CG 3.15Å; I619-L623 PolarHBondContact O-N 2.85Å; L620-L623 PolarHBondContact O-N 2.82Å; L623-L628 HydrophobicContact CD2-CD1 3.72Å; L623-L628 HydrophobicContact CD2-CD2 4.09Å; L623-L628 HydrophobicContact CD2-CG 3.98Å
624	R	78.6	Confident	68.3	Low	234 Å²	234	82.3 Å²	82.3	88%	0.883	45%	0.448	S	S	*	.	H	α-helix	trans	-75.9	-29.4	172.4	-169.4	175.1	-178.2	176.1	1.2	112.2	L620 I621 L622	L620-R624 PolarHBondContact O-N 3.17Å; L620-R624 VanDerWaalsContact O-N 3.08Å; I621-R624 PolarHBondContact O-N 3.33Å; L622-R624 PolarHBondContact O-N 3.34Å
625	K	71.9	Confident	65.2	Low	152 Å²	152	83 Å²	83	66%	0.661	46%	0.457	S	S	*	.	H	α-helix	trans	-94.5	-22.4	-173.8	-163.4	175.2	-177.9	-180	0	113.8	I621 L622	I621-K625 PolarHBondContact O-N 3Å; L622-K625 PolarHBondContact O-N 3.32Å; L622-K625 VanDerWaalsContact O-N 3.08Å
626	Y	64.2	Low	62.3	Low	81 Å²	81	86.1 Å²	86.1	32%	0.318	49%	0.491	S	S	.	.	S	Bend	trans	-126.6	139.1	-174.9	-62.3	-72.2	0	0	0	112.1	L622 Y655	L622-Y626 HydrophobicContact CD2-CD2 4.13Å; L622-Y626 HydrophobicContact CD2-CE2 3.82Å; L622-Y626 WeakPolarHBondContact O-CD2 3.27Å; L622-Y626 PolarHBondContact O-N 2.04Å; Y626-Y655 AromaticContact CD1-CD1 3.78Å; Y626-Y655 HydrophobicContact CD1-CD1 3.78Å; Y626-Y655 AromaticContact CD1-CE1 3.76Å; Y626-Y655 HydrophobicContact CD1-CE1 3.76Å; Y626-Y655 HydrophobicContact CD2-CE1 4.04Å; Y626-Y655 AromaticContact CE1-CD1 3.24Å; Y626-Y655 HydrophobicContact CE1-CD1 3.24Å; Y626-Y655 AromaticContact CE1-CE1 3.4Å; Y626-Y655 HydrophobicContact CE1-CE1 3.4Å; Y626-Y655 HydrophobicContact CE2-CD1 4.36Å; Y626-Y655 AromaticContact CE2-CE1 3.69Å; Y626-Y655 HydrophobicContact CE2-CE1 3.69Å; Y626-Y655 HydrophobicContact CG-CE1 4.07Å; Y626-Y655 AromaticContact CZ-CD1 3.57Å; Y626-Y655 AromaticContact CZ-CE1 3.34Å
627	H	59.3	Low	59.2	Low	141 Å²	141	91.9 Å²	91.9	65%	0.653	53%	0.525	S	S	*	.			trans	-78.5	134.8	170.2	-85.7	-80.1	0	0	0	110.3	E631	H627-E631 IonicContact CE1-OE2 2.8Å; H627-E631 IonicContact CG-OE2 3.9Å; H627-E631 IonicContact ND1-OE1 2.69Å; H627-E631 IonicContact ND1-OE2 3.56Å; H627-E631 PolarHBondContact ND1-OE2 3Å
628	L	60.4	Low	56.7	Low	23 Å²	23	96 Å²	96	12%	0.12	54%	0.541	C	S	.	.			trans	-74.9	147.8	178.8	-81.2	152	0	0	0	110.5	V384 C538 L623 G630 E631	V384-L628 HydrophobicContact CB-CD1 3.7Å; V384-L628 HydrophobicContact CG1-CD1 3.68Å; V384-L628 HydrophobicContact CG2-CD1 4.11Å; C538-L628 HydrophobicContact CB-CD2 4.39Å; L623-L628 HydrophobicContact CD2-CD1 3.72Å; L623-L628 HydrophobicContact CD2-CD2 4.09Å; L623-L628 HydrophobicContact CD2-CG 3.98Å; L628-G630 PolarHBondContact O-N 2.9Å; L628-E631 PolarHBondContact O-N 2.93Å
629	P	48	Very low	53.5	Low	89 Å²	89	100.7 Å²	100.7	58%	0.578	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	96.1	175.6	26.6	-31.7	0	0	0	109.8
630	G	42.2	Very low	50.6	Low	66 Å²	66	107.5 Å²	107.5	68%	0.68	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	151	-12	-178.7	0	0	0	0	0	115.7	L628 N632	L628-G630 PolarHBondContact O-N 2.9Å; G630-N632 PolarHBondContact O-N 3.48Å
631	E	43.2	Very low	47.7	Very low	96 Å²	96	115 Å²	115	45%	0.449	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-7.7	177.2	-112.4	167.8	154.3	0	0	113.7	K385 H627 L628	K385-E631 IonicContact NZ-OE1 2.66Å; K385-E631 PolarHBondContact NZ-OE1 3.39Å; K385-E631 IonicContact NZ-OE2 3.03Å; K385-E631 PolarHBondContact NZ-OE2 3.43Å; H627-E631 IonicContact CE1-OE2 2.8Å; H627-E631 IonicContact CG-OE2 3.9Å; H627-E631 IonicContact ND1-OE1 2.69Å; H627-E631 IonicContact ND1-OE2 3.56Å; H627-E631 PolarHBondContact ND1-OE2 3Å; L628-E631 PolarHBondContact O-N 2.93Å
632	N	33.1	Very low	44.6	Very low	147 Å²	147	116 Å²	116	79%	0.786	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	9.2	-174.6	-68.3	-0	0	0	0	115.5	G630 S634	G630-N632 PolarHBondContact O-N 3.48Å; N632-S634 PolarHBondContact O-N 2.86Å
633	A	32.8	Very low	41.9	Very low	99 Å²	99	124.6 Å²	124.6	82%	0.818	68%	0.683	S	S	*	*	S	Bend	trans	-94.8	29.5	-177.4	0	0	0	0	0	114.4
634	S	30.3	Very low	39.1	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	72%	0.721	S	S	*	*	S	Bend	trans	-142.6	61.1	171.5	74.3	0	0	0	0	113.3	N632	N632-S634 PolarHBondContact O-N 2.86Å
635	S	26.2	Very low	36.7	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	72%	0.723	S	S	*	*	S	Bend	trans	-163.6	108.5	150.9	54.8	0	0	0	0	107.5
636	G	31.3	Very low	34.4	Very low	76 Å²	76	125.6 Å²	125.6	78%	0.784	72%	0.723	S	S	*	*			trans	-63.1	138.2	-178	0	0	0	0	0	111.7
637	T	23.7	Very low	32.8	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	75%	0.754	S	S	*	*			trans	-163.2	127.9	142.8	-56	0	0	0	0	106.7
638	E	34.2	Very low	31.2	Very low	185 Å²	185	133.4 Å²	133.4	86%	0.864	76%	0.756	S	S	*	*			trans	-57.3	141.7	172.2	-68.8	176.4	136.4	0	0	111.1
639	L	23.1	Very low	29.8	Very low	173 Å²	173	139.3 Å²	139.3	91%	0.906	79%	0.788	S	S	*	*			trans	-146.1	132.2	154.2	-145.2	84.8	0	0	0	112.4
640	I	23.8	Very low	29.3	Very low	152 Å²	152	142.4 Å²	142.4	78%	0.779	80%	0.795	S	S	*	*			trans	-63.3	138.6	-172.7	-67.8	159.9	0	0	0	112.5	T642	I640-T642 PolarHBondContact O-N 3.36Å
641	E	24.4	Very low	29	Very low	189 Å²	189	143 Å²	143	88%	0.883	79%	0.787	S	S	*	*			trans	-60	128.5	171.4	-83	-171.8	138.3	0	0	112.2
642	T	21.2	Very low	28.4	Very low	135 Å²	135	146.8 Å²	146.8	83%	0.828	80%	0.803	S	S	*	*			trans	-129.3	116.8	151.4	12.1	0	0	0	0	110.3	I640 V644	I640-T642 PolarHBondContact O-N 3.36Å; T642-V644 PolarHBondContact O-N 2.96Å
643	K	27.8	Very low	28.6	Very low	212 Å²	212	145.1 Å²	145.1	92%	0.922	79%	0.793	S	S	*	*			trans	-62	120.8	175.2	-112.7	170.3	178.7	163.6	0	110.6
644	V	21.5	Very low	28.8	Very low	137 Å²	137	144.3 Å²	144.3	83%	0.83	77%	0.774	S	S	*	*			trans	-129.8	113.6	157	179.3	0	0	0	0	109.3	T642	T642-V644 PolarHBondContact O-N 2.96Å
645	K	28.5	Very low	29.4	Very low	215 Å²	215	143.4 Å²	143.4	94%	0.935	75%	0.754	S	S	*	*			trans	-68.1	123.1	169.8	-91	176.8	171.3	175.9	0	109.5
646	G	22.9	Very low	29.5	Very low	63 Å²	63	147.2 Å²	147.2	65%	0.649	76%	0.76	S	S	*	*			trans	-162	115.3	165.2	0	0	0	0	0	110.9	K648	G646-K648 PolarHBondContact O-N 2.94Å; G646-K648 VanDerWaalsContact O-N 3.1Å
647	K	31	Very low	29.2	Very low	226 Å²	226	152.5 Å²	152.5	98%	0.983	76%	0.761	S	S	*	*			trans	-55.4	111.6	170.3	-87.3	175.5	170.6	175.4	0	109
648	K	26.1	Very low	29.3	Very low	159 Å²	159	150.7 Å²	150.7	69%	0.691	75%	0.754	S	S	*	*			trans	-120.2	139	170	-95.2	-179.1	175.1	178.9	0	109.7	G646 E650	G646-K648 PolarHBondContact O-N 2.94Å; G646-K648 VanDerWaalsContact O-N 3.1Å; K648-E650 PolarHBondContact O-N 2.93Å; K648-E650 VanDerWaalsContact O-N 3.15Å
649	N	30.6	Very low	28.8	Very low	147 Å²	147	147.7 Å²	147.7	79%	0.786	75%	0.749	S	S	*	*			trans	-64.2	108.2	176.1	-81.4	-21.8	0	0	0	110.1	C651 K652	N649-C651 PolarHBondContact O-N 3.03Å; N649-K652 PolarHBondContact O-N 3.4Å
650	E	37.3	Very low	28.9	Very low	154 Å²	154	145 Å²	145	72%	0.72	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-12.5	-173.8	-72.1	172	148.8	0	0	115.7	K648	K648-E650 PolarHBondContact O-N 2.93Å; K648-E650 VanDerWaalsContact O-N 3.15Å
651	C	36	Very low	29.1	Very low	78 Å²	78	145.4 Å²	145.4	53%	0.527	74%	0.742	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.1	-21.4	-179.8	-136.6	0	0	0	0	114	C314 N649	C314-C651 PolarHBondContact SG-SG 2.9Å; N649-C651 PolarHBondContact O-N 3.03Å
652	K	30.8	Very low	29.1	Very low	177 Å²	177	143.1 Å²	143.1	77%	0.77	74%	0.736	S	S	*	*	S	Bend	trans	-91	-20.9	-176	-94.6	-176.6	174.6	-179.6	0	114.2	N649 M654 Y655	N649-K652 PolarHBondContact O-N 3.4Å; K652-M654 PolarHBondContact O-N 2.81Å; K652-Y655 PolarHBondContact O-N 2.82Å
653	D	38	Very low	29.5	Very low	111 Å²	111	144.3 Å²	144.3	59%	0.594	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	0.2	-173	-72.3	-25.8	0	0	0	113.9
654	M	37	Very low	29.6	Very low	83 Å²	83	142 Å²	142	41%	0.409	74%	0.735	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	-6.1	172.7	-116.5	-176.8	74.5	0	0	114.3	N315 K652	N315-M654 HydrophobicContact CB-CE 4.24Å; K652-M654 PolarHBondContact O-N 2.81Å
655	Y	41.6	Very low	30	Very low	91 Å²	91	144.4 Å²	144.4	36%	0.357	74%	0.737	S	S	.	*			trans	-130.7	71.6	-174.9	-74.9	-66.9	0	0	0	112.2	P316 Y626 K652 K657	P316-Y655 WeakPolarHBondContact CG-OH 3.33Å; Y626-Y655 AromaticContact CD1-CD1 3.78Å; Y626-Y655 HydrophobicContact CD1-CD1 3.78Å; Y626-Y655 AromaticContact CD1-CE1 3.76Å; Y626-Y655 HydrophobicContact CD1-CE1 3.76Å; Y626-Y655 HydrophobicContact CD2-CE1 4.04Å; Y626-Y655 AromaticContact CE1-CD1 3.24Å; Y626-Y655 HydrophobicContact CE1-CD1 3.24Å; Y626-Y655 AromaticContact CE1-CE1 3.4Å; Y626-Y655 HydrophobicContact CE1-CE1 3.4Å; Y626-Y655 HydrophobicContact CE2-CD1 4.36Å; Y626-Y655 AromaticContact CE2-CE1 3.69Å; Y626-Y655 HydrophobicContact CE2-CE1 3.69Å; Y626-Y655 HydrophobicContact CG-CE1 4.07Å; Y626-Y655 AromaticContact CZ-CD1 3.57Å; Y626-Y655 AromaticContact CZ-CE1 3.34Å; K652-Y655 PolarHBondContact O-N 2.82Å; Y655-K657 PolarHBondContact O-N 3.26Å
656	Q	28.4	Very low	30.2	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	73%	0.733	S	S	*	*			trans	-85.5	102.2	166	-155.8	154	1.1	0	0	109.4	S658	Q656-S658 PolarHBondContact O-N 3.06Å
657	K	26	Very low	30.7	Very low	187 Å²	187	148.6 Å²	148.6	81%	0.813	74%	0.744	S	S	*	*			trans	-72.9	110.4	166.2	-160.3	-176.9	-172.2	-171.7	0	106.2	Y655 T659	Y655-K657 PolarHBondContact O-N 3.26Å; K657-T659 PolarHBondContact O-N 3.05Å
658	S	24.8	Very low	31.1	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	74%	0.738	S	S	*	*			trans	-73.9	109.7	168.5	65	0	0	0	0	108.2	Q656 V660	Q656-S658 PolarHBondContact O-N 3.06Å; S658-V660 PolarHBondContact O-N 3.09Å
659	T	24.8	Very low	31.5	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	75%	0.747	S	S	*	*			trans	-67.4	112.8	153.2	25.9	0	0	0	0	106.6	K657 L661	K657-T659 PolarHBondContact O-N 3.05Å; T659-L661 PolarHBondContact O-N 3.22Å; T659-L661 VanDerWaalsContact O-N 3.15Å
660	V	24.8	Very low	31.5	Very low	118 Å²	118	151.6 Å²	151.6	72%	0.715	77%	0.773	S	S	*	*			trans	-59.5	111.5	166.6	176.7	0	0	0	0	106.9	S658	S658-V660 PolarHBondContact O-N 3.09Å
661	L	26.7	Very low	31.2	Very low	160 Å²	160	151.5 Å²	151.5	84%	0.838	78%	0.775	S	S	*	*			trans	-77.7	119.7	159.2	-103.8	115.4	0	0	0	106.2	T659 D663	T659-L661 PolarHBondContact O-N 3.22Å; T659-L661 VanDerWaalsContact O-N 3.15Å; L661-D663 PolarHBondContact O-N 3.04Å
662	N	24.6	Very low	31	Very low	141 Å²	141	155.3 Å²	155.3	75%	0.754	79%	0.788	S	S	*	*			trans	-64.7	125.9	172.1	-83.1	-9.8	0	0	0	109.2	D664	N662-D664 VanDerWaalsContact C-N 3.29Å; N662-D664 PolarHBondContact O-N 3.17Å
663	D	29.5	Very low	31	Very low	160 Å²	160	154.1 Å²	154.1	86%	0.856	79%	0.79	S	S	*	*	S	Bend	trans	-91.4	56.5	-178.2	-153.5	15.7	0	0	0	110.2	L661	L661-D663 PolarHBondContact O-N 3.04Å
664	D	30.5	Very low	30.6	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	80%	0.801	S	S	*	*			trans	-134.7	15.3	-177.9	-106.8	-19.7	0	0	0	114.5	N662	N662-D664 VanDerWaalsContact C-N 3.29Å; N662-D664 PolarHBondContact O-N 3.17Å
665	E	30.5	Very low	30.2	Very low	189 Å²	189	161.3 Å²	161.3	88%	0.883	83%	0.826	S	S	*	*	S	Bend	trans	-133.2	43	176.6	-148	177.6	-166.1	0	0	113
666	L	33	Very low	29.4	Very low	162 Å²	162	165.9 Å²	165.9	85%	0.848	86%	0.857	S	S	*	*	S	Bend	trans	-144.1	38.6	168.8	-149.7	89.5	0	0	0	114.2
667	K	33.8	Very low	29.5	Very low	204 Å²	204	164.3 Å²	164.3	89%	0.887	86%	0.855	S	S	*	*	S	Bend	trans	-142.4	59.9	163.7	-78.4	-167.5	-179.5	174.2	0	112.6
668	T	38.1	Very low	29.7	Very low	138 Å²	138	162.5 Å²	162.5	85%	0.847	86%	0.858	S	S	*	*	S	Bend	trans	-159.7	76.3	154.5	27.5	0	0	0	0	109.7
669	K	34.8	Very low	30.1	Very low	203 Å²	203	167.7 Å²	167.7	88%	0.883	87%	0.871	S	S	*	*			trans	-178.7	81.1	148.2	-102.4	177.1	-172.2	-175.9	0	109.2
670	L	30.6	Very low	30.6	Very low	253 Å²	253	171.8 Å²	171.8	100%	1.325	88%	0.882	S	S	*	*			trans	-165.3	0	142.1	-112.5	152.2	0	0	0	107.9

Retrieved 670 of 670 residues in 224.7 ms (Link to these results)

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