A0A077Z1N3_TRITR Loading...

Transcriptional adapter 2-alpha

AlphaFold DB , UniProt , Accession A0A077Z1N3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 368 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	34.1	Very low	78.9	Confident	247 Å²	247	93 Å²	93	100%	1.217	53%	0.527	S	S	*	.				0	92.7	0	-75.8	176.9	-175.2	0	0	106.7
2	E	48.1	Very low	79.9	Confident	179 Å²	179	95.6 Å²	95.6	84%	0.836	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-66.7	139.8	164.7	-82.4	179.6	139.8	0	0	108.2	T4	E2-T4 PolarHBondContact O-N 3.48Å
3	A	63	Low	80.5	Confident	92 Å²	92	94.9 Å²	94.9	76%	0.76	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-60.6	129.6	-179.3	0	0	0	0	0	110	V5	A3-V5 PolarHBondContact O-N 3.1Å
4	T	75.7	Confident	80.8	Confident	121 Å²	121	89.1 Å²	89.1	74%	0.742	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-58.4	123.5	175.4	45.5	0	0	0	0	109.5	E2	E2-T4 PolarHBondContact O-N 3.48Å
5	V	87.4	Confident	80.6	Confident	17 Å²	17	87.9 Å²	87.9	10%	0.103	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-83.1	122.6	-179.7	178.5	0	0	0	0	108.5	A3 I14 K28 I54	A3-V5 PolarHBondContact O-N 3.1Å; V5-I14 PolarHBondContact O-N 3.44Å; V5-K28 HydrophobicContact CG1-CD 3.56Å; V5-I54 HydrophobicContact CB-CD1 3.75Å; V5-I54 HydrophobicContact CB-CG1 4.12Å; V5-I54 HydrophobicContact CB-CG2 3.92Å; V5-I54 HydrophobicContact CG1-CD1 3.63Å; V5-I54 HydrophobicContact CG1-CG1 4.2Å; V5-I54 HydrophobicContact CG2-CD1 4.29Å; V5-I54 HydrophobicContact CG2-CG1 4.1Å; V5-I54 HydrophobicContact CG2-CG2 3.68Å
6	T	91.5	Very high	80.4	Confident	69 Å²	69	84.6 Å²	84.6	42%	0.423	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-103.9	154	178.5	52	0	0	0	0	112.1	I11 E12	T6-I11 WeakPolarHBondContact CB-O 3.3Å; T6-I11 WeakPolarHBondContact CG2-O 3.48Å; T6-E12 WeakPolarHBondContact CA-O 3.35Å
7	C	94.3	Very high	80.7	Confident	1 Å²	1	85.8 Å²	85.8	1%	0.007	48%	0.483	C	S	.	.	P	Polyproline II helix	trans	-73.9	128.4	173	-177.7	0	0	0	0	110.4	N9 C10 I11 E12 I14 K28 C30 C33	C7-N9 PolarHBondContact O-N 3.24Å; C7-C10 WeakPolarHBondContact CB-SG 3.46Å; C7-I11 WeakPolarHBondContact O-CA 3.4Å; C7-I11 PolarHBondContact O-N 3Å; C7-E12 PolarHBondContact N-O 3.15Å; C7-I14 HydrophobicContact CB-CD1 3.97Å; C7-I14 HydrophobicContact CB-CG1 4.04Å; C7-K28 CarbonylContact C-O 3.45Å; C7-K28 WeakPolarHBondContact CA-O 3.39Å; C7-C30 HydrophobicContact CB-CB 4.06Å; C7-C30 PolarHBondContact SG-N 3.22Å; C7-C33 VanDerWaalsContact SG-SG 3.67Å
8	S	93.7	Very high	81.2	Confident	47 Å²	47	81 Å²	81	33%	0.329	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.7	178	-53	0	0	0	0	113.4	K28 L40	S8-K28 PolarHBondContact N-O 3.43Å; S8-K28 PolarHBondContact OG-N 3.25Å; S8-K28 PolarHBondContact OG-O 2.99Å; S8-L40 WeakPolarHBondContact O-CD2 3.44Å
9	N	94.1	Very high	81.9	Confident	72 Å²	72	78 Å²	78	39%	0.385	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-63.7	-180	-175.7	49.3	0	0	0	113.4	C7 L29 C33 A38 L40	C7-N9 PolarHBondContact O-N 3.24Å; N9-L29 HydrophobicContact CB-CD2 4.03Å; N9-C33 HydrophobicContact CB-CB 4.12Å; N9-C33 PolarHBondContact ND2-SG 3.37Å; N9-A38 HydrophobicContact CB-CB 4.24Å; N9-L40 HydrophobicContact CB-CD1 3.71Å; N9-L40 HydrophobicContact CB-CD2 4.27Å
10	C	93.8	Very high	82.4	Confident	48 Å²	48	75.3 Å²	75.3	32%	0.324	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.8	-175.7	64	0	0	0	0	113.5	C7 E12 C33	C7-C10 WeakPolarHBondContact CB-SG 3.46Å; C10-E12 HydrophobicContact CB-CG 4.3Å; C10-E12 PolarHBondContact O-N 2.98Å; C10-C33 VanDerWaalsContact SG-SG 3.62Å
11	I	92.7	Very high	83	Confident	130 Å²	130	72 Å²	72	67%	0.667	40%	0.403	S	S	*	.			trans	66.5	-14.2	179.9	-49.8	173.1	0	0	0	113.8	T6 C7	T6-I11 WeakPolarHBondContact CB-O 3.3Å; T6-I11 WeakPolarHBondContact CG2-O 3.48Å; C7-I11 WeakPolarHBondContact O-CA 3.4Å; C7-I11 PolarHBondContact O-N 3Å
12	E	90.9	Very high	85.8	Confident	124 Å²	124	64.7 Å²	64.7	58%	0.579	37%	0.369	S	S	*	.			trans	-53.6	143.4	173.7	-63.3	-62.1	155.8	0	0	112.9	T6 C7 C10	T6-E12 WeakPolarHBondContact CA-O 3.35Å; C7-E12 PolarHBondContact N-O 3.15Å; C10-E12 HydrophobicContact CB-CG 4.3Å; C10-E12 PolarHBondContact O-N 2.98Å
13	P	86.9	Confident	87.9	Confident	87 Å²	87	60.6 Å²	60.6	57%	0.565	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-64.6	138.2	173.4	28.4	-33.4	0	0	0	110.8
14	I	85.5	Confident	89.3	Confident	13 Å²	13	57.1 Å²	57.1	7%	0.067	33%	0.326	C	S	.	.			trans	-101	112.8	176.2	-49.9	177.9	0	0	0	107.9	V5 C7 W17 C18 C30 I54	V5-I14 PolarHBondContact O-N 3.44Å; C7-I14 HydrophobicContact CB-CD1 3.97Å; C7-I14 HydrophobicContact CB-CG1 4.04Å; I14-W17 WeakPolarHBondContact CG2-O 3.06Å; I14-C18 HydrophobicContact CD1-CB 3.53Å; I14-C18 HydrophobicContact CG2-CB 4.07Å; I14-C30 HydrophobicContact CD1-CB 4.01Å; I14-C30 HydrophobicContact CG1-CB 3.91Å; I14-I54 HydrophobicContact CB-CD1 3.61Å; I14-I54 HydrophobicContact CG2-CD1 3.47Å; I14-I54 VanDerWaalsContact CG2-CD1 3.47Å
15	A	76.8	Confident	89.9	Confident	71 Å²	71	57 Å²	57	59%	0.587	33%	0.328	S	S	*	.			trans	-75.8	-45.4	-175.8	0	0	0	0	0	113.1	D55	A15-D55 WeakPolarHBondContact O-CB 3.43Å
16	T	77.2	Confident	89.9	Confident	35 Å²	35	61.6 Å²	61.6	22%	0.215	35%	0.352	C	S	.	.	S	Bend	trans	-116.4	-59.4	-160	54.7	0	0	0	0	113.3	I54 D55 P57	T16-I54 PolarHBondContact O-N 3.32Å; T16-D55 PolarHBondContact O-N 3.06Å; T16-P57 HydrophobicContact CG2-CB 4.02Å
17	W	86.3	Confident	90	Very high	105 Å²	105	59 Å²	59	40%	0.398	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	144	-179.8	44.9	-63.2	0	0	0	111.1	I14 F19 I31 V51 R52	I14-W17 WeakPolarHBondContact CG2-O 3.06Å; W17-F19 HydrophobicContact CE3-CE2 4.22Å; W17-F19 HydrophobicContact CE3-CZ 4.06Å; W17-F19 HydrophobicContact CZ3-CE2 4.14Å; W17-F19 AromaticContact CZ3-CZ 3.72Å; W17-F19 HydrophobicContact CZ3-CZ 3.72Å; W17-I31 HydrophobicContact CD2-CD1 3.75Å; W17-I31 HydrophobicContact CD2-CG1 4.02Å; W17-I31 HydrophobicContact CE3-CD1 4.34Å; W17-I31 HydrophobicContact CE3-CG1 4.17Å; W17-I31 HydrophobicContact CG-CD1 4.27Å; W17-I31 HydrophobicContact CH2-CD1 4.06Å; W17-I31 HydrophobicContact CH2-CG1 4.2Å; W17-I31 HydrophobicContact CZ2-CD1 3.42Å; W17-I31 VanDerWaalsContact CZ2-CD1 3.42Å; W17-I31 HydrophobicContact CZ2-CG1 4.04Å; W17-I31 HydrophobicContact CZ3-CD1 4.49Å; W17-I31 HydrophobicContact CZ3-CG1 4.27Å; W17-V51 HydrophobicContact CB-CG1 4.44Å; W17-V51 HydrophobicContact CE3-CG1 4.17Å; W17-R52 CarbonylContact C-O 3.59Å; W17-R52 VanDerWaalsContact CA-O 3.3Å; W17-R52 WeakPolarHBondContact CA-O 3.4Å
18	C	90.1	Very high	89.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	159.5	174.5	72.3	0	0	0	0	111.9	I14 L29 R52 I54	I14-C18 HydrophobicContact CD1-CB 3.53Å; I14-C18 HydrophobicContact CG2-CB 4.07Å; C18-L29 WeakPolarHBondContact CA-O 3.35Å; C18-L29 WeakPolarHBondContact CB-O 3.22Å; C18-R52 PolarHBondContact N-O 3.27Å; C18-R52 PolarHBondContact O-N 3.32Å; C18-I54 HydrophobicContact CB-CD1 3.67Å
19	F	93.3	Very high	90	Very high	24 Å²	24	59.2 Å²	59.2	11%	0.105	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.3	170.8	-63.2	-90.1	0	0	0	108.1	W17 K28 L29 I31 F34 Y49 V51	W17-F19 HydrophobicContact CE3-CE2 4.22Å; W17-F19 HydrophobicContact CE3-CZ 4.06Å; W17-F19 HydrophobicContact CZ3-CE2 4.14Å; W17-F19 AromaticContact CZ3-CZ 3.72Å; W17-F19 HydrophobicContact CZ3-CZ 3.72Å; F19-K28 WeakPolarHBondContact O-CA 3.42Å; F19-L29 PolarHBondContact N-O 3.39Å; F19-L29 PolarHBondContact O-N 3.15Å; F19-I31 HydrophobicContact CE2-CB 4.41Å; F19-I31 HydrophobicContact CE2-CG1 4.02Å; F19-F34 HydrophobicContact CB-CB 4.33Å; F19-F34 HydrophobicContact CB-CD2 3.6Å; F19-F34 HydrophobicContact CB-CE2 4.08Å; F19-F34 HydrophobicContact CB-CG 3.99Å; F19-F34 AromaticContact CD1-CD1 3.93Å; F19-F34 HydrophobicContact CD1-CD1 3.93Å; F19-F34 AromaticContact CD1-CD2 3.96Å; F19-F34 HydrophobicContact CD1-CD2 3.96Å; F19-F34 AromaticContact CD1-CE1 3.85Å; F19-F34 HydrophobicContact CD1-CE1 3.85Å; F19-F34 AromaticContact CD1-CE2 3.89Å; F19-F34 HydrophobicContact CD1-CE2 3.89Å; F19-F34 AromaticContact CD1-CG 3.98Å; F19-F34 HydrophobicContact CD1-CG 3.98Å; F19-F34 AromaticContact CD1-CZ 3.84Å; F19-F34 HydrophobicContact CD1-CZ 3.84Å; F19-F34 HydrophobicContact CD2-CB 3.52Å; F19-F34 AromaticContact CD2-CD1 3.78Å; F19-F34 HydrophobicContact CD2-CD1 3.78Å; F19-F34 HydrophobicContact CD2-CD2 4.03Å; F19-F34 AromaticContact CD2-CG 3.48Å; F19-F34 HydrophobicContact CD2-CG 3.48Å; F19-F34 VanDerWaalsContact CD2-CG 3.48Å; F19-F34 AromaticContact CE1-CD1 3.84Å; F19-F34 HydrophobicContact CE1-CD1 3.84Å; F19-F34 AromaticContact CE1-CE1 3.69Å; F19-F34 HydrophobicContact CE1-CE1 3.69Å; F19-F34 HydrophobicContact CE1-CG 4.34Å; F19-F34 HydrophobicContact CE1-CZ 4.07Å; F19-F34 HydrophobicContact CE2-CB 4.01Å; F19-F34 AromaticContact CE2-CD1 3.7Å; F19-F34 HydrophobicContact CE2-CD1 3.7Å; F19-F34 HydrophobicContact CE2-CE1 4.39Å; F19-F34 AromaticContact CE2-CG 3.9Å; F19-F34 HydrophobicContact CE2-CG 3.9Å; F19-F34 HydrophobicContact CG-CB 4Å; F19-F34 AromaticContact CG-CD1 3.89Å; F19-F34 HydrophobicContact CG-CD1 3.89Å; F19-F34 AromaticContact CG-CD2 3.58Å; F19-F34 HydrophobicContact CG-CD2 3.58Å; F19-F34 HydrophobicContact CG-CE1 4.27Å; F19-F34 AromaticContact CG-CE2 3.99Å; F19-F34 HydrophobicContact CG-CE2 3.99Å; F19-F34 AromaticContact CG-CG 3.52Å; F19-F34 HydrophobicContact CG-CG 3.52Å; F19-F34 HydrophobicContact CG-CZ 4.31Å; F19-F34 AromaticContact CZ-CD1 3.72Å; F19-F34 HydrophobicContact CZ-CD1 3.72Å; F19-F34 AromaticContact CZ-CE1 3.98Å; F19-F34 HydrophobicContact CZ-CE1 3.98Å; F19-F34 HydrophobicContact CZ-CG 4.3Å; F19-Y49 HydrophobicContact CB-CD1 4.28Å; F19-V51 HydrophobicContact CD1-CG2 4.12Å; F19-V51 HydrophobicContact CE1-CG2 3.87Å
20	Q	92.7	Very high	89.9	Confident	24 Å²	24	56.7 Å²	56.7	11%	0.112	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.4	174.8	-173	174.6	8.9	0	0	109.3	L27 K28 Y49 R50	Q20-L27 WeakPolarHBondContact CA-O 3.4Å; Q20-K28 HydrophobicContact CG-CG 4.43Å; Q20-Y49 CarbonylContact O-C 3.59Å; Q20-Y49 VanDerWaalsContact O-CA 3.26Å; Q20-Y49 WeakPolarHBondContact O-CA 3.09Å; Q20-R50 HydrophobicContact CB-CG 4.03Å; Q20-R50 PolarHBondContact N-O 3.1Å; Q20-R50 PolarHBondContact O-N 2.86Å; Q20-R50 VanDerWaalsContact OE1-NE 3.08Å
21	C	94.4	Very high	89.8	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.034	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.7	174.1	-173.8	0	0	0	0	110.1	V23 C24 L27 H43 Y49	C21-V23 VanDerWaalsContact C-N 3.35Å; C21-V23 PolarHBondContact SG-N 3.38Å; C21-V23 VanDerWaalsContact SG-N 3.44Å; C21-C24 HydrophobicContact CB-CB 4.07Å; C21-C24 PolarHBondContact SG-N 3.01Å; C21-C24 VanDerWaalsContact SG-SG 3.7Å; C21-L27 HydrophobicContact CB-CB 4.07Å; C21-L27 HydrophobicContact CB-CD2 3.91Å; C21-L27 PolarHBondContact N-O 2.95Å; C21-L27 VanDerWaalsContact N-O 3.11Å; C21-H43 VanDerWaalsContact SG-CE1 3.53Å; C21-Y49 HydrophobicContact CB-CD1 4.11Å; C21-Y49 HydrophobicContact CB-CE1 4.09Å
22	N	92.8	Very high	89.8	Confident	94 Å²	94	55.4 Å²	55.4	50%	0.503	32%	0.316	S	S	.	.	S	Bend	trans	-84.4	-13.2	176.6	-65.2	-15.5	0	0	0	112.5	S48 R50	N22-S48 WeakPolarHBondContact CB-O 3.39Å; N22-S48 PolarHBondContact N-O 2.86Å; N22-R50 WeakPolarHBondContact OD1-CG 3.41Å
23	V	93.4	Very high	90	Very high	93 Å²	93	50 Å²	50	56%	0.564	29%	0.292	S	S	*	.	S	Bend	trans	-102.8	-39.6	-176.6	-176.8	0	0	0	0	111.7	C21 H47	C21-V23 VanDerWaalsContact C-N 3.35Å; C21-V23 PolarHBondContact SG-N 3.38Å; C21-V23 VanDerWaalsContact SG-N 3.44Å; V23-H47 HydrophobicContact CB-CB 4.16Å; V23-H47 HydrophobicContact CG2-CB 3.94Å
24	C	92.7	Very high	90.4	Very high	20 Å²	20	49.2 Å²	49.2	14%	0.135	28%	0.279	C	S	.	.	S	Bend	trans	-94.3	130.9	-178.1	-57	0	0	0	0	110.3	C21 D26 L27 H43 H47	C21-C24 HydrophobicContact CB-CB 4.07Å; C21-C24 PolarHBondContact SG-N 3.01Å; C21-C24 VanDerWaalsContact SG-SG 3.7Å; C24-D26 PolarHBondContact O-N 3.2Å; C24-L27 HydrophobicContact CB-CB 3.95Å; C24-L27 HydrophobicContact CB-CD2 4.43Å; C24-H43 VanDerWaalsContact SG-CA 3.57Å; C24-H43 PolarHBondContact SG-ND1 3.45Å; C24-H47 VanDerWaalsContact SG-CE1 3.57Å; C24-H47 PolarHBondContact SG-ND1 3.47Å
25	C	87.8	Confident	90.8	Very high	118 Å²	118	59.1 Å²	59.1	80%	0.797	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	133.1	178.7	-160.7	0	0	0	0	111.1	L27	C25-L27 PolarHBondContact O-N 3.22Å
26	D	86.5	Confident	91.7	Very high	113 Å²	113	61 Å²	61	60%	0.604	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	16.5	175	-65.5	-40.5	0	0	0	117.7	C24 K28	C24-D26 PolarHBondContact O-N 3.2Å; D26-K28 PolarHBondContact O-N 3.45Å
27	L	93.1	Very high	92.5	Very high	15 Å²	15	60.5 Å²	60.5	8%	0.079	33%	0.325	C	S	.	.			trans	-79.8	118.4	176.1	-168	89.3	0	0	0	110.9	Q20 C21 C24 C25 L29 L40 H43	Q20-L27 WeakPolarHBondContact CA-O 3.4Å; C21-L27 HydrophobicContact CB-CB 4.07Å; C21-L27 HydrophobicContact CB-CD2 3.91Å; C21-L27 PolarHBondContact N-O 2.95Å; C21-L27 VanDerWaalsContact N-O 3.11Å; C24-L27 HydrophobicContact CB-CB 3.95Å; C24-L27 HydrophobicContact CB-CD2 4.43Å; C25-L27 PolarHBondContact O-N 3.22Å; L27-L29 HydrophobicContact CD2-CG 4.4Å; L27-L40 HydrophobicContact CD1-CB 4.22Å; L27-H43 HydrophobicContact CD2-CB 3.94Å; L27-H43 WeakPolarHBondContact CD2-CD2 3.4Å; L27-H43 VanDerWaalsContact CD2-CE1 3.42Å; L27-H43 WeakPolarHBondContact CD2-CE1 3.33Å; L27-H43 WeakPolarHBondContact CD2-ND1 3.32Å; L27-H43 VanDerWaalsContact CD2-NE2 3.33Å; L27-H43 WeakPolarHBondContact CD2-NE2 3.12Å
28	K	93.5	Very high	92.8	Very high	51 Å²	51	56 Å²	56	22%	0.222	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.7	177.6	-60.7	169.7	-166.4	161.1	0	108.9	V5 C7 S8 F19 Q20 D26	V5-K28 HydrophobicContact CG1-CD 3.56Å; C7-K28 CarbonylContact C-O 3.45Å; C7-K28 WeakPolarHBondContact CA-O 3.39Å; S8-K28 PolarHBondContact N-O 3.43Å; S8-K28 PolarHBondContact OG-N 3.25Å; S8-K28 PolarHBondContact OG-O 2.99Å; F19-K28 WeakPolarHBondContact O-CA 3.42Å; Q20-K28 HydrophobicContact CG-CG 4.43Å; D26-K28 PolarHBondContact O-N 3.45Å
29	L	94.5	Very high	93	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.5	178.4	-60.5	178.4	0	0	0	110.2	N9 C18 F19 L27 C33 F34 A38 L40 Y49	N9-L29 HydrophobicContact CB-CD2 4.03Å; C18-L29 WeakPolarHBondContact CA-O 3.35Å; C18-L29 WeakPolarHBondContact CB-O 3.22Å; F19-L29 PolarHBondContact N-O 3.39Å; F19-L29 PolarHBondContact O-N 3.15Å; L27-L29 HydrophobicContact CD2-CG 4.4Å; L29-C33 HydrophobicContact CB-CB 4.43Å; L29-C33 HydrophobicContact CD2-CB 4.36Å; L29-F34 HydrophobicContact CB-CB 4.19Å; L29-F34 HydrophobicContact CD1-CD2 4.46Å; L29-A38 HydrophobicContact CD2-CB 4.44Å; L29-L40 HydrophobicContact CD2-CD1 4.47Å; L29-Y49 HydrophobicContact CD1-CE1 4.22Å
30	C	93.1	Very high	92.8	Very high	20 Å²	20	62 Å²	62	14%	0.135	34%	0.34	C	S	.	.			trans	-69.2	161.7	165.6	74.7	0	0	0	0	110	C7 I14 S32 C33 F34	C7-C30 HydrophobicContact CB-CB 4.06Å; C7-C30 PolarHBondContact SG-N 3.22Å; I14-C30 HydrophobicContact CD1-CB 4.01Å; I14-C30 HydrophobicContact CG1-CB 3.91Å; C30-S32 PolarHBondContact O-N 2.84Å; C30-C33 PolarHBondContact O-N 3.47Å; C30-C33 VanDerWaalsContact O-N 3.12Å; C30-C33 PolarHBondContact SG-N 3.16Å; C30-C33 VanDerWaalsContact SG-N 3.39Å; C30-C33 PolarHBondContact SG-SG 3.29Å; C30-F34 WeakPolarHBondContact O-CB 3.35Å; C30-F34 PolarHBondContact O-N 3.5Å
31	I	91.9	Very high	92.6	Very high	66 Å²	66	65.1 Å²	65.1	34%	0.338	38%	0.379	S	S	.	.	H	α-helix	trans	-54.2	-42.8	-177.9	-59.4	155.7	0	0	0	111.5	W17 F19 F34 R35	W17-I31 HydrophobicContact CD2-CD1 3.75Å; W17-I31 HydrophobicContact CD2-CG1 4.02Å; W17-I31 HydrophobicContact CE3-CD1 4.34Å; W17-I31 HydrophobicContact CE3-CG1 4.17Å; W17-I31 HydrophobicContact CG-CD1 4.27Å; W17-I31 HydrophobicContact CH2-CD1 4.06Å; W17-I31 HydrophobicContact CH2-CG1 4.2Å; W17-I31 HydrophobicContact CZ2-CD1 3.42Å; W17-I31 VanDerWaalsContact CZ2-CD1 3.42Å; W17-I31 HydrophobicContact CZ2-CG1 4.04Å; W17-I31 HydrophobicContact CZ3-CD1 4.49Å; W17-I31 HydrophobicContact CZ3-CG1 4.27Å; F19-I31 HydrophobicContact CE2-CB 4.41Å; F19-I31 HydrophobicContact CE2-CG1 4.02Å; I31-F34 PolarHBondContact O-N 3.21Å; I31-R35 VanDerWaalsContact O-CB 3.28Å; I31-R35 WeakPolarHBondContact O-CB 3.3Å; I31-R35 PolarHBondContact O-N 2.91Å
32	S	92.7	Very high	92.5	Very high	85 Å²	85	69.9 Å²	69.9	59%	0.594	41%	0.412	S	S	*	.	H	α-helix	trans	-64.1	-45.3	179.4	-53.9	0	0	0	0	112.2	C30 R35 C36	C30-S32 PolarHBondContact O-N 2.84Å; S32-R35 PolarHBondContact O-N 3.24Å; S32-C36 PolarHBondContact O-N 3.44Å; S32-C36 PolarHBondContact O-SG 3.16Å
33	C	95.4	Very high	92.6	Very high	10 Å²	10	65.7 Å²	65.7	7%	0.068	39%	0.389	C	S	.	.	H	α-helix	trans	-69.4	-37.8	178.7	-69.9	0	0	0	0	112.2	C7 N9 C10 L29 C30 C36 G37 A38	C7-C33 VanDerWaalsContact SG-SG 3.67Å; N9-C33 HydrophobicContact CB-CB 4.12Å; N9-C33 PolarHBondContact ND2-SG 3.37Å; C10-C33 VanDerWaalsContact SG-SG 3.62Å; L29-C33 HydrophobicContact CB-CB 4.43Å; L29-C33 HydrophobicContact CD2-CB 4.36Å; C30-C33 PolarHBondContact O-N 3.47Å; C30-C33 VanDerWaalsContact O-N 3.12Å; C30-C33 PolarHBondContact SG-N 3.16Å; C30-C33 VanDerWaalsContact SG-N 3.39Å; C30-C33 PolarHBondContact SG-SG 3.29Å; C33-C36 PolarHBondContact O-N 2.8Å; C33-G37 PolarHBondContact O-N 3.43Å; C33-A38 HydrophobicContact CB-CB 4.17Å; C33-A38 WeakPolarHBondContact O-CB 3.09Å; C33-A38 PolarHBondContact O-N 3.4Å; C33-A38 VanDerWaalsContact O-N 3.07Å
34	F	94.6	Very high	92.6	Very high	70 Å²	70	65.9 Å²	65.9	31%	0.307	38%	0.384	S	S	.	.	H	α-helix	trans	-62.8	-45.9	174	-178.5	-100.4	0	0	0	111.2	F19 L29 C30 I31 C36 G37 Y49	F19-F34 HydrophobicContact CB-CB 4.33Å; F19-F34 HydrophobicContact CB-CD2 3.6Å; F19-F34 HydrophobicContact CB-CE2 4.08Å; F19-F34 HydrophobicContact CB-CG 3.99Å; F19-F34 AromaticContact CD1-CD1 3.93Å; F19-F34 HydrophobicContact CD1-CD1 3.93Å; F19-F34 AromaticContact CD1-CD2 3.96Å; F19-F34 HydrophobicContact CD1-CD2 3.96Å; F19-F34 AromaticContact CD1-CE1 3.85Å; F19-F34 HydrophobicContact CD1-CE1 3.85Å; F19-F34 AromaticContact CD1-CE2 3.89Å; F19-F34 HydrophobicContact CD1-CE2 3.89Å; F19-F34 AromaticContact CD1-CG 3.98Å; F19-F34 HydrophobicContact CD1-CG 3.98Å; F19-F34 AromaticContact CD1-CZ 3.84Å; F19-F34 HydrophobicContact CD1-CZ 3.84Å; F19-F34 HydrophobicContact CD2-CB 3.52Å; F19-F34 AromaticContact CD2-CD1 3.78Å; F19-F34 HydrophobicContact CD2-CD1 3.78Å; F19-F34 HydrophobicContact CD2-CD2 4.03Å; F19-F34 AromaticContact CD2-CG 3.48Å; F19-F34 HydrophobicContact CD2-CG 3.48Å; F19-F34 VanDerWaalsContact CD2-CG 3.48Å; F19-F34 AromaticContact CE1-CD1 3.84Å; F19-F34 HydrophobicContact CE1-CD1 3.84Å; F19-F34 AromaticContact CE1-CE1 3.69Å; F19-F34 HydrophobicContact CE1-CE1 3.69Å; F19-F34 HydrophobicContact CE1-CG 4.34Å; F19-F34 HydrophobicContact CE1-CZ 4.07Å; F19-F34 HydrophobicContact CE2-CB 4.01Å; F19-F34 AromaticContact CE2-CD1 3.7Å; F19-F34 HydrophobicContact CE2-CD1 3.7Å; F19-F34 HydrophobicContact CE2-CE1 4.39Å; F19-F34 AromaticContact CE2-CG 3.9Å; F19-F34 HydrophobicContact CE2-CG 3.9Å; F19-F34 HydrophobicContact CG-CB 4Å; F19-F34 AromaticContact CG-CD1 3.89Å; F19-F34 HydrophobicContact CG-CD1 3.89Å; F19-F34 AromaticContact CG-CD2 3.58Å; F19-F34 HydrophobicContact CG-CD2 3.58Å; F19-F34 HydrophobicContact CG-CE1 4.27Å; F19-F34 AromaticContact CG-CE2 3.99Å; F19-F34 HydrophobicContact CG-CE2 3.99Å; F19-F34 AromaticContact CG-CG 3.52Å; F19-F34 HydrophobicContact CG-CG 3.52Å; F19-F34 HydrophobicContact CG-CZ 4.31Å; F19-F34 AromaticContact CZ-CD1 3.72Å; F19-F34 HydrophobicContact CZ-CD1 3.72Å; F19-F34 AromaticContact CZ-CE1 3.98Å; F19-F34 HydrophobicContact CZ-CE1 3.98Å; F19-F34 HydrophobicContact CZ-CG 4.3Å; L29-F34 HydrophobicContact CB-CB 4.19Å; L29-F34 HydrophobicContact CD1-CD2 4.46Å; C30-F34 WeakPolarHBondContact O-CB 3.35Å; C30-F34 PolarHBondContact O-N 3.5Å; I31-F34 PolarHBondContact O-N 3.21Å; F34-C36 VanDerWaalsContact C-N 3.29Å; F34-C36 PolarHBondContact O-N 3.09Å; F34-G37 PolarHBondContact O-N 2.76Å; F34-Y49 HydrophobicContact CD2-CD1 4.37Å; F34-Y49 HydrophobicContact CD2-CE1 4.26Å; F34-Y49 HydrophobicContact CE2-CD1 4.01Å; F34-Y49 AromaticContact CE2-CD2 3.68Å; F34-Y49 HydrophobicContact CE2-CD2 3.68Å; F34-Y49 HydrophobicContact CE2-CE1 4.09Å; F34-Y49 AromaticContact CE2-CE2 3.76Å; F34-Y49 HydrophobicContact CE2-CE2 3.76Å; F34-Y49 AromaticContact CE2-CG 3.81Å; F34-Y49 HydrophobicContact CE2-CG 3.81Å; F34-Y49 AromaticContact CE2-CZ 3.95Å; F34-Y49 HydrophobicContact CZ-CD2 4.38Å
35	R	94.2	Very high	92.6	Very high	222 Å²	222	72.8 Å²	72.8	84%	0.838	41%	0.407	S	S	*	.	H	α-helix	trans	-59.5	-37.9	175.8	179.5	-177.6	170.9	-156.3	-2.4	112.6	I31 S32 G37	I31-R35 VanDerWaalsContact O-CB 3.28Å; I31-R35 WeakPolarHBondContact O-CB 3.3Å; I31-R35 PolarHBondContact O-N 2.91Å; S32-R35 PolarHBondContact O-N 3.24Å; R35-G37 PolarHBondContact O-N 3.18Å
36	C	94.8	Very high	92.9	Very high	111 Å²	111	73.3 Å²	73.3	75%	0.75	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-4.8	175.9	-67	0	0	0	0	113.5	S32 C33 F34	S32-C36 PolarHBondContact O-N 3.44Å; S32-C36 PolarHBondContact O-SG 3.16Å; C33-C36 PolarHBondContact O-N 2.8Å; F34-C36 VanDerWaalsContact C-N 3.29Å; F34-C36 PolarHBondContact O-N 3.09Å
37	G	93.9	Very high	93.4	Very high	23 Å²	23	69.7 Å²	69.7	24%	0.237	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	41.4	-177	0	0	0	0	0	112.5	C33 F34 R35 E39	C33-G37 PolarHBondContact O-N 3.43Å; F34-G37 PolarHBondContact O-N 2.76Å; R35-G37 PolarHBondContact O-N 3.18Å; G37-E39 PolarHBondContact O-N 2.92Å
38	A	93	Very high	93.4	Very high	11 Å²	11	72.7 Å²	72.7	9%	0.091	40%	0.403	C	S	.	.			trans	-57.6	124.1	-177.4	0	0	0	0	0	112.1	N9 L29 C33 L40 H43	N9-A38 HydrophobicContact CB-CB 4.24Å; L29-A38 HydrophobicContact CD2-CB 4.44Å; C33-A38 HydrophobicContact CB-CB 4.17Å; C33-A38 WeakPolarHBondContact O-CB 3.09Å; C33-A38 PolarHBondContact O-N 3.4Å; C33-A38 VanDerWaalsContact O-N 3.07Å; A38-L40 HydrophobicContact CB-CD1 4.05Å; A38-H43 PolarHBondContact O-CD2 3.33Å
39	E	93.8	Very high	93.4	Very high	103 Å²	103	72.6 Å²	72.6	48%	0.481	40%	0.401	S	S	.	.			trans	-111.3	125.5	176.9	-66.6	-173.9	160.3	0	0	109.4	G37 H43 R45	G37-E39 PolarHBondContact O-N 2.92Å; E39-H43 WeakPolarHBondContact CB-O 3.43Å; E39-R45 HydrophobicContact CG-CB 4.15Å; E39-R45 VanDerWaalsContact OE1-CG 3.3Å; E39-R45 WeakPolarHBondContact OE1-CG 3.21Å; E39-R45 PolarHBondContact OE1-N 2.96Å
40	L	89.3	Confident	93.3	Very high	47 Å²	47	79.1 Å²	79.1	25%	0.246	43%	0.426	C	S	.	.			trans	-129.7	117.4	-173.7	-84.1	87.3	0	0	0	111	S8 N9 L27 L29 A38 S42 H43	S8-L40 WeakPolarHBondContact O-CD2 3.44Å; N9-L40 HydrophobicContact CB-CD1 3.71Å; N9-L40 HydrophobicContact CB-CD2 4.27Å; L27-L40 HydrophobicContact CD1-CB 4.22Å; L29-L40 HydrophobicContact CD2-CD1 4.47Å; A38-L40 HydrophobicContact CB-CD1 4.05Å; L40-S42 PolarHBondContact O-N 3.26Å; L40-H43 WeakPolarHBondContact O-CB 3.26Å; L40-H43 PolarHBondContact O-N 3.31Å
41	G	89.9	Confident	93.2	Very high	90 Å²	90	82.5 Å²	82.5	93%	0.928	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-120	-179.7	0	0	0	0	0	111.4	H43	G41-H43 VanDerWaalsContact C-N 3.28Å
42	S	91.6	Very high	93	Very high	105 Å²	105	84.2 Å²	84.2	73%	0.734	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-0.5	175.8	58.1	0	0	0	0	114	L40	L40-S42 PolarHBondContact O-N 3.26Å
43	H	94	Very high	92.3	Very high	5 Å²	5	84.9 Å²	84.9	2%	0.023	45%	0.448	C	S	.	.			trans	-74.6	129.8	177.4	-178.1	58.8	0	0	0	111.7	C21 C24 L27 A38 E39 L40 G41 H47 Y49	C21-H43 VanDerWaalsContact SG-CE1 3.53Å; C24-H43 VanDerWaalsContact SG-CA 3.57Å; C24-H43 PolarHBondContact SG-ND1 3.45Å; L27-H43 HydrophobicContact CD2-CB 3.94Å; L27-H43 WeakPolarHBondContact CD2-CD2 3.4Å; L27-H43 VanDerWaalsContact CD2-CE1 3.42Å; L27-H43 WeakPolarHBondContact CD2-CE1 3.33Å; L27-H43 WeakPolarHBondContact CD2-ND1 3.32Å; L27-H43 VanDerWaalsContact CD2-NE2 3.33Å; L27-H43 WeakPolarHBondContact CD2-NE2 3.12Å; A38-H43 PolarHBondContact O-CD2 3.33Å; E39-H43 WeakPolarHBondContact CB-O 3.43Å; L40-H43 WeakPolarHBondContact O-CB 3.26Å; L40-H43 PolarHBondContact O-N 3.31Å; G41-H43 VanDerWaalsContact C-N 3.28Å; H43-H47 AromaticContact ND1-ND1 3.46Å; H43-H47 PolarHBondContact ND1-ND1 3.33Å; H43-Y49 AromaticContact CE1-CE1 3.46Å; H43-Y49 VanDerWaalsContact CE1-CE1 3.46Å; H43-Y49 WeakPolarHBondContact CE1-CE1 3.37Å; H43-Y49 AromaticContact CE1-CZ 3.41Å; H43-Y49 VanDerWaalsContact CE1-CZ 3.41Å; H43-Y49 PolarHBondContact CE1-OH 2.78Å; H43-Y49 AromaticContact NE2-CE1 3.59Å; H43-Y49 AromaticContact NE2-CZ 3.49Å; H43-Y49 PolarHBondContact NE2-OH 3.46Å
44	Q	94.6	Very high	91.4	Very high	98 Å²	98	86 Å²	86	46%	0.458	45%	0.453	S	S	.	.			trans	-114.2	145.9	170.4	-58.1	-175.3	7.6	0	0	110	I46 H47	Q44-I46 HydrophobicContact CB-CG1 3.79Å; Q44-I46 PolarHBondContact O-N 3.32Å; Q44-H47 WeakPolarHBondContact O-CB 3.41Å; Q44-H47 PolarHBondContact O-N 2.78Å
45	R	92.8	Very high	90.2	Very high	164 Å²	164	87.4 Å²	87.4	62%	0.619	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.6	179.7	73.3	-171.3	178.3	-137.7	-1.4	114	E39 Y49	E39-R45 HydrophobicContact CG-CB 4.15Å; E39-R45 VanDerWaalsContact OE1-CG 3.3Å; E39-R45 WeakPolarHBondContact OE1-CG 3.21Å; E39-R45 PolarHBondContact OE1-N 2.96Å; R45-Y49 WeakPolarHBondContact CA-OH 3.37Å
46	I	94.6	Very high	89	Confident	129 Å²	129	78 Å²	78	66%	0.662	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-5.2	179.8	62.6	162.3	0	0	0	113.4	Q44	Q44-I46 HydrophobicContact CB-CG1 3.79Å; Q44-I46 PolarHBondContact O-N 3.32Å
47	H	95.8	Very high	87.9	Confident	38 Å²	38	74.8 Å²	74.8	18%	0.176	41%	0.41	C	S	.	.	S	Bend	trans	-63.5	155	175.8	-70.1	178.4	0	0	0	111.1	V23 C24 H43 Q44 Y49	V23-H47 HydrophobicContact CB-CB 4.16Å; V23-H47 HydrophobicContact CG2-CB 3.94Å; C24-H47 VanDerWaalsContact SG-CE1 3.57Å; C24-H47 PolarHBondContact SG-ND1 3.47Å; H43-H47 AromaticContact ND1-ND1 3.46Å; H43-H47 PolarHBondContact ND1-ND1 3.33Å; Q44-H47 WeakPolarHBondContact O-CB 3.41Å; Q44-H47 PolarHBondContact O-N 2.78Å; H47-Y49 WeakPolarHBondContact O-CD2 3.37Å; H47-Y49 WeakPolarHBondContact O-CE2 3.3Å
48	S	94.4	Very high	87	Confident	78 Å²	78	76 Å²	76	55%	0.545	41%	0.412	S	S	.	.			trans	-72.4	141.4	172.7	-49.4	0	0	0	0	110.5	N22	N22-S48 WeakPolarHBondContact CB-O 3.39Å; N22-S48 PolarHBondContact N-O 2.86Å
49	Y	93.3	Very high	86.1	Confident	48 Å²	48	78.9 Å²	78.9	19%	0.188	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	157.5	178.2	-59.1	-97.1	0	0	0	111.3	F19 Q20 C21 L29 F34 H43 R45 H47	F19-Y49 HydrophobicContact CB-CD1 4.28Å; Q20-Y49 CarbonylContact O-C 3.59Å; Q20-Y49 VanDerWaalsContact O-CA 3.26Å; Q20-Y49 WeakPolarHBondContact O-CA 3.09Å; C21-Y49 HydrophobicContact CB-CD1 4.11Å; C21-Y49 HydrophobicContact CB-CE1 4.09Å; L29-Y49 HydrophobicContact CD1-CE1 4.22Å; F34-Y49 HydrophobicContact CD2-CD1 4.37Å; F34-Y49 HydrophobicContact CD2-CE1 4.26Å; F34-Y49 HydrophobicContact CE2-CD1 4.01Å; F34-Y49 AromaticContact CE2-CD2 3.68Å; F34-Y49 HydrophobicContact CE2-CD2 3.68Å; F34-Y49 HydrophobicContact CE2-CE1 4.09Å; F34-Y49 AromaticContact CE2-CE2 3.76Å; F34-Y49 HydrophobicContact CE2-CE2 3.76Å; F34-Y49 AromaticContact CE2-CG 3.81Å; F34-Y49 HydrophobicContact CE2-CG 3.81Å; F34-Y49 AromaticContact CE2-CZ 3.95Å; F34-Y49 HydrophobicContact CZ-CD2 4.38Å; H43-Y49 AromaticContact CE1-CE1 3.46Å; H43-Y49 VanDerWaalsContact CE1-CE1 3.46Å; H43-Y49 WeakPolarHBondContact CE1-CE1 3.37Å; H43-Y49 AromaticContact CE1-CZ 3.41Å; H43-Y49 VanDerWaalsContact CE1-CZ 3.41Å; H43-Y49 PolarHBondContact CE1-OH 2.78Å; H43-Y49 AromaticContact NE2-CE1 3.59Å; H43-Y49 AromaticContact NE2-CZ 3.49Å; H43-Y49 PolarHBondContact NE2-OH 3.46Å; R45-Y49 WeakPolarHBondContact CA-OH 3.37Å; H47-Y49 WeakPolarHBondContact O-CD2 3.37Å; H47-Y49 WeakPolarHBondContact O-CE2 3.3Å
50	R	92	Very high	85.4	Confident	139 Å²	139	76.7 Å²	76.7	53%	0.525	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.7	163.9	67.7	-176	-176.5	-170.7	-0.7	110.2	Q20 N22	Q20-R50 HydrophobicContact CB-CG 4.03Å; Q20-R50 PolarHBondContact N-O 3.1Å; Q20-R50 PolarHBondContact O-N 2.86Å; Q20-R50 VanDerWaalsContact OE1-NE 3.08Å; N22-R50 WeakPolarHBondContact OD1-CG 3.41Å
51	V	91	Very high	84.4	Confident	90 Å²	90	81.6 Å²	81.6	55%	0.545	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.4	172.3	-177.5	0	0	0	0	108.3	W17 F19	W17-V51 HydrophobicContact CB-CG1 4.44Å; W17-V51 HydrophobicContact CE3-CG1 4.17Å; F19-V51 HydrophobicContact CD1-CG2 4.12Å; F19-V51 HydrophobicContact CE1-CG2 3.87Å
52	R	86.3	Confident	83.2	Confident	102 Å²	102	80.3 Å²	80.3	39%	0.385	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	121.7	173.7	-177.3	176.6	-177.7	-100.6	-0.6	109	W17 C18	W17-R52 CarbonylContact C-O 3.59Å; W17-R52 VanDerWaalsContact CA-O 3.3Å; W17-R52 WeakPolarHBondContact CA-O 3.4Å; C18-R52 PolarHBondContact N-O 3.27Å; C18-R52 PolarHBondContact O-N 3.32Å
53	V	79.5	Confident	81.9	Confident	100 Å²	100	81 Å²	81	61%	0.606	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.7	125	167.4	-174.5	0	0	0	0	107.3	D55	V53-D55 WeakPolarHBondContact CG1-O 3.32Å
54	I	75.1	Confident	80.1	Confident	33 Å²	33	88 Å²	88	17%	0.169	45%	0.452	C	S	.	.			trans	-95.3	-48.8	-177.8	-66.8	160.4	0	0	0	109.3	V5 I14 T16 C18	V5-I54 HydrophobicContact CB-CD1 3.75Å; V5-I54 HydrophobicContact CB-CG1 4.12Å; V5-I54 HydrophobicContact CB-CG2 3.92Å; V5-I54 HydrophobicContact CG1-CD1 3.63Å; V5-I54 HydrophobicContact CG1-CG1 4.2Å; V5-I54 HydrophobicContact CG2-CD1 4.29Å; V5-I54 HydrophobicContact CG2-CG1 4.1Å; V5-I54 HydrophobicContact CG2-CG2 3.68Å; I14-I54 HydrophobicContact CB-CD1 3.61Å; I14-I54 HydrophobicContact CG2-CD1 3.47Å; I14-I54 VanDerWaalsContact CG2-CD1 3.47Å; T16-I54 PolarHBondContact O-N 3.32Å; C18-I54 HydrophobicContact CB-CD1 3.67Å
55	D	69.3	Low	78.2	Confident	100 Å²	100	91 Å²	91	54%	0.535	47%	0.471	S	S	.	.	S	Bend	trans	-142.6	165.5	174.9	-153.2	-12.7	0	0	0	109.3	A15 T16 V53	A15-D55 WeakPolarHBondContact O-CB 3.43Å; T16-D55 PolarHBondContact O-N 3.06Å; V53-D55 WeakPolarHBondContact CG1-O 3.32Å
56	S	70.3	Confident	76.3	Confident	23 Å²	23	88.4 Å²	88.4	16%	0.161	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-63.9	123.3	177.8	176.5	0	0	0	0	110.3	T73 L74 K75	S56-T73 WeakPolarHBondContact OG-CB 3.41Å; S56-L74 WeakPolarHBondContact OG-CA 3.44Å; S56-L74 WeakPolarHBondContact OG-CB 3.33Å; S56-L74 PolarHBondContact OG-N 2.87Å; S56-K75 PolarHBondContact OG-N 3.21Å
57	P	71.2	Confident	74.2	Confident	44 Å²	44	89.7 Å²	89.7	29%	0.286	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-63.6	149.6	-179	28	-34.9	0	0	0	111.6	T16 L74	T16-P57 HydrophobicContact CG2-CB 4.02Å; P57-L74 HydrophobicContact CG-CB 3.94Å; P57-L74 HydrophobicContact CG-CD2 3.74Å; P57-L74 WeakPolarHBondContact O-CA 3.26Å; P57-L74 WeakPolarHBondContact O-CB 3.22Å; P57-L74 PolarHBondContact O-N 2.81Å
58	V	74.8	Confident	72.1	Confident	49 Å²	49	95.9 Å²	95.9	30%	0.297	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-80.5	126.9	170.8	175.9	0	0	0	0	108.4	F60 P71 W72	V58-F60 WeakPolarHBondContact CG1-O 3.33Å; V58-P71 HydrophobicContact CG1-CB 3.99Å; V58-P71 HydrophobicContact CG2-CB 3.78Å; V58-P71 HydrophobicContact CG2-CG 4.09Å; V58-W72 WeakPolarHBondContact CA-O 3.47Å; V58-W72 WeakPolarHBondContact CG1-O 3.3Å
59	V	74.7	Confident	70.6	Confident	71 Å²	71	97.5 Å²	97.5	43%	0.43	50%	0.504	S	S	.	.	S	Bend	trans	-89.7	-50.2	-174.3	-177.2	0	0	0	0	111	L74 E77	V59-L74 HydrophobicContact CG2-CB 3.59Å; V59-L74 HydrophobicContact CG2-CD1 3.47Å; V59-L74 VanDerWaalsContact CG2-CD1 3.47Å; V59-L74 HydrophobicContact CG2-CG 4.1Å; V59-E77 HydrophobicContact CB-CG 4.38Å; V59-E77 HydrophobicContact CG2-CG 4.3Å
60	F	78.8	Confident	69.6	Low	58 Å²	58	101 Å²	101	25%	0.254	52%	0.521	S	S	.	.	S	Bend	trans	-97.6	111.9	174.2	-56.6	-71.7	0	0	0	108.5	V58 E77 C115 Y116	V58-F60 WeakPolarHBondContact CG1-O 3.33Å; F60-E77 HydrophobicContact CD2-CG 4.43Å; F60-E77 VanDerWaalsContact CD2-OE1 3.28Å; F60-E77 WeakPolarHBondContact CD2-OE1 3.44Å; F60-E77 HydrophobicContact CE2-CG 4.44Å; F60-C115 HydrophobicContact CD1-CB 4.28Å; F60-C115 HydrophobicContact CD2-CB 3.95Å; F60-C115 HydrophobicContact CE1-CB 4.08Å; F60-C115 HydrophobicContact CE2-CB 3.74Å; F60-C115 HydrophobicContact CG-CB 4.22Å; F60-C115 HydrophobicContact CZ-CB 3.81Å; F60-Y116 HydrophobicContact CE2-CE2 4.04Å; F60-Y116 AromaticContact CE2-CZ 3.89Å; F60-Y116 HydrophobicContact CZ-CE1 4.31Å; F60-Y116 HydrophobicContact CZ-CE2 4.45Å
61	L	68.7	Low	68.9	Low	149 Å²	149	97.2 Å²	97.2	78%	0.78	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-66.3	131.8	172.1	-66.9	171.9	0	0	0	108.3
62	P	64.7	Low	68.6	Low	63 Å²	63	93.9 Å²	93.9	41%	0.409	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-58.4	141.4	171.5	-3.2	10.7	0	0	0	109.2
63	D	63.3	Low	68.5	Low	120 Å²	120	90.5 Å²	90.5	64%	0.642	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-57.8	143.2	162.8	-69.5	-40.4	0	0	0	108.4	D65 K66	D63-D65 PolarHBondContact O-N 3.35Å; D63-K66 PolarHBondContact O-N 3.5Å
64	D	56.8	Low	68.7	Low	152 Å²	152	89.6 Å²	89.6	81%	0.813	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-49.6	-26.6	-174.8	-73.5	-39	0	0	0	113.3	L67	D64-L67 WeakPolarHBondContact O-CD1 3.25Å
65	D	54.4	Low	69.1	Low	160 Å²	160	95.6 Å²	95.6	86%	0.856	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-82.6	-9.4	-179.9	-77.5	-22.5	0	0	0	115.4	D63	D63-D65 PolarHBondContact O-N 3.35Å
66	K	54.1	Low	70	Confident	110 Å²	110	92.2 Å²	92.2	48%	0.478	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-107	31.3	-177.9	-66.3	-171.2	-176.5	178.4	0	113.9	D63 L68 H69 D114	D63-K66 PolarHBondContact O-N 3.5Å; K66-L68 PolarHBondContact O-N 3.01Å; K66-H69 PolarHBondContact O-N 3.36Å; K66-D114 IonicContact NZ-OD2 3.86Å
67	L	50.7	Low	71	Confident	156 Å²	156	91.3 Å²	91.3	82%	0.817	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-6.5	175.7	-80.7	160.7	0	0	0	115.7	D64	D64-L67 WeakPolarHBondContact O-CD1 3.25Å
68	L	50.3	Low	71.9	Confident	168 Å²	168	93.8 Å²	93.8	88%	0.88	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.6	-178.3	-68.5	170.8	0	0	0	113.9	K66	K66-L68 PolarHBondContact O-N 3.01Å
69	H	63.9	Low	72.5	Confident	112 Å²	112	96.2 Å²	96.2	52%	0.519	49%	0.488	S	S	.	.	S	Bend	trans	-106.4	142.9	-176.4	-69.7	-94.6	0	0	0	112.3	K66 E107	K66-H69 PolarHBondContact O-N 3.36Å; H69-E107 IonicContact CE1-OE1 3.77Å; H69-E107 IonicContact CG-OE1 3.84Å; H69-E107 IonicContact ND1-OE1 2.93Å; H69-E107 PolarHBondContact ND1-OE1 3.16Å
70	E	71.7	Confident	73.3	Confident	121 Å²	121	92.9 Å²	92.9	57%	0.565	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-61.8	127.1	173.5	-172.4	166.2	-157.9	0	0	109.1	R103	E70-R103 PolarHBondContact O-NH2 3.37Å
71	P	78.1	Confident	73.9	Confident	60 Å²	60	93.2 Å²	93.2	39%	0.39	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-64.4	147	-174.6	27.4	-35.7	0	0	0	111.1	V58 T73 R103	V58-P71 HydrophobicContact CG1-CB 3.99Å; V58-P71 HydrophobicContact CG2-CB 3.78Å; V58-P71 HydrophobicContact CG2-CG 4.09Å; P71-T73 PolarHBondContact O-N 2.73Å; P71-R103 PolarHBondContact O-NH2 3.17Å
72	W	85.1	Confident	75	Confident	20 Å²	20	90.2 Å²	90.2	8%	0.076	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-76	121.3	178.2	-74.2	77.5	0	0	0	111.1	V58 E76 E77 L80 I99 I108 H111	V58-W72 WeakPolarHBondContact CA-O 3.47Å; V58-W72 WeakPolarHBondContact CG1-O 3.3Å; W72-E76 HydrophobicContact CE3-CB 4.05Å; W72-E77 HydrophobicContact CB-CG 4.3Å; W72-E77 WeakPolarHBondContact CB-OE1 3.25Å; W72-L80 HydrophobicContact CH2-CD2 4.18Å; W72-L80 HydrophobicContact CZ3-CB 4.31Å; W72-L80 HydrophobicContact CZ3-CD2 3.91Å; W72-I99 HydrophobicContact CZ3-CG2 4.34Å; W72-I108 HydrophobicContact CH2-CB 4.4Å; W72-I108 HydrophobicContact CH2-CG1 3.96Å; W72-I108 HydrophobicContact CH2-CG2 4.27Å; W72-I108 HydrophobicContact CZ2-CG1 4.34Å; W72-H111 AromaticContact CD1-CE1 3.35Å; W72-H111 AromaticContact CD1-ND1 3.5Å; W72-H111 AromaticContact CD1-NE2 3.85Å; W72-H111 AromaticContact CD2-CD2 3.52Å; W72-H111 AromaticContact CD2-CE1 3.69Å; W72-H111 AromaticContact CD2-CG 3.93Å; W72-H111 AromaticContact CD2-NE2 3.35Å; W72-H111 AromaticContact CE2-CD2 3.33Å; W72-H111 AromaticContact CE2-CE1 3.76Å; W72-H111 AromaticContact CE2-CG 3.33Å; W72-H111 AromaticContact CE2-ND1 3.64Å; W72-H111 AromaticContact CE2-NE2 3.61Å; W72-H111 AromaticContact CE3-CD2 3.78Å; W72-H111 AromaticContact CE3-NE2 3.72Å; W72-H111 AromaticContact CG-CE1 3.45Å; W72-H111 VanDerWaalsContact CG-CE1 3.45Å; W72-H111 AromaticContact CG-ND1 4Å; W72-H111 AromaticContact CG-NE2 3.55Å; W72-H111 HydrophobicContact CH2-CB 4.34Å; W72-H111 AromaticContact CH2-CD2 3.7Å; W72-H111 HydrophobicContact CZ2-CB 3.58Å; W72-H111 AromaticContact CZ2-CD2 3.45Å; W72-H111 VanDerWaalsContact CZ2-CD2 3.45Å; W72-H111 WeakPolarHBondContact CZ2-CD2 3.49Å; W72-H111 AromaticContact CZ2-CG 3.47Å; W72-H111 VanDerWaalsContact CZ2-CG 3.47Å; W72-H111 AromaticContact CZ3-CD2 3.87Å; W72-H111 AromaticContact NE1-CD2 3.83Å; W72-H111 AromaticContact NE1-CE1 3.54Å; W72-H111 AromaticContact NE1-CG 3.42Å; W72-H111 AromaticContact NE1-ND1 3.26Å; W72-H111 PolarHBondContact NE1-ND1 2.99Å; W72-H111 AromaticContact NE1-NE2 3.88Å
73	T	83.6	Confident	76	Confident	32 Å²	32	87.4 Å²	87.4	20%	0.196	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-80.7	150.8	175.3	72.7	0	0	0	0	110.7	S56 P71 K75 E76 E77	S56-T73 WeakPolarHBondContact OG-CB 3.41Å; P71-T73 PolarHBondContact O-N 2.73Å; T73-K75 PolarHBondContact O-N 3.21Å; T73-K75 VanDerWaalsContact O-N 3.12Å; T73-E76 PolarHBondContact N-OE2 3.48Å; T73-E76 CarbonylContact O-C 3.6Å; T73-E76 WeakPolarHBondContact O-CA 3.35Å; T73-E76 WeakPolarHBondContact O-CB 3.4Å; T73-E76 PolarHBondContact O-N 3.15Å; T73-E76 WeakPolarHBondContact OG1-CG 3.36Å; T73-E76 PolarHBondContact OG1-N 3.43Å; T73-E77 WeakPolarHBondContact O-CG 3.46Å; T73-E77 PolarHBondContact O-N 3.03Å
74	L	83.5	Confident	77.3	Confident	80 Å²	80	82.3 Å²	82.3	42%	0.419	41%	0.409	S	S	.	.	H	α-helix	trans	-51.2	-36.1	174	173.1	65	0	0	0	112.6	S56 P57 V59 E77 L78	S56-L74 WeakPolarHBondContact OG-CA 3.44Å; S56-L74 WeakPolarHBondContact OG-CB 3.33Å; S56-L74 PolarHBondContact OG-N 2.87Å; P57-L74 HydrophobicContact CG-CB 3.94Å; P57-L74 HydrophobicContact CG-CD2 3.74Å; P57-L74 WeakPolarHBondContact O-CA 3.26Å; P57-L74 WeakPolarHBondContact O-CB 3.22Å; P57-L74 PolarHBondContact O-N 2.81Å; V59-L74 HydrophobicContact CG2-CB 3.59Å; V59-L74 HydrophobicContact CG2-CD1 3.47Å; V59-L74 VanDerWaalsContact CG2-CD1 3.47Å; V59-L74 HydrophobicContact CG2-CG 4.1Å; L74-E77 PolarHBondContact O-N 3.36Å; L74-L78 WeakPolarHBondContact O-CB 3.43Å; L74-L78 PolarHBondContact O-N 3.25Å
75	K	84.1	Confident	78.7	Confident	159 Å²	159	82.9 Å²	82.9	69%	0.691	41%	0.407	S	S	*	.	H	α-helix	trans	-65.7	-42.2	175.5	-172.3	-178.8	-179.9	-178.5	0	111.2	S56 T73 R79	S56-K75 PolarHBondContact OG-N 3.21Å; T73-K75 PolarHBondContact O-N 3.21Å; T73-K75 VanDerWaalsContact O-N 3.12Å; K75-R79 VanDerWaalsContact O-CB 3.26Å; K75-R79 WeakPolarHBondContact O-CB 3.32Å; K75-R79 PolarHBondContact O-N 3.34Å
76	E	87.5	Confident	80	Confident	30 Å²	30	78.7 Å²	78.7	14%	0.14	39%	0.394	C	S	.	.	H	α-helix	trans	-67.3	-40.5	174	-70.8	179.8	139.8	0	0	111.7	W72 T73 R79 L80 I99 N100 R103	W72-E76 HydrophobicContact CE3-CB 4.05Å; T73-E76 PolarHBondContact N-OE2 3.48Å; T73-E76 CarbonylContact O-C 3.6Å; T73-E76 WeakPolarHBondContact O-CA 3.35Å; T73-E76 WeakPolarHBondContact O-CB 3.4Å; T73-E76 PolarHBondContact O-N 3.15Å; T73-E76 WeakPolarHBondContact OG1-CG 3.36Å; T73-E76 PolarHBondContact OG1-N 3.43Å; E76-R79 PolarHBondContact O-N 2.74Å; E76-L80 WeakPolarHBondContact O-CB 3.24Å; E76-L80 PolarHBondContact O-N 3.37Å; E76-I99 HydrophobicContact CB-CG2 4.44Å; E76-N100 PolarHBondContact OE1-ND2 2.63Å; E76-R103 IonicContact OE1-CZ 2.76Å; E76-R103 IonicContact OE1-NH1 3.9Å; E76-R103 PolarHBondContact OE1-NH1 3.06Å; E76-R103 IonicContact OE2-CZ 3.24Å; E76-R103 IonicContact OE2-NH1 3.57Å; E76-R103 PolarHBondContact OE2-NH1 3.36Å; E76-R103 IonicContact OE2-NH2 3.96Å; E76-R103 PolarHBondContact OE2-NH2 2.79Å
77	E	90.6	Very high	81.2	Confident	3 Å²	3	77.3 Å²	77.3	1%	0.014	39%	0.388	C	S	.	.	H	α-helix	trans	-61.6	-47.6	175.4	-66.5	-63.8	171.5	0	0	112	V59 F60 W72 T73 L74 R79 L80 L81 H111 Y116	V59-E77 HydrophobicContact CB-CG 4.38Å; V59-E77 HydrophobicContact CG2-CG 4.3Å; F60-E77 HydrophobicContact CD2-CG 4.43Å; F60-E77 VanDerWaalsContact CD2-OE1 3.28Å; F60-E77 WeakPolarHBondContact CD2-OE1 3.44Å; F60-E77 HydrophobicContact CE2-CG 4.44Å; W72-E77 HydrophobicContact CB-CG 4.3Å; W72-E77 WeakPolarHBondContact CB-OE1 3.25Å; T73-E77 WeakPolarHBondContact O-CG 3.46Å; T73-E77 PolarHBondContact O-N 3.03Å; L74-E77 PolarHBondContact O-N 3.36Å; E77-R79 VanDerWaalsContact C-N 3.3Å; E77-R79 PolarHBondContact O-N 2.92Å; E77-L80 WeakPolarHBondContact O-CB 3.07Å; E77-L80 PolarHBondContact O-N 3.14Å; E77-L81 PolarHBondContact O-N 2.87Å; E77-L81 VanDerWaalsContact O-N 3.11Å; E77-H111 VanDerWaalsContact CD-NE2 3.33Å; E77-H111 IonicContact OE1-CD2 2.86Å; E77-H111 IonicContact OE1-CE1 3.36Å; E77-H111 PolarHBondContact OE1-CE1 2.65Å; E77-H111 VanDerWaalsContact OE1-CE1 3.24Å; E77-H111 IonicContact OE1-NE2 2.97Å; E77-H111 PolarHBondContact OE1-NE2 2.99Å; E77-H111 IonicContact OE2-CD2 2.74Å; E77-H111 IonicContact OE2-NE2 2.97Å; E77-H111 PolarHBondContact OE2-NE2 2.78Å; E77-Y116 WeakPolarHBondContact OE2-CE2 3.42Å; E77-Y116 PolarHBondContact OE2-OH 3.26Å
78	L	89.8	Confident	82.4	Confident	96 Å²	96	75.6 Å²	75.6	50%	0.503	38%	0.38	S	S	.	.	H	α-helix	trans	-62.5	-43.2	177.6	-172.6	67.2	0	0	0	110.3	L74 L80 L81 E82	L74-L78 WeakPolarHBondContact O-CB 3.43Å; L74-L78 PolarHBondContact O-N 3.25Å; L78-L80 VanDerWaalsContact C-N 3.3Å; L78-L80 PolarHBondContact O-N 3.32Å; L78-L81 PolarHBondContact O-N 3.34Å; L78-E82 WeakPolarHBondContact O-CG 3.28Å; L78-E82 PolarHBondContact O-N 2.8Å
79	R	89.2	Confident	83.8	Confident	101 Å²	101	72.6 Å²	72.6	38%	0.381	37%	0.365	S	S	.	.	H	α-helix	trans	-63.7	-37.2	177.6	-170.5	57.7	173.6	-179.7	3.4	112.1	K75 E76 E77 E82 T83 C98 I99	K75-R79 VanDerWaalsContact O-CB 3.26Å; K75-R79 WeakPolarHBondContact O-CB 3.32Å; K75-R79 PolarHBondContact O-N 3.34Å; E76-R79 PolarHBondContact O-N 2.74Å; E77-R79 VanDerWaalsContact C-N 3.3Å; E77-R79 PolarHBondContact O-N 2.92Å; R79-E82 IonicContact NH1-OE2 2.72Å; R79-E82 PolarHBondContact NH1-OE2 2.83Å; R79-T83 WeakPolarHBondContact O-CB 3.25Å; R79-T83 PolarHBondContact O-N 3.01Å; R79-T83 PolarHBondContact O-OG1 3.48Å; R79-C98 PolarHBondContact NE-O 2.86Å; R79-I99 HydrophobicContact CG-CG1 4.24Å
80	L	91.1	Very high	84.4	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.1	-51.9	174.4	170.2	62.2	0	0	0	110.8	W72 E76 E77 L78 T83 V84 V95 I99 I108 Y112 Y116	W72-L80 HydrophobicContact CH2-CD2 4.18Å; W72-L80 HydrophobicContact CZ3-CB 4.31Å; W72-L80 HydrophobicContact CZ3-CD2 3.91Å; E76-L80 WeakPolarHBondContact O-CB 3.24Å; E76-L80 PolarHBondContact O-N 3.37Å; E77-L80 WeakPolarHBondContact O-CB 3.07Å; E77-L80 PolarHBondContact O-N 3.14Å; L78-L80 VanDerWaalsContact C-N 3.3Å; L78-L80 PolarHBondContact O-N 3.32Å; L80-T83 PolarHBondContact O-N 3.47Å; L80-V84 HydrophobicContact CD1-CG2 3.83Å; L80-V84 WeakPolarHBondContact O-CB 3.37Å; L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.46Å; L80-V84 PolarHBondContact O-N 2.85Å; L80-V95 HydrophobicContact CD1-CG1 4Å; L80-I99 HydrophobicContact CB-CD1 3.75Å; L80-I99 HydrophobicContact CB-CG1 4.49Å; L80-I99 HydrophobicContact CD1-CD1 3.4Å; L80-I99 VanDerWaalsContact CD1-CD1 3.4Å; L80-I99 HydrophobicContact CG-CD1 4.18Å; L80-I108 HydrophobicContact CD1-CG2 3.6Å; L80-Y112 HydrophobicContact CD2-CD2 4.37Å; L80-Y112 HydrophobicContact CG-CD2 4.48Å; L80-Y116 HydrophobicContact CD2-CE2 4.18Å
81	L	91.8	Very high	85	Confident	66 Å²	66	67.1 Å²	67.1	35%	0.346	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-46.8	-179.4	-65.3	178.4	0	0	0	112.6	E77 L78 T83 V84 E85 Y112 Y116	E77-L81 PolarHBondContact O-N 2.87Å; E77-L81 VanDerWaalsContact O-N 3.11Å; L78-L81 PolarHBondContact O-N 3.34Å; L81-T83 VanDerWaalsContact C-N 3.26Å; L81-T83 PolarHBondContact O-N 3.27Å; L81-V84 PolarHBondContact O-N 3.24Å; L81-E85 WeakPolarHBondContact O-CB 3.27Å; L81-E85 PolarHBondContact O-N 3.5Å; L81-Y112 HydrophobicContact CD2-CE2 4.13Å; L81-Y116 HydrophobicContact CD1-CE1 3.79Å; L81-Y116 HydrophobicContact CD2-CD1 4.02Å; L81-Y116 HydrophobicContact CD2-CE1 3.7Å; L81-Y116 HydrophobicContact CD2-CE2 4.19Å; L81-Y116 HydrophobicContact CD2-CG 4.41Å; L81-Y116 HydrophobicContact CG-CE1 4.13Å
82	E	90.4	Very high	85.5	Confident	85 Å²	85	66.2 Å²	66.2	40%	0.397	34%	0.343	S	S	.	.	H	α-helix	trans	-58.5	-39.5	176.1	-71.1	172.5	175.3	0	0	112.1	L78 R79 A86	L78-E82 WeakPolarHBondContact O-CG 3.28Å; L78-E82 PolarHBondContact O-N 2.8Å; R79-E82 IonicContact NH1-OE2 2.72Å; R79-E82 PolarHBondContact NH1-OE2 2.83Å; E82-A86 PolarHBondContact O-N 3.32Å; E82-A86 VanDerWaalsContact O-N 3.13Å
83	T	87	Confident	85.6	Confident	5 Å²	5	71.9 Å²	71.9	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-75.2	-40.6	-177.5	-55.3	0	0	0	0	111.2	R79 L80 L81 E85 A86 F87 V95 C98	R79-T83 WeakPolarHBondContact O-CB 3.25Å; R79-T83 PolarHBondContact O-N 3.01Å; R79-T83 PolarHBondContact O-OG1 3.48Å; L80-T83 PolarHBondContact O-N 3.47Å; L81-T83 VanDerWaalsContact C-N 3.26Å; L81-T83 PolarHBondContact O-N 3.27Å; T83-E85 VanDerWaalsContact C-N 3.29Å; T83-E85 PolarHBondContact O-N 2.86Å; T83-A86 PolarHBondContact O-N 3.08Å; T83-A86 VanDerWaalsContact O-N 3.16Å; T83-F87 HydrophobicContact CG2-CD2 3.57Å; T83-F87 HydrophobicContact CG2-CE2 3.83Å; T83-F87 WeakPolarHBondContact O-CD2 3.29Å; T83-F87 PolarHBondContact O-N 3.16Å; T83-V95 HydrophobicContact CG2-CB 4.09Å; T83-V95 HydrophobicContact CG2-CG1 4.01Å; T83-V95 HydrophobicContact CG2-CG2 4.05Å; T83-C98 HydrophobicContact CG2-CB 3.65Å
84	V	89	Confident	85.6	Confident	13 Å²	13	72.7 Å²	72.7	8%	0.079	37%	0.374	C	S	.	.	H	α-helix	trans	-64.2	-36.5	174.6	170.4	0	0	0	0	111	L80 L81 A86 N88 L89 W92 V95 Y112	L80-V84 HydrophobicContact CD1-CG2 3.83Å; L80-V84 WeakPolarHBondContact O-CB 3.37Å; L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.46Å; L80-V84 PolarHBondContact O-N 2.85Å; L81-V84 PolarHBondContact O-N 3.24Å; V84-A86 VanDerWaalsContact C-N 3.34Å; V84-N88 CarbonylContact O-C 3.59Å; V84-N88 WeakPolarHBondContact O-CA 3.1Å; V84-N88 PolarHBondContact O-N 2.9Å; V84-L89 HydrophobicContact CG1-CD1 4.12Å; V84-W92 HydrophobicContact CG2-CH2 4.35Å; V84-W92 HydrophobicContact CG2-CZ3 3.77Å; V84-V95 HydrophobicContact CG2-CG1 4.17Å; V84-V95 HydrophobicContact CG2-CG2 4.3Å; V84-Y112 HydrophobicContact CG1-CE2 4.27Å
85	E	87	Confident	85.7	Confident	164 Å²	164	68.9 Å²	68.9	77%	0.766	35%	0.354	S	S	*	.	H	α-helix	trans	-62.6	-39.7	172.1	-175	176.9	-162.7	0	0	111.9	L81 T83	L81-E85 WeakPolarHBondContact O-CB 3.27Å; L81-E85 PolarHBondContact O-N 3.5Å; T83-E85 VanDerWaalsContact C-N 3.29Å; T83-E85 PolarHBondContact O-N 2.86Å
86	A	81.1	Confident	85.8	Confident	72 Å²	72	63.8 Å²	63.8	60%	0.595	33%	0.333	S	S	*	.	H	α-helix	trans	-76.4	-40	-178.5	0	0	0	0	0	114.7	E82 T83 V84	E82-A86 PolarHBondContact O-N 3.32Å; E82-A86 VanDerWaalsContact O-N 3.13Å; T83-A86 PolarHBondContact O-N 3.08Å; T83-A86 VanDerWaalsContact O-N 3.16Å; V84-A86 VanDerWaalsContact C-N 3.34Å
87	F	79	Confident	85.7	Confident	80 Å²	80	69 Å²	69	35%	0.351	36%	0.355	S	S	.	.	H	α-helix	trans	-97.4	-5.7	-176.7	-69.7	-81.8	0	0	0	113.9	T83 D91 D94 V95	T83-F87 HydrophobicContact CG2-CD2 3.57Å; T83-F87 HydrophobicContact CG2-CE2 3.83Å; T83-F87 WeakPolarHBondContact O-CD2 3.29Å; T83-F87 PolarHBondContact O-N 3.16Å; F87-D91 HydrophobicContact CB-CB 4.44Å; F87-D94 HydrophobicContact CD1-CB 3.87Å; F87-D94 HydrophobicContact CE1-CB 3.95Å; F87-D94 HydrophobicContact CG-CB 4.32Å; F87-D94 HydrophobicContact CZ-CB 4.44Å; F87-V95 HydrophobicContact CB-CG2 4.27Å
88	N	77.5	Confident	85.4	Confident	120 Å²	120	71.1 Å²	71.1	64%	0.642	37%	0.37	S	S	*	.			trans	65.7	162	-167.8	-53	-76.3	0	0	0	113.9	V84 G90	V84-N88 CarbonylContact O-C 3.59Å; V84-N88 WeakPolarHBondContact O-CA 3.1Å; V84-N88 PolarHBondContact O-N 2.9Å; N88-G90 PolarHBondContact O-N 3.34Å
89	L	78.2	Confident	85.1	Confident	106 Å²	106	67.7 Å²	67.7	56%	0.555	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	125.3	178.7	-166.4	73.5	0	0	0	110.9	V84 W92 Y112	V84-L89 HydrophobicContact CG1-CD1 4.12Å; L89-W92 HydrophobicContact CD1-CH2 3.52Å; L89-W92 HydrophobicContact CD1-CZ2 3.57Å; L89-W92 HydrophobicContact CG-CZ2 4.27Å; L89-Y112 HydrophobicContact CD1-CD1 4.01Å; L89-Y112 HydrophobicContact CD1-CE1 3.5Å
90	G	77.1	Confident	84.6	Confident	50 Å²	50	64 Å²	64	52%	0.515	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	117.1	-19.4	174.6	0	0	0	0	0	115.2	N88 W92	N88-G90 PolarHBondContact O-N 3.34Å; G90-W92 PolarHBondContact O-N 3.37Å; G90-W92 VanDerWaalsContact O-N 3.09Å
91	D	84.3	Confident	84	Confident	68 Å²	68	68.9 Å²	68.9	36%	0.364	37%	0.371	S	S	.	.			trans	-87.7	53.9	176.2	-153.8	-14.8	0	0	0	112.4	F87 Q93 D94 V95	F87-D91 HydrophobicContact CB-CB 4.44Å; D91-Q93 PolarHBondContact O-N 3.49Å; D91-Q93 VanDerWaalsContact O-N 3.07Å; D91-D94 PolarHBondContact O-N 3.17Å; D91-D94 VanDerWaalsContact O-N 3.12Å; D91-V95 WeakPolarHBondContact O-CG2 3.46Å; D91-V95 PolarHBondContact O-N 2.99Å; D91-V95 VanDerWaalsContact O-N 3.1Å
92	W	87.9	Confident	83.6	Confident	40 Å²	40	73.8 Å²	73.8	15%	0.152	39%	0.39	C	S	.	.	H	α-helix	trans	-61	-22.7	-172.5	-58.1	118	0	0	0	113.7	V84 L89 G90 V95 Q96 A105 I108 S109 Y112	V84-W92 HydrophobicContact CG2-CH2 4.35Å; V84-W92 HydrophobicContact CG2-CZ3 3.77Å; L89-W92 HydrophobicContact CD1-CH2 3.52Å; L89-W92 HydrophobicContact CD1-CZ2 3.57Å; L89-W92 HydrophobicContact CG-CZ2 4.27Å; G90-W92 PolarHBondContact O-N 3.37Å; G90-W92 VanDerWaalsContact O-N 3.09Å; W92-V95 HydrophobicContact CE3-CB 4.41Å; W92-V95 HydrophobicContact CE3-CG1 4.29Å; W92-V95 HydrophobicContact CE3-CG2 4.47Å; W92-Q96 VanDerWaalsContact O-CB 3.28Å; W92-Q96 WeakPolarHBondContact O-CB 3.37Å; W92-Q96 PolarHBondContact O-N 3.24Å; W92-A105 HydrophobicContact CB-CB 3.96Å; W92-I108 HydrophobicContact CE3-CG2 4.19Å; W92-I108 HydrophobicContact CZ3-CG2 4.42Å; W92-S109 PolarHBondContact NE1-OG 3.1Å; W92-S109 VanDerWaalsContact NE1-OG 3.08Å; W92-Y112 AromaticContact CH2-CD1 3.74Å; W92-Y112 HydrophobicContact CH2-CD1 3.74Å; W92-Y112 HydrophobicContact CH2-CD2 4.36Å; W92-Y112 HydrophobicContact CH2-CE1 4.42Å; W92-Y112 AromaticContact CH2-CG 3.7Å; W92-Y112 HydrophobicContact CH2-CG 3.7Å; W92-Y112 HydrophobicContact CZ2-CD1 4.39Å; W92-Y112 HydrophobicContact CZ3-CG 4.31Å
93	Q	87.3	Confident	83.4	Confident	139 Å²	139	70.1 Å²	70.1	65%	0.65	37%	0.372	S	S	*	.	H	α-helix	trans	-69.3	-40.3	177.4	-65.2	-173.3	6.5	0	0	112.2	D91 K97	D91-Q93 PolarHBondContact O-N 3.49Å; D91-Q93 VanDerWaalsContact O-N 3.07Å; Q93-K97 WeakPolarHBondContact O-CG 3.45Å
94	D	83.7	Confident	83.5	Confident	49 Å²	49	73.1 Å²	73.1	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-79.4	-33.7	176.7	-76.6	-21.1	0	0	0	111.6	F87 D91 Q96 K97 C98	F87-D94 HydrophobicContact CD1-CB 3.87Å; F87-D94 HydrophobicContact CE1-CB 3.95Å; F87-D94 HydrophobicContact CG-CB 4.32Å; F87-D94 HydrophobicContact CZ-CB 4.44Å; D91-D94 PolarHBondContact O-N 3.17Å; D91-D94 VanDerWaalsContact O-N 3.12Å; D94-Q96 VanDerWaalsContact C-N 3.35Å; D94-Q96 PolarHBondContact O-N 2.85Å; D94-K97 PolarHBondContact O-N 3.43Å; D94-K97 IonicContact OD1-NZ 3.15Å; D94-K97 PolarHBondContact OD1-NZ 3.41Å; D94-C98 PolarHBondContact O-SG 2.96Å
95	V	85.8	Confident	83.5	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.006	39%	0.39	C	S	.	.	H	α-helix	trans	-58.9	-46	171.8	175.1	0	0	0	0	111.1	L80 T83 V84 F87 D91 W92 K97 C98 I99 I108	L80-V95 HydrophobicContact CD1-CG1 4Å; T83-V95 HydrophobicContact CG2-CB 4.09Å; T83-V95 HydrophobicContact CG2-CG1 4.01Å; T83-V95 HydrophobicContact CG2-CG2 4.05Å; V84-V95 HydrophobicContact CG2-CG1 4.17Å; V84-V95 HydrophobicContact CG2-CG2 4.3Å; F87-V95 HydrophobicContact CB-CG2 4.27Å; D91-V95 WeakPolarHBondContact O-CG2 3.46Å; D91-V95 PolarHBondContact O-N 2.99Å; D91-V95 VanDerWaalsContact O-N 3.1Å; W92-V95 HydrophobicContact CE3-CB 4.41Å; W92-V95 HydrophobicContact CE3-CG1 4.29Å; W92-V95 HydrophobicContact CE3-CG2 4.47Å; V95-K97 VanDerWaalsContact C-N 3.3Å; V95-K97 PolarHBondContact O-N 3.29Å; V95-C98 PolarHBondContact O-N 2.96Å; V95-C98 VanDerWaalsContact O-N 3.12Å; V95-I99 HydrophobicContact CG1-CD1 3.37Å; V95-I99 HydrophobicContact CG1-CG1 4.3Å; V95-I99 WeakPolarHBondContact O-CG1 3.24Å; V95-I99 PolarHBondContact O-N 2.96Å; V95-I108 HydrophobicContact CG1-CG2 4.13Å
96	Q	87.5	Confident	83.7	Confident	51 Å²	51	71.2 Å²	71.2	24%	0.238	38%	0.382	C	S	.	.	H	α-helix	trans	-55.8	-41.9	178.3	-175.6	-165.3	-26.8	0	0	113	W92 D94 C98 N100 R103 A105 I108	W92-Q96 VanDerWaalsContact O-CB 3.28Å; W92-Q96 WeakPolarHBondContact O-CB 3.37Å; W92-Q96 PolarHBondContact O-N 3.24Å; D94-Q96 VanDerWaalsContact C-N 3.35Å; D94-Q96 PolarHBondContact O-N 2.85Å; Q96-C98 PolarHBondContact O-N 3.41Å; Q96-N100 CarbonylContact O-C 3.56Å; Q96-N100 PolarHBondContact O-N 2.97Å; Q96-R103 WeakPolarHBondContact CG-O 3.46Å; Q96-R103 PolarHBondContact NE2-O 3.33Å; Q96-A105 HydrophobicContact CB-CB 4.46Å; Q96-I108 VanDerWaalsContact CA-CD1 3.5Å; Q96-I108 HydrophobicContact CB-CD1 3.73Å; Q96-I108 HydrophobicContact CG-CD1 3.77Å
97	K	85.7	Confident	84.1	Confident	139 Å²	139	69.9 Å²	69.9	60%	0.604	36%	0.364	S	S	*	.	H	α-helix	trans	-63.8	-30	-179	-66.3	168.2	-166	160.2	0	112.5	Q93 D94 V95	Q93-K97 WeakPolarHBondContact O-CG 3.45Å; D94-K97 PolarHBondContact O-N 3.43Å; D94-K97 IonicContact OD1-NZ 3.15Å; D94-K97 PolarHBondContact OD1-NZ 3.41Å; V95-K97 VanDerWaalsContact C-N 3.3Å; V95-K97 PolarHBondContact O-N 3.29Å
98	C	83.3	Confident	84.6	Confident	48 Å²	48	66.1 Å²	66.1	32%	0.324	35%	0.347	S	S	.	.	H	α-helix	trans	-92.2	-22	-173.4	-63.1	0	0	0	0	114.2	R79 T83 D94 V95 Q96	R79-C98 PolarHBondContact NE-O 2.86Å; T83-C98 HydrophobicContact CG2-CB 3.65Å; D94-C98 PolarHBondContact O-SG 2.96Å; V95-C98 PolarHBondContact O-N 2.96Å; V95-C98 VanDerWaalsContact O-N 3.12Å; Q96-C98 PolarHBondContact O-N 3.41Å
99	I	83.5	Confident	85.3	Confident	25 Å²	25	61.1 Å²	61.1	13%	0.128	32%	0.322	C	S	.	.	H	α-helix	trans	-93.2	-69.6	-178.2	-58.8	165	0	0	0	110.6	W72 E76 R79 L80 V95 I108	W72-I99 HydrophobicContact CZ3-CG2 4.34Å; E76-I99 HydrophobicContact CB-CG2 4.44Å; R79-I99 HydrophobicContact CG-CG1 4.24Å; L80-I99 HydrophobicContact CB-CD1 3.75Å; L80-I99 HydrophobicContact CB-CG1 4.49Å; L80-I99 HydrophobicContact CD1-CD1 3.4Å; L80-I99 VanDerWaalsContact CD1-CD1 3.4Å; L80-I99 HydrophobicContact CG-CD1 4.18Å; V95-I99 HydrophobicContact CG1-CD1 3.37Å; V95-I99 HydrophobicContact CG1-CG1 4.3Å; V95-I99 WeakPolarHBondContact O-CG1 3.24Å; V95-I99 PolarHBondContact O-N 2.96Å; I99-I108 HydrophobicContact CD1-CD1 4.43Å; I99-I108 HydrophobicContact CD1-CG2 4.13Å
100	N	79	Confident	85.9	Confident	22 Å²	22	59.2 Å²	59.2	12%	0.118	32%	0.316	C	S	.	.			trans	-157.1	109.2	-176.9	-174.7	-16.3	0	0	0	109.5	E76 Q96 K102 R103	E76-N100 PolarHBondContact OE1-ND2 2.63Å; Q96-N100 CarbonylContact O-C 3.56Å; Q96-N100 PolarHBondContact O-N 2.97Å; N100-K102 PolarHBondContact O-N 2.78Å; N100-K102 VanDerWaalsContact OD1-CB 3.27Å; N100-K102 WeakPolarHBondContact OD1-CB 3.42Å; N100-K102 WeakPolarHBondContact OD1-CG 3.34Å; N100-K102 PolarHBondContact OD1-N 3.25Å; N100-R103 PolarHBondContact ND2-NH1 3.35Å; N100-R103 PolarHBondContact O-N 2.85Å; N100-R103 VanDerWaalsContact O-N 3.16Å
101	P	78.2	Confident	86.5	Confident	103 Å²	103	58 Å²	58	67%	0.669	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-7	-177.5	26.5	-33.7	0	0	0	114
102	K	83.4	Confident	86.8	Confident	169 Å²	169	56.6 Å²	56.6	74%	0.735	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-26.1	174.5	-60.8	179.8	-179	175.6	0	113.4	N100	N100-K102 PolarHBondContact O-N 2.78Å; N100-K102 VanDerWaalsContact OD1-CB 3.27Å; N100-K102 WeakPolarHBondContact OD1-CB 3.42Å; N100-K102 WeakPolarHBondContact OD1-CG 3.34Å; N100-K102 PolarHBondContact OD1-N 3.25Å
103	R	87	Confident	86.9	Confident	9 Å²	9	58.6 Å²	58.6	3%	0.034	30%	0.298	C	S	.	.	S	Bend	trans	-86.5	152.7	176.8	-67.5	-164.2	176.5	88.5	-3.7	110.2	E70 P71 E76 Q96 N100 E107 I108	E70-R103 PolarHBondContact O-NH2 3.37Å; P71-R103 PolarHBondContact O-NH2 3.17Å; E76-R103 IonicContact OE1-CZ 2.76Å; E76-R103 IonicContact OE1-NH1 3.9Å; E76-R103 PolarHBondContact OE1-NH1 3.06Å; E76-R103 IonicContact OE2-CZ 3.24Å; E76-R103 IonicContact OE2-NH1 3.57Å; E76-R103 PolarHBondContact OE2-NH1 3.36Å; E76-R103 IonicContact OE2-NH2 3.96Å; E76-R103 PolarHBondContact OE2-NH2 2.79Å; Q96-R103 WeakPolarHBondContact CG-O 3.46Å; Q96-R103 PolarHBondContact NE2-O 3.33Å; N100-R103 PolarHBondContact ND2-NH1 3.35Å; N100-R103 PolarHBondContact O-N 2.85Å; N100-R103 VanDerWaalsContact O-N 3.16Å; R103-E107 WeakPolarHBondContact CB-OE2 3.36Å; R103-E107 IonicContact NE-OE1 2.98Å; R103-I108 HydrophobicContact CB-CD1 4.26Å; R103-I108 HydrophobicContact CB-CG1 4.12Å
104	T	88.5	Confident	87.1	Confident	68 Å²	68	55.8 Å²	55.8	42%	0.417	29%	0.287	S	S	.	.			trans	-87.4	155.9	176.3	70.8	0	0	0	0	111.4	E106 E107 I108	T104-E106 WeakPolarHBondContact CB-OE2 3.39Å; T104-E106 PolarHBondContact O-N 3.23Å; T104-E106 PolarHBondContact OG1-OE2 2.84Å; T104-E107 PolarHBondContact O-N 3.43Å; T104-E107 VanDerWaalsContact O-N 3.16Å; T104-E107 WeakPolarHBondContact OG1-CB 3.28Å; T104-E107 PolarHBondContact OG1-N 3.35Å; T104-I108 WeakPolarHBondContact O-CG1 3.25Å; T104-I108 PolarHBondContact O-N 3.44Å
105	A	89.6	Confident	87.3	Confident	7 Å²	7	54.2 Å²	54.2	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-38	176.3	0	0	0	0	0	111.7	W92 Q96 I108 S109	W92-A105 HydrophobicContact CB-CB 3.96Å; Q96-A105 HydrophobicContact CB-CB 4.46Å; A105-I108 PolarHBondContact O-N 3.06Å; A105-S109 WeakPolarHBondContact O-CB 3.43Å; A105-S109 PolarHBondContact O-N 3.32Å
106	E	89.8	Confident	87.5	Confident	130 Å²	130	55.8 Å²	55.8	61%	0.607	29%	0.286	S	S	*	.	H	α-helix	trans	-66.3	-42.3	176.8	-60.4	75.4	-163.8	0	0	111.7	T104 I108 S109 C110	T104-E106 WeakPolarHBondContact CB-OE2 3.39Å; T104-E106 PolarHBondContact O-N 3.23Å; T104-E106 PolarHBondContact OG1-OE2 2.84Å; E106-I108 VanDerWaalsContact C-N 3.31Å; E106-I108 PolarHBondContact O-N 3.02Å; E106-S109 PolarHBondContact O-N 3.19Å; E106-C110 WeakPolarHBondContact O-CB 3.44Å; E106-C110 PolarHBondContact O-N 3.23Å; E106-C110 PolarHBondContact O-SG 3.01Å
107	E	89.4	Confident	87.5	Confident	44 Å²	44	57.3 Å²	57.3	21%	0.206	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-41.5	176.1	-179	179.9	-171.4	0	0	111.2	H69 R103 T104 H111	H69-E107 IonicContact CE1-OE1 3.77Å; H69-E107 IonicContact CG-OE1 3.84Å; H69-E107 IonicContact ND1-OE1 2.93Å; H69-E107 PolarHBondContact ND1-OE1 3.16Å; R103-E107 WeakPolarHBondContact CB-OE2 3.36Å; R103-E107 IonicContact NE-OE1 2.98Å; T104-E107 PolarHBondContact O-N 3.43Å; T104-E107 VanDerWaalsContact O-N 3.16Å; T104-E107 WeakPolarHBondContact OG1-CB 3.28Å; T104-E107 PolarHBondContact OG1-N 3.35Å; E107-H111 VanDerWaalsContact O-CB 3.28Å; E107-H111 WeakPolarHBondContact O-CB 3.36Å; E107-H111 PolarHBondContact O-N 3.34Å
108	I	90.3	Very high	87.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-44.9	178.3	-64.1	172.4	0	0	0	111	W72 L80 W92 V95 Q96 I99 R103 T104 A105 E106 H111 Y112	W72-I108 HydrophobicContact CH2-CB 4.4Å; W72-I108 HydrophobicContact CH2-CG1 3.96Å; W72-I108 HydrophobicContact CH2-CG2 4.27Å; W72-I108 HydrophobicContact CZ2-CG1 4.34Å; L80-I108 HydrophobicContact CD1-CG2 3.6Å; W92-I108 HydrophobicContact CE3-CG2 4.19Å; W92-I108 HydrophobicContact CZ3-CG2 4.42Å; V95-I108 HydrophobicContact CG1-CG2 4.13Å; Q96-I108 VanDerWaalsContact CA-CD1 3.5Å; Q96-I108 HydrophobicContact CB-CD1 3.73Å; Q96-I108 HydrophobicContact CG-CD1 3.77Å; I99-I108 HydrophobicContact CD1-CD1 4.43Å; I99-I108 HydrophobicContact CD1-CG2 4.13Å; R103-I108 HydrophobicContact CB-CD1 4.26Å; R103-I108 HydrophobicContact CB-CG1 4.12Å; T104-I108 WeakPolarHBondContact O-CG1 3.25Å; T104-I108 PolarHBondContact O-N 3.44Å; A105-I108 PolarHBondContact O-N 3.06Å; E106-I108 VanDerWaalsContact C-N 3.31Å; E106-I108 PolarHBondContact O-N 3.02Å; I108-H111 PolarHBondContact O-N 3.35Å; I108-Y112 PolarHBondContact O-N 3.23Å
109	S	91.4	Very high	87.6	Confident	16 Å²	16	53.5 Å²	53.5	11%	0.112	28%	0.282	C	S	.	.	H	α-helix	trans	-59.7	-50.3	176.1	-173.8	0	0	0	0	111.1	W92 A105 E106 H111 Y112 E113	W92-S109 PolarHBondContact NE1-OG 3.1Å; W92-S109 VanDerWaalsContact NE1-OG 3.08Å; A105-S109 WeakPolarHBondContact O-CB 3.43Å; A105-S109 PolarHBondContact O-N 3.32Å; E106-S109 PolarHBondContact O-N 3.19Å; S109-H111 VanDerWaalsContact C-N 3.32Å; S109-H111 PolarHBondContact O-N 3.15Å; S109-Y112 PolarHBondContact O-N 3.17Å; S109-E113 WeakPolarHBondContact O-CG 3.37Å; S109-E113 PolarHBondContact O-N 3.26Å
110	C	91.2	Very high	87.7	Confident	66 Å²	66	63.4 Å²	63.4	45%	0.446	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-41.2	178.3	-72.8	0	0	0	0	111.6	E106 E113 D114	E106-C110 WeakPolarHBondContact O-CB 3.44Å; E106-C110 PolarHBondContact O-N 3.23Å; E106-C110 PolarHBondContact O-SG 3.01Å; C110-E113 PolarHBondContact O-N 3.39Å; C110-D114 VanDerWaalsContact O-CB 3.26Å; C110-D114 WeakPolarHBondContact O-CB 3.27Å; C110-D114 VanDerWaalsContact O-CG 3.32Å; C110-D114 PolarHBondContact O-N 3.06Å
111	H	90	Very high	88.1	Confident	23 Å²	23	66.2 Å²	66.2	11%	0.106	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-43.8	176.7	179.5	74.1	0	0	0	112.3	W72 E77 E107 I108 S109 E113 D114 C115	W72-H111 AromaticContact CD1-CE1 3.35Å; W72-H111 AromaticContact CD1-ND1 3.5Å; W72-H111 AromaticContact CD1-NE2 3.85Å; W72-H111 AromaticContact CD2-CD2 3.52Å; W72-H111 AromaticContact CD2-CE1 3.69Å; W72-H111 AromaticContact CD2-CG 3.93Å; W72-H111 AromaticContact CD2-NE2 3.35Å; W72-H111 AromaticContact CE2-CD2 3.33Å; W72-H111 AromaticContact CE2-CE1 3.76Å; W72-H111 AromaticContact CE2-CG 3.33Å; W72-H111 AromaticContact CE2-ND1 3.64Å; W72-H111 AromaticContact CE2-NE2 3.61Å; W72-H111 AromaticContact CE3-CD2 3.78Å; W72-H111 AromaticContact CE3-NE2 3.72Å; W72-H111 AromaticContact CG-CE1 3.45Å; W72-H111 VanDerWaalsContact CG-CE1 3.45Å; W72-H111 AromaticContact CG-ND1 4Å; W72-H111 AromaticContact CG-NE2 3.55Å; W72-H111 HydrophobicContact CH2-CB 4.34Å; W72-H111 AromaticContact CH2-CD2 3.7Å; W72-H111 HydrophobicContact CZ2-CB 3.58Å; W72-H111 AromaticContact CZ2-CD2 3.45Å; W72-H111 VanDerWaalsContact CZ2-CD2 3.45Å; W72-H111 WeakPolarHBondContact CZ2-CD2 3.49Å; W72-H111 AromaticContact CZ2-CG 3.47Å; W72-H111 VanDerWaalsContact CZ2-CG 3.47Å; W72-H111 AromaticContact CZ3-CD2 3.87Å; W72-H111 AromaticContact NE1-CD2 3.83Å; W72-H111 AromaticContact NE1-CE1 3.54Å; W72-H111 AromaticContact NE1-CG 3.42Å; W72-H111 AromaticContact NE1-ND1 3.26Å; W72-H111 PolarHBondContact NE1-ND1 2.99Å; W72-H111 AromaticContact NE1-NE2 3.88Å; E77-H111 VanDerWaalsContact CD-NE2 3.33Å; E77-H111 IonicContact OE1-CD2 2.86Å; E77-H111 IonicContact OE1-CE1 3.36Å; E77-H111 PolarHBondContact OE1-CE1 2.65Å; E77-H111 VanDerWaalsContact OE1-CE1 3.24Å; E77-H111 IonicContact OE1-NE2 2.97Å; E77-H111 PolarHBondContact OE1-NE2 2.99Å; E77-H111 IonicContact OE2-CD2 2.74Å; E77-H111 IonicContact OE2-NE2 2.97Å; E77-H111 PolarHBondContact OE2-NE2 2.78Å; E107-H111 VanDerWaalsContact O-CB 3.28Å; E107-H111 WeakPolarHBondContact O-CB 3.36Å; E107-H111 PolarHBondContact O-N 3.34Å; I108-H111 PolarHBondContact O-N 3.35Å; S109-H111 VanDerWaalsContact C-N 3.32Å; S109-H111 PolarHBondContact O-N 3.15Å; H111-E113 PolarHBondContact O-N 2.93Å; H111-D114 PolarHBondContact O-N 3.47Å; H111-C115 PolarHBondContact CE1-SG 3.41Å; H111-C115 VanDerWaalsContact O-CB 3.3Å; H111-C115 WeakPolarHBondContact O-CB 3.31Å; H111-C115 PolarHBondContact O-N 3.27Å
112	Y	91.2	Very high	88.5	Confident	39 Å²	39	61.5 Å²	61.5	15%	0.153	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-47.2	176	-178.5	-90.2	0	0	0	111.2	L80 L81 V84 L89 W92 I108 S109 Y116 L117	L80-Y112 HydrophobicContact CD2-CD2 4.37Å; L80-Y112 HydrophobicContact CG-CD2 4.48Å; L81-Y112 HydrophobicContact CD2-CE2 4.13Å; V84-Y112 HydrophobicContact CG1-CE2 4.27Å; L89-Y112 HydrophobicContact CD1-CD1 4.01Å; L89-Y112 HydrophobicContact CD1-CE1 3.5Å; W92-Y112 AromaticContact CH2-CD1 3.74Å; W92-Y112 HydrophobicContact CH2-CD1 3.74Å; W92-Y112 HydrophobicContact CH2-CD2 4.36Å; W92-Y112 HydrophobicContact CH2-CE1 4.42Å; W92-Y112 AromaticContact CH2-CG 3.7Å; W92-Y112 HydrophobicContact CH2-CG 3.7Å; W92-Y112 HydrophobicContact CZ2-CD1 4.39Å; W92-Y112 HydrophobicContact CZ3-CG 4.31Å; I108-Y112 PolarHBondContact O-N 3.23Å; S109-Y112 PolarHBondContact O-N 3.17Å; Y112-Y116 AromaticContact CD2-CD2 3.92Å; Y112-Y116 HydrophobicContact CD2-CD2 3.92Å; Y112-Y116 HydrophobicContact CD2-CG 4.35Å; Y112-Y116 HydrophobicContact CE2-CD2 4.35Å; Y112-Y116 HydrophobicContact CE2-CG 4.35Å; Y112-Y116 HydrophobicContact CG-CD2 4.47Å; Y112-Y116 WeakPolarHBondContact O-CA 3.39Å; Y112-Y116 VanDerWaalsContact O-CB 3.32Å; Y112-Y116 WeakPolarHBondContact O-CB 3.48Å; Y112-Y116 PolarHBondContact O-N 3.35Å; Y112-L117 HydrophobicContact CD1-CD1 4.35Å; Y112-L117 HydrophobicContact CD1-CG 4.31Å; Y112-L117 HydrophobicContact CE1-CD1 4.11Å; Y112-L117 HydrophobicContact CE1-CD2 4.11Å; Y112-L117 HydrophobicContact CE1-CG 3.99Å
113	E	90.2	Very high	88.7	Confident	82 Å²	82	59.3 Å²	59.3	38%	0.383	29%	0.293	S	S	.	.	I	π-helix	trans	-62.1	-49.1	176.9	-70.5	-179.6	-167.6	0	0	111.9	S109 C110 H111 C115 L117 N118	S109-E113 WeakPolarHBondContact O-CG 3.37Å; S109-E113 PolarHBondContact O-N 3.26Å; C110-E113 PolarHBondContact O-N 3.39Å; H111-E113 PolarHBondContact O-N 2.93Å; E113-C115 PolarHBondContact O-N 3.32Å; E113-L117 HydrophobicContact CG-CD1 4.16Å; E113-L117 WeakPolarHBondContact O-CB 3.39Å; E113-L117 PolarHBondContact O-N 3.39Å; E113-N118 WeakPolarHBondContact O-CB 3.32Å; E113-N118 PolarHBondContact O-N 2.95Å
114	D	89.5	Confident	88.7	Confident	80 Å²	80	65.3 Å²	65.3	43%	0.428	32%	0.321	S	S	.	.	I	π-helix	trans	-66	-36.1	-176.5	-79.3	-8.6	0	0	0	112.5	K66 C110 H111 G119	K66-D114 IonicContact NZ-OD2 3.86Å; C110-D114 VanDerWaalsContact O-CB 3.26Å; C110-D114 WeakPolarHBondContact O-CB 3.27Å; C110-D114 VanDerWaalsContact O-CG 3.32Å; C110-D114 PolarHBondContact O-N 3.06Å; H111-D114 PolarHBondContact O-N 3.47Å; D114-G119 WeakPolarHBondContact O-CA 3.25Å; D114-G119 PolarHBondContact O-N 3.27Å
115	C	88.5	Confident	88.6	Confident	17 Å²	17	66.4 Å²	66.4	12%	0.115	33%	0.328	C	S	.	.	I	π-helix	trans	-92.5	-46.8	-176	-66.2	0	0	0	0	113	F60 H111 E113 G119	F60-C115 HydrophobicContact CD1-CB 4.28Å; F60-C115 HydrophobicContact CD2-CB 3.95Å; F60-C115 HydrophobicContact CE1-CB 4.08Å; F60-C115 HydrophobicContact CE2-CB 3.74Å; F60-C115 HydrophobicContact CG-CB 4.22Å; F60-C115 HydrophobicContact CZ-CB 3.81Å; H111-C115 PolarHBondContact CE1-SG 3.41Å; H111-C115 VanDerWaalsContact O-CB 3.3Å; H111-C115 WeakPolarHBondContact O-CB 3.31Å; H111-C115 PolarHBondContact O-N 3.27Å; E113-C115 PolarHBondContact O-N 3.32Å; C115-G119 WeakPolarHBondContact O-CA 3.35Å
116	Y	89.7	Confident	88.2	Confident	34 Å²	34	68.3 Å²	68.3	13%	0.133	34%	0.341	C	S	.	.	I	π-helix	trans	-98.6	-23.1	-169.4	-65.9	-84.4	0	0	0	114.3	F60 E77 L80 L81 Y112 L121 G122	F60-Y116 HydrophobicContact CE2-CE2 4.04Å; F60-Y116 AromaticContact CE2-CZ 3.89Å; F60-Y116 HydrophobicContact CZ-CE1 4.31Å; F60-Y116 HydrophobicContact CZ-CE2 4.45Å; E77-Y116 WeakPolarHBondContact OE2-CE2 3.42Å; E77-Y116 PolarHBondContact OE2-OH 3.26Å; L80-Y116 HydrophobicContact CD2-CE2 4.18Å; L81-Y116 HydrophobicContact CD1-CE1 3.79Å; L81-Y116 HydrophobicContact CD2-CD1 4.02Å; L81-Y116 HydrophobicContact CD2-CE1 3.7Å; L81-Y116 HydrophobicContact CD2-CE2 4.19Å; L81-Y116 HydrophobicContact CD2-CG 4.41Å; L81-Y116 HydrophobicContact CG-CE1 4.13Å; Y112-Y116 AromaticContact CD2-CD2 3.92Å; Y112-Y116 HydrophobicContact CD2-CD2 3.92Å; Y112-Y116 HydrophobicContact CD2-CG 4.35Å; Y112-Y116 HydrophobicContact CE2-CD2 4.35Å; Y112-Y116 HydrophobicContact CE2-CG 4.35Å; Y112-Y116 HydrophobicContact CG-CD2 4.47Å; Y112-Y116 WeakPolarHBondContact O-CA 3.39Å; Y112-Y116 VanDerWaalsContact O-CB 3.32Å; Y112-Y116 WeakPolarHBondContact O-CB 3.48Å; Y112-Y116 PolarHBondContact O-N 3.35Å; Y116-L121 HydrophobicContact CD1-CD2 3.68Å; Y116-L121 HydrophobicContact CE1-CD2 3.9Å; Y116-G122 WeakPolarHBondContact O-CA 3.49Å; Y116-G122 PolarHBondContact O-N 2.97Å
117	L	87.4	Confident	87.8	Confident	83 Å²	83	67.2 Å²	67.2	44%	0.435	34%	0.339	S	S	.	.	I	π-helix	trans	-105.7	-58.5	178.2	-56.2	-175.5	0	0	0	112	Y112 E113 G122	Y112-L117 HydrophobicContact CD1-CD1 4.35Å; Y112-L117 HydrophobicContact CD1-CG 4.31Å; Y112-L117 HydrophobicContact CE1-CD1 4.11Å; Y112-L117 HydrophobicContact CE1-CD2 4.11Å; Y112-L117 HydrophobicContact CE1-CG 3.99Å; E113-L117 HydrophobicContact CG-CD1 4.16Å; E113-L117 WeakPolarHBondContact O-CB 3.39Å; E113-L117 PolarHBondContact O-N 3.39Å; L117-G122 CarbonylContact O-C 3.54Å; L117-G122 WeakPolarHBondContact O-CA 3.32Å
118	N	85.6	Confident	87.1	Confident	94 Å²	94	68.8 Å²	68.8	50%	0.503	37%	0.367	S	S	.	.	S	Bend	trans	-91.1	-11.9	-175.7	-61.6	-42.9	0	0	0	113	E113 K123	E113-N118 WeakPolarHBondContact O-CB 3.32Å; E113-N118 PolarHBondContact O-N 2.95Å; N118-K123 WeakPolarHBondContact O-CE 3.32Å; N118-K123 PolarHBondContact O-NZ 3.47Å
119	G	85.9	Confident	86.3	Confident	13 Å²	13	73.3 Å²	73.3	13%	0.134	39%	0.391	C	S	.	.	S	Bend	trans	-74.1	-179.2	179.8	0	0	0	0	0	113.2	D114 C115 L121 G122 K123	D114-G119 WeakPolarHBondContact O-CA 3.25Å; D114-G119 PolarHBondContact O-N 3.27Å; C115-G119 WeakPolarHBondContact O-CA 3.35Å; G119-L121 VanDerWaalsContact C-N 3.27Å; G119-L121 PolarHBondContact O-N 2.93Å; G119-G122 PolarHBondContact O-N 3.07Å; G119-K123 WeakPolarHBondContact O-CB 3.5Å; G119-K123 WeakPolarHBondContact O-CG 3.14Å; G119-K123 PolarHBondContact O-N 3.17Å
120	R	86.3	Confident	85.2	Confident	233 Å²	233	79 Å²	79	88%	0.879	43%	0.425	S	S	*	.	H	α-helix	trans	-60.5	-40	177.7	-65.3	-172.9	-170.3	-171.3	4.5	111.7	E124	R120-E124 WeakPolarHBondContact O-CB 3.31Å; R120-E124 PolarHBondContact O-N 2.91Å
121	L	86.9	Confident	84.1	Confident	80 Å²	80	84.5 Å²	84.5	42%	0.419	44%	0.438	S	S	.	.	H	α-helix	trans	-64.2	-52.4	179.2	-177.1	65.1	0	0	0	110.9	Y116 G119 K123 E124 V125	Y116-L121 HydrophobicContact CD1-CD2 3.68Å; Y116-L121 HydrophobicContact CE1-CD2 3.9Å; G119-L121 VanDerWaalsContact C-N 3.27Å; G119-L121 PolarHBondContact O-N 2.93Å; L121-K123 VanDerWaalsContact C-N 3.34Å; L121-K123 PolarHBondContact O-N 3.28Å; L121-E124 PolarHBondContact O-N 3.07Å; L121-V125 HydrophobicContact CD1-CG2 4.22Å; L121-V125 HydrophobicContact CG-CG2 4.42Å; L121-V125 VanDerWaalsContact O-CG2 3.3Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.34Å
122	G	87.5	Confident	83.1	Confident	5 Å²	5	87.1 Å²	87.1	5%	0.052	46%	0.463	C	S	.	.	H	α-helix	trans	-59.5	-42.7	179.3	0	0	0	0	0	113.2	Y116 L117 G119 E124 V125 S126	Y116-G122 WeakPolarHBondContact O-CA 3.49Å; Y116-G122 PolarHBondContact O-N 2.97Å; L117-G122 CarbonylContact O-C 3.54Å; L117-G122 WeakPolarHBondContact O-CA 3.32Å; G119-G122 PolarHBondContact O-N 3.07Å; G122-E124 PolarHBondContact O-N 3.13Å; G122-V125 PolarHBondContact O-N 3.47Å; G122-S126 WeakPolarHBondContact O-CB 3.27Å; G122-S126 PolarHBondContact O-N 2.95Å; G122-S126 PolarHBondContact O-OG 3.19Å; G122-S126 VanDerWaalsContact O-OG 3.07Å
123	K	87.5	Confident	81.9	Confident	122 Å²	122	94.3 Å²	94.3	53%	0.53	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-47.4	174.2	-74.6	169.9	178.6	155.1	0	112	N118 G119 L121 S126 N127	N118-K123 WeakPolarHBondContact O-CE 3.32Å; N118-K123 PolarHBondContact O-NZ 3.47Å; G119-K123 WeakPolarHBondContact O-CB 3.5Å; G119-K123 WeakPolarHBondContact O-CG 3.14Å; G119-K123 PolarHBondContact O-N 3.17Å; L121-K123 VanDerWaalsContact C-N 3.34Å; L121-K123 PolarHBondContact O-N 3.28Å; K123-S126 WeakPolarHBondContact CA-OG 3.23Å; K123-S126 CarbonylContact O-C 3.54Å; K123-S126 PolarHBondContact O-N 3.37Å; K123-S126 PolarHBondContact O-OG 2.92Å; K123-N127 WeakPolarHBondContact O-CB 3.37Å; K123-N127 PolarHBondContact O-N 3.36Å; K123-N127 PolarHBondContact O-ND2 3.23Å; K123-N127 PolarHBondContact O-OD1 2.96Å
124	E	87.5	Confident	80.9	Confident	135 Å²	135	97.5 Å²	97.5	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-68.7	-37.8	-179.2	-164	62.6	-170	0	0	112.8	R120 L121 G122 S126 N127	R120-E124 WeakPolarHBondContact O-CB 3.31Å; R120-E124 PolarHBondContact O-N 2.91Å; L121-E124 PolarHBondContact O-N 3.07Å; G122-E124 PolarHBondContact O-N 3.13Å; E124-S126 VanDerWaalsContact C-N 3.33Å; E124-N127 PolarHBondContact O-N 3.45Å; E124-N127 PolarHBondContact OE2-ND2 3.34Å; E124-N127 VanDerWaalsContact OE2-ND2 3.15Å
125	V	85.2	Confident	79.9	Confident	92 Å²	92	97.4 Å²	97.4	56%	0.558	52%	0.521	S	S	*	.	H	α-helix	trans	-67.7	-36.9	173.9	174.3	0	0	0	0	111	L121 G122 N127 L129	L121-V125 HydrophobicContact CD1-CG2 4.22Å; L121-V125 HydrophobicContact CG-CG2 4.42Å; L121-V125 VanDerWaalsContact O-CG2 3.3Å; L121-V125 WeakPolarHBondContact O-CG2 3.47Å; L121-V125 PolarHBondContact O-N 3.34Å; G122-V125 PolarHBondContact O-N 3.47Å; V125-N127 VanDerWaalsContact C-N 3.35Å; V125-L129 WeakPolarHBondContact O-CD1 3.39Å; V125-L129 WeakPolarHBondContact O-CG 3.3Å
126	S	82	Confident	78.5	Confident	46 Å²	46	100.7 Å²	100.7	32%	0.322	54%	0.538	S	S	.	.	H	α-helix	trans	-75	-23.2	177.1	74.9	0	0	0	0	113.6	G122 K123 E124 G128 L129	G122-S126 WeakPolarHBondContact O-CB 3.27Å; G122-S126 PolarHBondContact O-N 2.95Å; G122-S126 PolarHBondContact O-OG 3.19Å; G122-S126 VanDerWaalsContact O-OG 3.07Å; K123-S126 WeakPolarHBondContact CA-OG 3.23Å; K123-S126 CarbonylContact O-C 3.54Å; K123-S126 PolarHBondContact O-N 3.37Å; K123-S126 PolarHBondContact O-OG 2.92Å; E124-S126 VanDerWaalsContact C-N 3.33Å; S126-G128 PolarHBondContact O-N 2.72Å; S126-L129 PolarHBondContact O-N 2.9Å
127	N	80.5	Confident	77.2	Confident	108 Å²	108	105.9 Å²	105.9	58%	0.578	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	104.4	178.2	-78.4	-20.3	0	0	0	109.2	K123 E124 V125	K123-N127 WeakPolarHBondContact O-CB 3.37Å; K123-N127 PolarHBondContact O-N 3.36Å; K123-N127 PolarHBondContact O-ND2 3.23Å; K123-N127 PolarHBondContact O-OD1 2.96Å; E124-N127 PolarHBondContact O-N 3.45Å; E124-N127 PolarHBondContact OE2-ND2 3.34Å; E124-N127 VanDerWaalsContact OE2-ND2 3.15Å; V125-N127 VanDerWaalsContact C-N 3.35Å
128	G	74.3	Confident	75.9	Confident	76 Å²	76	107.1 Å²	107.1	78%	0.784	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	103.5	-6.9	-177.4	0	0	0	0	0	114.3	S126 T130	S126-G128 PolarHBondContact O-N 2.72Å; G128-T130 PolarHBondContact O-N 3.48Å; G128-T130 VanDerWaalsContact O-N 3.11Å
129	L	73.7	Confident	74.3	Confident	96 Å²	96	106.5 Å²	106.5	50%	0.503	58%	0.577	S	S	.	*			trans	-76.3	97.4	166.4	-67.5	179.6	0	0	0	108.8	V125 S126 Y131	V125-L129 WeakPolarHBondContact O-CD1 3.39Å; V125-L129 WeakPolarHBondContact O-CG 3.3Å; S126-L129 PolarHBondContact O-N 2.9Å; L129-Y131 PolarHBondContact O-N 2.87Å; L129-Y131 VanDerWaalsContact O-N 3.1Å
130	T	69.6	Low	72.4	Confident	136 Å²	136	111.5 Å²	111.5	83%	0.834	61%	0.605	S	S	*	*			trans	-72.4	98.2	159.4	46.1	0	0	0	0	107.3	G128 A132	G128-T130 PolarHBondContact O-N 3.48Å; G128-T130 VanDerWaalsContact O-N 3.11Å; T130-A132 PolarHBondContact O-N 3.48Å
131	Y	67.6	Low	70.3	Confident	181 Å²	181	107.4 Å²	107.4	71%	0.71	59%	0.594	S	S	*	*			trans	-54.5	132.1	161.9	-70.6	-84.8	0	0	0	107.5	L129 Q133	L129-Y131 PolarHBondContact O-N 2.87Å; L129-Y131 VanDerWaalsContact O-N 3.1Å; Y131-Q133 PolarHBondContact O-N 2.89Å; Y131-Q133 VanDerWaalsContact O-N 3.08Å
132	A	69.8	Low	68.3	Low	77 Å²	77	109.2 Å²	109.2	64%	0.636	61%	0.614	S	S	*	*			trans	-52.5	124.4	169.3	0	0	0	0	0	107	T130 I134	T130-A132 PolarHBondContact O-N 3.48Å; A132-I134 HydrophobicContact CB-CG1 3.91Å; A132-I134 PolarHBondContact O-N 3.44Å
133	Q	64.3	Low	66	Low	191 Å²	191	111.9 Å²	111.9	89%	0.893	63%	0.631	S	S	*	*			trans	-70.4	79.7	168.4	-72	-167.5	-30.6	0	0	107	Y131 S135	Y131-Q133 PolarHBondContact O-N 2.89Å; Y131-Q133 VanDerWaalsContact O-N 3.08Å; Q133-S135 PolarHBondContact O-N 3.48Å
134	I	70	Confident	63.8	Low	148 Å²	148	108.8 Å²	108.8	76%	0.759	62%	0.624	S	S	*	*			trans	-71	101.8	174.5	-57.1	173.9	0	0	0	105	A132 D136	A132-I134 HydrophobicContact CB-CG1 3.91Å; A132-I134 PolarHBondContact O-N 3.44Å; I134-D136 PolarHBondContact O-N 3.25Å
135	S	68.3	Low	61.7	Low	78 Å²	78	110.1 Å²	110.1	55%	0.545	64%	0.635	S	S	.	*			trans	-70.1	115.6	167.9	-65.2	0	0	0	0	107.2	Q133 H137	Q133-S135 PolarHBondContact O-N 3.48Å; S135-H137 VanDerWaalsContact C-N 3.34Å; S135-H137 PolarHBondContact O-CD2 2.88Å; S135-H137 PolarHBondContact O-N 3.1Å
136	D	59.9	Low	59.3	Low	87 Å²	87	112.7 Å²	112.7	47%	0.465	64%	0.64	S	S	.	*			trans	-69.8	94	174.2	178.2	15.2	0	0	0	109.9	I134 T138 S139	I134-D136 PolarHBondContact O-N 3.25Å; D136-T138 VanDerWaalsContact CG-OG1 3.3Å; D136-T138 PolarHBondContact O-N 3.13Å; D136-T138 WeakPolarHBondContact OD1-CA 3.38Å; D136-T138 VanDerWaalsContact OD1-CB 3.26Å; D136-T138 WeakPolarHBondContact OD1-CB 3.39Å; D136-T138 PolarHBondContact OD1-N 3.17Å; D136-T138 PolarHBondContact OD1-OG1 2.93Å; D136-T138 PolarHBondContact OD2-OG1 3.41Å; D136-S139 PolarHBondContact O-OG 3.41Å
137	H	61	Low	57.1	Low	143 Å²	143	113.4 Å²	113.4	66%	0.662	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-4.8	174.8	-61.7	-64.2	0	0	0	113.4	S135	S135-H137 VanDerWaalsContact C-N 3.34Å; S135-H137 PolarHBondContact O-CD2 2.88Å; S135-H137 PolarHBondContact O-N 3.1Å
138	T	61	Low	55	Low	108 Å²	108	112.3 Å²	112.3	66%	0.663	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	-28.3	175.6	73.5	0	0	0	0	111.7	D136	D136-T138 VanDerWaalsContact CG-OG1 3.3Å; D136-T138 PolarHBondContact O-N 3.13Å; D136-T138 WeakPolarHBondContact OD1-CA 3.38Å; D136-T138 VanDerWaalsContact OD1-CB 3.26Å; D136-T138 WeakPolarHBondContact OD1-CB 3.39Å; D136-T138 PolarHBondContact OD1-N 3.17Å; D136-T138 PolarHBondContact OD1-OG1 2.93Å; D136-T138 PolarHBondContact OD2-OG1 3.41Å
139	S	51.5	Low	53.1	Low	81 Å²	81	118.1 Å²	118.1	57%	0.566	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-26.7	-175.1	66.4	0	0	0	0	115.2	D136 F141	D136-S139 PolarHBondContact O-OG 3.41Å; S139-F141 VanDerWaalsContact C-N 3.27Å; S139-F141 PolarHBondContact O-N 3.36Å
140	T	45.9	Very low	51.4	Low	118 Å²	118	119.7 Å²	119.7	72%	0.724	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-15	-176.7	-22.7	0	0	0	0	112.8	S142	T140-S142 PolarHBondContact O-N 2.92Å
141	F	43.1	Very low	49.9	Very low	148 Å²	148	120.2 Å²	120.2	65%	0.649	66%	0.659	S	S	*	*	S	Bend	trans	-83.6	91.9	162.7	-70.5	-75.6	0	0	0	107.6	S139 S143 P144	S139-F141 VanDerWaalsContact C-N 3.27Å; S139-F141 PolarHBondContact O-N 3.36Å; F141-S143 PolarHBondContact O-N 2.91Å; F141-P144 HydrophobicContact CB-CG 4.43Å; F141-P144 HydrophobicContact CD1-CG 4.2Å
142	S	44.2	Very low	48.5	Very low	118 Å²	118	115.7 Å²	115.7	83%	0.825	67%	0.668	S	S	*	*			trans	-48.2	99.6	153.5	-168.4	0	0	0	0	107.2	T140 P144	T140-S142 PolarHBondContact O-N 2.92Å; S142-P144 WeakPolarHBondContact O-CD 3.45Å
143	S	39.2	Very low	47	Very low	60 Å²	60	115.1 Å²	115.1	42%	0.42	67%	0.67	S	S	.	*			trans	-13	103.8	-167.2	-169.4	0	0	0	0	117.4	F141 L145 E146	F141-S143 PolarHBondContact O-N 2.91Å; S143-L145 VanDerWaalsContact C-N 3.31Å; S143-L145 PolarHBondContact OG-N 2.96Å; S143-E146 PolarHBondContact OG-N 3.34Å
144	P	41.5	Very low	46	Very low	58 Å²	58	111 Å²	111	38%	0.377	66%	0.662	S	S	.	*	H	α-helix	trans	-86.4	-0.8	149.2	-15	32	0	0	0	112.8	F141 S142 E146 A147 S148	F141-P144 HydrophobicContact CB-CG 4.43Å; F141-P144 HydrophobicContact CD1-CG 4.2Å; S142-P144 WeakPolarHBondContact O-CD 3.45Å; P144-E146 VanDerWaalsContact C-N 3.32Å; P144-A147 PolarHBondContact O-N 2.9Å; P144-S148 VanDerWaalsContact O-CB 3.31Å; P144-S148 WeakPolarHBondContact O-CB 3.5Å; P144-S148 PolarHBondContact O-N 3.3Å; P144-S148 PolarHBondContact O-OG 2.97Å
145	L	43.2	Very low	45.2	Very low	163 Å²	163	106.7 Å²	106.7	85%	0.853	66%	0.655	S	S	*	*	H	α-helix	trans	-75.5	-22.7	173	-79.6	162.2	0	0	0	112.2	S143	S143-L145 VanDerWaalsContact C-N 3.31Å; S143-L145 PolarHBondContact OG-N 2.96Å
146	E	35.4	Very low	44.7	Very low	145 Å²	145	104.2 Å²	104.2	68%	0.678	64%	0.636	S	S	*	*	H	α-helix	trans	-85.2	-32.5	164.2	-69.4	-116	131.9	0	0	111.9	S143 P144 R149	S143-E146 PolarHBondContact OG-N 3.34Å; P144-E146 VanDerWaalsContact C-N 3.32Å; E146-R149 WeakPolarHBondContact O-CG 3.35Å
147	A	35.7	Very low	44.8	Very low	62 Å²	62	103.9 Å²	103.9	51%	0.512	64%	0.639	S	S	.	*	H	α-helix	trans	-80.7	-18.1	-178.7	0	0	0	0	0	114.6	P144 R149 T150	P144-A147 PolarHBondContact O-N 2.9Å; A147-R149 PolarHBondContact O-N 3.15Å; A147-T150 PolarHBondContact O-OG1 3.38Å; A147-T150 VanDerWaalsContact O-OG1 3.08Å
148	S	34.9	Very low	45.2	Very low	84 Å²	84	97.3 Å²	97.3	59%	0.587	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-81	7.8	173.7	-56.6	0	0	0	0	113.2	P144 T150	P144-S148 VanDerWaalsContact O-CB 3.31Å; P144-S148 WeakPolarHBondContact O-CB 3.5Å; P144-S148 PolarHBondContact O-N 3.3Å; P144-S148 PolarHBondContact O-OG 2.97Å; S148-T150 PolarHBondContact O-N 2.92Å; S148-T150 VanDerWaalsContact O-N 3.13Å
149	R	35.8	Very low	45.5	Very low	198 Å²	198	99.1 Å²	99.1	75%	0.747	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-66.9	1	164.3	-66.7	-174	73.5	147.1	3.8	113.3	E146 A147	E146-R149 WeakPolarHBondContact O-CG 3.35Å; A147-R149 PolarHBondContact O-N 3.15Å
150	T	38.3	Very low	46.7	Very low	129 Å²	129	104.4 Å²	104.4	79%	0.791	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-109.9	13.5	179.3	56.3	0	0	0	0	115.6	A147 S148	A147-T150 PolarHBondContact O-OG1 3.38Å; A147-T150 VanDerWaalsContact O-OG1 3.08Å; S148-T150 PolarHBondContact O-N 2.92Å; S148-T150 VanDerWaalsContact O-N 3.13Å
151	D	37.4	Very low	48.2	Very low	147 Å²	147	101.5 Å²	101.5	79%	0.786	60%	0.604	S	S	*	*	S	Bend	trans	-124.2	78.3	162.5	-162.9	24.7	0	0	0	111.2	G153	D151-G153 PolarHBondContact O-N 3.36Å
152	G	37.8	Very low	49.9	Very low	86 Å²	86	99.2 Å²	99.2	89%	0.887	60%	0.598	S	S	*	*			trans	52.2	-7.5	147.6	0	0	0	0	0	121.5	S154	G152-S154 PolarHBondContact O-N 3.38Å
153	G	37.9	Very low	51.2	Low	66 Å²	66	96.8 Å²	96.8	68%	0.68	58%	0.581	S	S	*	*			trans	-85.9	110.3	-179.7	0	0	0	0	0	108.6	D151 G155	D151-G153 PolarHBondContact O-N 3.36Å; G153-G155 PolarHBondContact O-N 3Å
154	S	44.6	Very low	52.8	Low	103 Å²	103	96.9 Å²	96.9	72%	0.72	58%	0.575	S	S	*	*			trans	-55.9	82.1	168.6	-170.9	0	0	0	0	110.2	G152 V156	G152-S154 PolarHBondContact O-N 3.38Å; S154-V156 PolarHBondContact O-N 3.43Å
155	G	53.1	Low	54.5	Low	59 Å²	59	96.4 Å²	96.4	61%	0.608	57%	0.569	S	S	*	*			trans	-64.2	117.3	170	0	0	0	0	0	107.9	G153 C157	G153-G155 PolarHBondContact O-N 3Å; G155-C157 PolarHBondContact O-N 2.96Å
156	V	56.6	Low	56.1	Low	26 Å²	26	89.3 Å²	89.3	16%	0.158	53%	0.532	C	S	.	.			trans	-67.6	103.5	-177.6	180	0	0	0	0	109	S154 F158 S259	S154-V156 PolarHBondContact O-N 3.43Å; V156-F158 HydrophobicContact CB-CE2 4.29Å; V156-F158 HydrophobicContact CB-CZ 4.23Å; V156-F158 HydrophobicContact CG1-CD1 4.07Å; V156-F158 HydrophobicContact CG1-CD2 4.29Å; V156-F158 HydrophobicContact CG1-CE1 3.56Å; V156-F158 HydrophobicContact CG1-CE2 3.84Å; V156-F158 HydrophobicContact CG1-CG 4.41Å; V156-F158 HydrophobicContact CG1-CZ 3.46Å; V156-F158 VanDerWaalsContact CG1-CZ 3.46Å; V156-F158 PolarHBondContact O-N 2.98Å; V156-S259 WeakPolarHBondContact CG2-OG 2.94Å
157	C	62.3	Low	57.9	Low	79 Å²	79	90 Å²	90	53%	0.534	53%	0.528	S	S	.	.			trans	-84	105.8	173.4	-71.8	0	0	0	0	111	G155 N159	G155-C157 PolarHBondContact O-N 2.96Å; C157-N159 PolarHBondContact O-N 3.13Å
158	F	69.4	Low	59.5	Low	6 Å²	6	90 Å²	90	3%	0.026	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-73.8	-1.6	174.7	-63.7	-69.9	0	0	0	114.6	V156 K160 Y161 L166 Y171 F178 I258 I264	V156-F158 HydrophobicContact CB-CE2 4.29Å; V156-F158 HydrophobicContact CB-CZ 4.23Å; V156-F158 HydrophobicContact CG1-CD1 4.07Å; V156-F158 HydrophobicContact CG1-CD2 4.29Å; V156-F158 HydrophobicContact CG1-CE1 3.56Å; V156-F158 HydrophobicContact CG1-CE2 3.84Å; V156-F158 HydrophobicContact CG1-CG 4.41Å; V156-F158 HydrophobicContact CG1-CZ 3.46Å; V156-F158 VanDerWaalsContact CG1-CZ 3.46Å; V156-F158 PolarHBondContact O-N 2.98Å; F158-K160 PolarHBondContact O-N 3.5Å; F158-Y161 HydrophobicContact CD1-CD2 4.5Å; F158-Y161 HydrophobicContact CD1-CE2 4.46Å; F158-Y161 PolarHBondContact O-N 2.69Å; F158-Y161 VanDerWaalsContact O-N 3.09Å; F158-L166 HydrophobicContact CB-CD2 4.29Å; F158-Y171 HydrophobicContact CB-CE1 4.18Å; F158-Y171 HydrophobicContact CB-CE2 4.4Å; F158-Y171 HydrophobicContact CD2-CD2 4.31Å; F158-Y171 AromaticContact CD2-CE2 3.42Å; F158-Y171 HydrophobicContact CD2-CE2 3.42Å; F158-Y171 VanDerWaalsContact CD2-CE2 3.42Å; F158-Y171 AromaticContact CD2-CZ 3.6Å; F158-Y171 WeakPolarHBondContact CD2-OH 3.29Å; F158-Y171 AromaticContact CE2-CE2 3.89Å; F158-Y171 HydrophobicContact CE2-CE2 3.89Å; F158-Y171 HydrophobicContact CG-CE2 4.06Å; F158-F178 HydrophobicContact CE1-CE2 4.49Å; F158-F178 HydrophobicContact CE1-CZ 4.05Å; F158-F178 HydrophobicContact CE2-CE2 4.19Å; F158-F178 HydrophobicContact CE2-CZ 4.3Å; F158-F178 AromaticContact CZ-CE2 3.89Å; F158-F178 HydrophobicContact CZ-CE2 3.89Å; F158-F178 AromaticContact CZ-CZ 3.89Å; F158-F178 HydrophobicContact CZ-CZ 3.89Å; F158-I258 HydrophobicContact CE1-CG2 3.93Å; F158-I258 HydrophobicContact CZ-CG2 4.22Å; F158-I264 HydrophobicContact CD1-CD1 3.31Å; F158-I264 HydrophobicContact CE1-CD1 3.3Å; F158-I264 HydrophobicContact CZ-CD1 4.48Å
159	N	68.2	Low	61.4	Low	146 Å²	146	87.7 Å²	87.7	78%	0.781	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-59.1	-8.6	179.9	-71.5	-3.4	0	0	0	115.3	C157 Y161	C157-N159 PolarHBondContact O-N 3.13Å; N159-Y161 VanDerWaalsContact C-N 3.31Å
160	K	77.3	Confident	63.2	Low	191 Å²	191	78.7 Å²	78.7	83%	0.83	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-76.1	-19.2	175.6	-62.2	-178	-176.4	176.3	0	113	F158	F158-K160 PolarHBondContact O-N 3.5Å
161	Y	77.5	Confident	65	Low	58 Å²	58	73.2 Å²	73.2	23%	0.227	43%	0.434	C	S	.	.	S	Bend	trans	-95.4	151.5	-178.3	-61.2	-74.8	0	0	0	111.7	F158 N159 L166 D262 I264 S265 L268	F158-Y161 HydrophobicContact CD1-CD2 4.5Å; F158-Y161 HydrophobicContact CD1-CE2 4.46Å; F158-Y161 PolarHBondContact O-N 2.69Å; F158-Y161 VanDerWaalsContact O-N 3.09Å; N159-Y161 VanDerWaalsContact C-N 3.31Å; Y161-L166 HydrophobicContact CD2-CD2 4.34Å; Y161-L166 HydrophobicContact CG-CD2 4.4Å; Y161-D262 PolarHBondContact OH-OD1 3.39Å; Y161-I264 HydrophobicContact CD1-CG2 3.66Å; Y161-I264 HydrophobicContact CD2-CD1 4.14Å; Y161-I264 HydrophobicContact CD2-CG2 3.97Å; Y161-I264 HydrophobicContact CE1-CB 4.13Å; Y161-I264 HydrophobicContact CE1-CG2 3.42Å; Y161-I264 VanDerWaalsContact CE1-CG2 3.42Å; Y161-I264 HydrophobicContact CE2-CB 3.99Å; Y161-I264 HydrophobicContact CE2-CD1 3.84Å; Y161-I264 HydrophobicContact CE2-CG2 3.75Å; Y161-I264 HydrophobicContact CG-CG2 3.93Å; Y161-I264 VanDerWaalsContact CZ-CG2 3.46Å; Y161-S265 PolarHBondContact OH-OG 3.28Å; Y161-L268 HydrophobicContact CD1-CD1 3.98Å; Y161-L268 HydrophobicContact CE1-CD1 4.31Å
162	N	77	Confident	66.7	Low	99 Å²	99	69.4 Å²	69.4	53%	0.529	41%	0.412	S	S	.	.			trans	-66.7	142.9	175.3	-176.9	-1	0	0	0	110.4	H164 D165 L166	N162-H164 PolarHBondContact O-N 2.79Å; N162-H164 PolarHBondContact OD1-N 3.41Å; N162-D165 HydrophobicContact CB-CB 4.44Å; N162-D165 WeakPolarHBondContact O-CB 2.83Å; N162-D165 PolarHBondContact O-N 3.43Å; N162-L166 PolarHBondContact O-N 2.99Å
163	S	71.4	Confident	68.3	Low	68 Å²	68	69.2 Å²	69.2	48%	0.476	40%	0.395	S	S	.	.	H	α-helix	trans	-53.8	-35	173.9	172.7	0	0	0	0	112.9	R167	S163-R167 WeakPolarHBondContact O-CG 3.38Å; S163-R167 PolarHBondContact O-N 3.28Å; S163-R167 PolarHBondContact O-NE 2.73Å
164	H	73.5	Confident	69.7	Low	62 Å²	62	75.8 Å²	75.8	29%	0.287	41%	0.407	S	S	.	.	H	α-helix	trans	-63.6	-45.2	173.8	-175.6	75.4	0	0	0	112.6	N162 R167 L168	N162-H164 PolarHBondContact O-N 2.79Å; N162-H164 PolarHBondContact OD1-N 3.41Å; H164-R167 WeakPolarHBondContact O-CB 3.48Å; H164-R167 PolarHBondContact O-N 3.35Å; H164-L168 PolarHBondContact O-N 3.19Å
165	D	77.7	Confident	71.1	Confident	48 Å²	48	75.4 Å²	75.4	26%	0.257	39%	0.39	S	S	.	.	H	α-helix	trans	-66.8	-40.1	-179.5	-62.3	-19	0	0	0	111.4	N162 R167 L168 L169 L268	N162-D165 HydrophobicContact CB-CB 4.44Å; N162-D165 WeakPolarHBondContact O-CB 2.83Å; N162-D165 PolarHBondContact O-N 3.43Å; D165-R167 VanDerWaalsContact C-N 3.3Å; D165-R167 PolarHBondContact O-N 3.25Å; D165-L168 WeakPolarHBondContact O-CB 3.46Å; D165-L168 PolarHBondContact O-N 2.86Å; D165-L168 VanDerWaalsContact O-N 3.15Å; D165-L169 PolarHBondContact O-N 3.02Å; D165-L268 HydrophobicContact CB-CD1 3.87Å; D165-L268 HydrophobicContact CB-CD2 3.75Å; D165-L268 HydrophobicContact CB-CG 4.48Å
166	L	77	Confident	72	Confident	13 Å²	13	75.9 Å²	75.9	7%	0.068	38%	0.379	C	S	.	.	H	α-helix	trans	-64.4	-34.1	175.2	-70.1	176.7	0	0	0	112.2	F158 Y161 N162 L168 L169 A170 Y171	F158-L166 HydrophobicContact CB-CD2 4.29Å; Y161-L166 HydrophobicContact CD2-CD2 4.34Å; Y161-L166 HydrophobicContact CG-CD2 4.4Å; N162-L166 PolarHBondContact O-N 2.99Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 2.7Å; L166-L169 PolarHBondContact O-N 2.71Å; L166-A170 PolarHBondContact O-N 2.91Å; L166-Y171 HydrophobicContact CB-CD1 4Å; L166-Y171 HydrophobicContact CB-CG 4.46Å; L166-Y171 HydrophobicContact CD1-CD1 3.88Å; L166-Y171 HydrophobicContact CD1-CE1 4.15Å; L166-Y171 HydrophobicContact CD2-CD1 3.99Å; L166-Y171 HydrophobicContact CD2-CG 4.17Å; L166-Y171 HydrophobicContact CG-CD1 4.18Å; L166-Y171 WeakPolarHBondContact O-CB 3.39Å; L166-Y171 PolarHBondContact O-N 2.87Å
167	R	71.8	Confident	72.8	Confident	160 Å²	160	75.6 Å²	75.6	60%	0.604	38%	0.376	S	S	*	.	H	α-helix	trans	-64.3	-34.6	171.9	-80.4	-178.4	-69.4	-146.1	-2.1	112.8	S163 H164 D165 L169 A170	S163-R167 WeakPolarHBondContact O-CG 3.38Å; S163-R167 PolarHBondContact O-N 3.28Å; S163-R167 PolarHBondContact O-NE 2.73Å; H164-R167 WeakPolarHBondContact O-CB 3.48Å; H164-R167 PolarHBondContact O-N 3.35Å; D165-R167 VanDerWaalsContact C-N 3.3Å; D165-R167 PolarHBondContact O-N 3.25Å; R167-L169 PolarHBondContact O-N 3.05Å; R167-A170 WeakPolarHBondContact O-CA 3.39Å; R167-A170 PolarHBondContact O-N 3.43Å
168	L	70.1	Confident	73.4	Confident	63 Å²	63	73.3 Å²	73.3	33%	0.33	36%	0.358	S	S	.	.	H	α-helix	trans	-62.8	-27.6	175.4	-62.4	173	0	0	0	112.4	H164 D165 L166 A170 F267 W280	H164-L168 PolarHBondContact O-N 3.19Å; D165-L168 WeakPolarHBondContact O-CB 3.46Å; D165-L168 PolarHBondContact O-N 2.86Å; D165-L168 VanDerWaalsContact O-N 3.15Å; L166-L168 VanDerWaalsContact C-N 3.33Å; L166-L168 PolarHBondContact O-N 2.7Å; L168-A170 VanDerWaalsContact C-N 3.33Å; L168-F267 HydrophobicContact CB-CE1 4.47Å; L168-W280 HydrophobicContact CD1-CH2 4.05Å; L168-W280 HydrophobicContact CD1-CZ2 3.82Å; L168-W280 HydrophobicContact CD2-CH2 4.27Å; L168-W280 HydrophobicContact CD2-CZ2 3.8Å; L168-W280 HydrophobicContact CG-CZ2 4.5Å
169	L	74	Confident	73.4	Confident	34 Å²	34	74.6 Å²	74.6	18%	0.178	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-0.9	174.3	-68.3	170.4	0	0	0	113.1	D165 L166 R167 Y171 F178 I264 F267	D165-L169 PolarHBondContact O-N 3.02Å; L166-L169 PolarHBondContact O-N 2.71Å; R167-L169 PolarHBondContact O-N 3.05Å; L169-Y171 PolarHBondContact O-N 3.49Å; L169-F178 HydrophobicContact CB-CD1 4.03Å; L169-F178 HydrophobicContact CB-CE1 3.94Å; L169-F178 HydrophobicContact CD1-CE1 4.18Å; L169-I264 HydrophobicContact CD1-CB 4.25Å; L169-I264 HydrophobicContact CD1-CD1 4.09Å; L169-I264 HydrophobicContact CD1-CG1 3.77Å; L169-I264 HydrophobicContact CD1-CG2 3.79Å; L169-F267 HydrophobicContact CD2-CD1 3.45Å; L169-F267 VanDerWaalsContact CD2-CD1 3.45Å; L169-F267 HydrophobicContact CD2-CD2 4.29Å; L169-F267 HydrophobicContact CD2-CE1 3.57Å; L169-F267 HydrophobicContact CD2-CE2 4.39Å; L169-F267 HydrophobicContact CD2-CG 3.83Å; L169-F267 HydrophobicContact CD2-CZ 4.04Å; L169-F267 HydrophobicContact CG-CD1 4.11Å; L169-F267 HydrophobicContact CG-CE1 4.12Å
170	A	74.1	Confident	73.4	Confident	10 Å²	10	72.8 Å²	72.8	8%	0.083	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	40.8	-166.1	0	0	0	0	0	113.1	L166 R167 L168 E179 V181	L166-A170 PolarHBondContact O-N 2.91Å; R167-A170 WeakPolarHBondContact O-CA 3.39Å; R167-A170 PolarHBondContact O-N 3.43Å; L168-A170 VanDerWaalsContact C-N 3.33Å; A170-E179 HydrophobicContact CB-CB 3.78Å; A170-E179 PolarHBondContact O-N 3.06Å; A170-V181 HydrophobicContact CB-CG2 3.19Å
171	Y	75.6	Confident	72.5	Confident	14 Å²	14	65.8 Å²	65.8	6%	0.055	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	130.6	171.2	177.2	-102.4	0	0	0	110.2	F158 L166 L169 P173 D176 F178	F158-Y171 HydrophobicContact CB-CE1 4.18Å; F158-Y171 HydrophobicContact CB-CE2 4.4Å; F158-Y171 HydrophobicContact CD2-CD2 4.31Å; F158-Y171 AromaticContact CD2-CE2 3.42Å; F158-Y171 HydrophobicContact CD2-CE2 3.42Å; F158-Y171 VanDerWaalsContact CD2-CE2 3.42Å; F158-Y171 AromaticContact CD2-CZ 3.6Å; F158-Y171 WeakPolarHBondContact CD2-OH 3.29Å; F158-Y171 AromaticContact CE2-CE2 3.89Å; F158-Y171 HydrophobicContact CE2-CE2 3.89Å; F158-Y171 HydrophobicContact CG-CE2 4.06Å; L166-Y171 HydrophobicContact CB-CD1 4Å; L166-Y171 HydrophobicContact CB-CG 4.46Å; L166-Y171 HydrophobicContact CD1-CD1 3.88Å; L166-Y171 HydrophobicContact CD1-CE1 4.15Å; L166-Y171 HydrophobicContact CD2-CD1 3.99Å; L166-Y171 HydrophobicContact CD2-CG 4.17Å; L166-Y171 HydrophobicContact CG-CD1 4.18Å; L166-Y171 WeakPolarHBondContact O-CB 3.39Å; L166-Y171 PolarHBondContact O-N 2.87Å; L169-Y171 PolarHBondContact O-N 3.49Å; Y171-P173 HydrophobicContact CD1-CG 4.16Å; Y171-P173 HydrophobicContact CE1-CB 4.14Å; Y171-P173 HydrophobicContact CE1-CG 4.09Å; Y171-P173 WeakPolarHBondContact O-CD 3.14Å; Y171-D176 PolarHBondContact OH-OD1 3.08Å; Y171-F178 HydrophobicContact CD2-CD1 4.03Å; Y171-F178 HydrophobicContact CD2-CD2 4.35Å; Y171-F178 AromaticContact CD2-CE1 3.68Å; Y171-F178 HydrophobicContact CD2-CE1 3.68Å; Y171-F178 HydrophobicContact CD2-CE2 4.01Å; Y171-F178 HydrophobicContact CD2-CG 4.36Å; Y171-F178 AromaticContact CD2-CZ 3.65Å; Y171-F178 HydrophobicContact CD2-CZ 3.65Å; Y171-F178 HydrophobicContact CE2-CE2 4.48Å; Y171-F178 HydrophobicContact CE2-CZ 4.35Å; Y171-F178 HydrophobicContact CG-CD1 4.44Å; Y171-F178 HydrophobicContact CG-CE1 4.08Å; Y171-F178 HydrophobicContact CG-CZ 4.43Å
172	M	74.1	Confident	71.7	Confident	66 Å²	66	67 Å²	67	33%	0.325	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	103.5	178.1	-71.2	-62.1	127.4	0	0	110.2	H174 R175 D176 D177 E179	M172-H174 VanDerWaalsContact C-N 3.33Å; M172-H174 PolarHBondContact O-N 2.71Å; M172-R175 HydrophobicContact CB-CB 4.05Å; M172-R175 PolarHBondContact O-N 3.39Å; M172-R175 VanDerWaalsContact O-N 3.11Å; M172-D176 PolarHBondContact O-N 2.91Å; M172-D177 PolarHBondContact N-O 3.28Å; M172-D177 PolarHBondContact O-N 3.04Å; M172-E179 HydrophobicContact CG-CG 4.42Å; M172-E179 WeakPolarHBondContact CG-OE1 3.41Å
173	P	70.3	Confident	70.9	Confident	82 Å²	82	67.1 Å²	67.1	53%	0.532	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.8	-172.4	-24.9	34.2	0	0	0	114.4	Y171 R175 D176	Y171-P173 HydrophobicContact CD1-CG 4.16Å; Y171-P173 HydrophobicContact CE1-CB 4.14Å; Y171-P173 HydrophobicContact CE1-CG 4.09Å; Y171-P173 WeakPolarHBondContact O-CD 3.14Å; P173-R175 VanDerWaalsContact C-N 3.3Å; P173-R175 PolarHBondContact O-N 3.4Å; P173-D176 PolarHBondContact O-N 3.15Å
174	H	68.2	Low	70	Confident	205 Å²	205	66.8 Å²	66.8	95%	0.949	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-22.7	-179	-63.7	90.8	0	0	0	113	M172	M172-H174 VanDerWaalsContact C-N 3.33Å; M172-H174 PolarHBondContact O-N 2.71Å
175	R	73	Confident	69.4	Low	95 Å²	95	67.7 Å²	67.7	36%	0.358	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-12.6	176.8	-160.5	172.8	81.8	-125.7	2.1	112.4	M172 P173 D177 F178 E179	M172-R175 HydrophobicContact CB-CB 4.05Å; M172-R175 PolarHBondContact O-N 3.39Å; M172-R175 VanDerWaalsContact O-N 3.11Å; P173-R175 VanDerWaalsContact C-N 3.3Å; P173-R175 PolarHBondContact O-N 3.4Å; R175-D177 HydrophobicContact CB-CB 4.13Å; R175-D177 HydrophobicContact CG-CB 3.89Å; R175-D177 IonicContact CZ-OD2 3.19Å; R175-D177 IonicContact NE-OD2 3.56Å; R175-D177 PolarHBondContact NE-OD2 2.94Å; R175-D177 IonicContact NH2-OD2 3.95Å; R175-D177 PolarHBondContact NH2-OD2 3.37Å; R175-D177 PolarHBondContact O-N 3.45Å; R175-F178 PolarHBondContact NH2-O 3.31Å; R175-E179 IonicContact NH1-OE1 3.77Å; R175-E179 PolarHBondContact NH1-OE1 2.9Å
176	D	73.3	Confident	68.4	Low	69 Å²	69	67.9 Å²	67.9	37%	0.369	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	47.8	-168.6	-177.8	33.8	0	0	0	111.5	Y171 M172 P173 K255	Y171-D176 PolarHBondContact OH-OD1 3.08Å; M172-D176 PolarHBondContact O-N 2.91Å; P173-D176 PolarHBondContact O-N 3.15Å; D176-K255 WeakPolarHBondContact O-CE 3.35Å; D176-K255 PolarHBondContact O-NZ 3.24Å
177	D	73.4	Confident	67.7	Low	20 Å²	20	71 Å²	71	11%	0.107	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	157	-169.7	-164.3	38.4	0	0	0	112.8	M172 R175 K255	M172-D177 PolarHBondContact N-O 3.28Å; M172-D177 PolarHBondContact O-N 3.04Å; R175-D177 HydrophobicContact CB-CB 4.13Å; R175-D177 HydrophobicContact CG-CB 3.89Å; R175-D177 IonicContact CZ-OD2 3.19Å; R175-D177 IonicContact NE-OD2 3.56Å; R175-D177 PolarHBondContact NE-OD2 2.94Å; R175-D177 IonicContact NH2-OD2 3.95Å; R175-D177 PolarHBondContact NH2-OD2 3.37Å; R175-D177 PolarHBondContact O-N 3.45Å; D177-K255 WeakPolarHBondContact OD1-CE 3.21Å; D177-K255 IonicContact OD1-NZ 2.71Å; D177-K255 PolarHBondContact OD1-NZ 2.9Å
178	F	74.2	Confident	67.1	Low	31 Å²	31	67.6 Å²	67.6	14%	0.136	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	137.1	179.4	-61	-90.4	0	0	0	110.6	F158 L169 Y171 R175 I258 I264	F158-F178 HydrophobicContact CE1-CE2 4.49Å; F158-F178 HydrophobicContact CE1-CZ 4.05Å; F158-F178 HydrophobicContact CE2-CE2 4.19Å; F158-F178 HydrophobicContact CE2-CZ 4.3Å; F158-F178 AromaticContact CZ-CE2 3.89Å; F158-F178 HydrophobicContact CZ-CE2 3.89Å; F158-F178 AromaticContact CZ-CZ 3.89Å; F158-F178 HydrophobicContact CZ-CZ 3.89Å; L169-F178 HydrophobicContact CB-CD1 4.03Å; L169-F178 HydrophobicContact CB-CE1 3.94Å; L169-F178 HydrophobicContact CD1-CE1 4.18Å; Y171-F178 HydrophobicContact CD2-CD1 4.03Å; Y171-F178 HydrophobicContact CD2-CD2 4.35Å; Y171-F178 AromaticContact CD2-CE1 3.68Å; Y171-F178 HydrophobicContact CD2-CE1 3.68Å; Y171-F178 HydrophobicContact CD2-CE2 4.01Å; Y171-F178 HydrophobicContact CD2-CG 4.36Å; Y171-F178 AromaticContact CD2-CZ 3.65Å; Y171-F178 HydrophobicContact CD2-CZ 3.65Å; Y171-F178 HydrophobicContact CE2-CE2 4.48Å; Y171-F178 HydrophobicContact CE2-CZ 4.35Å; Y171-F178 HydrophobicContact CG-CD1 4.44Å; Y171-F178 HydrophobicContact CG-CE1 4.08Å; Y171-F178 HydrophobicContact CG-CZ 4.43Å; R175-F178 PolarHBondContact NH2-O 3.31Å; F178-I258 HydrophobicContact CD2-CD1 4.02Å; F178-I258 HydrophobicContact CE2-CD1 3.6Å; F178-I258 HydrophobicContact CZ-CD1 4.25Å; F178-I264 HydrophobicContact CZ-CD1 4.21Å
179	E	70.8	Confident	66.8	Low	32 Å²	32	73 Å²	73	15%	0.15	37%	0.373	C	S	.	.			trans	-87.7	137.2	170.4	-98	170.9	-143.4	0	0	110.9	A170 M172 R175 V181 S198 F200	A170-E179 HydrophobicContact CB-CB 3.78Å; A170-E179 PolarHBondContact O-N 3.06Å; M172-E179 HydrophobicContact CG-CG 4.42Å; M172-E179 WeakPolarHBondContact CG-OE1 3.41Å; R175-E179 IonicContact NH1-OE1 3.77Å; R175-E179 PolarHBondContact NH1-OE1 2.9Å; E179-V181 PolarHBondContact O-N 3.25Å; E179-V181 VanDerWaalsContact O-N 3.11Å; E179-S198 WeakPolarHBondContact CB-OG 3.37Å; E179-S198 WeakPolarHBondContact CG-OG 3.44Å; E179-S198 VanDerWaalsContact OE2-CB 3.3Å; E179-S198 WeakPolarHBondContact OE2-CB 3.23Å; E179-S198 PolarHBondContact OE2-OG 2.62Å; E179-F200 HydrophobicContact CG-CD1 4.32Å; E179-F200 HydrophobicContact CG-CE1 4.17Å; E179-F200 HydrophobicContact CG-CZ 4.35Å; E179-F200 VanDerWaalsContact OE1-CE1 3.25Å; E179-F200 WeakPolarHBondContact OE1-CE1 3.11Å; E179-F200 WeakPolarHBondContact OE1-CZ 3.14Å
180	K	66.5	Low	66.4	Low	108 Å²	108	79.9 Å²	79.9	47%	0.47	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	102.8	179	-176.8	-174.2	179.3	-179.6	0	108.4	K182 E199 M201	K180-K182 PolarHBondContact O-N 2.95Å; K180-E199 WeakPolarHBondContact CA-O 3.4Å; K180-E199 WeakPolarHBondContact CB-O 2.91Å; K180-E199 PolarHBondContact N-O 2.72Å; K180-E199 PolarHBondContact O-N 2.87Å; K180-M201 HydrophobicContact CB-CG 4.34Å
181	V	58.7	Low	65.2	Low	45 Å²	45	85.3 Å²	85.3	27%	0.273	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.9	178.3	-164.2	0	0	0	0	111.3	A170 E179 L196 W197	A170-V181 HydrophobicContact CB-CG2 3.19Å; E179-V181 PolarHBondContact O-N 3.25Å; E179-V181 VanDerWaalsContact O-N 3.11Å; V181-L196 HydrophobicContact CG1-CB 3.73Å; V181-L196 HydrophobicContact CG1-CD2 3.42Å; V181-L196 VanDerWaalsContact CG1-CD2 3.42Å; V181-L196 HydrophobicContact CG1-CG 4.12Å; V181-W197 CarbonylContact C-O 3.56Å
182	K	60.4	Low	64.1	Low	83 Å²	83	90.2 Å²	90.2	36%	0.361	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	147	165.8	-70.5	-172.9	175.5	173.1	0	110.1	K180 L196 W197 E199	K180-K182 PolarHBondContact O-N 2.95Å; K182-L196 CarbonylContact O-C 3.57Å; K182-W197 WeakPolarHBondContact CA-O 3.22Å; K182-W197 PolarHBondContact N-O 3.28Å; K182-W197 PolarHBondContact O-N 3.24Å; K182-E199 HydrophobicContact CD-CG 4.25Å; K182-E199 WeakPolarHBondContact CD-OE1 3.43Å; K182-E199 VanDerWaalsContact CE-OE1 3.29Å; K182-E199 WeakPolarHBondContact CE-OE1 3.49Å; K182-E199 WeakPolarHBondContact CE-OE2 3.48Å; K182-E199 IonicContact NZ-OE1 2.7Å; K182-E199 PolarHBondContact NZ-OE1 3.15Å; K182-E199 IonicContact NZ-OE2 3.79Å; K182-E199 PolarHBondContact NZ-OE2 3.46Å
183	F	59.9	Low	63.2	Low	102 Å²	102	91.5 Å²	91.5	45%	0.447	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	117.3	169.7	-67.9	-101	0	0	0	107.7	L196 R294	F183-L196 HydrophobicContact CD1-CD2 4.33Å; F183-L196 HydrophobicContact CD1-CG 4.36Å; F183-L196 HydrophobicContact CE1-CD2 3.71Å; F183-L196 HydrophobicContact CE1-CG 4.12Å; F183-L196 HydrophobicContact CE2-CD2 4.47Å; F183-L196 HydrophobicContact CZ-CD2 3.81Å; F183-R294 VanDerWaalsContact CE2-NH1 3.29Å
184	V	53.9	Low	62.1	Low	60 Å²	60	91 Å²	91	36%	0.364	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	132.5	173	-177.1	0	0	0	0	107.8	V186 T194 V195 W197	V184-V186 HydrophobicContact CG1-CG2 4.33Å; V184-T194 CarbonylContact O-C 3.59Å; V184-V195 PolarHBondContact N-O 3.49Å; V184-V195 PolarHBondContact O-N 2.7Å; V184-W197 HydrophobicContact CB-CG 4.28Å; V184-W197 HydrophobicContact CG2-CB 3.96Å; V184-W197 HydrophobicContact CG2-CG 3.65Å
185	L	59.7	Low	61.3	Low	81 Å²	81	83.6 Å²	83.6	42%	0.424	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.2	172.7	-65.2	166.6	0	0	0	108.2	L192 F193 T194	L185-L192 HydrophobicContact CB-CD1 3.96Å; L185-L192 HydrophobicContact CB-CD2 4.49Å; L185-L192 HydrophobicContact CB-CG 4.21Å; L185-L192 HydrophobicContact CD1-CD2 4.15Å; L185-L192 HydrophobicContact CD2-CD2 3.89Å; L185-L192 HydrophobicContact CD2-CG 3.99Å; L185-L192 HydrophobicContact CG-CD2 4.4Å; L185-F193 CarbonylContact C-O 3.6Å; L185-F193 WeakPolarHBondContact CA-O 3.32Å; L185-T194 HydrophobicContact CD2-CG2 3.4Å; L185-T194 VanDerWaalsContact CD2-CG2 3.4Å
186	V	57.3	Low	60.2	Low	53 Å²	53	84.4 Å²	84.4	32%	0.321	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	126.4	174.4	-177.9	0	0	0	0	108.1	V184 F193 V195	V184-V186 HydrophobicContact CG1-CG2 4.33Å; V186-F193 PolarHBondContact N-O 3.42Å; V186-F193 PolarHBondContact O-N 3.23Å; V186-V195 HydrophobicContact CB-CG2 3.95Å; V186-V195 HydrophobicContact CG2-CB 4.08Å; V186-V195 HydrophobicContact CG2-CG2 3.5Å
187	A	62.4	Low	58.7	Low	79 Å²	79	88 Å²	88	65%	0.653	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.2	173.1	0	0	0	0	0	109.6	Q191 L192	A187-Q191 CarbonylContact C-O 3.54Å; A187-Q191 WeakPolarHBondContact CA-O 3.04Å; A187-L192 HydrophobicContact CB-CD1 4.42Å
188	L	58.9	Low	57.6	Low	88 Å²	88	89.2 Å²	89.2	46%	0.461	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	115.3	178.2	-127.8	154.6	0	0	0	107.8	D190 Q191 F193	L188-D190 PolarHBondContact O-N 2.99Å; L188-Q191 PolarHBondContact N-O 3.42Å; L188-Q191 WeakPolarHBondContact O-CA 3.41Å; L188-Q191 WeakPolarHBondContact O-CB 3.43Å; L188-Q191 PolarHBondContact O-N 2.64Å; L188-F193 HydrophobicContact CB-CD2 3.87Å; L188-F193 HydrophobicContact CB-CE2 3.81Å
189	E	65.1	Low	56.8	Low	177 Å²	177	91.8 Å²	91.8	83%	0.827	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	58.1	178.4	-62.2	-177.2	168.5	0	0	113.6	Q191	E189-Q191 PolarHBondContact O-N 2.74Å; E189-Q191 VanDerWaalsContact O-N 3.12Å
190	D	64.1	Low	56.3	Low	177 Å²	177	96.1 Å²	96.1	95%	0.947	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	6.5	-178.7	-55.7	-37.4	0	0	0	116.1	L188	L188-D190 PolarHBondContact O-N 2.99Å
191	Q	50.6	Low	56.4	Low	125 Å²	125	95.3 Å²	95.3	58%	0.584	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.1	171.5	-65.1	-173.6	-1.1	0	0	111.7	A187 L188 E189 F193	A187-Q191 CarbonylContact C-O 3.54Å; A187-Q191 WeakPolarHBondContact CA-O 3.04Å; L188-Q191 PolarHBondContact N-O 3.42Å; L188-Q191 WeakPolarHBondContact O-CA 3.41Å; L188-Q191 WeakPolarHBondContact O-CB 3.43Å; L188-Q191 PolarHBondContact O-N 2.64Å; E189-Q191 PolarHBondContact O-N 2.74Å; E189-Q191 VanDerWaalsContact O-N 3.12Å; Q191-F193 HydrophobicContact CB-CD2 4.28Å; Q191-F193 HydrophobicContact CB-CE2 3.59Å; Q191-F193 HydrophobicContact CB-CZ 4.09Å; Q191-F193 VanDerWaalsContact OE1-CZ 3.31Å
192	L	51.1	Low	57.3	Low	116 Å²	116	97 Å²	97	61%	0.607	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99	115.7	177.5	-163.2	72.4	0	0	0	109.8	L185 A187	L185-L192 HydrophobicContact CB-CD1 3.96Å; L185-L192 HydrophobicContact CB-CD2 4.49Å; L185-L192 HydrophobicContact CB-CG 4.21Å; L185-L192 HydrophobicContact CD1-CD2 4.15Å; L185-L192 HydrophobicContact CD2-CD2 3.89Å; L185-L192 HydrophobicContact CD2-CG 3.99Å; L185-L192 HydrophobicContact CG-CD2 4.4Å; A187-L192 HydrophobicContact CB-CD1 4.42Å
193	F	55.2	Low	58.3	Low	94 Å²	94	96 Å²	96	41%	0.412	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	131.9	176.8	-66.9	-88.4	0	0	0	110.2	L185 V186 L188 Q191 V195	L185-F193 CarbonylContact C-O 3.6Å; L185-F193 WeakPolarHBondContact CA-O 3.32Å; V186-F193 PolarHBondContact N-O 3.42Å; V186-F193 PolarHBondContact O-N 3.23Å; L188-F193 HydrophobicContact CB-CD2 3.87Å; L188-F193 HydrophobicContact CB-CE2 3.81Å; Q191-F193 HydrophobicContact CB-CD2 4.28Å; Q191-F193 HydrophobicContact CB-CE2 3.59Å; Q191-F193 HydrophobicContact CB-CZ 4.09Å; Q191-F193 VanDerWaalsContact OE1-CZ 3.31Å; F193-V195 PolarHBondContact O-N 2.71Å
194	T	48.2	Very low	59.4	Low	71 Å²	71	91.2 Å²	91.2	44%	0.436	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	109.9	164.2	42.4	0	0	0	0	109	V184 L185 V287	V184-T194 CarbonylContact O-C 3.59Å; L185-T194 HydrophobicContact CD2-CG2 3.4Å; L185-T194 VanDerWaalsContact CD2-CG2 3.4Å; T194-V287 HydrophobicContact CG2-CG1 4.39Å
195	V	50.5	Low	61	Low	50 Å²	50	91 Å²	91	30%	0.303	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.8	170.3	-177	0	0	0	0	108.7	V184 V186 F193 W197	V184-V195 PolarHBondContact N-O 3.49Å; V184-V195 PolarHBondContact O-N 2.7Å; V186-V195 HydrophobicContact CB-CG2 3.95Å; V186-V195 HydrophobicContact CG2-CB 4.08Å; V186-V195 HydrophobicContact CG2-CG2 3.5Å; F193-V195 PolarHBondContact O-N 2.71Å; V195-W197 VanDerWaalsContact CG1-NE1 3.32Å
196	L	49.5	Very low	62.2	Low	112 Å²	112	90.4 Å²	90.4	59%	0.586	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.5	172.3	-67.5	118.4	0	0	0	108.5	V181 K182 F183	V181-L196 HydrophobicContact CG1-CB 3.73Å; V181-L196 HydrophobicContact CG1-CD2 3.42Å; V181-L196 VanDerWaalsContact CG1-CD2 3.42Å; V181-L196 HydrophobicContact CG1-CG 4.12Å; K182-L196 CarbonylContact O-C 3.57Å; F183-L196 HydrophobicContact CD1-CD2 4.33Å; F183-L196 HydrophobicContact CD1-CG 4.36Å; F183-L196 HydrophobicContact CE1-CD2 3.71Å; F183-L196 HydrophobicContact CE1-CG 4.12Å; F183-L196 HydrophobicContact CE2-CD2 4.47Å; F183-L196 HydrophobicContact CZ-CD2 3.81Å
197	W	42.5	Very low	63.5	Low	145 Å²	145	89.6 Å²	89.6	55%	0.549	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.7	173.5	-75.1	79.6	0	0	0	109.3	V181 K182 V184 V195	V181-W197 CarbonylContact C-O 3.56Å; K182-W197 WeakPolarHBondContact CA-O 3.22Å; K182-W197 PolarHBondContact N-O 3.28Å; K182-W197 PolarHBondContact O-N 3.24Å; V184-W197 HydrophobicContact CB-CG 4.28Å; V184-W197 HydrophobicContact CG2-CB 3.96Å; V184-W197 HydrophobicContact CG2-CG 3.65Å; V195-W197 VanDerWaalsContact CG1-NE1 3.32Å
198	S	51	Low	64.6	Low	44 Å²	44	88.3 Å²	88.3	31%	0.308	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	125.7	174.6	175.8	0	0	0	0	110.3	E179	E179-S198 WeakPolarHBondContact CB-OG 3.37Å; E179-S198 WeakPolarHBondContact CG-OG 3.44Å; E179-S198 VanDerWaalsContact OE2-CB 3.3Å; E179-S198 WeakPolarHBondContact OE2-CB 3.23Å; E179-S198 PolarHBondContact OE2-OG 2.62Å
199	E	56.5	Low	65.6	Low	86 Å²	86	87.8 Å²	87.8	40%	0.402	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.5	163.9	-74.4	-175.4	-178.3	0	0	109.7	K180 K182	K180-E199 WeakPolarHBondContact CA-O 3.4Å; K180-E199 WeakPolarHBondContact CB-O 2.91Å; K180-E199 PolarHBondContact N-O 2.72Å; K180-E199 PolarHBondContact O-N 2.87Å; K182-E199 HydrophobicContact CD-CG 4.25Å; K182-E199 WeakPolarHBondContact CD-OE1 3.43Å; K182-E199 VanDerWaalsContact CE-OE1 3.29Å; K182-E199 WeakPolarHBondContact CE-OE1 3.49Å; K182-E199 WeakPolarHBondContact CE-OE2 3.48Å; K182-E199 IonicContact NZ-OE1 2.7Å; K182-E199 PolarHBondContact NZ-OE1 3.15Å; K182-E199 IonicContact NZ-OE2 3.79Å; K182-E199 PolarHBondContact NZ-OE2 3.46Å
200	F	61	Low	66.3	Low	122 Å²	122	86.2 Å²	86.2	54%	0.535	45%	0.447	S	S	.	.			trans	-74.5	131.2	171.6	-69	-100.9	0	0	0	109.3	E179 N202	E179-F200 HydrophobicContact CG-CD1 4.32Å; E179-F200 HydrophobicContact CG-CE1 4.17Å; E179-F200 HydrophobicContact CG-CZ 4.35Å; E179-F200 VanDerWaalsContact OE1-CE1 3.25Å; E179-F200 WeakPolarHBondContact OE1-CE1 3.11Å; E179-F200 WeakPolarHBondContact OE1-CZ 3.14Å; F200-N202 HydrophobicContact CB-CB 4.49Å; F200-N202 PolarHBondContact O-N 2.83Å
201	M	68.5	Low	67	Low	91 Å²	91	78.9 Å²	78.9	45%	0.448	41%	0.408	S	S	.	.			trans	-73.5	79.1	166.5	-67.9	-169.5	-62.3	0	0	108.7	K180 D203 R251	K180-M201 HydrophobicContact CB-CG 4.34Å; M201-D203 VanDerWaalsContact C-N 3.31Å; M201-R251 VanDerWaalsContact O-CZ 3.28Å; M201-R251 PolarHBondContact O-NH2 3.02Å
202	N	77.8	Confident	68.1	Low	80 Å²	80	79.4 Å²	79.4	43%	0.428	41%	0.414	S	S	.	.			trans	-96.4	20.9	-175.5	-151	47.9	0	0	0	112.6	F200 A204 E205 S206	F200-N202 HydrophobicContact CB-CB 4.49Å; F200-N202 PolarHBondContact O-N 2.83Å; N202-A204 VanDerWaalsContact C-N 3.32Å; N202-A204 PolarHBondContact O-N 3.45Å; N202-E205 VanDerWaalsContact CA-OE2 3.32Å; N202-E205 WeakPolarHBondContact CA-OE2 3.22Å; N202-E205 PolarHBondContact O-N 3.38Å; N202-E205 WeakPolarHBondContact OD1-CB 3.44Å; N202-E205 VanDerWaalsContact OD1-CG 3.23Å; N202-E205 WeakPolarHBondContact OD1-CG 3.25Å; N202-E205 PolarHBondContact OD1-OE2 3.49Å; N202-S206 WeakPolarHBondContact O-CB 3.22Å; N202-S206 PolarHBondContact O-N 3.42Å; N202-S206 PolarHBondContact O-OG 2.96Å
203	D	80.1	Confident	68.9	Low	64 Å²	64	81.5 Å²	81.5	34%	0.342	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-34.2	-172.9	63.7	-38.6	0	0	0	112.9	M201 L207 R247 R251	M201-D203 VanDerWaalsContact C-N 3.31Å; D203-L207 WeakPolarHBondContact O-CG 3.31Å; D203-R247 IonicContact OD2-CZ 3.94Å; D203-R247 IonicContact OD2-NH1 3.32Å; D203-R247 PolarHBondContact OD2-NH1 3.32Å; D203-R251 IonicContact OD1-CZ 3.7Å; D203-R251 IonicContact OD1-NE 3.72Å; D203-R251 IonicContact OD1-NH2 2.96Å; D203-R251 PolarHBondContact OD1-NH2 3.42Å
204	A	83.8	Confident	69.2	Low	0 Å²	0	82.7 Å²	82.7	0%	0	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-53.3	173	0	0	0	0	0	110.4	N202 S206 L207 Y244 R247 L248	N202-A204 VanDerWaalsContact C-N 3.32Å; N202-A204 PolarHBondContact O-N 3.45Å; A204-S206 VanDerWaalsContact C-N 3.25Å; A204-S206 PolarHBondContact O-N 3.32Å; A204-L207 VanDerWaalsContact O-CB 3.24Å; A204-L207 WeakPolarHBondContact O-CB 3.31Å; A204-L207 PolarHBondContact O-N 2.95Å; A204-Y244 HydrophobicContact CB-CD2 3.65Å; A204-Y244 HydrophobicContact CB-CE2 3.95Å; A204-Y244 VanDerWaalsContact O-CD2 3.31Å; A204-Y244 WeakPolarHBondContact O-CD2 3.26Å; A204-R247 HydrophobicContact CB-CB 3.6Å; A204-R247 HydrophobicContact CB-CG 4.41Å; A204-L248 HydrophobicContact CB-CD2 4.34Å
205	E	86.9	Confident	69.7	Low	55 Å²	55	84.6 Å²	84.6	26%	0.257	44%	0.444	S	S	.	.	H	α-helix	trans	-62	-34.3	-176.2	-64.3	73.7	-165	0	0	111.7	N202 L207 I208 S209 R251	N202-E205 VanDerWaalsContact CA-OE2 3.32Å; N202-E205 WeakPolarHBondContact CA-OE2 3.22Å; N202-E205 PolarHBondContact O-N 3.38Å; N202-E205 WeakPolarHBondContact OD1-CB 3.44Å; N202-E205 VanDerWaalsContact OD1-CG 3.23Å; N202-E205 WeakPolarHBondContact OD1-CG 3.25Å; N202-E205 PolarHBondContact OD1-OE2 3.49Å; E205-L207 PolarHBondContact O-N 3.23Å; E205-I208 CarbonylContact O-C 3.5Å; E205-I208 VanDerWaalsContact O-CG1 3.27Å; E205-I208 WeakPolarHBondContact O-CG1 3.36Å; E205-I208 PolarHBondContact O-N 2.92Å; E205-S209 WeakPolarHBondContact O-CB 3.45Å; E205-S209 PolarHBondContact O-N 3.22Å; E205-R251 IonicContact OE1-CZ 2.65Å; E205-R251 IonicContact OE1-NH1 2.73Å; E205-R251 PolarHBondContact OE1-NH1 3.37Å; E205-R251 IonicContact OE1-NH2 3.82Å; E205-R251 IonicContact OE2-CZ 3.92Å; E205-R251 IonicContact OE2-NH1 3.58Å; E205-R251 PolarHBondContact OE2-NH1 3.28Å; E205-R251 VanDerWaalsContact OE2-NH1 3.15Å; E205-R251 IonicContact OE2-NH2 3.55Å; E205-R251 PolarHBondContact OE2-NH2 2.92Å
206	S	85.5	Confident	69.9	Low	69 Å²	69	86.4 Å²	86.4	48%	0.483	45%	0.452	S	S	.	.	H	α-helix	trans	-61.8	-26.2	174.3	-58.5	0	0	0	0	113	N202 A204 I208 S209	N202-S206 WeakPolarHBondContact O-CB 3.22Å; N202-S206 PolarHBondContact O-N 3.42Å; N202-S206 PolarHBondContact O-OG 2.96Å; A204-S206 VanDerWaalsContact C-N 3.25Å; A204-S206 PolarHBondContact O-N 3.32Å; S206-I208 VanDerWaalsContact C-N 3.26Å; S206-I208 PolarHBondContact O-N 2.95Å; S206-S209 PolarHBondContact O-OG 3.13Å
207	L	84.1	Confident	69.9	Low	36 Å²	36	84.8 Å²	84.8	19%	0.188	46%	0.462	C	S	.	.	H	α-helix	trans	-69.1	-28.6	175.6	-65.5	164.7	0	0	0	112	D203 A204 E205 L240 M243 R247	D203-L207 WeakPolarHBondContact O-CG 3.31Å; A204-L207 VanDerWaalsContact O-CB 3.24Å; A204-L207 WeakPolarHBondContact O-CB 3.31Å; A204-L207 PolarHBondContact O-N 2.95Å; E205-L207 PolarHBondContact O-N 3.23Å; L207-L240 HydrophobicContact CD2-CD2 4.32Å; L207-M243 HydrophobicContact CD1-CB 3.68Å; L207-M243 HydrophobicContact CD2-CE 3.79Å; L207-M243 HydrophobicContact CD2-SD 4.49Å; L207-R247 HydrophobicContact CD1-CG 4.23Å
208	I	84.9	Confident	70.2	Confident	53 Å²	53	85.7 Å²	85.7	27%	0.272	47%	0.47	S	S	.	.	H	α-helix	trans	-110.9	-7.7	-175.1	60.6	163.9	0	0	0	113.3	E205 S206 N210 L211 Y244	E205-I208 CarbonylContact O-C 3.5Å; E205-I208 VanDerWaalsContact O-CG1 3.27Å; E205-I208 WeakPolarHBondContact O-CG1 3.36Å; E205-I208 PolarHBondContact O-N 2.92Å; S206-I208 VanDerWaalsContact C-N 3.26Å; S206-I208 PolarHBondContact O-N 2.95Å; I208-N210 PolarHBondContact O-N 3.15Å; I208-L211 VanDerWaalsContact O-CB 3.23Å; I208-L211 WeakPolarHBondContact O-CB 3.24Å; I208-L211 PolarHBondContact O-N 3.48Å; I208-Y244 HydrophobicContact CD1-CD1 4.27Å; I208-Y244 HydrophobicContact CD1-CD2 3.92Å; I208-Y244 HydrophobicContact CD1-CE1 3.99Å; I208-Y244 HydrophobicContact CD1-CE2 3.62Å; I208-Y244 HydrophobicContact CD1-CG 4.22Å; I208-Y244 HydrophobicContact CG1-CD2 4.09Å; I208-Y244 HydrophobicContact CG1-CE2 4.19Å; I208-Y244 HydrophobicContact CG1-CG 4.47Å; I208-Y244 HydrophobicContact CG2-CD1 4.26Å; I208-Y244 HydrophobicContact CG2-CD2 4.22Å; I208-Y244 HydrophobicContact CG2-CG 3.82Å
209	S	81.2	Confident	69.9	Low	77 Å²	77	92.9 Å²	92.9	54%	0.538	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-34.5	-172.1	67.6	0	0	0	0	113.5	E205 S206	E205-S209 WeakPolarHBondContact O-CB 3.45Å; E205-S209 PolarHBondContact O-N 3.22Å; S206-S209 PolarHBondContact O-OG 3.13Å
210	N	78.7	Confident	69.7	Low	143 Å²	143	92.2 Å²	92.2	77%	0.765	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	13.3	180	-61.4	-38.2	0	0	0	112.4	I208 L212	I208-N210 PolarHBondContact O-N 3.15Å; N210-L212 PolarHBondContact O-N 3.18Å; N210-L212 VanDerWaalsContact O-N 3.07Å
211	L	80.2	Confident	69.2	Low	23 Å²	23	95 Å²	95	12%	0.12	52%	0.515	C	S	.	.			trans	-71.2	106.1	-179.3	-160	78.9	0	0	0	109.3	I208 F213 Q237 L240 I241	I208-L211 VanDerWaalsContact O-CB 3.23Å; I208-L211 WeakPolarHBondContact O-CB 3.24Å; I208-L211 PolarHBondContact O-N 3.48Å; L211-F213 HydrophobicContact CD2-CE1 4.23Å; L211-F213 HydrophobicContact CD2-CE2 4.44Å; L211-F213 HydrophobicContact CD2-CZ 3.93Å; L211-Q237 HydrophobicContact CD1-CB 3.97Å; L211-Q237 HydrophobicContact CD1-CG 3.72Å; L211-Q237 HydrophobicContact CG-CG 4.39Å; L211-L240 HydrophobicContact CD1-CB 4.29Å; L211-L240 HydrophobicContact CD1-CD1 3.77Å; L211-I241 HydrophobicContact CD2-CD1 3.92Å; L211-I241 HydrophobicContact CD2-CG1 3.85Å
212	L	72.6	Confident	68.1	Low	136 Å²	136	97.2 Å²	97.2	71%	0.712	52%	0.524	S	S	*	.			trans	-84.5	116.2	174.9	-66	173.5	0	0	0	109.8	N210 I214 Q237	N210-L212 PolarHBondContact O-N 3.18Å; N210-L212 VanDerWaalsContact O-N 3.07Å; L212-I214 PolarHBondContact O-N 3.33Å; L212-Q237 PolarHBondContact O-NE2 2.76Å
213	F	68.7	Low	66.9	Low	161 Å²	161	96.3 Å²	96.3	71%	0.706	53%	0.534	S	S	*	.			trans	-77.2	98.5	169.3	-65.2	-83.4	0	0	0	109.2	L211 S215	L211-F213 HydrophobicContact CD2-CE1 4.23Å; L211-F213 HydrophobicContact CD2-CE2 4.44Å; L211-F213 HydrophobicContact CD2-CZ 3.93Å; F213-S215 PolarHBondContact O-N 3.24Å; F213-S215 VanDerWaalsContact O-N 3.13Å
214	I	61.9	Low	65.8	Low	118 Å²	118	97.3 Å²	97.3	61%	0.605	55%	0.551	S	S	*	*			trans	-79.4	94.4	168.6	-55.4	174.9	0	0	0	106.6	L212 D216	L212-I214 PolarHBondContact O-N 3.33Å; I214-D216 VanDerWaalsContact C-N 3.3Å; I214-D216 PolarHBondContact O-N 3.19Å
215	S	58.5	Low	64.3	Low	112 Å²	112	103.2 Å²	103.2	78%	0.783	59%	0.587	S	S	*	*			trans	-69	90.2	167.7	-65.3	0	0	0	0	108.4	F213 G217	F213-S215 PolarHBondContact O-N 3.24Å; F213-S215 VanDerWaalsContact O-N 3.13Å; S215-G217 PolarHBondContact O-N 2.99Å
216	D	54.8	Low	62.6	Low	88 Å²	88	105.1 Å²	105.1	47%	0.471	60%	0.595	S	S	.	*			trans	-71.1	72.3	170.6	-101	-8.9	0	0	0	109.7	I214 K218	I214-D216 VanDerWaalsContact C-N 3.3Å; I214-D216 PolarHBondContact O-N 3.19Å; D216-K218 PolarHBondContact O-N 3.09Å
217	G	49.5	Very low	61	Low	77 Å²	77	105.5 Å²	105.5	79%	0.794	60%	0.596	S	S	*	*			trans	-76.1	5.8	166.3	0	0	0	0	0	112.8	S215	S215-G217 PolarHBondContact O-N 2.99Å
218	K	47.7	Very low	59.4	Low	165 Å²	165	107.9 Å²	107.9	72%	0.717	61%	0.612	S	S	*	*	S	Bend	trans	-117.7	108.8	175.9	-64.5	-170.8	-176.7	179.6	0	108.8	D216 V220	D216-K218 PolarHBondContact O-N 3.09Å; K218-V220 HydrophobicContact CB-CG2 4.09Å; K218-V220 PolarHBondContact O-N 3.48Å
219	Q	46	Very low	57.6	Low	195 Å²	195	110.9 Å²	110.9	91%	0.911	63%	0.625	S	S	*	*			trans	-52.3	89.7	158.7	-69	-91.5	-21.4	0	0	107.9	E221	Q219-E221 PolarHBondContact O-N 2.83Å
220	V	50.5	Low	56.4	Low	72 Å²	72	109.5 Å²	109.5	44%	0.436	61%	0.613	S	S	.	*			trans	-92.1	100.6	174	-178.2	0	0	0	0	107	K218 H222 F226	K218-V220 HydrophobicContact CB-CG2 4.09Å; K218-V220 PolarHBondContact O-N 3.48Å; V220-H222 HydrophobicContact CG1-CB 4.1Å; V220-H222 PolarHBondContact O-N 2.79Å; V220-F226 HydrophobicContact CB-CE1 4.26Å
221	E	50.9	Low	55.4	Low	179 Å²	179	105.4 Å²	105.4	84%	0.836	60%	0.595	S	S	*	*			trans	-65.3	66.4	173.2	-65.9	-175.2	153.1	0	0	111.9	Q219	Q219-E221 PolarHBondContact O-N 2.83Å
222	H	46.3	Very low	54.3	Low	139 Å²	139	108.7 Å²	108.7	64%	0.644	61%	0.612	S	S	*	*			trans	-141.7	92.4	178.9	-72.7	79.3	0	0	0	113.4	V220 F226	V220-H222 HydrophobicContact CG1-CB 4.1Å; V220-H222 PolarHBondContact O-N 2.79Å; H222-F226 WeakPolarHBondContact O-CB 3.46Å
223	G	51.9	Low	54.2	Low	61 Å²	61	104.6 Å²	104.6	63%	0.629	59%	0.592	S	S	*	*	H	α-helix	trans	71.9	144.9	150.3	0	0	0	0	0	118.3	T225 F226 C227	G223-T225 PolarHBondContact O-N 2.77Å; G223-T225 VanDerWaalsContact O-N 3.1Å; G223-F226 PolarHBondContact O-N 2.71Å; G223-F226 VanDerWaalsContact O-N 3.15Å; G223-C227 PolarHBondContact O-N 3.44Å
224	A	57.5	Low	54.6	Low	84 Å²	84	99.1 Å²	99.1	69%	0.694	57%	0.574	S	S	*	*	H	α-helix	trans	-54.1	-32	179	0	0	0	0	0	113.7	C227 V228	A224-C227 PolarHBondContact O-N 3.11Å; A224-V228 WeakPolarHBondContact O-CG2 3.33Å; A224-V228 PolarHBondContact O-N 2.58Å; A224-V228 VanDerWaalsContact O-N 3.15Å
225	T	52.5	Low	55.6	Low	124 Å²	124	99.8 Å²	99.8	76%	0.761	58%	0.575	S	S	*	*	H	α-helix	trans	-68.6	-37.2	-180	-47.6	0	0	0	0	113.4	G223 Q229	G223-T225 PolarHBondContact O-N 2.77Å; G223-T225 VanDerWaalsContact O-N 3.1Å; T225-Q229 PolarHBondContact O-N 3.44Å
226	F	51.5	Low	56.7	Low	96 Å²	96	97 Å²	97	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-69.6	-40.6	176.4	-173.4	-104.3	0	0	0	110.9	V220 H222 G223 V228 Q229 V230	V220-F226 HydrophobicContact CB-CE1 4.26Å; H222-F226 WeakPolarHBondContact O-CB 3.46Å; G223-F226 PolarHBondContact O-N 2.71Å; G223-F226 VanDerWaalsContact O-N 3.15Å; F226-V228 PolarHBondContact O-N 2.9Å; F226-Q229 PolarHBondContact O-N 2.79Å; F226-V230 HydrophobicContact CD1-CG2 4.12Å; F226-V230 HydrophobicContact CE1-CG2 3.79Å; F226-V230 HydrophobicContact CE2-CG2 4.48Å; F226-V230 HydrophobicContact CZ-CG2 3.98Å; F226-V230 WeakPolarHBondContact O-CG2 3.34Å; F226-V230 PolarHBondContact O-N 3.44Å
227	C	51.9	Low	58.1	Low	76 Å²	76	95.1 Å²	95.1	51%	0.514	55%	0.547	S	S	.	.	H	α-helix	trans	-58.7	-44.6	175.8	-177.6	0	0	0	0	111.9	G223 A224 Q229 V230 C231	G223-C227 PolarHBondContact O-N 3.44Å; A224-C227 PolarHBondContact O-N 3.11Å; C227-Q229 PolarHBondContact O-N 2.97Å; C227-V230 PolarHBondContact O-N 3.37Å; C227-C231 WeakPolarHBondContact O-CB 3.41Å; C227-C231 PolarHBondContact O-N 2.87Å; C227-C231 PolarHBondContact O-SG 2.96Å
228	V	48.9	Very low	59.8	Low	86 Å²	86	96.8 Å²	96.8	52%	0.521	54%	0.536	S	S	.	.	H	α-helix	trans	-62.2	-42	176.8	174.7	0	0	0	0	111.8	A224 F226 C231 I232	A224-V228 WeakPolarHBondContact O-CG2 3.33Å; A224-V228 PolarHBondContact O-N 2.58Å; A224-V228 VanDerWaalsContact O-N 3.15Å; F226-V228 PolarHBondContact O-N 2.9Å; V228-C231 PolarHBondContact O-N 2.86Å; V228-I232 HydrophobicContact CG1-CD1 3.78Å; V228-I232 HydrophobicContact CG1-CG1 4.43Å; V228-I232 VanDerWaalsContact O-CG1 3.3Å; V228-I232 WeakPolarHBondContact O-CG1 3.31Å; V228-I232 PolarHBondContact O-N 3.08Å
229	Q	47.5	Very low	61.8	Low	117 Å²	117	92.3 Å²	92.3	55%	0.547	53%	0.525	S	S	.	.	H	α-helix	trans	-66	-41.1	179.3	-172.2	61.6	63.3	0	0	112.3	T225 F226 C227 T233	T225-Q229 PolarHBondContact O-N 3.44Å; F226-Q229 PolarHBondContact O-N 2.79Å; C227-Q229 PolarHBondContact O-N 2.97Å; Q229-T233 WeakPolarHBondContact O-CG2 3.18Å; Q229-T233 PolarHBondContact O-N 3.42Å; Q229-T233 VanDerWaalsContact O-N 3.17Å; Q229-T233 PolarHBondContact O-OG1 2.66Å
230	V	56.2	Low	63.8	Low	48 Å²	48	86 Å²	86	29%	0.291	50%	0.498	S	S	.	.	H	α-helix	trans	-66.1	-40.2	175.7	175.6	0	0	0	0	111.2	F226 C227 T233 S234	F226-V230 HydrophobicContact CD1-CG2 4.12Å; F226-V230 HydrophobicContact CE1-CG2 3.79Å; F226-V230 HydrophobicContact CE2-CG2 4.48Å; F226-V230 HydrophobicContact CZ-CG2 3.98Å; F226-V230 WeakPolarHBondContact O-CG2 3.34Å; F226-V230 PolarHBondContact O-N 3.44Å; C227-V230 PolarHBondContact O-N 3.37Å; V230-T233 WeakPolarHBondContact CA-OG1 3.36Å; V230-T233 PolarHBondContact O-N 2.8Å; V230-T233 PolarHBondContact O-OG1 2.81Å; V230-S234 PolarHBondContact O-N 3.36Å
231	C	58.3	Low	65.6	Low	56 Å²	56	85 Å²	85	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-64.5	-44.4	176.4	-70.9	0	0	0	0	112.8	C227 V228 T233 S234 E235	C227-C231 WeakPolarHBondContact O-CB 3.41Å; C227-C231 PolarHBondContact O-N 2.87Å; C227-C231 PolarHBondContact O-SG 2.96Å; V228-C231 PolarHBondContact O-N 2.86Å; C231-T233 VanDerWaalsContact C-N 3.27Å; C231-T233 PolarHBondContact O-N 2.98Å; C231-S234 PolarHBondContact O-N 3.01Å; C231-S234 PolarHBondContact O-OG 3.29Å; C231-E235 WeakPolarHBondContact O-CG 3.31Å; C231-E235 PolarHBondContact O-N 3.13Å
232	I	57	Low	67.4	Low	93 Å²	93	80.2 Å²	80.2	48%	0.477	48%	0.475	S	S	.	.	H	α-helix	trans	-62.2	-39.2	177.2	-66.7	165.3	0	0	0	110.3	V228 A236	V228-I232 HydrophobicContact CG1-CD1 3.78Å; V228-I232 HydrophobicContact CG1-CG1 4.43Å; V228-I232 VanDerWaalsContact O-CG1 3.3Å; V228-I232 WeakPolarHBondContact O-CG1 3.31Å; V228-I232 PolarHBondContact O-N 3.08Å; I232-A236 VanDerWaalsContact O-CB 3.3Å; I232-A236 WeakPolarHBondContact O-CB 3.3Å; I232-A236 PolarHBondContact O-N 2.84Å
233	T	70.1	Confident	69.5	Low	49 Å²	49	77.5 Å²	77.5	30%	0.301	46%	0.464	S	S	.	.	H	α-helix	trans	-66.2	-40.7	176.8	50.1	0	0	0	0	112.5	Q229 V230 C231 Q237	Q229-T233 WeakPolarHBondContact O-CG2 3.18Å; Q229-T233 PolarHBondContact O-N 3.42Å; Q229-T233 VanDerWaalsContact O-N 3.17Å; Q229-T233 PolarHBondContact O-OG1 2.66Å; V230-T233 WeakPolarHBondContact CA-OG1 3.36Å; V230-T233 PolarHBondContact O-N 2.8Å; V230-T233 PolarHBondContact O-OG1 2.81Å; C231-T233 VanDerWaalsContact C-N 3.27Å; C231-T233 PolarHBondContact O-N 2.98Å; T233-Q237 WeakPolarHBondContact O-CB 3.34Å; T233-Q237 WeakPolarHBondContact O-CG 3.36Å; T233-Q237 PolarHBondContact O-N 3.22Å
234	S	77.6	Confident	71.3	Confident	46 Å²	46	77.4 Å²	77.4	32%	0.322	45%	0.445	S	S	.	.	H	α-helix	trans	-70	-40.6	-179.7	69	0	0	0	0	112.3	V230 C231 Q237 L238	V230-S234 PolarHBondContact O-N 3.36Å; C231-S234 PolarHBondContact O-N 3.01Å; C231-S234 PolarHBondContact O-OG 3.29Å; S234-Q237 PolarHBondContact O-N 3.01Å; S234-L238 WeakPolarHBondContact O-CB 3.48Å; S234-L238 VanDerWaalsContact O-CG 3.25Å; S234-L238 WeakPolarHBondContact O-CG 3.32Å; S234-L238 PolarHBondContact O-N 3.36Å
235	E	81.7	Confident	72.8	Confident	133 Å²	133	77.5 Å²	77.5	62%	0.621	43%	0.433	S	S	*	.	H	α-helix	trans	-65.1	-42.2	176.2	-72	179.9	-177.3	0	0	111.9	C231 Q237 L238 C239	C231-E235 WeakPolarHBondContact O-CG 3.31Å; C231-E235 PolarHBondContact O-N 3.13Å; E235-Q237 VanDerWaalsContact C-N 3.34Å; E235-Q237 PolarHBondContact O-N 3.2Å; E235-L238 PolarHBondContact O-N 2.92Å; E235-C239 WeakPolarHBondContact O-CB 3.5Å; E235-C239 PolarHBondContact O-N 3.37Å
236	A	82	Confident	74.4	Confident	52 Å²	52	75 Å²	75	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-62.6	-42.3	174.8	0	0	0	0	0	111.6	I232 C239 L240	I232-A236 VanDerWaalsContact O-CB 3.3Å; I232-A236 WeakPolarHBondContact O-CB 3.3Å; I232-A236 PolarHBondContact O-N 2.84Å; A236-C239 WeakPolarHBondContact O-CB 3.4Å; A236-C239 PolarHBondContact O-N 3.43Å; A236-L240 WeakPolarHBondContact O-CG 3.12Å; A236-L240 PolarHBondContact O-N 2.81Å
237	Q	84.7	Confident	76.1	Confident	50 Å²	50	75 Å²	75	23%	0.234	42%	0.418	C	S	.	.	H	α-helix	trans	-62.4	-45.6	175.1	-72.9	167.8	-14.3	0	0	111.9	L211 L212 T233 S234 E235 C239 L240 I241	L211-Q237 HydrophobicContact CD1-CB 3.97Å; L211-Q237 HydrophobicContact CD1-CG 3.72Å; L211-Q237 HydrophobicContact CG-CG 4.39Å; L212-Q237 PolarHBondContact O-NE2 2.76Å; T233-Q237 WeakPolarHBondContact O-CB 3.34Å; T233-Q237 WeakPolarHBondContact O-CG 3.36Å; T233-Q237 PolarHBondContact O-N 3.22Å; S234-Q237 PolarHBondContact O-N 3.01Å; E235-Q237 VanDerWaalsContact C-N 3.34Å; E235-Q237 PolarHBondContact O-N 3.2Å; Q237-C239 VanDerWaalsContact C-N 3.29Å; Q237-C239 PolarHBondContact O-N 3.02Å; Q237-L240 PolarHBondContact O-N 3.49Å; Q237-I241 VanDerWaalsContact O-CG1 3.32Å; Q237-I241 WeakPolarHBondContact O-CG1 3.43Å; Q237-I241 PolarHBondContact O-N 3.49Å
238	L	85.4	Confident	77.7	Confident	111 Å²	111	74.1 Å²	74.1	58%	0.581	41%	0.408	S	S	*	.	H	α-helix	trans	-62.8	-36	175.9	-71.9	172.3	0	0	0	111.9	S234 E235 I241 S242	S234-L238 WeakPolarHBondContact O-CB 3.48Å; S234-L238 VanDerWaalsContact O-CG 3.25Å; S234-L238 WeakPolarHBondContact O-CG 3.32Å; S234-L238 PolarHBondContact O-N 3.36Å; E235-L238 PolarHBondContact O-N 2.92Å; L238-I241 PolarHBondContact O-N 2.97Å; L238-S242 WeakPolarHBondContact O-CB 3.49Å; L238-S242 PolarHBondContact O-N 3.4Å
239	C	89.2	Confident	79.5	Confident	72 Å²	72	73.5 Å²	73.5	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-62.8	-47.1	173.8	-171.5	0	0	0	0	111.5	E235 A236 Q237 I241 S242 M243	E235-C239 WeakPolarHBondContact O-CB 3.5Å; E235-C239 PolarHBondContact O-N 3.37Å; A236-C239 WeakPolarHBondContact O-CB 3.4Å; A236-C239 PolarHBondContact O-N 3.43Å; Q237-C239 VanDerWaalsContact C-N 3.29Å; Q237-C239 PolarHBondContact O-N 3.02Å; C239-I241 VanDerWaalsContact C-N 3.33Å; C239-I241 PolarHBondContact O-N 3.05Å; C239-S242 WeakPolarHBondContact O-CB 3.36Å; C239-S242 PolarHBondContact O-N 3.21Å; C239-M243 WeakPolarHBondContact O-CG 3.49Å; C239-M243 PolarHBondContact O-N 3.06Å
240	L	88.6	Confident	81.2	Confident	62 Å²	62	73.1 Å²	73.1	33%	0.325	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-42.7	175.3	-70	173	0	0	0	112	L207 L211 A236 Q237 M243 Y244	L207-L240 HydrophobicContact CD2-CD2 4.32Å; L211-L240 HydrophobicContact CD1-CB 4.29Å; L211-L240 HydrophobicContact CD1-CD1 3.77Å; A236-L240 WeakPolarHBondContact O-CG 3.12Å; A236-L240 PolarHBondContact O-N 2.81Å; Q237-L240 PolarHBondContact O-N 3.49Å; L240-M243 PolarHBondContact O-N 3.32Å; L240-Y244 WeakPolarHBondContact O-CB 3.3Å; L240-Y244 PolarHBondContact O-N 2.85Å
241	I	87.6	Confident	82.4	Confident	52 Å²	52	72.6 Å²	72.6	27%	0.267	39%	0.393	S	S	.	.	H	α-helix	trans	-63.3	-42	175.5	-67.4	165.9	0	0	0	111	L211 Q237 L238 C239 Y244 I245	L211-I241 HydrophobicContact CD2-CD1 3.92Å; L211-I241 HydrophobicContact CD2-CG1 3.85Å; Q237-I241 VanDerWaalsContact O-CG1 3.32Å; Q237-I241 WeakPolarHBondContact O-CG1 3.43Å; Q237-I241 PolarHBondContact O-N 3.49Å; L238-I241 PolarHBondContact O-N 2.97Å; C239-I241 VanDerWaalsContact C-N 3.33Å; C239-I241 PolarHBondContact O-N 3.05Å; I241-Y244 WeakPolarHBondContact O-CB 3.49Å; I241-Y244 PolarHBondContact O-N 3.13Å; I241-I245 HydrophobicContact CG2-CD1 3.89Å; I241-I245 HydrophobicContact CG2-CG1 4.47Å; I241-I245 WeakPolarHBondContact O-CG1 3.42Å; I241-I245 PolarHBondContact O-N 3.02Å
242	S	89.3	Confident	83.5	Confident	77 Å²	77	77.6 Å²	77.6	54%	0.538	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-44.8	176.2	-177.1	0	0	0	0	111.6	L238 C239 Y244 I245 S246	L238-S242 WeakPolarHBondContact O-CB 3.49Å; L238-S242 PolarHBondContact O-N 3.4Å; C239-S242 WeakPolarHBondContact O-CB 3.36Å; C239-S242 PolarHBondContact O-N 3.21Å; S242-Y244 PolarHBondContact O-N 3.05Å; S242-I245 PolarHBondContact O-N 3.19Å; S242-S246 WeakPolarHBondContact O-CB 3.42Å; S242-S246 PolarHBondContact O-N 3.13Å
243	M	90.1	Very high	84.7	Confident	82 Å²	82	79.9 Å²	79.9	40%	0.404	41%	0.41	S	S	.	.	H	α-helix	trans	-60.9	-44.4	174.6	-68	174.8	66.9	0	0	111.6	L207 C239 L240 S246 R247	L207-M243 HydrophobicContact CD1-CB 3.68Å; L207-M243 HydrophobicContact CD2-CE 3.79Å; L207-M243 HydrophobicContact CD2-SD 4.49Å; C239-M243 WeakPolarHBondContact O-CG 3.49Å; C239-M243 PolarHBondContact O-N 3.06Å; L240-M243 PolarHBondContact O-N 3.32Å; M243-S246 WeakPolarHBondContact O-CB 3.4Å; M243-S246 PolarHBondContact O-N 2.75Å; M243-R247 WeakPolarHBondContact O-CG 3.18Å; M243-R247 PolarHBondContact O-N 2.79Å
244	Y	89.5	Confident	85.1	Confident	59 Å²	59	80.6 Å²	80.6	23%	0.231	42%	0.416	C	S	.	.	H	α-helix	trans	-57.1	-50.6	175.5	167.8	-109.3	0	0	0	112.2	A204 I208 L240 I241 S242 S246 R247 L248	A204-Y244 HydrophobicContact CB-CD2 3.65Å; A204-Y244 HydrophobicContact CB-CE2 3.95Å; A204-Y244 VanDerWaalsContact O-CD2 3.31Å; A204-Y244 WeakPolarHBondContact O-CD2 3.26Å; I208-Y244 HydrophobicContact CD1-CD1 4.27Å; I208-Y244 HydrophobicContact CD1-CD2 3.92Å; I208-Y244 HydrophobicContact CD1-CE1 3.99Å; I208-Y244 HydrophobicContact CD1-CE2 3.62Å; I208-Y244 HydrophobicContact CD1-CG 4.22Å; I208-Y244 HydrophobicContact CG1-CD2 4.09Å; I208-Y244 HydrophobicContact CG1-CE2 4.19Å; I208-Y244 HydrophobicContact CG1-CG 4.47Å; I208-Y244 HydrophobicContact CG2-CD1 4.26Å; I208-Y244 HydrophobicContact CG2-CD2 4.22Å; I208-Y244 HydrophobicContact CG2-CG 3.82Å; L240-Y244 WeakPolarHBondContact O-CB 3.3Å; L240-Y244 PolarHBondContact O-N 2.85Å; I241-Y244 WeakPolarHBondContact O-CB 3.49Å; I241-Y244 PolarHBondContact O-N 3.13Å; S242-Y244 PolarHBondContact O-N 3.05Å; Y244-S246 VanDerWaalsContact C-N 3.31Å; Y244-S246 PolarHBondContact O-N 3.03Å; Y244-R247 PolarHBondContact O-N 3.45Å; Y244-L248 HydrophobicContact CD1-CD1 4.33Å; Y244-L248 HydrophobicContact CD2-CG 4.45Å; Y244-L248 HydrophobicContact CE1-CD1 3.65Å; Y244-L248 HydrophobicContact CE1-CG 4.39Å; Y244-L248 HydrophobicContact CE2-CD1 4.04Å; Y244-L248 HydrophobicContact CE2-CD2 4.18Å; Y244-L248 HydrophobicContact CE2-CG 4.04Å; Y244-L248 VanDerWaalsContact CZ-CD1 3.49Å; Y244-L248 PolarHBondContact O-N 2.93Å
245	I	88.1	Confident	85.1	Confident	86 Å²	86	80.5 Å²	80.5	44%	0.441	41%	0.41	S	S	.	.	H	α-helix	trans	-60.5	-42.1	177.4	-68	167.5	0	0	0	110.8	I241 S242 R247 L248 N249	I241-I245 HydrophobicContact CG2-CD1 3.89Å; I241-I245 HydrophobicContact CG2-CG1 4.47Å; I241-I245 WeakPolarHBondContact O-CG1 3.42Å; I241-I245 PolarHBondContact O-N 3.02Å; S242-I245 PolarHBondContact O-N 3.19Å; I245-R247 VanDerWaalsContact C-N 3.31Å; I245-R247 PolarHBondContact O-N 2.76Å; I245-L248 PolarHBondContact O-N 3.42Å; I245-N249 PolarHBondContact O-N 2.9Å; I245-N249 PolarHBondContact O-ND2 3.36Å
246	S	87.9	Confident	85.1	Confident	73 Å²	73	77.4 Å²	77.4	51%	0.51	40%	0.398	S	S	.	.	H	α-helix	trans	-59.2	-42.7	177	-169.8	0	0	0	0	111.9	S242 M243 Y244 N249 E250	S242-S246 WeakPolarHBondContact O-CB 3.42Å; S242-S246 PolarHBondContact O-N 3.13Å; M243-S246 WeakPolarHBondContact O-CB 3.4Å; M243-S246 PolarHBondContact O-N 2.75Å; Y244-S246 VanDerWaalsContact C-N 3.31Å; Y244-S246 PolarHBondContact O-N 3.03Å; S246-N249 PolarHBondContact O-N 2.95Å; S246-E250 PolarHBondContact O-N 3.2Å
247	R	86.3	Confident	84.9	Confident	96 Å²	96	78.6 Å²	78.6	36%	0.362	40%	0.397	S	S	.	.	H	α-helix	trans	-66.3	-40.7	176.6	-66.7	-68.5	178.3	113.7	1.6	112.2	D203 A204 L207 M243 Y244 I245 N249 E250 R251	D203-R247 IonicContact OD2-CZ 3.94Å; D203-R247 IonicContact OD2-NH1 3.32Å; D203-R247 PolarHBondContact OD2-NH1 3.32Å; A204-R247 HydrophobicContact CB-CB 3.6Å; A204-R247 HydrophobicContact CB-CG 4.41Å; L207-R247 HydrophobicContact CD1-CG 4.23Å; M243-R247 WeakPolarHBondContact O-CG 3.18Å; M243-R247 PolarHBondContact O-N 2.79Å; Y244-R247 PolarHBondContact O-N 3.45Å; I245-R247 VanDerWaalsContact C-N 3.31Å; I245-R247 PolarHBondContact O-N 2.76Å; R247-N249 VanDerWaalsContact C-N 3.31Å; R247-N249 PolarHBondContact O-N 3.27Å; R247-E250 PolarHBondContact O-N 3.49Å; R247-R251 WeakPolarHBondContact O-CG 3.44Å; R247-R251 PolarHBondContact O-N 3.49Å
248	L	86	Confident	84.7	Confident	57 Å²	57	78 Å²	78	30%	0.298	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-39.9	174	-69.8	-173.1	0	0	0	112.4	A204 Y244 I245 R251 R252	A204-L248 HydrophobicContact CB-CD2 4.34Å; Y244-L248 HydrophobicContact CD1-CD1 4.33Å; Y244-L248 HydrophobicContact CD2-CG 4.45Å; Y244-L248 HydrophobicContact CE1-CD1 3.65Å; Y244-L248 HydrophobicContact CE1-CG 4.39Å; Y244-L248 HydrophobicContact CE2-CD1 4.04Å; Y244-L248 HydrophobicContact CE2-CD2 4.18Å; Y244-L248 HydrophobicContact CE2-CG 4.04Å; Y244-L248 VanDerWaalsContact CZ-CD1 3.49Å; Y244-L248 PolarHBondContact O-N 2.93Å; I245-L248 PolarHBondContact O-N 3.42Å; L248-R251 PolarHBondContact O-N 2.95Å; L248-R252 PolarHBondContact O-N 3.47Å
249	N	86.6	Confident	84.2	Confident	73 Å²	73	75.1 Å²	75.1	39%	0.39	38%	0.384	S	S	.	.	H	α-helix	trans	-66	-40	176.3	-74.6	-30.1	0	0	0	111.9	I245 S246 R247 R252 K253	I245-N249 PolarHBondContact O-N 2.9Å; I245-N249 PolarHBondContact O-ND2 3.36Å; S246-N249 PolarHBondContact O-N 2.95Å; R247-N249 VanDerWaalsContact C-N 3.31Å; R247-N249 PolarHBondContact O-N 3.27Å; N249-R252 PolarHBondContact O-N 3.11Å; N249-K253 WeakPolarHBondContact O-CG 3.16Å; N249-K253 PolarHBondContact O-N 2.96Å
250	E	82.8	Confident	83.8	Confident	109 Å²	109	78.2 Å²	78.2	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-62.1	-46.6	174.2	-171.8	175.1	-168.3	0	0	111.6	S246 R247 R252 K253 C254	S246-E250 PolarHBondContact O-N 3.2Å; R247-E250 PolarHBondContact O-N 3.49Å; E250-R252 VanDerWaalsContact C-N 3.31Å; E250-R252 PolarHBondContact O-N 3.27Å; E250-K253 WeakPolarHBondContact O-CB 3.3Å; E250-K253 PolarHBondContact O-N 3.27Å; E250-K253 VanDerWaalsContact O-N 3.13Å; E250-C254 PolarHBondContact O-N 2.86Å; E250-C254 PolarHBondContact O-SG 3.11Å; E250-C254 VanDerWaalsContact O-SG 3.34Å
251	R	81.8	Confident	83.4	Confident	37 Å²	37	81.7 Å²	81.7	14%	0.14	40%	0.401	C	S	.	.	H	α-helix	trans	-57.2	-44.1	174.7	-69.5	178.6	-169.9	172.1	3	112.1	M201 D203 E205 R247 L248 K253 C254 K255	M201-R251 VanDerWaalsContact O-CZ 3.28Å; M201-R251 PolarHBondContact O-NH2 3.02Å; D203-R251 IonicContact OD1-CZ 3.7Å; D203-R251 IonicContact OD1-NE 3.72Å; D203-R251 IonicContact OD1-NH2 2.96Å; D203-R251 PolarHBondContact OD1-NH2 3.42Å; E205-R251 IonicContact OE1-CZ 2.65Å; E205-R251 IonicContact OE1-NH1 2.73Å; E205-R251 PolarHBondContact OE1-NH1 3.37Å; E205-R251 IonicContact OE1-NH2 3.82Å; E205-R251 IonicContact OE2-CZ 3.92Å; E205-R251 IonicContact OE2-NH1 3.58Å; E205-R251 PolarHBondContact OE2-NH1 3.28Å; E205-R251 VanDerWaalsContact OE2-NH1 3.15Å; E205-R251 IonicContact OE2-NH2 3.55Å; E205-R251 PolarHBondContact OE2-NH2 2.92Å; R247-R251 WeakPolarHBondContact O-CG 3.44Å; R247-R251 PolarHBondContact O-N 3.49Å; L248-R251 PolarHBondContact O-N 2.95Å; R251-K253 PolarHBondContact O-N 3.31Å; R251-C254 PolarHBondContact O-N 2.96Å; R251-K255 WeakPolarHBondContact O-CG 3.39Å; R251-K255 PolarHBondContact O-N 3.08Å
252	R	80.8	Confident	83.2	Confident	160 Å²	160	82.8 Å²	82.8	60%	0.604	41%	0.407	S	S	*	.	H	α-helix	trans	-61.5	-43.1	176.4	-172.5	178.3	-60.5	177.1	2.5	111.8	L248 N249 E250 K255 N256	L248-R252 PolarHBondContact O-N 3.47Å; N249-R252 PolarHBondContact O-N 3.11Å; E250-R252 VanDerWaalsContact C-N 3.31Å; E250-R252 PolarHBondContact O-N 3.27Å; R252-K255 PolarHBondContact O-N 2.76Å; R252-N256 VanDerWaalsContact O-CG 3.3Å; R252-N256 PolarHBondContact O-N 3.12Å; R252-N256 PolarHBondContact O-OD1 3.3Å
253	K	82.4	Confident	82.8	Confident	142 Å²	142	82.7 Å²	82.7	62%	0.617	40%	0.4	S	S	*	.	H	α-helix	trans	-59.7	-47.8	174.9	-71.6	172.3	-175.9	-179.3	0	111	N249 E250 R251 K255 N256 L257	N249-K253 WeakPolarHBondContact O-CG 3.16Å; N249-K253 PolarHBondContact O-N 2.96Å; E250-K253 WeakPolarHBondContact O-CB 3.3Å; E250-K253 PolarHBondContact O-N 3.27Å; E250-K253 VanDerWaalsContact O-N 3.13Å; R251-K253 PolarHBondContact O-N 3.31Å; K253-K255 VanDerWaalsContact C-N 3.32Å; K253-K255 PolarHBondContact O-N 2.56Å; K253-N256 WeakPolarHBondContact O-CB 3.37Å; K253-N256 PolarHBondContact O-N 2.75Å; K253-N256 VanDerWaalsContact O-N 3.15Å; K253-L257 WeakPolarHBondContact O-CG 3.48Å; K253-L257 PolarHBondContact O-N 3.28Å
254	C	78.1	Confident	82.4	Confident	64 Å²	64	79 Å²	79	43%	0.432	38%	0.382	S	S	.	.	H	α-helix	trans	-57.7	-43.1	176.3	-66	0	0	0	0	112	E250 R251 N256 L257 I258	E250-C254 PolarHBondContact O-N 2.86Å; E250-C254 PolarHBondContact O-SG 3.11Å; E250-C254 VanDerWaalsContact O-SG 3.34Å; R251-C254 PolarHBondContact O-N 2.96Å; C254-N256 PolarHBondContact O-N 3.1Å; C254-L257 WeakPolarHBondContact O-CB 3.3Å; C254-L257 PolarHBondContact O-N 3.3Å; C254-I258 WeakPolarHBondContact O-CG1 3.32Å; C254-I258 PolarHBondContact O-N 3.25Å
255	K	79.1	Confident	82	Confident	43 Å²	43	78.3 Å²	78.3	19%	0.187	39%	0.386	C	S	.	.	H	α-helix	trans	-61.4	-41.8	175.6	-72.3	-179.3	-175	-175.6	0	112.7	D176 D177 R251 R252 K253 L257 I258 S259	D176-K255 WeakPolarHBondContact O-CE 3.35Å; D176-K255 PolarHBondContact O-NZ 3.24Å; D177-K255 WeakPolarHBondContact OD1-CE 3.21Å; D177-K255 IonicContact OD1-NZ 2.71Å; D177-K255 PolarHBondContact OD1-NZ 2.9Å; R251-K255 WeakPolarHBondContact O-CG 3.39Å; R251-K255 PolarHBondContact O-N 3.08Å; R252-K255 PolarHBondContact O-N 2.76Å; K253-K255 VanDerWaalsContact C-N 3.32Å; K253-K255 PolarHBondContact O-N 2.56Å; K255-L257 VanDerWaalsContact C-N 3.34Å; K255-L257 PolarHBondContact O-N 2.84Å; K255-I258 WeakPolarHBondContact O-CB 3.42Å; K255-I258 PolarHBondContact O-N 3.44Å; K255-S259 PolarHBondContact O-N 3.06Å
256	N	80.8	Confident	81.5	Confident	69 Å²	69	78.9 Å²	78.9	37%	0.369	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-43.2	176	-67.2	-8.3	0	0	0	111.1	R252 K253 C254 I258 S259 E260	R252-N256 VanDerWaalsContact O-CG 3.3Å; R252-N256 PolarHBondContact O-N 3.12Å; R252-N256 PolarHBondContact O-OD1 3.3Å; K253-N256 WeakPolarHBondContact O-CB 3.37Å; K253-N256 PolarHBondContact O-N 2.75Å; K253-N256 VanDerWaalsContact O-N 3.15Å; C254-N256 PolarHBondContact O-N 3.1Å; N256-I258 VanDerWaalsContact C-N 3.31Å; N256-I258 PolarHBondContact O-N 3.23Å; N256-S259 PolarHBondContact O-N 3Å; N256-S259 VanDerWaalsContact O-N 3.09Å; N256-S259 PolarHBondContact O-OG 2.8Å; N256-E260 WeakPolarHBondContact O-CB 3.47Å; N256-E260 PolarHBondContact O-N 3.01Å
257	L	78.7	Confident	80.9	Confident	77 Å²	77	78.2 Å²	78.2	40%	0.403	38%	0.375	S	S	.	.	H	α-helix	trans	-60.3	-38.6	177	-66.7	172.4	0	0	0	112.4	K253 C254 K255 S259 E260 Y261	K253-L257 WeakPolarHBondContact O-CG 3.48Å; K253-L257 PolarHBondContact O-N 3.28Å; C254-L257 WeakPolarHBondContact O-CB 3.3Å; C254-L257 PolarHBondContact O-N 3.3Å; K255-L257 VanDerWaalsContact C-N 3.34Å; K255-L257 PolarHBondContact O-N 2.84Å; L257-S259 PolarHBondContact O-N 3.15Å; L257-E260 PolarHBondContact O-N 3.4Å; L257-Y261 HydrophobicContact CB-CD2 4.38Å; L257-Y261 HydrophobicContact CD2-CD2 4.09Å; L257-Y261 HydrophobicContact CD2-CE2 3.59Å; L257-Y261 WeakPolarHBondContact O-CD2 3.43Å; L257-Y261 PolarHBondContact O-N 3.2Å
258	I	78.8	Confident	80.5	Confident	37 Å²	37	75.1 Å²	75.1	19%	0.19	37%	0.365	C	S	.	.	H	α-helix	trans	-54.3	-42.3	175.3	-67.4	168.9	0	0	0	111	F158 F178 C254 K255 N256 D262 L263 I264	F158-I258 HydrophobicContact CE1-CG2 3.93Å; F158-I258 HydrophobicContact CZ-CG2 4.22Å; F178-I258 HydrophobicContact CD2-CD1 4.02Å; F178-I258 HydrophobicContact CE2-CD1 3.6Å; F178-I258 HydrophobicContact CZ-CD1 4.25Å; C254-I258 WeakPolarHBondContact O-CG1 3.32Å; C254-I258 PolarHBondContact O-N 3.25Å; K255-I258 WeakPolarHBondContact O-CB 3.42Å; K255-I258 PolarHBondContact O-N 3.44Å; N256-I258 VanDerWaalsContact C-N 3.31Å; N256-I258 PolarHBondContact O-N 3.23Å; I258-D262 PolarHBondContact O-N 3.16Å; I258-L263 HydrophobicContact CG1-CD1 4.4Å; I258-L263 HydrophobicContact CG2-CB 4.47Å; I258-L263 PolarHBondContact O-N 2.99Å; I258-I264 HydrophobicContact CG2-CD1 3.97Å; I258-I264 HydrophobicContact CG2-CG1 3.76Å
259	S	75.8	Confident	80	Confident	50 Å²	50	80.1 Å²	80.1	35%	0.35	38%	0.384	S	S	.	.	H	α-helix	trans	-76.6	-41.8	179.3	78	0	0	0	0	113.7	V156 K255 N256 L257 Y261 D262	V156-S259 WeakPolarHBondContact CG2-OG 2.94Å; K255-S259 PolarHBondContact O-N 3.06Å; N256-S259 PolarHBondContact O-N 3Å; N256-S259 VanDerWaalsContact O-N 3.09Å; N256-S259 PolarHBondContact O-OG 2.8Å; L257-S259 PolarHBondContact O-N 3.15Å; S259-Y261 VanDerWaalsContact C-N 3.32Å; S259-Y261 PolarHBondContact O-N 3.09Å; S259-D262 PolarHBondContact O-N 3.13Å
260	E	81.8	Confident	79	Confident	138 Å²	138	83.8 Å²	83.8	65%	0.645	40%	0.399	S	S	*	.	H	α-helix	trans	-66.2	-38.1	-174.2	-174.9	177.8	-178.8	0	0	111.1	N256 L257	N256-E260 WeakPolarHBondContact O-CB 3.47Å; N256-E260 PolarHBondContact O-N 3.01Å; L257-E260 PolarHBondContact O-N 3.4Å
261	Y	80.1	Confident	77.9	Confident	134 Å²	134	81.1 Å²	81.1	53%	0.525	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	5.1	178.8	-67.8	-89	0	0	0	113.3	L257 S259 L263 Q266	L257-Y261 HydrophobicContact CB-CD2 4.38Å; L257-Y261 HydrophobicContact CD2-CD2 4.09Å; L257-Y261 HydrophobicContact CD2-CE2 3.59Å; L257-Y261 WeakPolarHBondContact O-CD2 3.43Å; L257-Y261 PolarHBondContact O-N 3.2Å; S259-Y261 VanDerWaalsContact C-N 3.32Å; S259-Y261 PolarHBondContact O-N 3.09Å; Y261-L263 PolarHBondContact O-N 2.9Å; Y261-Q266 PolarHBondContact O-NE2 2.96Å
262	D	82.9	Confident	76.5	Confident	76 Å²	76	87 Å²	87	41%	0.406	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	41.3	-178.9	-165.4	24.9	0	0	0	112.9	Y161 I258 S259 I264 S265 Q266	Y161-D262 PolarHBondContact OH-OD1 3.39Å; I258-D262 PolarHBondContact O-N 3.16Å; S259-D262 PolarHBondContact O-N 3.13Å; D262-I264 PolarHBondContact O-N 2.97Å; D262-S265 VanDerWaalsContact CG-CB 3.43Å; D262-S265 VanDerWaalsContact CG-OG 3.25Å; D262-S265 PolarHBondContact O-N 2.88Å; D262-S265 VanDerWaalsContact O-N 3.15Å; D262-S265 VanDerWaalsContact OD1-CB 3.31Å; D262-S265 WeakPolarHBondContact OD1-CB 3.38Å; D262-S265 PolarHBondContact OD1-OG 2.84Å; D262-S265 WeakPolarHBondContact OD2-CB 3.26Å; D262-S265 PolarHBondContact OD2-OG 2.87Å; D262-S265 VanDerWaalsContact OD2-OG 3.13Å; D262-Q266 PolarHBondContact O-N 3.41Å
263	L	80.9	Confident	74.9	Confident	75 Å²	75	83.2 Å²	83.2	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-63.5	-27.3	-170.4	-64.2	-175.1	0	0	0	112.7	I258 Y261 Q266 F267	I258-L263 HydrophobicContact CG1-CD1 4.4Å; I258-L263 HydrophobicContact CG2-CB 4.47Å; I258-L263 PolarHBondContact O-N 2.99Å; Y261-L263 PolarHBondContact O-N 2.9Å; L263-Q266 PolarHBondContact O-N 2.8Å; L263-F267 WeakPolarHBondContact O-CB 3.38Å; L263-F267 PolarHBondContact O-N 3.17Å
264	I	80.9	Confident	73	Confident	5 Å²	5	83.5 Å²	83.5	3%	0.026	43%	0.428	C	S	.	.	H	α-helix	trans	-66.5	-48.4	176.3	-65.3	179.9	0	0	0	110.6	F158 Y161 L169 F178 I258 D262 Q266 F267 L268	F158-I264 HydrophobicContact CD1-CD1 3.31Å; F158-I264 HydrophobicContact CE1-CD1 3.3Å; F158-I264 HydrophobicContact CZ-CD1 4.48Å; Y161-I264 HydrophobicContact CD1-CG2 3.66Å; Y161-I264 HydrophobicContact CD2-CD1 4.14Å; Y161-I264 HydrophobicContact CD2-CG2 3.97Å; Y161-I264 HydrophobicContact CE1-CB 4.13Å; Y161-I264 HydrophobicContact CE1-CG2 3.42Å; Y161-I264 VanDerWaalsContact CE1-CG2 3.42Å; Y161-I264 HydrophobicContact CE2-CB 3.99Å; Y161-I264 HydrophobicContact CE2-CD1 3.84Å; Y161-I264 HydrophobicContact CE2-CG2 3.75Å; Y161-I264 HydrophobicContact CG-CG2 3.93Å; Y161-I264 VanDerWaalsContact CZ-CG2 3.46Å; L169-I264 HydrophobicContact CD1-CB 4.25Å; L169-I264 HydrophobicContact CD1-CD1 4.09Å; L169-I264 HydrophobicContact CD1-CG1 3.77Å; L169-I264 HydrophobicContact CD1-CG2 3.79Å; F178-I264 HydrophobicContact CZ-CD1 4.21Å; I258-I264 HydrophobicContact CG2-CD1 3.97Å; I258-I264 HydrophobicContact CG2-CG1 3.76Å; D262-I264 PolarHBondContact O-N 2.97Å; I264-Q266 VanDerWaalsContact C-N 3.25Å; I264-Q266 PolarHBondContact O-N 3.37Å; I264-F267 PolarHBondContact O-N 3.25Å; I264-L268 HydrophobicContact CG2-CD1 3.83Å; I264-L268 HydrophobicContact CG2-CG 4.28Å; I264-L268 VanDerWaalsContact O-CG 3.31Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 3.29Å
265	S	80.9	Confident	71.2	Confident	43 Å²	43	82.8 Å²	82.8	30%	0.301	43%	0.431	S	S	.	.	H	α-helix	trans	-62.3	-36.9	178.4	-61.4	0	0	0	0	111.5	Y161 D262 K269	Y161-S265 PolarHBondContact OH-OG 3.28Å; D262-S265 VanDerWaalsContact CG-CB 3.43Å; D262-S265 VanDerWaalsContact CG-OG 3.25Å; D262-S265 PolarHBondContact O-N 2.88Å; D262-S265 VanDerWaalsContact O-N 3.15Å; D262-S265 VanDerWaalsContact OD1-CB 3.31Å; D262-S265 WeakPolarHBondContact OD1-CB 3.38Å; D262-S265 PolarHBondContact OD1-OG 2.84Å; D262-S265 WeakPolarHBondContact OD2-CB 3.26Å; D262-S265 PolarHBondContact OD2-OG 2.87Å; D262-S265 VanDerWaalsContact OD2-OG 3.13Å; S265-K269 WeakPolarHBondContact O-CB 3.33Å; S265-K269 PolarHBondContact O-N 3.34Å
266	Q	78.2	Confident	69.7	Low	99 Å²	99	89 Å²	89	46%	0.463	47%	0.465	S	S	.	.	H	α-helix	trans	-62.8	-50	173.9	-63.8	-177.8	19.9	0	0	111.4	Y261 D262 L263 I264 L268 K269 E270	Y261-Q266 PolarHBondContact O-NE2 2.96Å; D262-Q266 PolarHBondContact O-N 3.41Å; L263-Q266 PolarHBondContact O-N 2.8Å; I264-Q266 VanDerWaalsContact C-N 3.25Å; I264-Q266 PolarHBondContact O-N 3.37Å; Q266-L268 PolarHBondContact O-N 2.98Å; Q266-K269 WeakPolarHBondContact O-CB 3.28Å; Q266-K269 PolarHBondContact O-N 3.27Å; Q266-K269 VanDerWaalsContact O-N 3.13Å; Q266-E270 PolarHBondContact O-N 3.37Å
267	F	76.2	Confident	67.4	Low	59 Å²	59	93.6 Å²	93.6	26%	0.259	48%	0.484	S	S	.	.	H	α-helix	trans	-57.2	-47.8	176.7	177.1	-94.7	0	0	0	112.3	L168 L169 L263 I264 K269 E270 Q271	L168-F267 HydrophobicContact CB-CE1 4.47Å; L169-F267 HydrophobicContact CD2-CD1 3.45Å; L169-F267 VanDerWaalsContact CD2-CD1 3.45Å; L169-F267 HydrophobicContact CD2-CD2 4.29Å; L169-F267 HydrophobicContact CD2-CE1 3.57Å; L169-F267 HydrophobicContact CD2-CE2 4.39Å; L169-F267 HydrophobicContact CD2-CG 3.83Å; L169-F267 HydrophobicContact CD2-CZ 4.04Å; L169-F267 HydrophobicContact CG-CD1 4.11Å; L169-F267 HydrophobicContact CG-CE1 4.12Å; L263-F267 WeakPolarHBondContact O-CB 3.38Å; L263-F267 PolarHBondContact O-N 3.17Å; I264-F267 PolarHBondContact O-N 3.25Å; F267-K269 PolarHBondContact O-N 2.93Å; F267-E270 PolarHBondContact O-N 2.89Å; F267-Q271 HydrophobicContact CD1-CG 4.15Å; F267-Q271 HydrophobicContact CE1-CG 3.77Å; F267-Q271 HydrophobicContact CE2-CG 4.2Å; F267-Q271 HydrophobicContact CZ-CG 3.81Å; F267-Q271 WeakPolarHBondContact O-CG 3.34Å; F267-Q271 PolarHBondContact O-N 3.4Å
268	L	76.6	Confident	65.3	Low	30 Å²	30	96.2 Å²	96.2	16%	0.157	50%	0.498	C	S	.	.	H	α-helix	trans	-66.1	-27.9	179.6	-65.7	174.6	0	0	0	112.5	Y161 D165 I264 Q266	Y161-L268 HydrophobicContact CD1-CD1 3.98Å; Y161-L268 HydrophobicContact CE1-CD1 4.31Å; D165-L268 HydrophobicContact CB-CD1 3.87Å; D165-L268 HydrophobicContact CB-CD2 3.75Å; D165-L268 HydrophobicContact CB-CG 4.48Å; I264-L268 HydrophobicContact CG2-CD1 3.83Å; I264-L268 HydrophobicContact CG2-CG 4.28Å; I264-L268 VanDerWaalsContact O-CG 3.31Å; I264-L268 WeakPolarHBondContact O-CG 3.44Å; I264-L268 PolarHBondContact O-N 3.29Å; Q266-L268 PolarHBondContact O-N 2.98Å
269	K	75.6	Confident	63.4	Low	162 Å²	162	103.7 Å²	103.7	70%	0.704	53%	0.525	S	S	*	.	H	α-helix	trans	-71.2	-40.9	174	-173.7	-177.5	177	-172.7	0	111.7	S265 Q266 F267 Q271	S265-K269 WeakPolarHBondContact O-CB 3.33Å; S265-K269 PolarHBondContact O-N 3.34Å; Q266-K269 WeakPolarHBondContact O-CB 3.28Å; Q266-K269 PolarHBondContact O-N 3.27Å; Q266-K269 VanDerWaalsContact O-N 3.13Å; F267-K269 PolarHBondContact O-N 2.93Å; K269-Q271 VanDerWaalsContact C-N 3.35Å
270	E	66.4	Low	61.7	Low	151 Å²	151	106.3 Å²	106.3	71%	0.706	53%	0.528	S	S	*	.	H	α-helix	trans	-68.1	-33	177.6	-70.3	178.9	-180	0	0	112.8	Q266 F267 K272	Q266-E270 PolarHBondContact O-N 3.37Å; F267-E270 PolarHBondContact O-N 2.89Å; E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.47Å
271	Q	58.2	Low	59.8	Low	53 Å²	53	108.9 Å²	108.9	25%	0.248	54%	0.537	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-9.1	-179.2	-69.8	-69	-6.2	0	0	114.7	F267 K269 P273 W280 Y282	F267-Q271 HydrophobicContact CD1-CG 4.15Å; F267-Q271 HydrophobicContact CE1-CG 3.77Å; F267-Q271 HydrophobicContact CE2-CG 4.2Å; F267-Q271 HydrophobicContact CZ-CG 3.81Å; F267-Q271 WeakPolarHBondContact O-CG 3.34Å; F267-Q271 PolarHBondContact O-N 3.4Å; K269-Q271 VanDerWaalsContact C-N 3.35Å; Q271-P273 WeakPolarHBondContact O-CD 3.46Å; Q271-P273 VanDerWaalsContact O-N 3.15Å; Q271-W280 HydrophobicContact CB-CH2 4.24Å; Q271-Y282 PolarHBondContact OE1-OH 3.11Å
272	K	52.7	Low	58.5	Low	160 Å²	160	106 Å²	106	70%	0.696	53%	0.525	S	S	*	.			trans	-65.6	113	179.2	-76.6	-179.4	-178.9	178.7	0	110.1	E270	E270-K272 VanDerWaalsContact C-N 3.31Å; E270-K272 PolarHBondContact O-N 3.47Å
273	P	47.6	Very low	57.2	Low	80 Å²	80	105 Å²	105	52%	0.519	53%	0.525	S	S	.	.			trans	-64.9	139.8	179.5	-16.8	30.6	0	0	0	110.7	Q271 G275	Q271-P273 WeakPolarHBondContact O-CD 3.46Å; Q271-P273 VanDerWaalsContact O-N 3.15Å; P273-G275 PolarHBondContact O-N 3.41Å
274	C	42	Very low	56.3	Low	148 Å²	148	106 Å²	106	100%	1	54%	0.536	S	S	*	.	S	Bend	trans	-69.9	78.8	163.9	-60	0	0	0	0	109.3
275	G	42	Very low	55.4	Low	50 Å²	50	108.8 Å²	108.8	52%	0.515	56%	0.559	S	S	.	*	S	Bend	trans	166.6	134.6	175.7	0	0	0	0	0	114	P273 H277	P273-G275 PolarHBondContact O-N 3.41Å; G275-H277 VanDerWaalsContact C-N 3.32Å; G275-H277 PolarHBondContact O-N 3.01Å
276	I	46.6	Very low	54.6	Low	174 Å²	174	108.9 Å²	108.9	89%	0.892	56%	0.557	S	S	*	*	S	Bend	trans	-77.3	-9.4	-169.9	-68.8	172.7	0	0	0	113.7
277	H	32.5	Very low	53.9	Low	164 Å²	164	106.8 Å²	106.8	76%	0.759	55%	0.55	S	S	*	*	S	Bend	trans	-150.6	104.7	-178.5	-111.6	-90.6	0	0	0	110	G275	G275-H277 VanDerWaalsContact C-N 3.32Å; G275-H277 PolarHBondContact O-N 3.01Å
278	N	34.3	Very low	53.4	Low	133 Å²	133	112.4 Å²	112.4	71%	0.711	57%	0.57	S	S	*	*			trans	157.4	123.8	139.7	-75.8	-26.2	0	0	0	109.6	W280	N278-W280 PolarHBondContact O-N 3.27Å; N278-W280 VanDerWaalsContact O-N 3.17Å
279	Y	38.8	Very low	53.2	Low	193 Å²	193	116.4 Å²	116.4	76%	0.757	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47.3	118.4	166.3	-97.2	-113.6	0	0	0	109.8	K281	Y279-K281 PolarHBondContact O-N 2.96Å
280	W	39.5	Very low	52.8	Low	106 Å²	106	111.8 Å²	111.8	40%	0.402	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	42.6	41.2	154.4	-50.7	104.3	0	0	0	118.8	L168 Q271 N278 Y282	L168-W280 HydrophobicContact CD1-CH2 4.05Å; L168-W280 HydrophobicContact CD1-CZ2 3.82Å; L168-W280 HydrophobicContact CD2-CH2 4.27Å; L168-W280 HydrophobicContact CD2-CZ2 3.8Å; L168-W280 HydrophobicContact CG-CZ2 4.5Å; Q271-W280 HydrophobicContact CB-CH2 4.24Å; N278-W280 PolarHBondContact O-N 3.27Å; N278-W280 VanDerWaalsContact O-N 3.17Å; W280-Y282 HydrophobicContact CE3-CE2 4.18Å
281	K	43.1	Very low	53	Low	191 Å²	191	109.5 Å²	109.5	83%	0.83	55%	0.552	S	S	*	*			trans	-103.9	78.3	171.2	-147.8	173.9	-171.9	176.5	0	110.7	Y279	Y279-K281 PolarHBondContact O-N 2.96Å
282	Y	52.4	Low	53.7	Low	73 Å²	73	112.2 Å²	112.2	29%	0.286	57%	0.565	S	S	.	*			trans	-61.4	140.6	162	-69.2	-69.1	0	0	0	109.1	Q271 W280 D286 M290	Q271-Y282 PolarHBondContact OE1-OH 3.11Å; W280-Y282 HydrophobicContact CE3-CE2 4.18Å; Y282-D286 HydrophobicContact CD1-CB 4.06Å; Y282-D286 HydrophobicContact CG-CB 4.46Å; Y282-M290 HydrophobicContact CD1-CE 3.78Å; Y282-M290 HydrophobicContact CD1-SD 4.04Å; Y282-M290 HydrophobicContact CD2-SD 4.45Å; Y282-M290 HydrophobicContact CE1-CE 3.21Å; Y282-M290 HydrophobicContact CE1-SD 3.86Å; Y282-M290 HydrophobicContact CE2-CE 4.48Å; Y282-M290 HydrophobicContact CE2-SD 4.27Å; Y282-M290 HydrophobicContact CG-SD 4.34Å
283	S	56	Low	54.7	Low	57 Å²	57	107.4 Å²	107.4	40%	0.399	55%	0.545	S	S	.	.			trans	-60.1	148.8	167.4	175.1	0	0	0	0	109	A285 D286 V287	S283-A285 PolarHBondContact O-N 3.4Å; S283-A285 PolarHBondContact OG-N 3.04Å; S283-D286 VanDerWaalsContact CB-OD2 3.3Å; S283-D286 WeakPolarHBondContact CB-OD2 3.46Å; S283-D286 PolarHBondContact N-OD2 3.44Å; S283-D286 WeakPolarHBondContact O-CA 3.39Å; S283-D286 WeakPolarHBondContact O-CB 3.39Å; S283-D286 PolarHBondContact O-N 2.81Å; S283-V287 PolarHBondContact O-N 3.42Å
284	P	60.9	Low	55.9	Low	96 Å²	96	109.9 Å²	109.9	62%	0.623	54%	0.544	S	S	*	.	H	α-helix	trans	-49.9	-30.8	169.7	-28.5	35.6	0	0	0	113.2	R288	P284-R288 VanDerWaalsContact O-CG 3.31Å; P284-R288 WeakPolarHBondContact O-CG 3.5Å; P284-R288 PolarHBondContact O-N 3.19Å
285	A	63.2	Low	57.5	Low	63 Å²	63	108.2 Å²	108.2	52%	0.521	52%	0.521	S	S	.	.	H	α-helix	trans	-68.3	-40.7	173.6	0	0	0	0	0	112.9	S283 R288 R289	S283-A285 PolarHBondContact O-N 3.4Å; S283-A285 PolarHBondContact OG-N 3.04Å; A285-R288 PolarHBondContact O-N 3.07Å; A285-R289 WeakPolarHBondContact O-CB 3.42Å; A285-R289 PolarHBondContact O-N 3.15Å
286	D	64.2	Low	59	Low	45 Å²	45	108 Å²	108	24%	0.241	51%	0.508	C	S	.	.	H	α-helix	trans	-67.3	-41.2	175.8	-65.5	-50.4	0	0	0	111.1	Y282 S283 R288 R289 M290	Y282-D286 HydrophobicContact CD1-CB 4.06Å; Y282-D286 HydrophobicContact CG-CB 4.46Å; S283-D286 VanDerWaalsContact CB-OD2 3.3Å; S283-D286 WeakPolarHBondContact CB-OD2 3.46Å; S283-D286 PolarHBondContact N-OD2 3.44Å; S283-D286 WeakPolarHBondContact O-CA 3.39Å; S283-D286 WeakPolarHBondContact O-CB 3.39Å; S283-D286 PolarHBondContact O-N 2.81Å; D286-R288 PolarHBondContact O-N 3.48Å; D286-R289 PolarHBondContact O-N 3.24Å; D286-R289 IonicContact OD1-CZ 2.74Å; D286-R289 IonicContact OD1-NH1 2.64Å; D286-R289 PolarHBondContact OD1-NH1 3.49Å; D286-R289 IonicContact OD1-NH2 3.29Å; D286-R289 PolarHBondContact OD1-NH2 3Å; D286-M290 WeakPolarHBondContact O-CB 3.19Å; D286-M290 VanDerWaalsContact O-CG 3.24Å; D286-M290 WeakPolarHBondContact O-CG 3.44Å; D286-M290 PolarHBondContact O-N 3.46Å
287	V	64.1	Low	60.4	Low	54 Å²	54	104.1 Å²	104.1	33%	0.327	49%	0.485	S	S	.	.	H	α-helix	trans	-61.5	-44.8	176.6	178.3	0	0	0	0	110.9	T194 S283 M290 K291	T194-V287 HydrophobicContact CG2-CG1 4.39Å; S283-V287 PolarHBondContact O-N 3.42Å; V287-M290 PolarHBondContact O-N 3.31Å; V287-K291 WeakPolarHBondContact O-CB 3.49Å; V287-K291 PolarHBondContact O-N 3.3Å
288	R	65.5	Low	62.4	Low	177 Å²	177	101.6 Å²	101.6	67%	0.668	47%	0.473	S	S	*	.	H	α-helix	trans	-61.1	-49.3	174.9	-75.3	178.6	-170.1	-175.4	2.7	111.4	P284 A285 D286 M290 K291 E292	P284-R288 VanDerWaalsContact O-CG 3.31Å; P284-R288 WeakPolarHBondContact O-CG 3.5Å; P284-R288 PolarHBondContact O-N 3.19Å; A285-R288 PolarHBondContact O-N 3.07Å; D286-R288 PolarHBondContact O-N 3.48Å; R288-M290 VanDerWaalsContact C-N 3.33Å; R288-M290 PolarHBondContact O-N 3.12Å; R288-K291 WeakPolarHBondContact O-CB 3.42Å; R288-K291 PolarHBondContact O-N 3.46Å; R288-K291 VanDerWaalsContact O-N 3.13Å; R288-E292 WeakPolarHBondContact O-CG 3.46Å; R288-E292 PolarHBondContact O-N 2.62Å
289	R	71.2	Confident	64.2	Low	115 Å²	115	97.3 Å²	97.3	43%	0.434	46%	0.46	S	S	.	.	H	α-helix	trans	-57.3	-45.2	177.4	-173.4	-176	68.7	-124.4	-7.3	111.9	A285 D286 K291 E292 E293 M320	A285-R289 WeakPolarHBondContact O-CB 3.42Å; A285-R289 PolarHBondContact O-N 3.15Å; D286-R289 PolarHBondContact O-N 3.24Å; D286-R289 IonicContact OD1-CZ 2.74Å; D286-R289 IonicContact OD1-NH1 2.64Å; D286-R289 PolarHBondContact OD1-NH1 3.49Å; D286-R289 IonicContact OD1-NH2 3.29Å; D286-R289 PolarHBondContact OD1-NH2 3Å; R289-K291 VanDerWaalsContact C-N 3.34Å; R289-K291 PolarHBondContact O-N 3.35Å; R289-E292 PolarHBondContact O-N 2.7Å; R289-E293 WeakPolarHBondContact O-CB 3.19Å; R289-E293 PolarHBondContact O-N 3.07Å; R289-M320 HydrophobicContact CG-CE 3.57Å; R289-M320 VanDerWaalsContact O-CE 3.3Å; R289-M320 WeakPolarHBondContact O-CE 2.98Å
290	M	67.7	Low	65.9	Low	65 Å²	65	88.2 Å²	88.2	32%	0.32	43%	0.425	S	S	.	.	H	α-helix	trans	-65.5	-35.7	178	-74.4	-179.5	167.3	0	0	112.6	Y282 D286 V287 R288 R294	Y282-M290 HydrophobicContact CD1-CE 3.78Å; Y282-M290 HydrophobicContact CD1-SD 4.04Å; Y282-M290 HydrophobicContact CD2-SD 4.45Å; Y282-M290 HydrophobicContact CE1-CE 3.21Å; Y282-M290 HydrophobicContact CE1-SD 3.86Å; Y282-M290 HydrophobicContact CE2-CE 4.48Å; Y282-M290 HydrophobicContact CE2-SD 4.27Å; Y282-M290 HydrophobicContact CG-SD 4.34Å; D286-M290 WeakPolarHBondContact O-CB 3.19Å; D286-M290 VanDerWaalsContact O-CG 3.24Å; D286-M290 WeakPolarHBondContact O-CG 3.44Å; D286-M290 PolarHBondContact O-N 3.46Å; V287-M290 PolarHBondContact O-N 3.31Å; R288-M290 VanDerWaalsContact C-N 3.33Å; R288-M290 PolarHBondContact O-N 3.12Å; M290-R294 WeakPolarHBondContact O-CB 3.43Å; M290-R294 PolarHBondContact O-N 3.01Å; M290-R294 VanDerWaalsContact O-N 3.08Å
291	K	70.3	Confident	67.6	Low	103 Å²	103	91 Å²	91	45%	0.448	44%	0.435	S	S	.	.	H	α-helix	trans	-65.9	-50.1	174.2	180	-178.1	170.5	-176.5	0	110.9	V287 R288 R289 E293 R294 E295	V287-K291 WeakPolarHBondContact O-CB 3.49Å; V287-K291 PolarHBondContact O-N 3.3Å; R288-K291 WeakPolarHBondContact O-CB 3.42Å; R288-K291 PolarHBondContact O-N 3.46Å; R288-K291 VanDerWaalsContact O-N 3.13Å; R289-K291 VanDerWaalsContact C-N 3.34Å; R289-K291 PolarHBondContact O-N 3.35Å; K291-E293 VanDerWaalsContact C-N 3.33Å; K291-E293 PolarHBondContact O-N 3.09Å; K291-R294 WeakPolarHBondContact O-CB 3.34Å; K291-R294 PolarHBondContact O-N 3.12Å; K291-R294 VanDerWaalsContact O-N 3.15Å; K291-E295 WeakPolarHBondContact CE-OE1 3.1Å; K291-E295 IonicContact NZ-OE1 2.69Å; K291-E295 WeakPolarHBondContact O-CG 3.43Å; K291-E295 PolarHBondContact O-N 3.26Å
292	E	73	Confident	69	Low	109 Å²	109	91.7 Å²	91.7	51%	0.509	43%	0.433	S	S	.	.	H	α-helix	trans	-58	-44.7	177.3	-72	167.3	-176.3	0	0	111.3	R288 R289 R294 E295 L296 M320	R288-E292 WeakPolarHBondContact O-CG 3.46Å; R288-E292 PolarHBondContact O-N 2.62Å; R289-E292 PolarHBondContact O-N 2.7Å; E292-R294 VanDerWaalsContact C-N 3.32Å; E292-R294 PolarHBondContact O-N 2.93Å; E292-E295 PolarHBondContact O-N 3.1Å; E292-L296 VanDerWaalsContact O-CB 3.27Å; E292-L296 WeakPolarHBondContact O-CB 3.3Å; E292-L296 PolarHBondContact O-N 3.44Å; E292-M320 HydrophobicContact CB-CE 4.17Å
293	E	74.6	Confident	70.1	Confident	60 Å²	60	89.8 Å²	89.8	28%	0.28	43%	0.426	S	S	.	.	H	α-helix	trans	-61.4	-40.6	176.7	-167.8	-172.4	151.2	0	0	112	R289 K291 K297 I316 M320	R289-E293 WeakPolarHBondContact O-CB 3.19Å; R289-E293 PolarHBondContact O-N 3.07Å; K291-E293 VanDerWaalsContact C-N 3.33Å; K291-E293 PolarHBondContact O-N 3.09Å; E293-K297 HydrophobicContact CG-CD 4.33Å; E293-K297 WeakPolarHBondContact O-CB 3.39Å; E293-K297 WeakPolarHBondContact O-CG 3.4Å; E293-K297 PolarHBondContact O-N 3.34Å; E293-K297 WeakPolarHBondContact OE1-CE 3.38Å; E293-K297 IonicContact OE1-NZ 3.4Å; E293-K297 PolarHBondContact OE1-NZ 3.42Å; E293-I316 HydrophobicContact CG-CG2 4.24Å; E293-M320 HydrophobicContact CB-CE 3.83Å; E293-M320 HydrophobicContact CB-CG 4.48Å; E293-M320 HydrophobicContact CB-SD 3.95Å; E293-M320 HydrophobicContact CG-CG 4.28Å; E293-M320 HydrophobicContact CG-SD 4.34Å
294	R	72	Confident	70.9	Confident	131 Å²	131	90 Å²	90	49%	0.494	43%	0.426	S	S	.	.	H	α-helix	trans	-68.4	-44.2	178.9	-172.4	-174.1	-61.3	162.9	-0.8	112	F183 M290 K291 E292 L296 K297 E298	F183-R294 VanDerWaalsContact CE2-NH1 3.29Å; M290-R294 WeakPolarHBondContact O-CB 3.43Å; M290-R294 PolarHBondContact O-N 3.01Å; M290-R294 VanDerWaalsContact O-N 3.08Å; K291-R294 WeakPolarHBondContact O-CB 3.34Å; K291-R294 PolarHBondContact O-N 3.12Å; K291-R294 VanDerWaalsContact O-N 3.15Å; E292-R294 VanDerWaalsContact C-N 3.32Å; E292-R294 PolarHBondContact O-N 2.93Å; R294-L296 VanDerWaalsContact C-N 3.31Å; R294-K297 PolarHBondContact O-N 2.86Å; R294-E298 PolarHBondContact O-N 2.85Å
295	E	74.6	Confident	71.6	Confident	114 Å²	114	92.3 Å²	92.3	53%	0.533	43%	0.429	S	S	.	.	H	α-helix	trans	-63.1	-40.6	176.5	-73.1	174.5	173.7	0	0	110.8	K291 E292 E298 G299	K291-E295 WeakPolarHBondContact CE-OE1 3.1Å; K291-E295 IonicContact NZ-OE1 2.69Å; K291-E295 WeakPolarHBondContact O-CG 3.43Å; K291-E295 PolarHBondContact O-N 3.26Å; E292-E295 PolarHBondContact O-N 3.1Å; E295-E298 PolarHBondContact O-N 3.12Å; E295-G299 PolarHBondContact O-N 2.83Å
296	L	73.8	Confident	72.5	Confident	44 Å²	44	95.6 Å²	95.6	23%	0.23	43%	0.432	C	S	.	.	H	α-helix	trans	-62.5	-49.3	174.4	-169.4	64.6	0	0	0	111.4	E292 R294 E298 G299 F300 I316 L319 M320	E292-L296 VanDerWaalsContact O-CB 3.27Å; E292-L296 WeakPolarHBondContact O-CB 3.3Å; E292-L296 PolarHBondContact O-N 3.44Å; R294-L296 VanDerWaalsContact C-N 3.31Å; L296-E298 VanDerWaalsContact C-N 3.34Å; L296-E298 PolarHBondContact O-N 2.8Å; L296-G299 PolarHBondContact O-N 3.08Å; L296-G299 VanDerWaalsContact O-N 3.17Å; L296-F300 HydrophobicContact CD1-CD2 4.15Å; L296-F300 HydrophobicContact CD1-CE2 3.73Å; L296-F300 HydrophobicContact CG-CD2 4.12Å; L296-F300 HydrophobicContact CG-CE2 4.06Å; L296-F300 VanDerWaalsContact O-CD2 3.29Å; L296-F300 WeakPolarHBondContact O-CD2 3.39Å; L296-F300 PolarHBondContact O-N 3Å; L296-I316 HydrophobicContact CD2-CG2 4.2Å; L296-L319 HydrophobicContact CD1-CD1 4.27Å; L296-L319 HydrophobicContact CD2-CB 3.78Å; L296-L319 HydrophobicContact CD2-CD1 4Å; L296-M320 HydrophobicContact CD2-CG 4.39Å; L296-M320 HydrophobicContact CD2-SD 4.16Å
297	K	76.4	Confident	73.1	Confident	94 Å²	94	94.9 Å²	94.9	41%	0.409	43%	0.427	S	S	.	.	H	α-helix	trans	-56.7	-44	175.6	-83.6	171.4	171	172.8	0	112.2	E293 R294 F300 R301 I316	E293-K297 HydrophobicContact CG-CD 4.33Å; E293-K297 WeakPolarHBondContact O-CB 3.39Å; E293-K297 WeakPolarHBondContact O-CG 3.4Å; E293-K297 PolarHBondContact O-N 3.34Å; E293-K297 WeakPolarHBondContact OE1-CE 3.38Å; E293-K297 IonicContact OE1-NZ 3.4Å; E293-K297 PolarHBondContact OE1-NZ 3.42Å; R294-K297 PolarHBondContact O-N 2.86Å; K297-F300 PolarHBondContact O-N 3.19Å; K297-R301 PolarHBondContact O-N 2.98Å; K297-I316 HydrophobicContact CG-CD1 3.67Å; K297-I316 HydrophobicContact CG-CG2 4.48Å
298	E	74.1	Confident	73.9	Confident	111 Å²	111	95.2 Å²	95.2	52%	0.519	43%	0.431	S	S	.	.	H	α-helix	trans	-66.5	-38.5	177.2	-172.8	62.6	-160.3	0	0	111.7	R294 E295 L296 F300 R301	R294-E298 PolarHBondContact O-N 2.85Å; E295-E298 PolarHBondContact O-N 3.12Å; L296-E298 VanDerWaalsContact C-N 3.34Å; L296-E298 PolarHBondContact O-N 2.8Å; E298-F300 PolarHBondContact O-N 2.88Å; E298-R301 WeakPolarHBondContact O-CB 3.48Å; E298-R301 PolarHBondContact O-N 3.49Å; E298-R301 VanDerWaalsContact O-N 3.1Å; E298-R301 VanDerWaalsContact OE1-CD 3.25Å; E298-R301 WeakPolarHBondContact OE1-CD 3.35Å; E298-R301 IonicContact OE1-CZ 3.18Å; E298-R301 IonicContact OE1-NH1 2.81Å; E298-R301 PolarHBondContact OE1-NH1 3.24Å; E298-R301 IonicContact OE2-NH1 3.29Å
299	G	73	Confident	74.6	Confident	42 Å²	42	91.7 Å²	91.7	43%	0.433	43%	0.429	S	S	.	.	H	α-helix	trans	-59.3	-36.2	172.9	0	0	0	0	0	112.7	E295 L296 R301	E295-G299 PolarHBondContact O-N 2.83Å; L296-G299 PolarHBondContact O-N 3.08Å; L296-G299 VanDerWaalsContact O-N 3.17Å; G299-R301 VanDerWaalsContact C-N 3.33Å
300	F	75.3	Confident	75.1	Confident	3 Å²	3	89.9 Å²	89.9	1%	0.013	43%	0.434	C	S	.	.	H	α-helix	trans	-80.6	-7.3	176.8	-82.1	-75.9	0	0	0	114.9	L296 K297 E298 R302 F303 C304 L312 L315 L319 F345	L296-F300 HydrophobicContact CD1-CD2 4.15Å; L296-F300 HydrophobicContact CD1-CE2 3.73Å; L296-F300 HydrophobicContact CG-CD2 4.12Å; L296-F300 HydrophobicContact CG-CE2 4.06Å; L296-F300 VanDerWaalsContact O-CD2 3.29Å; L296-F300 WeakPolarHBondContact O-CD2 3.39Å; L296-F300 PolarHBondContact O-N 3Å; K297-F300 PolarHBondContact O-N 3.19Å; E298-F300 PolarHBondContact O-N 2.88Å; F300-R302 PolarHBondContact O-N 3.25Å; F300-F303 HydrophobicContact CD1-CB 4.4Å; F300-F303 AromaticContact CD1-CD2 4Å; F300-F303 HydrophobicContact CD1-CD2 4Å; F300-F303 WeakPolarHBondContact O-CA 3.4Å; F300-F303 WeakPolarHBondContact O-CB 3.45Å; F300-F303 PolarHBondContact O-N 3.44Å; F300-C304 PolarHBondContact O-N 3.38Å; F300-C304 VanDerWaalsContact O-N 3.15Å; F300-C304 PolarHBondContact O-SG 3.3Å; F300-L312 HydrophobicContact CB-CD1 3.94Å; F300-L312 HydrophobicContact CD1-CD1 4.02Å; F300-L312 HydrophobicContact CG-CD1 3.98Å; F300-L315 HydrophobicContact CE1-CD2 3.83Å; F300-L315 HydrophobicContact CZ-CD2 3.92Å; F300-L319 HydrophobicContact CE2-CD1 3.84Å; F300-L319 HydrophobicContact CZ-CD1 4.07Å; F300-F345 HydrophobicContact CE1-CD2 4.17Å; F300-F345 HydrophobicContact CE1-CE2 4.23Å; F300-F345 HydrophobicContact CE2-CE2 4.43Å; F300-F345 HydrophobicContact CZ-CD2 4.37Å; F300-F345 HydrophobicContact CZ-CE2 4.09Å; F300-F345 HydrophobicContact CZ-CZ 4.31Å
301	R	74	Confident	75.8	Confident	163 Å²	163	90.7 Å²	90.7	62%	0.615	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-37.8	-175.5	-175.3	177.4	178	175.3	2.5	113.9	K297 E298 G299 F303 C304	K297-R301 PolarHBondContact O-N 2.98Å; E298-R301 WeakPolarHBondContact O-CB 3.48Å; E298-R301 PolarHBondContact O-N 3.49Å; E298-R301 VanDerWaalsContact O-N 3.1Å; E298-R301 VanDerWaalsContact OE1-CD 3.25Å; E298-R301 WeakPolarHBondContact OE1-CD 3.35Å; E298-R301 IonicContact OE1-CZ 3.18Å; E298-R301 IonicContact OE1-NH1 2.81Å; E298-R301 PolarHBondContact OE1-NH1 3.24Å; E298-R301 IonicContact OE2-NH1 3.29Å; G299-R301 VanDerWaalsContact C-N 3.33Å; R301-F303 PolarHBondContact O-N 2.75Å; R301-C304 PolarHBondContact O-N 2.99Å
302	R	73.7	Confident	76.2	Confident	207 Å²	207	86.6 Å²	86.6	78%	0.781	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-22.6	179.1	-61.3	-174.4	-174.9	-136.5	3.2	113.3	F300 Q305	F300-R302 PolarHBondContact O-N 3.25Å; R302-Q305 PolarHBondContact O-NE2 3.18Å; R302-Q305 VanDerWaalsContact O-NE2 3.14Å
303	F	74.4	Confident	76.6	Confident	32 Å²	32	87.2 Å²	87.2	14%	0.14	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-17.1	-178.4	-56	-74.6	0	0	0	112.9	F300 R301 Q305 F306 I307 I341 H344 F345	F300-F303 HydrophobicContact CD1-CB 4.4Å; F300-F303 AromaticContact CD1-CD2 4Å; F300-F303 HydrophobicContact CD1-CD2 4Å; F300-F303 WeakPolarHBondContact O-CA 3.4Å; F300-F303 WeakPolarHBondContact O-CB 3.45Å; F300-F303 PolarHBondContact O-N 3.44Å; R301-F303 PolarHBondContact O-N 2.75Å; F303-Q305 PolarHBondContact O-N 3.39Å; F303-F306 PolarHBondContact O-N 3.41Å; F303-I307 HydrophobicContact CB-CD1 4.27Å; F303-I307 PolarHBondContact O-N 2.79Å; F303-I341 HydrophobicContact CB-CG2 4.18Å; F303-I341 HydrophobicContact CD1-CG2 3.31Å; F303-I341 HydrophobicContact CE1-CG2 3.85Å; F303-I341 HydrophobicContact CG-CG2 3.92Å; F303-H344 HydrophobicContact CE1-CB 4.21Å; F303-F345 HydrophobicContact CD2-CD2 4.33Å; F303-F345 AromaticContact CE2-CD2 3.57Å; F303-F345 HydrophobicContact CE2-CD2 3.57Å; F303-F345 HydrophobicContact CE2-CE2 4.3Å; F303-F345 HydrophobicContact CZ-CB 4.2Å; F303-F345 HydrophobicContact CZ-CD2 4.01Å
304	C	72.9	Confident	77	Confident	61 Å²	61	86.5 Å²	86.5	41%	0.412	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-23	177.6	-61.9	0	0	0	0	113.8	F300 R301 F306 L312	F300-C304 PolarHBondContact O-N 3.38Å; F300-C304 VanDerWaalsContact O-N 3.15Å; F300-C304 PolarHBondContact O-SG 3.3Å; R301-C304 PolarHBondContact O-N 2.99Å; C304-F306 VanDerWaalsContact C-N 3.29Å; C304-F306 PolarHBondContact O-N 3.44Å; C304-L312 HydrophobicContact CB-CD2 4.34Å; C304-L312 WeakPolarHBondContact SG-CD2 3.36Å
305	Q	75.2	Confident	77.3	Confident	145 Å²	145	81.2 Å²	81.2	68%	0.678	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-14.2	175.8	68.8	-175.5	-26.6	0	0	114	R302 F303	R302-Q305 PolarHBondContact O-NE2 3.18Å; R302-Q305 VanDerWaalsContact O-NE2 3.14Å; F303-Q305 PolarHBondContact O-N 3.39Å
306	F	81.7	Confident	77.5	Confident	133 Å²	133	76.2 Å²	76.2	58%	0.583	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	-12.1	-174.2	-56.1	-61.3	0	0	0	113.9	F303 C304 I341	F303-F306 PolarHBondContact O-N 3.41Å; C304-F306 VanDerWaalsContact C-N 3.29Å; C304-F306 PolarHBondContact O-N 3.44Å; F306-I341 HydrophobicContact CB-CD1 3.81Å
307	I	77.1	Confident	77.8	Confident	29 Å²	29	77.6 Å²	77.6	15%	0.149	40%	0.398	C	S	.	.	S	Bend	trans	-119.9	132.1	-175.3	-56.1	178.6	0	0	0	108.7	F303 E311 L312 I341	F303-I307 HydrophobicContact CB-CD1 4.27Å; F303-I307 PolarHBondContact O-N 2.79Å; I307-E311 HydrophobicContact CG2-CB 3.86Å; I307-L312 HydrophobicContact CG2-CB 4.02Å; I307-I341 HydrophobicContact CD1-CD1 3.96Å; I307-I341 HydrophobicContact CD1-CG2 4.02Å; I307-I341 HydrophobicContact CG1-CD1 3.5Å; I307-I341 VanDerWaalsContact CG1-CD1 3.5Å
308	P	82.4	Confident	77.8	Confident	62 Å²	62	74.8 Å²	74.8	40%	0.403	39%	0.388	S	S	.	.			trans	-64	144.7	173.4	28.4	-34.2	0	0	0	111.1	S310 E311 L312	P308-S310 VanDerWaalsContact C-N 3.26Å; P308-S310 PolarHBondContact O-N 2.91Å; P308-S310 VanDerWaalsContact O-N 3.13Å; P308-E311 VanDerWaalsContact CD-OE2 3.28Å; P308-E311 WeakPolarHBondContact CD-OE2 3.45Å; P308-E311 HydrophobicContact CG-CB 4.02Å; P308-E311 HydrophobicContact CG-CG 3.81Å; P308-E311 VanDerWaalsContact CG-OE1 3.27Å; P308-E311 WeakPolarHBondContact CG-OE1 3.35Å; P308-E311 VanDerWaalsContact CG-OE2 3.25Å; P308-E311 WeakPolarHBondContact CG-OE2 3.28Å; P308-E311 PolarHBondContact O-N 3.05Å; P308-L312 PolarHBondContact O-N 3.21Å; P308-L312 VanDerWaalsContact O-N 3.16Å
309	V	78.6	Confident	78	Confident	102 Å²	102	70.9 Å²	70.9	62%	0.618	37%	0.37	S	S	*	.	H	α-helix	trans	-54.8	-38.7	-171.5	69.5	0	0	0	0	113.4	E311 L312 E313	V309-E311 PolarHBondContact O-N 3.32Å; V309-L312 PolarHBondContact O-N 2.89Å; V309-E313 HydrophobicContact CG2-CG 4.35Å; V309-E313 WeakPolarHBondContact O-CB 3.26Å; V309-E313 WeakPolarHBondContact O-CG 3.45Å; V309-E313 PolarHBondContact O-N 2.7Å
310	S	82.7	Confident	78.3	Confident	78 Å²	78	71.6 Å²	71.6	55%	0.545	36%	0.363	S	S	.	.	H	α-helix	trans	-65.8	-36.3	-179.2	51.9	0	0	0	0	113.4	P308 A314	P308-S310 VanDerWaalsContact C-N 3.26Å; P308-S310 PolarHBondContact O-N 2.91Å; P308-S310 VanDerWaalsContact O-N 3.13Å; S310-A314 WeakPolarHBondContact O-CB 3.4Å; S310-A314 PolarHBondContact O-N 3.41Å; S310-A314 VanDerWaalsContact O-N 3.1Å
311	E	81.2	Confident	78.4	Confident	81 Å²	81	75.1 Å²	75.1	38%	0.379	39%	0.388	S	S	.	.	H	α-helix	trans	-73.9	-40.4	177.2	-73	168.8	-154.3	0	0	110.7	I307 P308 V309 A314 L315	I307-E311 HydrophobicContact CG2-CB 3.86Å; P308-E311 VanDerWaalsContact CD-OE2 3.28Å; P308-E311 WeakPolarHBondContact CD-OE2 3.45Å; P308-E311 HydrophobicContact CG-CB 4.02Å; P308-E311 HydrophobicContact CG-CG 3.81Å; P308-E311 VanDerWaalsContact CG-OE1 3.27Å; P308-E311 WeakPolarHBondContact CG-OE1 3.35Å; P308-E311 VanDerWaalsContact CG-OE2 3.25Å; P308-E311 WeakPolarHBondContact CG-OE2 3.28Å; P308-E311 PolarHBondContact O-N 3.05Å; V309-E311 PolarHBondContact O-N 3.32Å; E311-A314 PolarHBondContact O-N 3.29Å; E311-L315 WeakPolarHBondContact O-CB 3.43Å; E311-L315 PolarHBondContact O-N 2.97Å
312	L	80	Confident	78.2	Confident	18 Å²	18	70.6 Å²	70.6	9%	0.094	38%	0.376	C	S	.	.	H	α-helix	trans	-63.5	-44.3	176.2	-179.2	64.2	0	0	0	111.7	F300 C304 I307 P308 V309 L315 I316	F300-L312 HydrophobicContact CB-CD1 3.94Å; F300-L312 HydrophobicContact CD1-CD1 4.02Å; F300-L312 HydrophobicContact CG-CD1 3.98Å; C304-L312 HydrophobicContact CB-CD2 4.34Å; C304-L312 WeakPolarHBondContact SG-CD2 3.36Å; I307-L312 HydrophobicContact CG2-CB 4.02Å; P308-L312 PolarHBondContact O-N 3.21Å; P308-L312 VanDerWaalsContact O-N 3.16Å; V309-L312 PolarHBondContact O-N 2.89Å; L312-L315 WeakPolarHBondContact O-CB 2.99Å; L312-L315 PolarHBondContact O-N 3.35Å; L312-I316 HydrophobicContact CD1-CD1 4.04Å; L312-I316 HydrophobicContact CD1-CG1 4.38Å; L312-I316 HydrophobicContact CG-CD1 3.83Å; L312-I316 VanDerWaalsContact O-CG1 3.31Å; L312-I316 WeakPolarHBondContact O-CG1 3.3Å; L312-I316 PolarHBondContact O-N 3.41Å
313	E	81.4	Confident	77.7	Confident	121 Å²	121	62.5 Å²	62.5	57%	0.565	36%	0.357	S	S	*	.	H	α-helix	trans	-61.9	-43.5	175.2	-76.7	177.1	175.1	0	0	111.8	V309 L315 I316 S317	V309-E313 HydrophobicContact CG2-CG 4.35Å; V309-E313 WeakPolarHBondContact O-CB 3.26Å; V309-E313 WeakPolarHBondContact O-CG 3.45Å; V309-E313 PolarHBondContact O-N 2.7Å; E313-L315 VanDerWaalsContact C-N 3.33Å; E313-L315 PolarHBondContact O-N 2.94Å; E313-I316 PolarHBondContact O-N 3.04Å; E313-S317 VanDerWaalsContact O-CB 3.25Å; E313-S317 WeakPolarHBondContact O-CB 3.41Å; E313-S317 PolarHBondContact O-N 3.38Å
314	A	82	Confident	77	Confident	45 Å²	45	67.3 Å²	67.3	37%	0.372	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-43	174.5	0	0	0	0	0	111.2	S310 E311 S317 N318	S310-A314 WeakPolarHBondContact O-CB 3.4Å; S310-A314 PolarHBondContact O-N 3.41Å; S310-A314 VanDerWaalsContact O-N 3.1Å; E311-A314 PolarHBondContact O-N 3.29Å; A314-S317 PolarHBondContact O-N 2.93Å; A314-N318 WeakPolarHBondContact O-CB 3.26Å; A314-N318 VanDerWaalsContact O-CG 3.28Å; A314-N318 PolarHBondContact O-N 3.3Å; A314-N318 PolarHBondContact O-ND2 2.9Å
315	L	78	Confident	76.2	Confident	21 Å²	21	72.5 Å²	72.5	11%	0.11	40%	0.401	C	S	.	.	H	α-helix	trans	-60.9	-50.9	177.2	179.8	65	0	0	0	111.5	F300 E311 L312 E313 S317 N318 L319 I331	F300-L315 HydrophobicContact CE1-CD2 3.83Å; F300-L315 HydrophobicContact CZ-CD2 3.92Å; E311-L315 WeakPolarHBondContact O-CB 3.43Å; E311-L315 PolarHBondContact O-N 2.97Å; L312-L315 WeakPolarHBondContact O-CB 2.99Å; L312-L315 PolarHBondContact O-N 3.35Å; E313-L315 VanDerWaalsContact C-N 3.33Å; E313-L315 PolarHBondContact O-N 2.94Å; L315-S317 PolarHBondContact O-N 3.45Å; L315-N318 PolarHBondContact O-N 2.9Å; L315-L319 HydrophobicContact CD1-CD1 4.32Å; L315-L319 HydrophobicContact CG-CD1 4.07Å; L315-L319 WeakPolarHBondContact O-CG 2.94Å; L315-L319 PolarHBondContact O-N 2.9Å; L315-I331 HydrophobicContact CD1-CD1 3.99Å; L315-I331 HydrophobicContact CD1-CG1 4.11Å
316	I	79.2	Confident	75.3	Confident	9 Å²	9	71.3 Å²	71.3	5%	0.046	39%	0.393	C	S	.	.	H	α-helix	trans	-59.6	-47.3	178.2	-70	162.5	0	0	0	110.5	E293 L296 K297 L312 E313 N318 L319 M320	E293-I316 HydrophobicContact CG-CG2 4.24Å; L296-I316 HydrophobicContact CD2-CG2 4.2Å; K297-I316 HydrophobicContact CG-CD1 3.67Å; K297-I316 HydrophobicContact CG-CG2 4.48Å; L312-I316 HydrophobicContact CD1-CD1 4.04Å; L312-I316 HydrophobicContact CD1-CG1 4.38Å; L312-I316 HydrophobicContact CG-CD1 3.83Å; L312-I316 VanDerWaalsContact O-CG1 3.31Å; L312-I316 WeakPolarHBondContact O-CG1 3.3Å; L312-I316 PolarHBondContact O-N 3.41Å; E313-I316 PolarHBondContact O-N 3.04Å; I316-N318 VanDerWaalsContact C-N 3.3Å; I316-N318 PolarHBondContact O-N 3.31Å; I316-L319 PolarHBondContact O-N 2.93Å; I316-M320 HydrophobicContact CG2-CG 4.28Å; I316-M320 VanDerWaalsContact O-CG 3.28Å; I316-M320 WeakPolarHBondContact O-CG 3.28Å; I316-M320 PolarHBondContact O-N 2.91Å
317	S	80.8	Confident	74	Confident	72 Å²	72	65 Å²	65	50%	0.503	37%	0.367	S	S	.	.	H	α-helix	trans	-59.7	-40.2	178	-176.2	0	0	0	0	112.4	E313 A314 L315 M320 S321	E313-S317 VanDerWaalsContact O-CB 3.25Å; E313-S317 WeakPolarHBondContact O-CB 3.41Å; E313-S317 PolarHBondContact O-N 3.38Å; A314-S317 PolarHBondContact O-N 2.93Å; L315-S317 PolarHBondContact O-N 3.45Å; S317-M320 PolarHBondContact O-N 2.74Å; S317-S321 WeakPolarHBondContact O-CB 3.45Å; S317-S321 PolarHBondContact O-N 3.24Å; S317-S321 PolarHBondContact O-OG 3.29Å
318	N	76.4	Confident	72.9	Confident	36 Å²	36	66 Å²	66	19%	0.193	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-42.9	175.6	-73.5	-55.3	0	0	0	111.6	A314 L315 I316 M320 S321 N322	A314-N318 WeakPolarHBondContact O-CB 3.26Å; A314-N318 VanDerWaalsContact O-CG 3.28Å; A314-N318 PolarHBondContact O-N 3.3Å; A314-N318 PolarHBondContact O-ND2 2.9Å; L315-N318 PolarHBondContact O-N 2.9Å; I316-N318 VanDerWaalsContact C-N 3.3Å; I316-N318 PolarHBondContact O-N 3.31Å; N318-M320 VanDerWaalsContact C-N 3.34Å; N318-M320 PolarHBondContact O-N 3.16Å; N318-S321 PolarHBondContact O-N 2.83Å; N318-S321 PolarHBondContact O-OG 2.87Å; N318-N322 WeakPolarHBondContact O-CB 3.46Å; N318-N322 PolarHBondContact O-N 3.11Å
319	L	78.6	Confident	71.8	Confident	28 Å²	28	70 Å²	70	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-61.2	-42.5	176.3	-73.6	167.7	0	0	0	111.8	L296 F300 L315 I316 G323 A327	L296-L319 HydrophobicContact CD1-CD1 4.27Å; L296-L319 HydrophobicContact CD2-CB 3.78Å; L296-L319 HydrophobicContact CD2-CD1 4Å; F300-L319 HydrophobicContact CE2-CD1 3.84Å; F300-L319 HydrophobicContact CZ-CD1 4.07Å; L315-L319 HydrophobicContact CD1-CD1 4.32Å; L315-L319 HydrophobicContact CG-CD1 4.07Å; L315-L319 WeakPolarHBondContact O-CG 2.94Å; L315-L319 PolarHBondContact O-N 2.9Å; I316-L319 PolarHBondContact O-N 2.93Å; L319-G323 PolarHBondContact O-N 3.26Å; L319-A327 HydrophobicContact CD2-CB 3.36Å; L319-A327 HydrophobicContact CG-CB 3.97Å
320	M	79.1	Confident	70.8	Confident	58 Å²	58	70.4 Å²	70.4	29%	0.286	39%	0.385	S	S	.	.	H	α-helix	trans	-68.4	-34.1	178.7	-69	-59.1	-61	0	0	113.6	R289 E292 E293 L296 I316 S317 N318	R289-M320 HydrophobicContact CG-CE 3.57Å; R289-M320 VanDerWaalsContact O-CE 3.3Å; R289-M320 WeakPolarHBondContact O-CE 2.98Å; E292-M320 HydrophobicContact CB-CE 4.17Å; E293-M320 HydrophobicContact CB-CE 3.83Å; E293-M320 HydrophobicContact CB-CG 4.48Å; E293-M320 HydrophobicContact CB-SD 3.95Å; E293-M320 HydrophobicContact CG-CG 4.28Å; E293-M320 HydrophobicContact CG-SD 4.34Å; L296-M320 HydrophobicContact CD2-CG 4.39Å; L296-M320 HydrophobicContact CD2-SD 4.16Å; I316-M320 HydrophobicContact CG2-CG 4.28Å; I316-M320 VanDerWaalsContact O-CG 3.28Å; I316-M320 WeakPolarHBondContact O-CG 3.28Å; I316-M320 PolarHBondContact O-N 2.91Å; S317-M320 PolarHBondContact O-N 2.74Å; N318-M320 VanDerWaalsContact C-N 3.34Å; N318-M320 PolarHBondContact O-N 3.16Å
321	S	76.5	Confident	69.3	Low	76 Å²	76	67.8 Å²	67.8	53%	0.531	37%	0.365	S	S	.	.	H	α-helix	trans	-92.8	-30.3	-174	54	0	0	0	0	114.4	S317 N318	S317-S321 WeakPolarHBondContact O-CB 3.45Å; S317-S321 PolarHBondContact O-N 3.24Å; S317-S321 PolarHBondContact O-OG 3.29Å; N318-S321 PolarHBondContact O-N 2.83Å; N318-S321 PolarHBondContact O-OG 2.87Å
322	N	69.6	Low	68.1	Low	69 Å²	69	68.1 Å²	68.1	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-126.5	-2.7	-164.1	-75.4	-62.9	0	0	0	114.5	N318 K326	N318-N322 WeakPolarHBondContact O-CB 3.46Å; N318-N322 PolarHBondContact O-N 3.11Å; N322-K326 HydrophobicContact CB-CB 3.85Å; N322-K326 HydrophobicContact CB-CD 3.73Å; N322-K326 HydrophobicContact CB-CG 4.42Å; N322-K326 PolarHBondContact OD1-NZ 2.93Å
323	G	63.4	Low	67.1	Low	36 Å²	36	71.1 Å²	71.1	37%	0.371	40%	0.404	S	S	.	.	H	α-helix	trans	70.7	169.4	-175.9	0	0	0	0	0	113.5	L319 E325 A327	L319-G323 PolarHBondContact O-N 3.26Å; G323-E325 VanDerWaalsContact C-N 3.26Å; G323-E325 PolarHBondContact O-N 3.41Å; G323-A327 PolarHBondContact O-N 3.41Å
324	I	60.7	Low	65.6	Low	134 Å²	134	68.4 Å²	68.4	69%	0.687	39%	0.392	S	S	*	.	H	α-helix	trans	-59.5	-34.1	-171.6	-62	166.9	0	0	0	112.2	A327 A328	I324-A327 PolarHBondContact O-N 2.82Å; I324-A328 WeakPolarHBondContact O-CB 3.49Å; I324-A328 PolarHBondContact O-N 3.05Å
325	E	55.5	Low	64.1	Low	170 Å²	170	77.4 Å²	77.4	79%	0.794	42%	0.417	S	S	*	.	H	α-helix	trans	-65	-48.6	-173.1	-66	-178.3	170.4	0	0	113.5	G323 A328 E329	G323-E325 VanDerWaalsContact C-N 3.26Å; G323-E325 PolarHBondContact O-N 3.41Å; E325-A328 WeakPolarHBondContact O-CB 3.45Å; E325-A328 PolarHBondContact O-N 3Å; E325-E329 PolarHBondContact O-N 2.89Å
326	K	56.7	Low	63.1	Low	119 Å²	119	78.9 Å²	78.9	52%	0.517	44%	0.436	S	S	.	.	H	α-helix	trans	-72.5	-30.8	176.6	-77.3	179.9	175.1	179.7	0	112.5	N322 A328 E329 K330	N322-K326 HydrophobicContact CB-CB 3.85Å; N322-K326 HydrophobicContact CB-CD 3.73Å; N322-K326 HydrophobicContact CB-CG 4.42Å; N322-K326 PolarHBondContact OD1-NZ 2.93Å; K326-A328 VanDerWaalsContact C-N 3.3Å; K326-E329 PolarHBondContact O-N 2.99Å; K326-K330 PolarHBondContact O-N 2.76Å
327	A	55	Low	61.5	Low	2 Å²	2	83.2 Å²	83.2	2%	0.017	47%	0.468	C	S	.	.	H	α-helix	trans	-61.7	-43.2	170.6	0	0	0	0	0	109.9	L319 G323 I324 E329 K330 I331	L319-A327 HydrophobicContact CD2-CB 3.36Å; L319-A327 HydrophobicContact CG-CB 3.97Å; G323-A327 PolarHBondContact O-N 3.41Å; I324-A327 PolarHBondContact O-N 2.82Å; A327-E329 PolarHBondContact O-N 3.03Å; A327-K330 PolarHBondContact O-N 2.86Å; A327-I331 HydrophobicContact CB-CD1 4.4Å; A327-I331 WeakPolarHBondContact O-CB 3.43Å; A327-I331 VanDerWaalsContact O-CD1 3.24Å; A327-I331 WeakPolarHBondContact O-CD1 3.27Å; A327-I331 WeakPolarHBondContact O-CG1 2.97Å; A327-I331 PolarHBondContact O-N 3.16Å
328	A	53.7	Low	59.9	Low	48 Å²	48	82.4 Å²	82.4	40%	0.397	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-39.9	174.5	0	0	0	0	0	112.8	I324 E325 K326 I331 A332	I324-A328 WeakPolarHBondContact O-CB 3.49Å; I324-A328 PolarHBondContact O-N 3.05Å; E325-A328 WeakPolarHBondContact O-CB 3.45Å; E325-A328 PolarHBondContact O-N 3Å; K326-A328 VanDerWaalsContact C-N 3.3Å; A328-I331 PolarHBondContact O-N 3.43Å; A328-A332 VanDerWaalsContact O-CB 3.32Å; A328-A332 WeakPolarHBondContact O-CB 3.33Å; A328-A332 PolarHBondContact O-N 3.27Å
329	E	57.9	Low	58.6	Low	146 Å²	146	82.8 Å²	82.8	68%	0.682	46%	0.464	S	S	*	.	H	α-helix	trans	-62.2	-42.5	173	-74.2	-176.9	165.2	0	0	112.5	E325 K326 A327 A332 S333	E325-E329 PolarHBondContact O-N 2.89Å; K326-E329 PolarHBondContact O-N 2.99Å; A327-E329 PolarHBondContact O-N 3.03Å; E329-A332 PolarHBondContact O-N 2.83Å; E329-S333 PolarHBondContact O-N 2.93Å
330	K	57.7	Low	57.3	Low	112 Å²	112	85.6 Å²	85.6	49%	0.487	48%	0.482	S	S	.	.	H	α-helix	trans	-70.1	-36.1	176.6	-166.7	156.7	-179.6	176.7	0	111.8	K326 A327 S333 M334	K326-K330 PolarHBondContact O-N 2.76Å; A327-K330 PolarHBondContact O-N 2.86Å; K330-S333 WeakPolarHBondContact O-CB 3.42Å; K330-S333 PolarHBondContact O-N 3.41Å; K330-S333 VanDerWaalsContact O-N 3.15Å; K330-S333 PolarHBondContact O-OG 2.85Å; K330-M334 WeakPolarHBondContact O-CG 3.19Å; K330-M334 PolarHBondContact O-N 3.29Å
331	I	51.9	Low	55.9	Low	22 Å²	22	84 Å²	84	11%	0.113	47%	0.474	C	S	.	.	H	α-helix	trans	-65.9	-40.4	173.1	-67.4	158.1	0	0	0	111.4	L315 A327 A328 S333 M334 F342	L315-I331 HydrophobicContact CD1-CD1 3.99Å; L315-I331 HydrophobicContact CD1-CG1 4.11Å; A327-I331 HydrophobicContact CB-CD1 4.4Å; A327-I331 WeakPolarHBondContact O-CB 3.43Å; A327-I331 VanDerWaalsContact O-CD1 3.24Å; A327-I331 WeakPolarHBondContact O-CD1 3.27Å; A327-I331 WeakPolarHBondContact O-CG1 2.97Å; A327-I331 PolarHBondContact O-N 3.16Å; A328-I331 PolarHBondContact O-N 3.43Å; I331-S333 PolarHBondContact O-N 3.4Å; I331-M334 HydrophobicContact CB-CE 3.96Å; I331-M334 HydrophobicContact CG1-CE 3.48Å; I331-M334 VanDerWaalsContact CG1-CE 3.48Å; I331-M334 HydrophobicContact CG2-CE 4.33Å; I331-M334 WeakPolarHBondContact O-CB 3.37Å; I331-M334 PolarHBondContact O-N 3.47Å; I331-F342 HydrophobicContact CD1-CD2 3.79Å; I331-F342 HydrophobicContact CD1-CE1 4.17Å; I331-F342 HydrophobicContact CD1-CE2 3.39Å; I331-F342 HydrophobicContact CD1-CG 4.34Å; I331-F342 HydrophobicContact CD1-CZ 3.59Å; I331-F342 HydrophobicContact CG2-CB 4.34Å; I331-F342 HydrophobicContact CG2-CD2 4.42Å; I331-F342 HydrophobicContact CG2-CG 4.2Å
332	A	55.8	Low	54.7	Low	88 Å²	88	83.1 Å²	83.1	73%	0.727	46%	0.461	S	S	*	.	H	α-helix	trans	-63.6	-22.5	173.5	0	0	0	0	0	112.5	A328 E329	A328-A332 VanDerWaalsContact O-CB 3.32Å; A328-A332 WeakPolarHBondContact O-CB 3.33Å; A328-A332 PolarHBondContact O-N 3.27Å; E329-A332 PolarHBondContact O-N 2.83Å
333	S	60	Low	53.8	Low	82 Å²	82	85.4 Å²	85.4	57%	0.573	47%	0.469	S	S	*	.	H	α-helix	trans	-82.9	-19.7	173.5	85.2	0	0	0	0	114	E329 K330 I331	E329-S333 PolarHBondContact O-N 2.93Å; K330-S333 WeakPolarHBondContact O-CB 3.42Å; K330-S333 PolarHBondContact O-N 3.41Å; K330-S333 VanDerWaalsContact O-N 3.15Å; K330-S333 PolarHBondContact O-OG 2.85Å; I331-S333 PolarHBondContact O-N 3.4Å
334	M	49.8	Very low	53	Low	64 Å²	64	89.2 Å²	89.2	32%	0.315	48%	0.477	S	S	.	.			trans	-76.6	133.9	179.2	-73.9	-167.6	-63.5	0	0	110.8	K330 I331 E338	K330-M334 WeakPolarHBondContact O-CG 3.19Å; K330-M334 PolarHBondContact O-N 3.29Å; I331-M334 HydrophobicContact CB-CE 3.96Å; I331-M334 HydrophobicContact CG1-CE 3.48Å; I331-M334 VanDerWaalsContact CG1-CE 3.48Å; I331-M334 HydrophobicContact CG2-CE 4.33Å; I331-M334 WeakPolarHBondContact O-CB 3.37Å; I331-M334 PolarHBondContact O-N 3.47Å; M334-E338 HydrophobicContact CB-CB 4.38Å; M334-E338 WeakPolarHBondContact CB-OE2 3.26Å
335	R	49.4	Very low	52.4	Low	234 Å²	234	86 Å²	86	88%	0.883	46%	0.459	S	S	*	.			trans	-122.8	123.2	-172.6	-69.9	-171.7	179.6	-152.6	0.2	110.4
336	G	56.9	Low	52.1	Low	51 Å²	51	85.6 Å²	85.6	53%	0.526	45%	0.45	S	S	.	.	S	Bend	trans	128.1	-142.6	169.3	0	0	0	0	0	113.6	E338 A339	G336-E338 PolarHBondContact O-N 2.93Å; G336-E338 VanDerWaalsContact O-N 3.09Å; G336-A339 PolarHBondContact O-N 3.17Å
337	S	47.1	Very low	51.6	Low	100 Å²	100	84.4 Å²	84.4	70%	0.699	45%	0.448	S	S	*	.	H	α-helix	trans	-56.5	-20.5	176.9	44.2	0	0	0	0	113.8	A339	S337-A339 PolarHBondContact O-N 3.46Å
338	E	46.8	Very low	51.1	Low	56 Å²	56	85.8 Å²	85.8	26%	0.262	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-34	177.5	-63.1	168.1	149.9	0	0	113.2	M334 G336	M334-E338 HydrophobicContact CB-CB 4.38Å; M334-E338 WeakPolarHBondContact CB-OE2 3.26Å; G336-E338 PolarHBondContact O-N 2.93Å; G336-E338 VanDerWaalsContact O-N 3.09Å
339	A	49.6	Very low	50.6	Low	43 Å²	43	84.9 Å²	84.9	36%	0.355	46%	0.458	S	S	.	.	H	α-helix	trans	-71.2	-37	-179.1	0	0	0	0	0	112.6	G336 S337 I341 F342 E343	G336-A339 PolarHBondContact O-N 3.17Å; S337-A339 PolarHBondContact O-N 3.46Å; A339-I341 PolarHBondContact O-N 3.25Å; A339-F342 PolarHBondContact O-N 3.31Å; A339-F342 VanDerWaalsContact O-N 3.16Å; A339-E343 PolarHBondContact O-N 3.02Å; A339-E343 VanDerWaalsContact O-N 3.16Å
340	V	51	Low	49.7	Very low	87 Å²	87	81.9 Å²	81.9	53%	0.527	45%	0.446	S	S	.	.	H	α-helix	trans	-62.4	-34.3	-178.6	-179.2	0	0	0	0	111.5	F342 H344	V340-F342 VanDerWaalsContact C-N 3.35Å; V340-H344 PolarHBondContact O-CD2 2.87Å; V340-H344 PolarHBondContact O-N 2.69Å
341	I	48.7	Very low	48.9	Very low	25 Å²	25	79.6 Å²	79.6	13%	0.128	44%	0.442	C	S	.	.	H	α-helix	trans	-69.5	-35.5	-179.8	-63.1	171.9	0	0	0	111.1	F303 F306 I307 A339 H344 F345	F303-I341 HydrophobicContact CB-CG2 4.18Å; F303-I341 HydrophobicContact CD1-CG2 3.31Å; F303-I341 HydrophobicContact CE1-CG2 3.85Å; F303-I341 HydrophobicContact CG-CG2 3.92Å; F306-I341 HydrophobicContact CB-CD1 3.81Å; I307-I341 HydrophobicContact CD1-CD1 3.96Å; I307-I341 HydrophobicContact CD1-CG2 4.02Å; I307-I341 HydrophobicContact CG1-CD1 3.5Å; I307-I341 VanDerWaalsContact CG1-CD1 3.5Å; A339-I341 PolarHBondContact O-N 3.25Å; I341-H344 WeakPolarHBondContact O-CB 3.48Å; I341-H344 PolarHBondContact O-N 2.93Å; I341-F345 PolarHBondContact O-N 3.37Å
342	F	50.9	Low	48	Very low	58 Å²	58	84 Å²	84	25%	0.254	47%	0.465	S	S	.	.	H	α-helix	trans	-78.8	-30.8	179.3	-138.7	-90.4	0	0	0	112.8	I331 A339 V340 H344 F345 R346	I331-F342 HydrophobicContact CD1-CD2 3.79Å; I331-F342 HydrophobicContact CD1-CE1 4.17Å; I331-F342 HydrophobicContact CD1-CE2 3.39Å; I331-F342 HydrophobicContact CD1-CG 4.34Å; I331-F342 HydrophobicContact CD1-CZ 3.59Å; I331-F342 HydrophobicContact CG2-CB 4.34Å; I331-F342 HydrophobicContact CG2-CD2 4.42Å; I331-F342 HydrophobicContact CG2-CG 4.2Å; A339-F342 PolarHBondContact O-N 3.31Å; A339-F342 VanDerWaalsContact O-N 3.16Å; V340-F342 VanDerWaalsContact C-N 3.35Å; F342-H344 PolarHBondContact O-N 2.99Å; F342-F345 HydrophobicContact CE1-CD1 4.46Å; F342-F345 HydrophobicContact CE2-CD1 4.47Å; F342-F345 HydrophobicContact CZ-CD1 4.18Å; F342-F345 PolarHBondContact O-N 2.87Å; F342-R346 WeakPolarHBondContact O-CB 3.21Å; F342-R346 PolarHBondContact O-N 3.46Å
343	E	51.5	Low	47.1	Very low	116 Å²	116	83 Å²	83	54%	0.542	45%	0.452	S	S	.	.	H	α-helix	trans	-55.9	-43.5	165.7	-125.6	89.2	-162.1	0	0	110.1	A339 R346 I347	A339-E343 PolarHBondContact O-N 3.02Å; A339-E343 VanDerWaalsContact O-N 3.16Å; E343-R346 PolarHBondContact O-N 3.12Å; E343-I347 WeakPolarHBondContact O-CB 3.44Å; E343-I347 WeakPolarHBondContact O-CD1 3.19Å; E343-I347 WeakPolarHBondContact O-CG1 3.48Å; E343-I347 PolarHBondContact O-N 3.31Å
344	H	47.3	Very low	45.9	Very low	116 Å²	116	85.9 Å²	85.9	54%	0.537	46%	0.456	S	S	.	.	H	α-helix	trans	-66.8	-36.7	174.5	-84.8	-68.2	0	0	0	113.7	F303 V340 I341 F342 G348	F303-H344 HydrophobicContact CE1-CB 4.21Å; V340-H344 PolarHBondContact O-CD2 2.87Å; V340-H344 PolarHBondContact O-N 2.69Å; I341-H344 WeakPolarHBondContact O-CB 3.48Å; I341-H344 PolarHBondContact O-N 2.93Å; F342-H344 PolarHBondContact O-N 2.99Å; H344-G348 PolarHBondContact O-N 2.94Å
345	F	47.1	Very low	45.2	Very low	67 Å²	67	88.3 Å²	88.3	29%	0.294	47%	0.467	S	S	.	.	H	α-helix	trans	-69.3	-39.3	174.3	-168.1	-92.2	0	0	0	111.9	F300 F303 I341 F342 G348 G349	F300-F345 HydrophobicContact CE1-CD2 4.17Å; F300-F345 HydrophobicContact CE1-CE2 4.23Å; F300-F345 HydrophobicContact CE2-CE2 4.43Å; F300-F345 HydrophobicContact CZ-CD2 4.37Å; F300-F345 HydrophobicContact CZ-CE2 4.09Å; F300-F345 HydrophobicContact CZ-CZ 4.31Å; F303-F345 HydrophobicContact CD2-CD2 4.33Å; F303-F345 AromaticContact CE2-CD2 3.57Å; F303-F345 HydrophobicContact CE2-CD2 3.57Å; F303-F345 HydrophobicContact CE2-CE2 4.3Å; F303-F345 HydrophobicContact CZ-CB 4.2Å; F303-F345 HydrophobicContact CZ-CD2 4.01Å; I341-F345 PolarHBondContact O-N 3.37Å; F342-F345 HydrophobicContact CE1-CD1 4.46Å; F342-F345 HydrophobicContact CE2-CD1 4.47Å; F342-F345 HydrophobicContact CZ-CD1 4.18Å; F342-F345 PolarHBondContact O-N 2.87Å; F345-G348 PolarHBondContact O-N 3.32Å; F345-G349 PolarHBondContact O-N 3.35Å
346	R	48.7	Very low	44.4	Very low	162 Å²	162	80 Å²	80	61%	0.611	45%	0.449	S	S	*	.	H	α-helix	trans	-64.2	-47.2	175	-163.8	-175.2	102.3	166.1	2.8	110.6	F342 E343 G348 G349 D350	F342-R346 WeakPolarHBondContact O-CB 3.21Å; F342-R346 PolarHBondContact O-N 3.46Å; E343-R346 PolarHBondContact O-N 3.12Å; R346-G348 VanDerWaalsContact C-N 3.33Å; R346-G348 PolarHBondContact O-N 3.22Å; R346-G349 PolarHBondContact O-N 3.33Å; R346-D350 IonicContact NE-OD2 3.01Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.22Å; R346-D350 PolarHBondContact O-N 3.07Å
347	I	47.1	Very low	43.1	Very low	94 Å²	94	82.4 Å²	82.4	48%	0.482	45%	0.449	S	S	.	.	H	α-helix	trans	-60.5	-43.2	174.2	-66.1	162.6	0	0	0	110.5	E343 D350 V351	E343-I347 WeakPolarHBondContact O-CB 3.44Å; E343-I347 WeakPolarHBondContact O-CD1 3.19Å; E343-I347 WeakPolarHBondContact O-CG1 3.48Å; E343-I347 PolarHBondContact O-N 3.31Å; I347-D350 PolarHBondContact O-N 3.06Å; I347-V351 VanDerWaalsContact O-CG2 3.22Å; I347-V351 WeakPolarHBondContact O-CG2 3.42Å; I347-V351 PolarHBondContact O-N 3.29Å
348	G	44.9	Very low	42.6	Very low	31 Å²	31	80.8 Å²	80.8	32%	0.32	44%	0.442	S	S	.	.	H	α-helix	trans	-66	-37.1	176.5	0	0	0	0	0	113.5	H344 F345 R346 V351 L352	H344-G348 PolarHBondContact O-N 2.94Å; F345-G348 PolarHBondContact O-N 3.32Å; R346-G348 VanDerWaalsContact C-N 3.33Å; R346-G348 PolarHBondContact O-N 3.22Å; G348-V351 PolarHBondContact O-N 3.35Å; G348-L352 WeakPolarHBondContact O-CB 3.3Å; G348-L352 VanDerWaalsContact O-CG 3.3Å; G348-L352 WeakPolarHBondContact O-CG 3.28Å; G348-L352 PolarHBondContact O-N 3.31Å
349	G	43.3	Very low	41.9	Very low	28 Å²	28	86.6 Å²	86.6	29%	0.289	47%	0.469	S	S	.	.	H	α-helix	trans	-70.3	-38.6	175.3	0	0	0	0	0	112.6	F345 R346 L352 C353	F345-G349 PolarHBondContact O-N 3.35Å; R346-G349 PolarHBondContact O-N 3.33Å; G349-L352 PolarHBondContact O-N 3.37Å; G349-C353 VanDerWaalsContact O-CB 3.25Å; G349-C353 WeakPolarHBondContact O-CB 3.48Å; G349-C353 PolarHBondContact O-N 3.39Å
350	D	39	Very low	41	Very low	83 Å²	83	92.7 Å²	92.7	44%	0.444	49%	0.49	S	S	.	.	H	α-helix	trans	-64.1	-41.4	171.9	-70.5	-25.6	0	0	0	110.1	R346 I347 C353 E354	R346-D350 IonicContact NE-OD2 3.01Å; R346-D350 WeakPolarHBondContact O-CB 3.43Å; R346-D350 VanDerWaalsContact O-CG 3.22Å; R346-D350 PolarHBondContact O-N 3.07Å; I347-D350 PolarHBondContact O-N 3.06Å; D350-C353 PolarHBondContact O-N 3.42Å; D350-E354 WeakPolarHBondContact O-CB 3.34Å; D350-E354 WeakPolarHBondContact O-CG 3.45Å; D350-E354 PolarHBondContact O-N 2.88Å
351	V	40	Very low	39.9	Very low	65 Å²	65	93.3 Å²	93.3	39%	0.394	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-39.9	173.9	171.2	0	0	0	0	112.1	I347 G348 Q355	I347-V351 VanDerWaalsContact O-CG2 3.22Å; I347-V351 WeakPolarHBondContact O-CG2 3.42Å; I347-V351 PolarHBondContact O-N 3.29Å; G348-V351 PolarHBondContact O-N 3.35Å; V351-Q355 WeakPolarHBondContact O-CB 3.45Å; V351-Q355 VanDerWaalsContact O-CG 3.3Å; V351-Q355 WeakPolarHBondContact O-CG 3.5Å; V351-Q355 PolarHBondContact O-N 3.25Å
352	L	33.9	Very low	38.8	Very low	114 Å²	114	98 Å²	98	60%	0.597	52%	0.515	S	S	*	.	H	α-helix	trans	-70	-34.7	175.1	-73.5	171.9	0	0	0	112.2	G348 G349 A356	G348-L352 WeakPolarHBondContact O-CB 3.3Å; G348-L352 VanDerWaalsContact O-CG 3.3Å; G348-L352 WeakPolarHBondContact O-CG 3.28Å; G348-L352 PolarHBondContact O-N 3.31Å; G349-L352 PolarHBondContact O-N 3.37Å; L352-A356 VanDerWaalsContact O-CB 3.22Å; L352-A356 WeakPolarHBondContact O-CB 3.09Å; L352-A356 PolarHBondContact O-N 2.92Å
353	C	36.4	Very low	37.6	Very low	68 Å²	68	102.5 Å²	102.5	46%	0.459	55%	0.547	S	S	.	.	H	α-helix	trans	-71.9	-38.4	175.1	-169.1	0	0	0	0	111.4	G349 D350 A356 N357	G349-C353 VanDerWaalsContact O-CB 3.25Å; G349-C353 WeakPolarHBondContact O-CB 3.48Å; G349-C353 PolarHBondContact O-N 3.39Å; D350-C353 PolarHBondContact O-N 3.42Å; C353-A356 PolarHBondContact O-N 3.17Å; C353-N357 VanDerWaalsContact O-CB 3.26Å; C353-N357 WeakPolarHBondContact O-CB 3.48Å; C353-N357 VanDerWaalsContact O-CG 3.27Å; C353-N357 PolarHBondContact O-N 3.28Å; C353-N357 PolarHBondContact O-ND2 2.88Å
354	E	33.9	Very low	36.3	Very low	142 Å²	142	106 Å²	106	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-65.5	-40.5	170.9	-79	-174.4	165.9	0	0	111.6	D350 N357 A358	D350-E354 WeakPolarHBondContact O-CB 3.34Å; D350-E354 WeakPolarHBondContact O-CG 3.45Å; D350-E354 PolarHBondContact O-N 2.88Å; E354-N357 PolarHBondContact O-N 2.76Å; E354-A358 WeakPolarHBondContact O-CB 3.49Å; E354-A358 PolarHBondContact O-N 3.2Å
355	Q	35.7	Very low	35.1	Very low	114 Å²	114	110.4 Å²	110.4	53%	0.533	57%	0.567	S	S	.	*	H	α-helix	trans	-66.5	-42.3	174.2	-78.4	177.9	-18.8	0	0	112.1	V351 A358 E359	V351-Q355 WeakPolarHBondContact O-CB 3.45Å; V351-Q355 VanDerWaalsContact O-CG 3.3Å; V351-Q355 WeakPolarHBondContact O-CG 3.5Å; V351-Q355 PolarHBondContact O-N 3.25Å; Q355-A358 PolarHBondContact O-N 3.4Å; Q355-E359 PolarHBondContact O-N 3.2Å; Q355-E359 VanDerWaalsContact O-N 3.08Å
356	A	32.4	Very low	34.2	Very low	61 Å²	61	117.4 Å²	117.4	50%	0.504	60%	0.598	S	S	.	*	H	α-helix	trans	-64.8	-38	175.5	0	0	0	0	0	112.3	L352 C353	L352-A356 VanDerWaalsContact O-CB 3.22Å; L352-A356 WeakPolarHBondContact O-CB 3.09Å; L352-A356 PolarHBondContact O-N 2.92Å; C353-A356 PolarHBondContact O-N 3.17Å
357	N	30.6	Very low	33.1	Very low	101 Å²	101	115.1 Å²	115.1	54%	0.54	60%	0.598	S	S	.	*	H	α-helix	trans	-76.1	-28	174.5	-74.7	-23.2	0	0	0	112.7	C353 E354 E360	C353-N357 VanDerWaalsContact O-CB 3.26Å; C353-N357 WeakPolarHBondContact O-CB 3.48Å; C353-N357 VanDerWaalsContact O-CG 3.27Å; C353-N357 PolarHBondContact O-N 3.28Å; C353-N357 PolarHBondContact O-ND2 2.88Å; E354-N357 PolarHBondContact O-N 2.76Å; N357-E360 PolarHBondContact O-N 2.81Å
358	A	35.6	Very low	32.5	Very low	66 Å²	66	123.3 Å²	123.3	55%	0.545	64%	0.637	S	S	.	*	H	α-helix	trans	-72.8	-30.8	177.1	0	0	0	0	0	112.2	E354 Q355 E360 V361	E354-A358 WeakPolarHBondContact O-CB 3.49Å; E354-A358 PolarHBondContact O-N 3.2Å; Q355-A358 PolarHBondContact O-N 3.4Å; A358-E360 PolarHBondContact O-N 3.46Å; A358-V361 PolarHBondContact O-N 3.39Å
359	E	33.2	Very low	31.9	Very low	177 Å²	177	128 Å²	128	83%	0.827	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-21.1	175	-75.8	-171.6	166.8	0	0	113.2	Q355	Q355-E359 PolarHBondContact O-N 3.2Å; Q355-E359 VanDerWaalsContact O-N 3.08Å
360	E	29.6	Very low	31.3	Very low	172 Å²	172	133.2 Å²	133.2	80%	0.804	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-4	175.1	-95.9	-169.4	164.4	0	0	114.8	N357 A358	N357-E360 PolarHBondContact O-N 2.81Å; A358-E360 PolarHBondContact O-N 3.46Å
361	V	29.1	Very low	30.8	Very low	99 Å²	99	136 Å²	136	60%	0.6	69%	0.685	S	S	*	*	S	Bend	trans	-130.4	77	-170	-172.8	0	0	0	0	112.3	A358	A358-V361 PolarHBondContact O-N 3.39Å
362	H	25.1	Very low	30.3	Very low	123 Å²	123	140.2 Å²	140.2	57%	0.569	70%	0.702	S	S	*	*			trans	163	75.8	131.9	-102.5	-107.2	0	0	0	112.2	R364	H362-R364 WeakPolarHBondContact CE1-CD 3.12Å; H362-R364 VanDerWaalsContact CE1-CZ 3.48Å; H362-R364 PolarHBondContact CE1-NE 2.87Å; H362-R364 WeakPolarHBondContact ND1-CD 3.16Å; H362-R364 VanDerWaalsContact ND1-CG 3.32Å; H362-R364 WeakPolarHBondContact ND1-CG 3.45Å; H362-R364 PolarHBondContact O-N 2.87Å; H362-R364 VanDerWaalsContact O-N 3.16Å
363	V	25.9	Very low	30.1	Very low	154 Å²	154	141.8 Å²	141.8	93%	0.933	71%	0.709	S	S	*	*			trans	-80.9	75.5	147.7	-174	0	0	0	0	106.9
364	R	24.6	Very low	29.7	Very low	188 Å²	188	146.7 Å²	146.7	71%	0.709	73%	0.725	S	S	*	*			trans	-97.8	105.8	164.7	-79.9	-161.8	-166.9	176.6	4.3	109.3	H362 F366	H362-R364 WeakPolarHBondContact CE1-CD 3.12Å; H362-R364 VanDerWaalsContact CE1-CZ 3.48Å; H362-R364 PolarHBondContact CE1-NE 2.87Å; H362-R364 WeakPolarHBondContact ND1-CD 3.16Å; H362-R364 VanDerWaalsContact ND1-CG 3.32Å; H362-R364 WeakPolarHBondContact ND1-CG 3.45Å; H362-R364 PolarHBondContact O-N 2.87Å; H362-R364 VanDerWaalsContact O-N 3.16Å; R364-F366 PolarHBondContact O-N 2.86Å
365	R	22	Very low	29.4	Very low	210 Å²	210	147.1 Å²	147.1	79%	0.792	73%	0.73	S	S	*	*			trans	-20.4	113.4	153	-118.1	170.7	169.3	145.1	2.8	111.7	D367	R365-D367 VanDerWaalsContact C-N 3.34Å; R365-D367 WeakPolarHBondContact CD-OD2 3.42Å; R365-D367 IonicContact NE-OD2 2.76Å; R365-D367 PolarHBondContact NE-OD2 2.93Å; R365-D367 PolarHBondContact O-N 2.92Å
366	F	28.3	Very low	28.9	Very low	213 Å²	213	149.6 Å²	149.6	93%	0.934	75%	0.745	S	S	*	*			trans	-82	91.3	152.9	-90.1	-88.2	0	0	0	106.9	R364	R364-F366 PolarHBondContact O-N 2.86Å
367	D	24.7	Very low	28.6	Very low	115 Å²	115	157 Å²	157	62%	0.615	77%	0.765	S	S	*	*			trans	-96.8	101.6	157.3	-76.6	-40.7	0	0	0	107	R365	R365-D367 VanDerWaalsContact C-N 3.34Å; R365-D367 WeakPolarHBondContact CD-OD2 3.42Å; R365-D367 IonicContact NE-OD2 2.76Å; R365-D367 PolarHBondContact NE-OD2 2.93Å; R365-D367 PolarHBondContact O-N 2.92Å
368	M	34.2	Very low	28.4	Very low	266 Å²	266	162.1 Å²	162.1	100%	1.31	79%	0.785	S	S	*	*			trans	-176.2	0	135	-108.3	-173.6	-83.9	0	0	110.4

Retrieved 368 of 368 residues in 682.7 ms (Link to these results)

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