A0A077ZF72_TRITR Loading...

Exocyst complex component 3

AlphaFold DB , UniProt , Accession A0A077ZF72, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 746 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	53.2	Low	78.1	Confident	204 Å²	204	113.5 Å²	113.5	100%	1.005	60%	0.595	S	S	*	*				0	121.3	0	-82.9	-160.1	-77.8	0	0	106.5	V3 L6	M1-V3 PolarHBondContact O-N 3.14Å; M1-L6 HydrophobicContact CB-CD1 3.85Å; M1-L6 HydrophobicContact CG-CD1 4.29Å; M1-L6 HydrophobicContact SD-CD1 3.71Å
2	D	68.9	Low	78.6	Confident	110 Å²	110	108.8 Å²	108.8	59%	0.588	59%	0.585	S	S	*	*			trans	-73.7	107.3	179.3	-149.7	-4.4	0	0	0	107.3	P4 T5 L6	D2-P4 VanDerWaalsContact C-N 3.32Å; D2-P4 WeakPolarHBondContact OD1-CD 3.38Å; D2-T5 HydrophobicContact CB-CG2 4.2Å; D2-T5 PolarHBondContact O-N 2.82Å; D2-T5 PolarHBondContact O-OG1 3.31Å; D2-L6 PolarHBondContact O-N 3.41Å
3	V	78.6	Confident	78.9	Confident	93 Å²	93	103.3 Å²	103.3	56%	0.564	57%	0.57	S	S	*	*	H	α-helix	trans	-56.6	-40.1	-174	-179.5	0	0	0	0	112.4	M1 T5 L6 E7	M1-V3 PolarHBondContact O-N 3.14Å; V3-T5 PolarHBondContact O-N 3.26Å; V3-L6 PolarHBondContact O-N 2.74Å; V3-E7 PolarHBondContact O-N 3.39Å; V3-E7 VanDerWaalsContact O-N 3.11Å
4	P	83.6	Confident	79.3	Confident	76 Å²	76	99.2 Å²	99.2	49%	0.494	56%	0.557	S	S	.	*	H	α-helix	trans	-63.1	-37.9	179.6	-21.4	33.5	0	0	0	113.4	D2 E7 E8	D2-P4 VanDerWaalsContact C-N 3.32Å; D2-P4 WeakPolarHBondContact OD1-CD 3.38Å; P4-E7 PolarHBondContact O-N 2.63Å; P4-E8 PolarHBondContact O-N 3.21Å
5	T	80.2	Confident	79.6	Confident	62 Å²	62	97.7 Å²	97.7	38%	0.38	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-36.5	-178.8	62.3	0	0	0	0	111.6	D2 V3 E7 E8 E9	D2-T5 HydrophobicContact CB-CG2 4.2Å; D2-T5 PolarHBondContact O-N 2.82Å; D2-T5 PolarHBondContact O-OG1 3.31Å; V3-T5 PolarHBondContact O-N 3.26Å; T5-E7 VanDerWaalsContact C-N 3.33Å; T5-E8 PolarHBondContact O-N 2.76Å; T5-E9 WeakPolarHBondContact O-CG 3.34Å; T5-E9 PolarHBondContact O-N 3.46Å
6	L	79.4	Confident	79.8	Confident	71 Å²	71	102.2 Å²	102.2	37%	0.372	56%	0.562	S	S	.	*	H	α-helix	trans	-65.4	-36.6	173.2	-73.1	171.5	0	0	0	112.3	M1 D2 V3 A10	M1-L6 HydrophobicContact CB-CD1 3.85Å; M1-L6 HydrophobicContact CG-CD1 4.29Å; M1-L6 HydrophobicContact SD-CD1 3.71Å; D2-L6 PolarHBondContact O-N 3.41Å; V3-L6 PolarHBondContact O-N 2.74Å; L6-A10 WeakPolarHBondContact O-CB 3.47Å; L6-A10 PolarHBondContact O-N 2.59Å
7	E	83.2	Confident	79.9	Confident	137 Å²	137	101.8 Å²	101.8	64%	0.64	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-42.5	173.7	-75.7	-174.2	166.2	0	0	111.4	V3 P4 T5 A10 F11	V3-E7 PolarHBondContact O-N 3.39Å; V3-E7 VanDerWaalsContact O-N 3.11Å; P4-E7 PolarHBondContact O-N 2.63Å; T5-E7 VanDerWaalsContact C-N 3.33Å; E7-A10 PolarHBondContact O-N 3.29Å; E7-F11 VanDerWaalsContact O-CB 3.26Å; E7-F11 WeakPolarHBondContact O-CB 3.13Å; E7-F11 PolarHBondContact O-N 2.83Å
8	E	82.2	Confident	80	Confident	149 Å²	149	100.8 Å²	100.8	70%	0.696	55%	0.553	S	S	*	*	H	α-helix	trans	-63.5	-44.2	175.1	-77.2	-172.2	161.9	0	0	112.6	P4 T5 F11 A12	P4-E8 PolarHBondContact O-N 3.21Å; T5-E8 PolarHBondContact O-N 2.76Å; E8-F11 PolarHBondContact O-N 3.33Å; E8-A12 WeakPolarHBondContact O-CB 3.29Å; E8-A12 PolarHBondContact O-N 3.33Å
9	E	81.8	Confident	80.1	Confident	132 Å²	132	98.8 Å²	98.8	62%	0.617	55%	0.551	S	S	*	*	H	α-helix	trans	-63.9	-44	176.4	-75.1	180	179.7	0	0	112	T5 F11 A12 G13	T5-E9 WeakPolarHBondContact O-CG 3.34Å; T5-E9 PolarHBondContact O-N 3.46Å; E9-F11 VanDerWaalsContact C-N 3.33Å; E9-F11 PolarHBondContact O-N 3.28Å; E9-A12 PolarHBondContact O-N 3.06Å; E9-G13 PolarHBondContact O-N 3.43Å
10	A	83.2	Confident	80	Confident	66 Å²	66	97.4 Å²	97.4	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-63.9	-40.2	176.8	0	0	0	0	0	111.3	L6 E7 G13 A14	L6-A10 WeakPolarHBondContact O-CB 3.47Å; L6-A10 PolarHBondContact O-N 2.59Å; E7-A10 PolarHBondContact O-N 3.29Å; A10-G13 PolarHBondContact O-N 2.72Å; A10-A14 WeakPolarHBondContact O-CB 3.43Å; A10-A14 PolarHBondContact O-N 3.4Å
11	F	85.3	Confident	79.9	Confident	148 Å²	148	95 Å²	95	65%	0.649	53%	0.533	S	S	*	.	H	α-helix	trans	-64.7	-49.1	175.6	-173.5	-96.4	0	0	0	111.3	E7 E8 E9 G13 A14 V15	E7-F11 VanDerWaalsContact O-CB 3.26Å; E7-F11 WeakPolarHBondContact O-CB 3.13Å; E7-F11 PolarHBondContact O-N 2.83Å; E8-F11 PolarHBondContact O-N 3.33Å; E9-F11 VanDerWaalsContact C-N 3.33Å; E9-F11 PolarHBondContact O-N 3.28Å; F11-G13 VanDerWaalsContact C-N 3.29Å; F11-G13 PolarHBondContact O-N 3.01Å; F11-A14 PolarHBondContact O-N 3.12Å; F11-V15 HydrophobicContact CD1-CG2 4.1Å; F11-V15 HydrophobicContact CE1-CG2 3.76Å; F11-V15 HydrophobicContact CZ-CG2 4.04Å; F11-V15 VanDerWaalsContact O-CG2 3.31Å; F11-V15 WeakPolarHBondContact O-CG2 3.5Å; F11-V15 PolarHBondContact O-N 2.84Å
12	A	84	Confident	81.1	Confident	57 Å²	57	88.3 Å²	88.3	47%	0.471	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-39	176.9	0	0	0	0	0	112.4	E8 E9 K16	E8-A12 WeakPolarHBondContact O-CB 3.29Å; E8-A12 PolarHBondContact O-N 3.33Å; E9-A12 PolarHBondContact O-N 3.06Å; A12-K16 PolarHBondContact O-N 3.36Å; A12-K16 VanDerWaalsContact O-N 3.08Å
13	G	82.8	Confident	81.4	Confident	38 Å²	38	91.1 Å²	91.1	39%	0.392	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-44.7	174.2	0	0	0	0	0	113	E9 A10 F11 V15 K16 Q17	E9-G13 PolarHBondContact O-N 3.43Å; A10-G13 PolarHBondContact O-N 2.72Å; F11-G13 VanDerWaalsContact C-N 3.29Å; F11-G13 PolarHBondContact O-N 3.01Å; G13-V15 VanDerWaalsContact C-N 3.35Å; G13-V15 PolarHBondContact O-N 3.1Å; G13-K16 PolarHBondContact O-N 3.05Å; G13-Q17 WeakPolarHBondContact O-CB 3.18Å; G13-Q17 PolarHBondContact O-N 2.68Å
14	A	83.9	Confident	81.1	Confident	46 Å²	46	88 Å²	88	38%	0.38	50%	0.496	S	S	.	.	H	α-helix	trans	-62.5	-42	176.5	0	0	0	0	0	111.5	A10 F11 Q17 V18	A10-A14 WeakPolarHBondContact O-CB 3.43Å; A10-A14 PolarHBondContact O-N 3.4Å; F11-A14 PolarHBondContact O-N 3.12Å; A14-Q17 PolarHBondContact O-N 3.24Å; A14-V18 WeakPolarHBondContact O-CG2 3.27Å; A14-V18 PolarHBondContact O-N 3.02Å
15	V	83.9	Confident	80.7	Confident	77 Å²	77	89.2 Å²	89.2	47%	0.467	51%	0.507	S	S	.	.	H	α-helix	trans	-60.7	-47.3	175.9	172	0	0	0	0	110.9	F11 G13 Q17 V18 A19	F11-V15 HydrophobicContact CD1-CG2 4.1Å; F11-V15 HydrophobicContact CE1-CG2 3.76Å; F11-V15 HydrophobicContact CZ-CG2 4.04Å; F11-V15 VanDerWaalsContact O-CG2 3.31Å; F11-V15 WeakPolarHBondContact O-CG2 3.5Å; F11-V15 PolarHBondContact O-N 2.84Å; G13-V15 VanDerWaalsContact C-N 3.35Å; G13-V15 PolarHBondContact O-N 3.1Å; V15-Q17 VanDerWaalsContact C-N 3.32Å; V15-Q17 PolarHBondContact O-N 2.92Å; V15-V18 PolarHBondContact O-N 3.33Å; V15-A19 VanDerWaalsContact O-CB 3.31Å; V15-A19 WeakPolarHBondContact O-CB 3.3Å; V15-A19 PolarHBondContact O-N 3.28Å
16	K	83.3	Confident	80.4	Confident	169 Å²	169	90.9 Å²	90.9	74%	0.735	51%	0.514	S	S	*	.	H	α-helix	trans	-59.1	-42.5	174.5	-87.8	-176.4	176.3	176.3	0	112.4	A12 G13 A19 S20	A12-K16 PolarHBondContact O-N 3.36Å; A12-K16 VanDerWaalsContact O-N 3.08Å; G13-K16 PolarHBondContact O-N 3.05Å; K16-A19 PolarHBondContact O-N 2.73Å; K16-S20 PolarHBondContact O-N 3.49Å
17	Q	81.6	Confident	80.1	Confident	96 Å²	96	89.6 Å²	89.6	45%	0.449	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-44.3	-178.8	-169.3	172	38.6	0	0	111.5	G13 A14 V15 S20 M21	G13-Q17 WeakPolarHBondContact O-CB 3.18Å; G13-Q17 PolarHBondContact O-N 2.68Å; A14-Q17 PolarHBondContact O-N 3.24Å; V15-Q17 VanDerWaalsContact C-N 3.32Å; V15-Q17 PolarHBondContact O-N 2.92Å; Q17-S20 PolarHBondContact O-N 3.36Å; Q17-S20 PolarHBondContact O-OG 2.69Å; Q17-M21 HydrophobicContact CG-CE 3.8Å; Q17-M21 WeakPolarHBondContact O-CG 3.46Å; Q17-M21 PolarHBondContact O-N 3.25Å; Q17-M21 VanDerWaalsContact O-N 3.16Å
18	V	81.8	Confident	79.7	Confident	84 Å²	84	87.6 Å²	87.6	51%	0.509	50%	0.499	S	S	.	.	H	α-helix	trans	-63.8	-43.4	176.2	173.7	0	0	0	0	110.7	A14 V15 S20 M21 I22	A14-V18 WeakPolarHBondContact O-CG2 3.27Å; A14-V18 PolarHBondContact O-N 3.02Å; V15-V18 PolarHBondContact O-N 3.33Å; V18-S20 VanDerWaalsContact C-N 3.25Å; V18-S20 PolarHBondContact O-N 3.34Å; V18-M21 PolarHBondContact O-N 2.93Å; V18-M21 VanDerWaalsContact O-N 3.09Å; V18-I22 HydrophobicContact CG1-CD1 4.18Å; V18-I22 PolarHBondContact O-N 3.36Å
19	A	80.2	Confident	79.4	Confident	62 Å²	62	87.5 Å²	87.5	51%	0.512	50%	0.503	S	S	.	.	H	α-helix	trans	-60.4	-34.2	175.8	0	0	0	0	0	112.6	V15 K16	V15-A19 VanDerWaalsContact O-CB 3.31Å; V15-A19 WeakPolarHBondContact O-CB 3.3Å; V15-A19 PolarHBondContact O-N 3.28Å; K16-A19 PolarHBondContact O-N 2.73Å
20	S	79.5	Confident	79.2	Confident	70 Å²	70	85.9 Å²	85.9	49%	0.49	49%	0.494	S	S	.	.	H	α-helix	trans	-74.2	-24.6	176	74	0	0	0	0	114	K16 Q17 V18	K16-S20 PolarHBondContact O-N 3.49Å; Q17-S20 PolarHBondContact O-N 3.36Å; Q17-S20 PolarHBondContact O-OG 2.69Å; V18-S20 VanDerWaalsContact C-N 3.25Å; V18-S20 PolarHBondContact O-N 3.34Å
21	M	76.8	Confident	79.1	Confident	47 Å²	47	85.5 Å²	85.5	23%	0.232	48%	0.483	C	S	.	.	H	α-helix	trans	-85.6	-28.9	-178.9	-70.7	178.7	178	0	0	113.1	Q17 V18 Y34	Q17-M21 HydrophobicContact CG-CE 3.8Å; Q17-M21 WeakPolarHBondContact O-CG 3.46Å; Q17-M21 PolarHBondContact O-N 3.25Å; Q17-M21 VanDerWaalsContact O-N 3.16Å; V18-M21 PolarHBondContact O-N 2.93Å; V18-M21 VanDerWaalsContact O-N 3.09Å; M21-Y34 HydrophobicContact SD-CD1 4.19Å
22	I	78.3	Confident	79.1	Confident	65 Å²	65	84.1 Å²	84.1	33%	0.333	48%	0.482	S	S	.	.			trans	-116.3	67.5	-174.7	-48.1	176.5	0	0	0	109.5	V18 L28 L31	V18-I22 HydrophobicContact CG1-CD1 4.18Å; V18-I22 PolarHBondContact O-N 3.36Å; I22-L28 HydrophobicContact CG2-CD2 4.36Å; I22-L28 HydrophobicContact CG2-CG 4.44Å; I22-L31 HydrophobicContact CD1-CD1 4.03Å
23	Q	75.6	Confident	79.1	Confident	168 Å²	168	87.3 Å²	87.3	79%	0.785	49%	0.487	S	S	*	.	S	Bend	trans	-86.4	-15	178.8	-67.6	-173.4	-7.9	0	0	114
24	G	72.5	Confident	79.2	Confident	27 Å²	27	87.6 Å²	87.6	28%	0.278	48%	0.476	S	S	.	.	S	Bend	trans	-147.5	160.7	-177.9	0	0	0	0	0	112.2	D26 Q27	G24-D26 VanDerWaalsContact C-OD1 3.31Å; G24-D26 WeakPolarHBondContact CA-OD1 3.32Å; G24-D26 PolarHBondContact O-N 3.02Å; G24-Q27 PolarHBondContact O-N 3.35Å
25	S	75.8	Confident	79.3	Confident	103 Å²	103	91.5 Å²	91.5	72%	0.72	49%	0.485	S	S	*	.	G	3₁₀ helix	trans	-66.4	-25.7	-177.6	58.5	0	0	0	0	113.4	Q27 L28	S25-Q27 VanDerWaalsContact C-N 3.26Å; S25-Q27 PolarHBondContact O-N 2.93Å; S25-L28 WeakPolarHBondContact O-CB 3.29Å; S25-L28 PolarHBondContact O-N 2.85Å
26	D	73.4	Confident	79.5	Confident	96 Å²	96	90.3 Å²	90.3	51%	0.513	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-66.5	-23.9	174.3	62.5	-47.3	0	0	0	113.2	G24 L28	G24-D26 VanDerWaalsContact C-OD1 3.31Å; G24-D26 WeakPolarHBondContact CA-OD1 3.32Å; G24-D26 PolarHBondContact O-N 3.02Å; D26-L28 VanDerWaalsContact C-N 3.29Å; D26-L28 PolarHBondContact O-N 2.87Å
27	Q	72.7	Confident	79.6	Confident	44 Å²	44	85.1 Å²	85.1	21%	0.206	46%	0.459	C	S	.	.	G	3₁₀ helix	trans	-79.4	-12.1	177.9	-55.6	-70.2	-24.6	0	0	112.7	G24 S25 D29 K30 Y34	G24-Q27 PolarHBondContact O-N 3.35Å; S25-Q27 VanDerWaalsContact C-N 3.26Å; S25-Q27 PolarHBondContact O-N 2.93Å; Q27-D29 VanDerWaalsContact C-N 3.27Å; Q27-D29 PolarHBondContact O-N 3.41Å; Q27-K30 PolarHBondContact O-N 3.36Å; Q27-K30 VanDerWaalsContact O-N 3.16Å; Q27-K30 VanDerWaalsContact OE1-NZ 3.14Å; Q27-Y34 PolarHBondContact OE1-OH 2.76Å; Q27-Y34 VanDerWaalsContact OE1-OH 3.06Å
28	L	74.3	Confident	79.8	Confident	96 Å²	96	84.3 Å²	84.3	50%	0.503	46%	0.46	S	S	.	.	G	3₁₀ helix	trans	-67.3	-27.4	175	-75.3	161.8	0	0	0	112.2	I22 S25 D26 K30 L31	I22-L28 HydrophobicContact CG2-CD2 4.36Å; I22-L28 HydrophobicContact CG2-CG 4.44Å; S25-L28 WeakPolarHBondContact O-CB 3.29Å; S25-L28 PolarHBondContact O-N 2.85Å; D26-L28 VanDerWaalsContact C-N 3.29Å; D26-L28 PolarHBondContact O-N 2.87Å; L28-K30 PolarHBondContact O-N 2.85Å; L28-L31 HydrophobicContact CD2-CD1 4.39Å; L28-L31 WeakPolarHBondContact O-CB 3.24Å; L28-L31 PolarHBondContact O-N 2.83Å; L28-L31 VanDerWaalsContact O-N 3.08Å
29	D	76.6	Confident	80.1	Confident	147 Å²	147	84 Å²	84	79%	0.786	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-66.7	-23.3	174.3	-67.3	-22.8	0	0	0	112	Q27 L31	Q27-D29 VanDerWaalsContact C-N 3.27Å; Q27-D29 PolarHBondContact O-N 3.41Å; D29-L31 VanDerWaalsContact C-N 3.33Å
30	K	77.6	Confident	80.5	Confident	98 Å²	98	89.7 Å²	89.7	43%	0.426	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-89	4.1	175.9	-62.2	179	-167.1	158.8	0	113	Q27 L28 D32 H33 Y34	Q27-K30 PolarHBondContact O-N 3.36Å; Q27-K30 VanDerWaalsContact O-N 3.16Å; Q27-K30 VanDerWaalsContact OE1-NZ 3.14Å; L28-K30 PolarHBondContact O-N 2.85Å; K30-D32 VanDerWaalsContact C-N 3.27Å; K30-D32 PolarHBondContact O-N 2.76Å; K30-H33 CarbonylContact O-C 3.58Å; K30-H33 WeakPolarHBondContact O-CA 3.39Å; K30-H33 WeakPolarHBondContact O-CB 3.43Å; K30-H33 PolarHBondContact O-N 2.71Å; K30-Y34 HydrophobicContact CB-CD2 3.97Å; K30-Y34 HydrophobicContact CB-CE2 3.51Å; K30-Y34 HydrophobicContact CD-CE2 4.49Å; K30-Y34 WeakPolarHBondContact O-CD2 3.48Å; K30-Y34 PolarHBondContact O-N 2.78Å
31	L	80.7	Confident	80.9	Confident	57 Å²	57	91.8 Å²	91.8	30%	0.298	47%	0.47	S	S	.	.	H	α-helix	trans	-56.9	-40.3	-176.5	-164.1	91.6	0	0	0	112.2	I22 L28 D29 Y34 K35	I22-L31 HydrophobicContact CD1-CD1 4.03Å; L28-L31 HydrophobicContact CD2-CD1 4.39Å; L28-L31 WeakPolarHBondContact O-CB 3.24Å; L28-L31 PolarHBondContact O-N 2.83Å; L28-L31 VanDerWaalsContact O-N 3.08Å; D29-L31 VanDerWaalsContact C-N 3.33Å; L31-Y34 PolarHBondContact O-N 3.36Å; L31-K35 WeakPolarHBondContact O-CB 3.4Å; L31-K35 WeakPolarHBondContact O-CG 3.37Å; L31-K35 PolarHBondContact O-N 3.23Å
32	D	85.8	Confident	81.5	Confident	120 Å²	120	95.9 Å²	95.9	64%	0.642	49%	0.487	S	S	*	.	H	α-helix	trans	-68.5	-35.4	177.3	-73.5	-27.9	0	0	0	112.3	K30 S36	K30-D32 VanDerWaalsContact C-N 3.27Å; K30-D32 PolarHBondContact O-N 2.76Å; D32-S36 WeakPolarHBondContact O-CB 3.35Å; D32-S36 PolarHBondContact O-N 3.49Å
33	H	85.1	Confident	82.1	Confident	123 Å²	123	95.5 Å²	95.5	57%	0.569	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-44.9	172.3	-171.6	78.4	0	0	0	111	K30 S36 M37	K30-H33 CarbonylContact O-C 3.58Å; K30-H33 WeakPolarHBondContact O-CA 3.39Å; K30-H33 WeakPolarHBondContact O-CB 3.43Å; K30-H33 PolarHBondContact O-N 2.71Å; H33-S36 PolarHBondContact O-N 2.69Å; H33-M37 WeakPolarHBondContact O-CB 3.42Å; H33-M37 PolarHBondContact O-N 2.85Å
34	Y	84.3	Confident	82.7	Confident	44 Å²	44	90 Å²	90	17%	0.173	48%	0.476	C	S	.	.	H	α-helix	trans	-62.8	-44.4	175.6	-65.6	-50.4	0	0	0	112	M21 Q27 K30 L31 S36 M37 V38	M21-Y34 HydrophobicContact SD-CD1 4.19Å; Q27-Y34 PolarHBondContact OE1-OH 2.76Å; Q27-Y34 VanDerWaalsContact OE1-OH 3.06Å; K30-Y34 HydrophobicContact CB-CD2 3.97Å; K30-Y34 HydrophobicContact CB-CE2 3.51Å; K30-Y34 HydrophobicContact CD-CE2 4.49Å; K30-Y34 WeakPolarHBondContact O-CD2 3.48Å; K30-Y34 PolarHBondContact O-N 2.78Å; L31-Y34 PolarHBondContact O-N 3.36Å; Y34-S36 PolarHBondContact O-N 2.72Å; Y34-M37 HydrophobicContact CD1-CE 3.7Å; Y34-M37 HydrophobicContact CE1-CE 4.15Å; Y34-M37 WeakPolarHBondContact O-CB 3.23Å; Y34-M37 PolarHBondContact O-N 2.77Å; Y34-V38 WeakPolarHBondContact O-CB 3.45Å; Y34-V38 VanDerWaalsContact O-CG2 3.3Å; Y34-V38 WeakPolarHBondContact O-CG2 3.39Å; Y34-V38 PolarHBondContact O-N 3.41Å
35	K	85.8	Confident	83.5	Confident	129 Å²	129	92.3 Å²	92.3	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-59.9	-45.1	174.5	-79	179.1	-179.7	172.9	0	111.9	L31 M37 V38 S39	L31-K35 WeakPolarHBondContact O-CB 3.4Å; L31-K35 WeakPolarHBondContact O-CG 3.37Å; L31-K35 PolarHBondContact O-N 3.23Å; K35-M37 VanDerWaalsContact C-N 3.34Å; K35-M37 PolarHBondContact O-N 3.4Å; K35-V38 PolarHBondContact O-N 3.22Å; K35-S39 VanDerWaalsContact O-CB 3.26Å; K35-S39 WeakPolarHBondContact O-CB 3.44Å; K35-S39 PolarHBondContact O-N 2.69Å
36	S	87.4	Confident	84.3	Confident	51 Å²	51	90.7 Å²	90.7	36%	0.357	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-40.5	176.8	-170	0	0	0	0	111.5	D32 H33 Y34 S39 R40	D32-S36 WeakPolarHBondContact O-CB 3.35Å; D32-S36 PolarHBondContact O-N 3.49Å; H33-S36 PolarHBondContact O-N 2.69Å; Y34-S36 PolarHBondContact O-N 2.72Å; S36-S39 PolarHBondContact O-N 2.71Å; S36-R40 WeakPolarHBondContact O-CB 3.11Å; S36-R40 WeakPolarHBondContact O-CG 3.24Å; S36-R40 PolarHBondContact O-N 3.4Å
37	M	85.5	Confident	85.1	Confident	61 Å²	61	88.7 Å²	88.7	30%	0.3	47%	0.465	S	S	.	.	H	α-helix	trans	-63.7	-46.4	176.6	-161.9	-158.3	-41.8	0	0	112	H33 Y34 K35 R40 K41	H33-M37 WeakPolarHBondContact O-CB 3.42Å; H33-M37 PolarHBondContact O-N 2.85Å; Y34-M37 HydrophobicContact CD1-CE 3.7Å; Y34-M37 HydrophobicContact CE1-CE 4.15Å; Y34-M37 WeakPolarHBondContact O-CB 3.23Å; Y34-M37 PolarHBondContact O-N 2.77Å; K35-M37 VanDerWaalsContact C-N 3.34Å; K35-M37 PolarHBondContact O-N 3.4Å; M37-R40 PolarHBondContact O-N 3.43Å; M37-K41 WeakPolarHBondContact O-CG 3.48Å; M37-K41 PolarHBondContact O-N 2.77Å
38	V	85.3	Confident	85.9	Confident	78 Å²	78	93.3 Å²	93.3	47%	0.473	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-40.5	176.7	173	0	0	0	0	110.6	Y34 K35 R40 K41 K42	Y34-V38 WeakPolarHBondContact O-CB 3.45Å; Y34-V38 VanDerWaalsContact O-CG2 3.3Å; Y34-V38 WeakPolarHBondContact O-CG2 3.39Å; Y34-V38 PolarHBondContact O-N 3.41Å; K35-V38 PolarHBondContact O-N 3.22Å; V38-R40 PolarHBondContact O-N 2.7Å; V38-K41 PolarHBondContact O-N 3.48Å; V38-K42 WeakPolarHBondContact O-CB 3.26Å; V38-K42 PolarHBondContact O-N 3.34Å
39	S	89.5	Confident	86.7	Confident	77 Å²	77	93.2 Å²	93.2	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-38.2	175.8	-169.5	0	0	0	0	112.4	K35 S36 K42 A43	K35-S39 VanDerWaalsContact O-CB 3.26Å; K35-S39 WeakPolarHBondContact O-CB 3.44Å; K35-S39 PolarHBondContact O-N 2.69Å; S36-S39 PolarHBondContact O-N 2.71Å; S39-K42 PolarHBondContact O-N 2.79Å; S39-A43 WeakPolarHBondContact O-CB 3.14Å; S39-A43 PolarHBondContact O-N 3.19Å
40	R	88.4	Confident	87.4	Confident	183 Å²	183	93.9 Å²	93.9	69%	0.691	48%	0.484	S	S	*	.	H	α-helix	trans	-66.8	-42.8	173.1	-74.9	-179.2	-156.4	177.9	5.7	111.5	S36 M37 V38 K42 A43 A44	S36-R40 WeakPolarHBondContact O-CB 3.11Å; S36-R40 WeakPolarHBondContact O-CG 3.24Å; S36-R40 PolarHBondContact O-N 3.4Å; M37-R40 PolarHBondContact O-N 3.43Å; V38-R40 PolarHBondContact O-N 2.7Å; R40-K42 VanDerWaalsContact C-N 3.34Å; R40-A43 PolarHBondContact O-N 3.39Å; R40-A44 WeakPolarHBondContact O-CB 3.45Å; R40-A44 PolarHBondContact O-N 3.49Å
41	K	87.1	Confident	88	Confident	113 Å²	113	93.6 Å²	93.6	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-60.1	-44.8	173.9	-77.7	-175.6	178.4	-177.9	0	111.1	M37 V38 A44 V45	M37-K41 WeakPolarHBondContact O-CG 3.48Å; M37-K41 PolarHBondContact O-N 2.77Å; V38-K41 PolarHBondContact O-N 3.48Å; K41-A44 PolarHBondContact O-N 2.76Å; K41-V45 WeakPolarHBondContact O-CB 3.21Å; K41-V45 VanDerWaalsContact O-CG2 3.27Å; K41-V45 WeakPolarHBondContact O-CG2 3.37Å; K41-V45 PolarHBondContact O-N 3.26Å
42	K	89.7	Confident	88.4	Confident	133 Å²	133	93.3 Å²	93.3	58%	0.578	50%	0.497	S	S	*	.	H	α-helix	trans	-59.1	-49.5	174.7	-177.5	-179.8	177.1	-179.5	0	111.4	V38 S39 R40 A44 V45 D46	V38-K42 WeakPolarHBondContact O-CB 3.26Å; V38-K42 PolarHBondContact O-N 3.34Å; S39-K42 PolarHBondContact O-N 2.79Å; R40-K42 VanDerWaalsContact C-N 3.34Å; K42-A44 VanDerWaalsContact C-N 3.3Å; K42-A44 PolarHBondContact O-N 2.94Å; K42-V45 PolarHBondContact O-N 3.47Å; K42-D46 WeakPolarHBondContact O-CB 3.38Å; K42-D46 VanDerWaalsContact O-CG 3.31Å; K42-D46 PolarHBondContact O-N 2.81Å
43	A	91	Very high	88.6	Confident	57 Å²	57	91.5 Å²	91.5	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-61.5	-38	178.5	0	0	0	0	0	112.6	S39 R40 A47	S39-A43 WeakPolarHBondContact O-CB 3.14Å; S39-A43 PolarHBondContact O-N 3.19Å; R40-A43 PolarHBondContact O-N 3.39Å; A43-A47 WeakPolarHBondContact O-CB 3.44Å; A43-A47 PolarHBondContact O-N 2.86Å
44	A	89.3	Confident	88.9	Confident	52 Å²	52	91 Å²	91	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-66	-46.2	174.5	0	0	0	0	0	111.7	R40 K41 K42 A47 M48	R40-A44 WeakPolarHBondContact O-CB 3.45Å; R40-A44 PolarHBondContact O-N 3.49Å; K41-A44 PolarHBondContact O-N 2.76Å; K42-A44 VanDerWaalsContact C-N 3.3Å; K42-A44 PolarHBondContact O-N 2.94Å; A44-A47 PolarHBondContact O-N 2.96Å; A44-M48 WeakPolarHBondContact O-CB 3.25Å; A44-M48 VanDerWaalsContact O-CG 3.26Å; A44-M48 WeakPolarHBondContact O-CG 3.41Å; A44-M48 PolarHBondContact O-N 2.78Å
45	V	88.6	Confident	89.1	Confident	77 Å²	77	92.2 Å²	92.2	47%	0.467	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-42.7	176.6	171.3	0	0	0	0	111.1	K41 K42 A47 M48 L49	K41-V45 WeakPolarHBondContact O-CB 3.21Å; K41-V45 VanDerWaalsContact O-CG2 3.27Å; K41-V45 WeakPolarHBondContact O-CG2 3.37Å; K41-V45 PolarHBondContact O-N 3.26Å; K42-V45 PolarHBondContact O-N 3.47Å; V45-A47 PolarHBondContact O-N 3.45Å; V45-M48 PolarHBondContact O-N 2.74Å; V45-L49 HydrophobicContact CG1-CD1 3.73Å; V45-L49 HydrophobicContact CG1-CG 4.33Å; V45-L49 VanDerWaalsContact O-CB 3.3Å; V45-L49 WeakPolarHBondContact O-CB 3.29Å; V45-L49 WeakPolarHBondContact O-CG 3.21Å; V45-L49 PolarHBondContact O-N 3.43Å
46	D	91.2	Very high	89.3	Confident	69 Å²	69	91.6 Å²	91.6	37%	0.369	50%	0.498	S	S	.	.	H	α-helix	trans	-63.9	-40	176.7	-74.8	-17.5	0	0	0	111.8	K42 K50	K42-D46 WeakPolarHBondContact O-CB 3.38Å; K42-D46 VanDerWaalsContact O-CG 3.31Å; K42-D46 PolarHBondContact O-N 2.81Å; D46-K50 WeakPolarHBondContact O-CB 3.43Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 2.75Å
47	A	90.7	Very high	89.5	Confident	53 Å²	53	94.3 Å²	94.3	44%	0.438	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-44	174.9	0	0	0	0	0	111.5	A43 A44 V45 K50 T51	A43-A47 WeakPolarHBondContact O-CB 3.44Å; A43-A47 PolarHBondContact O-N 2.86Å; A44-A47 PolarHBondContact O-N 2.96Å; V45-A47 PolarHBondContact O-N 3.45Å; A47-K50 PolarHBondContact O-N 3.39Å; A47-T51 PolarHBondContact O-N 2.75Å; A47-T51 PolarHBondContact O-OG1 3.37Å; A47-T51 VanDerWaalsContact O-OG1 3.06Å
48	M	90.4	Very high	89.8	Confident	141 Å²	141	96.8 Å²	96.8	70%	0.695	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-42.9	174.9	-71.6	177.2	79.7	0	0	111.5	A44 V45 T51 A52	A44-M48 WeakPolarHBondContact O-CB 3.25Å; A44-M48 VanDerWaalsContact O-CG 3.26Å; A44-M48 WeakPolarHBondContact O-CG 3.41Å; A44-M48 PolarHBondContact O-N 2.78Å; V45-M48 PolarHBondContact O-N 2.74Å; M48-T51 PolarHBondContact O-N 3.26Å; M48-A52 WeakPolarHBondContact O-CB 3.13Å; M48-A52 PolarHBondContact O-N 2.63Å
49	L	90.2	Very high	90	Very high	95 Å²	95	97.6 Å²	97.6	50%	0.497	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-44	175.7	-81.1	165.3	0	0	0	111.4	V45 T51 A52 V53	V45-L49 HydrophobicContact CG1-CD1 3.73Å; V45-L49 HydrophobicContact CG1-CG 4.33Å; V45-L49 VanDerWaalsContact O-CB 3.3Å; V45-L49 WeakPolarHBondContact O-CB 3.29Å; V45-L49 WeakPolarHBondContact O-CG 3.21Å; V45-L49 PolarHBondContact O-N 3.43Å; L49-T51 PolarHBondContact O-N 3.27Å; L49-A52 PolarHBondContact O-N 3.37Å; L49-V53 VanDerWaalsContact O-CB 3.26Å; L49-V53 WeakPolarHBondContact O-CB 3.47Å; L49-V53 WeakPolarHBondContact O-CG2 3.19Å; L49-V53 PolarHBondContact O-N 3.18Å
50	K	91.3	Very high	90.1	Very high	160 Å²	160	97.6 Å²	97.6	70%	0.696	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-45.7	176.1	-80.2	178.1	-179.4	178.7	0	112	D46 A47 H54	D46-K50 WeakPolarHBondContact O-CB 3.43Å; D46-K50 WeakPolarHBondContact O-CG 3.48Å; D46-K50 PolarHBondContact O-N 2.75Å; A47-K50 PolarHBondContact O-N 3.39Å; K50-H54 VanDerWaalsContact O-CB 3.25Å; K50-H54 WeakPolarHBondContact O-CB 3.21Å; K50-H54 PolarHBondContact O-N 3.22Å
51	T	90.6	Very high	90.2	Very high	92 Å²	92	97.4 Å²	97.4	56%	0.564	52%	0.516	S	S	*	.	H	α-helix	trans	-64.7	-44.2	176.6	-55.2	0	0	0	0	110.9	A47 M48 L49 H54 V55	A47-T51 PolarHBondContact O-N 2.75Å; A47-T51 PolarHBondContact O-OG1 3.37Å; A47-T51 VanDerWaalsContact O-OG1 3.06Å; M48-T51 PolarHBondContact O-N 3.26Å; L49-T51 PolarHBondContact O-N 3.27Å; T51-H54 PolarHBondContact O-N 3.41Å; T51-V55 HydrophobicContact CG2-CG2 4.42Å; T51-V55 WeakPolarHBondContact O-CB 3.15Å; T51-V55 VanDerWaalsContact O-CG2 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.36Å; T51-V55 PolarHBondContact O-N 2.67Å
52	A	88.3	Confident	90.3	Very high	52 Å²	52	94.2 Å²	94.2	43%	0.43	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-43.1	178.2	0	0	0	0	0	112.2	M48 L49 V55 Q56	M48-A52 WeakPolarHBondContact O-CB 3.13Å; M48-A52 PolarHBondContact O-N 2.63Å; L49-A52 PolarHBondContact O-N 3.37Å; A52-V55 PolarHBondContact O-N 3.49Å; A52-Q56 WeakPolarHBondContact O-CB 3.12Å; A52-Q56 VanDerWaalsContact O-CG 3.28Å; A52-Q56 WeakPolarHBondContact O-CG 3.24Å; A52-Q56 PolarHBondContact O-N 2.86Å
53	V	91.1	Very high	90.3	Very high	82 Å²	82	89.4 Å²	89.4	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-40.7	175.5	170	0	0	0	0	110.4	L49 Q56 L57	L49-V53 VanDerWaalsContact O-CB 3.26Å; L49-V53 WeakPolarHBondContact O-CB 3.47Å; L49-V53 WeakPolarHBondContact O-CG2 3.19Å; L49-V53 PolarHBondContact O-N 3.18Å; V53-Q56 PolarHBondContact O-N 3.41Å; V53-L57 HydrophobicContact CG1-CD1 3.95Å; V53-L57 HydrophobicContact CG1-CG 4.37Å; V53-L57 WeakPolarHBondContact O-CB 3.18Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.26Å; V53-L57 PolarHBondContact O-N 3.12Å
54	H	90.6	Very high	90.4	Very high	113 Å²	113	91.7 Å²	91.7	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-65.2	-45.8	177.2	-169.7	50.9	0	0	0	111.9	K50 T51 Q56 L57 E58	K50-H54 VanDerWaalsContact O-CB 3.25Å; K50-H54 WeakPolarHBondContact O-CB 3.21Å; K50-H54 PolarHBondContact O-N 3.22Å; T51-H54 PolarHBondContact O-N 3.41Å; H54-Q56 VanDerWaalsContact C-N 3.34Å; H54-Q56 PolarHBondContact O-N 2.68Å; H54-L57 PolarHBondContact O-N 3.46Å; H54-E58 PolarHBondContact O-N 2.82Å
55	V	89.6	Confident	90.4	Very high	68 Å²	68	93 Å²	93	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-61.4	-41.9	174.3	170	0	0	0	0	111	T51 A52 E58 N59	T51-V55 HydrophobicContact CG2-CG2 4.42Å; T51-V55 WeakPolarHBondContact O-CB 3.15Å; T51-V55 VanDerWaalsContact O-CG2 3.26Å; T51-V55 WeakPolarHBondContact O-CG2 3.36Å; T51-V55 PolarHBondContact O-N 2.67Å; A52-V55 PolarHBondContact O-N 3.49Å; V55-E58 PolarHBondContact O-N 3.49Å; V55-N59 VanDerWaalsContact O-CB 3.31Å; V55-N59 WeakPolarHBondContact O-CB 3.49Å; V55-N59 PolarHBondContact O-N 2.77Å; V55-N59 PolarHBondContact O-ND2 3.18Å
56	Q	90.2	Very high	90.5	Very high	117 Å²	117	95.8 Å²	95.8	55%	0.547	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-40.6	175.2	-77.4	-67.2	-2.9	0	0	112	A52 V53 H54 N59 V60	A52-Q56 WeakPolarHBondContact O-CB 3.12Å; A52-Q56 VanDerWaalsContact O-CG 3.28Å; A52-Q56 WeakPolarHBondContact O-CG 3.24Å; A52-Q56 PolarHBondContact O-N 2.86Å; V53-Q56 PolarHBondContact O-N 3.41Å; H54-Q56 VanDerWaalsContact C-N 3.34Å; H54-Q56 PolarHBondContact O-N 2.68Å; Q56-N59 PolarHBondContact O-N 3.39Å; Q56-V60 VanDerWaalsContact O-CB 3.31Å; Q56-V60 WeakPolarHBondContact O-CB 3.23Å; Q56-V60 WeakPolarHBondContact O-CG2 3.16Å; Q56-V60 PolarHBondContact O-N 2.83Å
57	L	91.6	Very high	90.5	Very high	107 Å²	107	98.1 Å²	98.1	56%	0.56	52%	0.523	S	S	*	.	H	α-helix	trans	-66.4	-38.9	175.5	-75	171.2	0	0	0	112.1	V53 H54 V60 R61	V53-L57 HydrophobicContact CG1-CD1 3.95Å; V53-L57 HydrophobicContact CG1-CG 4.37Å; V53-L57 WeakPolarHBondContact O-CB 3.18Å; V53-L57 VanDerWaalsContact O-CG 3.27Å; V53-L57 WeakPolarHBondContact O-CG 3.26Å; V53-L57 PolarHBondContact O-N 3.12Å; H54-L57 PolarHBondContact O-N 3.46Å; L57-V60 PolarHBondContact O-N 3.24Å; L57-R61 WeakPolarHBondContact O-CB 3.27Å; L57-R61 PolarHBondContact O-N 3.44Å
58	E	90.4	Very high	90.5	Very high	113 Å²	113	99.8 Å²	99.8	53%	0.528	52%	0.524	S	S	.	.	H	α-helix	trans	-66.2	-42.8	173.3	-76.1	-156.7	145.2	0	0	111.8	H54 V55 R61 A62	H54-E58 PolarHBondContact O-N 2.82Å; V55-E58 PolarHBondContact O-N 3.49Å; E58-R61 PolarHBondContact O-N 3.46Å; E58-A62 VanDerWaalsContact O-CB 3.25Å; E58-A62 WeakPolarHBondContact O-CB 3.36Å; E58-A62 PolarHBondContact O-N 3.35Å
59	N	90	Very high	90.4	Very high	95 Å²	95	99.1 Å²	99.1	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-63.7	-41.2	175.1	-72.1	-18.7	0	0	0	111.6	V55 Q56 G63	V55-N59 VanDerWaalsContact O-CB 3.31Å; V55-N59 WeakPolarHBondContact O-CB 3.49Å; V55-N59 PolarHBondContact O-N 2.77Å; V55-N59 PolarHBondContact O-ND2 3.18Å; Q56-N59 PolarHBondContact O-N 3.39Å; N59-G63 WeakPolarHBondContact O-CA 2.99Å; N59-G63 PolarHBondContact O-N 2.76Å
60	V	91.2	Very high	90.4	Very high	78 Å²	78	99 Å²	99	47%	0.473	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-39.4	174.7	168.3	0	0	0	0	110.4	Q56 L57 G63 L64	Q56-V60 VanDerWaalsContact O-CB 3.31Å; Q56-V60 WeakPolarHBondContact O-CB 3.23Å; Q56-V60 WeakPolarHBondContact O-CG2 3.16Å; Q56-V60 PolarHBondContact O-N 2.83Å; L57-V60 PolarHBondContact O-N 3.24Å; V60-G63 PolarHBondContact O-N 2.78Å; V60-L64 HydrophobicContact CG1-CD1 3.9Å; V60-L64 HydrophobicContact CG1-CG 4.41Å; V60-L64 VanDerWaalsContact O-CB 3.27Å; V60-L64 WeakPolarHBondContact O-CB 3.29Å; V60-L64 VanDerWaalsContact O-CG 3.29Å; V60-L64 WeakPolarHBondContact O-CG 3.34Å; V60-L64 PolarHBondContact O-N 3.35Å
61	R	91.2	Very high	90.4	Very high	178 Å²	178	93.6 Å²	93.6	67%	0.672	51%	0.506	S	S	*	.	H	α-helix	trans	-69.1	-42.4	176.9	-169.5	177.9	-172.7	-178	1.8	111.9	L57 E58 L64 N65	L57-R61 WeakPolarHBondContact O-CB 3.27Å; L57-R61 PolarHBondContact O-N 3.44Å; E58-R61 PolarHBondContact O-N 3.46Å; R61-L64 PolarHBondContact O-N 2.86Å; R61-N65 WeakPolarHBondContact O-CB 3.08Å; R61-N65 PolarHBondContact O-N 2.65Å; R61-N65 PolarHBondContact O-ND2 2.81Å
62	A	90	Very high	90.4	Very high	47 Å²	47	94.6 Å²	94.6	39%	0.388	50%	0.503	S	S	.	.	H	α-helix	trans	-63.5	-43.2	173.5	0	0	0	0	0	110.6	E58 N65 Q66	E58-A62 VanDerWaalsContact O-CB 3.25Å; E58-A62 WeakPolarHBondContact O-CB 3.36Å; E58-A62 PolarHBondContact O-N 3.35Å; A62-N65 PolarHBondContact O-N 2.93Å; A62-Q66 WeakPolarHBondContact O-CB 3.5Å; A62-Q66 WeakPolarHBondContact O-CG 3.48Å; A62-Q66 PolarHBondContact O-N 3.47Å
63	G	89.9	Confident	90.5	Very high	32 Å²	32	96.3 Å²	96.3	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-42.7	174.7	0	0	0	0	0	112.7	N59 V60 Q66 L67	N59-G63 WeakPolarHBondContact O-CA 2.99Å; N59-G63 PolarHBondContact O-N 2.76Å; V60-G63 PolarHBondContact O-N 2.78Å; G63-Q66 PolarHBondContact O-N 3.4Å; G63-L67 VanDerWaalsContact O-CB 3.26Å; G63-L67 WeakPolarHBondContact O-CB 3.4Å; G63-L67 PolarHBondContact O-N 3.42Å
64	L	91.5	Very high	90.5	Very high	105 Å²	105	94.9 Å²	94.9	55%	0.55	50%	0.502	S	S	.	.	H	α-helix	trans	-66	-40.2	174.2	-81.5	167.2	0	0	0	111.9	V60 R61 L67 N68	V60-L64 HydrophobicContact CG1-CD1 3.9Å; V60-L64 HydrophobicContact CG1-CG 4.41Å; V60-L64 VanDerWaalsContact O-CB 3.27Å; V60-L64 WeakPolarHBondContact O-CB 3.29Å; V60-L64 VanDerWaalsContact O-CG 3.29Å; V60-L64 WeakPolarHBondContact O-CG 3.34Å; V60-L64 PolarHBondContact O-N 3.35Å; R61-L64 PolarHBondContact O-N 2.86Å; L64-L67 PolarHBondContact O-N 2.76Å; L64-N68 VanDerWaalsContact O-CB 3.29Å; L64-N68 WeakPolarHBondContact O-CB 3.21Å; L64-N68 PolarHBondContact O-N 3.2Å
65	N	90.5	Very high	90.5	Very high	80 Å²	80	95.7 Å²	95.7	43%	0.428	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-45.8	174.8	-74.9	-20.8	0	0	0	110.8	R61 A62 L67 N68 F69	R61-N65 WeakPolarHBondContact O-CB 3.08Å; R61-N65 PolarHBondContact O-N 2.65Å; R61-N65 PolarHBondContact O-ND2 2.81Å; A62-N65 PolarHBondContact O-N 2.93Å; N65-L67 VanDerWaalsContact C-N 3.32Å; N65-L67 PolarHBondContact O-N 3.4Å; N65-N68 WeakPolarHBondContact O-CB 3.49Å; N65-N68 PolarHBondContact O-N 3.02Å; N65-F69 HydrophobicContact CB-CE2 4.35Å; N65-F69 WeakPolarHBondContact O-CD2 3.14Å; N65-F69 WeakPolarHBondContact O-CG 3.47Å; N65-F69 PolarHBondContact O-N 3.27Å
66	Q	90.1	Very high	90.5	Very high	134 Å²	134	96.3 Å²	96.3	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-60.1	-41.7	173.4	-79.9	179.8	-8	0	0	111.3	A62 G63 N68 F69 V70	A62-Q66 WeakPolarHBondContact O-CB 3.5Å; A62-Q66 WeakPolarHBondContact O-CG 3.48Å; A62-Q66 PolarHBondContact O-N 3.47Å; G63-Q66 PolarHBondContact O-N 3.4Å; Q66-N68 VanDerWaalsContact C-N 3.31Å; Q66-N68 PolarHBondContact O-N 3.15Å; Q66-F69 PolarHBondContact O-N 3.43Å; Q66-V70 WeakPolarHBondContact O-CB 3.29Å; Q66-V70 VanDerWaalsContact O-CG2 3.24Å; Q66-V70 WeakPolarHBondContact O-CG2 3.33Å; Q66-V70 PolarHBondContact O-N 3.04Å
67	L	90.5	Very high	90.5	Very high	119 Å²	119	95.7 Å²	95.7	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-63.9	-38.6	176.1	-161.5	86.6	0	0	0	111.2	G63 L64 N65 V70 A71	G63-L67 VanDerWaalsContact O-CB 3.26Å; G63-L67 WeakPolarHBondContact O-CB 3.4Å; G63-L67 PolarHBondContact O-N 3.42Å; L64-L67 PolarHBondContact O-N 2.76Å; N65-L67 VanDerWaalsContact C-N 3.32Å; N65-L67 PolarHBondContact O-N 3.4Å; L67-V70 PolarHBondContact O-N 3.16Å; L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 3.07Å
68	N	90.8	Very high	90.4	Very high	87 Å²	87	92.6 Å²	92.6	47%	0.465	50%	0.495	S	S	.	.	H	α-helix	trans	-69.4	-38.4	175.7	-165.5	-0.9	0	0	0	111.5	L64 N65 Q66 A71 K72	L64-N68 VanDerWaalsContact O-CB 3.29Å; L64-N68 WeakPolarHBondContact O-CB 3.21Å; L64-N68 PolarHBondContact O-N 3.2Å; N65-N68 WeakPolarHBondContact O-CB 3.49Å; N65-N68 PolarHBondContact O-N 3.02Å; Q66-N68 VanDerWaalsContact C-N 3.31Å; Q66-N68 PolarHBondContact O-N 3.15Å; N68-A71 PolarHBondContact O-N 3.22Å; N68-K72 WeakPolarHBondContact O-CG 3.21Å; N68-K72 PolarHBondContact O-N 2.91Å
69	F	89.8	Confident	90.4	Very high	128 Å²	128	93.1 Å²	93.1	56%	0.561	50%	0.498	S	S	*	.	H	α-helix	trans	-64.5	-47.6	171.3	-73.8	-61	0	0	0	111.4	N65 Q66 A71 K72 D73	N65-F69 HydrophobicContact CB-CE2 4.35Å; N65-F69 WeakPolarHBondContact O-CD2 3.14Å; N65-F69 WeakPolarHBondContact O-CG 3.47Å; N65-F69 PolarHBondContact O-N 3.27Å; Q66-F69 PolarHBondContact O-N 3.43Å; F69-A71 VanDerWaalsContact C-N 3.28Å; F69-A71 PolarHBondContact O-N 3.38Å; F69-K72 CarbonylContact O-C 3.56Å; F69-K72 PolarHBondContact O-N 2.81Å; F69-D73 WeakPolarHBondContact O-CB 3.4Å; F69-D73 VanDerWaalsContact O-CG 3.26Å; F69-D73 PolarHBondContact O-N 3.41Å
70	V	90.2	Very high	90.4	Very high	92 Å²	92	94 Å²	94	56%	0.558	50%	0.498	S	S	*	.	H	α-helix	trans	-62.4	-35.5	175.7	171.1	0	0	0	0	111.1	Q66 L67 A74	Q66-V70 WeakPolarHBondContact O-CB 3.29Å; Q66-V70 VanDerWaalsContact O-CG2 3.24Å; Q66-V70 WeakPolarHBondContact O-CG2 3.33Å; Q66-V70 PolarHBondContact O-N 3.04Å; L67-V70 PolarHBondContact O-N 3.16Å; V70-A74 WeakPolarHBondContact O-CA 3.21Å; V70-A74 WeakPolarHBondContact O-CB 3.47Å; V70-A74 PolarHBondContact O-N 2.74Å
71	A	90.8	Very high	90.3	Very high	47 Å²	47	93.4 Å²	93.4	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-65.7	-45.5	174.5	0	0	0	0	0	111.2	L67 N68 F69 A74 E75	L67-A71 WeakPolarHBondContact O-CB 3.3Å; L67-A71 PolarHBondContact O-N 3.07Å; N68-A71 PolarHBondContact O-N 3.22Å; F69-A71 VanDerWaalsContact C-N 3.28Å; F69-A71 PolarHBondContact O-N 3.38Å; A71-A74 PolarHBondContact O-N 2.77Å; A71-E75 WeakPolarHBondContact O-CG 3.29Å; A71-E75 PolarHBondContact O-N 3.09Å
72	K	90.4	Very high	90.1	Very high	113 Å²	113	91.3 Å²	91.3	49%	0.491	50%	0.495	S	S	.	.	H	α-helix	trans	-65.5	-40.2	174.3	-73.4	178.9	-179.8	-175.6	0	112.8	N68 F69 A74 E75 L76	N68-K72 WeakPolarHBondContact O-CG 3.21Å; N68-K72 PolarHBondContact O-N 2.91Å; F69-K72 CarbonylContact O-C 3.56Å; F69-K72 PolarHBondContact O-N 2.81Å; K72-A74 VanDerWaalsContact C-N 3.34Å; K72-E75 PolarHBondContact O-N 3.44Å; K72-L76 WeakPolarHBondContact O-CB 3.25Å; K72-L76 PolarHBondContact O-N 3.21Å
73	D	90.9	Very high	90	Very high	88 Å²	88	92.3 Å²	92.3	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-67.8	-36.8	176.1	-72.7	-13.9	0	0	0	110.3	F69 L76 I77	F69-D73 WeakPolarHBondContact O-CB 3.4Å; F69-D73 VanDerWaalsContact O-CG 3.26Å; F69-D73 PolarHBondContact O-N 3.41Å; D73-L76 CarbonylContact O-C 3.53Å; D73-L76 PolarHBondContact O-N 2.89Å; D73-I77 VanDerWaalsContact O-CB 3.29Å; D73-I77 WeakPolarHBondContact O-CB 3.48Å; D73-I77 WeakPolarHBondContact O-CD1 3.36Å; D73-I77 WeakPolarHBondContact O-CG1 3.38Å; D73-I77 PolarHBondContact O-N 3.46Å
74	A	90	Very high	89.8	Confident	52 Å²	52	96.3 Å²	96.3	43%	0.43	51%	0.511	S	S	.	.	H	α-helix	trans	-69.1	-37.7	173.8	0	0	0	0	0	111.6	V70 A71 K72 I77 A78	V70-A74 WeakPolarHBondContact O-CA 3.21Å; V70-A74 WeakPolarHBondContact O-CB 3.47Å; V70-A74 PolarHBondContact O-N 2.74Å; A71-A74 PolarHBondContact O-N 2.77Å; K72-A74 VanDerWaalsContact C-N 3.34Å; A74-I77 PolarHBondContact O-N 3.35Å; A74-A78 WeakPolarHBondContact O-CB 3.26Å; A74-A78 PolarHBondContact O-N 2.86Å
75	E	90.2	Very high	89.5	Confident	130 Å²	130	96.2 Å²	96.2	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-45.9	170.4	-78.3	175.9	180	0	0	110.8	A71 K72 A78 E79	A71-E75 WeakPolarHBondContact O-CG 3.29Å; A71-E75 PolarHBondContact O-N 3.09Å; K72-E75 PolarHBondContact O-N 3.44Å; E75-A78 CarbonylContact O-C 3.53Å; E75-A78 WeakPolarHBondContact O-CB 3.24Å; E75-A78 PolarHBondContact O-N 3.38Å; E75-E79 WeakPolarHBondContact O-CB 3.38Å; E75-E79 WeakPolarHBondContact O-CG 3.47Å; E75-E79 PolarHBondContact O-N 2.85Å
76	L	91.2	Very high	89.2	Confident	81 Å²	81	94.7 Å²	94.7	42%	0.424	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-43.2	174	-88.8	164.3	0	0	0	112.5	K72 D73 A78 E79 H80	K72-L76 WeakPolarHBondContact O-CB 3.25Å; K72-L76 PolarHBondContact O-N 3.21Å; D73-L76 CarbonylContact O-C 3.53Å; D73-L76 PolarHBondContact O-N 2.89Å; L76-A78 VanDerWaalsContact C-N 3.3Å; L76-E79 PolarHBondContact O-N 3.46Å; L76-H80 WeakPolarHBondContact O-CB 3.42Å; L76-H80 VanDerWaalsContact O-CG 3.23Å; L76-H80 PolarHBondContact O-N 2.79Å; L76-H80 PolarHBondContact O-ND1 2.83Å
77	I	89.4	Confident	88.8	Confident	103 Å²	103	93 Å²	93	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-65.3	-38.4	175.2	-71.5	163.6	0	0	0	109.2	D73 A74 H80 C81	D73-I77 VanDerWaalsContact O-CB 3.29Å; D73-I77 WeakPolarHBondContact O-CB 3.48Å; D73-I77 WeakPolarHBondContact O-CD1 3.36Å; D73-I77 WeakPolarHBondContact O-CG1 3.38Å; D73-I77 PolarHBondContact O-N 3.46Å; A74-I77 PolarHBondContact O-N 3.35Å; I77-H80 PolarHBondContact O-N 3.39Å; I77-C81 WeakPolarHBondContact O-CA 3.33Å; I77-C81 WeakPolarHBondContact O-CB 3.18Å; I77-C81 PolarHBondContact O-N 2.88Å; I77-C81 PolarHBondContact O-SG 3.29Å
78	A	90.5	Very high	88.4	Confident	43 Å²	43	91.8 Å²	91.8	36%	0.355	50%	0.495	S	S	.	.	H	α-helix	trans	-65.7	-42.4	175.1	0	0	0	0	0	111.2	A74 E75 L76 C81 Q82	A74-A78 WeakPolarHBondContact O-CB 3.26Å; A74-A78 PolarHBondContact O-N 2.86Å; E75-A78 CarbonylContact O-C 3.53Å; E75-A78 WeakPolarHBondContact O-CB 3.24Å; E75-A78 PolarHBondContact O-N 3.38Å; L76-A78 VanDerWaalsContact C-N 3.3Å; A78-C81 PolarHBondContact O-N 2.83Å; A78-Q82 VanDerWaalsContact O-CB 3.27Å; A78-Q82 WeakPolarHBondContact O-CB 3.44Å; A78-Q82 WeakPolarHBondContact O-CG 3.35Å; A78-Q82 PolarHBondContact O-N 2.74Å
79	E	89.5	Confident	87.9	Confident	124 Å²	124	91.1 Å²	91.1	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-63	-45.6	172.7	-76.8	-176.2	168.6	0	0	111.4	E75 L76 Q82 S83	E75-E79 WeakPolarHBondContact O-CB 3.38Å; E75-E79 WeakPolarHBondContact O-CG 3.47Å; E75-E79 PolarHBondContact O-N 2.85Å; L76-E79 PolarHBondContact O-N 3.46Å; E79-Q82 PolarHBondContact O-N 3.21Å; E79-S83 VanDerWaalsContact O-CB 3.3Å; E79-S83 WeakPolarHBondContact O-CB 3.23Å; E79-S83 PolarHBondContact O-N 3.33Å
80	H	90.2	Very high	87.5	Confident	112 Å²	112	89.7 Å²	89.7	52%	0.519	49%	0.491	S	S	.	.	H	α-helix	trans	-64.8	-40	175.2	-71.3	124.6	0	0	0	111.7	L76 I77 S83 M84	L76-H80 WeakPolarHBondContact O-CB 3.42Å; L76-H80 VanDerWaalsContact O-CG 3.23Å; L76-H80 PolarHBondContact O-N 2.79Å; L76-H80 PolarHBondContact O-ND1 2.83Å; I77-H80 PolarHBondContact O-N 3.39Å; H80-S83 PolarHBondContact O-N 3.19Å; H80-M84 WeakPolarHBondContact O-CA 3.46Å; H80-M84 WeakPolarHBondContact O-CB 3.29Å; H80-M84 WeakPolarHBondContact O-CG 3.47Å; H80-M84 PolarHBondContact O-N 3.47Å
81	C	87.8	Confident	87	Confident	67 Å²	67	89.6 Å²	89.6	45%	0.453	49%	0.486	S	S	.	.	H	α-helix	trans	-67.3	-37.8	174.9	-78.7	0	0	0	0	110.8	I77 A78 N85	I77-C81 WeakPolarHBondContact O-CA 3.33Å; I77-C81 WeakPolarHBondContact O-CB 3.18Å; I77-C81 PolarHBondContact O-N 2.88Å; I77-C81 PolarHBondContact O-SG 3.29Å; A78-C81 PolarHBondContact O-N 2.83Å; C81-N85 VanDerWaalsContact O-CB 3.24Å; C81-N85 WeakPolarHBondContact O-CB 3.28Å; C81-N85 PolarHBondContact O-N 3.31Å
82	Q	88.6	Confident	86.4	Confident	134 Å²	134	94.3 Å²	94.3	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-67.5	-42	173.3	-77.3	174.6	21.5	0	0	111	A78 E79 N85 A86	A78-Q82 VanDerWaalsContact O-CB 3.27Å; A78-Q82 WeakPolarHBondContact O-CB 3.44Å; A78-Q82 WeakPolarHBondContact O-CG 3.35Å; A78-Q82 PolarHBondContact O-N 2.74Å; E79-Q82 PolarHBondContact O-N 3.21Å; Q82-N85 CarbonylContact O-C 3.5Å; Q82-N85 PolarHBondContact O-N 3.38Å; Q82-A86 VanDerWaalsContact O-CB 3.32Å; Q82-A86 WeakPolarHBondContact O-CB 3.3Å; Q82-A86 PolarHBondContact O-N 2.76Å
83	S	87.8	Confident	85.8	Confident	67 Å²	67	94.5 Å²	94.5	47%	0.469	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-45	174.2	-172.3	0	0	0	0	110.9	E79 H80 N85 A86 E87	E79-S83 VanDerWaalsContact O-CB 3.3Å; E79-S83 WeakPolarHBondContact O-CB 3.23Å; E79-S83 PolarHBondContact O-N 3.33Å; H80-S83 PolarHBondContact O-N 3.19Å; S83-N85 VanDerWaalsContact C-N 3.35Å; S83-A86 WeakPolarHBondContact O-CB 3.44Å; S83-A86 PolarHBondContact O-N 2.87Å; S83-E87 WeakPolarHBondContact O-CG 3.06Å; S83-E87 PolarHBondContact O-N 2.97Å
84	M	84.4	Confident	85.2	Confident	117 Å²	117	93.4 Å²	93.4	58%	0.576	50%	0.499	S	S	*	.	H	α-helix	trans	-62.2	-42.9	173.1	-77.6	177	68.8	0	0	110.1	H80 A86 E87 L88	H80-M84 WeakPolarHBondContact O-CA 3.46Å; H80-M84 WeakPolarHBondContact O-CB 3.29Å; H80-M84 WeakPolarHBondContact O-CG 3.47Å; H80-M84 PolarHBondContact O-N 3.47Å; M84-A86 VanDerWaalsContact C-N 3.31Å; M84-A86 PolarHBondContact O-N 3.37Å; M84-E87 CarbonylContact O-C 3.6Å; M84-E87 PolarHBondContact O-N 3.02Å; M84-L88 VanDerWaalsContact O-CB 3.23Å; M84-L88 WeakPolarHBondContact O-CB 3.05Å; M84-L88 WeakPolarHBondContact O-CG 3.05Å; M84-L88 PolarHBondContact O-N 3.35Å
85	N	86.1	Confident	84.6	Confident	103 Å²	103	97.7 Å²	97.7	55%	0.551	51%	0.508	S	S	*	.	H	α-helix	trans	-63.7	-39	174.8	-115.9	-10.9	0	0	0	110.9	C81 Q82 S83 L88 S89	C81-N85 VanDerWaalsContact O-CB 3.24Å; C81-N85 WeakPolarHBondContact O-CB 3.28Å; C81-N85 PolarHBondContact O-N 3.31Å; Q82-N85 CarbonylContact O-C 3.5Å; Q82-N85 PolarHBondContact O-N 3.38Å; S83-N85 VanDerWaalsContact C-N 3.35Å; N85-L88 CarbonylContact O-C 3.58Å; N85-L88 PolarHBondContact O-N 3.26Å; N85-S89 VanDerWaalsContact O-CB 3.29Å; N85-S89 WeakPolarHBondContact O-CB 3.4Å; N85-S89 PolarHBondContact O-N 3.25Å; N85-S89 PolarHBondContact O-OG 2.84Å
86	A	84.2	Confident	84	Confident	48 Å²	48	98.3 Å²	98.3	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-43.1	175.2	0	0	0	0	0	111	Q82 S83 M84 S89 K90	Q82-A86 VanDerWaalsContact O-CB 3.32Å; Q82-A86 WeakPolarHBondContact O-CB 3.3Å; Q82-A86 PolarHBondContact O-N 2.76Å; S83-A86 WeakPolarHBondContact O-CB 3.44Å; S83-A86 PolarHBondContact O-N 2.87Å; M84-A86 VanDerWaalsContact C-N 3.31Å; M84-A86 PolarHBondContact O-N 3.37Å; A86-S89 WeakPolarHBondContact O-CB 3.16Å; A86-S89 PolarHBondContact O-N 3.36Å; A86-K90 WeakPolarHBondContact O-CG 3.26Å; A86-K90 PolarHBondContact O-N 2.79Å; A86-K90 VanDerWaalsContact O-N 3.12Å
87	E	82.4	Confident	83.5	Confident	99 Å²	99	101.7 Å²	101.7	46%	0.463	52%	0.522	S	S	.	.	H	α-helix	trans	-66.9	-41	173.3	-66.6	-54.3	142.9	0	0	112.5	S83 M84 S89 K90 I91	S83-E87 WeakPolarHBondContact O-CG 3.06Å; S83-E87 PolarHBondContact O-N 2.97Å; M84-E87 CarbonylContact O-C 3.6Å; M84-E87 PolarHBondContact O-N 3.02Å; E87-S89 VanDerWaalsContact C-N 3.27Å; E87-S89 PolarHBondContact O-N 2.75Å; E87-K90 CarbonylContact O-C 3.45Å; E87-K90 WeakPolarHBondContact O-CA 3.34Å; E87-K90 VanDerWaalsContact O-CB 3.29Å; E87-K90 WeakPolarHBondContact O-CB 3.16Å; E87-K90 PolarHBondContact O-N 3.24Å; E87-K90 VanDerWaalsContact O-N 3.1Å; E87-K90 IonicContact OE1-NZ 2.63Å; E87-K90 PolarHBondContact OE1-NZ 3.38Å; E87-K90 WeakPolarHBondContact OE2-CD 3.31Å; E87-K90 IonicContact OE2-NZ 3.14Å; E87-K90 PolarHBondContact OE2-NZ 2.79Å; E87-K90 VanDerWaalsContact OE2-NZ 3.14Å; E87-I91 PolarHBondContact O-N 3.23Å
88	L	82	Confident	83.1	Confident	92 Å²	92	100.1 Å²	100.1	48%	0.482	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-32.5	173.5	-71.8	170.6	0	0	0	111.1	M84 N85 K90 I91	M84-L88 VanDerWaalsContact O-CB 3.23Å; M84-L88 WeakPolarHBondContact O-CB 3.05Å; M84-L88 WeakPolarHBondContact O-CG 3.05Å; M84-L88 PolarHBondContact O-N 3.35Å; N85-L88 CarbonylContact O-C 3.58Å; N85-L88 PolarHBondContact O-N 3.26Å; L88-K90 VanDerWaalsContact C-N 3.3Å; L88-I91 HydrophobicContact CD2-CD1 3.54Å; L88-I91 WeakPolarHBondContact O-CA 3.27Å; L88-I91 VanDerWaalsContact O-CB 3.23Å; L88-I91 WeakPolarHBondContact O-CB 3.38Å; L88-I91 PolarHBondContact O-N 3.48Å
89	S	80.7	Confident	82.7	Confident	73 Å²	73	105 Å²	105	51%	0.51	52%	0.524	S	S	.	.	H	α-helix	trans	-64.2	-40	172.7	-57.1	0	0	0	0	109.8	N85 A86 E87 I91 Q92	N85-S89 VanDerWaalsContact O-CB 3.29Å; N85-S89 WeakPolarHBondContact O-CB 3.4Å; N85-S89 PolarHBondContact O-N 3.25Å; N85-S89 PolarHBondContact O-OG 2.84Å; A86-S89 WeakPolarHBondContact O-CB 3.16Å; A86-S89 PolarHBondContact O-N 3.36Å; E87-S89 VanDerWaalsContact C-N 3.27Å; E87-S89 PolarHBondContact O-N 2.75Å; S89-I91 PolarHBondContact O-N 3.1Å; S89-Q92 WeakPolarHBondContact O-CB 3.25Å; S89-Q92 PolarHBondContact O-N 2.8Å
90	K	81.4	Confident	82.4	Confident	98 Å²	98	104.1 Å²	104.1	43%	0.426	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-24.8	170.8	-58.7	171.4	-163.7	170.6	0	112.3	A86 E87 L88 Q92 E93 V94	A86-K90 WeakPolarHBondContact O-CG 3.26Å; A86-K90 PolarHBondContact O-N 2.79Å; A86-K90 VanDerWaalsContact O-N 3.12Å; E87-K90 CarbonylContact O-C 3.45Å; E87-K90 WeakPolarHBondContact O-CA 3.34Å; E87-K90 VanDerWaalsContact O-CB 3.29Å; E87-K90 WeakPolarHBondContact O-CB 3.16Å; E87-K90 PolarHBondContact O-N 3.24Å; E87-K90 VanDerWaalsContact O-N 3.1Å; E87-K90 IonicContact OE1-NZ 2.63Å; E87-K90 PolarHBondContact OE1-NZ 3.38Å; E87-K90 WeakPolarHBondContact OE2-CD 3.31Å; E87-K90 IonicContact OE2-NZ 3.14Å; E87-K90 PolarHBondContact OE2-NZ 2.79Å; E87-K90 VanDerWaalsContact OE2-NZ 3.14Å; L88-K90 VanDerWaalsContact C-N 3.3Å; K90-Q92 PolarHBondContact O-N 3.13Å; K90-E93 CarbonylContact O-C 3.59Å; K90-E93 WeakPolarHBondContact O-CA 3.31Å; K90-E93 WeakPolarHBondContact O-CB 3.34Å; K90-E93 PolarHBondContact O-N 3.07Å; K90-V94 WeakPolarHBondContact O-CG2 3.25Å; K90-V94 PolarHBondContact O-N 2.85Å
91	I	78.8	Confident	82.1	Confident	90 Å²	90	103.6 Å²	103.6	46%	0.462	53%	0.528	S	S	.	.	H	α-helix	trans	-60.6	-27.3	171.5	-62.2	-178.4	0	0	0	111.1	E87 L88 S89 V94 K95	E87-I91 PolarHBondContact O-N 3.23Å; L88-I91 HydrophobicContact CD2-CD1 3.54Å; L88-I91 WeakPolarHBondContact O-CA 3.27Å; L88-I91 VanDerWaalsContact O-CB 3.23Å; L88-I91 WeakPolarHBondContact O-CB 3.38Å; L88-I91 PolarHBondContact O-N 3.48Å; S89-I91 PolarHBondContact O-N 3.1Å; I91-V94 CarbonylContact O-C 3.59Å; I91-V94 PolarHBondContact O-N 3.33Å; I91-K95 WeakPolarHBondContact O-CA 3.3Å; I91-K95 WeakPolarHBondContact O-CB 3.48Å; I91-K95 PolarHBondContact O-N 3.46Å
92	Q	77.3	Confident	81.8	Confident	147 Å²	147	104.1 Å²	104.1	69%	0.687	53%	0.526	S	S	*	.	H	α-helix	trans	-64.8	-44	171.3	-67.5	-156.8	-11.8	0	0	111.7	S89 K90 V94 K95 Q96	S89-Q92 WeakPolarHBondContact O-CB 3.25Å; S89-Q92 PolarHBondContact O-N 2.8Å; K90-Q92 PolarHBondContact O-N 3.13Å; Q92-V94 VanDerWaalsContact C-N 3.34Å; Q92-V94 PolarHBondContact O-N 2.9Å; Q92-K95 PolarHBondContact O-N 2.8Å; Q92-Q96 WeakPolarHBondContact O-CB 3.15Å; Q92-Q96 PolarHBondContact O-N 3.42Å
93	E	78.3	Confident	81.5	Confident	117 Å²	117	101.3 Å²	101.3	55%	0.547	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-41.4	173.2	-61.4	-174.2	179	0	0	111.8	K90 Q96 K97	K90-E93 CarbonylContact O-C 3.59Å; K90-E93 WeakPolarHBondContact O-CA 3.31Å; K90-E93 WeakPolarHBondContact O-CB 3.34Å; K90-E93 PolarHBondContact O-N 3.07Å; E93-Q96 PolarHBondContact O-N 3.33Å; E93-K97 WeakPolarHBondContact O-CB 3.28Å; E93-K97 WeakPolarHBondContact O-CG 3.32Å; E93-K97 PolarHBondContact O-N 2.83Å
94	V	78.2	Confident	81.4	Confident	65 Å²	65	100.6 Å²	100.6	39%	0.394	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-41.4	176.3	175.5	0	0	0	0	110.6	K90 I91 Q92 Q96 K97 L98	K90-V94 WeakPolarHBondContact O-CG2 3.25Å; K90-V94 PolarHBondContact O-N 2.85Å; I91-V94 CarbonylContact O-C 3.59Å; I91-V94 PolarHBondContact O-N 3.33Å; Q92-V94 VanDerWaalsContact C-N 3.34Å; Q92-V94 PolarHBondContact O-N 2.9Å; V94-Q96 PolarHBondContact O-N 2.68Å; V94-K97 PolarHBondContact O-N 3.25Å; V94-L98 HydrophobicContact CG1-CD1 3.47Å; V94-L98 VanDerWaalsContact CG1-CD1 3.47Å; V94-L98 HydrophobicContact CG1-CG 3.84Å; V94-L98 WeakPolarHBondContact O-CA 3.39Å; V94-L98 WeakPolarHBondContact O-CB 3.26Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.35Å; V94-L98 PolarHBondContact O-N 3.32Å
95	K	78.5	Confident	81.4	Confident	142 Å²	142	97.7 Å²	97.7	62%	0.617	50%	0.502	S	S	*	.	H	α-helix	trans	-62.5	-33.5	175	-177.5	179.7	-179.3	-179.7	0	110.8	I91 Q92 L98 R99	I91-K95 WeakPolarHBondContact O-CA 3.3Å; I91-K95 WeakPolarHBondContact O-CB 3.48Å; I91-K95 PolarHBondContact O-N 3.46Å; Q92-K95 PolarHBondContact O-N 2.8Å; K95-L98 CarbonylContact O-C 3.39Å; K95-R99 VanDerWaalsContact O-CA 3.26Å; K95-R99 WeakPolarHBondContact O-CA 3.25Å; K95-R99 WeakPolarHBondContact O-CB 3.35Å; K95-R99 PolarHBondContact O-N 3.5Å
96	Q	76.5	Confident	81.1	Confident	142 Å²	142	97.6 Å²	97.6	66%	0.664	49%	0.494	S	S	*	.	H	α-helix	trans	-76	-39.6	176.1	-158	142.4	-6.8	0	0	112	Q92 E93 V94 R99	Q92-Q96 WeakPolarHBondContact O-CB 3.15Å; Q92-Q96 PolarHBondContact O-N 3.42Å; E93-Q96 PolarHBondContact O-N 3.33Å; V94-Q96 PolarHBondContact O-N 2.68Å; Q96-R99 WeakPolarHBondContact O-CB 3.19Å; Q96-R99 PolarHBondContact O-N 2.82Å
97	K	80.2	Confident	81	Confident	153 Å²	153	101.3 Å²	101.3	67%	0.665	50%	0.501	S	S	*	.	H	α-helix	trans	-67.1	-43.3	172.3	-73.7	173.2	-178.3	169.6	0	112.5	E93 V94 R99	E93-K97 WeakPolarHBondContact O-CB 3.28Å; E93-K97 WeakPolarHBondContact O-CG 3.32Å; E93-K97 PolarHBondContact O-N 2.83Å; V94-K97 PolarHBondContact O-N 3.25Å; K97-R99 PolarHBondContact O-N 3.05Å
98	L	81.4	Confident	81.2	Confident	69 Å²	69	102.9 Å²	102.9	36%	0.361	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	9.3	175.1	-62.4	-177.4	0	0	0	111.7	V94 K95 T100 L101 N102	V94-L98 HydrophobicContact CG1-CD1 3.47Å; V94-L98 VanDerWaalsContact CG1-CD1 3.47Å; V94-L98 HydrophobicContact CG1-CG 3.84Å; V94-L98 WeakPolarHBondContact O-CA 3.39Å; V94-L98 WeakPolarHBondContact O-CB 3.26Å; V94-L98 VanDerWaalsContact O-CG 3.24Å; V94-L98 WeakPolarHBondContact O-CG 3.35Å; V94-L98 PolarHBondContact O-N 3.32Å; K95-L98 CarbonylContact O-C 3.39Å; L98-T100 PolarHBondContact O-N 2.88Å; L98-L101 HydrophobicContact CB-CB 4.34Å; L98-L101 HydrophobicContact CD2-CB 4.28Å; L98-L101 HydrophobicContact CD2-CD2 3.9Å; L98-L101 CarbonylContact O-C 3.59Å; L98-L101 PolarHBondContact O-N 3.35Å; L98-N102 WeakPolarHBondContact O-CB 3.13Å; L98-N102 PolarHBondContact O-N 2.98Å; L98-N102 PolarHBondContact O-ND2 3.44Å
99	R	81.8	Confident	81.2	Confident	146 Å²	146	102.7 Å²	102.7	55%	0.551	51%	0.506	S	S	*	.	H	α-helix	trans	-57.1	-42.8	-180	-177.7	175.4	176.6	170.4	3.3	110.4	K95 Q96 K97 N102 E103	K95-R99 VanDerWaalsContact O-CA 3.26Å; K95-R99 WeakPolarHBondContact O-CA 3.25Å; K95-R99 WeakPolarHBondContact O-CB 3.35Å; K95-R99 PolarHBondContact O-N 3.5Å; Q96-R99 WeakPolarHBondContact O-CB 3.19Å; Q96-R99 PolarHBondContact O-N 2.82Å; K97-R99 PolarHBondContact O-N 3.05Å; R99-N102 PolarHBondContact O-N 2.86Å; R99-E103 HydrophobicContact CG-CG 4.46Å; R99-E103 VanDerWaalsContact CG-OE1 3.25Å; R99-E103 WeakPolarHBondContact CG-OE1 3.21Å; R99-E103 IonicContact CZ-OE1 3.85Å; R99-E103 IonicContact NE-OE1 2.93Å; R99-E103 PolarHBondContact NE-OE1 3.34Å; R99-E103 IonicContact NH2-OE1 3.43Å; R99-E103 VanDerWaalsContact O-CB 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.2Å; R99-E103 WeakPolarHBondContact O-CG 3.24Å; R99-E103 PolarHBondContact O-N 2.77Å
100	T	83	Confident	81.2	Confident	106 Å²	106	101.9 Å²	101.9	65%	0.65	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-40.7	174.6	53.5	0	0	0	0	112.4	L98 A104	L98-T100 PolarHBondContact O-N 2.88Å; T100-A104 WeakPolarHBondContact O-CB 3.12Å; T100-A104 PolarHBondContact O-N 2.82Å
101	L	85.4	Confident	81.2	Confident	101 Å²	101	100.5 Å²	100.5	53%	0.529	50%	0.496	S	S	.	.	H	α-helix	trans	-69.9	-39.2	176.6	-177.4	65.4	0	0	0	112.3	L98 A104 S105	L98-L101 HydrophobicContact CB-CB 4.34Å; L98-L101 HydrophobicContact CD2-CB 4.28Å; L98-L101 HydrophobicContact CD2-CD2 3.9Å; L98-L101 CarbonylContact O-C 3.59Å; L98-L101 PolarHBondContact O-N 3.35Å; L101-A104 CarbonylContact O-C 3.6Å; L101-A104 PolarHBondContact O-N 3.3Å; L101-S105 WeakPolarHBondContact O-CB 3.47Å; L101-S105 PolarHBondContact O-N 3.39Å
102	N	81.7	Confident	81.6	Confident	77 Å²	77	97.8 Å²	97.8	41%	0.412	49%	0.485	S	S	.	.	H	α-helix	trans	-68.8	-41.4	177.2	-75.5	-32.6	0	0	0	110.7	L98 R99 A104 S105 R106	L98-N102 WeakPolarHBondContact O-CB 3.13Å; L98-N102 PolarHBondContact O-N 2.98Å; L98-N102 PolarHBondContact O-ND2 3.44Å; R99-N102 PolarHBondContact O-N 2.86Å; N102-A104 VanDerWaalsContact C-N 3.34Å; N102-S105 PolarHBondContact O-N 3.49Å; N102-R106 WeakPolarHBondContact O-CB 3.47Å; N102-R106 PolarHBondContact O-N 3.04Å
103	E	81.8	Confident	81.9	Confident	76 Å²	76	91.7 Å²	91.7	36%	0.355	46%	0.458	S	S	.	.	H	α-helix	trans	-63.3	-41.8	171.9	-73.7	170.2	-169.9	0	0	110.6	R99 K107	R99-E103 HydrophobicContact CG-CG 4.46Å; R99-E103 VanDerWaalsContact CG-OE1 3.25Å; R99-E103 WeakPolarHBondContact CG-OE1 3.21Å; R99-E103 IonicContact CZ-OE1 3.85Å; R99-E103 IonicContact NE-OE1 2.93Å; R99-E103 PolarHBondContact NE-OE1 3.34Å; R99-E103 IonicContact NH2-OE1 3.43Å; R99-E103 VanDerWaalsContact O-CB 3.29Å; R99-E103 WeakPolarHBondContact O-CB 3.2Å; R99-E103 WeakPolarHBondContact O-CG 3.24Å; R99-E103 PolarHBondContact O-N 2.77Å; E103-K107 WeakPolarHBondContact O-CB 3.41Å; E103-K107 VanDerWaalsContact O-CG 3.26Å; E103-K107 WeakPolarHBondContact O-CG 3.46Å; E103-K107 PolarHBondContact O-N 3.32Å
104	A	85.1	Confident	82	Confident	52 Å²	52	87.8 Å²	87.8	43%	0.43	45%	0.445	S	S	.	.	H	α-helix	trans	-66.8	-40.3	174.9	0	0	0	0	0	112.9	T100 L101 N102 K107 H108	T100-A104 WeakPolarHBondContact O-CB 3.12Å; T100-A104 PolarHBondContact O-N 2.82Å; L101-A104 CarbonylContact O-C 3.6Å; L101-A104 PolarHBondContact O-N 3.3Å; N102-A104 VanDerWaalsContact C-N 3.34Å; A104-K107 PolarHBondContact O-N 3.11Å; A104-H108 VanDerWaalsContact O-CB 3.24Å; A104-H108 WeakPolarHBondContact O-CB 3.41Å; A104-H108 PolarHBondContact O-N 3.38Å
105	S	84.2	Confident	82.3	Confident	55 Å²	55	90.2 Å²	90.2	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-70.3	-39.3	177.9	176.7	0	0	0	0	111.2	L101 N102 H108 M109	L101-S105 WeakPolarHBondContact O-CB 3.47Å; L101-S105 PolarHBondContact O-N 3.39Å; N102-S105 PolarHBondContact O-N 3.49Å; S105-H108 CarbonylContact O-C 3.58Å; S105-H108 PolarHBondContact O-N 3.41Å; S105-M109 WeakPolarHBondContact O-CB 3.44Å; S105-M109 PolarHBondContact O-N 2.94Å
106	R	79.8	Confident	82.6	Confident	102 Å²	102	90 Å²	90	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-63.2	-47.6	172.7	-171.6	-176.8	79.9	177.2	8.8	110.8	N102 H108 M109 Q110 T164	N102-R106 WeakPolarHBondContact O-CB 3.47Å; N102-R106 PolarHBondContact O-N 3.04Å; R106-H108 VanDerWaalsContact C-N 3.3Å; R106-H108 PolarHBondContact O-N 3.19Å; R106-M109 PolarHBondContact O-N 3.34Å; R106-Q110 WeakPolarHBondContact O-CB 3.43Å; R106-Q110 VanDerWaalsContact O-CG 3.3Å; R106-Q110 WeakPolarHBondContact O-CG 3.28Å; R106-Q110 PolarHBondContact O-N 3.29Å; R106-T164 HydrophobicContact CG-CG2 4.49Å; R106-T164 VanDerWaalsContact CZ-CG2 3.45Å
107	K	81.8	Confident	82.9	Confident	126 Å²	126	84.4 Å²	84.4	55%	0.548	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-42.9	173.1	-75.7	177.1	-179.8	-177.9	0	111	E103 A104 Q110 C111	E103-K107 WeakPolarHBondContact O-CB 3.41Å; E103-K107 VanDerWaalsContact O-CG 3.26Å; E103-K107 WeakPolarHBondContact O-CG 3.46Å; E103-K107 PolarHBondContact O-N 3.32Å; A104-K107 PolarHBondContact O-N 3.11Å; K107-Q110 PolarHBondContact O-N 2.85Å; K107-C111 VanDerWaalsContact O-CB 3.25Å; K107-C111 WeakPolarHBondContact O-CB 3.33Å; K107-C111 PolarHBondContact O-N 2.92Å; K107-C111 PolarHBondContact O-SG 3.27Å
108	H	86.6	Confident	83	Confident	131 Å²	131	81.6 Å²	81.6	61%	0.606	42%	0.423	S	S	*	.	H	α-helix	trans	-63.4	-41.4	176.6	178.9	68.4	0	0	0	112	A104 S105 R106 C111 S112	A104-H108 VanDerWaalsContact O-CB 3.24Å; A104-H108 WeakPolarHBondContact O-CB 3.41Å; A104-H108 PolarHBondContact O-N 3.38Å; S105-H108 CarbonylContact O-C 3.58Å; S105-H108 PolarHBondContact O-N 3.41Å; R106-H108 VanDerWaalsContact C-N 3.3Å; R106-H108 PolarHBondContact O-N 3.19Å; H108-C111 CarbonylContact O-C 3.54Å; H108-C111 PolarHBondContact O-N 3.3Å; H108-S112 WeakPolarHBondContact O-CA 3.35Å; H108-S112 WeakPolarHBondContact O-CB 3.42Å; H108-S112 PolarHBondContact O-N 3.33Å
109	M	82.7	Confident	83	Confident	88 Å²	88	85 Å²	85	43%	0.433	43%	0.434	S	S	.	.	H	α-helix	trans	-67.8	-46.4	178.1	-170.3	168.7	-68.7	0	0	110.8	S105 R106 C111 S112 T113	S105-M109 WeakPolarHBondContact O-CB 3.44Å; S105-M109 PolarHBondContact O-N 2.94Å; R106-M109 PolarHBondContact O-N 3.34Å; M109-C111 VanDerWaalsContact C-N 3.33Å; M109-C111 PolarHBondContact O-N 2.94Å; M109-S112 PolarHBondContact O-N 3.46Å; M109-S112 VanDerWaalsContact O-N 3.16Å; M109-T113 WeakPolarHBondContact O-CB 3.19Å; M109-T113 PolarHBondContact O-N 3.14Å; M109-T113 PolarHBondContact O-OG1 3.28Å
110	Q	81	Confident	82.9	Confident	56 Å²	56	79.2 Å²	79.2	26%	0.262	42%	0.418	S	S	.	.	H	α-helix	trans	-56.8	-46.5	172.5	-73.5	175.3	-27.4	0	0	111.4	R106 K107 A114 E160 T164	R106-Q110 WeakPolarHBondContact O-CB 3.43Å; R106-Q110 VanDerWaalsContact O-CG 3.3Å; R106-Q110 WeakPolarHBondContact O-CG 3.28Å; R106-Q110 PolarHBondContact O-N 3.29Å; K107-Q110 PolarHBondContact O-N 2.85Å; Q110-A114 WeakPolarHBondContact O-CB 3.26Å; Q110-A114 PolarHBondContact O-N 2.8Å; Q110-E160 HydrophobicContact CG-CB 4.32Å; Q110-T164 VanDerWaalsContact NE2-CG2 3.27Å
111	C	81.9	Confident	82.7	Confident	70 Å²	70	75.8 Å²	75.8	47%	0.473	40%	0.396	S	S	.	.	H	α-helix	trans	-66.6	-39.3	175.4	-70	0	0	0	0	112.1	K107 H108 M109 A114 I115	K107-C111 VanDerWaalsContact O-CB 3.25Å; K107-C111 WeakPolarHBondContact O-CB 3.33Å; K107-C111 PolarHBondContact O-N 2.92Å; K107-C111 PolarHBondContact O-SG 3.27Å; H108-C111 CarbonylContact O-C 3.54Å; H108-C111 PolarHBondContact O-N 3.3Å; M109-C111 VanDerWaalsContact C-N 3.33Å; M109-C111 PolarHBondContact O-N 2.94Å; C111-A114 CarbonylContact O-C 3.5Å; C111-A114 PolarHBondContact O-N 3.34Å; C111-I115 VanDerWaalsContact O-CB 3.23Å; C111-I115 WeakPolarHBondContact O-CB 3.35Å; C111-I115 WeakPolarHBondContact O-CD1 3.44Å; C111-I115 WeakPolarHBondContact O-CG1 3.41Å; C111-I115 PolarHBondContact O-N 2.9Å
112	S	86.8	Confident	82.6	Confident	33 Å²	33	80.7 Å²	80.7	23%	0.231	41%	0.408	C	S	.	.	H	α-helix	trans	-66.2	-47.9	179.6	-164.3	0	0	0	0	110.2	H108 M109 A114 I115 E116	H108-S112 WeakPolarHBondContact O-CA 3.35Å; H108-S112 WeakPolarHBondContact O-CB 3.42Å; H108-S112 PolarHBondContact O-N 3.33Å; M109-S112 PolarHBondContact O-N 3.46Å; M109-S112 VanDerWaalsContact O-N 3.16Å; S112-A114 VanDerWaalsContact C-N 3.32Å; S112-A114 PolarHBondContact O-N 2.93Å; S112-I115 CarbonylContact O-C 3.55Å; S112-I115 PolarHBondContact O-N 3.41Å; S112-I115 VanDerWaalsContact O-N 3.1Å; S112-E116 WeakPolarHBondContact O-CB 3.32Å; S112-E116 VanDerWaalsContact O-CG 3.26Å; S112-E116 WeakPolarHBondContact O-CG 3.37Å; S112-E116 PolarHBondContact O-N 3.42Å; S112-E116 PolarHBondContact OG-OE1 3.33Å
113	T	82.9	Confident	82.8	Confident	18 Å²	18	80.4 Å²	80.4	11%	0.11	41%	0.405	C	S	.	.	H	α-helix	trans	-62.2	-41.5	175	-55.4	0	0	0	0	110.9	M109 I115 N117 N156 E160	M109-T113 WeakPolarHBondContact O-CB 3.19Å; M109-T113 PolarHBondContact O-N 3.14Å; M109-T113 PolarHBondContact O-OG1 3.28Å; T113-I115 VanDerWaalsContact C-N 3.32Å; T113-I115 PolarHBondContact O-N 3.22Å; T113-N117 WeakPolarHBondContact O-CB 3.49Å; T113-N117 PolarHBondContact O-N 3.43Å; T113-N117 PolarHBondContact O-ND2 3.24Å; T113-N156 HydrophobicContact CG2-CB 4.01Å; T113-E160 HydrophobicContact CG2-CG 3.85Å
114	A	80.6	Confident	83	Confident	35 Å²	35	77.7 Å²	77.7	29%	0.289	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-34.5	174.1	0	0	0	0	0	112.5	Q110 C111 S112 N117 L118	Q110-A114 WeakPolarHBondContact O-CB 3.26Å; Q110-A114 PolarHBondContact O-N 2.8Å; C111-A114 CarbonylContact O-C 3.5Å; C111-A114 PolarHBondContact O-N 3.34Å; S112-A114 VanDerWaalsContact C-N 3.32Å; S112-A114 PolarHBondContact O-N 2.93Å; A114-N117 CarbonylContact O-C 3.34Å; A114-L118 WeakPolarHBondContact O-CA 3.38Å; A114-L118 VanDerWaalsContact O-CB 3.25Å; A114-L118 WeakPolarHBondContact O-CB 3.29Å; A114-L118 PolarHBondContact O-N 3Å
115	I	85.5	Confident	83.1	Confident	116 Å²	116	80.3 Å²	80.3	60%	0.595	40%	0.396	S	S	*	.	H	α-helix	trans	-72.4	-45.8	177.5	-74.5	163.7	0	0	0	111	C111 S112 T113 N117 L118	C111-I115 VanDerWaalsContact O-CB 3.23Å; C111-I115 WeakPolarHBondContact O-CB 3.35Å; C111-I115 WeakPolarHBondContact O-CD1 3.44Å; C111-I115 WeakPolarHBondContact O-CG1 3.41Å; C111-I115 PolarHBondContact O-N 2.9Å; S112-I115 CarbonylContact O-C 3.55Å; S112-I115 PolarHBondContact O-N 3.41Å; S112-I115 VanDerWaalsContact O-N 3.1Å; T113-I115 VanDerWaalsContact C-N 3.32Å; T113-I115 PolarHBondContact O-N 3.22Å; I115-N117 VanDerWaalsContact C-N 3.25Å; I115-N117 PolarHBondContact O-N 2.98Å; I115-L118 WeakPolarHBondContact O-CB 3.32Å; I115-L118 PolarHBondContact O-N 3.44Å; I115-L118 VanDerWaalsContact O-N 3.07Å
116	E	84	Confident	83.3	Confident	138 Å²	138	82.7 Å²	82.7	65%	0.645	40%	0.401	S	S	*	.	H	α-helix	trans	-60.5	-37.9	176.8	-75.2	165	-151.9	0	0	111.1	S112	S112-E116 WeakPolarHBondContact O-CB 3.32Å; S112-E116 VanDerWaalsContact O-CG 3.26Å; S112-E116 WeakPolarHBondContact O-CG 3.37Å; S112-E116 PolarHBondContact O-N 3.42Å; S112-E116 PolarHBondContact OG-OE1 3.33Å
117	N	83.3	Confident	83.8	Confident	24 Å²	24	78.9 Å²	78.9	13%	0.128	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	5.5	176.4	-62	-79.2	0	0	0	112.9	T113 A114 I115 K119 A120 I121 A153	T113-N117 WeakPolarHBondContact O-CB 3.49Å; T113-N117 PolarHBondContact O-N 3.43Å; T113-N117 PolarHBondContact O-ND2 3.24Å; A114-N117 CarbonylContact O-C 3.34Å; I115-N117 VanDerWaalsContact C-N 3.25Å; I115-N117 PolarHBondContact O-N 2.98Å; N117-K119 VanDerWaalsContact C-N 3.26Å; N117-K119 PolarHBondContact O-N 3.43Å; N117-A120 PolarHBondContact O-N 3.31Å; N117-A120 VanDerWaalsContact O-N 3.11Å; N117-I121 HydrophobicContact CB-CD1 4.15Å; N117-I121 VanDerWaalsContact O-CG1 3.31Å; N117-I121 WeakPolarHBondContact O-CG1 3.28Å; N117-I121 PolarHBondContact O-N 3.11Å; N117-A153 HydrophobicContact CB-CB 4.08Å; N117-A153 WeakPolarHBondContact OD1-CA 3.33Å
118	L	82.2	Confident	84.2	Confident	95 Å²	95	73 Å²	73	50%	0.497	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-37.8	-171.1	-171	67.9	0	0	0	111.8	A114 I115 I121 Y122	A114-L118 WeakPolarHBondContact O-CA 3.38Å; A114-L118 VanDerWaalsContact O-CB 3.25Å; A114-L118 WeakPolarHBondContact O-CB 3.29Å; A114-L118 PolarHBondContact O-N 3Å; I115-L118 WeakPolarHBondContact O-CB 3.32Å; I115-L118 PolarHBondContact O-N 3.44Å; I115-L118 VanDerWaalsContact O-N 3.07Å; L118-I121 PolarHBondContact O-N 2.93Å; L118-Y122 VanDerWaalsContact O-CB 3.24Å; L118-Y122 WeakPolarHBondContact O-CB 3.28Å; L118-Y122 PolarHBondContact O-N 3.36Å
119	K	81.4	Confident	84.4	Confident	139 Å²	139	70.9 Å²	70.9	60%	0.604	36%	0.356	S	S	*	.	H	α-helix	trans	-59.6	-49.7	177.5	-171.3	-177.2	176	-170.8	0	110.9	N117 I121 Y122 E123	N117-K119 VanDerWaalsContact C-N 3.26Å; N117-K119 PolarHBondContact O-N 3.43Å; K119-I121 VanDerWaalsContact C-N 3.32Å; K119-I121 PolarHBondContact O-N 3.25Å; K119-Y122 PolarHBondContact O-N 3.4Å; K119-E123 VanDerWaalsContact CE-OE1 3.29Å; K119-E123 WeakPolarHBondContact CE-OE1 3.46Å; K119-E123 WeakPolarHBondContact CE-OE2 3.47Å; K119-E123 HydrophobicContact CG-CG 4.43Å; K119-E123 VanDerWaalsContact O-CB 3.27Å; K119-E123 WeakPolarHBondContact O-CB 3.39Å; K119-E123 WeakPolarHBondContact O-CG 3.5Å; K119-E123 PolarHBondContact O-N 2.68Å
120	A	79.2	Confident	84.9	Confident	26 Å²	26	71.1 Å²	71.1	22%	0.215	36%	0.355	C	S	.	.	H	α-helix	trans	-65.4	-34.8	179.1	0	0	0	0	0	112.5	N117 I124 L150 A153	N117-A120 PolarHBondContact O-N 3.31Å; N117-A120 VanDerWaalsContact O-N 3.11Å; A120-I124 WeakPolarHBondContact O-CA 3.45Å; A120-I124 PolarHBondContact O-N 2.92Å; A120-L150 HydrophobicContact CB-CD2 4.35Å; A120-A153 HydrophobicContact CB-CB 3.69Å
121	I	79.5	Confident	85.4	Confident	34 Å²	34	68.4 Å²	68.4	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-71.7	-46.2	177.1	-62.6	164.7	0	0	0	110.7	N117 L118 K119 I124 V157 Y178 F179	N117-I121 HydrophobicContact CB-CD1 4.15Å; N117-I121 VanDerWaalsContact O-CG1 3.31Å; N117-I121 WeakPolarHBondContact O-CG1 3.28Å; N117-I121 PolarHBondContact O-N 3.11Å; L118-I121 PolarHBondContact O-N 2.93Å; K119-I121 VanDerWaalsContact C-N 3.32Å; K119-I121 PolarHBondContact O-N 3.25Å; I121-I124 WeakPolarHBondContact O-CB 3.45Å; I121-I124 VanDerWaalsContact O-CG2 3.28Å; I121-I124 WeakPolarHBondContact O-CG2 3.31Å; I121-I124 PolarHBondContact O-N 3.49Å; I121-V157 HydrophobicContact CD1-CG2 3.88Å; I121-Y178 HydrophobicContact CG2-CE1 4.05Å; I121-Y178 PolarHBondContact O-OH 3.04Å; I121-F179 HydrophobicContact CG1-CZ 4.38Å
122	Y	82.9	Confident	85.9	Confident	203 Å²	203	68.4 Å²	68.4	80%	0.796	33%	0.333	S	S	*	.	H	α-helix	trans	-70.9	-40.3	-177.4	-170.7	-93.6	0	0	0	112.3	L118 K119 I124	L118-Y122 VanDerWaalsContact O-CB 3.24Å; L118-Y122 WeakPolarHBondContact O-CB 3.28Å; L118-Y122 PolarHBondContact O-N 3.36Å; K119-Y122 PolarHBondContact O-N 3.4Å; Y122-I124 VanDerWaalsContact C-N 3.25Å; Y122-I124 PolarHBondContact O-N 2.91Å
123	E	85.8	Confident	86.2	Confident	72 Å²	72	72.5 Å²	72.5	34%	0.336	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	14.4	179.1	-60.3	174.1	-176.7	0	0	112.4	K119 Q125 E126 T127	K119-E123 VanDerWaalsContact CE-OE1 3.29Å; K119-E123 WeakPolarHBondContact CE-OE1 3.46Å; K119-E123 WeakPolarHBondContact CE-OE2 3.47Å; K119-E123 HydrophobicContact CG-CG 4.43Å; K119-E123 VanDerWaalsContact O-CB 3.27Å; K119-E123 WeakPolarHBondContact O-CB 3.39Å; K119-E123 WeakPolarHBondContact O-CG 3.5Å; K119-E123 PolarHBondContact O-N 2.68Å; E123-Q125 PolarHBondContact O-N 2.79Å; E123-E126 PolarHBondContact O-N 3.37Å; E123-T127 WeakPolarHBondContact O-CB 3.41Å; E123-T127 PolarHBondContact O-N 3.31Å; E123-T127 PolarHBondContact O-OG1 2.97Å
124	I	86.1	Confident	86.6	Confident	18 Å²	18	73.1 Å²	73.1	9%	0.092	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-48	-173.3	-167.3	170.4	0	0	0	111.9	A120 I121 Y122 T127 V128 L150 Y178 F179	A120-I124 WeakPolarHBondContact O-CA 3.45Å; A120-I124 PolarHBondContact O-N 2.92Å; I121-I124 WeakPolarHBondContact O-CB 3.45Å; I121-I124 VanDerWaalsContact O-CG2 3.28Å; I121-I124 WeakPolarHBondContact O-CG2 3.31Å; I121-I124 PolarHBondContact O-N 3.49Å; Y122-I124 VanDerWaalsContact C-N 3.25Å; Y122-I124 PolarHBondContact O-N 2.91Å; I124-T127 PolarHBondContact O-N 3.33Å; I124-V128 HydrophobicContact CG1-CG2 4.13Å; I124-V128 VanDerWaalsContact O-CB 3.25Å; I124-V128 WeakPolarHBondContact O-CB 3.33Å; I124-V128 WeakPolarHBondContact O-CG2 3.26Å; I124-V128 PolarHBondContact O-N 3.32Å; I124-L150 HydrophobicContact CG1-CD2 4.28Å; I124-Y178 HydrophobicContact CD1-CD1 4.36Å; I124-Y178 HydrophobicContact CD1-CE1 3.89Å; I124-Y178 HydrophobicContact CG2-CE1 4.33Å; I124-Y178 WeakPolarHBondContact CG2-OH 3.29Å; I124-F179 HydrophobicContact CD1-CD1 3.52Å; I124-F179 HydrophobicContact CD1-CE1 3.66Å
125	Q	86.4	Confident	87.2	Confident	107 Å²	107	71.8 Å²	71.8	50%	0.5	34%	0.339	S	S	.	.	H	α-helix	trans	-66.8	-44	-176.3	-171.3	62	35.4	0	0	111.1	E123 T127 V128 D129	E123-Q125 PolarHBondContact O-N 2.79Å; Q125-T127 PolarHBondContact O-N 3.22Å; Q125-V128 PolarHBondContact O-N 2.88Å; Q125-D129 PolarHBondContact NE2-OD1 2.78Å; Q125-D129 VanDerWaalsContact NE2-OD1 3.12Å; Q125-D129 WeakPolarHBondContact O-CB 3.42Å; Q125-D129 PolarHBondContact O-N 3.49Å
126	E	89.6	Confident	87.4	Confident	106 Å²	106	71 Å²	71	50%	0.495	34%	0.343	S	S	.	.	H	α-helix	trans	-64.5	-41.9	178.4	-172.8	-178	166.9	0	0	111.5	E123 K130	E123-E126 PolarHBondContact O-N 3.37Å; E126-K130 HydrophobicContact CG-CD 4.31Å; E126-K130 WeakPolarHBondContact O-CB 3.27Å; E126-K130 VanDerWaalsContact O-CG 3.25Å; E126-K130 WeakPolarHBondContact O-CG 3.38Å; E126-K130 PolarHBondContact O-N 3.47Å; E126-K130 VanDerWaalsContact OE1-CE 3.23Å; E126-K130 WeakPolarHBondContact OE1-CE 3.41Å; E126-K130 IonicContact OE1-NZ 3.07Å; E126-K130 PolarHBondContact OE1-NZ 2.89Å
127	T	90	Very high	87.7	Confident	22 Å²	22	67.5 Å²	67.5	14%	0.135	33%	0.334	C	S	.	.	H	α-helix	trans	-68.3	-39.8	177.3	-52.3	0	0	0	0	111	E123 I124 Q125 T131 N146 L150	E123-T127 WeakPolarHBondContact O-CB 3.41Å; E123-T127 PolarHBondContact O-N 3.31Å; E123-T127 PolarHBondContact O-OG1 2.97Å; I124-T127 PolarHBondContact O-N 3.33Å; Q125-T127 PolarHBondContact O-N 3.22Å; T127-T131 VanDerWaalsContact O-CB 3.25Å; T127-T131 WeakPolarHBondContact O-CB 3.3Å; T127-T131 PolarHBondContact O-N 3.06Å; T127-T131 PolarHBondContact O-OG1 3.5Å; T127-N146 HydrophobicContact CG2-CB 4.04Å; T127-L150 HydrophobicContact CG2-CD1 3.8Å; T127-L150 HydrophobicContact CG2-CD2 4.3Å; T127-L150 HydrophobicContact CG2-CG 4.15Å
128	V	90.7	Very high	87.9	Confident	3 Å²	3	68.8 Å²	68.8	2%	0.018	35%	0.353	C	S	.	.	H	α-helix	trans	-62.5	-47.4	175.2	166.8	0	0	0	0	110.6	I124 Q125 T131 Y132 L150 L182 L185	I124-V128 HydrophobicContact CG1-CG2 4.13Å; I124-V128 VanDerWaalsContact O-CB 3.25Å; I124-V128 WeakPolarHBondContact O-CB 3.33Å; I124-V128 WeakPolarHBondContact O-CG2 3.26Å; I124-V128 PolarHBondContact O-N 3.32Å; Q125-V128 PolarHBondContact O-N 2.88Å; V128-T131 PolarHBondContact O-N 2.88Å; V128-T131 VanDerWaalsContact O-N 3.12Å; V128-Y132 HydrophobicContact CG1-CD2 3.74Å; V128-Y132 HydrophobicContact CG1-CE2 3.5Å; V128-Y132 VanDerWaalsContact O-CD2 3.3Å; V128-Y132 WeakPolarHBondContact O-CD2 3.46Å; V128-Y132 PolarHBondContact O-N 3.37Å; V128-L150 HydrophobicContact CG2-CD1 3.96Å; V128-L182 HydrophobicContact CG2-CD2 3.97Å; V128-L185 HydrophobicContact CG2-CD2 4.27Å
129	D	90.8	Very high	88.3	Confident	85 Å²	85	69.3 Å²	69.3	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-62.6	-46.7	178.9	-67.8	-21.6	0	0	0	111.3	Q125 T131 Y132 E133	Q125-D129 PolarHBondContact NE2-OD1 2.78Å; Q125-D129 VanDerWaalsContact NE2-OD1 3.12Å; Q125-D129 WeakPolarHBondContact O-CB 3.42Å; Q125-D129 PolarHBondContact O-N 3.49Å; D129-T131 VanDerWaalsContact C-N 3.26Å; D129-T131 PolarHBondContact O-N 3.42Å; D129-Y132 PolarHBondContact O-N 2.88Å; D129-E133 PolarHBondContact O-N 3.33Å
130	K	92.1	Very high	88.8	Confident	93 Å²	93	63 Å²	63	40%	0.404	32%	0.321	S	S	.	.	H	α-helix	trans	-59.2	-37.7	172.7	-74.8	173.7	-174.7	168.3	0	112	E126 E133 M134	E126-K130 HydrophobicContact CG-CD 4.31Å; E126-K130 WeakPolarHBondContact O-CB 3.27Å; E126-K130 VanDerWaalsContact O-CG 3.25Å; E126-K130 WeakPolarHBondContact O-CG 3.38Å; E126-K130 PolarHBondContact O-N 3.47Å; E126-K130 VanDerWaalsContact OE1-CE 3.23Å; E126-K130 WeakPolarHBondContact OE1-CE 3.41Å; E126-K130 IonicContact OE1-NZ 3.07Å; E126-K130 PolarHBondContact OE1-NZ 2.89Å; K130-E133 WeakPolarHBondContact O-CB 3.34Å; K130-E133 PolarHBondContact O-N 2.87Å; K130-M134 VanDerWaalsContact O-CG 3.27Å; K130-M134 WeakPolarHBondContact O-CG 3.18Å; K130-M134 PolarHBondContact O-N 3.41Å
131	T	92	Very high	89.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-70.7	-38.7	-179.8	-56.3	0	0	0	0	111.1	T127 V128 D129 E133 M134 I135 A143 N146 L185	T127-T131 VanDerWaalsContact O-CB 3.25Å; T127-T131 WeakPolarHBondContact O-CB 3.3Å; T127-T131 PolarHBondContact O-N 3.06Å; T127-T131 PolarHBondContact O-OG1 3.5Å; V128-T131 PolarHBondContact O-N 2.88Å; V128-T131 VanDerWaalsContact O-N 3.12Å; D129-T131 VanDerWaalsContact C-N 3.26Å; D129-T131 PolarHBondContact O-N 3.42Å; T131-E133 VanDerWaalsContact C-N 3.3Å; T131-E133 PolarHBondContact O-N 2.87Å; T131-M134 PolarHBondContact O-N 2.97Å; T131-I135 HydrophobicContact CG2-CD1 4.28Å; T131-I135 VanDerWaalsContact O-CG1 3.25Å; T131-I135 WeakPolarHBondContact O-CG1 3.37Å; T131-I135 PolarHBondContact O-N 3.22Å; T131-A143 HydrophobicContact CG2-CB 3.9Å; T131-A143 WeakPolarHBondContact CG2-O 3.33Å; T131-N146 HydrophobicContact CG2-CB 4.25Å; T131-N146 WeakPolarHBondContact OG1-CB 3.45Å; T131-N146 PolarHBondContact OG1-ND2 2.94Å; T131-N146 VanDerWaalsContact OG1-ND2 3.16Å; T131-L185 HydrophobicContact CG2-CD1 3.85Å; T131-L185 HydrophobicContact CG2-CD2 3.73Å; T131-L185 HydrophobicContact CG2-CG 4.02Å
132	Y	92.9	Very high	90	Very high	69 Å²	69	68 Å²	68	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-38.7	169.7	-80.9	-63	0	0	0	112.1	V128 D129 I135 S136 L185 E188	V128-Y132 HydrophobicContact CG1-CD2 3.74Å; V128-Y132 HydrophobicContact CG1-CE2 3.5Å; V128-Y132 VanDerWaalsContact O-CD2 3.3Å; V128-Y132 WeakPolarHBondContact O-CD2 3.46Å; V128-Y132 PolarHBondContact O-N 3.37Å; D129-Y132 PolarHBondContact O-N 2.88Å; Y132-I135 PolarHBondContact O-N 3.02Å; Y132-S136 WeakPolarHBondContact O-CB 3.42Å; Y132-S136 PolarHBondContact O-N 2.91Å; Y132-S136 PolarHBondContact O-OG 3.28Å; Y132-L185 HydrophobicContact CD1-CD1 3.63Å; Y132-L185 HydrophobicContact CD2-CD1 3.81Å; Y132-L185 HydrophobicContact CE1-CD1 3.61Å; Y132-L185 HydrophobicContact CE2-CD1 3.81Å; Y132-L185 HydrophobicContact CG-CD1 3.72Å; Y132-L185 PolarHBondContact OH-N 2.86Å; Y132-E188 HydrophobicContact CE1-CB 4.19Å; Y132-E188 HydrophobicContact CE1-CG 4.33Å
133	E	92.5	Very high	90.5	Very high	120 Å²	120	58.3 Å²	58.3	56%	0.561	30%	0.303	S	S	*	.	H	α-helix	trans	-64.6	-39.8	172.8	-165.9	-172.9	167.3	0	0	112	D129 K130 T131 S136 S137	D129-E133 PolarHBondContact O-N 3.33Å; K130-E133 WeakPolarHBondContact O-CB 3.34Å; K130-E133 PolarHBondContact O-N 2.87Å; T131-E133 VanDerWaalsContact C-N 3.3Å; T131-E133 PolarHBondContact O-N 2.87Å; E133-S136 WeakPolarHBondContact CA-OG 3.43Å; E133-S136 PolarHBondContact O-N 3.47Å; E133-S136 PolarHBondContact O-OG 3.47Å; E133-S137 VanDerWaalsContact O-CB 3.3Å; E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 2.9Å; E133-S137 PolarHBondContact O-OG 2.94Å
134	M	92.1	Very high	90.9	Very high	31 Å²	31	55.6 Å²	55.6	15%	0.153	29%	0.291	C	S	.	.	H	α-helix	trans	-65.6	-41.2	175.2	-71.7	171	177.9	0	0	112.3	K130 T131 S137 G138 R139 E142 A143 N146	K130-M134 VanDerWaalsContact O-CG 3.27Å; K130-M134 WeakPolarHBondContact O-CG 3.18Å; K130-M134 PolarHBondContact O-N 3.41Å; T131-M134 PolarHBondContact O-N 2.97Å; M134-S137 WeakPolarHBondContact CA-OG 3.26Å; M134-S137 PolarHBondContact O-N 3.48Å; M134-S137 PolarHBondContact O-OG 3.18Å; M134-G138 PolarHBondContact O-N 2.82Å; M134-G138 VanDerWaalsContact O-N 3.15Å; M134-R139 HydrophobicContact CB-CB 4.38Å; M134-R139 PolarHBondContact O-N 3.39Å; M134-E142 HydrophobicContact CE-CB 4.28Å; M134-E142 HydrophobicContact CG-CB 4.45Å; M134-E142 HydrophobicContact SD-CB 3.71Å; M134-A143 HydrophobicContact CB-CB 3.87Å; M134-N146 PolarHBondContact SD-ND2 2.88Å
135	I	92.3	Very high	91.2	Very high	7 Å²	7	58 Å²	58	4%	0.036	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-48.4	175.3	-67.4	168.1	0	0	0	110	T131 Y132 S137 G138 A143 L185 E188 L189 Q192	T131-I135 HydrophobicContact CG2-CD1 4.28Å; T131-I135 VanDerWaalsContact O-CG1 3.25Å; T131-I135 WeakPolarHBondContact O-CG1 3.37Å; T131-I135 PolarHBondContact O-N 3.22Å; Y132-I135 PolarHBondContact O-N 3.02Å; I135-S137 PolarHBondContact O-N 3.42Å; I135-G138 PolarHBondContact O-N 3.32Å; I135-G138 VanDerWaalsContact O-N 3.11Å; I135-A143 HydrophobicContact CG1-CB 3.63Å; I135-L185 HydrophobicContact CD1-CD1 3.6Å; I135-L185 HydrophobicContact CD1-CG 4.32Å; I135-E188 HydrophobicContact CG2-CG 4.28Å; I135-L189 HydrophobicContact CD1-CB 3.99Å; I135-L189 HydrophobicContact CG1-CB 4.45Å; I135-L189 HydrophobicContact CG1-CD1 4.12Å; I135-Q192 HydrophobicContact CG2-CB 4.4Å; I135-Q192 HydrophobicContact CG2-CG 3.53Å
136	S	90.5	Very high	91.5	Very high	98 Å²	98	54.3 Å²	54.3	69%	0.685	29%	0.292	S	S	*	.	H	α-helix	trans	-68.2	-31.9	-179.4	58.4	0	0	0	0	113.4	Y132 E133 G138	Y132-S136 WeakPolarHBondContact O-CB 3.42Å; Y132-S136 PolarHBondContact O-N 2.91Å; Y132-S136 PolarHBondContact O-OG 3.28Å; E133-S136 WeakPolarHBondContact CA-OG 3.43Å; E133-S136 PolarHBondContact O-N 3.47Å; E133-S136 PolarHBondContact O-OG 3.47Å; S136-G138 VanDerWaalsContact C-N 3.27Å; S136-G138 PolarHBondContact O-N 3.47Å
137	S	89.9	Confident	91.6	Very high	65 Å²	65	49.2 Å²	49.2	46%	0.455	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.7	172.5	58.5	0	0	0	0	114.2	E133 M134 I135 R139	E133-S137 VanDerWaalsContact O-CB 3.3Å; E133-S137 WeakPolarHBondContact O-CB 3.45Å; E133-S137 PolarHBondContact O-N 2.9Å; E133-S137 PolarHBondContact O-OG 2.94Å; M134-S137 WeakPolarHBondContact CA-OG 3.26Å; M134-S137 PolarHBondContact O-N 3.48Å; M134-S137 PolarHBondContact O-OG 3.18Å; I135-S137 PolarHBondContact O-N 3.42Å; S137-R139 VanDerWaalsContact C-N 3.33Å; S137-R139 PolarHBondContact OG-NE 2.94Å
138	G	87.3	Confident	91.7	Very high	51 Å²	51	49.5 Å²	49.5	53%	0.526	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	11.6	179.1	0	0	0	0	0	114.8	M134 I135 S136 L140	M134-G138 PolarHBondContact O-N 2.82Å; M134-G138 VanDerWaalsContact O-N 3.15Å; I135-G138 PolarHBondContact O-N 3.32Å; I135-G138 VanDerWaalsContact O-N 3.11Å; S136-G138 VanDerWaalsContact C-N 3.27Å; S136-G138 PolarHBondContact O-N 3.47Å; G138-L140 PolarHBondContact O-N 2.81Å
139	R	90.7	Very high	91.6	Very high	106 Å²	106	55.2 Å²	55.2	40%	0.4	30%	0.296	S	S	.	.			trans	-82.9	64.6	174.5	-69.1	-176.2	-70.9	173	-6.4	110.6	M134 S137 L141 E142 A143	M134-R139 HydrophobicContact CB-CB 4.38Å; M134-R139 PolarHBondContact O-N 3.39Å; S137-R139 VanDerWaalsContact C-N 3.33Å; S137-R139 PolarHBondContact OG-NE 2.94Å; R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.33Å; R139-E142 HydrophobicContact CB-CB 4.46Å; R139-E142 IonicContact CZ-OE2 2.85Å; R139-E142 IonicContact NE-OE2 2.79Å; R139-E142 IonicContact NH1-OE2 3.24Å; R139-E142 PolarHBondContact NH1-OE2 2.89Å; R139-E142 PolarHBondContact O-N 3.38Å; R139-A143 PolarHBondContact O-N 3.43Å
140	L	92	Very high	91.6	Very high	7 Å²	7	51.3 Å²	51.3	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-66.1	-28.9	-169.7	-56	-176.8	0	0	0	113.9	G138 H144 L189 Q192 V193 I196 L220	G138-L140 PolarHBondContact O-N 2.81Å; L140-H144 WeakPolarHBondContact O-CB 2.96Å; L140-H144 PolarHBondContact O-N 2.62Å; L140-L189 HydrophobicContact CB-CD1 4.36Å; L140-L189 HydrophobicContact CD2-CD1 4.08Å; L140-Q192 HydrophobicContact CD2-CB 3.98Å; L140-V193 HydrophobicContact CD1-CG2 4.21Å; L140-I196 HydrophobicContact CD1-CD1 3.43Å; L140-I196 VanDerWaalsContact CD1-CD1 3.43Å; L140-L220 HydrophobicContact CB-CD1 3.69Å
141	L	91.8	Very high	91.5	Very high	76 Å²	76	47.1 Å²	47.1	40%	0.398	26%	0.257	S	S	.	.	H	α-helix	trans	-68.1	-48.7	177	-67.3	172.5	0	0	0	111.7	R139 A143 H144 C145 T216 L220	R139-L141 VanDerWaalsContact C-N 3.31Å; R139-L141 PolarHBondContact O-N 3.33Å; L141-A143 VanDerWaalsContact C-N 3.29Å; L141-A143 PolarHBondContact O-N 3.03Å; L141-H144 PolarHBondContact O-N 2.93Å; L141-C145 PolarHBondContact O-N 2.97Å; L141-C145 PolarHBondContact O-SG 3.16Å; L141-C145 VanDerWaalsContact O-SG 3.34Å; L141-T216 HydrophobicContact CD1-CG2 3.98Å; L141-T216 HydrophobicContact CD2-CG2 3.83Å; L141-T216 HydrophobicContact CG-CG2 3.54Å; L141-L220 HydrophobicContact CD2-CD2 3.85Å; L141-L220 HydrophobicContact CD2-CG 4.21Å
142	E	91.7	Very high	91.4	Very high	89 Å²	89	51 Å²	51	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-62.2	-42.1	177.2	-65.8	171	-150.1	0	0	110.2	M134 R139 H144 C145 N146	M134-E142 HydrophobicContact CE-CB 4.28Å; M134-E142 HydrophobicContact CG-CB 4.45Å; M134-E142 HydrophobicContact SD-CB 3.71Å; R139-E142 HydrophobicContact CB-CB 4.46Å; R139-E142 IonicContact CZ-OE2 2.85Å; R139-E142 IonicContact NE-OE2 2.79Å; R139-E142 IonicContact NH1-OE2 3.24Å; R139-E142 PolarHBondContact NH1-OE2 2.89Å; R139-E142 PolarHBondContact O-N 3.38Å; E142-H144 VanDerWaalsContact C-N 3.35Å; E142-H144 PolarHBondContact O-N 2.81Å; E142-C145 PolarHBondContact O-N 3.48Å; E142-N146 PolarHBondContact O-N 3.34Å; E142-N146 VanDerWaalsContact O-N 3.07Å
143	A	93.5	Very high	91.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-42.3	175.6	0	0	0	0	0	112.9	T131 M134 I135 R139 L141 L147 L189	T131-A143 HydrophobicContact CG2-CB 3.9Å; T131-A143 WeakPolarHBondContact CG2-O 3.33Å; M134-A143 HydrophobicContact CB-CB 3.87Å; I135-A143 HydrophobicContact CG1-CB 3.63Å; R139-A143 PolarHBondContact O-N 3.43Å; L141-A143 VanDerWaalsContact C-N 3.29Å; L141-A143 PolarHBondContact O-N 3.03Å; A143-L147 WeakPolarHBondContact O-CB 3.26Å; A143-L147 PolarHBondContact O-N 3.34Å; A143-L189 HydrophobicContact CB-CD1 4.12Å
144	H	94.5	Very high	90.9	Very high	14 Å²	14	42.5 Å²	42.5	7%	0.065	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-42.1	176.7	-178.5	-105.6	0	0	0	112.1	L140 L141 E142 N146 L147 V148 L189 L220 E224	L140-H144 WeakPolarHBondContact O-CB 2.96Å; L140-H144 PolarHBondContact O-N 2.62Å; L141-H144 PolarHBondContact O-N 2.93Å; E142-H144 VanDerWaalsContact C-N 3.35Å; E142-H144 PolarHBondContact O-N 2.81Å; H144-N146 PolarHBondContact O-N 3.4Å; H144-L147 PolarHBondContact O-N 3.18Å; H144-V148 VanDerWaalsContact CE1-CG2 3.42Å; H144-V148 WeakPolarHBondContact CE1-CG2 3.38Å; H144-V148 WeakPolarHBondContact NE2-CG2 3.43Å; H144-V148 WeakPolarHBondContact O-CB 3.39Å; H144-V148 WeakPolarHBondContact O-CG2 3.33Å; H144-V148 PolarHBondContact O-N 3.49Å; H144-L189 HydrophobicContact CB-CD2 4.02Å; H144-L220 HydrophobicContact CB-CD1 4.45Å; H144-L220 HydrophobicContact CB-CD2 3.38Å; H144-E224 IonicContact CD2-OE1 3.74Å; H144-E224 IonicContact CE1-OE1 2.7Å; H144-E224 IonicContact NE2-OE1 2.59Å; H144-E224 PolarHBondContact NE2-OE1 3.05Å
145	C	93	Very high	90.6	Very high	68 Å²	68	41.9 Å²	41.9	46%	0.459	24%	0.238	S	C	.	.	H	α-helix	trans	-57.1	-51	175.4	-70.4	0	0	0	0	111.5	L141 E142 L147 V148 E149	L141-C145 PolarHBondContact O-N 2.97Å; L141-C145 PolarHBondContact O-SG 3.16Å; L141-C145 VanDerWaalsContact O-SG 3.34Å; E142-C145 PolarHBondContact O-N 3.48Å; C145-L147 VanDerWaalsContact C-N 3.32Å; C145-L147 PolarHBondContact O-N 3.33Å; C145-V148 PolarHBondContact O-N 3.39Å; C145-E149 WeakPolarHBondContact O-CG 3.29Å; C145-E149 PolarHBondContact O-N 2.96Å
146	N	91.3	Very high	90.3	Very high	30 Å²	30	44.1 Å²	44.1	16%	0.16	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-43.1	177.7	-70.8	-3.6	0	0	0	111.7	T127 T131 M134 E142 H144 V148 E149 L150	T127-N146 HydrophobicContact CG2-CB 4.04Å; T131-N146 HydrophobicContact CG2-CB 4.25Å; T131-N146 WeakPolarHBondContact OG1-CB 3.45Å; T131-N146 PolarHBondContact OG1-ND2 2.94Å; T131-N146 VanDerWaalsContact OG1-ND2 3.16Å; M134-N146 PolarHBondContact SD-ND2 2.88Å; E142-N146 PolarHBondContact O-N 3.34Å; E142-N146 VanDerWaalsContact O-N 3.07Å; H144-N146 PolarHBondContact O-N 3.4Å; N146-V148 PolarHBondContact O-N 2.85Å; N146-E149 PolarHBondContact O-N 3.35Å; N146-L150 VanDerWaalsContact O-CG 3.31Å; N146-L150 WeakPolarHBondContact O-CG 3.13Å; N146-L150 PolarHBondContact O-N 2.63Å
147	L	91.9	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.9	-45.5	177.5	179	67.1	0	0	0	111.3	A143 H144 C145 L150 E151 L185 A186 L189	A143-L147 WeakPolarHBondContact O-CB 3.26Å; A143-L147 PolarHBondContact O-N 3.34Å; H144-L147 PolarHBondContact O-N 3.18Å; C145-L147 VanDerWaalsContact C-N 3.32Å; C145-L147 PolarHBondContact O-N 3.33Å; L147-L150 PolarHBondContact O-N 2.81Å; L147-E151 HydrophobicContact CD1-CG 4.28Å; L147-E151 HydrophobicContact CG-CG 4.37Å; L147-E151 WeakPolarHBondContact O-CB 3.34Å; L147-E151 WeakPolarHBondContact O-CG 3.31Å; L147-E151 PolarHBondContact O-N 3.12Å; L147-L185 HydrophobicContact CD1-CB 4.35Å; L147-L185 HydrophobicContact CD1-CD2 3.98Å; L147-L185 HydrophobicContact CD1-CG 4.19Å; L147-A186 HydrophobicContact CD1-CB 4.2Å; L147-A186 HydrophobicContact CD2-CB 3.81Å; L147-L189 HydrophobicContact CD2-CD2 3.7Å
148	V	91.4	Very high	89.8	Confident	27 Å²	27	38.1 Å²	38.1	16%	0.164	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-39.9	179.2	169.6	0	0	0	0	111.3	H144 C145 N146 E151 N152 I227	H144-V148 VanDerWaalsContact CE1-CG2 3.42Å; H144-V148 WeakPolarHBondContact CE1-CG2 3.38Å; H144-V148 WeakPolarHBondContact NE2-CG2 3.43Å; H144-V148 WeakPolarHBondContact O-CB 3.39Å; H144-V148 WeakPolarHBondContact O-CG2 3.33Å; H144-V148 PolarHBondContact O-N 3.49Å; C145-V148 PolarHBondContact O-N 3.39Å; N146-V148 PolarHBondContact O-N 2.85Å; V148-E151 PolarHBondContact O-N 3.48Å; V148-N152 WeakPolarHBondContact CG1-ND2 3.32Å; V148-N152 VanDerWaalsContact O-CB 3.26Å; V148-N152 WeakPolarHBondContact O-CB 3.31Å; V148-N152 PolarHBondContact O-N 3.43Å; V148-N152 PolarHBondContact O-ND2 2.8Å; V148-I227 HydrophobicContact CG1-CD1 4.48Å; V148-I227 HydrophobicContact CG2-CD1 3.86Å
149	E	90	Very high	89.6	Confident	124 Å²	124	36.9 Å²	36.9	58%	0.579	19%	0.186	S	C	*	.	H	α-helix	trans	-60.5	-45.1	174.5	-73.9	179.4	-169.7	0	0	111.7	C145 N146 N152 A153	C145-E149 WeakPolarHBondContact O-CG 3.29Å; C145-E149 PolarHBondContact O-N 2.96Å; N146-E149 PolarHBondContact O-N 3.35Å; E149-N152 PolarHBondContact O-N 3.49Å; E149-A153 WeakPolarHBondContact O-CB 3.45Å; E149-A153 PolarHBondContact O-N 3.29Å
150	L	89.9	Confident	89.2	Confident	3 Å²	3	32.9 Å²	32.9	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-68.1	-39.7	176.8	-66.8	175.4	0	0	0	112.5	A120 I124 T127 V128 N146 L147 A153 R154 L182	A120-L150 HydrophobicContact CB-CD2 4.35Å; I124-L150 HydrophobicContact CG1-CD2 4.28Å; T127-L150 HydrophobicContact CG2-CD1 3.8Å; T127-L150 HydrophobicContact CG2-CD2 4.3Å; T127-L150 HydrophobicContact CG2-CG 4.15Å; V128-L150 HydrophobicContact CG2-CD1 3.96Å; N146-L150 VanDerWaalsContact O-CG 3.31Å; N146-L150 WeakPolarHBondContact O-CG 3.13Å; N146-L150 PolarHBondContact O-N 2.63Å; L147-L150 PolarHBondContact O-N 2.81Å; L150-A153 PolarHBondContact O-N 2.9Å; L150-R154 WeakPolarHBondContact O-CB 3.46Å; L150-R154 PolarHBondContact O-N 3.49Å; L150-L182 HydrophobicContact CB-CD1 3.96Å; L150-L182 HydrophobicContact CB-CD2 3.66Å; L150-L182 HydrophobicContact CB-CG 4.49Å; L150-L182 HydrophobicContact CD1-CD2 3.61Å; L150-L182 HydrophobicContact CG-CD2 4.22Å
151	E	90.1	Very high	88.6	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.019	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-42.7	174.7	-77.2	-175.8	179.7	0	0	111.6	L147 V148 R154 D155 R245 R247	L147-E151 HydrophobicContact CD1-CG 4.28Å; L147-E151 HydrophobicContact CG-CG 4.37Å; L147-E151 WeakPolarHBondContact O-CB 3.34Å; L147-E151 WeakPolarHBondContact O-CG 3.31Å; L147-E151 PolarHBondContact O-N 3.12Å; V148-E151 PolarHBondContact O-N 3.48Å; E151-R154 WeakPolarHBondContact O-CB 3.44Å; E151-R154 PolarHBondContact O-N 3.35Å; E151-D155 VanDerWaalsContact O-CB 3.29Å; E151-D155 WeakPolarHBondContact O-CB 3.11Å; E151-D155 PolarHBondContact O-N 2.92Å; E151-R245 IonicContact OE2-CZ 3.38Å; E151-R245 IonicContact OE2-NH2 2.75Å; E151-R245 PolarHBondContact OE2-NH2 2.83Å; E151-R247 IonicContact OE1-CZ 2.94Å; E151-R247 IonicContact OE1-NH1 3.4Å; E151-R247 IonicContact OE1-NH2 2.6Å; E151-R247 PolarHBondContact OE1-NH2 3.36Å; E151-R247 IonicContact OE2-CZ 2.66Å; E151-R247 IonicContact OE2-NH1 2.81Å; E151-R247 IonicContact OE2-NH2 2.98Å
152	N	89.2	Confident	88.2	Confident	82 Å²	82	33 Å²	33	44%	0.439	17%	0.17	S	C	.	.	H	α-helix	trans	-62.8	-43.2	175.5	-74.5	-26.5	0	0	0	111.3	V148 E149 D155 N156	V148-N152 WeakPolarHBondContact CG1-ND2 3.32Å; V148-N152 VanDerWaalsContact O-CB 3.26Å; V148-N152 WeakPolarHBondContact O-CB 3.31Å; V148-N152 PolarHBondContact O-N 3.43Å; V148-N152 PolarHBondContact O-ND2 2.8Å; E149-N152 PolarHBondContact O-N 3.49Å; N152-D155 PolarHBondContact O-N 2.87Å; N152-N156 WeakPolarHBondContact O-CB 3.25Å; N152-N156 PolarHBondContact O-N 3.49Å; N152-N156 PolarHBondContact O-ND2 3.4Å; N152-N156 VanDerWaalsContact O-ND2 3.14Å
153	A	87.5	Confident	87.6	Confident	2 Å²	2	33.2 Å²	33.2	2%	0.017	17%	0.17	C	C	.	.	H	α-helix	trans	-61.1	-47.1	175.7	0	0	0	0	0	111.5	N117 A120 E149 L150 V157	N117-A153 HydrophobicContact CB-CB 4.08Å; N117-A153 WeakPolarHBondContact OD1-CA 3.33Å; A120-A153 HydrophobicContact CB-CB 3.69Å; E149-A153 WeakPolarHBondContact O-CB 3.45Å; E149-A153 PolarHBondContact O-N 3.29Å; L150-A153 PolarHBondContact O-N 2.9Å; A153-V157 WeakPolarHBondContact O-CG2 3.41Å; A153-V157 PolarHBondContact O-N 3.23Å; A153-V157 VanDerWaalsContact O-N 3.13Å
154	R	87.4	Confident	86.7	Confident	8 Å²	8	33.9 Å²	33.9	3%	0.03	17%	0.174	C	C	.	.	H	α-helix	trans	-56.1	-52.6	173	176.3	-163.5	73.5	-154	-7.8	110.8	L150 E151 N156 V157 M158 F179 L182	L150-R154 WeakPolarHBondContact O-CB 3.46Å; L150-R154 PolarHBondContact O-N 3.49Å; E151-R154 WeakPolarHBondContact O-CB 3.44Å; E151-R154 PolarHBondContact O-N 3.35Å; R154-N156 VanDerWaalsContact C-N 3.32Å; R154-N156 PolarHBondContact O-N 2.88Å; R154-V157 PolarHBondContact O-N 3.35Å; R154-M158 HydrophobicContact CG-CG 3.97Å; R154-M158 VanDerWaalsContact O-CB 3.28Å; R154-M158 WeakPolarHBondContact O-CB 3.25Å; R154-M158 WeakPolarHBondContact O-CG 3.37Å; R154-M158 PolarHBondContact O-N 2.88Å; R154-F179 HydrophobicContact CB-CB 4.48Å; R154-F179 HydrophobicContact CB-CD1 3.86Å; R154-F179 HydrophobicContact CB-CD2 4.03Å; R154-F179 HydrophobicContact CB-CE1 3.98Å; R154-F179 HydrophobicContact CB-CE2 4.15Å; R154-F179 HydrophobicContact CB-CG 3.88Å; R154-F179 HydrophobicContact CB-CZ 4.13Å; R154-F179 HydrophobicContact CG-CB 3.89Å; R154-F179 HydrophobicContact CG-CD1 4.13Å; R154-F179 HydrophobicContact CG-CD2 3.57Å; R154-F179 HydrophobicContact CG-CE2 4.07Å; R154-F179 HydrophobicContact CG-CG 3.61Å; R154-L182 HydrophobicContact CB-CD1 4.22Å
155	D	87.2	Confident	85.3	Confident	19 Å²	19	41.4 Å²	41.4	10%	0.102	21%	0.206	C	C	.	.	H	α-helix	trans	-66.8	-35.4	-171.9	-68.8	-12.1	0	0	0	111.7	E151 N152 F159 P242	E151-D155 VanDerWaalsContact O-CB 3.29Å; E151-D155 WeakPolarHBondContact O-CB 3.11Å; E151-D155 PolarHBondContact O-N 2.92Å; N152-D155 PolarHBondContact O-N 2.87Å; D155-F159 WeakPolarHBondContact O-CB 3.4Å; D155-F159 PolarHBondContact O-N 3.08Å; D155-P242 HydrophobicContact CB-CG 4.39Å; D155-P242 WeakPolarHBondContact OD2-CB 3.37Å; D155-P242 WeakPolarHBondContact OD2-CG 3.39Å
156	N	86.2	Confident	83.5	Confident	53 Å²	53	42.5 Å²	42.5	28%	0.283	22%	0.22	S	C	.	.	H	α-helix	trans	-63.6	-48	172.5	-72.5	-26.5	0	0	0	111.8	T113 N152 R154 F159 E160	T113-N156 HydrophobicContact CG2-CB 4.01Å; N152-N156 WeakPolarHBondContact O-CB 3.25Å; N152-N156 PolarHBondContact O-N 3.49Å; N152-N156 PolarHBondContact O-ND2 3.4Å; N152-N156 VanDerWaalsContact O-ND2 3.14Å; R154-N156 VanDerWaalsContact C-N 3.32Å; R154-N156 PolarHBondContact O-N 2.88Å; N156-F159 PolarHBondContact O-N 3.2Å; N156-E160 PolarHBondContact O-N 3Å; N156-E160 VanDerWaalsContact O-N 3.15Å
157	V	84.2	Confident	81.8	Confident	21 Å²	21	46.9 Å²	46.9	13%	0.127	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-45.6	178	175.1	0	0	0	0	111	I121 A153 R154 F159 E160 V161 L175	I121-V157 HydrophobicContact CD1-CG2 3.88Å; A153-V157 WeakPolarHBondContact O-CG2 3.41Å; A153-V157 PolarHBondContact O-N 3.23Å; A153-V157 VanDerWaalsContact O-N 3.13Å; R154-V157 PolarHBondContact O-N 3.35Å; V157-F159 VanDerWaalsContact C-N 3.27Å; V157-F159 PolarHBondContact O-N 3.33Å; V157-E160 PolarHBondContact O-N 3.24Å; V157-V161 PolarHBondContact O-N 3.04Å; V157-L175 HydrophobicContact CG1-CD1 3.95Å; V157-L175 HydrophobicContact CG1-CD2 4Å
158	M	84.2	Confident	80.4	Confident	16 Å²	16	47.7 Å²	47.7	8%	0.079	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-36.5	177.3	-73.2	-67.3	-75.1	0	0	111.8	R154 V161 F162 Q172 L175 F240	R154-M158 HydrophobicContact CG-CG 3.97Å; R154-M158 VanDerWaalsContact O-CB 3.28Å; R154-M158 WeakPolarHBondContact O-CB 3.25Å; R154-M158 WeakPolarHBondContact O-CG 3.37Å; R154-M158 PolarHBondContact O-N 2.88Å; M158-V161 PolarHBondContact O-N 2.95Å; M158-F162 VanDerWaalsContact O-CB 3.29Å; M158-F162 WeakPolarHBondContact O-CB 3.26Å; M158-F162 PolarHBondContact O-N 3.45Å; M158-Q172 HydrophobicContact CE-CB 4.21Å; M158-Q172 HydrophobicContact CE-CG 4.13Å; M158-L175 HydrophobicContact SD-CB 3.35Å; M158-L175 WeakPolarHBondContact SD-CB 3.23Å; M158-L175 HydrophobicContact SD-CD1 3.61Å; M158-L175 HydrophobicContact SD-CG 4.13Å; M158-F240 HydrophobicContact CB-CE2 4.38Å; M158-F240 HydrophobicContact CB-CZ 3.95Å
159	F	84.7	Confident	79.3	Confident	25 Å²	25	52.4 Å²	52.4	11%	0.11	27%	0.27	C	S	.	.	H	α-helix	trans	-66.1	-41.6	175.9	-177.2	-119.2	0	0	0	112.2	D155 N156 V157 V161 F162 K163 R234 T238 F240	D155-F159 WeakPolarHBondContact O-CB 3.4Å; D155-F159 PolarHBondContact O-N 3.08Å; N156-F159 PolarHBondContact O-N 3.2Å; V157-F159 VanDerWaalsContact C-N 3.27Å; V157-F159 PolarHBondContact O-N 3.33Å; F159-V161 VanDerWaalsContact C-N 3.32Å; F159-V161 PolarHBondContact O-N 3.42Å; F159-F162 WeakPolarHBondContact O-CB 3.43Å; F159-F162 PolarHBondContact O-N 3.38Å; F159-K163 HydrophobicContact CE1-CD 4.44Å; F159-K163 WeakPolarHBondContact O-CG 3.34Å; F159-K163 PolarHBondContact O-N 2.72Å; F159-R234 VanDerWaalsContact CD1-NH2 3.29Å; F159-T238 HydrophobicContact CE2-CG2 4.05Å; F159-T238 HydrophobicContact CZ-CG2 3.84Å; F159-F240 HydrophobicContact CB-CD1 4.25Å; F159-F240 HydrophobicContact CB-CE1 4.1Å; F159-F240 HydrophobicContact CB-CZ 4.43Å; F159-F240 HydrophobicContact CD2-CB 3.71Å; F159-F240 AromaticContact CD2-CD1 3.65Å; F159-F240 HydrophobicContact CD2-CD1 3.65Å; F159-F240 HydrophobicContact CD2-CD2 4.37Å; F159-F240 HydrophobicContact CD2-CE1 4.35Å; F159-F240 AromaticContact CD2-CG 3.65Å; F159-F240 HydrophobicContact CD2-CG 3.65Å; F159-F240 HydrophobicContact CE2-CB 3.86Å; F159-F240 HydrophobicContact CE2-CD1 4.47Å; F159-F240 HydrophobicContact CE2-CG 4.32Å; F159-F240 HydrophobicContact CG-CD1 4.36Å
160	E	82.2	Confident	78.6	Confident	23 Å²	23	54.7 Å²	54.7	11%	0.107	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-34.5	175.4	-66.8	-52.1	135.9	0	0	112.6	Q110 T113 N156 V157 K163 T164	Q110-E160 HydrophobicContact CG-CB 4.32Å; T113-E160 HydrophobicContact CG2-CG 3.85Å; N156-E160 PolarHBondContact O-N 3Å; N156-E160 VanDerWaalsContact O-N 3.15Å; V157-E160 PolarHBondContact O-N 3.24Å; E160-K163 VanDerWaalsContact CD-NZ 3.31Å; E160-K163 IonicContact OE1-NZ 3.2Å; E160-K163 PolarHBondContact OE1-NZ 2.79Å; E160-K163 WeakPolarHBondContact OE2-CD 3.48Å; E160-K163 IonicContact OE2-NZ 3.89Å; E160-K163 PolarHBondContact OE2-NZ 2.89Å; E160-T164 PolarHBondContact O-OG1 2.75Å
161	V	79.9	Confident	77.8	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-71.8	-37.3	172.7	174.6	0	0	0	0	111.8	V157 M158 F159 K163 T164 D171 Q172 L175	V157-V161 PolarHBondContact O-N 3.04Å; M158-V161 PolarHBondContact O-N 2.95Å; F159-V161 VanDerWaalsContact C-N 3.32Å; F159-V161 PolarHBondContact O-N 3.42Å; V161-K163 VanDerWaalsContact C-N 3.29Å; V161-K163 PolarHBondContact O-N 2.8Å; V161-T164 VanDerWaalsContact C-OG1 3.31Å; V161-T164 WeakPolarHBondContact CA-OG1 3.32Å; V161-T164 PolarHBondContact O-N 3.29Å; V161-T164 VanDerWaalsContact O-N 3.12Å; V161-T164 PolarHBondContact O-OG1 2.81Å; V161-D171 HydrophobicContact CG1-CB 3.88Å; V161-Q172 HydrophobicContact CG1-CG 4.14Å; V161-L175 HydrophobicContact CB-CD1 4.18Å; V161-L175 HydrophobicContact CG1-CD1 4.45Å; V161-L175 HydrophobicContact CG2-CD1 3.61Å
162	F	81.6	Confident	77	Confident	65 Å²	65	59.9 Å²	59.9	29%	0.285	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-39	174.7	177.7	-100.7	0	0	0	111.8	M158 F159 T164 K165 F240	M158-F162 VanDerWaalsContact O-CB 3.29Å; M158-F162 WeakPolarHBondContact O-CB 3.26Å; M158-F162 PolarHBondContact O-N 3.45Å; F159-F162 WeakPolarHBondContact O-CB 3.43Å; F159-F162 PolarHBondContact O-N 3.38Å; F162-T164 PolarHBondContact O-N 3.07Å; F162-K165 PolarHBondContact O-N 2.89Å; F162-F240 HydrophobicContact CB-CD2 3.83Å; F162-F240 HydrophobicContact CB-CE2 4.13Å; F162-F240 HydrophobicContact CD1-CB 3.86Å; F162-F240 AromaticContact CD1-CD2 3.92Å; F162-F240 HydrophobicContact CD1-CD2 3.92Å; F162-F240 HydrophobicContact CD1-CG 4.27Å; F162-F240 AromaticContact CD2-CD2 3.97Å; F162-F240 HydrophobicContact CD2-CD2 3.97Å; F162-F240 HydrophobicContact CE1-CB 3.86Å; F162-F240 HydrophobicContact CE1-CD2 4.47Å; F162-F240 HydrophobicContact CG-CB 4.45Å; F162-F240 AromaticContact CG-CD2 3.63Å; F162-F240 HydrophobicContact CG-CD2 3.63Å; F162-F240 HydrophobicContact CG-CE2 4.36Å; F162-F240 HydrophobicContact CG-CG 4.42Å; F162-F240 HydrophobicContact CZ-CB 4.46Å
163	K	79.4	Confident	76.6	Confident	95 Å²	95	62.6 Å²	62.6	41%	0.413	31%	0.308	S	S	.	.	H	α-helix	trans	-60	-28	175.4	-72.7	175.6	-171.9	169.3	0	113.4	F159 E160 V161 K165	F159-K163 HydrophobicContact CE1-CD 4.44Å; F159-K163 WeakPolarHBondContact O-CG 3.34Å; F159-K163 PolarHBondContact O-N 2.72Å; E160-K163 VanDerWaalsContact CD-NZ 3.31Å; E160-K163 IonicContact OE1-NZ 3.2Å; E160-K163 PolarHBondContact OE1-NZ 2.79Å; E160-K163 WeakPolarHBondContact OE2-CD 3.48Å; E160-K163 IonicContact OE2-NZ 3.89Å; E160-K163 PolarHBondContact OE2-NZ 2.89Å; V161-K163 VanDerWaalsContact C-N 3.29Å; V161-K163 PolarHBondContact O-N 2.8Å; K163-K165 VanDerWaalsContact C-N 3.31Å; K163-K165 PolarHBondContact O-N 3.1Å
164	T	74	Confident	76.3	Confident	13 Å²	13	66.1 Å²	66.1	8%	0.08	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-19.3	-176.2	11.3	0	0	0	0	114.7	R106 Q110 E160 V161 F162 A166	R106-T164 HydrophobicContact CG-CG2 4.49Å; R106-T164 VanDerWaalsContact CZ-CG2 3.45Å; Q110-T164 VanDerWaalsContact NE2-CG2 3.27Å; E160-T164 PolarHBondContact O-OG1 2.75Å; V161-T164 VanDerWaalsContact C-OG1 3.31Å; V161-T164 WeakPolarHBondContact CA-OG1 3.32Å; V161-T164 PolarHBondContact O-N 3.29Å; V161-T164 VanDerWaalsContact O-N 3.12Å; V161-T164 PolarHBondContact O-OG1 2.81Å; F162-T164 PolarHBondContact O-N 3.07Å; T164-A166 PolarHBondContact O-N 3.23Å
165	K	66.1	Low	75.9	Confident	173 Å²	173	67.2 Å²	67.2	75%	0.752	33%	0.332	S	S	*	.			trans	49.3	-20.6	174.9	-66.9	-172.2	179	-175.7	0	118.9	F162 K163	F162-K165 PolarHBondContact O-N 2.89Å; K163-K165 VanDerWaalsContact C-N 3.31Å; K163-K165 PolarHBondContact O-N 3.1Å
166	A	54.6	Low	75.6	Confident	90 Å²	90	67.6 Å²	67.6	74%	0.744	34%	0.341	S	S	*	.	S	Bend	trans	-110.7	-17.1	-166.3	0	0	0	0	0	114	T164	T164-A166 PolarHBondContact O-N 3.23Å
167	E	56.7	Low	75.4	Confident	122 Å²	122	70 Å²	70	57%	0.57	35%	0.353	S	S	*	.	S	Bend	trans	-121.6	9.7	-179.6	-68.6	166.4	166.1	0	0	111.1	D169	E167-D169 PolarHBondContact O-N 2.77Å
168	S	61.5	Low	75.4	Confident	18 Å²	18	74 Å²	74	13%	0.126	37%	0.367	C	S	.	.	H	α-helix	trans	-69.5	-36.2	-155.2	60.2	0	0	0	0	115.8	Q172	S168-Q172 WeakPolarHBondContact O-CA 3.45Å; S168-Q172 WeakPolarHBondContact O-CB 3.39Å; S168-Q172 WeakPolarHBondContact O-CG 3.46Å; S168-Q172 PolarHBondContact O-N 2.86Å
169	D	68.9	Low	75.4	Confident	126 Å²	126	73.4 Å²	73.4	67%	0.674	36%	0.364	S	S	*	.	H	α-helix	trans	-76.1	-37.8	-162.8	-65.7	4.4	0	0	0	112.4	E167 K173	E167-D169 PolarHBondContact O-N 2.77Å; D169-K173 VanDerWaalsContact O-CB 3.28Å; D169-K173 WeakPolarHBondContact O-CB 3.31Å; D169-K173 PolarHBondContact O-N 3.26Å; D169-K173 VanDerWaalsContact O-N 3.09Å
170	Y	75.1	Confident	75.4	Confident	172 Å²	172	74.3 Å²	74.3	68%	0.675	37%	0.373	S	S	*	.	H	α-helix	trans	-70.6	-45.2	175.4	-177.4	-107.8	0	0	0	111	K173 I174	Y170-K173 PolarHBondContact O-N 3.49Å; Y170-I174 HydrophobicContact CD1-CD1 3.59Å; Y170-I174 HydrophobicContact CD1-CG1 4.46Å; Y170-I174 HydrophobicContact CE1-CD1 3.12Å; Y170-I174 HydrophobicContact CE1-CG1 4.17Å; Y170-I174 HydrophobicContact CE2-CD1 4.23Å; Y170-I174 HydrophobicContact CG-CD1 4.34Å; Y170-I174 VanDerWaalsContact CZ-CD1 3.48Å; Y170-I174 WeakPolarHBondContact O-CG1 3.33Å; Y170-I174 PolarHBondContact O-N 3.49Å
171	D	73.2	Confident	75.6	Confident	57 Å²	57	76.3 Å²	76.3	31%	0.305	38%	0.383	S	S	.	.	H	α-helix	trans	-68.1	-40.2	-179.7	-68	-15.8	0	0	0	112.1	V161 K173 I174 L175	V161-D171 HydrophobicContact CG1-CB 3.88Å; D171-K173 VanDerWaalsContact C-N 3.28Å; D171-K173 PolarHBondContact O-N 3.07Å; D171-I174 PolarHBondContact O-N 3.23Å; D171-L175 WeakPolarHBondContact O-CB 3.27Å; D171-L175 VanDerWaalsContact O-CG 3.3Å; D171-L175 WeakPolarHBondContact O-CG 3.41Å; D171-L175 PolarHBondContact O-N 3.4Å
172	Q	74.3	Confident	76	Confident	58 Å²	58	75.4 Å²	75.4	27%	0.271	38%	0.377	S	S	.	.	H	α-helix	trans	-63.6	-35.8	172.8	-76.3	175.6	4.7	0	0	111.4	M158 V161 S168 G176	M158-Q172 HydrophobicContact CE-CB 4.21Å; M158-Q172 HydrophobicContact CE-CG 4.13Å; V161-Q172 HydrophobicContact CG1-CG 4.14Å; S168-Q172 WeakPolarHBondContact O-CA 3.45Å; S168-Q172 WeakPolarHBondContact O-CB 3.39Å; S168-Q172 WeakPolarHBondContact O-CG 3.46Å; S168-Q172 PolarHBondContact O-N 2.86Å; Q172-G176 WeakPolarHBondContact O-CA 3.33Å; Q172-G176 PolarHBondContact O-N 3.16Å
173	K	80.2	Confident	76.4	Confident	139 Å²	139	73.8 Å²	73.8	60%	0.604	37%	0.37	S	S	*	.	H	α-helix	trans	-69.3	-44.6	175.4	-171	176.7	179.8	179.9	0	111.5	D169 Y170 D171 L175 G176 D177	D169-K173 VanDerWaalsContact O-CB 3.28Å; D169-K173 WeakPolarHBondContact O-CB 3.31Å; D169-K173 PolarHBondContact O-N 3.26Å; D169-K173 VanDerWaalsContact O-N 3.09Å; Y170-K173 PolarHBondContact O-N 3.49Å; D171-K173 VanDerWaalsContact C-N 3.28Å; D171-K173 PolarHBondContact O-N 3.07Å; K173-L175 VanDerWaalsContact C-N 3.34Å; K173-L175 PolarHBondContact O-N 2.9Å; K173-G176 PolarHBondContact O-N 3.29Å; K173-D177 WeakPolarHBondContact O-CB 3.42Å; K173-D177 VanDerWaalsContact O-CG 3.26Å; K173-D177 PolarHBondContact O-N 3.3Å
174	I	81.8	Confident	76.9	Confident	77 Å²	77	74.7 Å²	74.7	40%	0.395	37%	0.374	S	S	.	.	H	α-helix	trans	-58.7	-47.8	175	-71	169.5	0	0	0	110.7	Y170 D171 G176 D177 Y178	Y170-I174 HydrophobicContact CD1-CD1 3.59Å; Y170-I174 HydrophobicContact CD1-CG1 4.46Å; Y170-I174 HydrophobicContact CE1-CD1 3.12Å; Y170-I174 HydrophobicContact CE1-CG1 4.17Å; Y170-I174 HydrophobicContact CE2-CD1 4.23Å; Y170-I174 HydrophobicContact CG-CD1 4.34Å; Y170-I174 VanDerWaalsContact CZ-CD1 3.48Å; Y170-I174 WeakPolarHBondContact O-CG1 3.33Å; Y170-I174 PolarHBondContact O-N 3.49Å; D171-I174 PolarHBondContact O-N 3.23Å; I174-G176 VanDerWaalsContact C-N 3.34Å; I174-D177 PolarHBondContact O-N 2.9Å; I174-Y178 WeakPolarHBondContact O-CB 3.42Å; I174-Y178 PolarHBondContact O-N 3.42Å
175	L	78.8	Confident	77.7	Confident	31 Å²	31	74 Å²	74	16%	0.162	37%	0.37	C	S	.	.	H	α-helix	trans	-65.8	-39.3	178.2	-70.2	173.3	0	0	0	111.2	V157 M158 V161 D171 K173 D177 Y178 F179	V157-L175 HydrophobicContact CG1-CD1 3.95Å; V157-L175 HydrophobicContact CG1-CD2 4Å; M158-L175 HydrophobicContact SD-CB 3.35Å; M158-L175 WeakPolarHBondContact SD-CB 3.23Å; M158-L175 HydrophobicContact SD-CD1 3.61Å; M158-L175 HydrophobicContact SD-CG 4.13Å; V161-L175 HydrophobicContact CB-CD1 4.18Å; V161-L175 HydrophobicContact CG1-CD1 4.45Å; V161-L175 HydrophobicContact CG2-CD1 3.61Å; D171-L175 WeakPolarHBondContact O-CB 3.27Å; D171-L175 VanDerWaalsContact O-CG 3.3Å; D171-L175 WeakPolarHBondContact O-CG 3.41Å; D171-L175 PolarHBondContact O-N 3.4Å; K173-L175 VanDerWaalsContact C-N 3.34Å; K173-L175 PolarHBondContact O-N 2.9Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 3.47Å; L175-Y178 PolarHBondContact O-N 3.5Å; L175-F179 HydrophobicContact CB-CD2 4.46Å; L175-F179 HydrophobicContact CD2-CE2 4.1Å; L175-F179 WeakPolarHBondContact O-CB 3.43Å; L175-F179 WeakPolarHBondContact O-CD2 3.36Å; L175-F179 PolarHBondContact O-N 3.01Å
176	G	79.6	Confident	79	Confident	27 Å²	27	66 Å²	66	28%	0.278	34%	0.336	S	S	.	.	H	α-helix	trans	-59.3	-42.8	173.8	0	0	0	0	0	112.5	Q172 K173 I174 S180	Q172-G176 WeakPolarHBondContact O-CA 3.33Å; Q172-G176 PolarHBondContact O-N 3.16Å; K173-G176 PolarHBondContact O-N 3.29Å; I174-G176 VanDerWaalsContact C-N 3.34Å; G176-S180 WeakPolarHBondContact O-CA 3.32Å; G176-S180 WeakPolarHBondContact O-CB 3.49Å; G176-S180 PolarHBondContact O-N 2.61Å
177	D	82.6	Confident	80.8	Confident	102 Å²	102	65.2 Å²	65.2	55%	0.545	32%	0.319	S	S	.	.	H	α-helix	trans	-69.7	-41.6	176.7	-70	-17.8	0	0	0	111.2	K173 I174 L175 S180	K173-D177 WeakPolarHBondContact O-CB 3.42Å; K173-D177 VanDerWaalsContact O-CG 3.26Å; K173-D177 PolarHBondContact O-N 3.3Å; I174-D177 PolarHBondContact O-N 2.9Å; L175-D177 VanDerWaalsContact C-N 3.33Å; L175-D177 PolarHBondContact O-N 3.47Å; D177-S180 WeakPolarHBondContact O-CB 3.48Å; D177-S180 PolarHBondContact O-N 3.28Å; D177-S180 PolarHBondContact O-OG 2.92Å
178	Y	83.6	Confident	82.5	Confident	105 Å²	105	62 Å²	62	41%	0.412	30%	0.304	S	S	.	.	H	α-helix	trans	-62.2	-44.6	176.9	-175.6	-99.3	0	0	0	112.6	I121 I124 I174 L175 S180	I121-Y178 HydrophobicContact CG2-CE1 4.05Å; I121-Y178 PolarHBondContact O-OH 3.04Å; I124-Y178 HydrophobicContact CD1-CD1 4.36Å; I124-Y178 HydrophobicContact CD1-CE1 3.89Å; I124-Y178 HydrophobicContact CG2-CE1 4.33Å; I124-Y178 WeakPolarHBondContact CG2-OH 3.29Å; I174-Y178 WeakPolarHBondContact O-CB 3.42Å; I174-Y178 PolarHBondContact O-N 3.42Å; L175-Y178 PolarHBondContact O-N 3.5Å; Y178-S180 VanDerWaalsContact C-N 3.29Å; Y178-S180 PolarHBondContact O-N 3.27Å
179	F	84.9	Confident	84.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.018	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	9.8	178.6	-67.7	-71.1	0	0	0	113.2	I121 I124 R154 L175 E181 L182	I121-F179 HydrophobicContact CG1-CZ 4.38Å; I124-F179 HydrophobicContact CD1-CD1 3.52Å; I124-F179 HydrophobicContact CD1-CE1 3.66Å; R154-F179 HydrophobicContact CB-CB 4.48Å; R154-F179 HydrophobicContact CB-CD1 3.86Å; R154-F179 HydrophobicContact CB-CD2 4.03Å; R154-F179 HydrophobicContact CB-CE1 3.98Å; R154-F179 HydrophobicContact CB-CE2 4.15Å; R154-F179 HydrophobicContact CB-CG 3.88Å; R154-F179 HydrophobicContact CB-CZ 4.13Å; R154-F179 HydrophobicContact CG-CB 3.89Å; R154-F179 HydrophobicContact CG-CD1 4.13Å; R154-F179 HydrophobicContact CG-CD2 3.57Å; R154-F179 HydrophobicContact CG-CE2 4.07Å; R154-F179 HydrophobicContact CG-CG 3.61Å; L175-F179 HydrophobicContact CB-CD2 4.46Å; L175-F179 HydrophobicContact CD2-CE2 4.1Å; L175-F179 WeakPolarHBondContact O-CB 3.43Å; L175-F179 WeakPolarHBondContact O-CD2 3.36Å; L175-F179 PolarHBondContact O-N 3.01Å; F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 3.12Å; F179-L182 HydrophobicContact CB-CD1 4.1Å; F179-L182 HydrophobicContact CB-CG 4.4Å; F179-L182 HydrophobicContact CD1-CD1 3.58Å; F179-L182 HydrophobicContact CD1-CG 4.26Å; F179-L182 HydrophobicContact CE1-CD1 4.43Å; F179-L182 HydrophobicContact CG-CD1 4.24Å; F179-L182 VanDerWaalsContact O-CB 3.31Å; F179-L182 WeakPolarHBondContact O-CB 3.39Å; F179-L182 PolarHBondContact O-N 2.89Å
180	S	85.4	Confident	85.3	Confident	44 Å²	44	55.2 Å²	55.2	31%	0.308	27%	0.267	S	S	.	.	H	α-helix	trans	-60.4	-34.1	-175.4	63.6	0	0	0	0	113.2	G176 D177 Y178 L182 F183	G176-S180 WeakPolarHBondContact O-CA 3.32Å; G176-S180 WeakPolarHBondContact O-CB 3.49Å; G176-S180 PolarHBondContact O-N 2.61Å; D177-S180 WeakPolarHBondContact O-CB 3.48Å; D177-S180 PolarHBondContact O-N 3.28Å; D177-S180 PolarHBondContact O-OG 2.92Å; Y178-S180 VanDerWaalsContact C-N 3.29Å; Y178-S180 PolarHBondContact O-N 3.27Å; S180-L182 VanDerWaalsContact C-N 3.26Å; S180-L182 PolarHBondContact O-N 3.02Å; S180-F183 WeakPolarHBondContact O-CB 3.49Å; S180-F183 PolarHBondContact O-N 3.25Å; S180-F183 VanDerWaalsContact O-N 3.16Å
181	E	86.4	Confident	86.2	Confident	66 Å²	66	52.5 Å²	52.5	31%	0.308	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-29	176.1	-70.1	-57.3	133.2	0	0	112.9	F179 F183 K184 L185	F179-E181 VanDerWaalsContact C-N 3.25Å; F179-E181 PolarHBondContact O-N 3.12Å; E181-F183 VanDerWaalsContact C-N 3.25Å; E181-F183 PolarHBondContact O-N 3.01Å; E181-K184 PolarHBondContact O-N 3.32Å; E181-K184 IonicContact OE1-NZ 3.66Å; E181-K184 PolarHBondContact OE1-NZ 3.35Å; E181-K184 IonicContact OE2-NZ 2.68Å; E181-L185 WeakPolarHBondContact O-CB 3.38Å; E181-L185 PolarHBondContact O-N 2.85Å
182	L	88.3	Confident	87.2	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-34.3	175.6	-60.1	-173.5	0	0	0	111.9	V128 L150 R154 F179 S180 L185 A186	V128-L182 HydrophobicContact CG2-CD2 3.97Å; L150-L182 HydrophobicContact CB-CD1 3.96Å; L150-L182 HydrophobicContact CB-CD2 3.66Å; L150-L182 HydrophobicContact CB-CG 4.49Å; L150-L182 HydrophobicContact CD1-CD2 3.61Å; L150-L182 HydrophobicContact CG-CD2 4.22Å; R154-L182 HydrophobicContact CB-CD1 4.22Å; F179-L182 HydrophobicContact CB-CD1 4.1Å; F179-L182 HydrophobicContact CB-CG 4.4Å; F179-L182 HydrophobicContact CD1-CD1 3.58Å; F179-L182 HydrophobicContact CD1-CG 4.26Å; F179-L182 HydrophobicContact CE1-CD1 4.43Å; F179-L182 HydrophobicContact CG-CD1 4.24Å; F179-L182 VanDerWaalsContact O-CB 3.31Å; F179-L182 WeakPolarHBondContact O-CB 3.39Å; F179-L182 PolarHBondContact O-N 2.89Å; S180-L182 VanDerWaalsContact C-N 3.26Å; S180-L182 PolarHBondContact O-N 3.02Å; L182-L185 PolarHBondContact O-N 3.27Å; L182-A186 WeakPolarHBondContact O-CB 3.19Å; L182-A186 PolarHBondContact O-N 3.08Å
183	F	88.2	Confident	88.2	Confident	30 Å²	30	50 Å²	50	13%	0.132	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-39.7	177	-64.4	-58.9	0	0	0	111.8	S180 E181 L185 A186 D187 V243 K244	S180-F183 WeakPolarHBondContact O-CB 3.49Å; S180-F183 PolarHBondContact O-N 3.25Å; S180-F183 VanDerWaalsContact O-N 3.16Å; E181-F183 VanDerWaalsContact C-N 3.25Å; E181-F183 PolarHBondContact O-N 3.01Å; F183-L185 VanDerWaalsContact C-N 3.35Å; F183-A186 PolarHBondContact O-N 2.9Å; F183-D187 WeakPolarHBondContact O-CB 3.25Å; F183-D187 VanDerWaalsContact O-CG 3.25Å; F183-D187 PolarHBondContact O-N 2.82Å; F183-V243 HydrophobicContact CE1-CB 4.36Å; F183-V243 HydrophobicContact CE1-CG1 4.37Å; F183-V243 HydrophobicContact CZ-CB 3.97Å; F183-V243 HydrophobicContact CZ-CG1 3.97Å; F183-K244 HydrophobicContact CD1-CD 3.55Å; F183-K244 HydrophobicContact CD1-CG 3.99Å; F183-K244 HydrophobicContact CE1-CB 4.38Å; F183-K244 HydrophobicContact CE1-CD 3.98Å; F183-K244 HydrophobicContact CE1-CG 3.87Å; F183-K244 HydrophobicContact CG-CD 4.27Å
184	K	91	Very high	88.9	Confident	114 Å²	114	44 Å²	44	50%	0.496	22%	0.219	S	C	.	.	H	α-helix	trans	-66.2	-41.4	175.8	-63.2	177.9	-172.8	165.3	0	110.8	E181 D187 E188	E181-K184 PolarHBondContact O-N 3.32Å; E181-K184 IonicContact OE1-NZ 3.66Å; E181-K184 PolarHBondContact OE1-NZ 3.35Å; E181-K184 IonicContact OE2-NZ 2.68Å; K184-D187 PolarHBondContact O-N 3.09Å; K184-E188 WeakPolarHBondContact O-CB 3.3Å; K184-E188 PolarHBondContact O-N 3.31Å
185	L	91.6	Very high	89.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-44.6	176.5	-172.6	65.9	0	0	0	111.8	V128 T131 Y132 I135 L147 E181 L182 F183 E188 L189	V128-L185 HydrophobicContact CG2-CD2 4.27Å; T131-L185 HydrophobicContact CG2-CD1 3.85Å; T131-L185 HydrophobicContact CG2-CD2 3.73Å; T131-L185 HydrophobicContact CG2-CG 4.02Å; Y132-L185 HydrophobicContact CD1-CD1 3.63Å; Y132-L185 HydrophobicContact CD2-CD1 3.81Å; Y132-L185 HydrophobicContact CE1-CD1 3.61Å; Y132-L185 HydrophobicContact CE2-CD1 3.81Å; Y132-L185 HydrophobicContact CG-CD1 3.72Å; Y132-L185 PolarHBondContact OH-N 2.86Å; I135-L185 HydrophobicContact CD1-CD1 3.6Å; I135-L185 HydrophobicContact CD1-CG 4.32Å; L147-L185 HydrophobicContact CD1-CB 4.35Å; L147-L185 HydrophobicContact CD1-CD2 3.98Å; L147-L185 HydrophobicContact CD1-CG 4.19Å; E181-L185 WeakPolarHBondContact O-CB 3.38Å; E181-L185 PolarHBondContact O-N 2.85Å; L182-L185 PolarHBondContact O-N 3.27Å; F183-L185 VanDerWaalsContact C-N 3.35Å; L185-E188 PolarHBondContact O-N 3.45Å; L185-L189 PolarHBondContact O-N 2.84Å
186	A	91.6	Very high	90.2	Very high	4 Å²	4	46.5 Å²	46.5	3%	0.033	22%	0.224	C	C	.	.	H	α-helix	trans	-62.6	-42	174.4	0	0	0	0	0	112.4	L147 L182 F183 E188 L189 A190	L147-A186 HydrophobicContact CD1-CB 4.2Å; L147-A186 HydrophobicContact CD2-CB 3.81Å; L182-A186 WeakPolarHBondContact O-CB 3.19Å; L182-A186 PolarHBondContact O-N 3.08Å; F183-A186 PolarHBondContact O-N 2.9Å; A186-E188 VanDerWaalsContact C-N 3.32Å; A186-E188 PolarHBondContact O-N 3.25Å; A186-L189 PolarHBondContact O-N 2.87Å; A186-A190 VanDerWaalsContact O-CB 3.29Å; A186-A190 WeakPolarHBondContact O-CB 3.14Å; A186-A190 PolarHBondContact O-N 3.17Å
187	D	92.9	Very high	91	Very high	73 Å²	73	45.2 Å²	45.2	39%	0.39	21%	0.211	S	C	.	.	H	α-helix	trans	-64.6	-37.5	176.6	-73.5	-29.8	0	0	0	111.2	F183 K184 A190 K191 K244	F183-D187 WeakPolarHBondContact O-CB 3.25Å; F183-D187 VanDerWaalsContact O-CG 3.25Å; F183-D187 PolarHBondContact O-N 2.82Å; K184-D187 PolarHBondContact O-N 3.09Å; D187-A190 PolarHBondContact O-N 2.69Å; D187-K191 WeakPolarHBondContact O-CG 3.19Å; D187-K191 PolarHBondContact O-N 3.31Å; D187-K244 IonicContact OD2-NZ 2.65Å; D187-K244 PolarHBondContact OD2-NZ 2.93Å
188	E	93.2	Very high	91.5	Very high	54 Å²	54	41.4 Å²	41.4	25%	0.252	20%	0.196	S	C	.	.	H	α-helix	trans	-70.8	-42	176.9	-163	55.4	-142.5	0	0	112.5	Y132 I135 K184 L185 A186 A190 K191 Q192	Y132-E188 HydrophobicContact CE1-CB 4.19Å; Y132-E188 HydrophobicContact CE1-CG 4.33Å; I135-E188 HydrophobicContact CG2-CG 4.28Å; K184-E188 WeakPolarHBondContact O-CB 3.3Å; K184-E188 PolarHBondContact O-N 3.31Å; L185-E188 PolarHBondContact O-N 3.45Å; A186-E188 VanDerWaalsContact C-N 3.32Å; A186-E188 PolarHBondContact O-N 3.25Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.16Å; E188-K191 PolarHBondContact O-N 3.11Å; E188-K191 WeakPolarHBondContact OE2-CD 3.36Å; E188-K191 IonicContact OE2-NZ 3.66Å; E188-K191 PolarHBondContact OE2-NZ 3.24Å; E188-Q192 PolarHBondContact O-N 2.93Å; E188-Q192 VanDerWaalsContact O-N 3.14Å
189	L	94.2	Very high	92	Very high	1 Å²	1	42 Å²	42	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-46.8	171.5	179.9	66.6	0	0	0	110.6	I135 L140 A143 H144 L147 L185 A186 K191 Q192 V193 W249	I135-L189 HydrophobicContact CD1-CB 3.99Å; I135-L189 HydrophobicContact CG1-CB 4.45Å; I135-L189 HydrophobicContact CG1-CD1 4.12Å; L140-L189 HydrophobicContact CB-CD1 4.36Å; L140-L189 HydrophobicContact CD2-CD1 4.08Å; A143-L189 HydrophobicContact CB-CD1 4.12Å; H144-L189 HydrophobicContact CB-CD2 4.02Å; L147-L189 HydrophobicContact CD2-CD2 3.7Å; L185-L189 PolarHBondContact O-N 2.84Å; A186-L189 PolarHBondContact O-N 2.87Å; L189-K191 VanDerWaalsContact C-N 3.34Å; L189-K191 PolarHBondContact O-N 2.98Å; L189-Q192 PolarHBondContact O-N 3.42Å; L189-V193 HydrophobicContact CD1-CG2 4.44Å; L189-V193 HydrophobicContact CG-CG2 4.46Å; L189-V193 WeakPolarHBondContact O-CG2 3.38Å; L189-V193 PolarHBondContact O-N 3.42Å; L189-W249 HydrophobicContact CD2-CH2 4.43Å
190	A	94.2	Very high	92.4	Very high	2 Å²	2	41.8 Å²	41.8	2%	0.017	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-44.1	177.4	0	0	0	0	0	111.3	A186 D187 E188 Q192 V193 F194 W249	A186-A190 VanDerWaalsContact O-CB 3.29Å; A186-A190 WeakPolarHBondContact O-CB 3.14Å; A186-A190 PolarHBondContact O-N 3.17Å; D187-A190 PolarHBondContact O-N 2.69Å; E188-A190 VanDerWaalsContact C-N 3.33Å; E188-A190 PolarHBondContact O-N 3.16Å; A190-Q192 VanDerWaalsContact C-N 3.33Å; A190-Q192 PolarHBondContact O-N 3.22Å; A190-V193 PolarHBondContact O-N 2.93Å; A190-F194 HydrophobicContact CB-CD2 4.13Å; A190-F194 HydrophobicContact CB-CE2 4.06Å; A190-F194 WeakPolarHBondContact O-CB 3.5Å; A190-F194 WeakPolarHBondContact O-CD2 3.3Å; A190-F194 PolarHBondContact O-N 3.36Å; A190-W249 HydrophobicContact CB-CH2 4.36Å; A190-W249 HydrophobicContact CB-CZ2 3.91Å
191	K	94.6	Very high	92.7	Very high	115 Å²	115	39.7 Å²	39.7	50%	0.5	18%	0.182	S	C	.	.	H	α-helix	trans	-56.4	-45.8	175.7	-74.8	175.7	-153.4	159	0	111.9	D187 E188 L189 Y195	D187-K191 WeakPolarHBondContact O-CG 3.19Å; D187-K191 PolarHBondContact O-N 3.31Å; E188-K191 PolarHBondContact O-N 3.11Å; E188-K191 WeakPolarHBondContact OE2-CD 3.36Å; E188-K191 IonicContact OE2-NZ 3.66Å; E188-K191 PolarHBondContact OE2-NZ 3.24Å; L189-K191 VanDerWaalsContact C-N 3.34Å; L189-K191 PolarHBondContact O-N 2.98Å; K191-Y195 WeakPolarHBondContact O-CB 3.47Å; K191-Y195 PolarHBondContact O-N 3.46Å
192	Q	93.7	Very high	92.9	Very high	63 Å²	63	39.8 Å²	39.8	29%	0.294	18%	0.182	S	C	.	.	H	α-helix	trans	-66.2	-43.2	178.8	-64.9	-55.4	-33.5	0	0	112.3	I135 L140 E188 L189 A190 Y195 I196	I135-Q192 HydrophobicContact CG2-CB 4.4Å; I135-Q192 HydrophobicContact CG2-CG 3.53Å; L140-Q192 HydrophobicContact CD2-CB 3.98Å; E188-Q192 PolarHBondContact O-N 2.93Å; E188-Q192 VanDerWaalsContact O-N 3.14Å; L189-Q192 PolarHBondContact O-N 3.42Å; A190-Q192 VanDerWaalsContact C-N 3.33Å; A190-Q192 PolarHBondContact O-N 3.22Å; Q192-Y195 PolarHBondContact O-N 2.93Å; Q192-I196 WeakPolarHBondContact O-CG1 3.34Å; Q192-I196 PolarHBondContact O-N 3.47Å; Q192-I196 VanDerWaalsContact O-N 3.1Å
193	V	95.1	Very high	93	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-50.9	176.7	169.8	0	0	0	0	111	L140 L189 A190 Y195 I196 I197 A217 L220 V221 W249	L140-V193 HydrophobicContact CD1-CG2 4.21Å; L189-V193 HydrophobicContact CD1-CG2 4.44Å; L189-V193 HydrophobicContact CG-CG2 4.46Å; L189-V193 WeakPolarHBondContact O-CG2 3.38Å; L189-V193 PolarHBondContact O-N 3.42Å; A190-V193 PolarHBondContact O-N 2.93Å; V193-Y195 VanDerWaalsContact C-N 3.32Å; V193-Y195 PolarHBondContact O-N 3.06Å; V193-I196 PolarHBondContact O-N 3.5Å; V193-I197 HydrophobicContact CG1-CD1 3.9Å; V193-I197 WeakPolarHBondContact O-CG1 3.45Å; V193-I197 PolarHBondContact O-N 3.49Å; V193-A217 HydrophobicContact CG1-CB 4.11Å; V193-L220 HydrophobicContact CG2-CD1 3.77Å; V193-V221 HydrophobicContact CG1-CG2 4.16Å; V193-W249 HydrophobicContact CB-CZ3 4.46Å; V193-W249 HydrophobicContact CG1-CE3 4.43Å; V193-W249 HydrophobicContact CG1-CZ3 4.19Å; V193-W249 HydrophobicContact CG2-CZ3 4.26Å
194	F	96.3	Very high	93.2	Very high	12 Å²	12	40.1 Å²	40.1	5%	0.053	19%	0.188	C	C	.	.	H	α-helix	trans	-73.1	-23.9	-179.2	-67.4	-62.2	0	0	0	113	A190 I197 G198 W249 R252 C253 V256	A190-F194 HydrophobicContact CB-CD2 4.13Å; A190-F194 HydrophobicContact CB-CE2 4.06Å; A190-F194 WeakPolarHBondContact O-CB 3.5Å; A190-F194 WeakPolarHBondContact O-CD2 3.3Å; A190-F194 PolarHBondContact O-N 3.36Å; F194-I197 HydrophobicContact CD1-CD1 3.89Å; F194-I197 HydrophobicContact CE1-CD1 4.13Å; F194-G198 PolarHBondContact O-N 3.47Å; F194-W249 HydrophobicContact CE2-CD2 4.25Å; F194-W249 HydrophobicContact CE2-CG 4.42Å; F194-W249 HydrophobicContact CZ-CB 4.12Å; F194-W249 HydrophobicContact CZ-CD2 4.03Å; F194-W249 HydrophobicContact CZ-CE3 4.37Å; F194-W249 AromaticContact CZ-CG 3.91Å; F194-W249 HydrophobicContact CZ-CG 3.91Å; F194-R252 HydrophobicContact CD1-CG 4.09Å; F194-R252 HydrophobicContact CD2-CG 4.29Å; F194-R252 VanDerWaalsContact CD2-CZ 3.43Å; F194-R252 VanDerWaalsContact CD2-NE 3.29Å; F194-R252 HydrophobicContact CE1-CB 3.91Å; F194-R252 HydrophobicContact CE1-CG 3.68Å; F194-R252 HydrophobicContact CE2-CG 3.94Å; F194-R252 VanDerWaalsContact CE2-NE 3.34Å; F194-R252 HydrophobicContact CG-CG 4.4Å; F194-R252 HydrophobicContact CZ-CB 3.81Å; F194-R252 HydrophobicContact CZ-CG 3.62Å; F194-C253 HydrophobicContact CE1-CB 4.36Å; F194-V256 HydrophobicContact CB-CG2 4.21Å; F194-V256 HydrophobicContact CD1-CG2 4.02Å; F194-V256 HydrophobicContact CG-CG2 4.35Å
195	Y	94	Very high	93.1	Very high	130 Å²	130	39.1 Å²	39.1	51%	0.51	18%	0.182	S	C	.	.	H	α-helix	trans	-64.6	-42	168.9	173.4	-104.6	0	0	0	111.6	K191 Q192 V193 G198 R199	K191-Y195 WeakPolarHBondContact O-CB 3.47Å; K191-Y195 PolarHBondContact O-N 3.46Å; Q192-Y195 PolarHBondContact O-N 2.93Å; V193-Y195 VanDerWaalsContact C-N 3.32Å; V193-Y195 PolarHBondContact O-N 3.06Å; Y195-G198 PolarHBondContact O-N 3.25Å; Y195-R199 PolarHBondContact O-N 2.97Å; Y195-R199 PolarHBondContact OH-NH1 3.29Å
196	I	93.3	Very high	92.5	Very high	31 Å²	31	41 Å²	41	16%	0.159	20%	0.201	C	C	.	.	H	α-helix	trans	-65.3	-46.2	175	-65.8	167.9	0	0	0	110.6	L140 Q192 V193 G198 R199 R213 A217	L140-I196 HydrophobicContact CD1-CD1 3.43Å; L140-I196 VanDerWaalsContact CD1-CD1 3.43Å; Q192-I196 WeakPolarHBondContact O-CG1 3.34Å; Q192-I196 PolarHBondContact O-N 3.47Å; Q192-I196 VanDerWaalsContact O-N 3.1Å; V193-I196 PolarHBondContact O-N 3.5Å; I196-G198 VanDerWaalsContact C-N 3.31Å; I196-G198 PolarHBondContact O-N 3.47Å; I196-R199 CarbonylContact O-C 3.59Å; I196-R199 PolarHBondContact O-N 3.27Å; I196-R213 HydrophobicContact CG2-CB 4.41Å; I196-A217 HydrophobicContact CB-CB 4.21Å; I196-A217 HydrophobicContact CG2-CB 3.98Å
197	I	95.3	Very high	91.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.4	-40.7	177.6	-66.4	165.9	0	0	0	110.9	V193 F194 R199 T200 A217 V221 C253 V256 L257	V193-I197 HydrophobicContact CG1-CD1 3.9Å; V193-I197 WeakPolarHBondContact O-CG1 3.45Å; V193-I197 PolarHBondContact O-N 3.49Å; F194-I197 HydrophobicContact CD1-CD1 3.89Å; F194-I197 HydrophobicContact CE1-CD1 4.13Å; I197-R199 PolarHBondContact O-N 3.34Å; I197-R199 VanDerWaalsContact O-N 3.08Å; I197-T200 WeakPolarHBondContact O-CB 3.31Å; I197-T200 PolarHBondContact O-N 2.95Å; I197-T200 VanDerWaalsContact O-N 3.1Å; I197-T200 PolarHBondContact O-OG1 3.31Å; I197-A217 HydrophobicContact CG1-CB 4.2Å; I197-V221 HydrophobicContact CD1-CG2 3.76Å; I197-C253 HydrophobicContact CD1-CB 4.38Å; I197-V256 HydrophobicContact CB-CG1 4.44Å; I197-V256 HydrophobicContact CG2-CB 4.42Å; I197-V256 HydrophobicContact CG2-CG1 4.07Å; I197-L257 HydrophobicContact CG2-CD2 3.8Å; I197-L257 HydrophobicContact CG2-CG 3.99Å
198	G	94.2	Very high	90.8	Very high	22 Å²	22	48.6 Å²	48.6	23%	0.227	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.4	175.4	0	0	0	0	0	114.4	F194 Y195 I196 M260	F194-G198 PolarHBondContact O-N 3.47Å; Y195-G198 PolarHBondContact O-N 3.25Å; I196-G198 VanDerWaalsContact C-N 3.31Å; I196-G198 PolarHBondContact O-N 3.47Å; G198-M260 WeakPolarHBondContact O-CG 3.27Å
199	R	92.7	Very high	90.2	Very high	116 Å²	116	48.7 Å²	48.7	44%	0.438	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	28.2	176	-62.8	-172.1	67.1	179.4	-1.5	112.6	Y195 I196 I197 L201 E202 A203	Y195-R199 PolarHBondContact O-N 2.97Å; Y195-R199 PolarHBondContact OH-NH1 3.29Å; I196-R199 CarbonylContact O-C 3.59Å; I196-R199 PolarHBondContact O-N 3.27Å; I197-R199 PolarHBondContact O-N 3.34Å; I197-R199 VanDerWaalsContact O-N 3.08Å; R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.48Å; R199-E202 VanDerWaalsContact CA-OE2 3.24Å; R199-E202 WeakPolarHBondContact CA-OE2 3.3Å; R199-E202 HydrophobicContact CB-CB 4.49Å; R199-E202 PolarHBondContact O-N 2.96Å; R199-A203 VanDerWaalsContact O-CB 3.28Å; R199-A203 WeakPolarHBondContact O-CB 3.45Å; R199-A203 PolarHBondContact O-N 3.2Å
200	T	94.1	Very high	89.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-53	-45.6	-176.9	-72.3	0	0	0	0	112.4	I197 A203 V204 L214 L257 F306 F316	I197-T200 WeakPolarHBondContact O-CB 3.31Å; I197-T200 PolarHBondContact O-N 2.95Å; I197-T200 VanDerWaalsContact O-N 3.1Å; I197-T200 PolarHBondContact O-OG1 3.31Å; T200-A203 PolarHBondContact O-N 3.42Å; T200-V204 WeakPolarHBondContact O-CG2 3.34Å; T200-V204 PolarHBondContact O-N 2.93Å; T200-L214 HydrophobicContact CG2-CD1 4.49Å; T200-L214 HydrophobicContact CG2-CD2 3.88Å; T200-L257 HydrophobicContact CG2-CD2 4.43Å; T200-L257 WeakPolarHBondContact OG1-CD2 3.46Å; T200-F306 HydrophobicContact CG2-CE2 3.79Å; T200-F306 HydrophobicContact CG2-CZ 3.93Å; T200-F316 HydrophobicContact CG2-CZ 4.27Å
201	L	92.1	Very high	89.6	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-42.5	-178.5	-65.1	176.6	0	0	0	111.6	R199 A203 V204 R205 M260 D294 V297 V298 F316 Y320	R199-L201 VanDerWaalsContact C-N 3.31Å; R199-L201 PolarHBondContact O-N 3.48Å; L201-A203 VanDerWaalsContact C-N 3.33Å; L201-V204 PolarHBondContact O-N 3.44Å; L201-R205 WeakPolarHBondContact O-CB 3.33Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 3.06Å; L201-M260 HydrophobicContact CD1-CE 3.98Å; L201-M260 HydrophobicContact CD1-SD 3.68Å; L201-M260 HydrophobicContact CG-CE 3.94Å; L201-M260 HydrophobicContact CG-SD 4.18Å; L201-D294 HydrophobicContact CD1-CB 4.16Å; L201-V297 HydrophobicContact CD2-CG1 4.36Å; L201-V298 HydrophobicContact CD2-CG2 3.55Å; L201-F316 HydrophobicContact CD2-CE1 4.49Å; L201-Y320 WeakPolarHBondContact CD1-OH 3.37Å
202	E	91	Very high	89.5	Confident	68 Å²	68	50.7 Å²	50.7	32%	0.318	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-39.5	175.9	-64.6	70.9	-154.8	0	0	111.5	R199 V204 R205 G206 R264	R199-E202 VanDerWaalsContact CA-OE2 3.24Å; R199-E202 WeakPolarHBondContact CA-OE2 3.3Å; R199-E202 HydrophobicContact CB-CB 4.49Å; R199-E202 PolarHBondContact O-N 2.96Å; E202-V204 VanDerWaalsContact C-N 3.31Å; E202-V204 PolarHBondContact O-N 3.36Å; E202-R205 PolarHBondContact O-N 3.27Å; E202-G206 PolarHBondContact O-N 2.86Å; E202-R264 IonicContact OE1-NH1 3.23Å; E202-R264 PolarHBondContact OE1-NH1 3.15Å
203	A	90.6	Very high	89.3	Confident	16 Å²	16	55 Å²	55	13%	0.132	28%	0.282	C	S	.	.	H	α-helix	trans	-63.6	-37.5	178.7	0	0	0	0	0	111.9	R199 T200 L201 G210 P211 L214	R199-A203 VanDerWaalsContact O-CB 3.28Å; R199-A203 WeakPolarHBondContact O-CB 3.45Å; R199-A203 PolarHBondContact O-N 3.2Å; T200-A203 PolarHBondContact O-N 3.42Å; L201-A203 VanDerWaalsContact C-N 3.33Å; A203-G210 CarbonylContact O-C 3.31Å; A203-G210 WeakPolarHBondContact O-CA 3.37Å; A203-P211 VanDerWaalsContact O-CD 3.23Å; A203-P211 WeakPolarHBondContact O-CD 3.44Å; A203-L214 HydrophobicContact CB-CB 4.47Å
204	V	90.8	Very high	89.3	Confident	22 Å²	22	55 Å²	55	13%	0.133	28%	0.282	C	S	.	.	H	α-helix	trans	-84.1	-28.7	180	173.1	0	0	0	0	112.8	T200 L201 E202 L214 V297	T200-V204 WeakPolarHBondContact O-CG2 3.34Å; T200-V204 PolarHBondContact O-N 2.93Å; L201-V204 PolarHBondContact O-N 3.44Å; E202-V204 VanDerWaalsContact C-N 3.31Å; E202-V204 PolarHBondContact O-N 3.36Å; V204-L214 HydrophobicContact CG2-CD2 3.81Å; V204-V297 HydrophobicContact CB-CG1 4.31Å; V204-V297 HydrophobicContact CG1-CG1 3.9Å
205	R	89.5	Confident	89.1	Confident	93 Å²	93	56.2 Å²	56.2	35%	0.351	29%	0.29	S	S	.	.	H	α-helix	trans	-72	-34.5	173.8	-76.2	173.6	-175.7	-89.4	10	112.8	L201 E202 D293 D294 V297	L201-R205 WeakPolarHBondContact O-CB 3.33Å; L201-R205 WeakPolarHBondContact O-CG 3.46Å; L201-R205 PolarHBondContact O-N 3.06Å; E202-R205 PolarHBondContact O-N 3.27Å; R205-D293 IonicContact CZ-OD1 3.63Å; R205-D293 IonicContact CZ-OD2 3.82Å; R205-D293 VanDerWaalsContact NH1-CG 3.25Å; R205-D293 IonicContact NH1-OD1 3.27Å; R205-D293 PolarHBondContact NH1-OD1 2.95Å; R205-D293 IonicContact NH1-OD2 3.8Å; R205-D293 PolarHBondContact NH1-OD2 3.27Å; R205-D293 IonicContact NH2-OD1 2.77Å; R205-D293 IonicContact NH2-OD2 3.23Å; R205-D293 PolarHBondContact NH2-OD2 3.14Å; R205-D294 IonicContact CZ-OD1 3.89Å; R205-D294 IonicContact NE-OD1 3.81Å; R205-D294 IonicContact NH2-OD1 3.35Å; R205-D294 PolarHBondContact NH2-OD1 2.87Å; R205-V297 HydrophobicContact CG-CB 4.39Å; R205-V297 HydrophobicContact CG-CG1 3.74Å; R205-V297 HydrophobicContact CG-CG2 3.82Å; R205-V297 VanDerWaalsContact CZ-CG2 3.49Å
206	G	79.3	Confident	89.1	Confident	39 Å²	39	51.6 Å²	51.6	40%	0.402	28%	0.276	S	S	.	.	S	Bend	trans	-70.7	168.5	179.5	0	0	0	0	0	113.1	E202	E202-G206 PolarHBondContact O-N 2.86Å
207	T	73.9	Confident	89.1	Confident	129 Å²	129	50.1 Å²	50.1	79%	0.791	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-74.4	168.4	166	54.1	0	0	0	0	110.7	G210	T207-G210 PolarHBondContact O-N 3.42Å
208	D	74.5	Confident	89.1	Confident	108 Å²	108	50.4 Å²	50.4	58%	0.578	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	140.2	170.5	-73.8	-43.7	0	0	0	111.4
209	P	80.6	Confident	89.1	Confident	56 Å²	56	56.7 Å²	56.7	36%	0.364	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	cis	-99.4	21.9	16.7	38.8	-36.9	0	0	0	115.1	Q212 R213	P209-Q212 PolarHBondContact O-N 2.75Å; P209-R213 WeakPolarHBondContact O-CG 3.33Å; P209-R213 PolarHBondContact O-N 2.98Å
210	G	87.6	Confident	89.2	Confident	14 Å²	14	51.3 Å²	51.3	14%	0.144	27%	0.266	C	S	.	.	H	α-helix	trans	-53.3	-58.8	-175.6	0	0	0	0	0	114.4	A203 T207 Q212 R213 L214	A203-G210 CarbonylContact O-C 3.31Å; A203-G210 WeakPolarHBondContact O-CA 3.37Å; T207-G210 PolarHBondContact O-N 3.42Å; G210-Q212 VanDerWaalsContact C-N 3.3Å; G210-Q212 PolarHBondContact O-N 2.88Å; G210-R213 PolarHBondContact O-N 3.46Å; G210-L214 PolarHBondContact O-N 3.45Å; G210-L214 VanDerWaalsContact O-N 3.1Å
211	P	89.5	Confident	89.2	Confident	32 Å²	32	51.3 Å²	51.3	21%	0.208	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-36.7	178.9	-24.2	35.4	0	0	0	112.8	A203 R213 L214 V215	A203-P211 VanDerWaalsContact O-CD 3.23Å; A203-P211 WeakPolarHBondContact O-CD 3.44Å; P211-R213 PolarHBondContact O-N 3.18Å; P211-L214 PolarHBondContact O-N 2.85Å; P211-V215 WeakPolarHBondContact O-CG2 3.25Å; P211-V215 PolarHBondContact O-N 2.77Å
212	Q	90.6	Very high	89.4	Confident	113 Å²	113	53.3 Å²	53.3	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-64.3	-41.1	178.4	-61.6	177.8	4	0	0	112.1	P209 G210 T216	P209-Q212 PolarHBondContact O-N 2.75Å; G210-Q212 VanDerWaalsContact C-N 3.3Å; G210-Q212 PolarHBondContact O-N 2.88Å; Q212-T216 WeakPolarHBondContact O-CB 3.27Å; Q212-T216 PolarHBondContact O-N 2.95Å; Q212-T216 PolarHBondContact O-OG1 3.33Å
213	R	91.3	Very high	89.5	Confident	154 Å²	154	57.3 Å²	57.3	58%	0.581	29%	0.288	S	S	*	.	H	α-helix	trans	-65.8	-39.8	175	-72.6	176.5	178.5	177.4	0.5	111.6	I196 P209 G210 P211 T216 A217	I196-R213 HydrophobicContact CG2-CB 4.41Å; P209-R213 WeakPolarHBondContact O-CG 3.33Å; P209-R213 PolarHBondContact O-N 2.98Å; G210-R213 PolarHBondContact O-N 3.46Å; P211-R213 PolarHBondContact O-N 3.18Å; R213-T216 WeakPolarHBondContact O-CB 3.35Å; R213-T216 PolarHBondContact O-N 2.97Å; R213-A217 PolarHBondContact O-N 3.43Å
214	L	93.1	Very high	89.7	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.1	-49.3	175.3	177.3	63.5	0	0	0	111.6	T200 A203 V204 G210 P211 T216 A217 L218 C305 F306	T200-L214 HydrophobicContact CG2-CD1 4.49Å; T200-L214 HydrophobicContact CG2-CD2 3.88Å; A203-L214 HydrophobicContact CB-CB 4.47Å; V204-L214 HydrophobicContact CG2-CD2 3.81Å; G210-L214 PolarHBondContact O-N 3.45Å; G210-L214 VanDerWaalsContact O-N 3.1Å; P211-L214 PolarHBondContact O-N 2.85Å; L214-T216 PolarHBondContact O-N 3.28Å; L214-A217 PolarHBondContact O-N 3.16Å; L214-A217 VanDerWaalsContact O-N 3.14Å; L214-L218 HydrophobicContact CD1-CD1 4.17Å; L214-L218 HydrophobicContact CD1-CG 4.28Å; L214-L218 HydrophobicContact CG-CD1 4.02Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 3.18Å; L214-C305 HydrophobicContact CD2-CB 4Å; L214-F306 HydrophobicContact CD2-CE2 4.01Å
215	V	93.8	Very high	89.8	Confident	38 Å²	38	57.8 Å²	57.8	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-58.4	-39.1	175.7	171.3	0	0	0	0	110.8	P211 L218 R219 C305	P211-V215 WeakPolarHBondContact O-CG2 3.25Å; P211-V215 PolarHBondContact O-N 2.77Å; V215-L218 PolarHBondContact O-N 3.35Å; V215-R219 HydrophobicContact CG1-CG 4.43Å; V215-R219 WeakPolarHBondContact O-CB 3.48Å; V215-R219 VanDerWaalsContact O-CG 3.25Å; V215-R219 WeakPolarHBondContact O-CG 3.45Å; V215-R219 PolarHBondContact O-N 2.97Å; V215-C305 HydrophobicContact CG2-CB 3.89Å
216	T	92.9	Very high	90.1	Very high	33 Å²	33	58 Å²	58	20%	0.202	29%	0.291	C	S	.	.	H	α-helix	trans	-61.9	-47.9	175.3	-61.3	0	0	0	0	111.8	L141 Q212 R213 L214 L218 R219 L220	L141-T216 HydrophobicContact CD1-CG2 3.98Å; L141-T216 HydrophobicContact CD2-CG2 3.83Å; L141-T216 HydrophobicContact CG-CG2 3.54Å; Q212-T216 WeakPolarHBondContact O-CB 3.27Å; Q212-T216 PolarHBondContact O-N 2.95Å; Q212-T216 PolarHBondContact O-OG1 3.33Å; R213-T216 WeakPolarHBondContact O-CB 3.35Å; R213-T216 PolarHBondContact O-N 2.97Å; L214-T216 PolarHBondContact O-N 3.28Å; T216-L218 PolarHBondContact O-N 3.44Å; T216-R219 PolarHBondContact O-N 3.06Å; T216-L220 WeakPolarHBondContact O-CG 3.42Å; T216-L220 PolarHBondContact O-N 3.28Å; T216-L220 VanDerWaalsContact O-N 3.14Å
217	A	94.7	Very high	90.7	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-42.7	176.3	0	0	0	0	0	112.1	V193 I196 I197 R213 L214 L220 V221	V193-A217 HydrophobicContact CG1-CB 4.11Å; I196-A217 HydrophobicContact CB-CB 4.21Å; I196-A217 HydrophobicContact CG2-CB 3.98Å; I197-A217 HydrophobicContact CG1-CB 4.2Å; R213-A217 PolarHBondContact O-N 3.43Å; L214-A217 PolarHBondContact O-N 3.16Å; L214-A217 VanDerWaalsContact O-N 3.14Å; A217-L220 WeakPolarHBondContact O-CB 3.36Å; A217-L220 PolarHBondContact O-N 2.5Å; A217-V221 PolarHBondContact O-N 3.45Å; A217-V221 VanDerWaalsContact O-N 3.08Å
218	L	94.5	Very high	91.6	Very high	5 Å²	5	52 Å²	52	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-67	-36.8	177.8	-68.4	171.2	0	0	0	112.6	L214 V215 T216 L220 V221 E222 C305 F306	L214-L218 HydrophobicContact CD1-CD1 4.17Å; L214-L218 HydrophobicContact CD1-CG 4.28Å; L214-L218 HydrophobicContact CG-CD1 4.02Å; L214-L218 WeakPolarHBondContact O-CG 3.42Å; L214-L218 PolarHBondContact O-N 3.18Å; V215-L218 PolarHBondContact O-N 3.35Å; T216-L218 PolarHBondContact O-N 3.44Å; L218-L220 VanDerWaalsContact C-N 3.28Å; L218-L220 PolarHBondContact O-N 3.06Å; L218-V221 WeakPolarHBondContact O-CB 3.3Å; L218-V221 PolarHBondContact O-N 2.83Å; L218-E222 PolarHBondContact O-N 2.9Å; L218-C305 WeakPolarHBondContact CD1-O 3.35Å; L218-F306 HydrophobicContact CD1-CB 4.48Å; L218-F306 HydrophobicContact CD1-CD1 3.68Å; L218-F306 HydrophobicContact CD1-CD2 3.89Å; L218-F306 HydrophobicContact CD1-CE1 3.78Å; L218-F306 HydrophobicContact CD1-CE2 4.01Å; L218-F306 HydrophobicContact CD1-CG 3.75Å; L218-F306 HydrophobicContact CD1-CZ 3.95Å; L218-F306 HydrophobicContact CD2-CD1 3.89Å; L218-F306 HydrophobicContact CD2-CE1 3.59Å; L218-F306 HydrophobicContact CD2-CZ 4.24Å; L218-F306 HydrophobicContact CG-CD1 4.46Å; L218-F306 HydrophobicContact CG-CE1 4.33Å
219	R	94.2	Very high	92.5	Very high	155 Å²	155	52.5 Å²	52.5	59%	0.585	24%	0.243	S	C	*	.	H	α-helix	trans	-60.8	-39.1	172.4	-76.8	173	-179.2	-174.1	1.8	111.8	V215 T216 E222 R223	V215-R219 HydrophobicContact CG1-CG 4.43Å; V215-R219 WeakPolarHBondContact O-CB 3.48Å; V215-R219 VanDerWaalsContact O-CG 3.25Å; V215-R219 WeakPolarHBondContact O-CG 3.45Å; V215-R219 PolarHBondContact O-N 2.97Å; T216-R219 PolarHBondContact O-N 3.06Å; R219-E222 PolarHBondContact O-N 3.32Å; R219-R223 WeakPolarHBondContact O-CB 3.25Å; R219-R223 VanDerWaalsContact O-CG 3.3Å; R219-R223 WeakPolarHBondContact O-CG 3.38Å; R219-R223 PolarHBondContact O-N 3.43Å
220	L	94.6	Very high	93.1	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-66	-40.8	175.7	-67.3	178.7	0	0	0	111.9	L140 L141 H144 V193 T216 A217 L218 E222 R223 E224 W249	L140-L220 HydrophobicContact CB-CD1 3.69Å; L141-L220 HydrophobicContact CD2-CD2 3.85Å; L141-L220 HydrophobicContact CD2-CG 4.21Å; H144-L220 HydrophobicContact CB-CD1 4.45Å; H144-L220 HydrophobicContact CB-CD2 3.38Å; V193-L220 HydrophobicContact CG2-CD1 3.77Å; T216-L220 WeakPolarHBondContact O-CG 3.42Å; T216-L220 PolarHBondContact O-N 3.28Å; T216-L220 VanDerWaalsContact O-N 3.14Å; A217-L220 WeakPolarHBondContact O-CB 3.36Å; A217-L220 PolarHBondContact O-N 2.5Å; L218-L220 VanDerWaalsContact C-N 3.28Å; L218-L220 PolarHBondContact O-N 3.06Å; L220-E222 PolarHBondContact O-N 3.24Å; L220-R223 PolarHBondContact O-N 3.44Å; L220-E224 WeakPolarHBondContact O-CG 3.47Å; L220-E224 PolarHBondContact O-N 3.45Å; L220-W249 HydrophobicContact CB-CZ3 4.37Å
221	V	95.1	Very high	93.2	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.4	-48.6	173.4	171.1	0	0	0	0	111.4	V193 I197 A217 L218 R223 E224 E225 W249 R250 C253	V193-V221 HydrophobicContact CG1-CG2 4.16Å; I197-V221 HydrophobicContact CD1-CG2 3.76Å; A217-V221 PolarHBondContact O-N 3.45Å; A217-V221 VanDerWaalsContact O-N 3.08Å; L218-V221 WeakPolarHBondContact O-CB 3.3Å; L218-V221 PolarHBondContact O-N 2.83Å; V221-R223 VanDerWaalsContact C-N 3.34Å; V221-R223 PolarHBondContact O-N 3.03Å; V221-E224 PolarHBondContact O-N 3.49Å; V221-E225 PolarHBondContact O-N 3.28Å; V221-W249 HydrophobicContact CB-CB 4.46Å; V221-W249 HydrophobicContact CG1-CB 4.03Å; V221-W249 HydrophobicContact CG2-CB 4.4Å; V221-W249 HydrophobicContact CG2-CE3 4.18Å; V221-R250 HydrophobicContact CG1-CB 4.33Å; V221-C253 HydrophobicContact CG1-CB 4.37Å
222	E	94.9	Very high	93.3	Very high	42 Å²	42	56.8 Å²	56.8	20%	0.196	26%	0.255	C	S	.	.	H	α-helix	trans	-67.2	-34	179.2	-72.6	-62.5	120.3	0	0	112.8	L218 R219 L220 E225 Q226 R250 P307 Y310	L218-E222 PolarHBondContact O-N 2.9Å; R219-E222 PolarHBondContact O-N 3.32Å; L220-E222 PolarHBondContact O-N 3.24Å; E222-E225 PolarHBondContact O-N 3.21Å; E222-Q226 WeakPolarHBondContact O-CG 3.45Å; E222-Q226 PolarHBondContact O-N 2.87Å; E222-Q226 VanDerWaalsContact O-N 3.11Å; E222-R250 VanDerWaalsContact CD-NH2 3.31Å; E222-R250 IonicContact OE1-CZ 3.82Å; E222-R250 IonicContact OE1-NE 3.52Å; E222-R250 PolarHBondContact OE1-NE 3.19Å; E222-R250 IonicContact OE1-NH2 3.64Å; E222-R250 PolarHBondContact OE1-NH2 2.98Å; E222-R250 IonicContact OE2-CZ 3.72Å; E222-R250 IonicContact OE2-NH2 2.75Å; E222-R250 PolarHBondContact OE2-NH2 3.01Å; E222-P307 HydrophobicContact CG-CG 4.26Å; E222-Y310 WeakPolarHBondContact OE1-CE1 3.39Å; E222-Y310 PolarHBondContact OE1-OH 3.36Å
223	R	93.6	Very high	93.4	Very high	152 Å²	152	56 Å²	56	57%	0.574	25%	0.252	S	S	*	.	H	α-helix	trans	-66.6	-42.9	174.2	-77.1	-69	-174.8	-175.4	4.6	112.4	R219 L220 V221 E225 Q226 I227	R219-R223 WeakPolarHBondContact O-CB 3.25Å; R219-R223 VanDerWaalsContact O-CG 3.3Å; R219-R223 WeakPolarHBondContact O-CG 3.38Å; R219-R223 PolarHBondContact O-N 3.43Å; L220-R223 PolarHBondContact O-N 3.44Å; V221-R223 VanDerWaalsContact C-N 3.34Å; V221-R223 PolarHBondContact O-N 3.03Å; R223-E225 VanDerWaalsContact C-N 3.32Å; R223-E225 PolarHBondContact O-N 3.38Å; R223-Q226 PolarHBondContact O-N 3.48Å; R223-I227 WeakPolarHBondContact O-CG1 3.31Å; R223-I227 PolarHBondContact O-N 3.44Å
224	E	94.7	Very high	93.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.1	-36.5	176.7	-76.1	-73.8	121.1	0	0	112.2	H144 L220 V221 I227 D228 R245 R247 W249	H144-E224 IonicContact CD2-OE1 3.74Å; H144-E224 IonicContact CE1-OE1 2.7Å; H144-E224 IonicContact NE2-OE1 2.59Å; H144-E224 PolarHBondContact NE2-OE1 3.05Å; L220-E224 WeakPolarHBondContact O-CG 3.47Å; L220-E224 PolarHBondContact O-N 3.45Å; V221-E224 PolarHBondContact O-N 3.49Å; E224-I227 PolarHBondContact O-N 3.42Å; E224-D228 PolarHBondContact O-N 3.08Å; E224-R245 IonicContact OE1-NH2 2.79Å; E224-R245 PolarHBondContact OE1-NH2 3.3Å; E224-R245 IonicContact OE2-CZ 2.63Å; E224-R245 VanDerWaalsContact OE2-CZ 3.23Å; E224-R245 IonicContact OE2-NH1 3.96Å; E224-R245 PolarHBondContact OE2-NH1 2.89Å; E224-R245 IonicContact OE2-NH2 3.84Å; E224-R245 PolarHBondContact OE2-NH2 2.78Å; E224-R247 IonicContact OE1-NH1 2.62Å; E224-R247 WeakPolarHBondContact OE2-CD 3.38Å; E224-R247 IonicContact OE2-CZ 3.92Å; E224-R247 IonicContact OE2-NE 3.99Å; E224-R247 IonicContact OE2-NH1 3.6Å; E224-R247 PolarHBondContact OE2-NH1 2.95Å; E224-W249 HydrophobicContact CB-CB 4.27Å; E224-W249 HydrophobicContact CB-CD2 3.81Å; E224-W249 HydrophobicContact CB-CE3 3.93Å; E224-W249 HydrophobicContact CB-CG 3.99Å; E224-W249 HydrophobicContact CB-CZ3 4.49Å; E224-W249 HydrophobicContact CG-CD2 3.71Å; E224-W249 HydrophobicContact CG-CE3 3.59Å; E224-W249 HydrophobicContact CG-CG 4.41Å; E224-W249 HydrophobicContact CG-CH2 3.86Å; E224-W249 HydrophobicContact CG-CZ2 4Å; E224-W249 HydrophobicContact CG-CZ3 3.66Å
225	E	93.8	Very high	93.1	Very high	48 Å²	48	55.7 Å²	55.7	22%	0.224	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-38.3	175.4	-161.8	68.4	-153.5	0	0	111.8	V221 E222 R223 D228 Q229 R250	V221-E225 PolarHBondContact O-N 3.28Å; E222-E225 PolarHBondContact O-N 3.21Å; R223-E225 VanDerWaalsContact C-N 3.32Å; R223-E225 PolarHBondContact O-N 3.38Å; E225-D228 PolarHBondContact O-N 3.23Å; E225-Q229 PolarHBondContact O-N 2.88Å; E225-R250 PolarHBondContact OE2-N 2.71Å
226	Q	94.2	Very high	92.9	Very high	97 Å²	97	60.7 Å²	60.7	45%	0.453	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-40.3	173	-72.2	171.5	4.8	0	0	112.2	E222 R223 Q229 F230	E222-Q226 WeakPolarHBondContact O-CG 3.45Å; E222-Q226 PolarHBondContact O-N 2.87Å; E222-Q226 VanDerWaalsContact O-N 3.11Å; R223-Q226 PolarHBondContact O-N 3.48Å; Q226-Q229 PolarHBondContact O-N 3.39Å; Q226-F230 PolarHBondContact O-N 3.23Å
227	I	92.7	Very high	92.6	Very high	40 Å²	40	67.4 Å²	67.4	21%	0.205	31%	0.307	C	S	.	.	H	α-helix	trans	-65	-45.2	175.7	-66	164.8	0	0	0	110.2	V148 R223 E224 Q229 F230 C231	V148-I227 HydrophobicContact CG1-CD1 4.48Å; V148-I227 HydrophobicContact CG2-CD1 3.86Å; R223-I227 WeakPolarHBondContact O-CG1 3.31Å; R223-I227 PolarHBondContact O-N 3.44Å; E224-I227 PolarHBondContact O-N 3.42Å; I227-Q229 VanDerWaalsContact C-N 3.32Å; I227-Q229 PolarHBondContact O-N 3.3Å; I227-F230 PolarHBondContact O-N 3.04Å; I227-C231 PolarHBondContact O-N 3.45Å; I227-C231 PolarHBondContact O-SG 2.85Å
228	D	93.6	Very high	92.1	Very high	3 Å²	3	69.7 Å²	69.7	2%	0.016	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-44.9	176.5	-78.6	-11.1	0	0	0	111.4	E224 E225 C231 V232 R245 P246 R247 K248	E224-D228 PolarHBondContact O-N 3.08Å; E225-D228 PolarHBondContact O-N 3.23Å; D228-C231 PolarHBondContact O-N 3.3Å; D228-V232 WeakPolarHBondContact O-CG2 3.44Å; D228-V232 PolarHBondContact O-N 3.36Å; D228-R245 WeakPolarHBondContact OD1-CD 3.32Å; D228-R245 IonicContact OD1-CZ 2.92Å; D228-R245 IonicContact OD1-NE 2.6Å; D228-R245 IonicContact OD1-NH1 3.9Å; D228-R245 PolarHBondContact OD1-NH1 3.23Å; D228-P246 HydrophobicContact CB-CB 3.8Å; D228-P246 WeakPolarHBondContact OD1-CA 3.47Å; D228-R247 PolarHBondContact OD1-N 3.14Å; D228-R247 VanDerWaalsContact OD1-N 3.1Å; D228-R247 WeakPolarHBondContact OD2-CA 3.37Å; D228-R247 PolarHBondContact OD2-N 3.47Å; D228-K248 PolarHBondContact OD2-N 3.02Å
229	Q	93.4	Very high	91.6	Very high	117 Å²	117	71.5 Å²	71.5	55%	0.547	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-47.7	176.1	-177	175.4	-5	0	0	111.6	E225 Q226 I227 C231 V232 E233	E225-Q229 PolarHBondContact O-N 2.88Å; Q226-Q229 PolarHBondContact O-N 3.39Å; I227-Q229 VanDerWaalsContact C-N 3.32Å; I227-Q229 PolarHBondContact O-N 3.3Å; Q229-C231 VanDerWaalsContact C-N 3.35Å; Q229-C231 PolarHBondContact O-N 3.01Å; Q229-V232 PolarHBondContact O-N 3.1Å; Q229-E233 WeakPolarHBondContact CG-OE1 3.26Å; Q229-E233 PolarHBondContact NE2-OE1 3.45Å; Q229-E233 WeakPolarHBondContact O-CG 3.44Å; Q229-E233 PolarHBondContact O-N 3.11Å
230	F	92.6	Very high	91.2	Very high	121 Å²	121	65 Å²	65	53%	0.531	32%	0.317	S	S	.	.	H	α-helix	trans	-60.7	-41.5	177.2	177.4	-99.6	0	0	0	112.6	Q226 I227 V232 E233 R234	Q226-F230 PolarHBondContact O-N 3.23Å; I227-F230 PolarHBondContact O-N 3.04Å; F230-V232 VanDerWaalsContact C-N 3.34Å; F230-V232 PolarHBondContact O-N 3.47Å; F230-E233 PolarHBondContact O-N 2.89Å; F230-R234 WeakPolarHBondContact O-CB 3.01Å; F230-R234 PolarHBondContact O-N 3.14Å
231	C	90	Very high	90.8	Very high	10 Å²	10	68 Å²	68	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-62.6	-40.5	176.3	-69.8	0	0	0	0	112.1	I227 D228 Q229 H235 R245	I227-C231 PolarHBondContact O-N 3.45Å; I227-C231 PolarHBondContact O-SG 2.85Å; D228-C231 PolarHBondContact O-N 3.3Å; Q229-C231 VanDerWaalsContact C-N 3.35Å; Q229-C231 PolarHBondContact O-N 3.01Å; C231-H235 WeakPolarHBondContact O-CB 3.47Å; C231-H235 PolarHBondContact O-N 3.19Å; C231-R245 HydrophobicContact CB-CB 4.38Å
232	V	91.6	Very high	90.2	Very high	62 Å²	62	68.5 Å²	68.5	38%	0.376	34%	0.336	S	S	.	.	H	α-helix	trans	-66.6	-43.9	177.5	171.5	0	0	0	0	111	D228 Q229 F230 H235 L236 P246	D228-V232 WeakPolarHBondContact O-CG2 3.44Å; D228-V232 PolarHBondContact O-N 3.36Å; Q229-V232 PolarHBondContact O-N 3.1Å; F230-V232 VanDerWaalsContact C-N 3.34Å; F230-V232 PolarHBondContact O-N 3.47Å; V232-H235 WeakPolarHBondContact O-CB 3.43Å; V232-H235 PolarHBondContact O-N 3.48Å; V232-L236 PolarHBondContact O-N 3.07Å; V232-P246 HydrophobicContact CG2-CG 4.49Å
233	E	91.6	Very high	89.5	Confident	97 Å²	97	70.3 Å²	70.3	45%	0.453	35%	0.349	S	S	.	.	H	α-helix	trans	-61.5	-47.1	176.1	-71.7	171.5	-171.6	0	0	111.4	Q229 F230 H235 L236	Q229-E233 WeakPolarHBondContact CG-OE1 3.26Å; Q229-E233 PolarHBondContact NE2-OE1 3.45Å; Q229-E233 WeakPolarHBondContact O-CG 3.44Å; Q229-E233 PolarHBondContact O-N 3.11Å; F230-E233 PolarHBondContact O-N 2.89Å; E233-H235 VanDerWaalsContact C-N 3.29Å; E233-H235 PolarHBondContact O-N 3.15Å; E233-L236 WeakPolarHBondContact O-CB 3.16Å; E233-L236 PolarHBondContact O-N 3.09Å
234	R	88.9	Confident	89.1	Confident	74 Å²	74	68.1 Å²	68.1	28%	0.279	34%	0.344	S	S	.	.	H	α-helix	trans	-64.1	-31.6	176.2	-176.2	172.9	177.3	161.5	-3	113.2	F159 F230 L236 E237 T238	F159-R234 VanDerWaalsContact CD1-NH2 3.29Å; F230-R234 WeakPolarHBondContact O-CB 3.01Å; F230-R234 PolarHBondContact O-N 3.14Å; R234-L236 VanDerWaalsContact C-N 3.32Å; R234-E237 PolarHBondContact O-N 3.07Å; R234-T238 HydrophobicContact CG-CG2 4.15Å; R234-T238 WeakPolarHBondContact O-CB 3.5Å; R234-T238 PolarHBondContact O-N 3.49Å; R234-T238 PolarHBondContact O-OG1 2.86Å
235	H	89.5	Confident	88.7	Confident	72 Å²	72	68.9 Å²	68.9	33%	0.333	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-38.6	175.9	176.3	64	0	0	0	111.6	C231 V232 E233 E237 T238 G239 F240 I241	C231-H235 WeakPolarHBondContact O-CB 3.47Å; C231-H235 PolarHBondContact O-N 3.19Å; V232-H235 WeakPolarHBondContact O-CB 3.43Å; V232-H235 PolarHBondContact O-N 3.48Å; E233-H235 VanDerWaalsContact C-N 3.29Å; E233-H235 PolarHBondContact O-N 3.15Å; H235-E237 PolarHBondContact O-N 3.28Å; H235-T238 PolarHBondContact O-N 3.22Å; H235-G239 PolarHBondContact CE1-O 3.03Å; H235-G239 VanDerWaalsContact ND1-C 3.35Å; H235-G239 PolarHBondContact ND1-O 3.36Å; H235-G239 VanDerWaalsContact O-CA 3.3Å; H235-G239 WeakPolarHBondContact O-CA 3.25Å; H235-G239 PolarHBondContact O-N 3.21Å; H235-F240 WeakPolarHBondContact CA-O 3.46Å; H235-F240 WeakPolarHBondContact CB-O 3.42Å; H235-F240 PolarHBondContact ND1-O 3.49Å; H235-I241 HydrophobicContact CB-CB 4.37Å
236	L	89	Confident	88.5	Confident	144 Å²	144	69.3 Å²	69.3	75%	0.754	35%	0.354	S	S	*	.	H	α-helix	trans	-61	-34.3	176.4	-65	170.6	0	0	0	112.2	V232 E233 R234	V232-L236 PolarHBondContact O-N 3.07Å; E233-L236 WeakPolarHBondContact O-CB 3.16Å; E233-L236 PolarHBondContact O-N 3.09Å; R234-L236 VanDerWaalsContact C-N 3.32Å
237	E	86.5	Confident	88.4	Confident	173 Å²	173	66.9 Å²	66.9	81%	0.808	34%	0.34	S	S	*	.	H	α-helix	trans	-83.4	-38.9	-179.8	-63.3	-178.2	169.4	0	0	113.4	R234 H235	R234-E237 PolarHBondContact O-N 3.07Å; H235-E237 PolarHBondContact O-N 3.28Å
238	T	85.6	Confident	88.4	Confident	49 Å²	49	70.2 Å²	70.2	30%	0.301	35%	0.353	S	S	.	.	H	α-helix	trans	-110.8	-16.3	-166.6	65.3	0	0	0	0	114.6	F159 R234 H235 F240	F159-T238 HydrophobicContact CE2-CG2 4.05Å; F159-T238 HydrophobicContact CZ-CG2 3.84Å; R234-T238 HydrophobicContact CG-CG2 4.15Å; R234-T238 WeakPolarHBondContact O-CB 3.5Å; R234-T238 PolarHBondContact O-N 3.49Å; R234-T238 PolarHBondContact O-OG1 2.86Å; H235-T238 PolarHBondContact O-N 3.22Å; T238-F240 PolarHBondContact O-N 3.18Å; T238-F240 PolarHBondContact OG1-N 2.9Å
239	G	84.5	Confident	88.5	Confident	43 Å²	43	70.3 Å²	70.3	44%	0.443	35%	0.353	S	S	.	.	S	Bend	trans	70.9	-2	-169.6	0	0	0	0	0	114.4	H235	H235-G239 PolarHBondContact CE1-O 3.03Å; H235-G239 VanDerWaalsContact ND1-C 3.35Å; H235-G239 PolarHBondContact ND1-O 3.36Å; H235-G239 VanDerWaalsContact O-CA 3.3Å; H235-G239 WeakPolarHBondContact O-CA 3.25Å; H235-G239 PolarHBondContact O-N 3.21Å
240	F	84.5	Confident	88.6	Confident	18 Å²	18	69 Å²	69	8%	0.079	34%	0.344	C	S	.	.			trans	-94.5	134	178.4	177.6	-104.7	0	0	0	110.8	M158 F159 F162 H235 T238 P242	M158-F240 HydrophobicContact CB-CE2 4.38Å; M158-F240 HydrophobicContact CB-CZ 3.95Å; F159-F240 HydrophobicContact CB-CD1 4.25Å; F159-F240 HydrophobicContact CB-CE1 4.1Å; F159-F240 HydrophobicContact CB-CZ 4.43Å; F159-F240 HydrophobicContact CD2-CB 3.71Å; F159-F240 AromaticContact CD2-CD1 3.65Å; F159-F240 HydrophobicContact CD2-CD1 3.65Å; F159-F240 HydrophobicContact CD2-CD2 4.37Å; F159-F240 HydrophobicContact CD2-CE1 4.35Å; F159-F240 AromaticContact CD2-CG 3.65Å; F159-F240 HydrophobicContact CD2-CG 3.65Å; F159-F240 HydrophobicContact CE2-CB 3.86Å; F159-F240 HydrophobicContact CE2-CD1 4.47Å; F159-F240 HydrophobicContact CE2-CG 4.32Å; F159-F240 HydrophobicContact CG-CD1 4.36Å; F162-F240 HydrophobicContact CB-CD2 3.83Å; F162-F240 HydrophobicContact CB-CE2 4.13Å; F162-F240 HydrophobicContact CD1-CB 3.86Å; F162-F240 AromaticContact CD1-CD2 3.92Å; F162-F240 HydrophobicContact CD1-CD2 3.92Å; F162-F240 HydrophobicContact CD1-CG 4.27Å; F162-F240 AromaticContact CD2-CD2 3.97Å; F162-F240 HydrophobicContact CD2-CD2 3.97Å; F162-F240 HydrophobicContact CE1-CB 3.86Å; F162-F240 HydrophobicContact CE1-CD2 4.47Å; F162-F240 HydrophobicContact CG-CB 4.45Å; F162-F240 AromaticContact CG-CD2 3.63Å; F162-F240 HydrophobicContact CG-CD2 3.63Å; F162-F240 HydrophobicContact CG-CE2 4.36Å; F162-F240 HydrophobicContact CG-CG 4.42Å; F162-F240 HydrophobicContact CZ-CB 4.46Å; H235-F240 WeakPolarHBondContact CA-O 3.46Å; H235-F240 WeakPolarHBondContact CB-O 3.42Å; H235-F240 PolarHBondContact ND1-O 3.49Å; T238-F240 PolarHBondContact O-N 3.18Å; T238-F240 PolarHBondContact OG1-N 2.9Å; F240-P242 HydrophobicContact CE1-CG 4.14Å
241	I	86.6	Confident	88.7	Confident	66 Å²	66	68.3 Å²	68.3	34%	0.338	34%	0.342	S	S	.	.			trans	-127.7	131.5	169.7	-167.6	165.8	0	0	0	108.7	H235 R245	H235-I241 HydrophobicContact CB-CB 4.37Å; I241-R245 VanDerWaalsContact CD1-O 3.28Å; I241-R245 WeakPolarHBondContact CD1-O 3.44Å; I241-R245 HydrophobicContact CG1-CB 4.46Å
242	P	83.3	Confident	88.9	Confident	11 Å²	11	72.9 Å²	72.9	7%	0.071	36%	0.358	C	S	.	.			trans	-57.8	146.5	173.3	-27.2	36.4	0	0	0	112.2	D155 F240 K244 R245	D155-P242 HydrophobicContact CB-CG 4.39Å; D155-P242 WeakPolarHBondContact OD2-CB 3.37Å; D155-P242 WeakPolarHBondContact OD2-CG 3.39Å; F240-P242 HydrophobicContact CE1-CG 4.14Å; P242-K244 PolarHBondContact O-N 3.41Å; P242-R245 HydrophobicContact CB-CB 4.35Å; P242-R245 HydrophobicContact CB-CG 3.98Å; P242-R245 PolarHBondContact O-N 3.14Å
243	V	79.9	Confident	89.1	Confident	79 Å²	79	69.9 Å²	69.9	48%	0.479	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	134.3	-180	-173.3	0	0	0	0	109.7	F183	F183-V243 HydrophobicContact CE1-CB 4.36Å; F183-V243 HydrophobicContact CE1-CG1 4.37Å; F183-V243 HydrophobicContact CZ-CB 3.97Å; F183-V243 HydrophobicContact CZ-CG1 3.97Å
244	K	83.8	Confident	89.3	Confident	106 Å²	106	67.4 Å²	67.4	46%	0.461	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	14.3	-174.5	-53.8	-164.6	-176.7	-174.8	0	116.7	F183 D187 P242 R247	F183-K244 HydrophobicContact CD1-CD 3.55Å; F183-K244 HydrophobicContact CD1-CG 3.99Å; F183-K244 HydrophobicContact CE1-CB 4.38Å; F183-K244 HydrophobicContact CE1-CD 3.98Å; F183-K244 HydrophobicContact CE1-CG 3.87Å; F183-K244 HydrophobicContact CG-CD 4.27Å; D187-K244 IonicContact OD2-NZ 2.65Å; D187-K244 PolarHBondContact OD2-NZ 2.93Å; P242-K244 PolarHBondContact O-N 3.41Å; K244-R247 WeakPolarHBondContact O-CG 3.41Å
245	R	88	Confident	89.7	Confident	16 Å²	16	67.8 Å²	67.8	6%	0.06	34%	0.335	C	S	.	.			trans	-103.6	146.2	169.8	-67.4	-76.6	-179.7	-172.5	-1.8	110.4	E151 E224 D228 C231 I241 P242	E151-R245 IonicContact OE2-CZ 3.38Å; E151-R245 IonicContact OE2-NH2 2.75Å; E151-R245 PolarHBondContact OE2-NH2 2.83Å; E224-R245 IonicContact OE1-NH2 2.79Å; E224-R245 PolarHBondContact OE1-NH2 3.3Å; E224-R245 IonicContact OE2-CZ 2.63Å; E224-R245 VanDerWaalsContact OE2-CZ 3.23Å; E224-R245 IonicContact OE2-NH1 3.96Å; E224-R245 PolarHBondContact OE2-NH1 2.89Å; E224-R245 IonicContact OE2-NH2 3.84Å; E224-R245 PolarHBondContact OE2-NH2 2.78Å; D228-R245 WeakPolarHBondContact OD1-CD 3.32Å; D228-R245 IonicContact OD1-CZ 2.92Å; D228-R245 IonicContact OD1-NE 2.6Å; D228-R245 IonicContact OD1-NH1 3.9Å; D228-R245 PolarHBondContact OD1-NH1 3.23Å; C231-R245 HydrophobicContact CB-CB 4.38Å; I241-R245 VanDerWaalsContact CD1-O 3.28Å; I241-R245 WeakPolarHBondContact CD1-O 3.44Å; I241-R245 HydrophobicContact CG1-CB 4.46Å; P242-R245 HydrophobicContact CB-CB 4.35Å; P242-R245 HydrophobicContact CB-CG 3.98Å; P242-R245 PolarHBondContact O-N 3.14Å
246	P	89.3	Confident	90	Very high	57 Å²	57	65.9 Å²	65.9	37%	0.37	33%	0.329	S	S	.	.			cis	-76.8	147.1	-5.7	32.8	-35	0	0	0	112.5	D228 V232 K248	D228-P246 HydrophobicContact CB-CB 3.8Å; D228-P246 WeakPolarHBondContact OD1-CA 3.47Å; V232-P246 HydrophobicContact CG2-CG 4.49Å; P246-K248 HydrophobicContact CB-CG 4.49Å
247	R	91.2	Very high	90.4	Very high	47 Å²	47	59 Å²	59	18%	0.177	29%	0.293	C	S	.	.			trans	-88.1	-25.6	178.8	-65.2	-179.5	176.1	169.4	-4.9	114.3	E151 E224 D228 K244 W249	E151-R247 IonicContact OE1-CZ 2.94Å; E151-R247 IonicContact OE1-NH1 3.4Å; E151-R247 IonicContact OE1-NH2 2.6Å; E151-R247 PolarHBondContact OE1-NH2 3.36Å; E151-R247 IonicContact OE2-CZ 2.66Å; E151-R247 IonicContact OE2-NH1 2.81Å; E151-R247 IonicContact OE2-NH2 2.98Å; E224-R247 IonicContact OE1-NH1 2.62Å; E224-R247 WeakPolarHBondContact OE2-CD 3.38Å; E224-R247 IonicContact OE2-CZ 3.92Å; E224-R247 IonicContact OE2-NE 3.99Å; E224-R247 IonicContact OE2-NH1 3.6Å; E224-R247 PolarHBondContact OE2-NH1 2.95Å; D228-R247 PolarHBondContact OD1-N 3.14Å; D228-R247 VanDerWaalsContact OD1-N 3.1Å; D228-R247 WeakPolarHBondContact OD2-CA 3.37Å; D228-R247 PolarHBondContact OD2-N 3.47Å; K244-R247 WeakPolarHBondContact O-CG 3.41Å; R247-W249 VanDerWaalsContact CB-CD1 3.47Å
248	K	93.4	Very high	90.8	Very high	109 Å²	109	54 Å²	54	47%	0.474	27%	0.269	S	S	.	.			trans	55.8	53.5	179.1	-54.2	-177.9	178.2	-176	0	113.8	D228 P246 R250 E251 R252	D228-K248 PolarHBondContact OD2-N 3.02Å; P246-K248 HydrophobicContact CB-CG 4.49Å; K248-R250 PolarHBondContact O-N 3.44Å; K248-E251 HydrophobicContact CB-CB 4.32Å; K248-E251 WeakPolarHBondContact CD-OE2 3.4Å; K248-E251 PolarHBondContact O-N 3.47Å; K248-R252 PolarHBondContact O-N 3.33Å
249	W	95.2	Very high	91.3	Very high	5 Å²	5	57.6 Å²	57.6	2%	0.019	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-27.4	-176.3	-82	25.9	0	0	0	113.1	L189 A190 V193 F194 L220 V221 E224 R247 R252 C253	L189-W249 HydrophobicContact CD2-CH2 4.43Å; A190-W249 HydrophobicContact CB-CH2 4.36Å; A190-W249 HydrophobicContact CB-CZ2 3.91Å; V193-W249 HydrophobicContact CB-CZ3 4.46Å; V193-W249 HydrophobicContact CG1-CE3 4.43Å; V193-W249 HydrophobicContact CG1-CZ3 4.19Å; V193-W249 HydrophobicContact CG2-CZ3 4.26Å; F194-W249 HydrophobicContact CE2-CD2 4.25Å; F194-W249 HydrophobicContact CE2-CG 4.42Å; F194-W249 HydrophobicContact CZ-CB 4.12Å; F194-W249 HydrophobicContact CZ-CD2 4.03Å; F194-W249 HydrophobicContact CZ-CE3 4.37Å; F194-W249 AromaticContact CZ-CG 3.91Å; F194-W249 HydrophobicContact CZ-CG 3.91Å; L220-W249 HydrophobicContact CB-CZ3 4.37Å; V221-W249 HydrophobicContact CB-CB 4.46Å; V221-W249 HydrophobicContact CG1-CB 4.03Å; V221-W249 HydrophobicContact CG2-CB 4.4Å; V221-W249 HydrophobicContact CG2-CE3 4.18Å; E224-W249 HydrophobicContact CB-CB 4.27Å; E224-W249 HydrophobicContact CB-CD2 3.81Å; E224-W249 HydrophobicContact CB-CE3 3.93Å; E224-W249 HydrophobicContact CB-CG 3.99Å; E224-W249 HydrophobicContact CB-CZ3 4.49Å; E224-W249 HydrophobicContact CG-CD2 3.71Å; E224-W249 HydrophobicContact CG-CE3 3.59Å; E224-W249 HydrophobicContact CG-CG 4.41Å; E224-W249 HydrophobicContact CG-CH2 3.86Å; E224-W249 HydrophobicContact CG-CZ2 4Å; E224-W249 HydrophobicContact CG-CZ3 3.66Å; R247-W249 VanDerWaalsContact CB-CD1 3.47Å; W249-R252 PolarHBondContact O-N 3.47Å; W249-C253 WeakPolarHBondContact O-CB 3.37Å; W249-C253 PolarHBondContact O-N 2.85Å
250	R	94.9	Very high	91.8	Very high	90 Å²	90	56.1 Å²	56.1	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-45.5	176.1	-173.6	-178.8	-65.1	158.2	-3.1	112.4	V221 E222 E225 K248 R252 C253 F254	V221-R250 HydrophobicContact CG1-CB 4.33Å; E222-R250 VanDerWaalsContact CD-NH2 3.31Å; E222-R250 IonicContact OE1-CZ 3.82Å; E222-R250 IonicContact OE1-NE 3.52Å; E222-R250 PolarHBondContact OE1-NE 3.19Å; E222-R250 IonicContact OE1-NH2 3.64Å; E222-R250 PolarHBondContact OE1-NH2 2.98Å; E222-R250 IonicContact OE2-CZ 3.72Å; E222-R250 IonicContact OE2-NH2 2.75Å; E222-R250 PolarHBondContact OE2-NH2 3.01Å; E225-R250 PolarHBondContact OE2-N 2.71Å; K248-R250 PolarHBondContact O-N 3.44Å; R250-R252 VanDerWaalsContact C-N 3.34Å; R250-R252 PolarHBondContact O-N 3.42Å; R250-C253 VanDerWaalsContact O-CB 3.31Å; R250-C253 WeakPolarHBondContact O-CB 3.43Å; R250-C253 PolarHBondContact O-N 3.45Å; R250-F254 HydrophobicContact CG-CD2 4.22Å; R250-F254 HydrophobicContact CG-CE2 3.8Å; R250-F254 VanDerWaalsContact O-CD2 3.25Å; R250-F254 WeakPolarHBondContact O-CD2 3.41Å; R250-F254 PolarHBondContact O-N 3.02Å
251	E	95	Very high	92.4	Very high	107 Å²	107	55.2 Å²	55.2	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-61.1	-45.5	176	-173.4	-176.2	161.1	0	0	110.7	K248 C253 F254 N255	K248-E251 HydrophobicContact CB-CB 4.32Å; K248-E251 WeakPolarHBondContact CD-OE2 3.4Å; K248-E251 PolarHBondContact O-N 3.47Å; E251-C253 VanDerWaalsContact C-N 3.31Å; E251-C253 PolarHBondContact O-N 2.62Å; E251-F254 PolarHBondContact O-N 2.92Å; E251-N255 PolarHBondContact O-N 3.09Å; E251-N255 PolarHBondContact O-ND2 3.23Å
252	R	95.3	Very high	92.8	Very high	105 Å²	105	56.9 Å²	56.9	40%	0.396	26%	0.261	S	S	.	.	H	α-helix	trans	-62.3	-36.4	176.5	-173	170	171.6	-175	-1.8	112.6	F194 K248 W249 R250 N255 V256	F194-R252 HydrophobicContact CD1-CG 4.09Å; F194-R252 HydrophobicContact CD2-CG 4.29Å; F194-R252 VanDerWaalsContact CD2-CZ 3.43Å; F194-R252 VanDerWaalsContact CD2-NE 3.29Å; F194-R252 HydrophobicContact CE1-CB 3.91Å; F194-R252 HydrophobicContact CE1-CG 3.68Å; F194-R252 HydrophobicContact CE2-CG 3.94Å; F194-R252 VanDerWaalsContact CE2-NE 3.34Å; F194-R252 HydrophobicContact CG-CG 4.4Å; F194-R252 HydrophobicContact CZ-CB 3.81Å; F194-R252 HydrophobicContact CZ-CG 3.62Å; K248-R252 PolarHBondContact O-N 3.33Å; W249-R252 PolarHBondContact O-N 3.47Å; R250-R252 VanDerWaalsContact C-N 3.34Å; R250-R252 PolarHBondContact O-N 3.42Å; R252-N255 PolarHBondContact O-N 3.05Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.44Å; R252-V256 PolarHBondContact O-N 3.28Å
253	C	95.6	Very high	93.3	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-57.9	-51.7	174.8	179	0	0	0	0	111	F194 I197 V221 W249 R250 E251 N255 V256 L257	F194-C253 HydrophobicContact CE1-CB 4.36Å; I197-C253 HydrophobicContact CD1-CB 4.38Å; V221-C253 HydrophobicContact CG1-CB 4.37Å; W249-C253 WeakPolarHBondContact O-CB 3.37Å; W249-C253 PolarHBondContact O-N 2.85Å; R250-C253 VanDerWaalsContact O-CB 3.31Å; R250-C253 WeakPolarHBondContact O-CB 3.43Å; R250-C253 PolarHBondContact O-N 3.45Å; E251-C253 VanDerWaalsContact C-N 3.31Å; E251-C253 PolarHBondContact O-N 2.62Å; C253-N255 PolarHBondContact O-N 3.12Å; C253-V256 PolarHBondContact O-N 3.1Å; C253-L257 WeakPolarHBondContact O-CG 3.44Å; C253-L257 PolarHBondContact O-N 3.08Å
254	F	96.2	Very high	93.9	Very high	44 Å²	44	61 Å²	61	19%	0.193	27%	0.271	C	S	.	.	H	α-helix	trans	-63.9	-39.4	178.8	-71.4	-63.7	0	0	0	112.9	R250 E251 V256 L257 E258 Y310 M319	R250-F254 HydrophobicContact CG-CD2 4.22Å; R250-F254 HydrophobicContact CG-CE2 3.8Å; R250-F254 VanDerWaalsContact O-CD2 3.25Å; R250-F254 WeakPolarHBondContact O-CD2 3.41Å; R250-F254 PolarHBondContact O-N 3.02Å; E251-F254 PolarHBondContact O-N 2.92Å; F254-V256 VanDerWaalsContact C-N 3.28Å; F254-V256 PolarHBondContact O-N 3.37Å; F254-L257 HydrophobicContact CD1-CD1 4.37Å; F254-L257 PolarHBondContact O-N 2.93Å; F254-E258 WeakPolarHBondContact O-CB 3.27Å; F254-E258 PolarHBondContact O-N 3.12Å; F254-Y310 AromaticContact CE1-CD2 3.87Å; F254-Y310 HydrophobicContact CE1-CD2 3.87Å; F254-Y310 HydrophobicContact CE1-CE2 4.42Å; F254-Y310 HydrophobicContact CE2-CD2 4.21Å; F254-Y310 HydrophobicContact CE2-CE2 4.17Å; F254-Y310 AromaticContact CZ-CD2 3.37Å; F254-Y310 HydrophobicContact CZ-CD2 3.37Å; F254-Y310 AromaticContact CZ-CE2 3.76Å; F254-Y310 HydrophobicContact CZ-CE2 3.76Å; F254-Y310 AromaticContact CZ-CG 3.82Å; F254-Y310 HydrophobicContact CZ-CG 3.82Å; F254-M319 HydrophobicContact CD1-CE 4.14Å
255	N	96.2	Very high	94.3	Very high	83 Å²	83	56 Å²	56	44%	0.444	25%	0.249	S	C	.	.	H	α-helix	trans	-61.5	-36.5	175	-69.2	-20.6	0	0	0	112.4	E251 R252 C253 K259	E251-N255 PolarHBondContact O-N 3.09Å; E251-N255 PolarHBondContact O-ND2 3.23Å; R252-N255 PolarHBondContact O-N 3.05Å; C253-N255 PolarHBondContact O-N 3.12Å; N255-K259 VanDerWaalsContact O-CB 3.32Å; N255-K259 WeakPolarHBondContact O-CB 3.35Å; N255-K259 PolarHBondContact O-N 2.91Å
256	V	96.5	Very high	94.5	Very high	32 Å²	32	59.6 Å²	59.6	19%	0.194	27%	0.267	C	S	.	.	H	α-helix	trans	-68.8	-42.1	175.9	169.6	0	0	0	0	111.1	F194 I197 R252 C253 F254 K259 M260	F194-V256 HydrophobicContact CB-CG2 4.21Å; F194-V256 HydrophobicContact CD1-CG2 4.02Å; F194-V256 HydrophobicContact CG-CG2 4.35Å; I197-V256 HydrophobicContact CB-CG1 4.44Å; I197-V256 HydrophobicContact CG2-CB 4.42Å; I197-V256 HydrophobicContact CG2-CG1 4.07Å; R252-V256 VanDerWaalsContact O-CG2 3.26Å; R252-V256 WeakPolarHBondContact O-CG2 3.44Å; R252-V256 PolarHBondContact O-N 3.28Å; C253-V256 PolarHBondContact O-N 3.1Å; F254-V256 VanDerWaalsContact C-N 3.28Å; F254-V256 PolarHBondContact O-N 3.37Å; V256-K259 PolarHBondContact O-N 3.47Å; V256-M260 WeakPolarHBondContact O-CB 3.34Å; V256-M260 PolarHBondContact O-N 3.44Å
257	L	96.3	Very high	94.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-45.2	175.9	-66.4	175.8	0	0	0	111.8	I197 T200 C253 F254 K259 M260 V261 F306 I312 F316 M319	I197-L257 HydrophobicContact CG2-CD2 3.8Å; I197-L257 HydrophobicContact CG2-CG 3.99Å; T200-L257 HydrophobicContact CG2-CD2 4.43Å; T200-L257 WeakPolarHBondContact OG1-CD2 3.46Å; C253-L257 WeakPolarHBondContact O-CG 3.44Å; C253-L257 PolarHBondContact O-N 3.08Å; F254-L257 HydrophobicContact CD1-CD1 4.37Å; F254-L257 PolarHBondContact O-N 2.93Å; L257-K259 VanDerWaalsContact C-N 3.35Å; L257-K259 PolarHBondContact O-N 3.34Å; L257-M260 HydrophobicContact CD2-CE 4.37Å; L257-M260 WeakPolarHBondContact O-CB 3.17Å; L257-M260 PolarHBondContact O-N 3.45Å; L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 2.91Å; L257-F306 HydrophobicContact CD1-CE1 3.96Å; L257-F306 HydrophobicContact CD1-CZ 4.15Å; L257-I312 HydrophobicContact CD1-CD1 4.05Å; L257-F316 HydrophobicContact CD2-CZ 4.11Å; L257-M319 HydrophobicContact CB-CE 4.28Å; L257-M319 HydrophobicContact CB-SD 4.23Å
258	E	96.2	Very high	94.3	Very high	68 Å²	68	58.2 Å²	58.2	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-61.7	-43.8	177.5	-168.4	-165.1	150.5	0	0	111.2	F254 M260 V261 R262 M319	F254-E258 WeakPolarHBondContact O-CB 3.27Å; F254-E258 PolarHBondContact O-N 3.12Å; E258-M260 VanDerWaalsContact C-N 3.32Å; E258-M260 PolarHBondContact O-N 3.31Å; E258-V261 PolarHBondContact O-N 3.21Å; E258-R262 WeakPolarHBondContact O-CB 3.28Å; E258-R262 PolarHBondContact O-N 2.78Å; E258-R262 IonicContact OE1-CZ 3.84Å; E258-R262 IonicContact OE1-NH2 3.66Å; E258-R262 PolarHBondContact OE1-NH2 3.44Å; E258-M319 HydrophobicContact CB-CE 4.36Å; E258-M319 HydrophobicContact CB-CG 4.38Å; E258-M319 HydrophobicContact CB-SD 4.33Å; E258-M319 HydrophobicContact CG-CG 4.26Å
259	K	95.8	Very high	94.1	Very high	124 Å²	124	55.7 Å²	55.7	54%	0.539	26%	0.26	S	S	.	.	H	α-helix	trans	-60.5	-41.9	175	-177.5	177.3	177.6	179.2	0	111.7	N255 V256 L257 R262 Q263	N255-K259 VanDerWaalsContact O-CB 3.32Å; N255-K259 WeakPolarHBondContact O-CB 3.35Å; N255-K259 PolarHBondContact O-N 2.91Å; V256-K259 PolarHBondContact O-N 3.47Å; L257-K259 VanDerWaalsContact C-N 3.35Å; L257-K259 PolarHBondContact O-N 3.34Å; K259-R262 PolarHBondContact O-N 3.48Å; K259-Q263 VanDerWaalsContact CE-NE2 3.31Å; K259-Q263 HydrophobicContact CG-CG 4.42Å; K259-Q263 WeakPolarHBondContact O-CB 3.33Å; K259-Q263 VanDerWaalsContact O-CG 3.27Å; K259-Q263 WeakPolarHBondContact O-CG 3.39Å; K259-Q263 PolarHBondContact O-N 2.88Å
260	M	95.3	Very high	93.6	Very high	11 Å²	11	61.7 Å²	61.7	5%	0.054	29%	0.292	C	S	.	.	H	α-helix	trans	-62	-47.2	176.7	175.1	-83.7	-66	0	0	111.3	G198 L201 V256 L257 E258 R262 Q263 R264 F316	G198-M260 WeakPolarHBondContact O-CG 3.27Å; L201-M260 HydrophobicContact CD1-CE 3.98Å; L201-M260 HydrophobicContact CD1-SD 3.68Å; L201-M260 HydrophobicContact CG-CE 3.94Å; L201-M260 HydrophobicContact CG-SD 4.18Å; V256-M260 WeakPolarHBondContact O-CB 3.34Å; V256-M260 PolarHBondContact O-N 3.44Å; L257-M260 HydrophobicContact CD2-CE 4.37Å; L257-M260 WeakPolarHBondContact O-CB 3.17Å; L257-M260 PolarHBondContact O-N 3.45Å; E258-M260 VanDerWaalsContact C-N 3.32Å; E258-M260 PolarHBondContact O-N 3.31Å; M260-R262 VanDerWaalsContact C-N 3.34Å; M260-R262 PolarHBondContact O-N 2.87Å; M260-Q263 PolarHBondContact O-N 3.2Å; M260-R264 WeakPolarHBondContact O-CG 3.32Å; M260-R264 PolarHBondContact O-N 3.31Å; M260-R264 HydrophobicContact SD-CG 4.31Å; M260-F316 HydrophobicContact CE-CE1 3.62Å; M260-F316 HydrophobicContact CE-CZ 3.94Å
261	V	95.7	Very high	93.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-45.6	176.5	170.1	0	0	0	0	111.1	L257 E258 R264 V265 F316 M319 Y320 A323	L257-V261 WeakPolarHBondContact O-CG2 3.4Å; L257-V261 PolarHBondContact O-N 2.91Å; E258-V261 PolarHBondContact O-N 3.21Å; V261-R264 PolarHBondContact O-N 3.36Å; V261-V265 WeakPolarHBondContact O-CG2 3.26Å; V261-V265 PolarHBondContact O-N 2.92Å; V261-V265 VanDerWaalsContact O-N 3.07Å; V261-F316 HydrophobicContact CG2-CD1 3.69Å; V261-F316 HydrophobicContact CG2-CE1 3.67Å; V261-M319 HydrophobicContact CB-CB 4.26Å; V261-M319 HydrophobicContact CG1-CB 4.04Å; V261-M319 HydrophobicContact CG2-CB 4.22Å; V261-M319 HydrophobicContact CG2-SD 4.47Å; V261-Y320 HydrophobicContact CG1-CD1 3.59Å; V261-Y320 HydrophobicContact CG1-CD2 3.96Å; V261-Y320 HydrophobicContact CG1-CE1 3.79Å; V261-Y320 HydrophobicContact CG1-CE2 4.11Å; V261-Y320 HydrophobicContact CG1-CG 3.68Å; V261-Y320 HydrophobicContact CG2-CD2 4.32Å; V261-Y320 HydrophobicContact CG2-CE2 3.92Å; V261-A323 HydrophobicContact CG1-CB 4.33Å
262	R	94.8	Very high	92.7	Very high	101 Å²	101	57.7 Å²	57.7	38%	0.381	28%	0.28	S	S	.	.	H	α-helix	trans	-60.2	-47.5	178	-169.6	-176.7	-51.5	164.9	3.5	112.2	E258 K259 M260 R264 V265 E266	E258-R262 WeakPolarHBondContact O-CB 3.28Å; E258-R262 PolarHBondContact O-N 2.78Å; E258-R262 IonicContact OE1-CZ 3.84Å; E258-R262 IonicContact OE1-NH2 3.66Å; E258-R262 PolarHBondContact OE1-NH2 3.44Å; K259-R262 PolarHBondContact O-N 3.48Å; M260-R262 VanDerWaalsContact C-N 3.34Å; M260-R262 PolarHBondContact O-N 2.87Å; R262-R264 VanDerWaalsContact C-N 3.26Å; R262-R264 PolarHBondContact O-N 3.44Å; R262-V265 PolarHBondContact O-N 2.91Å; R262-E266 WeakPolarHBondContact CD-OE1 3.41Å; R262-E266 HydrophobicContact CG-CG 4.44Å; R262-E266 WeakPolarHBondContact CG-OE1 3.39Å; R262-E266 WeakPolarHBondContact O-CB 3.35Å; R262-E266 WeakPolarHBondContact O-CG 3.5Å; R262-E266 PolarHBondContact O-N 3.3Å
263	Q	94	Very high	92.2	Very high	111 Å²	111	57.2 Å²	57.2	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-32.4	177.4	-75.2	179.1	-22.2	0	0	112.8	K259 M260 G267	K259-Q263 VanDerWaalsContact CE-NE2 3.31Å; K259-Q263 HydrophobicContact CG-CG 4.42Å; K259-Q263 WeakPolarHBondContact O-CB 3.33Å; K259-Q263 VanDerWaalsContact O-CG 3.27Å; K259-Q263 WeakPolarHBondContact O-CG 3.39Å; K259-Q263 PolarHBondContact O-N 2.88Å; M260-Q263 PolarHBondContact O-N 3.2Å; Q263-G267 WeakPolarHBondContact O-CA 3.47Å; Q263-G267 PolarHBondContact O-N 3.34Å
264	R	92.7	Very high	91.7	Very high	65 Å²	65	65.6 Å²	65.6	25%	0.245	32%	0.319	C	S	.	.	H	α-helix	trans	-69.4	-44.2	173.7	-71.2	-178.5	80.7	92.2	-2.4	111.9	E202 M260 V261 R262 N268 D294	E202-R264 IonicContact OE1-NH1 3.23Å; E202-R264 PolarHBondContact OE1-NH1 3.15Å; M260-R264 WeakPolarHBondContact O-CG 3.32Å; M260-R264 PolarHBondContact O-N 3.31Å; M260-R264 HydrophobicContact SD-CG 4.31Å; V261-R264 PolarHBondContact O-N 3.36Å; R262-R264 VanDerWaalsContact C-N 3.26Å; R262-R264 PolarHBondContact O-N 3.44Å; R264-N268 PolarHBondContact O-N 3.49Å; R264-N268 PolarHBondContact O-ND2 3.27Å; R264-N268 PolarHBondContact O-OD1 2.79Å; R264-D294 IonicContact CZ-OD1 2.84Å; R264-D294 IonicContact CZ-OD2 2.89Å; R264-D294 IonicContact NE-OD1 3.75Å; R264-D294 IonicContact NE-OD2 3.46Å; R264-D294 PolarHBondContact NE-OD2 3.39Å; R264-D294 IonicContact NH2-OD1 2.79Å; R264-D294 PolarHBondContact NH2-OD1 2.9Å; R264-D294 IonicContact NH2-OD2 2.7Å; R264-D294 PolarHBondContact NH2-OD2 2.94Å
265	V	92.9	Very high	91.2	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.012	34%	0.342	C	S	.	.	H	α-helix	trans	-65.3	-44.8	178.3	175.8	0	0	0	0	111.2	V261 R262 Y283 I287 Y320 A323 I324	V261-V265 WeakPolarHBondContact O-CG2 3.26Å; V261-V265 PolarHBondContact O-N 2.92Å; V261-V265 VanDerWaalsContact O-N 3.07Å; R262-V265 PolarHBondContact O-N 2.91Å; V265-Y283 WeakPolarHBondContact O-CE2 3.47Å; V265-Y283 PolarHBondContact O-OH 3.06Å; V265-I287 HydrophobicContact CG1-CD1 4.46Å; V265-Y320 HydrophobicContact CG2-CD1 4.04Å; V265-Y320 HydrophobicContact CG2-CE1 4.33Å; V265-A323 HydrophobicContact CB-CB 4.35Å; V265-A323 HydrophobicContact CG2-CB 4.02Å; V265-I324 HydrophobicContact CG1-CG1 4.15Å; V265-I324 HydrophobicContact CG2-CG1 4.2Å
266	E	91.3	Very high	90.8	Very high	91 Å²	91	69 Å²	69	43%	0.425	34%	0.336	S	S	.	.	H	α-helix	trans	-69.1	-43.6	177.5	-69.9	170.2	-173.5	0	0	111.7	R262 N268 Q269	R262-E266 WeakPolarHBondContact CD-OE1 3.41Å; R262-E266 HydrophobicContact CG-CG 4.44Å; R262-E266 WeakPolarHBondContact CG-OE1 3.39Å; R262-E266 WeakPolarHBondContact O-CB 3.35Å; R262-E266 WeakPolarHBondContact O-CG 3.5Å; R262-E266 PolarHBondContact O-N 3.3Å; E266-N268 PolarHBondContact O-N 3.49Å; E266-Q269 WeakPolarHBondContact O-CB 3.47Å; E266-Q269 PolarHBondContact O-N 3.06Å
267	G	90	Very high	90.2	Very high	47 Å²	47	74.7 Å²	74.7	49%	0.485	36%	0.359	S	S	.	.	H	α-helix	trans	-67.7	-14.9	-178.2	0	0	0	0	0	114.9	Q263 Q269	Q263-G267 WeakPolarHBondContact O-CA 3.47Å; Q263-G267 PolarHBondContact O-N 3.34Å; G267-Q269 PolarHBondContact O-N 3.17Å
268	N	88.1	Confident	89.7	Confident	28 Å²	28	79.8 Å²	79.8	15%	0.15	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-14	171.1	-76.2	-23.7	0	0	0	113	R264 E266 L270 Y283 L286 I287 T290	R264-N268 PolarHBondContact O-N 3.49Å; R264-N268 PolarHBondContact O-ND2 3.27Å; R264-N268 PolarHBondContact O-OD1 2.79Å; E266-N268 PolarHBondContact O-N 3.49Å; N268-L270 PolarHBondContact O-N 3.05Å; N268-L270 VanDerWaalsContact O-N 3.13Å; N268-Y283 HydrophobicContact CB-CD2 4.17Å; N268-Y283 HydrophobicContact CB-CE2 3.83Å; N268-L286 HydrophobicContact CB-CB 4.33Å; N268-L286 WeakPolarHBondContact O-CD1 3.29Å; N268-I287 HydrophobicContact CB-CG1 4.35Å; N268-T290 PolarHBondContact ND2-OG1 3.08Å
269	Q	87.4	Confident	89.6	Confident	55 Å²	55	77.4 Å²	77.4	26%	0.257	37%	0.371	S	S	.	.			trans	-82	92	175.5	-171.9	172.8	-16.8	0	0	110.3	E266 G267 E271 W279 Y283	E266-Q269 WeakPolarHBondContact O-CB 3.47Å; E266-Q269 PolarHBondContact O-N 3.06Å; G267-Q269 PolarHBondContact O-N 3.17Å; Q269-E271 VanDerWaalsContact CG-O 3.3Å; Q269-E271 WeakPolarHBondContact CG-O 3.35Å; Q269-E271 PolarHBondContact NE2-O 3.38Å; Q269-W279 HydrophobicContact CG-CE3 4.45Å; Q269-W279 HydrophobicContact CG-CZ3 4.37Å; Q269-Y283 VanDerWaalsContact CA-CD2 3.43Å; Q269-Y283 HydrophobicContact CB-CD2 3.6Å; Q269-Y283 HydrophobicContact CB-CE2 3.56Å; Q269-Y283 HydrophobicContact CB-CG 4.29Å; Q269-Y283 HydrophobicContact CG-CD2 4.21Å; Q269-Y283 HydrophobicContact CG-CG 4.45Å; Q269-Y283 VanDerWaalsContact N-CE2 3.33Å
270	L	84.8	Confident	89.4	Confident	131 Å²	131	71.5 Å²	71.5	69%	0.686	35%	0.345	S	S	*	.			trans	-87.1	-19.4	-179.9	-56.8	178.2	0	0	0	113.2	N268 L286	N268-L270 PolarHBondContact O-N 3.05Å; N268-L270 VanDerWaalsContact O-N 3.13Å; L270-L286 HydrophobicContact CD1-CD1 4.05Å; L270-L286 HydrophobicContact CG-CD1 4.43Å
271	E	86.6	Confident	89.1	Confident	46 Å²	46	72.6 Å²	72.6	22%	0.215	36%	0.356	C	S	.	.			trans	-134.4	155.4	-170.6	-66	165.3	-164.5	0	0	110	Q269 L275 H276 W279 R282	Q269-E271 VanDerWaalsContact CG-O 3.3Å; Q269-E271 WeakPolarHBondContact CG-O 3.35Å; Q269-E271 PolarHBondContact NE2-O 3.38Å; E271-L275 HydrophobicContact CB-CB 4.46Å; E271-H276 WeakPolarHBondContact OE2-CB 3.28Å; E271-H276 IonicContact OE2-CG 3.84Å; E271-W279 HydrophobicContact CB-CB 4.12Å; E271-R282 VanDerWaalsContact CD-NE 3.34Å; E271-R282 IonicContact OE1-CZ 2.77Å; E271-R282 IonicContact OE1-NE 3.44Å; E271-R282 PolarHBondContact OE1-NE 2.98Å; E271-R282 VanDerWaalsContact OE1-NE 3.12Å; E271-R282 IonicContact OE1-NH2 3.94Å; E271-R282 PolarHBondContact OE1-NH2 2.67Å; E271-R282 VanDerWaalsContact OE2-CD 3.27Å; E271-R282 WeakPolarHBondContact OE2-CD 3.48Å; E271-R282 IonicContact OE2-CZ 2.67Å; E271-R282 IonicContact OE2-NE 3.4Å; E271-R282 PolarHBondContact OE2-NE 2.9Å; E271-R282 IonicContact OE2-NH2 2.69Å
272	D	85	Confident	88.9	Confident	68 Å²	68	78.4 Å²	78.4	36%	0.364	38%	0.377	S	S	.	.			trans	-122.9	179.5	170.5	68.7	10.4	0	0	0	110.4	M274 L275 H276 W279	D272-M274 PolarHBondContact O-N 3.36Å; D272-M274 VanDerWaalsContact O-N 3.17Å; D272-M274 WeakPolarHBondContact OD1-CA 3.36Å; D272-M274 WeakPolarHBondContact OD1-CB 3.48Å; D272-M274 PolarHBondContact OD1-N 2.91Å; D272-L275 PolarHBondContact O-N 3.44Å; D272-L275 VanDerWaalsContact O-N 3.11Å; D272-L275 WeakPolarHBondContact OD1-CG 3.46Å; D272-L275 PolarHBondContact OD1-N 3.41Å; D272-H276 PolarHBondContact O-N 3.36Å; D272-W279 VanDerWaalsContact C-CG 3.49Å; D272-W279 WeakPolarHBondContact O-CB 3.2Å
273	R	84.8	Confident	88.8	Confident	94 Å²	94	73.8 Å²	73.8	36%	0.355	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.5	178.8	-167.1	-174	-67.2	164.1	0.1	113.2	N335 E337 E340	R273-N335 PolarHBondContact NH2-O 2.69Å; R273-E337 WeakPolarHBondContact CD-OE1 3.44Å; R273-E337 IonicContact NE-OE1 2.92Å; R273-E340 IonicContact CZ-OE1 3.16Å; R273-E340 IonicContact CZ-OE2 2.82Å; R273-E340 IonicContact NE-OE1 3.28Å; R273-E340 PolarHBondContact NE-OE1 2.67Å; R273-E340 IonicContact NE-OE2 2.79Å; R273-E340 IonicContact NH2-OE1 2.72Å; R273-E340 PolarHBondContact NH2-OE1 2.89Å; R273-E340 IonicContact NH2-OE2 3.4Å; R273-E340 PolarHBondContact NH2-OE2 3.38Å
274	M	84.4	Confident	88.7	Confident	177 Å²	177	68.6 Å²	68.6	87%	0.872	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-32	-179.8	-61.9	-65.3	-177.5	0	0	111.8	D272	D272-M274 PolarHBondContact O-N 3.36Å; D272-M274 VanDerWaalsContact O-N 3.17Å; D272-M274 WeakPolarHBondContact OD1-CA 3.36Å; D272-M274 WeakPolarHBondContact OD1-CB 3.48Å; D272-M274 PolarHBondContact OD1-N 2.91Å
275	L	87.5	Confident	88.7	Confident	128 Å²	128	69.1 Å²	69.1	67%	0.67	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-39.6	-179.6	-67.8	170.7	0	0	0	112.9	E271 D272	E271-L275 HydrophobicContact CB-CB 4.46Å; D272-L275 PolarHBondContact O-N 3.44Å; D272-L275 VanDerWaalsContact O-N 3.11Å; D272-L275 WeakPolarHBondContact OD1-CG 3.46Å; D272-L275 PolarHBondContact OD1-N 3.41Å
276	H	86.5	Confident	88.7	Confident	70 Å²	70	72 Å²	72	32%	0.324	36%	0.356	S	S	.	.			trans	-147.9	129.9	-177	-160	-89.3	0	0	0	112.3	E271 D272 E278 W279	E271-H276 WeakPolarHBondContact OE2-CB 3.28Å; E271-H276 IonicContact OE2-CG 3.84Å; D272-H276 PolarHBondContact O-N 3.36Å; H276-E278 PolarHBondContact ND1-N 3.31Å; H276-E278 VanDerWaalsContact ND1-N 3.15Å; H276-E278 PolarHBondContact O-N 3.21Å; H276-E278 VanDerWaalsContact O-N 3.11Å; H276-W279 HydrophobicContact CB-CB 4.48Å; H276-W279 WeakPolarHBondContact O-CB 3.44Å; H276-W279 PolarHBondContact O-N 3.07Å; H276-W279 VanDerWaalsContact O-N 3.07Å
277	K	83.8	Confident	88.9	Confident	152 Å²	152	67.8 Å²	67.8	66%	0.661	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.5	-179.9	-171.5	179.1	179.8	-176.9	0	113.2	N339	K277-N339 PolarHBondContact O-ND2 3.47Å; K277-N339 VanDerWaalsContact O-ND2 3.09Å
278	E	86.9	Confident	89	Confident	106 Å²	106	68 Å²	68	50%	0.495	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	29	-179.9	-53.7	180	157.3	0	0	112.8	H276 L280 A281 R282	H276-E278 PolarHBondContact ND1-N 3.31Å; H276-E278 VanDerWaalsContact ND1-N 3.15Å; H276-E278 PolarHBondContact O-N 3.21Å; H276-E278 VanDerWaalsContact O-N 3.11Å; E278-L280 PolarHBondContact O-N 3.31Å; E278-A281 HydrophobicContact CB-CB 4.46Å; E278-A281 PolarHBondContact O-N 2.84Å; E278-R282 PolarHBondContact O-N 3.1Å
279	W	93.4	Very high	89.2	Confident	19 Å²	19	70.7 Å²	70.7	7%	0.072	34%	0.336	C	S	.	.	H	α-helix	trans	-51.9	-39.1	-179.5	73.2	-81.4	0	0	0	112.3	Q269 E271 D272 H276 R282 Y283 E340	Q269-W279 HydrophobicContact CG-CE3 4.45Å; Q269-W279 HydrophobicContact CG-CZ3 4.37Å; E271-W279 HydrophobicContact CB-CB 4.12Å; D272-W279 VanDerWaalsContact C-CG 3.49Å; D272-W279 WeakPolarHBondContact O-CB 3.2Å; H276-W279 HydrophobicContact CB-CB 4.48Å; H276-W279 WeakPolarHBondContact O-CB 3.44Å; H276-W279 PolarHBondContact O-N 3.07Å; H276-W279 VanDerWaalsContact O-N 3.07Å; W279-R282 PolarHBondContact O-N 2.95Å; W279-Y283 VanDerWaalsContact O-CB 3.28Å; W279-Y283 WeakPolarHBondContact O-CB 3.35Å; W279-Y283 PolarHBondContact O-N 3.24Å; W279-E340 PolarHBondContact NE1-OE1 2.85Å
280	L	91	Very high	89.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-68.7	-43.8	-177.3	-178.8	62.3	0	0	0	111.9	E278 R282 Y283 L284 I331 E340 Q343 L344	E278-L280 PolarHBondContact O-N 3.31Å; L280-R282 VanDerWaalsContact C-N 3.34Å; L280-R282 PolarHBondContact O-N 3.24Å; L280-Y283 HydrophobicContact CD1-CD1 4.31Å; L280-Y283 PolarHBondContact O-N 3.06Å; L280-L284 HydrophobicContact CD1-CD1 3.88Å; L280-L284 HydrophobicContact CD1-CD2 4.45Å; L280-L284 HydrophobicContact CD1-CG 3.92Å; L280-L284 HydrophobicContact CG-CD1 3.81Å; L280-L284 HydrophobicContact CG-CG 4.28Å; L280-L284 VanDerWaalsContact O-CB 3.3Å; L280-L284 WeakPolarHBondContact O-CB 3.24Å; L280-L284 WeakPolarHBondContact O-CG 3.38Å; L280-L284 PolarHBondContact O-N 3.47Å; L280-I331 HydrophobicContact CD1-CD1 3.94Å; L280-I331 HydrophobicContact CD1-CG2 4.02Å; L280-I331 HydrophobicContact CD2-CG2 4.23Å; L280-E340 HydrophobicContact CD2-CB 3.84Å; L280-E340 HydrophobicContact CD2-CG 4.4Å; L280-E340 WeakPolarHBondContact CD2-O 3.44Å; L280-Q343 HydrophobicContact CD2-CB 4.45Å; L280-L344 HydrophobicContact CD2-CB 4.25Å
281	A	89.5	Confident	89.9	Confident	34 Å²	34	63.5 Å²	63.5	28%	0.281	30%	0.301	S	S	.	.	H	α-helix	trans	-58.4	-45.4	173.2	0	0	0	0	0	112	E278 L284 E285 Q343	E278-A281 HydrophobicContact CB-CB 4.46Å; E278-A281 PolarHBondContact O-N 2.84Å; A281-L284 PolarHBondContact O-N 3.31Å; A281-E285 VanDerWaalsContact O-CB 3.31Å; A281-E285 WeakPolarHBondContact O-CB 3.29Å; A281-E285 PolarHBondContact O-N 2.71Å; A281-Q343 HydrophobicContact CB-CB 4.5Å; A281-Q343 HydrophobicContact CB-CG 3.91Å
282	R	91.5	Very high	90.2	Very high	121 Å²	121	62.1 Å²	62.1	46%	0.457	30%	0.296	S	S	.	.	H	α-helix	trans	-64.2	-43.6	179	-68.5	170.3	62.1	88	-2.8	111.3	E271 E278 W279 L280 E285 L286	E271-R282 VanDerWaalsContact CD-NE 3.34Å; E271-R282 IonicContact OE1-CZ 2.77Å; E271-R282 IonicContact OE1-NE 3.44Å; E271-R282 PolarHBondContact OE1-NE 2.98Å; E271-R282 VanDerWaalsContact OE1-NE 3.12Å; E271-R282 IonicContact OE1-NH2 3.94Å; E271-R282 PolarHBondContact OE1-NH2 2.67Å; E271-R282 VanDerWaalsContact OE2-CD 3.27Å; E271-R282 WeakPolarHBondContact OE2-CD 3.48Å; E271-R282 IonicContact OE2-CZ 2.67Å; E271-R282 IonicContact OE2-NE 3.4Å; E271-R282 PolarHBondContact OE2-NE 2.9Å; E271-R282 IonicContact OE2-NH2 2.69Å; E278-R282 PolarHBondContact O-N 3.1Å; W279-R282 PolarHBondContact O-N 2.95Å; L280-R282 VanDerWaalsContact C-N 3.34Å; L280-R282 PolarHBondContact O-N 3.24Å; R282-E285 PolarHBondContact O-N 2.9Å; R282-L286 WeakPolarHBondContact O-CG 3.49Å; R282-L286 PolarHBondContact O-N 3.17Å
283	Y	93.3	Very high	90.6	Very high	5 Å²	5	62.1 Å²	62.1	2%	0.02	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-50.1	176.1	174.4	-124.4	0	0	0	112.3	V265 N268 Q269 W279 L280 E285 L286 I287 R327 I331	V265-Y283 WeakPolarHBondContact O-CE2 3.47Å; V265-Y283 PolarHBondContact O-OH 3.06Å; N268-Y283 HydrophobicContact CB-CD2 4.17Å; N268-Y283 HydrophobicContact CB-CE2 3.83Å; Q269-Y283 VanDerWaalsContact CA-CD2 3.43Å; Q269-Y283 HydrophobicContact CB-CD2 3.6Å; Q269-Y283 HydrophobicContact CB-CE2 3.56Å; Q269-Y283 HydrophobicContact CB-CG 4.29Å; Q269-Y283 HydrophobicContact CG-CD2 4.21Å; Q269-Y283 HydrophobicContact CG-CG 4.45Å; Q269-Y283 VanDerWaalsContact N-CE2 3.33Å; W279-Y283 VanDerWaalsContact O-CB 3.28Å; W279-Y283 WeakPolarHBondContact O-CB 3.35Å; W279-Y283 PolarHBondContact O-N 3.24Å; L280-Y283 HydrophobicContact CD1-CD1 4.31Å; L280-Y283 PolarHBondContact O-N 3.06Å; Y283-E285 VanDerWaalsContact C-N 3.31Å; Y283-E285 PolarHBondContact O-N 3.35Å; Y283-L286 PolarHBondContact O-N 3.35Å; Y283-I287 HydrophobicContact CD1-CD1 3.9Å; Y283-I287 HydrophobicContact CD2-CD1 4.13Å; Y283-I287 HydrophobicContact CD2-CG1 4.35Å; Y283-I287 HydrophobicContact CE1-CD1 3.36Å; Y283-I287 HydrophobicContact CE1-CG1 4.48Å; Y283-I287 HydrophobicContact CE2-CD1 3.62Å; Y283-I287 HydrophobicContact CE2-CG1 3.9Å; Y283-I287 HydrophobicContact CG-CD1 4.27Å; Y283-I287 WeakPolarHBondContact O-CG1 3.43Å; Y283-I287 PolarHBondContact O-N 2.82Å; Y283-I287 WeakPolarHBondContact OH-CD1 3.44Å; Y283-R327 HydrophobicContact CE1-CG 4.14Å; Y283-R327 WeakPolarHBondContact OH-CG 3.37Å; Y283-I331 HydrophobicContact CD1-CD1 4.24Å; Y283-I331 HydrophobicContact CE1-CD1 3.9Å
284	L	92.5	Very high	91	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-66	-33.7	-179	-70.5	176.2	0	0	0	112.3	L280 A281 I287 R288 L328 W347	L280-L284 HydrophobicContact CD1-CD1 3.88Å; L280-L284 HydrophobicContact CD1-CD2 4.45Å; L280-L284 HydrophobicContact CD1-CG 3.92Å; L280-L284 HydrophobicContact CG-CD1 3.81Å; L280-L284 HydrophobicContact CG-CG 4.28Å; L280-L284 VanDerWaalsContact O-CB 3.3Å; L280-L284 WeakPolarHBondContact O-CB 3.24Å; L280-L284 WeakPolarHBondContact O-CG 3.38Å; L280-L284 PolarHBondContact O-N 3.47Å; A281-L284 PolarHBondContact O-N 3.31Å; L284-I287 HydrophobicContact CD2-CD1 4.29Å; L284-I287 PolarHBondContact O-N 3.34Å; L284-R288 WeakPolarHBondContact O-CB 3.21Å; L284-R288 PolarHBondContact O-N 3.14Å; L284-L328 HydrophobicContact CD2-CD2 3.69Å; L284-W347 VanDerWaalsContact CB-CD1 3.5Å; L284-W347 HydrophobicContact CB-CD2 4.25Å; L284-W347 HydrophobicContact CB-CG 3.86Å; L284-W347 HydrophobicContact CD1-CB 3.78Å; L284-W347 HydrophobicContact CD1-CD2 4.44Å; L284-W347 HydrophobicContact CD1-CG 3.91Å; L284-W347 HydrophobicContact CD2-CD2 3.97Å; L284-W347 HydrophobicContact CD2-CE3 4.27Å; L284-W347 HydrophobicContact CD2-CG 4.25Å; L284-W347 HydrophobicContact CD2-CZ2 4.47Å; L284-W347 HydrophobicContact CG-CD2 4.45Å; L284-W347 HydrophobicContact CG-CG 4.23Å; L284-W347 PolarHBondContact O-NE1 3.24Å
285	E	92.5	Very high	91.5	Very high	77 Å²	77	49.3 Å²	49.3	36%	0.36	24%	0.238	S	C	.	.	H	α-helix	trans	-69.3	-40.8	173.8	-179	59.3	-171	0	0	112.2	A281 R282 Y283 R288 I289	A281-E285 VanDerWaalsContact O-CB 3.31Å; A281-E285 WeakPolarHBondContact O-CB 3.29Å; A281-E285 PolarHBondContact O-N 2.71Å; R282-E285 PolarHBondContact O-N 2.9Å; Y283-E285 VanDerWaalsContact C-N 3.31Å; Y283-E285 PolarHBondContact O-N 3.35Å; E285-R288 WeakPolarHBondContact O-CB 3.36Å; E285-R288 PolarHBondContact O-N 3.48Å; E285-R288 IonicContact OE1-CZ 2.71Å; E285-R288 IonicContact OE1-NE 2.85Å; E285-R288 PolarHBondContact OE1-NE 2.93Å; E285-R288 IonicContact OE1-NH2 3.4Å; E285-R288 PolarHBondContact OE1-NH2 3.48Å; E285-R288 IonicContact OE2-CZ 3.76Å; E285-R288 IonicContact OE2-NE 2.78Å; E285-R288 PolarHBondContact OE2-NE 3.25Å; E285-R288 IonicContact OE2-NH2 3.49Å; E285-I289 HydrophobicContact CG-CD1 4.19Å; E285-I289 WeakPolarHBondContact O-CG1 3.47Å; E285-I289 PolarHBondContact O-N 2.97Å
286	L	93.1	Very high	91.8	Very high	62 Å²	62	44 Å²	44	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-61.8	-43.2	172.7	-73.4	171.6	0	0	0	111.5	N268 L270 R282 Y283 R288 I289 T290	N268-L286 HydrophobicContact CB-CB 4.33Å; N268-L286 WeakPolarHBondContact O-CD1 3.29Å; L270-L286 HydrophobicContact CD1-CD1 4.05Å; L270-L286 HydrophobicContact CG-CD1 4.43Å; R282-L286 WeakPolarHBondContact O-CG 3.49Å; R282-L286 PolarHBondContact O-N 3.17Å; Y283-L286 PolarHBondContact O-N 3.35Å; L286-R288 VanDerWaalsContact C-N 3.34Å; L286-R288 PolarHBondContact O-N 3.32Å; L286-I289 PolarHBondContact O-N 2.96Å; L286-T290 WeakPolarHBondContact O-CB 3.36Å; L286-T290 VanDerWaalsContact O-CG2 3.23Å; L286-T290 WeakPolarHBondContact O-CG2 3.37Å; L286-T290 PolarHBondContact O-N 3.04Å; L286-T290 PolarHBondContact O-OG1 3.48Å
287	I	93.8	Very high	92.1	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-57.5	-48.1	172.4	-68.9	165.2	0	0	0	110.4	V265 N268 Y283 L284 I289 T290 V291 I324 W347 M356	V265-I287 HydrophobicContact CG1-CD1 4.46Å; N268-I287 HydrophobicContact CB-CG1 4.35Å; Y283-I287 HydrophobicContact CD1-CD1 3.9Å; Y283-I287 HydrophobicContact CD2-CD1 4.13Å; Y283-I287 HydrophobicContact CD2-CG1 4.35Å; Y283-I287 HydrophobicContact CE1-CD1 3.36Å; Y283-I287 HydrophobicContact CE1-CG1 4.48Å; Y283-I287 HydrophobicContact CE2-CD1 3.62Å; Y283-I287 HydrophobicContact CE2-CG1 3.9Å; Y283-I287 HydrophobicContact CG-CD1 4.27Å; Y283-I287 WeakPolarHBondContact O-CG1 3.43Å; Y283-I287 PolarHBondContact O-N 2.82Å; Y283-I287 WeakPolarHBondContact OH-CD1 3.44Å; L284-I287 HydrophobicContact CD2-CD1 4.29Å; L284-I287 PolarHBondContact O-N 3.34Å; I287-I289 PolarHBondContact O-N 3.01Å; I287-T290 WeakPolarHBondContact CA-OG1 3.46Å; I287-T290 PolarHBondContact O-N 3.45Å; I287-T290 PolarHBondContact O-OG1 2.83Å; I287-V291 HydrophobicContact CG2-CG2 3.76Å; I287-V291 VanDerWaalsContact O-CB 3.26Å; I287-V291 WeakPolarHBondContact O-CB 3.37Å; I287-V291 WeakPolarHBondContact O-CG2 3.34Å; I287-V291 PolarHBondContact O-N 2.9Å; I287-I324 HydrophobicContact CG2-CD1 4.01Å; I287-I324 HydrophobicContact CG2-CG1 4.1Å; I287-W347 HydrophobicContact CB-CZ2 4.44Å; I287-W347 HydrophobicContact CG2-CH2 4.36Å; I287-W347 HydrophobicContact CG2-CZ2 3.99Å; I287-M356 HydrophobicContact CG2-CE 4.29Å
288	R	93.3	Very high	92.5	Very high	51 Å²	51	34 Å²	34	19%	0.192	17%	0.168	C	C	.	.	H	α-helix	trans	-55.9	-50	-178.7	-170.5	-168.2	66.6	75.3	-1.3	111.5	L284 E285 L286 V292 D355 M356	L284-R288 WeakPolarHBondContact O-CB 3.21Å; L284-R288 PolarHBondContact O-N 3.14Å; E285-R288 WeakPolarHBondContact O-CB 3.36Å; E285-R288 PolarHBondContact O-N 3.48Å; E285-R288 IonicContact OE1-CZ 2.71Å; E285-R288 IonicContact OE1-NE 2.85Å; E285-R288 PolarHBondContact OE1-NE 2.93Å; E285-R288 IonicContact OE1-NH2 3.4Å; E285-R288 PolarHBondContact OE1-NH2 3.48Å; E285-R288 IonicContact OE2-CZ 3.76Å; E285-R288 IonicContact OE2-NE 2.78Å; E285-R288 PolarHBondContact OE2-NE 3.25Å; E285-R288 IonicContact OE2-NH2 3.49Å; L286-R288 VanDerWaalsContact C-N 3.34Å; L286-R288 PolarHBondContact O-N 3.32Å; R288-V292 WeakPolarHBondContact O-CG2 3.28Å; R288-V292 PolarHBondContact O-N 3.31Å; R288-D355 PolarHBondContact NH1-O 3.13Å; R288-M356 HydrophobicContact CB-SD 4.49Å; R288-M356 HydrophobicContact CG-CB 4.06Å; R288-M356 HydrophobicContact CG-CG 4.1Å; R288-M356 HydrophobicContact CG-SD 4.17Å
289	I	92.1	Very high	92.8	Very high	86 Å²	86	32.2 Å²	32.2	44%	0.441	16%	0.159	S	C	.	.	H	α-helix	trans	-66.8	-49.5	-178.5	-64.2	168.2	0	0	0	111	E285 L286 I287 D293	E285-I289 HydrophobicContact CG-CD1 4.19Å; E285-I289 WeakPolarHBondContact O-CG1 3.47Å; E285-I289 PolarHBondContact O-N 2.97Å; L286-I289 PolarHBondContact O-N 2.96Å; I287-I289 PolarHBondContact O-N 3.01Å; I289-D293 WeakPolarHBondContact O-CB 3.14Å; I289-D293 PolarHBondContact O-N 3.21Å; I289-D293 VanDerWaalsContact O-N 3.14Å
290	T	92.6	Very high	92.6	Very high	32 Å²	32	39.9 Å²	39.9	20%	0.196	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-42.6	-174	53	0	0	0	0	112.6	N268 L286 I287 D293 D294	N268-T290 PolarHBondContact ND2-OG1 3.08Å; L286-T290 WeakPolarHBondContact O-CB 3.36Å; L286-T290 VanDerWaalsContact O-CG2 3.23Å; L286-T290 WeakPolarHBondContact O-CG2 3.37Å; L286-T290 PolarHBondContact O-N 3.04Å; L286-T290 PolarHBondContact O-OG1 3.48Å; I287-T290 WeakPolarHBondContact CA-OG1 3.46Å; I287-T290 PolarHBondContact O-N 3.45Å; I287-T290 PolarHBondContact O-OG1 2.83Å; T290-D293 PolarHBondContact O-N 3.44Å; T290-D294 VanDerWaalsContact O-CB 3.27Å; T290-D294 WeakPolarHBondContact O-CB 3.23Å; T290-D294 PolarHBondContact O-N 2.9Å
291	V	93.6	Very high	92.5	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-42.3	-178.8	173.9	0	0	0	0	111.3	I287 D294 L295 Y320 I324 M356	I287-V291 HydrophobicContact CG2-CG2 3.76Å; I287-V291 VanDerWaalsContact O-CB 3.26Å; I287-V291 WeakPolarHBondContact O-CB 3.37Å; I287-V291 WeakPolarHBondContact O-CG2 3.34Å; I287-V291 PolarHBondContact O-N 2.9Å; V291-D294 PolarHBondContact O-N 3.16Å; V291-L295 HydrophobicContact CG1-CD1 3.85Å; V291-L295 HydrophobicContact CG1-CG 4.28Å; V291-L295 WeakPolarHBondContact O-CB 3.21Å; V291-L295 VanDerWaalsContact O-CG 3.29Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 3.48Å; V291-Y320 HydrophobicContact CB-CD1 4.36Å; V291-Y320 HydrophobicContact CG1-CD1 4Å; V291-Y320 HydrophobicContact CG1-CG 4.14Å; V291-Y320 HydrophobicContact CG2-CD1 3.72Å; V291-Y320 HydrophobicContact CG2-CE1 3.97Å; V291-I324 HydrophobicContact CG1-CD1 4.35Å; V291-I324 HydrophobicContact CG2-CD1 4Å; V291-M356 HydrophobicContact CB-CE 4.39Å; V291-M356 HydrophobicContact CG1-CE 4.36Å
292	V	93	Very high	92.7	Very high	18 Å²	18	39.1 Å²	39.1	11%	0.109	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-45.6	177.3	173.4	0	0	0	0	110.6	R288 C296 M356 H359	R288-V292 WeakPolarHBondContact O-CG2 3.28Å; R288-V292 PolarHBondContact O-N 3.31Å; V292-C296 WeakPolarHBondContact O-CB 3.23Å; V292-C296 PolarHBondContact O-N 3.04Å; V292-C296 PolarHBondContact O-SG 3.4Å; V292-M356 HydrophobicContact CG2-CB 4.49Å; V292-M356 HydrophobicContact CG2-CG 4.19Å; V292-H359 HydrophobicContact CG1-CB 4.37Å
293	D	93	Very high	92.7	Very high	67 Å²	67	37.2 Å²	37.2	36%	0.358	18%	0.181	S	C	.	.	H	α-helix	trans	-65	-44.1	178.4	-179.3	37.9	0	0	0	111.6	R205 I289 T290 C296 V297	R205-D293 IonicContact CZ-OD1 3.63Å; R205-D293 IonicContact CZ-OD2 3.82Å; R205-D293 VanDerWaalsContact NH1-CG 3.25Å; R205-D293 IonicContact NH1-OD1 3.27Å; R205-D293 PolarHBondContact NH1-OD1 2.95Å; R205-D293 IonicContact NH1-OD2 3.8Å; R205-D293 PolarHBondContact NH1-OD2 3.27Å; R205-D293 IonicContact NH2-OD1 2.77Å; R205-D293 IonicContact NH2-OD2 3.23Å; R205-D293 PolarHBondContact NH2-OD2 3.14Å; I289-D293 WeakPolarHBondContact O-CB 3.14Å; I289-D293 PolarHBondContact O-N 3.21Å; I289-D293 VanDerWaalsContact O-N 3.14Å; T290-D293 PolarHBondContact O-N 3.44Å; D293-C296 WeakPolarHBondContact O-CB 3.19Å; D293-C296 PolarHBondContact O-N 3.41Å; D293-V297 WeakPolarHBondContact O-CG2 3.48Å; D293-V297 PolarHBondContact O-N 2.78Å
294	D	94.3	Very high	92.6	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-60.4	-49.7	176.2	-74.6	-18.8	0	0	0	111.6	L201 R205 R264 T290 V291 C296 V297 V298 Y320	L201-D294 HydrophobicContact CD1-CB 4.16Å; R205-D294 IonicContact CZ-OD1 3.89Å; R205-D294 IonicContact NE-OD1 3.81Å; R205-D294 IonicContact NH2-OD1 3.35Å; R205-D294 PolarHBondContact NH2-OD1 2.87Å; R264-D294 IonicContact CZ-OD1 2.84Å; R264-D294 IonicContact CZ-OD2 2.89Å; R264-D294 IonicContact NE-OD1 3.75Å; R264-D294 IonicContact NE-OD2 3.46Å; R264-D294 PolarHBondContact NE-OD2 3.39Å; R264-D294 IonicContact NH2-OD1 2.79Å; R264-D294 PolarHBondContact NH2-OD1 2.9Å; R264-D294 IonicContact NH2-OD2 2.7Å; R264-D294 PolarHBondContact NH2-OD2 2.94Å; T290-D294 VanDerWaalsContact O-CB 3.27Å; T290-D294 WeakPolarHBondContact O-CB 3.23Å; T290-D294 PolarHBondContact O-N 2.9Å; V291-D294 PolarHBondContact O-N 3.16Å; D294-C296 VanDerWaalsContact C-N 3.3Å; D294-C296 PolarHBondContact O-N 2.84Å; D294-V297 CarbonylContact O-C 3.56Å; D294-V297 WeakPolarHBondContact O-CA 3.15Å; D294-V297 WeakPolarHBondContact O-CB 3.36Å; D294-V297 PolarHBondContact O-N 2.92Å; D294-V298 WeakPolarHBondContact O-CG2 3.32Å; D294-V298 PolarHBondContact O-N 2.88Å; D294-Y320 HydrophobicContact CB-CE2 4.19Å; D294-Y320 WeakPolarHBondContact CB-OH 3.13Å; D294-Y320 PolarHBondContact OD2-OH 3.38Å
295	L	94.6	Very high	92.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-64	-34.7	178.3	-70.1	175.3	0	0	0	112.2	V291 V297 V298 K299 F316 L317 Y320 L357 L362	V291-L295 HydrophobicContact CG1-CD1 3.85Å; V291-L295 HydrophobicContact CG1-CG 4.28Å; V291-L295 WeakPolarHBondContact O-CB 3.21Å; V291-L295 VanDerWaalsContact O-CG 3.29Å; V291-L295 WeakPolarHBondContact O-CG 3.36Å; V291-L295 PolarHBondContact O-N 3.48Å; L295-V297 VanDerWaalsContact C-N 3.32Å; L295-V298 PolarHBondContact O-N 2.88Å; L295-K299 WeakPolarHBondContact O-CB 3.46Å; L295-K299 PolarHBondContact O-N 3.4Å; L295-F316 HydrophobicContact CD2-CB 4.26Å; L295-L317 HydrophobicContact CD1-CD1 3.99Å; L295-Y320 HydrophobicContact CD2-CD2 3.76Å; L295-Y320 HydrophobicContact CD2-CE2 4.24Å; L295-Y320 HydrophobicContact CG-CD2 4.25Å; L295-L357 HydrophobicContact CD1-CD2 3.82Å; L295-L362 HydrophobicContact CB-CD1 4.42Å; L295-L362 HydrophobicContact CB-CD2 3.57Å; L295-L362 HydrophobicContact CD1-CD1 4.19Å
296	C	92.6	Very high	92.7	Very high	16 Å²	16	39.6 Å²	39.6	11%	0.108	20%	0.203	C	C	.	.	H	α-helix	trans	-64.1	-37.4	172.1	-73.4	0	0	0	0	112.1	V292 D293 D294 R300	V292-C296 WeakPolarHBondContact O-CB 3.23Å; V292-C296 PolarHBondContact O-N 3.04Å; V292-C296 PolarHBondContact O-SG 3.4Å; D293-C296 WeakPolarHBondContact O-CB 3.19Å; D293-C296 PolarHBondContact O-N 3.41Å; D294-C296 VanDerWaalsContact C-N 3.3Å; D294-C296 PolarHBondContact O-N 2.84Å; C296-R300 WeakPolarHBondContact O-CB 3.3Å; C296-R300 WeakPolarHBondContact O-CG 3.46Å; C296-R300 PolarHBondContact O-N 3.34Å; C296-R300 VanDerWaalsContact O-N 3.1Å; C296-R300 PolarHBondContact O-NE 2.65Å
297	V	92.8	Very high	92.7	Very high	12 Å²	12	38.2 Å²	38.2	7%	0.073	20%	0.198	C	C	.	.	H	α-helix	trans	-68.5	-43.9	174	166.4	0	0	0	0	111.5	L201 V204 R205 D293 D294 L295 K299 R300 G301	L201-V297 HydrophobicContact CD2-CG1 4.36Å; V204-V297 HydrophobicContact CB-CG1 4.31Å; V204-V297 HydrophobicContact CG1-CG1 3.9Å; R205-V297 HydrophobicContact CG-CB 4.39Å; R205-V297 HydrophobicContact CG-CG1 3.74Å; R205-V297 HydrophobicContact CG-CG2 3.82Å; R205-V297 VanDerWaalsContact CZ-CG2 3.49Å; D293-V297 WeakPolarHBondContact O-CG2 3.48Å; D293-V297 PolarHBondContact O-N 2.78Å; D294-V297 CarbonylContact O-C 3.56Å; D294-V297 WeakPolarHBondContact O-CA 3.15Å; D294-V297 WeakPolarHBondContact O-CB 3.36Å; D294-V297 PolarHBondContact O-N 2.92Å; L295-V297 VanDerWaalsContact C-N 3.32Å; V297-K299 VanDerWaalsContact C-N 3.29Å; V297-K299 PolarHBondContact O-N 3.03Å; V297-R300 PolarHBondContact O-N 3.36Å; V297-G301 PolarHBondContact O-N 2.82Å
298	V	93.9	Very high	92.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-56.3	-48.2	176.1	173.9	0	0	0	0	110.1	L201 D294 L295 R300 C302 I303 F313 F316	L201-V298 HydrophobicContact CD2-CG2 3.55Å; D294-V298 WeakPolarHBondContact O-CG2 3.32Å; D294-V298 PolarHBondContact O-N 2.88Å; L295-V298 PolarHBondContact O-N 2.88Å; V298-R300 PolarHBondContact O-N 3.39Å; V298-C302 HydrophobicContact CB-CB 4.37Å; V298-C302 HydrophobicContact CG1-CB 3.99Å; V298-C302 WeakPolarHBondContact O-CA 3.44Å; V298-C302 VanDerWaalsContact O-CB 3.29Å; V298-C302 WeakPolarHBondContact O-CB 3.34Å; V298-C302 PolarHBondContact O-N 3.06Å; V298-I303 PolarHBondContact O-N 3.25Å; V298-F313 HydrophobicContact CG1-CB 4.44Å; V298-F313 HydrophobicContact CG1-CD2 4.07Å; V298-F316 HydrophobicContact CB-CD2 4.36Å; V298-F316 HydrophobicContact CB-CG 4.47Å; V298-F316 HydrophobicContact CG1-CB 3.98Å; V298-F316 HydrophobicContact CG1-CD2 3.52Å; V298-F316 HydrophobicContact CG1-CE2 4.24Å; V298-F316 HydrophobicContact CG1-CG 3.91Å; V298-F316 HydrophobicContact CG2-CB 4.19Å; V298-F316 HydrophobicContact CG2-CD1 3.97Å; V298-F316 HydrophobicContact CG2-CD2 3.8Å; V298-F316 HydrophobicContact CG2-CE1 4.27Å; V298-F316 HydrophobicContact CG2-CE2 4.13Å; V298-F316 HydrophobicContact CG2-CG 3.72Å; V298-F316 HydrophobicContact CG2-CZ 4.34Å
299	K	91.6	Very high	92.5	Very high	69 Å²	69	47.7 Å²	47.7	30%	0.3	26%	0.259	S	S	.	.	I	π-helix	trans	-62.9	-43	-179.9	-165.7	169.6	-177.7	177.8	0	113	L295 V297 I303 F313 A361 L362	L295-K299 WeakPolarHBondContact O-CB 3.46Å; L295-K299 PolarHBondContact O-N 3.4Å; V297-K299 VanDerWaalsContact C-N 3.29Å; V297-K299 PolarHBondContact O-N 3.03Å; K299-I303 HydrophobicContact CG-CD1 4.14Å; K299-I303 WeakPolarHBondContact O-CD1 3.48Å; K299-F313 HydrophobicContact CB-CD2 3.82Å; K299-F313 HydrophobicContact CB-CE2 3.75Å; K299-F313 HydrophobicContact CD-CE2 4.07Å; K299-F313 HydrophobicContact CD-CZ 4.26Å; K299-F313 HydrophobicContact CG-CD2 4.23Å; K299-F313 HydrophobicContact CG-CE2 4.17Å; K299-A361 WeakPolarHBondContact CD-O 3.37Å; K299-A361 PolarHBondContact NZ-O 3.46Å; K299-L362 VanDerWaalsContact NZ-C 3.27Å; K299-L362 PolarHBondContact NZ-O 3.45Å
300	R	90.7	Very high	92.5	Very high	180 Å²	180	44.3 Å²	44.3	68%	0.679	24%	0.24	S	C	*	.	I	π-helix	trans	-78	-35.6	-176.1	-72.1	-177.4	-64.1	-159.7	2.3	113.6	C296 V297 V298	C296-R300 WeakPolarHBondContact O-CB 3.3Å; C296-R300 WeakPolarHBondContact O-CG 3.46Å; C296-R300 PolarHBondContact O-N 3.34Å; C296-R300 VanDerWaalsContact O-N 3.1Å; C296-R300 PolarHBondContact O-NE 2.65Å; V297-R300 PolarHBondContact O-N 3.36Å; V298-R300 PolarHBondContact O-N 3.39Å
301	G	89.3	Confident	92.6	Very high	19 Å²	19	48.2 Å²	48.2	20%	0.196	26%	0.256	C	S	.	.	I	π-helix	trans	-131.6	-19.5	-167.8	0	0	0	0	0	116.6	V297 C305	V297-G301 PolarHBondContact O-N 2.82Å; G301-C305 PolarHBondContact O-SG 2.74Å
302	C	92.4	Very high	92.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-79.9	-37.6	172.9	-64.7	0	0	0	0	111.4	V298 P304 C305 F306	V298-C302 HydrophobicContact CB-CB 4.37Å; V298-C302 HydrophobicContact CG1-CB 3.99Å; V298-C302 WeakPolarHBondContact O-CA 3.44Å; V298-C302 VanDerWaalsContact O-CB 3.29Å; V298-C302 WeakPolarHBondContact O-CB 3.34Å; V298-C302 PolarHBondContact O-N 3.06Å; C302-P304 VanDerWaalsContact C-N 3.35Å; C302-C305 PolarHBondContact O-N 3.46Å; C302-F306 HydrophobicContact CB-CD2 4.19Å; C302-F306 HydrophobicContact CB-CE2 4.17Å; C302-F306 WeakPolarHBondContact O-CD2 3.4Å; C302-F306 PolarHBondContact O-N 3.48Å
303	I	92.5	Very high	92.6	Very high	81 Å²	81	48.8 Å²	48.8	42%	0.415	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-45.5	-179.2	-63.3	-179.5	0	0	0	112.7	V298 K299 C305 I312 F313	V298-I303 PolarHBondContact O-N 3.25Å; K299-I303 HydrophobicContact CG-CD1 4.14Å; K299-I303 WeakPolarHBondContact O-CD1 3.48Å; I303-C305 VanDerWaalsContact C-N 3.28Å; I303-C305 PolarHBondContact O-N 3.03Å; I303-I312 HydrophobicContact CG1-CG2 4.21Å; I303-F313 HydrophobicContact CD1-CB 4.1Å; I303-F313 HydrophobicContact CG1-CB 4.3Å
304	P	91.1	Very high	92.6	Very high	104 Å²	104	50 Å²	50	68%	0.675	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.2	177.5	-20.3	34.2	0	0	0	114.9	C302	C302-P304 VanDerWaalsContact C-N 3.35Å
305	C	91.5	Very high	92.6	Very high	17 Å²	17	55.5 Å²	55.5	12%	0.115	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-30.7	-175.2	-64.7	0	0	0	0	113.2	L214 V215 L218 G301 C302 I303	L214-C305 HydrophobicContact CD2-CB 4Å; V215-C305 HydrophobicContact CG2-CB 3.89Å; L218-C305 WeakPolarHBondContact CD1-O 3.35Å; G301-C305 PolarHBondContact O-SG 2.74Å; C302-C305 PolarHBondContact O-N 3.46Å; I303-C305 VanDerWaalsContact C-N 3.28Å; I303-C305 PolarHBondContact O-N 3.03Å
306	F	94.2	Very high	92.6	Very high	11 Å²	11	55.5 Å²	55.5	5%	0.048	29%	0.285	C	S	.	.	S	Bend	trans	-94.7	151.9	-175.3	-76.4	-101.9	0	0	0	112	T200 L214 L218 L257 C302 Y310 I312	T200-F306 HydrophobicContact CG2-CE2 3.79Å; T200-F306 HydrophobicContact CG2-CZ 3.93Å; L214-F306 HydrophobicContact CD2-CE2 4.01Å; L218-F306 HydrophobicContact CD1-CB 4.48Å; L218-F306 HydrophobicContact CD1-CD1 3.68Å; L218-F306 HydrophobicContact CD1-CD2 3.89Å; L218-F306 HydrophobicContact CD1-CE1 3.78Å; L218-F306 HydrophobicContact CD1-CE2 4.01Å; L218-F306 HydrophobicContact CD1-CG 3.75Å; L218-F306 HydrophobicContact CD1-CZ 3.95Å; L218-F306 HydrophobicContact CD2-CD1 3.89Å; L218-F306 HydrophobicContact CD2-CE1 3.59Å; L218-F306 HydrophobicContact CD2-CZ 4.24Å; L218-F306 HydrophobicContact CG-CD1 4.46Å; L218-F306 HydrophobicContact CG-CE1 4.33Å; L257-F306 HydrophobicContact CD1-CE1 3.96Å; L257-F306 HydrophobicContact CD1-CZ 4.15Å; C302-F306 HydrophobicContact CB-CD2 4.19Å; C302-F306 HydrophobicContact CB-CE2 4.17Å; C302-F306 WeakPolarHBondContact O-CD2 3.4Å; C302-F306 PolarHBondContact O-N 3.48Å; F306-Y310 AromaticContact CD1-CD2 3.78Å; F306-Y310 HydrophobicContact CD1-CD2 3.78Å; F306-Y310 HydrophobicContact CD1-CE2 4.29Å; F306-Y310 HydrophobicContact CE1-CD2 4.49Å; F306-I312 HydrophobicContact CB-CB 4.04Å; F306-I312 HydrophobicContact CB-CG1 4.26Å; F306-I312 HydrophobicContact CB-CG2 4.08Å; F306-I312 HydrophobicContact CD1-CB 4.44Å; F306-I312 HydrophobicContact CD1-CD1 3.81Å; F306-I312 HydrophobicContact CD1-CG1 3.91Å; F306-I312 HydrophobicContact CD2-CB 4.43Å; F306-I312 HydrophobicContact CD2-CD1 4.45Å; F306-I312 HydrophobicContact CD2-CG1 3.78Å; F306-I312 HydrophobicContact CD2-CG2 4.43Å; F306-I312 HydrophobicContact CE1-CD1 3.74Å; F306-I312 HydrophobicContact CE1-CG1 4.14Å; F306-I312 HydrophobicContact CE2-CD1 4.39Å; F306-I312 HydrophobicContact CE2-CG1 4.01Å; F306-I312 HydrophobicContact CG-CB 4.07Å; F306-I312 HydrophobicContact CG-CD1 4.16Å; F306-I312 HydrophobicContact CG-CG1 3.72Å; F306-I312 HydrophobicContact CG-CG2 4.35Å; F306-I312 HydrophobicContact CZ-CD1 4.05Å; F306-I312 HydrophobicContact CZ-CG1 4.19Å
307	P	93.1	Very high	92.7	Very high	34 Å²	34	55.5 Å²	55.5	22%	0.221	28%	0.283	C	S	.	.			trans	-56.5	140.5	170.2	-23.2	34	0	0	0	111.4	E222 D309 Y310	E222-P307 HydrophobicContact CG-CG 4.26Å; P307-D309 VanDerWaalsContact C-N 3.25Å; P307-D309 PolarHBondContact O-N 3.26Å; P307-Y310 HydrophobicContact CB-CD1 3.73Å; P307-Y310 HydrophobicContact CB-CE1 3.96Å; P307-Y310 HydrophobicContact CB-CG 4.41Å; P307-Y310 HydrophobicContact CG-CD1 3.92Å; P307-Y310 HydrophobicContact CG-CE1 3.74Å; P307-Y310 HydrophobicContact CG-CG 4.46Å; P307-Y310 WeakPolarHBondContact O-CB 3.38Å; P307-Y310 PolarHBondContact O-N 2.77Å
308	P	91.4	Very high	92.7	Very high	111 Å²	111	59.7 Å²	59.7	72%	0.721	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-55.9	-38.3	-177.8	-27.5	35.2	0	0	0	113.9	Y310 H311	P308-Y310 PolarHBondContact O-N 2.96Å; P308-Y310 VanDerWaalsContact O-N 3.09Å; P308-H311 PolarHBondContact O-N 3.2Å; P308-H311 VanDerWaalsContact O-N 3.12Å
309	D	92.3	Very high	92.8	Very high	141 Å²	141	60.7 Å²	60.7	75%	0.754	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-65.3	-13.1	-178.3	-55.3	-26.5	0	0	0	113.3	P307 H311	P307-D309 VanDerWaalsContact C-N 3.25Å; P307-D309 PolarHBondContact O-N 3.26Å; D309-H311 VanDerWaalsContact C-N 3.27Å; D309-H311 PolarHBondContact O-CD2 2.85Å; D309-H311 VanDerWaalsContact O-CD2 3.28Å; D309-H311 PolarHBondContact O-N 3.22Å
310	Y	93.1	Very high	93	Very high	14 Å²	14	57.5 Å²	57.5	6%	0.055	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-74.8	-19.9	177	-80	38.7	0	0	0	112.2	E222 F254 F306 P307 P308 I312 R315	E222-Y310 WeakPolarHBondContact OE1-CE1 3.39Å; E222-Y310 PolarHBondContact OE1-OH 3.36Å; F254-Y310 AromaticContact CE1-CD2 3.87Å; F254-Y310 HydrophobicContact CE1-CD2 3.87Å; F254-Y310 HydrophobicContact CE1-CE2 4.42Å; F254-Y310 HydrophobicContact CE2-CD2 4.21Å; F254-Y310 HydrophobicContact CE2-CE2 4.17Å; F254-Y310 AromaticContact CZ-CD2 3.37Å; F254-Y310 HydrophobicContact CZ-CD2 3.37Å; F254-Y310 AromaticContact CZ-CE2 3.76Å; F254-Y310 HydrophobicContact CZ-CE2 3.76Å; F254-Y310 AromaticContact CZ-CG 3.82Å; F254-Y310 HydrophobicContact CZ-CG 3.82Å; F306-Y310 AromaticContact CD1-CD2 3.78Å; F306-Y310 HydrophobicContact CD1-CD2 3.78Å; F306-Y310 HydrophobicContact CD1-CE2 4.29Å; F306-Y310 HydrophobicContact CE1-CD2 4.49Å; P307-Y310 HydrophobicContact CB-CD1 3.73Å; P307-Y310 HydrophobicContact CB-CE1 3.96Å; P307-Y310 HydrophobicContact CB-CG 4.41Å; P307-Y310 HydrophobicContact CG-CD1 3.92Å; P307-Y310 HydrophobicContact CG-CE1 3.74Å; P307-Y310 HydrophobicContact CG-CG 4.46Å; P307-Y310 WeakPolarHBondContact O-CB 3.38Å; P307-Y310 PolarHBondContact O-N 2.77Å; P308-Y310 PolarHBondContact O-N 2.96Å; P308-Y310 VanDerWaalsContact O-N 3.09Å; Y310-I312 PolarHBondContact O-N 3.06Å; Y310-R315 WeakPolarHBondContact O-CG 3.42Å
311	H	93.1	Very high	93.1	Very high	114 Å²	114	49.7 Å²	49.7	53%	0.528	26%	0.264	S	S	.	.			trans	47.4	47.4	-174.7	-60.9	-74.2	0	0	0	112.2	P308 D309 F313 D314 R315	P308-H311 PolarHBondContact O-N 3.2Å; P308-H311 VanDerWaalsContact O-N 3.12Å; D309-H311 VanDerWaalsContact C-N 3.27Å; D309-H311 PolarHBondContact O-CD2 2.85Å; D309-H311 VanDerWaalsContact O-CD2 3.28Å; D309-H311 PolarHBondContact O-N 3.22Å; H311-F313 VanDerWaalsContact C-N 3.27Å; H311-F313 PolarHBondContact O-N 3.41Å; H311-F313 VanDerWaalsContact O-N 3.12Å; H311-D314 PolarHBondContact O-N 3.16Å; H311-D314 VanDerWaalsContact O-N 3.09Å; H311-R315 PolarHBondContact O-N 3.01Å
312	I	94	Very high	93.4	Very high	9 Å²	9	51.6 Å²	51.6	5%	0.046	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-35.9	-162.4	-167.1	55.1	0	0	0	113.6	L257 I303 F306 Y310 R315 F316	L257-I312 HydrophobicContact CD1-CD1 4.05Å; I303-I312 HydrophobicContact CG1-CG2 4.21Å; F306-I312 HydrophobicContact CB-CB 4.04Å; F306-I312 HydrophobicContact CB-CG1 4.26Å; F306-I312 HydrophobicContact CB-CG2 4.08Å; F306-I312 HydrophobicContact CD1-CB 4.44Å; F306-I312 HydrophobicContact CD1-CD1 3.81Å; F306-I312 HydrophobicContact CD1-CG1 3.91Å; F306-I312 HydrophobicContact CD2-CB 4.43Å; F306-I312 HydrophobicContact CD2-CD1 4.45Å; F306-I312 HydrophobicContact CD2-CG1 3.78Å; F306-I312 HydrophobicContact CD2-CG2 4.43Å; F306-I312 HydrophobicContact CE1-CD1 3.74Å; F306-I312 HydrophobicContact CE1-CG1 4.14Å; F306-I312 HydrophobicContact CE2-CD1 4.39Å; F306-I312 HydrophobicContact CE2-CG1 4.01Å; F306-I312 HydrophobicContact CG-CB 4.07Å; F306-I312 HydrophobicContact CG-CD1 4.16Å; F306-I312 HydrophobicContact CG-CG1 3.72Å; F306-I312 HydrophobicContact CG-CG2 4.35Å; F306-I312 HydrophobicContact CZ-CD1 4.05Å; F306-I312 HydrophobicContact CZ-CG1 4.19Å; Y310-I312 PolarHBondContact O-N 3.06Å; I312-R315 PolarHBondContact O-N 3.16Å; I312-F316 HydrophobicContact CD1-CD2 3.75Å; I312-F316 HydrophobicContact CD1-CE2 3.59Å; I312-F316 HydrophobicContact CG1-CD2 3.71Å; I312-F316 HydrophobicContact CG1-CE2 3.68Å; I312-F316 VanDerWaalsContact O-CD2 3.28Å; I312-F316 WeakPolarHBondContact O-CD2 3.43Å; I312-F316 PolarHBondContact O-N 3.28Å
313	F	93.8	Very high	93.5	Very high	24 Å²	24	52.1 Å²	52.1	11%	0.105	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-47.8	178.4	179.1	-99.8	0	0	0	112	V298 K299 I303 H311 R315 F316 L317 V364	V298-F313 HydrophobicContact CG1-CB 4.44Å; V298-F313 HydrophobicContact CG1-CD2 4.07Å; K299-F313 HydrophobicContact CB-CD2 3.82Å; K299-F313 HydrophobicContact CB-CE2 3.75Å; K299-F313 HydrophobicContact CD-CE2 4.07Å; K299-F313 HydrophobicContact CD-CZ 4.26Å; K299-F313 HydrophobicContact CG-CD2 4.23Å; K299-F313 HydrophobicContact CG-CE2 4.17Å; I303-F313 HydrophobicContact CD1-CB 4.1Å; I303-F313 HydrophobicContact CG1-CB 4.3Å; H311-F313 VanDerWaalsContact C-N 3.27Å; H311-F313 PolarHBondContact O-N 3.41Å; H311-F313 VanDerWaalsContact O-N 3.12Å; F313-R315 VanDerWaalsContact C-N 3.3Å; F313-R315 PolarHBondContact O-N 3.25Å; F313-F316 PolarHBondContact O-N 3.1Å; F313-L317 WeakPolarHBondContact O-CB 3.39Å; F313-L317 PolarHBondContact O-N 3.09Å; F313-V364 HydrophobicContact CE1-CG2 3.91Å; F313-V364 HydrophobicContact CZ-CG2 3.97Å
314	D	93	Very high	93.7	Very high	93 Å²	93	48.3 Å²	48.3	50%	0.497	26%	0.257	S	S	.	.	H	α-helix	trans	-65.1	-37.6	178.9	-57.9	-41.3	0	0	0	110.8	H311 L317 E318	H311-D314 PolarHBondContact O-N 3.16Å; H311-D314 VanDerWaalsContact O-N 3.09Å; D314-L317 WeakPolarHBondContact O-CB 3.36Å; D314-L317 PolarHBondContact O-N 3.11Å; D314-E318 WeakPolarHBondContact O-CB 3.48Å; D314-E318 PolarHBondContact O-N 3.38Å
315	R	93.7	Very high	93.8	Very high	116 Å²	116	43.5 Å²	43.5	44%	0.438	23%	0.227	S	C	.	.	H	α-helix	trans	-62.7	-46.3	173.5	-68.8	-62.5	-172.8	-156.9	1.2	112.5	Y310 H311 I312 F313 L317 E318 M319	Y310-R315 WeakPolarHBondContact O-CG 3.42Å; H311-R315 PolarHBondContact O-N 3.01Å; I312-R315 PolarHBondContact O-N 3.16Å; F313-R315 VanDerWaalsContact C-N 3.3Å; F313-R315 PolarHBondContact O-N 3.25Å; R315-L317 VanDerWaalsContact C-N 3.32Å; R315-L317 PolarHBondContact O-N 3.26Å; R315-E318 IonicContact NH1-OE2 2.81Å; R315-E318 PolarHBondContact NH1-OE2 3.38Å; R315-E318 PolarHBondContact O-N 3.16Å; R315-M319 HydrophobicContact CB-CE 4.44Å; R315-M319 WeakPolarHBondContact O-CB 3.29Å; R315-M319 WeakPolarHBondContact O-CG 3.37Å; R315-M319 PolarHBondContact O-N 2.97Å
316	F	94.8	Very high	93.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-62	-41.6	174.8	-93.4	-75.6	0	0	0	111.5	T200 L201 L257 M260 V261 L295 V298 I312 F313 E318 M319 Y320	T200-F316 HydrophobicContact CG2-CZ 4.27Å; L201-F316 HydrophobicContact CD2-CE1 4.49Å; L257-F316 HydrophobicContact CD2-CZ 4.11Å; M260-F316 HydrophobicContact CE-CE1 3.62Å; M260-F316 HydrophobicContact CE-CZ 3.94Å; V261-F316 HydrophobicContact CG2-CD1 3.69Å; V261-F316 HydrophobicContact CG2-CE1 3.67Å; L295-F316 HydrophobicContact CD2-CB 4.26Å; V298-F316 HydrophobicContact CB-CD2 4.36Å; V298-F316 HydrophobicContact CB-CG 4.47Å; V298-F316 HydrophobicContact CG1-CB 3.98Å; V298-F316 HydrophobicContact CG1-CD2 3.52Å; V298-F316 HydrophobicContact CG1-CE2 4.24Å; V298-F316 HydrophobicContact CG1-CG 3.91Å; V298-F316 HydrophobicContact CG2-CB 4.19Å; V298-F316 HydrophobicContact CG2-CD1 3.97Å; V298-F316 HydrophobicContact CG2-CD2 3.8Å; V298-F316 HydrophobicContact CG2-CE1 4.27Å; V298-F316 HydrophobicContact CG2-CE2 4.13Å; V298-F316 HydrophobicContact CG2-CG 3.72Å; V298-F316 HydrophobicContact CG2-CZ 4.34Å; I312-F316 HydrophobicContact CD1-CD2 3.75Å; I312-F316 HydrophobicContact CD1-CE2 3.59Å; I312-F316 HydrophobicContact CG1-CD2 3.71Å; I312-F316 HydrophobicContact CG1-CE2 3.68Å; I312-F316 VanDerWaalsContact O-CD2 3.28Å; I312-F316 WeakPolarHBondContact O-CD2 3.43Å; I312-F316 PolarHBondContact O-N 3.28Å; F313-F316 PolarHBondContact O-N 3.1Å; F316-E318 PolarHBondContact O-N 2.99Å; F316-M319 PolarHBondContact O-N 3.31Å; F316-Y320 HydrophobicContact CD1-CD2 4.37Å; F316-Y320 AromaticContact CD1-CE2 3.91Å; F316-Y320 HydrophobicContact CD1-CE2 3.91Å; F316-Y320 VanDerWaalsContact O-CD2 3.23Å; F316-Y320 WeakPolarHBondContact O-CD2 3.3Å; F316-Y320 PolarHBondContact O-N 2.97Å
317	L	93.8	Very high	93.8	Very high	16 Å²	16	47.6 Å²	47.6	8%	0.084	24%	0.244	C	C	.	.	H	α-helix	trans	-58.5	-47.5	176.2	-178	68.6	0	0	0	111.3	L295 F313 D314 R315 Y320 H321 L357 V364 L369	L295-L317 HydrophobicContact CD1-CD1 3.99Å; F313-L317 WeakPolarHBondContact O-CB 3.39Å; F313-L317 PolarHBondContact O-N 3.09Å; D314-L317 WeakPolarHBondContact O-CB 3.36Å; D314-L317 PolarHBondContact O-N 3.11Å; R315-L317 VanDerWaalsContact C-N 3.32Å; R315-L317 PolarHBondContact O-N 3.26Å; L317-Y320 PolarHBondContact O-N 3.37Å; L317-H321 WeakPolarHBondContact O-CB 3.26Å; L317-H321 PolarHBondContact O-N 2.89Å; L317-L357 HydrophobicContact CD1-CD1 4.4Å; L317-L357 HydrophobicContact CD1-CD2 3.81Å; L317-V364 HydrophobicContact CD1-CG1 4.44Å; L317-V364 HydrophobicContact CD1-CG2 4.45Å; L317-V364 HydrophobicContact CD2-CG1 3.76Å; L317-V364 HydrophobicContact CD2-CG2 4.01Å; L317-L369 HydrophobicContact CD1-CD2 4.44Å; L317-L369 HydrophobicContact CD2-CD2 4.34Å; L317-L369 HydrophobicContact CG-CD2 4.3Å
318	E	93.7	Very high	93.8	Very high	100 Å²	100	46 Å²	46	47%	0.467	23%	0.234	S	C	.	.	H	α-helix	trans	-61.8	-43.7	176	-174.2	-179.7	-168.2	0	0	112	D314 R315 F316 H321 T322	D314-E318 WeakPolarHBondContact O-CB 3.48Å; D314-E318 PolarHBondContact O-N 3.38Å; R315-E318 IonicContact NH1-OE2 2.81Å; R315-E318 PolarHBondContact NH1-OE2 3.38Å; R315-E318 PolarHBondContact O-N 3.16Å; F316-E318 PolarHBondContact O-N 2.99Å; E318-H321 PolarHBondContact O-N 3.49Å; E318-T322 VanDerWaalsContact O-CB 3.27Å; E318-T322 WeakPolarHBondContact O-CB 3.27Å; E318-T322 PolarHBondContact O-N 3.24Å; E318-T322 PolarHBondContact O-OG1 2.98Å
319	M	95.5	Very high	93.9	Very high	21 Å²	21	45.9 Å²	45.9	10%	0.103	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-47.5	177.2	-70.9	169.9	-176	0	0	111.9	F254 L257 E258 V261 R315 F316 T322 A323	F254-M319 HydrophobicContact CD1-CE 4.14Å; L257-M319 HydrophobicContact CB-CE 4.28Å; L257-M319 HydrophobicContact CB-SD 4.23Å; E258-M319 HydrophobicContact CB-CE 4.36Å; E258-M319 HydrophobicContact CB-CG 4.38Å; E258-M319 HydrophobicContact CB-SD 4.33Å; E258-M319 HydrophobicContact CG-CG 4.26Å; V261-M319 HydrophobicContact CB-CB 4.26Å; V261-M319 HydrophobicContact CG1-CB 4.04Å; V261-M319 HydrophobicContact CG2-CB 4.22Å; V261-M319 HydrophobicContact CG2-SD 4.47Å; R315-M319 HydrophobicContact CB-CE 4.44Å; R315-M319 WeakPolarHBondContact O-CB 3.29Å; R315-M319 WeakPolarHBondContact O-CG 3.37Å; R315-M319 PolarHBondContact O-N 2.97Å; F316-M319 PolarHBondContact O-N 3.31Å; M319-T322 PolarHBondContact O-N 3.37Å; M319-A323 VanDerWaalsContact O-CB 3.26Å; M319-A323 WeakPolarHBondContact O-CB 3.44Å; M319-A323 PolarHBondContact O-N 3.06Å
320	Y	95.2	Very high	93.9	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.012	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-45	177	-86	-73.8	0	0	0	111.1	L201 V261 V265 V291 D294 L295 F316 L317 T322 A323 I324	L201-Y320 WeakPolarHBondContact CD1-OH 3.37Å; V261-Y320 HydrophobicContact CG1-CD1 3.59Å; V261-Y320 HydrophobicContact CG1-CD2 3.96Å; V261-Y320 HydrophobicContact CG1-CE1 3.79Å; V261-Y320 HydrophobicContact CG1-CE2 4.11Å; V261-Y320 HydrophobicContact CG1-CG 3.68Å; V261-Y320 HydrophobicContact CG2-CD2 4.32Å; V261-Y320 HydrophobicContact CG2-CE2 3.92Å; V265-Y320 HydrophobicContact CG2-CD1 4.04Å; V265-Y320 HydrophobicContact CG2-CE1 4.33Å; V291-Y320 HydrophobicContact CB-CD1 4.36Å; V291-Y320 HydrophobicContact CG1-CD1 4Å; V291-Y320 HydrophobicContact CG1-CG 4.14Å; V291-Y320 HydrophobicContact CG2-CD1 3.72Å; V291-Y320 HydrophobicContact CG2-CE1 3.97Å; D294-Y320 HydrophobicContact CB-CE2 4.19Å; D294-Y320 WeakPolarHBondContact CB-OH 3.13Å; D294-Y320 PolarHBondContact OD2-OH 3.38Å; L295-Y320 HydrophobicContact CD2-CD2 3.76Å; L295-Y320 HydrophobicContact CD2-CE2 4.24Å; L295-Y320 HydrophobicContact CG-CD2 4.25Å; F316-Y320 HydrophobicContact CD1-CD2 4.37Å; F316-Y320 AromaticContact CD1-CE2 3.91Å; F316-Y320 HydrophobicContact CD1-CE2 3.91Å; F316-Y320 VanDerWaalsContact O-CD2 3.23Å; F316-Y320 WeakPolarHBondContact O-CD2 3.3Å; F316-Y320 PolarHBondContact O-N 2.97Å; L317-Y320 PolarHBondContact O-N 3.37Å; Y320-T322 VanDerWaalsContact C-N 3.34Å; Y320-T322 PolarHBondContact O-N 2.85Å; Y320-A323 PolarHBondContact O-N 2.98Å; Y320-I324 WeakPolarHBondContact O-CB 3.36Å; Y320-I324 WeakPolarHBondContact O-CD1 3.38Å; Y320-I324 WeakPolarHBondContact O-CG1 3.28Å; Y320-I324 PolarHBondContact O-N 3.31Å
321	H	94.4	Very high	93.8	Very high	15 Å²	15	42.9 Å²	42.9	7%	0.069	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-45.6	177.8	-178.5	79.9	0	0	0	111.8	L317 E318 G325 Y351 H373	L317-H321 WeakPolarHBondContact O-CB 3.26Å; L317-H321 PolarHBondContact O-N 2.89Å; E318-H321 PolarHBondContact O-N 3.49Å; H321-G325 PolarHBondContact O-N 2.85Å; H321-Y351 AromaticContact ND1-CE1 3.8Å; H321-Y351 AromaticContact ND1-CZ 3.7Å; H321-Y351 PolarHBondContact ND1-OH 2.88Å; H321-H373 PolarHBondContact CE1-O 2.85Å; H321-H373 PolarHBondContact NE2-O 3.46Å
322	T	94.7	Very high	93.7	Very high	59 Å²	59	38.2 Å²	38.2	36%	0.362	18%	0.182	S	C	.	.	H	α-helix	trans	-66.9	-44.7	178.6	-57.9	0	0	0	0	111.9	E318 M319 Y320 G325 N326	E318-T322 VanDerWaalsContact O-CB 3.27Å; E318-T322 WeakPolarHBondContact O-CB 3.27Å; E318-T322 PolarHBondContact O-N 3.24Å; E318-T322 PolarHBondContact O-OG1 2.98Å; M319-T322 PolarHBondContact O-N 3.37Å; Y320-T322 VanDerWaalsContact C-N 3.34Å; Y320-T322 PolarHBondContact O-N 2.85Å; T322-G325 PolarHBondContact O-N 3.39Å; T322-N326 WeakPolarHBondContact O-CB 3.41Å; T322-N326 VanDerWaalsContact O-CG 3.22Å; T322-N326 PolarHBondContact O-N 3.35Å; T322-N326 PolarHBondContact O-ND2 3.39Å
323	A	95.2	Very high	93.5	Very high	12 Å²	12	42.3 Å²	42.3	10%	0.099	21%	0.211	C	C	.	.	H	α-helix	trans	-62.1	-45.2	178.5	0	0	0	0	0	111.8	V261 V265 M319 Y320 R327	V261-A323 HydrophobicContact CG1-CB 4.33Å; V265-A323 HydrophobicContact CB-CB 4.35Å; V265-A323 HydrophobicContact CG2-CB 4.02Å; M319-A323 VanDerWaalsContact O-CB 3.26Å; M319-A323 WeakPolarHBondContact O-CB 3.44Å; M319-A323 PolarHBondContact O-N 3.06Å; Y320-A323 PolarHBondContact O-N 2.98Å; A323-R327 WeakPolarHBondContact O-CB 3.41Å; A323-R327 PolarHBondContact O-N 3.42Å
324	I	95.1	Very high	93.3	Very high	1 Å²	1	46 Å²	46	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-48.6	175.5	-65.3	165.2	0	0	0	110	V265 I287 V291 Y320 N326 R327 L328 W347 Y351 M356 L375	V265-I324 HydrophobicContact CG1-CG1 4.15Å; V265-I324 HydrophobicContact CG2-CG1 4.2Å; I287-I324 HydrophobicContact CG2-CD1 4.01Å; I287-I324 HydrophobicContact CG2-CG1 4.1Å; V291-I324 HydrophobicContact CG1-CD1 4.35Å; V291-I324 HydrophobicContact CG2-CD1 4Å; Y320-I324 WeakPolarHBondContact O-CB 3.36Å; Y320-I324 WeakPolarHBondContact O-CD1 3.38Å; Y320-I324 WeakPolarHBondContact O-CG1 3.28Å; Y320-I324 PolarHBondContact O-N 3.31Å; I324-N326 VanDerWaalsContact C-N 3.32Å; I324-N326 PolarHBondContact O-N 2.94Å; I324-R327 PolarHBondContact O-N 3.19Å; I324-R327 VanDerWaalsContact O-N 3.17Å; I324-L328 HydrophobicContact CG2-CD1 3.79Å; I324-L328 HydrophobicContact CG2-CG 4.08Å; I324-L328 WeakPolarHBondContact O-CB 3.17Å; I324-L328 VanDerWaalsContact O-CG 3.28Å; I324-L328 WeakPolarHBondContact O-CG 3.45Å; I324-L328 PolarHBondContact O-N 2.94Å; I324-W347 HydrophobicContact CG2-CH2 3.78Å; I324-W347 HydrophobicContact CG2-CZ3 4.12Å; I324-Y351 HydrophobicContact CD1-CE2 4.14Å; I324-Y351 HydrophobicContact CG2-CE2 4.41Å; I324-M356 HydrophobicContact CD1-CE 4.05Å; I324-L375 HydrophobicContact CB-CD2 4.36Å; I324-L375 HydrophobicContact CG2-CD2 3.99Å
325	G	93.6	Very high	93	Very high	3 Å²	3	47.4 Å²	47.4	3%	0.031	24%	0.239	C	C	.	.	H	α-helix	trans	-59.1	-41.2	-179.8	0	0	0	0	0	113	H321 T322 R329	H321-G325 PolarHBondContact O-N 2.85Å; T322-G325 PolarHBondContact O-N 3.39Å; G325-R329 WeakPolarHBondContact O-CB 3.49Å; G325-R329 PolarHBondContact O-N 3.39Å
326	N	93.6	Very high	92.7	Very high	61 Å²	61	42 Å²	42	33%	0.326	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-46.8	174.6	-71.5	-18.5	0	0	0	111.5	T322 I324 L328 R329 E330	T322-N326 WeakPolarHBondContact O-CB 3.41Å; T322-N326 VanDerWaalsContact O-CG 3.22Å; T322-N326 PolarHBondContact O-N 3.35Å; T322-N326 PolarHBondContact O-ND2 3.39Å; I324-N326 VanDerWaalsContact C-N 3.32Å; I324-N326 PolarHBondContact O-N 2.94Å; N326-L328 PolarHBondContact O-N 3.37Å; N326-R329 WeakPolarHBondContact O-CB 3.23Å; N326-R329 PolarHBondContact O-N 2.87Å; N326-R329 VanDerWaalsContact O-N 3.15Å; N326-R329 PolarHBondContact OD1-NH1 2.68Å; N326-E330 PolarHBondContact O-N 3.29Å
327	R	93	Very high	92.4	Very high	53 Å²	53	46 Å²	46	20%	0.2	24%	0.238	C	C	.	.	H	α-helix	trans	-66	-40.8	-179.2	-173.4	59.2	-175.3	153.7	4.8	112.9	Y283 A323 I324 R329 E330 I331	Y283-R327 HydrophobicContact CE1-CG 4.14Å; Y283-R327 WeakPolarHBondContact OH-CG 3.37Å; A323-R327 WeakPolarHBondContact O-CB 3.41Å; A323-R327 PolarHBondContact O-N 3.42Å; I324-R327 PolarHBondContact O-N 3.19Å; I324-R327 VanDerWaalsContact O-N 3.17Å; R327-R329 VanDerWaalsContact C-N 3.26Å; R327-R329 PolarHBondContact O-N 3.44Å; R327-E330 WeakPolarHBondContact CD-OE2 3.3Å; R327-E330 IonicContact CZ-OE2 3.66Å; R327-E330 IonicContact NH1-OE2 3.77Å; R327-E330 PolarHBondContact NH1-OE2 3.43Å; R327-E330 WeakPolarHBondContact O-CB 3.33Å; R327-E330 PolarHBondContact O-N 2.86Å; R327-I331 HydrophobicContact CG-CD1 4.2Å; R327-I331 WeakPolarHBondContact O-CG1 3.28Å; R327-I331 PolarHBondContact O-N 2.96Å
328	L	92.9	Very high	91.9	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-64.5	-33.3	174.4	-66.3	-178.9	0	0	0	111.8	L284 I324 N326 I331 A332 L344 W347 L348 L375 L376	L284-L328 HydrophobicContact CD2-CD2 3.69Å; I324-L328 HydrophobicContact CG2-CD1 3.79Å; I324-L328 HydrophobicContact CG2-CG 4.08Å; I324-L328 WeakPolarHBondContact O-CB 3.17Å; I324-L328 VanDerWaalsContact O-CG 3.28Å; I324-L328 WeakPolarHBondContact O-CG 3.45Å; I324-L328 PolarHBondContact O-N 2.94Å; N326-L328 PolarHBondContact O-N 3.37Å; L328-I331 PolarHBondContact O-N 3.46Å; L328-A332 WeakPolarHBondContact O-CB 3.49Å; L328-A332 PolarHBondContact O-N 2.95Å; L328-L344 HydrophobicContact CD2-CD1 3.76Å; L328-W347 HydrophobicContact CD1-CE3 4.26Å; L328-W347 HydrophobicContact CD1-CZ3 3.73Å; L328-L348 HydrophobicContact CD1-CD2 4.04Å; L328-L375 HydrophobicContact CD1-CB 4.34Å; L328-L375 HydrophobicContact CD1-CD1 3.97Å; L328-L376 HydrophobicContact CB-CD2 4.02Å; L328-L376 HydrophobicContact CB-CG 4.36Å
329	R	92.9	Very high	91.5	Very high	108 Å²	108	43.8 Å²	43.8	41%	0.408	23%	0.228	S	C	.	.	H	α-helix	trans	-68.1	-38.7	176.4	-165.5	-177.7	-53.4	112.9	8.7	111.9	G325 N326 R327 A332 S333 L376	G325-R329 WeakPolarHBondContact O-CB 3.49Å; G325-R329 PolarHBondContact O-N 3.39Å; N326-R329 WeakPolarHBondContact O-CB 3.23Å; N326-R329 PolarHBondContact O-N 2.87Å; N326-R329 VanDerWaalsContact O-N 3.15Å; N326-R329 PolarHBondContact OD1-NH1 2.68Å; R327-R329 VanDerWaalsContact C-N 3.26Å; R327-R329 PolarHBondContact O-N 3.44Å; R329-A332 PolarHBondContact O-N 3.41Å; R329-S333 PolarHBondContact O-N 2.82Å; R329-L376 HydrophobicContact CB-CD2 4.05Å
330	E	92	Very high	91.2	Very high	90 Å²	90	42.8 Å²	42.8	42%	0.421	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-50.9	171.8	-68.7	169.2	-174.7	0	0	110.5	N326 R327 A332 S333 D334	N326-E330 PolarHBondContact O-N 3.29Å; R327-E330 WeakPolarHBondContact CD-OE2 3.3Å; R327-E330 IonicContact CZ-OE2 3.66Å; R327-E330 IonicContact NH1-OE2 3.77Å; R327-E330 PolarHBondContact NH1-OE2 3.43Å; R327-E330 WeakPolarHBondContact O-CB 3.33Å; R327-E330 PolarHBondContact O-N 2.86Å; E330-A332 VanDerWaalsContact C-N 3.31Å; E330-A332 PolarHBondContact O-N 2.74Å; E330-S333 PolarHBondContact O-N 2.65Å; E330-S333 PolarHBondContact O-OG 3.25Å; E330-D334 PolarHBondContact O-N 3.23Å
331	I	92.2	Very high	90.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-41.1	177.8	-65.2	167.2	0	0	0	111.3	L280 Y283 R327 L328 S333 D334 L336	L280-I331 HydrophobicContact CD1-CD1 3.94Å; L280-I331 HydrophobicContact CD1-CG2 4.02Å; L280-I331 HydrophobicContact CD2-CG2 4.23Å; Y283-I331 HydrophobicContact CD1-CD1 4.24Å; Y283-I331 HydrophobicContact CE1-CD1 3.9Å; R327-I331 HydrophobicContact CG-CD1 4.2Å; R327-I331 WeakPolarHBondContact O-CG1 3.28Å; R327-I331 PolarHBondContact O-N 2.96Å; L328-I331 PolarHBondContact O-N 3.46Å; I331-S333 PolarHBondContact O-N 3.5Å; I331-D334 PolarHBondContact O-N 2.9Å; I331-L336 HydrophobicContact CG2-CD1 4.43Å; I331-L336 HydrophobicContact CG2-CD2 3.81Å; I331-L336 WeakPolarHBondContact O-CD2 3.49Å
332	A	90.3	Very high	90.1	Very high	15 Å²	15	44.3 Å²	44.3	12%	0.124	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-23.2	178.2	0	0	0	0	0	113.4	L328 R329 E330 L344 L376 T380 L384	L328-A332 WeakPolarHBondContact O-CB 3.49Å; L328-A332 PolarHBondContact O-N 2.95Å; R329-A332 PolarHBondContact O-N 3.41Å; E330-A332 VanDerWaalsContact C-N 3.31Å; E330-A332 PolarHBondContact O-N 2.74Å; A332-L344 HydrophobicContact CB-CD2 4.4Å; A332-L376 HydrophobicContact CB-CD1 4.32Å; A332-L376 HydrophobicContact CB-CD2 4.33Å; A332-T380 HydrophobicContact CB-CG2 3.9Å; A332-L384 HydrophobicContact CB-CD1 4.06Å; A332-L384 HydrophobicContact CB-CD2 4.43Å
333	S	90	Very high	89.7	Confident	95 Å²	95	43 Å²	43	66%	0.664	22%	0.221	S	C	*	.	H	α-helix	trans	-80.7	-18.2	176	71.7	0	0	0	0	113.4	R329 E330 I331	R329-S333 PolarHBondContact O-N 2.82Å; E330-S333 PolarHBondContact O-N 2.65Å; E330-S333 PolarHBondContact O-OG 3.25Å; I331-S333 PolarHBondContact O-N 3.5Å
334	D	88.7	Confident	89.3	Confident	101 Å²	101	42.5 Å²	42.5	54%	0.54	22%	0.216	S	C	.	.	S	Bend	trans	-77.1	164.2	176.7	-76.7	-25.8	0	0	0	112.6	E330 I331 L336	E330-D334 PolarHBondContact O-N 3.23Å; I331-D334 PolarHBondContact O-N 2.9Å; D334-L336 PolarHBondContact O-N 3.42Å
335	N	87.7	Confident	88.7	Confident	123 Å²	123	43.9 Å²	43.9	66%	0.658	22%	0.224	S	C	*	.			trans	-77.2	88.3	173.5	-168.3	23.3	0	0	0	110.8	R273 K387	R273-N335 PolarHBondContact NH2-O 2.69Å; N335-K387 PolarHBondContact OD1-NZ 2.86Å
336	L	87.7	Confident	88.1	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	25%	0.245	C	C	.	.			trans	-74.2	136.5	177.7	-60.7	176.7	0	0	0	112.8	I331 D334 E340 L341 L344 L384 K387	I331-L336 HydrophobicContact CG2-CD1 4.43Å; I331-L336 HydrophobicContact CG2-CD2 3.81Å; I331-L336 WeakPolarHBondContact O-CD2 3.49Å; D334-L336 PolarHBondContact O-N 3.42Å; L336-E340 VanDerWaalsContact CA-OE2 3.3Å; L336-E340 WeakPolarHBondContact CA-OE2 3.45Å; L336-E340 HydrophobicContact CB-CB 4.21Å; L336-E340 HydrophobicContact CD2-CB 4.11Å; L336-L341 HydrophobicContact CB-CD2 3.81Å; L336-L341 HydrophobicContact CB-CG 3.94Å; L336-L341 HydrophobicContact CD1-CD2 3.87Å; L336-L341 HydrophobicContact CG-CD2 4.49Å; L336-L344 HydrophobicContact CD1-CD2 3.74Å; L336-L384 HydrophobicContact CD1-CD2 3.99Å; L336-K387 PolarHBondContact O-NZ 3.11Å
337	E	88.9	Confident	87.8	Confident	82 Å²	82	44.6 Å²	44.6	38%	0.383	23%	0.231	S	C	.	.			trans	-75	163.5	169.4	-67.8	-177.4	-175.7	0	0	111.4	R273 N339 E340 L341	R273-E337 WeakPolarHBondContact CD-OE1 3.44Å; R273-E337 IonicContact NE-OE1 2.92Å; E337-N339 VanDerWaalsContact C-N 3.32Å; E337-N339 WeakPolarHBondContact CB-OD1 3.37Å; E337-N339 PolarHBondContact O-N 2.95Å; E337-E340 HydrophobicContact CB-CG 4.3Å; E337-E340 PolarHBondContact N-OE2 3.13Å; E337-E340 WeakPolarHBondContact O-CB 3.34Å; E337-E340 PolarHBondContact O-N 2.99Å; E337-L341 WeakPolarHBondContact O-CG 3.43Å; E337-L341 PolarHBondContact O-N 3.26Å
338	K	82.2	Confident	87.4	Confident	35 Å²	35	43.8 Å²	43.8	15%	0.152	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-40.9	-175.9	179.2	170.2	169	168.3	0	113.1	L341 I342 F388 M391 T392 D395	K338-L341 PolarHBondContact O-N 2.77Å; K338-I342 HydrophobicContact CG-CD1 4.41Å; K338-I342 WeakPolarHBondContact O-CG1 3.22Å; K338-I342 PolarHBondContact O-N 2.95Å; K338-I342 VanDerWaalsContact O-N 3.17Å; K338-F388 HydrophobicContact CG-CD2 4.12Å; K338-F388 HydrophobicContact CG-CE2 3.98Å; K338-M391 HydrophobicContact CB-CE 3.94Å; K338-T392 VanDerWaalsContact CE-OG1 3.26Å; K338-T392 WeakPolarHBondContact CE-OG1 3.37Å; K338-T392 PolarHBondContact NZ-OG1 3.03Å; K338-T392 VanDerWaalsContact NZ-OG1 3.1Å; K338-D395 VanDerWaalsContact CD-OD2 3.24Å; K338-D395 WeakPolarHBondContact CD-OD2 3.1Å; K338-D395 IonicContact NZ-OD2 2.73Å; K338-D395 PolarHBondContact NZ-OD2 3.05Å
339	N	84.7	Confident	86.8	Confident	35 Å²	35	52.9 Å²	52.9	19%	0.187	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-43.7	174	58.5	-29.8	0	0	0	111.9	K277 E337 I342 Q343	K277-N339 PolarHBondContact O-ND2 3.47Å; K277-N339 VanDerWaalsContact O-ND2 3.09Å; E337-N339 VanDerWaalsContact C-N 3.32Å; E337-N339 WeakPolarHBondContact CB-OD1 3.37Å; E337-N339 PolarHBondContact O-N 2.95Å; N339-I342 PolarHBondContact O-N 3.17Å; N339-Q343 WeakPolarHBondContact O-CG 3.45Å; N339-Q343 PolarHBondContact O-N 3.11Å
340	E	89.2	Confident	86.3	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-38.1	179.5	-63.3	173.2	156.2	0	0	111.6	R273 W279 L280 L336 E337 Q343 L344	R273-E340 IonicContact CZ-OE1 3.16Å; R273-E340 IonicContact CZ-OE2 2.82Å; R273-E340 IonicContact NE-OE1 3.28Å; R273-E340 PolarHBondContact NE-OE1 2.67Å; R273-E340 IonicContact NE-OE2 2.79Å; R273-E340 IonicContact NH2-OE1 2.72Å; R273-E340 PolarHBondContact NH2-OE1 2.89Å; R273-E340 IonicContact NH2-OE2 3.4Å; R273-E340 PolarHBondContact NH2-OE2 3.38Å; W279-E340 PolarHBondContact NE1-OE1 2.85Å; L280-E340 HydrophobicContact CD2-CB 3.84Å; L280-E340 HydrophobicContact CD2-CG 4.4Å; L280-E340 WeakPolarHBondContact CD2-O 3.44Å; L336-E340 VanDerWaalsContact CA-OE2 3.3Å; L336-E340 WeakPolarHBondContact CA-OE2 3.45Å; L336-E340 HydrophobicContact CB-CB 4.21Å; L336-E340 HydrophobicContact CD2-CB 4.11Å; E337-E340 HydrophobicContact CB-CG 4.3Å; E337-E340 PolarHBondContact N-OE2 3.13Å; E337-E340 WeakPolarHBondContact O-CB 3.34Å; E337-E340 PolarHBondContact O-N 2.99Å; E340-Q343 PolarHBondContact O-N 3.05Å; E340-L344 WeakPolarHBondContact O-CB 3.37Å; E340-L344 PolarHBondContact O-N 2.88Å
341	L	85.5	Confident	86.1	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.3	-46.7	173	-70.9	172	0	0	0	111.6	L336 E337 K338 L344 L345 L384 K387 F388 M391	L336-L341 HydrophobicContact CB-CD2 3.81Å; L336-L341 HydrophobicContact CB-CG 3.94Å; L336-L341 HydrophobicContact CD1-CD2 3.87Å; L336-L341 HydrophobicContact CG-CD2 4.49Å; E337-L341 WeakPolarHBondContact O-CG 3.43Å; E337-L341 PolarHBondContact O-N 3.26Å; K338-L341 PolarHBondContact O-N 2.77Å; L341-L344 PolarHBondContact O-N 2.78Å; L341-L345 WeakPolarHBondContact O-CB 3.33Å; L341-L345 VanDerWaalsContact O-CG 3.26Å; L341-L345 WeakPolarHBondContact O-CG 3.24Å; L341-L345 PolarHBondContact O-N 3.41Å; L341-L384 HydrophobicContact CD2-CB 4.37Å; L341-L384 HydrophobicContact CD2-CD2 3.59Å; L341-K387 HydrophobicContact CD1-CB 4.37Å; L341-K387 HydrophobicContact CD1-CD 4.12Å; L341-K387 HydrophobicContact CD1-CG 4.11Å; L341-K387 HydrophobicContact CD2-CD 4.48Å; L341-F388 HydrophobicContact CB-CB 4.34Å; L341-F388 HydrophobicContact CB-CD2 4.39Å; L341-F388 HydrophobicContact CD1-CB 4.07Å; L341-M391 HydrophobicContact CD1-SD 3.78Å
342	I	81.7	Confident	85.6	Confident	50 Å²	50	47.5 Å²	47.5	26%	0.256	25%	0.252	S	S	.	.	H	α-helix	trans	-61.4	-46.6	176.5	-66.8	162	0	0	0	110.4	K338 N339 L344 L345 S346 F388	K338-I342 HydrophobicContact CG-CD1 4.41Å; K338-I342 WeakPolarHBondContact O-CG1 3.22Å; K338-I342 PolarHBondContact O-N 2.95Å; K338-I342 VanDerWaalsContact O-N 3.17Å; N339-I342 PolarHBondContact O-N 3.17Å; I342-L344 PolarHBondContact O-N 2.96Å; I342-L345 PolarHBondContact O-N 2.98Å; I342-S346 WeakPolarHBondContact O-CB 3.14Å; I342-S346 PolarHBondContact O-N 3.43Å; I342-F388 HydrophobicContact CD1-CE2 3.68Å; I342-F388 HydrophobicContact CD1-CZ 4.24Å; I342-F388 HydrophobicContact CG1-CD2 3.99Å; I342-F388 HydrophobicContact CG1-CE2 3.37Å; I342-F388 HydrophobicContact CG1-CZ 3.91Å
343	Q	85.9	Confident	85.2	Confident	33 Å²	33	48.3 Å²	48.3	15%	0.154	26%	0.256	C	S	.	.	H	α-helix	trans	-60.5	-45.8	-179	-70.8	168.4	7.5	0	0	111.4	L280 A281 N339 E340 W347	L280-Q343 HydrophobicContact CD2-CB 4.45Å; A281-Q343 HydrophobicContact CB-CB 4.5Å; A281-Q343 HydrophobicContact CB-CG 3.91Å; N339-Q343 WeakPolarHBondContact O-CG 3.45Å; N339-Q343 PolarHBondContact O-N 3.11Å; E340-Q343 PolarHBondContact O-N 3.05Å; Q343-W347 VanDerWaalsContact O-CB 3.28Å; Q343-W347 WeakPolarHBondContact O-CB 3.49Å; Q343-W347 PolarHBondContact O-N 2.98Å
344	L	87.8	Confident	85	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-51.6	177.4	-179.4	58.6	0	0	0	112.1	L280 L328 A332 L336 E340 L341 I342 S346 W347 L348 L384	L280-L344 HydrophobicContact CD2-CB 4.25Å; L328-L344 HydrophobicContact CD2-CD1 3.76Å; A332-L344 HydrophobicContact CB-CD2 4.4Å; L336-L344 HydrophobicContact CD1-CD2 3.74Å; E340-L344 WeakPolarHBondContact O-CB 3.37Å; E340-L344 PolarHBondContact O-N 2.88Å; L341-L344 PolarHBondContact O-N 2.78Å; I342-L344 PolarHBondContact O-N 2.96Å; L344-S346 VanDerWaalsContact C-N 3.33Å; L344-S346 PolarHBondContact O-N 2.87Å; L344-W347 PolarHBondContact O-N 3.4Å; L344-L348 WeakPolarHBondContact O-CG 3.38Å; L344-L348 PolarHBondContact O-N 3.07Å; L344-L384 HydrophobicContact CD2-CD1 3.76Å
345	L	83.3	Confident	84.8	Confident	30 Å²	30	51.2 Å²	51.2	16%	0.157	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-37.7	-178.1	-71.1	172.8	0	0	0	112.2	L341 I342 L348 V381 L384 I385 F388	L341-L345 WeakPolarHBondContact O-CB 3.33Å; L341-L345 VanDerWaalsContact O-CG 3.26Å; L341-L345 WeakPolarHBondContact O-CG 3.24Å; L341-L345 PolarHBondContact O-N 3.41Å; I342-L345 PolarHBondContact O-N 2.98Å; L345-L348 HydrophobicContact CD2-CD1 4.43Å; L345-V381 HydrophobicContact CD2-CG1 4.4Å; L345-L384 HydrophobicContact CD2-CB 4.16Å; L345-I385 HydrophobicContact CD1-CG1 4.08Å; L345-I385 HydrophobicContact CD2-CG1 3.93Å; L345-F388 HydrophobicContact CD1-CB 4.44Å
346	S	80	Confident	84.8	Confident	67 Å²	67	45.4 Å²	45.4	47%	0.469	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-47	173.9	-175.4	0	0	0	0	110.9	I342 L344 L348 R349 T350	I342-S346 WeakPolarHBondContact O-CB 3.14Å; I342-S346 PolarHBondContact O-N 3.43Å; L344-S346 VanDerWaalsContact C-N 3.33Å; L344-S346 PolarHBondContact O-N 2.87Å; S346-L348 PolarHBondContact O-N 2.95Å; S346-R349 WeakPolarHBondContact O-CB 3.49Å; S346-R349 PolarHBondContact O-N 3.16Å; S346-T350 PolarHBondContact O-N 3.05Å; S346-T350 PolarHBondContact O-OG1 2.75Å
347	W	87.9	Confident	84.9	Confident	13 Å²	13	45.3 Å²	45.3	5%	0.049	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-34	-178	-169.3	92.2	0	0	0	113.5	L284 I287 I324 L328 Q343 L344 R349 T350 Y351 M356 L375	L284-W347 VanDerWaalsContact CB-CD1 3.5Å; L284-W347 HydrophobicContact CB-CD2 4.25Å; L284-W347 HydrophobicContact CB-CG 3.86Å; L284-W347 HydrophobicContact CD1-CB 3.78Å; L284-W347 HydrophobicContact CD1-CD2 4.44Å; L284-W347 HydrophobicContact CD1-CG 3.91Å; L284-W347 HydrophobicContact CD2-CD2 3.97Å; L284-W347 HydrophobicContact CD2-CE3 4.27Å; L284-W347 HydrophobicContact CD2-CG 4.25Å; L284-W347 HydrophobicContact CD2-CZ2 4.47Å; L284-W347 HydrophobicContact CG-CD2 4.45Å; L284-W347 HydrophobicContact CG-CG 4.23Å; L284-W347 PolarHBondContact O-NE1 3.24Å; I287-W347 HydrophobicContact CB-CZ2 4.44Å; I287-W347 HydrophobicContact CG2-CH2 4.36Å; I287-W347 HydrophobicContact CG2-CZ2 3.99Å; I324-W347 HydrophobicContact CG2-CH2 3.78Å; I324-W347 HydrophobicContact CG2-CZ3 4.12Å; L328-W347 HydrophobicContact CD1-CE3 4.26Å; L328-W347 HydrophobicContact CD1-CZ3 3.73Å; Q343-W347 VanDerWaalsContact O-CB 3.28Å; Q343-W347 WeakPolarHBondContact O-CB 3.49Å; Q343-W347 PolarHBondContact O-N 2.98Å; L344-W347 PolarHBondContact O-N 3.4Å; W347-R349 PolarHBondContact O-N 3.42Å; W347-T350 CarbonylContact O-C 3.56Å; W347-T350 WeakPolarHBondContact O-CA 3.46Å; W347-T350 WeakPolarHBondContact O-CB 3.22Å; W347-T350 PolarHBondContact O-N 3.2Å; W347-Y351 AromaticContact CH2-CD2 3.55Å; W347-Y351 HydrophobicContact CH2-CD2 3.55Å; W347-Y351 HydrophobicContact CH2-CE2 4.11Å; W347-Y351 HydrophobicContact CZ2-CD2 4.42Å; W347-Y351 AromaticContact CZ3-CD2 3.67Å; W347-Y351 HydrophobicContact CZ3-CD2 3.67Å; W347-Y351 HydrophobicContact CZ3-CE2 4.45Å; W347-Y351 HydrophobicContact CZ3-CG 4.34Å; W347-Y351 PolarHBondContact O-N 3.43Å; W347-M356 HydrophobicContact CH2-CE 3.69Å; W347-M356 HydrophobicContact CH2-SD 3.83Å; W347-M356 HydrophobicContact CZ2-CE 3.6Å; W347-M356 HydrophobicContact CZ2-SD 3.54Å; W347-M356 VanDerWaalsContact CZ2-SD 3.54Å; W347-L375 HydrophobicContact CZ3-CD1 4.13Å
348	L	84.5	Confident	84.7	Confident	35 Å²	35	42.7 Å²	42.7	18%	0.183	22%	0.22	C	C	.	.	H	α-helix	trans	-56.7	-32.4	172.5	-72.5	170.5	0	0	0	112.3	L328 L344 L345 S346 L375 L376 V381	L328-L348 HydrophobicContact CD1-CD2 4.04Å; L344-L348 WeakPolarHBondContact O-CG 3.38Å; L344-L348 PolarHBondContact O-N 3.07Å; L345-L348 HydrophobicContact CD2-CD1 4.43Å; S346-L348 PolarHBondContact O-N 2.95Å; L348-L375 HydrophobicContact CD2-CB 4.36Å; L348-L375 HydrophobicContact CD2-CD1 4.07Å; L348-L376 HydrophobicContact CD1-CD1 3.91Å; L348-L376 HydrophobicContact CD2-CD1 4.26Å; L348-L376 HydrophobicContact CD2-CG 4.49Å; L348-V381 HydrophobicContact CD1-CG2 4.45Å
349	R	78.9	Confident	85	Confident	192 Å²	192	44 Å²	44	73%	0.725	23%	0.226	S	C	*	.	H	α-helix	trans	-74.9	-36.2	173.8	-61.9	178.1	175.5	173.5	0.5	111.7	S346 W347 Y351	S346-R349 WeakPolarHBondContact O-CB 3.49Å; S346-R349 PolarHBondContact O-N 3.16Å; W347-R349 PolarHBondContact O-N 3.42Å; R349-Y351 VanDerWaalsContact C-N 3.27Å; R349-Y351 PolarHBondContact O-N 2.95Å
350	T	83.4	Confident	85	Confident	38 Å²	38	47.3 Å²	47.3	23%	0.233	25%	0.25	C	C	.	.	H	α-helix	trans	-67.3	-25.6	176.3	-50.7	0	0	0	0	112.6	S346 W347 C352 S353	S346-T350 PolarHBondContact O-N 3.05Å; S346-T350 PolarHBondContact O-OG1 2.75Å; W347-T350 CarbonylContact O-C 3.56Å; W347-T350 WeakPolarHBondContact O-CA 3.46Å; W347-T350 WeakPolarHBondContact O-CB 3.22Å; W347-T350 PolarHBondContact O-N 3.2Å; T350-C352 VanDerWaalsContact C-N 3.3Å; T350-C352 PolarHBondContact O-N 2.88Å; T350-S353 VanDerWaalsContact O-CB 3.24Å; T350-S353 WeakPolarHBondContact O-CB 3.48Å; T350-S353 PolarHBondContact O-N 3.23Å; T350-S353 PolarHBondContact O-OG 3.19Å
351	Y	87	Confident	84.9	Confident	3 Å²	3	49.6 Å²	49.6	1%	0.012	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-40.3	-177.9	-171.3	-103.3	0	0	0	114.1	H321 I324 W347 R349 M356 L357 V370 L375	H321-Y351 AromaticContact ND1-CE1 3.8Å; H321-Y351 AromaticContact ND1-CZ 3.7Å; H321-Y351 PolarHBondContact ND1-OH 2.88Å; I324-Y351 HydrophobicContact CD1-CE2 4.14Å; I324-Y351 HydrophobicContact CG2-CE2 4.41Å; W347-Y351 AromaticContact CH2-CD2 3.55Å; W347-Y351 HydrophobicContact CH2-CD2 3.55Å; W347-Y351 HydrophobicContact CH2-CE2 4.11Å; W347-Y351 HydrophobicContact CZ2-CD2 4.42Å; W347-Y351 AromaticContact CZ3-CD2 3.67Å; W347-Y351 HydrophobicContact CZ3-CD2 3.67Å; W347-Y351 HydrophobicContact CZ3-CE2 4.45Å; W347-Y351 HydrophobicContact CZ3-CG 4.34Å; W347-Y351 PolarHBondContact O-N 3.43Å; R349-Y351 VanDerWaalsContact C-N 3.27Å; R349-Y351 PolarHBondContact O-N 2.95Å; Y351-M356 HydrophobicContact CD2-CE 3.55Å; Y351-M356 HydrophobicContact CD2-CG 4.48Å; Y351-M356 HydrophobicContact CD2-SD 3.36Å; Y351-M356 WeakPolarHBondContact CD2-SD 3.26Å; Y351-M356 HydrophobicContact CE2-CE 3.52Å; Y351-M356 HydrophobicContact CE2-SD 3.97Å; Y351-M356 HydrophobicContact CG-SD 4.2Å; Y351-L357 HydrophobicContact CD1-CD1 4.16Å; Y351-L357 HydrophobicContact CE1-CD1 3.36Å; Y351-L357 HydrophobicContact CE1-CG 4.15Å; Y351-L357 HydrophobicContact CE2-CD1 4.25Å; Y351-L357 HydrophobicContact CE2-CG 4.36Å; Y351-L357 VanDerWaalsContact CZ-CD1 3.4Å; Y351-L357 PolarHBondContact O-N 2.99Å; Y351-L357 WeakPolarHBondContact OH-CD1 3.41Å; Y351-V370 HydrophobicContact CD1-CG2 3.7Å; Y351-V370 HydrophobicContact CE1-CG2 3.73Å; Y351-L375 HydrophobicContact CD1-CD1 3.59Å; Y351-L375 HydrophobicContact CD1-CG 4.23Å; Y351-L375 HydrophobicContact CD2-CD1 3.64Å; Y351-L375 HydrophobicContact CE1-CD1 3.77Å; Y351-L375 HydrophobicContact CE1-CD2 4.15Å; Y351-L375 HydrophobicContact CE1-CG 3.98Å; Y351-L375 HydrophobicContact CE2-CD1 3.85Å; Y351-L375 HydrophobicContact CE2-CD2 4.21Å; Y351-L375 HydrophobicContact CG-CD1 3.51Å
352	C	82.4	Confident	85	Confident	47 Å²	47	49.6 Å²	49.6	32%	0.318	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-1.2	175.6	-61.6	0	0	0	0	113.4	T350 A366 V370	T350-C352 VanDerWaalsContact C-N 3.3Å; T350-C352 PolarHBondContact O-N 2.88Å; C352-A366 HydrophobicContact CB-CB 4.34Å; C352-V370 VanDerWaalsContact SG-CG2 3.57Å
353	S	82.9	Confident	85.2	Confident	31 Å²	31	54 Å²	54	22%	0.217	29%	0.293	C	S	.	.	S	Bend	trans	-72.9	170	-177.3	91.2	0	0	0	0	111.7	T350 D355 M356 G358	T350-S353 VanDerWaalsContact O-CB 3.24Å; T350-S353 WeakPolarHBondContact O-CB 3.48Å; T350-S353 PolarHBondContact O-N 3.23Å; T350-S353 PolarHBondContact O-OG 3.19Å; S353-D355 PolarHBondContact O-N 3.19Å; S353-D355 VanDerWaalsContact O-N 3.16Å; S353-D355 WeakPolarHBondContact OG-CB 3.32Å; S353-D355 PolarHBondContact OG-N 2.96Å; S353-D355 PolarHBondContact OG-OD2 3.23Å; S353-M356 PolarHBondContact O-N 3.01Å; S353-G358 WeakPolarHBondContact O-CA 3.44Å; S353-G358 PolarHBondContact O-N 3.36Å
354	K	85.7	Confident	85.1	Confident	163 Å²	163	53.8 Å²	53.8	71%	0.709	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.8	173.7	-64.9	-178.9	-179.9	177.7	0	113	M356 H359	K354-M356 VanDerWaalsContact C-N 3.34Å; K354-H359 VanDerWaalsContact O-CA 3.28Å; K354-H359 WeakPolarHBondContact O-CA 3.49Å; K354-H359 WeakPolarHBondContact O-CB 3.43Å
355	D	84.4	Confident	85	Confident	95 Å²	95	58.4 Å²	58.4	51%	0.508	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.3	-178.8	-48.9	-54.6	0	0	0	112.7	R288 S353	R288-D355 PolarHBondContact NH1-O 3.13Å; S353-D355 PolarHBondContact O-N 3.19Å; S353-D355 VanDerWaalsContact O-N 3.16Å; S353-D355 WeakPolarHBondContact OG-CB 3.32Å; S353-D355 PolarHBondContact OG-N 2.96Å; S353-D355 PolarHBondContact OG-OD2 3.23Å
356	M	88	Confident	84.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.1	-112.3	178.6	-162.4	170.9	-179.2	0	0	112.6	I287 R288 V291 V292 I324 W347 Y351 S353 K354 G358 H359	I287-M356 HydrophobicContact CG2-CE 4.29Å; R288-M356 HydrophobicContact CB-SD 4.49Å; R288-M356 HydrophobicContact CG-CB 4.06Å; R288-M356 HydrophobicContact CG-CG 4.1Å; R288-M356 HydrophobicContact CG-SD 4.17Å; V291-M356 HydrophobicContact CB-CE 4.39Å; V291-M356 HydrophobicContact CG1-CE 4.36Å; V292-M356 HydrophobicContact CG2-CB 4.49Å; V292-M356 HydrophobicContact CG2-CG 4.19Å; I324-M356 HydrophobicContact CD1-CE 4.05Å; W347-M356 HydrophobicContact CH2-CE 3.69Å; W347-M356 HydrophobicContact CH2-SD 3.83Å; W347-M356 HydrophobicContact CZ2-CE 3.6Å; W347-M356 HydrophobicContact CZ2-SD 3.54Å; W347-M356 VanDerWaalsContact CZ2-SD 3.54Å; Y351-M356 HydrophobicContact CD2-CE 3.55Å; Y351-M356 HydrophobicContact CD2-CG 4.48Å; Y351-M356 HydrophobicContact CD2-SD 3.36Å; Y351-M356 WeakPolarHBondContact CD2-SD 3.26Å; Y351-M356 HydrophobicContact CE2-CE 3.52Å; Y351-M356 HydrophobicContact CE2-SD 3.97Å; Y351-M356 HydrophobicContact CG-SD 4.2Å; S353-M356 PolarHBondContact O-N 3.01Å; K354-M356 VanDerWaalsContact C-N 3.34Å; M356-G358 VanDerWaalsContact C-N 3.29Å; M356-G358 PolarHBondContact O-N 3.17Å; M356-H359 WeakPolarHBondContact O-CB 3.28Å; M356-H359 PolarHBondContact O-N 3.47Å; M356-H359 VanDerWaalsContact O-N 3.16Å
357	L	88.7	Confident	85	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-24.7	-175.9	-72.6	-168.7	0	0	0	113.3	L295 L317 Y351 H359 L362 A366 L369	L295-L357 HydrophobicContact CD1-CD2 3.82Å; L317-L357 HydrophobicContact CD1-CD1 4.4Å; L317-L357 HydrophobicContact CD1-CD2 3.81Å; Y351-L357 HydrophobicContact CD1-CD1 4.16Å; Y351-L357 HydrophobicContact CE1-CD1 3.36Å; Y351-L357 HydrophobicContact CE1-CG 4.15Å; Y351-L357 HydrophobicContact CE2-CD1 4.25Å; Y351-L357 HydrophobicContact CE2-CG 4.36Å; Y351-L357 VanDerWaalsContact CZ-CD1 3.4Å; Y351-L357 PolarHBondContact O-N 2.99Å; Y351-L357 WeakPolarHBondContact OH-CD1 3.41Å; L357-H359 PolarHBondContact O-N 2.82Å; L357-L362 HydrophobicContact CD2-CD1 4.38Å; L357-A366 HydrophobicContact CB-CB 3.54Å; L357-A366 HydrophobicContact CD1-CB 4.49Å; L357-L369 HydrophobicContact CD1-CD2 3.81Å
358	G	84.4	Confident	84.8	Confident	27 Å²	27	64.3 Å²	64.3	28%	0.278	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	6.6	172.8	0	0	0	0	0	113.7	S353 M356	S353-G358 WeakPolarHBondContact O-CA 3.44Å; S353-G358 PolarHBondContact O-N 3.36Å; M356-G358 VanDerWaalsContact C-N 3.29Å; M356-G358 PolarHBondContact O-N 3.17Å
359	H	88.4	Confident	84.8	Confident	62 Å²	62	64.3 Å²	64.3	29%	0.287	34%	0.343	S	S	.	.			trans	-62.8	131.3	179.5	-172.9	-87.3	0	0	0	111	V292 K354 M356 L357 A361 L362	V292-H359 HydrophobicContact CG1-CB 4.37Å; K354-H359 VanDerWaalsContact O-CA 3.28Å; K354-H359 WeakPolarHBondContact O-CA 3.49Å; K354-H359 WeakPolarHBondContact O-CB 3.43Å; M356-H359 WeakPolarHBondContact O-CB 3.28Å; M356-H359 PolarHBondContact O-N 3.47Å; M356-H359 VanDerWaalsContact O-N 3.16Å; L357-H359 PolarHBondContact O-N 2.82Å; H359-A361 WeakPolarHBondContact ND1-CB 3.45Å; H359-A361 PolarHBondContact ND1-N 3.39Å; H359-A361 PolarHBondContact O-N 2.93Å; H359-A361 VanDerWaalsContact O-N 3.07Å; H359-L362 HydrophobicContact CB-CD1 4.31Å; H359-L362 HydrophobicContact CB-CG 4.34Å; H359-L362 PolarHBondContact O-N 3.01Å
360	P	86.1	Confident	85	Confident	105 Å²	105	57 Å²	57	68%	0.682	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.6	-170.7	21.5	-33.8	0	0	0	113.8	L362	P360-L362 VanDerWaalsContact C-N 3.29Å; P360-L362 PolarHBondContact O-N 3.25Å
361	A	85.7	Confident	84.9	Confident	48 Å²	48	58.4 Å²	58.4	40%	0.397	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-29.2	177.2	0	0	0	0	0	113.2	K299 H359	K299-A361 WeakPolarHBondContact CD-O 3.37Å; K299-A361 PolarHBondContact NZ-O 3.46Å; H359-A361 WeakPolarHBondContact ND1-CB 3.45Å; H359-A361 PolarHBondContact ND1-N 3.39Å; H359-A361 PolarHBondContact O-N 2.93Å; H359-A361 VanDerWaalsContact O-N 3.07Å
362	L	87.8	Confident	84.7	Confident	1 Å²	1	63 Å²	63	1%	0.005	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-34.5	-177.5	-59.6	-178.2	0	0	0	111.4	L295 K299 L357 H359 P360 V364	L295-L362 HydrophobicContact CB-CD1 4.42Å; L295-L362 HydrophobicContact CB-CD2 3.57Å; L295-L362 HydrophobicContact CD1-CD1 4.19Å; K299-L362 VanDerWaalsContact NZ-C 3.27Å; K299-L362 PolarHBondContact NZ-O 3.45Å; L357-L362 HydrophobicContact CD2-CD1 4.38Å; H359-L362 HydrophobicContact CB-CD1 4.31Å; H359-L362 HydrophobicContact CB-CG 4.34Å; H359-L362 PolarHBondContact O-N 3.01Å; P360-L362 VanDerWaalsContact C-N 3.29Å; P360-L362 PolarHBondContact O-N 3.25Å; L362-V364 VanDerWaalsContact C-N 3.25Å; L362-V364 HydrophobicContact CB-CG2 4.07Å; L362-V364 PolarHBondContact O-N 3.01Å
363	N	85.4	Confident	85	Confident	141 Å²	141	66.5 Å²	66.5	75%	0.754	37%	0.371	S	S	*	.			trans	53.3	42.1	-177.2	-161.2	46.2	0	0	0	112.6
364	V	84.5	Confident	85.2	Confident	29 Å²	29	67.9 Å²	67.9	18%	0.176	38%	0.38	C	S	.	.			trans	-103.6	134.9	179	175	0	0	0	0	108.7	F313 L317 L362 A366	F313-V364 HydrophobicContact CE1-CG2 3.91Å; F313-V364 HydrophobicContact CZ-CG2 3.97Å; L317-V364 HydrophobicContact CD1-CG1 4.44Å; L317-V364 HydrophobicContact CD1-CG2 4.45Å; L317-V364 HydrophobicContact CD2-CG1 3.76Å; L317-V364 HydrophobicContact CD2-CG2 4.01Å; L362-V364 VanDerWaalsContact C-N 3.25Å; L362-V364 HydrophobicContact CB-CG2 4.07Å; L362-V364 PolarHBondContact O-N 3.01Å; V364-A366 VanDerWaalsContact C-N 3.25Å; V364-A366 PolarHBondContact O-N 2.86Å
365	D	85.4	Confident	85.3	Confident	98 Å²	98	60.5 Å²	60.5	52%	0.524	35%	0.348	S	S	.	.			trans	-77.6	80.2	168.2	-172.3	-9.3	0	0	0	109.7	A367 R368 L369	D365-A367 PolarHBondContact O-N 3.43Å; D365-A367 PolarHBondContact OD1-N 2.92Å; D365-R368 HydrophobicContact CB-CB 4.15Å; D365-R368 VanDerWaalsContact CG-CB 3.49Å; D365-R368 PolarHBondContact O-N 3.14Å; D365-R368 PolarHBondContact OD1-N 3.45Å; D365-R368 VanDerWaalsContact OD1-N 3.16Å; D365-R368 WeakPolarHBondContact OD2-CB 3.27Å; D365-L369 PolarHBondContact O-N 2.92Å; D365-L369 VanDerWaalsContact O-N 3.11Å
366	A	82.4	Confident	85.5	Confident	4 Å²	4	56.2 Å²	56.2	3%	0.033	33%	0.325	C	S	.	.	H	α-helix	trans	-60.5	-30	-177.1	0	0	0	0	0	112.8	C352 L357 V364 V370	C352-A366 HydrophobicContact CB-CB 4.34Å; L357-A366 HydrophobicContact CB-CB 3.54Å; L357-A366 HydrophobicContact CD1-CB 4.49Å; V364-A366 VanDerWaalsContact C-N 3.25Å; V364-A366 PolarHBondContact O-N 2.86Å; A366-V370 WeakPolarHBondContact O-CG2 3.29Å; A366-V370 PolarHBondContact O-N 3.25Å; A366-V370 VanDerWaalsContact O-N 3.16Å
367	A	80.2	Confident	85.5	Confident	65 Å²	65	59 Å²	59	54%	0.537	34%	0.343	S	S	.	.	H	α-helix	trans	-69.4	-43.8	179.5	0	0	0	0	0	110.9	D365 A371	D365-A367 PolarHBondContact O-N 3.43Å; D365-A367 PolarHBondContact OD1-N 2.92Å; A367-A371 WeakPolarHBondContact O-CB 3.27Å; A367-A371 PolarHBondContact O-N 3Å
368	R	83.7	Confident	85.2	Confident	165 Å²	165	68.6 Å²	68.6	62%	0.623	38%	0.379	S	S	*	.	H	α-helix	trans	-64.9	-44	175.2	-174.3	176.3	178.9	173.3	0.4	112.2	D365 V370 A371 D372	D365-R368 HydrophobicContact CB-CB 4.15Å; D365-R368 VanDerWaalsContact CG-CB 3.49Å; D365-R368 PolarHBondContact O-N 3.14Å; D365-R368 PolarHBondContact OD1-N 3.45Å; D365-R368 VanDerWaalsContact OD1-N 3.16Å; D365-R368 WeakPolarHBondContact OD2-CB 3.27Å; R368-V370 VanDerWaalsContact C-N 3.33Å; R368-V370 PolarHBondContact O-N 3.02Å; R368-A371 WeakPolarHBondContact O-CB 3.32Å; R368-A371 PolarHBondContact O-N 3.47Å; R368-A371 VanDerWaalsContact O-N 3.16Å; R368-D372 IonicContact NE-OD2 2.89Å; R368-D372 PolarHBondContact O-N 3.47Å
369	L	85.6	Confident	85.1	Confident	34 Å²	34	75.2 Å²	75.2	18%	0.178	40%	0.4	C	S	.	.	H	α-helix	trans	-56.3	-47.7	177.7	-178.8	68.7	0	0	0	111.6	L317 L357 D365 A371 D372 H373	L317-L369 HydrophobicContact CD1-CD2 4.44Å; L317-L369 HydrophobicContact CD2-CD2 4.34Å; L317-L369 HydrophobicContact CG-CD2 4.3Å; L357-L369 HydrophobicContact CD1-CD2 3.81Å; D365-L369 PolarHBondContact O-N 2.92Å; D365-L369 VanDerWaalsContact O-N 3.11Å; L369-A371 VanDerWaalsContact C-N 3.33Å; L369-D372 PolarHBondContact O-N 2.92Å; L369-H373 CarbonylContact O-C 3.53Å; L369-H373 WeakPolarHBondContact O-CA 3.28Å; L369-H373 PolarHBondContact O-N 3.36Å
370	V	82.5	Confident	85	Confident	39 Å²	39	73.7 Å²	73.7	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-72.6	-27.1	-179.7	173.8	0	0	0	0	112.5	Y351 C352 A366 R368 H373 P374	Y351-V370 HydrophobicContact CD1-CG2 3.7Å; Y351-V370 HydrophobicContact CE1-CG2 3.73Å; C352-V370 VanDerWaalsContact SG-CG2 3.57Å; A366-V370 WeakPolarHBondContact O-CG2 3.29Å; A366-V370 PolarHBondContact O-N 3.25Å; A366-V370 VanDerWaalsContact O-N 3.16Å; R368-V370 VanDerWaalsContact C-N 3.33Å; R368-V370 PolarHBondContact O-N 3.02Å; V370-H373 CarbonylContact O-C 3.09Å; V370-P374 VanDerWaalsContact O-CA 3.29Å; V370-P374 WeakPolarHBondContact O-CA 3.45Å
371	A	80.9	Confident	84.7	Confident	67 Å²	67	70.5 Å²	70.5	55%	0.554	37%	0.374	S	S	*	.	H	α-helix	trans	-68	-43.3	173.9	0	0	0	0	0	111.9	A367 R368 L369	A367-A371 WeakPolarHBondContact O-CB 3.27Å; A367-A371 PolarHBondContact O-N 3Å; R368-A371 WeakPolarHBondContact O-CB 3.32Å; R368-A371 PolarHBondContact O-N 3.47Å; R368-A371 VanDerWaalsContact O-N 3.16Å; L369-A371 VanDerWaalsContact C-N 3.33Å
372	D	84.1	Confident	84.2	Confident	100 Å²	100	71.8 Å²	71.8	54%	0.535	38%	0.377	S	S	.	.	H	α-helix	trans	-78.8	-41.8	-179.3	-66.3	-21.4	0	0	0	111.3	R368 L369	R368-D372 IonicContact NE-OD2 2.89Å; R368-D372 PolarHBondContact O-N 3.47Å; L369-D372 PolarHBondContact O-N 2.92Å
373	H	87.8	Confident	84	Confident	120 Å²	120	77.6 Å²	77.6	56%	0.556	40%	0.404	S	S	*	.	S	Bend	trans	-131.1	89	-179.2	-58	-55.9	0	0	0	109.9	H321 L369 V370	H321-H373 PolarHBondContact CE1-O 2.85Å; H321-H373 PolarHBondContact NE2-O 3.46Å; L369-H373 CarbonylContact O-C 3.53Å; L369-H373 WeakPolarHBondContact O-CA 3.28Å; L369-H373 PolarHBondContact O-N 3.36Å; V370-H373 CarbonylContact O-C 3.09Å
374	P	86.6	Confident	83.8	Confident	61 Å²	61	71.3 Å²	71.3	40%	0.396	37%	0.37	S	S	.	.			trans	-73.3	139.3	179.2	29	-34.7	0	0	0	111.2	V370 L376	V370-P374 VanDerWaalsContact O-CA 3.29Å; V370-P374 WeakPolarHBondContact O-CA 3.45Å; P374-L376 VanDerWaalsContact C-N 3.27Å; P374-L376 PolarHBondContact O-N 2.85Å
375	L	89.3	Confident	83.2	Confident	7 Å²	7	72.5 Å²	72.5	4%	0.037	38%	0.375	C	S	.	.	S	Bend	trans	-54.5	-44.3	177	-74.1	174.1	0	0	0	112.5	I324 L328 W347 L348 Y351	I324-L375 HydrophobicContact CB-CD2 4.36Å; I324-L375 HydrophobicContact CG2-CD2 3.99Å; L328-L375 HydrophobicContact CD1-CB 4.34Å; L328-L375 HydrophobicContact CD1-CD1 3.97Å; W347-L375 HydrophobicContact CZ3-CD1 4.13Å; L348-L375 HydrophobicContact CD2-CB 4.36Å; L348-L375 HydrophobicContact CD2-CD1 4.07Å; Y351-L375 HydrophobicContact CD1-CD1 3.59Å; Y351-L375 HydrophobicContact CD1-CG 4.23Å; Y351-L375 HydrophobicContact CD2-CD1 3.64Å; Y351-L375 HydrophobicContact CE1-CD1 3.77Å; Y351-L375 HydrophobicContact CE1-CD2 4.15Å; Y351-L375 HydrophobicContact CE1-CG 3.98Å; Y351-L375 HydrophobicContact CE2-CD1 3.85Å; Y351-L375 HydrophobicContact CE2-CD2 4.21Å; Y351-L375 HydrophobicContact CG-CD1 3.51Å
376	L	87.9	Confident	82.8	Confident	6 Å²	6	72.4 Å²	72.4	3%	0.031	38%	0.375	C	S	.	.	S	Bend	trans	-120.9	140	174.2	-67.9	180	0	0	0	109.5	L328 R329 A332 L348 P374 R378 V381 L384	L328-L376 HydrophobicContact CB-CD2 4.02Å; L328-L376 HydrophobicContact CB-CG 4.36Å; R329-L376 HydrophobicContact CB-CD2 4.05Å; A332-L376 HydrophobicContact CB-CD1 4.32Å; A332-L376 HydrophobicContact CB-CD2 4.33Å; L348-L376 HydrophobicContact CD1-CD1 3.91Å; L348-L376 HydrophobicContact CD2-CD1 4.26Å; L348-L376 HydrophobicContact CD2-CG 4.49Å; P374-L376 VanDerWaalsContact C-N 3.27Å; P374-L376 PolarHBondContact O-N 2.85Å; L376-R378 PolarHBondContact O-N 2.88Å; L376-V381 HydrophobicContact CB-CG2 3.81Å; L376-V381 HydrophobicContact CD1-CG2 4.48Å; L376-L384 HydrophobicContact CD1-CD1 4.09Å
377	P	88.3	Confident	82.8	Confident	58 Å²	58	75.4 Å²	75.4	38%	0.377	39%	0.387	S	S	.	.			trans	-55	141.4	171.6	-22.6	33	0	0	0	110.9	K379 T380 V381	P377-K379 PolarHBondContact O-N 2.92Å; P377-K379 VanDerWaalsContact O-N 3.08Å; P377-T380 WeakPolarHBondContact O-CB 3.43Å; P377-T380 PolarHBondContact O-N 3.31Å; P377-V381 PolarHBondContact O-N 3.42Å; P377-V381 VanDerWaalsContact O-N 3.16Å
378	R	81.6	Confident	82.7	Confident	203 Å²	203	73 Å²	73	77%	0.766	37%	0.365	S	S	*	.	H	α-helix	trans	-51.9	-37.1	179.5	-69	-175.5	179.4	175.5	0.7	112.8	L376 V381 T382	L376-R378 PolarHBondContact O-N 2.88Å; R378-V381 PolarHBondContact O-N 3.17Å; R378-T382 PolarHBondContact O-N 3.47Å; R378-T382 PolarHBondContact O-OG1 3.21Å; R378-T382 VanDerWaalsContact O-OG1 3.09Å
379	K	83.2	Confident	82	Confident	166 Å²	166	66.6 Å²	66.6	72%	0.722	34%	0.344	S	S	*	.	H	α-helix	trans	-57.8	-49.1	175.9	-66.1	-174.1	177.8	-176.1	0	112.1	P377 V381 T382 E383	P377-K379 PolarHBondContact O-N 2.92Å; P377-K379 VanDerWaalsContact O-N 3.08Å; K379-V381 VanDerWaalsContact C-N 3.33Å; K379-V381 PolarHBondContact O-N 3.31Å; K379-T382 PolarHBondContact O-N 2.96Å; K379-E383 WeakPolarHBondContact O-CG 3.3Å; K379-E383 PolarHBondContact O-N 3.47Å
380	T	85.7	Confident	81.6	Confident	30 Å²	30	68.2 Å²	68.2	18%	0.184	36%	0.358	C	S	.	.	H	α-helix	trans	-62.1	-41.2	178.5	-50.2	0	0	0	0	111.2	A332 P377 T382 E383 L384	A332-T380 HydrophobicContact CB-CG2 3.9Å; P377-T380 WeakPolarHBondContact O-CB 3.43Å; P377-T380 PolarHBondContact O-N 3.31Å; T380-T382 PolarHBondContact O-N 3.49Å; T380-E383 PolarHBondContact O-N 2.96Å; T380-L384 HydrophobicContact CG2-CD1 4.42Å; T380-L384 VanDerWaalsContact O-CG 3.28Å; T380-L384 WeakPolarHBondContact O-CG 3.35Å; T380-L384 PolarHBondContact O-N 2.95Å
381	V	79.4	Confident	81.5	Confident	39 Å²	39	69.3 Å²	69.3	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-62.7	-43.8	176.1	-179.9	0	0	0	0	111.2	L345 L348 L376 P377 R378 K379 L384 I385	L345-V381 HydrophobicContact CD2-CG1 4.4Å; L348-V381 HydrophobicContact CD1-CG2 4.45Å; L376-V381 HydrophobicContact CB-CG2 3.81Å; L376-V381 HydrophobicContact CD1-CG2 4.48Å; P377-V381 PolarHBondContact O-N 3.42Å; P377-V381 VanDerWaalsContact O-N 3.16Å; R378-V381 PolarHBondContact O-N 3.17Å; K379-V381 VanDerWaalsContact C-N 3.33Å; K379-V381 PolarHBondContact O-N 3.31Å; V381-L384 PolarHBondContact O-N 3.07Å; V381-I385 HydrophobicContact CG1-CD1 3.95Å; V381-I385 VanDerWaalsContact O-CG1 3.3Å; V381-I385 WeakPolarHBondContact O-CG1 3.43Å; V381-I385 PolarHBondContact O-N 3.36Å
382	T	75.1	Confident	81	Confident	75 Å²	75	66.4 Å²	66.4	46%	0.46	34%	0.337	S	S	.	.	H	α-helix	trans	-62.8	-40.4	175.3	-56.8	0	0	0	0	112.2	R378 K379 T380 I385 N386	R378-T382 PolarHBondContact O-N 3.47Å; R378-T382 PolarHBondContact O-OG1 3.21Å; R378-T382 VanDerWaalsContact O-OG1 3.09Å; K379-T382 PolarHBondContact O-N 2.96Å; T380-T382 PolarHBondContact O-N 3.49Å; T382-I385 PolarHBondContact O-N 2.92Å; T382-N386 WeakPolarHBondContact O-CB 3.27Å; T382-N386 PolarHBondContact O-N 2.9Å; T382-N386 PolarHBondContact O-ND2 3.18Å
383	E	83.7	Confident	80.2	Confident	122 Å²	122	61.7 Å²	61.7	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-62.9	-42.7	175.5	-73.7	164.5	-173.3	0	0	112.1	K379 T380 N386 K387	K379-E383 WeakPolarHBondContact O-CG 3.3Å; K379-E383 PolarHBondContact O-N 3.47Å; T380-E383 PolarHBondContact O-N 2.96Å; E383-N386 PolarHBondContact O-N 3Å; E383-K387 WeakPolarHBondContact O-CB 3.31Å; E383-K387 PolarHBondContact O-N 3.43Å
384	L	81.4	Confident	79.7	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.047	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-43.2	175.7	-68.9	171.1	0	0	0	111.9	A332 L336 L341 L344 L345 L376 T380 V381 K387 F388	A332-L384 HydrophobicContact CB-CD1 4.06Å; A332-L384 HydrophobicContact CB-CD2 4.43Å; L336-L384 HydrophobicContact CD1-CD2 3.99Å; L341-L384 HydrophobicContact CD2-CB 4.37Å; L341-L384 HydrophobicContact CD2-CD2 3.59Å; L344-L384 HydrophobicContact CD2-CD1 3.76Å; L345-L384 HydrophobicContact CD2-CB 4.16Å; L376-L384 HydrophobicContact CD1-CD1 4.09Å; T380-L384 HydrophobicContact CG2-CD1 4.42Å; T380-L384 VanDerWaalsContact O-CG 3.28Å; T380-L384 WeakPolarHBondContact O-CG 3.35Å; T380-L384 PolarHBondContact O-N 2.95Å; V381-L384 PolarHBondContact O-N 3.07Å; L384-K387 PolarHBondContact O-N 3.09Å; L384-F388 WeakPolarHBondContact O-CB 3.19Å; L384-F388 PolarHBondContact O-N 3.3Å
385	I	73.4	Confident	79.2	Confident	55 Å²	55	58.9 Å²	58.9	28%	0.282	30%	0.304	S	S	.	.	H	α-helix	trans	-62.4	-48.4	175	-68	167.1	0	0	0	109.9	L345 V381 T382 K387 F388 T389	L345-I385 HydrophobicContact CD1-CG1 4.08Å; L345-I385 HydrophobicContact CD2-CG1 3.93Å; V381-I385 HydrophobicContact CG1-CD1 3.95Å; V381-I385 VanDerWaalsContact O-CG1 3.3Å; V381-I385 WeakPolarHBondContact O-CG1 3.43Å; V381-I385 PolarHBondContact O-N 3.36Å; T382-I385 PolarHBondContact O-N 2.92Å; I385-K387 VanDerWaalsContact C-N 3.32Å; I385-K387 PolarHBondContact O-N 3.45Å; I385-F388 WeakPolarHBondContact O-CB 3.07Å; I385-F388 PolarHBondContact O-N 3.17Å; I385-F388 VanDerWaalsContact O-N 3.17Å; I385-T389 WeakPolarHBondContact O-CB 3.42Å; I385-T389 PolarHBondContact O-N 3.25Å; I385-T389 PolarHBondContact O-OG1 2.8Å
386	N	76.1	Confident	78.3	Confident	96 Å²	96	59.2 Å²	59.2	51%	0.513	31%	0.307	S	S	.	.	H	α-helix	trans	-60.4	-40.9	178.7	-72.4	-16.9	0	0	0	112.2	T382 E383 T389 S390	T382-N386 WeakPolarHBondContact O-CB 3.27Å; T382-N386 PolarHBondContact O-N 2.9Å; T382-N386 PolarHBondContact O-ND2 3.18Å; E383-N386 PolarHBondContact O-N 3Å; N386-T389 PolarHBondContact O-N 2.77Å; N386-S390 VanDerWaalsContact O-CB 3.29Å; N386-S390 WeakPolarHBondContact O-CB 3.28Å; N386-S390 PolarHBondContact O-N 2.79Å
387	K	82.1	Confident	77.4	Confident	66 Å²	66	59.9 Å²	59.9	29%	0.287	31%	0.312	S	S	.	.	H	α-helix	trans	-62.5	-46.4	175.4	-169.3	-176.4	-176.8	-163.9	0	110.9	N335 L336 L341 E383 L384 I385 S390 M391	N335-K387 PolarHBondContact OD1-NZ 2.86Å; L336-K387 PolarHBondContact O-NZ 3.11Å; L341-K387 HydrophobicContact CD1-CB 4.37Å; L341-K387 HydrophobicContact CD1-CD 4.12Å; L341-K387 HydrophobicContact CD1-CG 4.11Å; L341-K387 HydrophobicContact CD2-CD 4.48Å; E383-K387 WeakPolarHBondContact O-CB 3.31Å; E383-K387 PolarHBondContact O-N 3.43Å; L384-K387 PolarHBondContact O-N 3.09Å; I385-K387 VanDerWaalsContact C-N 3.32Å; I385-K387 PolarHBondContact O-N 3.45Å; K387-S390 PolarHBondContact O-N 3.03Å; K387-M391 HydrophobicContact CG-SD 4.24Å; K387-M391 VanDerWaalsContact O-CG 3.28Å; K387-M391 WeakPolarHBondContact O-CG 3.37Å; K387-M391 PolarHBondContact O-N 3.31Å
388	F	78.3	Confident	77	Confident	15 Å²	15	61.9 Å²	61.9	7%	0.066	32%	0.316	C	S	.	.	H	α-helix	trans	-61.2	-44.4	176.4	171.8	-106.9	0	0	0	112.3	K338 L341 I342 L345 L384 I385 M391 T392 A444	K338-F388 HydrophobicContact CG-CD2 4.12Å; K338-F388 HydrophobicContact CG-CE2 3.98Å; L341-F388 HydrophobicContact CB-CB 4.34Å; L341-F388 HydrophobicContact CB-CD2 4.39Å; L341-F388 HydrophobicContact CD1-CB 4.07Å; I342-F388 HydrophobicContact CD1-CE2 3.68Å; I342-F388 HydrophobicContact CD1-CZ 4.24Å; I342-F388 HydrophobicContact CG1-CD2 3.99Å; I342-F388 HydrophobicContact CG1-CE2 3.37Å; I342-F388 HydrophobicContact CG1-CZ 3.91Å; L345-F388 HydrophobicContact CD1-CB 4.44Å; L384-F388 WeakPolarHBondContact O-CB 3.19Å; L384-F388 PolarHBondContact O-N 3.3Å; I385-F388 WeakPolarHBondContact O-CB 3.07Å; I385-F388 PolarHBondContact O-N 3.17Å; I385-F388 VanDerWaalsContact O-N 3.17Å; F388-M391 PolarHBondContact O-N 2.95Å; F388-T392 WeakPolarHBondContact O-CB 3.37Å; F388-T392 PolarHBondContact O-N 3.15Å; F388-T392 PolarHBondContact O-OG1 3.07Å; F388-A444 HydrophobicContact CE1-CB 3.49Å; F388-A444 VanDerWaalsContact CE1-CB 3.49Å; F388-A444 HydrophobicContact CZ-CB 3.94Å
389	T	68.6	Low	76.9	Confident	30 Å²	30	56.9 Å²	56.9	18%	0.184	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-42.5	177.4	-59.2	0	0	0	0	111.1	I385 N386 T392 S393	I385-T389 WeakPolarHBondContact O-CB 3.42Å; I385-T389 PolarHBondContact O-N 3.25Å; I385-T389 PolarHBondContact O-OG1 2.8Å; N386-T389 PolarHBondContact O-N 2.77Å; T389-T392 PolarHBondContact O-N 2.76Å; T389-S393 VanDerWaalsContact O-CB 3.27Å; T389-S393 WeakPolarHBondContact O-CB 3.43Å; T389-S393 PolarHBondContact O-N 3.12Å
390	S	78	Confident	76.4	Confident	69 Å²	69	49.4 Å²	49.4	48%	0.483	27%	0.265	S	S	.	.	H	α-helix	trans	-64.9	-45.7	176.6	176.4	0	0	0	0	112.4	N386 K387 T392 S393 A394	N386-S390 VanDerWaalsContact O-CB 3.29Å; N386-S390 WeakPolarHBondContact O-CB 3.28Å; N386-S390 PolarHBondContact O-N 2.79Å; K387-S390 PolarHBondContact O-N 3.03Å; S390-T392 VanDerWaalsContact C-N 3.35Å; S390-T392 PolarHBondContact O-N 3.48Å; S390-S393 VanDerWaalsContact O-CB 3.27Å; S390-S393 WeakPolarHBondContact O-CB 3.36Å; S390-S393 PolarHBondContact O-N 3.14Å; S390-A394 PolarHBondContact O-N 2.77Å
391	M	80	Confident	76.1	Confident	61 Å²	61	49 Å²	49	30%	0.3	27%	0.267	S	S	.	.	H	α-helix	trans	-62	-43.8	175.9	-69.3	177.4	77.7	0	0	111.4	K338 L341 K387 F388 S393 A394 D395	K338-M391 HydrophobicContact CB-CE 3.94Å; L341-M391 HydrophobicContact CD1-SD 3.78Å; K387-M391 HydrophobicContact CG-SD 4.24Å; K387-M391 VanDerWaalsContact O-CG 3.28Å; K387-M391 WeakPolarHBondContact O-CG 3.37Å; K387-M391 PolarHBondContact O-N 3.31Å; F388-M391 PolarHBondContact O-N 2.95Å; M391-S393 VanDerWaalsContact C-N 3.31Å; M391-S393 PolarHBondContact O-N 3.26Å; M391-A394 PolarHBondContact O-N 3.43Å; M391-D395 VanDerWaalsContact O-CG 3.23Å; M391-D395 PolarHBondContact O-N 3.27Å
392	T	70.5	Confident	76.3	Confident	6 Å²	6	54.8 Å²	54.8	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-37.6	176.8	-59.7	0	0	0	0	112.1	K338 F388 T389 S390 D395 V396 Q440	K338-T392 VanDerWaalsContact CE-OG1 3.26Å; K338-T392 WeakPolarHBondContact CE-OG1 3.37Å; K338-T392 PolarHBondContact NZ-OG1 3.03Å; K338-T392 VanDerWaalsContact NZ-OG1 3.1Å; F388-T392 WeakPolarHBondContact O-CB 3.37Å; F388-T392 PolarHBondContact O-N 3.15Å; F388-T392 PolarHBondContact O-OG1 3.07Å; T389-T392 PolarHBondContact O-N 2.76Å; S390-T392 VanDerWaalsContact C-N 3.35Å; S390-T392 PolarHBondContact O-N 3.48Å; T392-D395 PolarHBondContact O-N 2.82Å; T392-V396 HydrophobicContact CG2-CG2 4.32Å; T392-V396 WeakPolarHBondContact O-CB 3.43Å; T392-V396 WeakPolarHBondContact O-CG2 3.43Å; T392-V396 PolarHBondContact O-N 3.29Å; T392-Q440 HydrophobicContact CG2-CB 4.4Å; T392-Q440 HydrophobicContact CG2-CG 4.29Å; T392-Q440 VanDerWaalsContact CG2-OE1 3.23Å
393	S	68.1	Low	76.6	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-46.6	173.5	-156	0	0	0	0	112.7	T389 S390 M391 S397 S448 E450	T389-S393 VanDerWaalsContact O-CB 3.27Å; T389-S393 WeakPolarHBondContact O-CB 3.43Å; T389-S393 PolarHBondContact O-N 3.12Å; S390-S393 VanDerWaalsContact O-CB 3.27Å; S390-S393 WeakPolarHBondContact O-CB 3.36Å; S390-S393 PolarHBondContact O-N 3.14Å; M391-S393 VanDerWaalsContact C-N 3.31Å; M391-S393 PolarHBondContact O-N 3.26Å; S393-S397 VanDerWaalsContact O-CB 3.3Å; S393-S397 WeakPolarHBondContact O-CB 2.98Å; S393-S397 PolarHBondContact O-N 3.04Å; S393-S397 PolarHBondContact O-OG 2.92Å; S393-S448 WeakPolarHBondContact CA-OG 3.31Å; S393-S448 VanDerWaalsContact CB-CB 3.48Å; S393-S448 WeakPolarHBondContact CB-OG 3.22Å; S393-S448 WeakPolarHBondContact OG-CB 3.18Å; S393-S448 PolarHBondContact OG-OG 3.16Å; S393-E450 WeakPolarHBondContact CB-OE2 3.3Å; S393-E450 VanDerWaalsContact OG-CB 3.24Å; S393-E450 WeakPolarHBondContact OG-CB 3.41Å; S393-E450 PolarHBondContact OG-OE2 3.47Å
394	A	77.5	Confident	76.5	Confident	51 Å²	51	47 Å²	47	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-48.2	178.3	0	0	0	0	0	111.3	S390 M391 V396 S397 E398	S390-A394 PolarHBondContact O-N 2.77Å; M391-A394 PolarHBondContact O-N 3.43Å; A394-V396 VanDerWaalsContact C-N 3.34Å; A394-V396 PolarHBondContact O-N 2.9Å; A394-S397 PolarHBondContact O-N 3.16Å; A394-E398 WeakPolarHBondContact O-CB 3.37Å; A394-E398 PolarHBondContact O-N 3.06Å
395	D	75.8	Confident	76.7	Confident	71 Å²	71	50.3 Å²	50.3	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-56.4	-47.6	178.2	-66.9	-17	0	0	0	111.5	K338 M391 T392 W399	K338-D395 VanDerWaalsContact CD-OD2 3.24Å; K338-D395 WeakPolarHBondContact CD-OD2 3.1Å; K338-D395 IonicContact NZ-OD2 2.73Å; K338-D395 PolarHBondContact NZ-OD2 3.05Å; M391-D395 VanDerWaalsContact O-CG 3.23Å; M391-D395 PolarHBondContact O-N 3.27Å; T392-D395 PolarHBondContact O-N 2.82Å; D395-W399 VanDerWaalsContact O-CB 3.22Å; D395-W399 WeakPolarHBondContact O-CB 3Å; D395-W399 PolarHBondContact O-N 3.21Å
396	V	69.1	Low	77.3	Confident	15 Å²	15	52.3 Å²	52.3	9%	0.091	27%	0.274	C	S	.	.	H	α-helix	trans	-65	-43.3	179.7	171.3	0	0	0	0	110.9	T392 A394 M400 M436 Q440 A451	T392-V396 HydrophobicContact CG2-CG2 4.32Å; T392-V396 WeakPolarHBondContact O-CB 3.43Å; T392-V396 WeakPolarHBondContact O-CG2 3.43Å; T392-V396 PolarHBondContact O-N 3.29Å; A394-V396 VanDerWaalsContact C-N 3.34Å; A394-V396 PolarHBondContact O-N 2.9Å; V396-M400 WeakPolarHBondContact O-CB 3.46Å; V396-M400 PolarHBondContact O-N 3.2Å; V396-M436 HydrophobicContact CB-CE 4.49Å; V396-M436 HydrophobicContact CB-SD 4.34Å; V396-M436 HydrophobicContact CG1-CE 3.53Å; V396-M436 HydrophobicContact CG1-SD 3.99Å; V396-M436 HydrophobicContact CG2-SD 4.3Å; V396-Q440 HydrophobicContact CG2-CG 3.67Å; V396-A451 HydrophobicContact CB-CB 4.23Å; V396-A451 HydrophobicContact CG1-CB 3.38Å
397	S	70.7	Confident	77.7	Confident	20 Å²	20	48.4 Å²	48.4	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-67.9	-42.2	-178.7	-58.5	0	0	0	0	112.2	S393 A394 G401 E450 N454	S393-S397 VanDerWaalsContact O-CB 3.3Å; S393-S397 WeakPolarHBondContact O-CB 2.98Å; S393-S397 PolarHBondContact O-N 3.04Å; S393-S397 PolarHBondContact O-OG 2.92Å; A394-S397 PolarHBondContact O-N 3.16Å; S397-G401 PolarHBondContact O-N 2.83Å; S397-E450 PolarHBondContact OG-O 3.07Å; S397-N454 PolarHBondContact O-ND2 3.06Å
398	E	78.8	Confident	77.8	Confident	99 Å²	99	48.1 Å²	48.1	46%	0.463	25%	0.253	S	S	.	.	H	α-helix	trans	-64.7	-48.2	176.3	-179.3	-177.9	170.2	0	0	110.9	A394 G401 R402	A394-E398 WeakPolarHBondContact O-CB 3.37Å; A394-E398 PolarHBondContact O-N 3.06Å; E398-G401 PolarHBondContact O-N 2.66Å; E398-R402 WeakPolarHBondContact O-CG 3.24Å; E398-R402 PolarHBondContact O-N 2.83Å; E398-R402 IonicContact OE1-CZ 3.9Å; E398-R402 IonicContact OE1-NE 3.58Å; E398-R402 IonicContact OE1-NH1 3.5Å; E398-R402 PolarHBondContact OE1-NH1 2.73Å; E398-R402 VanDerWaalsContact OE1-NH1 3.07Å; E398-R402 IonicContact OE1-NH2 2.68Å; E398-R402 PolarHBondContact OE1-NH2 3.23Å
399	W	78.7	Confident	78.2	Confident	99 Å²	99	51.6 Å²	51.6	38%	0.375	27%	0.272	S	S	.	.	H	α-helix	trans	-64.1	-44.6	178.5	-173.7	97.2	0	0	0	111.5	D395 G401 R402 T403 I432 L433 M436	D395-W399 VanDerWaalsContact O-CB 3.22Å; D395-W399 WeakPolarHBondContact O-CB 3Å; D395-W399 PolarHBondContact O-N 3.21Å; W399-G401 VanDerWaalsContact C-N 3.33Å; W399-G401 PolarHBondContact O-N 2.81Å; W399-R402 WeakPolarHBondContact O-CB 3.03Å; W399-R402 PolarHBondContact O-N 3.45Å; W399-T403 PolarHBondContact O-N 3.27Å; W399-T403 PolarHBondContact O-OG1 3.33Å; W399-T403 VanDerWaalsContact O-OG1 3.04Å; W399-I432 HydrophobicContact CH2-CB 4.33Å; W399-I432 HydrophobicContact CH2-CG2 3.06Å; W399-I432 WeakPolarHBondContact CH2-O 3.5Å; W399-I432 HydrophobicContact CZ2-CG2 3.62Å; W399-I432 HydrophobicContact CZ3-CG2 3.83Å; W399-L433 HydrophobicContact CZ3-CD2 4.34Å; W399-M436 HydrophobicContact CB-SD 4.24Å; W399-M436 HydrophobicContact CD2-SD 3.66Å; W399-M436 HydrophobicContact CE3-CB 4.32Å; W399-M436 HydrophobicContact CE3-CE 3.78Å; W399-M436 HydrophobicContact CE3-CG 4.11Å; W399-M436 HydrophobicContact CE3-SD 3.04Å; W399-M436 HydrophobicContact CG-SD 4.19Å; W399-M436 HydrophobicContact CH2-CB 3.66Å; W399-M436 HydrophobicContact CH2-CG 4.25Å; W399-M436 HydrophobicContact CH2-SD 4.19Å; W399-M436 HydrophobicContact CZ2-CB 4.49Å; W399-M436 HydrophobicContact CZ3-CB 3.64Å; W399-M436 HydrophobicContact CZ3-CE 3.77Å; W399-M436 HydrophobicContact CZ3-CG 3.94Å; W399-M436 HydrophobicContact CZ3-SD 3.36Å; W399-M436 WeakPolarHBondContact CZ3-SD 3.47Å
400	M	74.2	Confident	79.1	Confident	8 Å²	8	52.8 Å²	52.8	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-41.1	177.9	-167	171.3	80.6	0	0	111.4	V396 R402 T403 L404 L433 M436 A451 N454	V396-M400 WeakPolarHBondContact O-CB 3.46Å; V396-M400 PolarHBondContact O-N 3.2Å; M400-R402 VanDerWaalsContact C-N 3.35Å; M400-R402 PolarHBondContact O-N 3.1Å; M400-T403 PolarHBondContact O-N 2.96Å; M400-L404 HydrophobicContact CE-CD1 4.41Å; M400-L404 HydrophobicContact CG-CD1 3.79Å; M400-L404 HydrophobicContact CG-CG 4.32Å; M400-L404 WeakPolarHBondContact O-CB 3.39Å; M400-L404 VanDerWaalsContact O-CG 3.22Å; M400-L404 WeakPolarHBondContact O-CG 3.3Å; M400-L404 PolarHBondContact O-N 3.45Å; M400-L433 HydrophobicContact CG-CD2 3.72Å; M400-L433 HydrophobicContact SD-CD2 4.08Å; M400-M436 HydrophobicContact CB-CE 4.3Å; M400-A451 WeakPolarHBondContact CE-O 3.28Å; M400-N454 HydrophobicContact CE-CB 3.45Å; M400-N454 VanDerWaalsContact CE-CB 3.45Å
401	G	77.9	Confident	79.5	Confident	22 Å²	22	50 Å²	50	23%	0.227	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-43.3	173.9	0	0	0	0	0	112.5	S397 E398 W399 T405	S397-G401 PolarHBondContact O-N 2.83Å; E398-G401 PolarHBondContact O-N 2.66Å; W399-G401 VanDerWaalsContact C-N 3.33Å; W399-G401 PolarHBondContact O-N 2.81Å; G401-T405 WeakPolarHBondContact O-CB 3.26Å; G401-T405 PolarHBondContact O-N 3.38Å; G401-T405 PolarHBondContact O-OG1 3.49Å
402	R	83.9	Confident	79.8	Confident	160 Å²	160	50.6 Å²	50.6	60%	0.604	26%	0.256	S	S	*	.	H	α-helix	trans	-63.5	-47.6	175.2	-74.1	177.2	174.2	151.8	5.5	112.3	E398 W399 M400 L404 T405 Q406	E398-R402 WeakPolarHBondContact O-CG 3.24Å; E398-R402 PolarHBondContact O-N 2.83Å; E398-R402 IonicContact OE1-CZ 3.9Å; E398-R402 IonicContact OE1-NE 3.58Å; E398-R402 IonicContact OE1-NH1 3.5Å; E398-R402 PolarHBondContact OE1-NH1 2.73Å; E398-R402 VanDerWaalsContact OE1-NH1 3.07Å; E398-R402 IonicContact OE1-NH2 2.68Å; E398-R402 PolarHBondContact OE1-NH2 3.23Å; W399-R402 WeakPolarHBondContact O-CB 3.03Å; W399-R402 PolarHBondContact O-N 3.45Å; M400-R402 VanDerWaalsContact C-N 3.35Å; M400-R402 PolarHBondContact O-N 3.1Å; R402-L404 VanDerWaalsContact C-N 3.33Å; R402-L404 PolarHBondContact O-N 2.98Å; R402-T405 PolarHBondContact O-N 2.75Å; R402-Q406 WeakPolarHBondContact O-CB 3.34Å; R402-Q406 PolarHBondContact O-N 3.24Å
403	T	82.8	Confident	80.5	Confident	24 Å²	24	56.2 Å²	56.2	15%	0.147	28%	0.28	C	S	.	.	H	α-helix	trans	-61	-42.3	179.9	-58.6	0	0	0	0	111.4	W399 M400 Q406 E407 L429 I432	W399-T403 PolarHBondContact O-N 3.27Å; W399-T403 PolarHBondContact O-OG1 3.33Å; W399-T403 VanDerWaalsContact O-OG1 3.04Å; M400-T403 PolarHBondContact O-N 2.96Å; T403-Q406 PolarHBondContact O-N 3.39Å; T403-E407 PolarHBondContact O-N 3.01Å; T403-L429 HydrophobicContact CG2-CD1 3.61Å; T403-I432 HydrophobicContact CG2-CG2 3.71Å
404	L	81.4	Confident	81.1	Confident	11 Å²	11	57.7 Å²	57.7	6%	0.058	30%	0.295	C	S	.	.	H	α-helix	trans	-72.8	-35.4	178.8	-66	169.2	0	0	0	112.7	M400 R402 Q406 E407 M408 L429 N454 L456	M400-L404 HydrophobicContact CE-CD1 4.41Å; M400-L404 HydrophobicContact CG-CD1 3.79Å; M400-L404 HydrophobicContact CG-CG 4.32Å; M400-L404 WeakPolarHBondContact O-CB 3.39Å; M400-L404 VanDerWaalsContact O-CG 3.22Å; M400-L404 WeakPolarHBondContact O-CG 3.3Å; M400-L404 PolarHBondContact O-N 3.45Å; R402-L404 VanDerWaalsContact C-N 3.33Å; R402-L404 PolarHBondContact O-N 2.98Å; L404-Q406 VanDerWaalsContact C-N 3.32Å; L404-E407 PolarHBondContact O-N 2.88Å; L404-M408 VanDerWaalsContact O-CG 3.31Å; L404-M408 WeakPolarHBondContact O-CG 3.4Å; L404-M408 PolarHBondContact O-N 3.29Å; L404-L429 HydrophobicContact CD2-CD1 3.74Å; L404-L429 HydrophobicContact CD2-CD2 3.74Å; L404-L429 HydrophobicContact CD2-CG 4.35Å; L404-N454 WeakPolarHBondContact CD1-O 3.49Å; L404-L456 HydrophobicContact CD2-CD1 4.35Å; L404-L456 HydrophobicContact CD2-CG 3.96Å
405	T	84.3	Confident	81.5	Confident	78 Å²	78	59.4 Å²	59.4	48%	0.479	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-43.4	172.5	-55.2	0	0	0	0	110.5	G401 R402 E407 M408 D409	G401-T405 WeakPolarHBondContact O-CB 3.26Å; G401-T405 PolarHBondContact O-N 3.38Å; G401-T405 PolarHBondContact O-OG1 3.49Å; R402-T405 PolarHBondContact O-N 2.75Å; T405-E407 PolarHBondContact O-N 2.6Å; T405-M408 PolarHBondContact O-N 3.07Å; T405-D409 PolarHBondContact O-N 2.76Å
406	Q	86.1	Confident	81.9	Confident	96 Å²	96	59 Å²	59	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-60.8	-44.2	175.7	-176.1	60.9	56.4	0	0	111.7	R402 T403 L404 M408 D409 D410	R402-Q406 WeakPolarHBondContact O-CB 3.34Å; R402-Q406 PolarHBondContact O-N 3.24Å; T403-Q406 PolarHBondContact O-N 3.39Å; L404-Q406 VanDerWaalsContact C-N 3.32Å; Q406-M408 VanDerWaalsContact C-N 3.35Å; Q406-M408 PolarHBondContact O-N 3.03Å; Q406-D409 PolarHBondContact O-N 2.98Å; Q406-D410 PolarHBondContact NE2-OD1 3.43Å; Q406-D410 PolarHBondContact O-N 3.49Å
407	E	85.6	Confident	82.9	Confident	15 Å²	15	59.5 Å²	59.5	7%	0.07	31%	0.31	C	S	.	.	H	α-helix	trans	-59.2	-45.9	175.2	-176.9	76.3	-176.3	0	0	111.4	T403 L404 T405 D409 D410 W411 S427 L429	T403-E407 PolarHBondContact O-N 3.01Å; L404-E407 PolarHBondContact O-N 2.88Å; T405-E407 PolarHBondContact O-N 2.6Å; E407-D409 PolarHBondContact O-N 3.01Å; E407-D410 WeakPolarHBondContact O-CB 3.24Å; E407-D410 PolarHBondContact O-N 3.29Å; E407-W411 HydrophobicContact CG-CZ2 4.4Å; E407-W411 PolarHBondContact O-N 3.35Å; E407-W411 PolarHBondContact O-NE1 3.47Å; E407-S427 VanDerWaalsContact CD-OG 3.27Å; E407-S427 WeakPolarHBondContact OE1-CB 2.8Å; E407-S427 PolarHBondContact OE1-OG 2.72Å; E407-S427 PolarHBondContact OE2-OG 3.46Å; E407-L429 HydrophobicContact CG-CD2 4.08Å
408	M	83.9	Confident	83.8	Confident	59 Å²	59	64.6 Å²	64.6	29%	0.291	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-40.5	178.5	-73	175.7	57	0	0	112.1	L404 T405 Q406 D410 W411 Y412 L456 A460	L404-M408 VanDerWaalsContact O-CG 3.31Å; L404-M408 WeakPolarHBondContact O-CG 3.4Å; L404-M408 PolarHBondContact O-N 3.29Å; T405-M408 PolarHBondContact O-N 3.07Å; Q406-M408 VanDerWaalsContact C-N 3.35Å; Q406-M408 PolarHBondContact O-N 3.03Å; M408-D410 VanDerWaalsContact C-N 3.28Å; M408-D410 PolarHBondContact O-N 3.37Å; M408-W411 HydrophobicContact CG-CE3 4.36Å; M408-W411 HydrophobicContact CG-CH2 4.23Å; M408-W411 HydrophobicContact CG-CZ3 4.08Å; M408-W411 WeakPolarHBondContact O-CB 3.28Å; M408-W411 PolarHBondContact O-N 2.98Å; M408-Y412 WeakPolarHBondContact O-CD2 3.19Å; M408-Y412 WeakPolarHBondContact O-CE2 3.35Å; M408-L456 HydrophobicContact CG-CD2 4.44Å; M408-A460 HydrophobicContact CE-CB 3.49Å; M408-A460 VanDerWaalsContact CE-CB 3.49Å; M408-A460 HydrophobicContact SD-CB 3.81Å
409	D	86.7	Confident	84.3	Confident	89 Å²	89	63.4 Å²	63.4	48%	0.476	33%	0.331	S	S	.	.	H	α-helix	trans	-63.8	-35.7	175.3	-74.7	-19.5	0	0	0	111.5	T405 Q406 E407 W411 Y412	T405-D409 PolarHBondContact O-N 2.76Å; Q406-D409 PolarHBondContact O-N 2.98Å; E407-D409 PolarHBondContact O-N 3.01Å; D409-W411 VanDerWaalsContact C-N 3.28Å; D409-W411 PolarHBondContact O-N 3.02Å; D409-Y412 PolarHBondContact O-N 3.34Å; D409-Y412 VanDerWaalsContact O-N 3.15Å
410	D	86.6	Confident	84.8	Confident	55 Å²	55	60.1 Å²	60.1	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-33.2	177.9	-69.2	-7.3	0	0	0	112.3	Q406 E407 M408 Y412 K413	Q406-D410 PolarHBondContact NE2-OD1 3.43Å; Q406-D410 PolarHBondContact O-N 3.49Å; E407-D410 WeakPolarHBondContact O-CB 3.24Å; E407-D410 PolarHBondContact O-N 3.29Å; M408-D410 VanDerWaalsContact C-N 3.28Å; M408-D410 PolarHBondContact O-N 3.37Å; D410-Y412 PolarHBondContact O-N 3.25Å; D410-K413 HydrophobicContact CB-CD 4.47Å; D410-K413 WeakPolarHBondContact O-CB 3.29Å; D410-K413 PolarHBondContact O-N 2.73Å; D410-K413 VanDerWaalsContact O-N 3.15Å; D410-K413 WeakPolarHBondContact OD1-CE 3.43Å; D410-K413 IonicContact OD1-NZ 3.58Å; D410-K413 PolarHBondContact OD1-NZ 2.78Å
411	W	87.6	Confident	85.4	Confident	11 Å²	11	65.4 Å²	65.4	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-30.1	175.2	-58.1	-12.2	0	0	0	113.2	E407 M408 D409 L456 A460 V461 F464 T481 I485	E407-W411 HydrophobicContact CG-CZ2 4.4Å; E407-W411 PolarHBondContact O-N 3.35Å; E407-W411 PolarHBondContact O-NE1 3.47Å; M408-W411 HydrophobicContact CG-CE3 4.36Å; M408-W411 HydrophobicContact CG-CH2 4.23Å; M408-W411 HydrophobicContact CG-CZ3 4.08Å; M408-W411 WeakPolarHBondContact O-CB 3.28Å; M408-W411 PolarHBondContact O-N 2.98Å; D409-W411 VanDerWaalsContact C-N 3.28Å; D409-W411 PolarHBondContact O-N 3.02Å; W411-L456 HydrophobicContact CH2-CD2 3.2Å; W411-L456 HydrophobicContact CZ2-CD1 4.36Å; W411-L456 HydrophobicContact CZ2-CD2 3.43Å; W411-L456 VanDerWaalsContact CZ2-CD2 3.43Å; W411-L456 HydrophobicContact CZ3-CD2 4.34Å; W411-A460 HydrophobicContact CZ3-CB 4.47Å; W411-V461 HydrophobicContact CH2-CG2 3.98Å; W411-F464 HydrophobicContact CB-CD2 4.29Å; W411-F464 HydrophobicContact CB-CE2 3.99Å; W411-F464 HydrophobicContact CB-CZ 4.2Å; W411-F464 HydrophobicContact CE3-CB 4.21Å; W411-F464 HydrophobicContact CE3-CG 4.21Å; W411-F464 HydrophobicContact CZ3-CB 4.42Å; W411-T481 HydrophobicContact CB-CG2 3.78Å; W411-T481 HydrophobicContact CG-CG2 3.78Å; W411-I485 HydrophobicContact CD2-CD1 3.78Å; W411-I485 HydrophobicContact CD2-CG1 4.35Å; W411-I485 HydrophobicContact CE3-CD1 4.11Å; W411-I485 HydrophobicContact CG-CD1 4.32Å; W411-I485 HydrophobicContact CH2-CD1 3.96Å; W411-I485 HydrophobicContact CH2-CG1 4.34Å; W411-I485 HydrophobicContact CZ2-CD1 3.67Å; W411-I485 HydrophobicContact CZ2-CG1 3.63Å; W411-I485 HydrophobicContact CZ3-CD1 4.2Å
412	Y	85.7	Confident	85.7	Confident	73 Å²	73	73.7 Å²	73.7	29%	0.286	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-2.8	-178.7	-62.5	-75.7	0	0	0	113.5	M408 D409 D410 G414 F464 K467 F475	M408-Y412 WeakPolarHBondContact O-CD2 3.19Å; M408-Y412 WeakPolarHBondContact O-CE2 3.35Å; D409-Y412 PolarHBondContact O-N 3.34Å; D409-Y412 VanDerWaalsContact O-N 3.15Å; D410-Y412 PolarHBondContact O-N 3.25Å; Y412-G414 VanDerWaalsContact C-N 3.28Å; Y412-G414 PolarHBondContact O-N 3.4Å; Y412-F464 HydrophobicContact CD1-CD2 4.14Å; Y412-F464 HydrophobicContact CD1-CE2 4.22Å; Y412-F464 AromaticContact CE1-CD2 3.68Å; Y412-F464 HydrophobicContact CE1-CD2 3.68Å; Y412-F464 HydrophobicContact CE1-CE2 4.21Å; Y412-F464 AromaticContact CZ-CD2 3.96Å; Y412-K467 HydrophobicContact CE1-CD 3.92Å; Y412-K467 PolarHBondContact OH-NZ 2.97Å; Y412-K467 VanDerWaalsContact OH-NZ 3.14Å; Y412-F475 HydrophobicContact CD1-CD1 4.19Å; Y412-F475 AromaticContact CD1-CE1 3.52Å; Y412-F475 HydrophobicContact CD1-CE1 3.52Å; Y412-F475 HydrophobicContact CD1-CZ 4.12Å; Y412-F475 HydrophobicContact CE1-CE1 4.08Å; Y412-F475 HydrophobicContact CE1-CZ 4.24Å
413	K	85.4	Confident	85.9	Confident	123 Å²	123	67.5 Å²	67.5	54%	0.535	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.6	-178.5	-70.9	179.7	178.5	170.9	0	114	D410 T415	D410-K413 HydrophobicContact CB-CD 4.47Å; D410-K413 WeakPolarHBondContact O-CB 3.29Å; D410-K413 PolarHBondContact O-N 2.73Å; D410-K413 VanDerWaalsContact O-N 3.15Å; D410-K413 WeakPolarHBondContact OD1-CE 3.43Å; D410-K413 IonicContact OD1-NZ 3.58Å; D410-K413 PolarHBondContact OD1-NZ 2.78Å; K413-T415 PolarHBondContact O-N 3.46Å
414	G	80.2	Confident	86.2	Confident	32 Å²	32	66.6 Å²	66.6	33%	0.33	36%	0.364	S	S	.	.			trans	68.1	24.5	-177.8	0	0	0	0	0	113.6	Y412 C477	Y412-G414 VanDerWaalsContact C-N 3.28Å; Y412-G414 PolarHBondContact O-N 3.4Å; G414-C477 PolarHBondContact O-SG 2.94Å; G414-C477 VanDerWaalsContact O-SG 3.38Å
415	T	85.3	Confident	86.7	Confident	88 Å²	88	67.1 Å²	67.1	54%	0.54	37%	0.366	S	S	.	.			trans	-104.6	136.8	174.5	51.2	0	0	0	0	109.6	K413	K413-T415 PolarHBondContact O-N 3.46Å
416	A	85.1	Confident	86.9	Confident	61 Å²	61	66.6 Å²	66.6	50%	0.504	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-59.2	138.7	174.2	0	0	0	0	0	110.5
417	P	89.7	Confident	87	Confident	26 Å²	26	62.8 Å²	62.8	17%	0.169	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-61.5	162	174.7	-20.8	33.5	0	0	0	112.4	Y425 Q480	P417-Y425 HydrophobicContact CB-CD1 4.4Å; P417-Y425 HydrophobicContact CB-CG 4.4Å; P417-Q480 HydrophobicContact CG-CB 4.38Å
418	E	89.3	Confident	87.1	Confident	127 Å²	127	64.9 Å²	64.9	59%	0.593	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	155.3	173.6	-62.4	-175.4	178.6	0	0	111.2	Y425 Y426	E418-Y425 CarbonylContact O-C 3.24Å; E418-Y425 VanDerWaalsContact O-CA 3.29Å; E418-Y425 WeakPolarHBondContact O-CA 3.28Å; E418-Y426 HydrophobicContact CB-CD1 4.06Å; E418-Y426 HydrophobicContact CB-CE1 3.5Å; E418-Y426 VanDerWaalsContact CB-CE1 3.5Å; E418-Y426 WeakPolarHBondContact O-CD1 3.4Å; E418-Y426 PolarHBondContact O-N 3.46Å; E418-Y426 PolarHBondContact OE2-OH 2.99Å
419	T	90.6	Very high	87.3	Confident	74 Å²	74	62.1 Å²	62.1	45%	0.454	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	136.6	174.2	47.6	0	0	0	0	111.4	A424 Y425 Y426	T419-A424 CarbonylContact C-O 3.56Å; T419-A424 WeakPolarHBondContact CA-O 2.88Å; T419-Y425 HydrophobicContact CG2-CD1 3.43Å; T419-Y425 VanDerWaalsContact CG2-CD1 3.43Å; T419-Y425 HydrophobicContact CG2-CE1 3.47Å; T419-Y425 VanDerWaalsContact CG2-CE1 3.47Å; T419-Y426 VanDerWaalsContact C-CE1 3.42Å; T419-Y426 WeakPolarHBondContact O-CE1 3.47Å
420	D	87.8	Confident	87.3	Confident	31 Å²	31	58.2 Å²	58.2	17%	0.166	32%	0.321	C	S	.	.			trans	-75.6	179.5	174.5	75.8	8	0	0	0	111.4	Y422 G423 A424 Y426 K596	D420-Y422 PolarHBondContact O-N 3.18Å; D420-Y422 VanDerWaalsContact O-N 3.12Å; D420-Y422 VanDerWaalsContact OD1-C 3.31Å; D420-Y422 VanDerWaalsContact OD1-CA 3.28Å; D420-Y422 WeakPolarHBondContact OD1-CA 3.48Å; D420-Y422 WeakPolarHBondContact OD1-CB 3.36Å; D420-Y422 PolarHBondContact OD1-N 3.29Å; D420-G423 PolarHBondContact O-N 3.3Å; D420-G423 PolarHBondContact OD1-N 3.2Å; D420-A424 PolarHBondContact N-O 3.48Å; D420-A424 PolarHBondContact OD1-N 2.87Å; D420-Y426 HydrophobicContact CB-CD1 3.88Å; D420-Y426 HydrophobicContact CB-CE1 4.29Å; D420-Y426 HydrophobicContact CB-CG 4.34Å; D420-Y426 VanDerWaalsContact N-CD1 3.32Å; D420-K596 IonicContact OD2-NZ 2.77Å; D420-K596 PolarHBondContact OD2-NZ 3.2Å
421	C	86.6	Confident	87.3	Confident	118 Å²	118	59.1 Å²	59.1	80%	0.797	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-12.2	179.1	58.3	0	0	0	0	114.5
422	Y	85.2	Confident	87.2	Confident	196 Å²	196	61.4 Å²	61.4	77%	0.769	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	3.6	174.2	-56.2	-75.1	0	0	0	112.1	D420 A424	D420-Y422 PolarHBondContact O-N 3.18Å; D420-Y422 VanDerWaalsContact O-N 3.12Å; D420-Y422 VanDerWaalsContact OD1-C 3.31Å; D420-Y422 VanDerWaalsContact OD1-CA 3.28Å; D420-Y422 WeakPolarHBondContact OD1-CA 3.48Å; D420-Y422 WeakPolarHBondContact OD1-CB 3.36Å; D420-Y422 PolarHBondContact OD1-N 3.29Å; Y422-A424 VanDerWaalsContact C-N 3.32Å
423	G	87.4	Confident	86.9	Confident	30 Å²	30	58.5 Å²	58.5	31%	0.309	33%	0.334	S	S	.	.	S	Bend	trans	79.7	5.7	-177	0	0	0	0	0	114	D420 H594	D420-G423 PolarHBondContact O-N 3.3Å; D420-G423 PolarHBondContact OD1-N 3.2Å; G423-H594 PolarHBondContact O-ND1 3.24Å
424	A	90.2	Very high	86.7	Confident	5 Å²	5	54.8 Å²	54.8	4%	0.041	32%	0.317	C	S	.	.			trans	-78.3	138.7	178.5	0	0	0	0	0	111.3	T419 D420 Y422 Y426 H594 K596	T419-A424 CarbonylContact C-O 3.56Å; T419-A424 WeakPolarHBondContact CA-O 2.88Å; D420-A424 PolarHBondContact N-O 3.48Å; D420-A424 PolarHBondContact OD1-N 2.87Å; Y422-A424 VanDerWaalsContact C-N 3.32Å; A424-Y426 PolarHBondContact O-N 3.18Å; A424-H594 CarbonylContact C-O 3.56Å; A424-H594 WeakPolarHBondContact CA-O 3.4Å; A424-H594 WeakPolarHBondContact CB-O 3.37Å; A424-K596 HydrophobicContact CB-CD 4.09Å
425	Y	92.4	Very high	86.8	Confident	23 Å²	23	57.8 Å²	57.8	9%	0.09	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	135	174.3	-68.9	-43.1	0	0	0	110.5	P417 E418 T419 Q480 V483 N487 H594	P417-Y425 HydrophobicContact CB-CD1 4.4Å; P417-Y425 HydrophobicContact CB-CG 4.4Å; E418-Y425 CarbonylContact O-C 3.24Å; E418-Y425 VanDerWaalsContact O-CA 3.29Å; E418-Y425 WeakPolarHBondContact O-CA 3.28Å; T419-Y425 HydrophobicContact CG2-CD1 3.43Å; T419-Y425 VanDerWaalsContact CG2-CD1 3.43Å; T419-Y425 HydrophobicContact CG2-CE1 3.47Å; T419-Y425 VanDerWaalsContact CG2-CE1 3.47Å; Y425-Q480 HydrophobicContact CD2-CB 3.99Å; Y425-Q480 HydrophobicContact CD2-CG 4.39Å; Y425-Q480 HydrophobicContact CE2-CB 3.61Å; Y425-Q480 HydrophobicContact CE2-CG 3.52Å; Y425-V483 HydrophobicContact CD2-CB 4.04Å; Y425-V483 HydrophobicContact CD2-CG1 3.7Å; Y425-V483 HydrophobicContact CG-CG1 4.41Å; Y425-N487 WeakPolarHBondContact O-CB 3.4Å; Y425-N487 PolarHBondContact O-ND2 3.4Å; Y425-H594 HydrophobicContact CD1-CB 4.21Å; Y425-H594 HydrophobicContact CD2-CB 3.31Å; Y425-H594 AromaticContact CD2-CG 3.79Å; Y425-H594 HydrophobicContact CE1-CB 4.32Å; Y425-H594 AromaticContact CE1-CG 3.83Å; Y425-H594 AromaticContact CE1-ND1 3.79Å; Y425-H594 HydrophobicContact CE2-CB 3.46Å; Y425-H594 VanDerWaalsContact CE2-CB 3.46Å; Y425-H594 AromaticContact CE2-CD2 3.39Å; Y425-H594 WeakPolarHBondContact CE2-CD2 3.28Å; Y425-H594 AromaticContact CE2-CG 3.43Å; Y425-H594 VanDerWaalsContact CE2-CG 3.43Å; Y425-H594 HydrophobicContact CG-CB 3.69Å; Y425-H594 AromaticContact CZ-CD2 3.29Å; Y425-H594 AromaticContact CZ-CE1 3.91Å; Y425-H594 AromaticContact CZ-CG 3.43Å; Y425-H594 VanDerWaalsContact CZ-CG 3.43Å; Y425-H594 AromaticContact CZ-ND1 3.8Å; Y425-H594 AromaticContact CZ-NE2 3.62Å; Y425-H594 PolarHBondContact N-O 2.97Å; Y425-H594 PolarHBondContact OH-CD2 3.01Å; Y425-H594 VanDerWaalsContact OH-CD2 3.23Å; Y425-H594 PolarHBondContact OH-NE2 2.85Å
426	Y	88.1	Confident	86.5	Confident	67 Å²	67	54.4 Å²	54.4	26%	0.263	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	166.3	-177.3	84	-71.7	0	0	0	112.3	E418 T419 D420 A424	E418-Y426 HydrophobicContact CB-CD1 4.06Å; E418-Y426 HydrophobicContact CB-CE1 3.5Å; E418-Y426 VanDerWaalsContact CB-CE1 3.5Å; E418-Y426 WeakPolarHBondContact O-CD1 3.4Å; E418-Y426 PolarHBondContact O-N 3.46Å; E418-Y426 PolarHBondContact OE2-OH 2.99Å; T419-Y426 VanDerWaalsContact C-CE1 3.42Å; T419-Y426 WeakPolarHBondContact O-CE1 3.47Å; D420-Y426 HydrophobicContact CB-CD1 3.88Å; D420-Y426 HydrophobicContact CB-CE1 4.29Å; D420-Y426 HydrophobicContact CB-CG 4.34Å; D420-Y426 VanDerWaalsContact N-CD1 3.32Å; A424-Y426 PolarHBondContact O-N 3.18Å
427	S	87.8	Confident	85.8	Confident	16 Å²	16	53.4 Å²	53.4	11%	0.112	29%	0.287	C	S	.	.			trans	-124.8	160.8	162.7	77.2	0	0	0	0	110.1	E407 L429 P430 V488	E407-S427 VanDerWaalsContact CD-OG 3.27Å; E407-S427 WeakPolarHBondContact OE1-CB 2.8Å; E407-S427 PolarHBondContact OE1-OG 2.72Å; E407-S427 PolarHBondContact OE2-OG 3.46Å; S427-L429 PolarHBondContact O-N 2.96Å; S427-L429 WeakPolarHBondContact OG-CB 3.15Å; S427-L429 PolarHBondContact OG-N 2.93Å; S427-P430 WeakPolarHBondContact O-CD 3.36Å; S427-V488 WeakPolarHBondContact OG-CG2 3.5Å
428	S	87.5	Confident	85	Confident	58 Å²	58	53.9 Å²	53.9	41%	0.406	29%	0.288	S	S	.	.	S	Bend	trans	-72.3	-2.9	177.5	56.6	0	0	0	0	113.2	S431 I432	S428-S431 PolarHBondContact O-N 3.38Å; S428-S431 PolarHBondContact O-OG 3.04Å; S428-I432 WeakPolarHBondContact O-CB 3.39Å; S428-I432 VanDerWaalsContact O-CG1 3.23Å; S428-I432 WeakPolarHBondContact O-CG1 3.22Å; S428-I432 PolarHBondContact O-N 2.9Å; S428-I432 VanDerWaalsContact OG-CD1 3.28Å; S428-I432 WeakPolarHBondContact OG-CD1 3.43Å
429	L	87.9	Confident	84.3	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-52.7	-50.2	-177.3	179.9	69.1	0	0	0	113.5	T403 L404 E407 S427 S431 I432 L433 L456 V488 W540	T403-L429 HydrophobicContact CG2-CD1 3.61Å; L404-L429 HydrophobicContact CD2-CD1 3.74Å; L404-L429 HydrophobicContact CD2-CD2 3.74Å; L404-L429 HydrophobicContact CD2-CG 4.35Å; E407-L429 HydrophobicContact CG-CD2 4.08Å; S427-L429 PolarHBondContact O-N 2.96Å; S427-L429 WeakPolarHBondContact OG-CB 3.15Å; S427-L429 PolarHBondContact OG-N 2.93Å; L429-S431 PolarHBondContact O-N 3.43Å; L429-I432 PolarHBondContact O-N 2.96Å; L429-L433 HydrophobicContact CD1-CD1 3.85Å; L429-L433 HydrophobicContact CD1-CD2 4.27Å; L429-L433 HydrophobicContact CD1-CG 3.83Å; L429-L433 HydrophobicContact CD2-CD1 4.4Å; L429-L433 HydrophobicContact CG-CD1 3.82Å; L429-L433 HydrophobicContact CG-CG 4.19Å; L429-L433 WeakPolarHBondContact O-CB 3.36Å; L429-L433 VanDerWaalsContact O-CG 3.27Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.92Å; L429-L456 HydrophobicContact CD2-CD1 3.6Å; L429-V488 HydrophobicContact CB-CG1 4.21Å; L429-V488 HydrophobicContact CD2-CG1 3.88Å; L429-V488 HydrophobicContact CG-CG1 4.47Å; L429-W540 HydrophobicContact CD2-CH2 4.45Å
430	P	86.5	Confident	83.2	Confident	7 Å²	7	49.7 Å²	49.7	5%	0.045	27%	0.265	C	S	.	.	H	α-helix	trans	-63	-40.2	-176.4	-21.8	34.7	0	0	0	112.9	S427 Y434 V488 M491 L495	S427-P430 WeakPolarHBondContact O-CD 3.36Å; P430-Y434 WeakPolarHBondContact O-CB 3.45Å; P430-Y434 PolarHBondContact O-N 3.39Å; P430-V488 HydrophobicContact CG-CB 4.35Å; P430-V488 HydrophobicContact CG-CG1 3.89Å; P430-V488 HydrophobicContact CG-CG2 4.46Å; P430-M491 HydrophobicContact CB-CB 4.22Å; P430-M491 HydrophobicContact CG-CB 4.11Å; P430-M491 HydrophobicContact CG-CE 4.11Å; P430-L495 HydrophobicContact CB-CD1 3.5Å; P430-L495 VanDerWaalsContact CB-CD1 3.5Å; P430-L495 VanDerWaalsContact O-CD1 3.27Å; P430-L495 WeakPolarHBondContact O-CD1 3.49Å
431	S	86.6	Confident	82.1	Confident	74 Å²	74	49.7 Å²	49.7	52%	0.517	26%	0.264	S	S	.	.	H	α-helix	trans	-70.9	-41.1	179.6	54.9	0	0	0	0	111.8	S428 L429 Y434 Q435	S428-S431 PolarHBondContact O-N 3.38Å; S428-S431 PolarHBondContact O-OG 3.04Å; L429-S431 PolarHBondContact O-N 3.43Å; S431-Y434 PolarHBondContact O-N 2.95Å; S431-Q435 WeakPolarHBondContact O-CB 3.42Å; S431-Q435 PolarHBondContact O-N 3.49Å
432	I	85.8	Confident	81.1	Confident	60 Å²	60	50.9 Å²	50.9	31%	0.308	26%	0.258	S	S	.	.	H	α-helix	trans	-59.7	-49.7	175	-73.3	174.9	0	0	0	110.5	W399 T403 S428 L429 Y434 Q435 M436	W399-I432 HydrophobicContact CH2-CB 4.33Å; W399-I432 HydrophobicContact CH2-CG2 3.06Å; W399-I432 WeakPolarHBondContact CH2-O 3.5Å; W399-I432 HydrophobicContact CZ2-CG2 3.62Å; W399-I432 HydrophobicContact CZ3-CG2 3.83Å; T403-I432 HydrophobicContact CG2-CG2 3.71Å; S428-I432 WeakPolarHBondContact O-CB 3.39Å; S428-I432 VanDerWaalsContact O-CG1 3.23Å; S428-I432 WeakPolarHBondContact O-CG1 3.22Å; S428-I432 PolarHBondContact O-N 2.9Å; S428-I432 VanDerWaalsContact OG-CD1 3.28Å; S428-I432 WeakPolarHBondContact OG-CD1 3.43Å; L429-I432 PolarHBondContact O-N 2.96Å; I432-Y434 PolarHBondContact O-N 3.41Å; I432-Q435 PolarHBondContact O-N 3.46Å; I432-M436 PolarHBondContact O-N 3.45Å; I432-M436 VanDerWaalsContact O-N 3.08Å
433	L	80.6	Confident	79.7	Confident	11 Å²	11	46.1 Å²	46.1	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-61.6	-44.1	177.9	-69.9	178.4	0	0	0	112.2	W399 M400 L429 M436 I437 W540	W399-L433 HydrophobicContact CZ3-CD2 4.34Å; M400-L433 HydrophobicContact CG-CD2 3.72Å; M400-L433 HydrophobicContact SD-CD2 4.08Å; L429-L433 HydrophobicContact CD1-CD1 3.85Å; L429-L433 HydrophobicContact CD1-CD2 4.27Å; L429-L433 HydrophobicContact CD1-CG 3.83Å; L429-L433 HydrophobicContact CD2-CD1 4.4Å; L429-L433 HydrophobicContact CG-CD1 3.82Å; L429-L433 HydrophobicContact CG-CG 4.19Å; L429-L433 WeakPolarHBondContact O-CB 3.36Å; L429-L433 VanDerWaalsContact O-CG 3.27Å; L429-L433 WeakPolarHBondContact O-CG 3.42Å; L429-L433 PolarHBondContact O-N 2.92Å; L433-M436 PolarHBondContact O-N 2.89Å; L433-I437 WeakPolarHBondContact O-CG1 3.35Å; L433-I437 PolarHBondContact O-N 3.29Å; L433-I437 VanDerWaalsContact O-N 3.16Å; L433-W540 HydrophobicContact CD1-CH2 4.37Å; L433-W540 HydrophobicContact CD1-CZ2 3.98Å
434	Y	80.4	Confident	78.1	Confident	45 Å²	45	45.1 Å²	45.1	18%	0.176	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-46.7	179.4	-179.1	-88.5	0	0	0	112.1	P430 S431 I432 M436 I437 D438 L495 N502	P430-Y434 WeakPolarHBondContact O-CB 3.45Å; P430-Y434 PolarHBondContact O-N 3.39Å; S431-Y434 PolarHBondContact O-N 2.95Å; I432-Y434 PolarHBondContact O-N 3.41Å; Y434-M436 VanDerWaalsContact C-N 3.31Å; Y434-M436 PolarHBondContact O-N 3.45Å; Y434-I437 PolarHBondContact O-N 3.11Å; Y434-D438 HydrophobicContact CE1-CB 4.39Å; Y434-D438 WeakPolarHBondContact O-CB 3.21Å; Y434-D438 PolarHBondContact O-N 3.15Å; Y434-L495 HydrophobicContact CD2-CB 4.13Å; Y434-L495 HydrophobicContact CD2-CD2 3.94Å; Y434-L495 HydrophobicContact CD2-CG 4.5Å; Y434-L495 HydrophobicContact CE2-CD2 4.43Å; Y434-L495 HydrophobicContact CG-CD2 4.18Å; Y434-N502 PolarHBondContact OH-ND2 2.98Å
435	Q	82.7	Confident	76.3	Confident	96 Å²	96	52.5 Å²	52.5	45%	0.449	27%	0.265	S	S	.	.	H	α-helix	trans	-61.3	-41.7	179.6	-170.7	62.6	46.8	0	0	111.4	S431 I432 I437 D438 D439	S431-Q435 WeakPolarHBondContact O-CB 3.42Å; S431-Q435 PolarHBondContact O-N 3.49Å; I432-Q435 PolarHBondContact O-N 3.46Å; Q435-I437 PolarHBondContact O-N 3.5Å; Q435-D438 PolarHBondContact O-N 3.14Å; Q435-D439 PolarHBondContact NE2-OD1 2.95Å; Q435-D439 WeakPolarHBondContact O-CB 3.43Å; Q435-D439 PolarHBondContact O-N 3.22Å
436	M	77.7	Confident	74.1	Confident	16 Å²	16	55.4 Å²	55.4	8%	0.079	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-47.6	176.3	-178.2	-169.5	57.6	0	0	111.5	V396 W399 M400 I432 L433 Y434 D438 D439 Q440	V396-M436 HydrophobicContact CB-CE 4.49Å; V396-M436 HydrophobicContact CB-SD 4.34Å; V396-M436 HydrophobicContact CG1-CE 3.53Å; V396-M436 HydrophobicContact CG1-SD 3.99Å; V396-M436 HydrophobicContact CG2-SD 4.3Å; W399-M436 HydrophobicContact CB-SD 4.24Å; W399-M436 HydrophobicContact CD2-SD 3.66Å; W399-M436 HydrophobicContact CE3-CB 4.32Å; W399-M436 HydrophobicContact CE3-CE 3.78Å; W399-M436 HydrophobicContact CE3-CG 4.11Å; W399-M436 HydrophobicContact CE3-SD 3.04Å; W399-M436 HydrophobicContact CG-SD 4.19Å; W399-M436 HydrophobicContact CH2-CB 3.66Å; W399-M436 HydrophobicContact CH2-CG 4.25Å; W399-M436 HydrophobicContact CH2-SD 4.19Å; W399-M436 HydrophobicContact CZ2-CB 4.49Å; W399-M436 HydrophobicContact CZ3-CB 3.64Å; W399-M436 HydrophobicContact CZ3-CE 3.77Å; W399-M436 HydrophobicContact CZ3-CG 3.94Å; W399-M436 HydrophobicContact CZ3-SD 3.36Å; W399-M436 WeakPolarHBondContact CZ3-SD 3.47Å; M400-M436 HydrophobicContact CB-CE 4.3Å; I432-M436 PolarHBondContact O-N 3.45Å; I432-M436 VanDerWaalsContact O-N 3.08Å; L433-M436 PolarHBondContact O-N 2.89Å; Y434-M436 VanDerWaalsContact C-N 3.31Å; Y434-M436 PolarHBondContact O-N 3.45Å; M436-D438 VanDerWaalsContact C-N 3.34Å; M436-D439 PolarHBondContact O-N 3.34Å; M436-Q440 WeakPolarHBondContact O-CG 3.49Å; M436-Q440 PolarHBondContact O-N 3.04Å; M436-Q440 VanDerWaalsContact O-N 3.07Å
437	I	71.9	Confident	71.9	Confident	41 Å²	41	54.5 Å²	54.5	21%	0.21	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-43.3	-179.5	-65.7	169.3	0	0	0	110.1	L433 Y434 Q435 Q440 M441 I447 L499	L433-I437 WeakPolarHBondContact O-CG1 3.35Å; L433-I437 PolarHBondContact O-N 3.29Å; L433-I437 VanDerWaalsContact O-N 3.16Å; Y434-I437 PolarHBondContact O-N 3.11Å; Q435-I437 PolarHBondContact O-N 3.5Å; I437-Q440 PolarHBondContact O-N 3.33Å; I437-M441 HydrophobicContact CG2-CG 4.25Å; I437-M441 HydrophobicContact CG2-SD 4.23Å; I437-M441 WeakPolarHBondContact O-CB 3.28Å; I437-M441 VanDerWaalsContact O-CG 3.28Å; I437-M441 WeakPolarHBondContact O-CG 3.43Å; I437-M441 PolarHBondContact O-N 3.49Å; I437-I447 HydrophobicContact CG2-CD1 3.83Å; I437-L499 HydrophobicContact CD1-CD2 4.45Å; I437-L499 HydrophobicContact CG2-CD1 3.86Å; I437-L499 HydrophobicContact CG2-CD2 3.79Å; I437-L499 HydrophobicContact CG2-CG 4.49Å
438	D	72.1	Confident	69.6	Low	36 Å²	36	54.2 Å²	54.2	19%	0.193	28%	0.277	C	S	.	.	H	α-helix	trans	-62	-45.4	178.9	-162.8	63	0	0	0	111.7	Y434 Q435 M436 Q440 M441 Q442	Y434-D438 HydrophobicContact CE1-CB 4.39Å; Y434-D438 WeakPolarHBondContact O-CB 3.21Å; Y434-D438 PolarHBondContact O-N 3.15Å; Q435-D438 PolarHBondContact O-N 3.14Å; M436-D438 VanDerWaalsContact C-N 3.34Å; D438-Q440 PolarHBondContact O-N 3.11Å; D438-M441 WeakPolarHBondContact O-CB 3.33Å; D438-M441 PolarHBondContact O-N 2.97Å; D438-Q442 WeakPolarHBondContact O-CG 3.05Å; D438-Q442 PolarHBondContact O-N 2.97Å; D438-Q442 PolarHBondContact OD2-NE2 3.2Å; D438-Q442 VanDerWaalsContact OD2-NE2 3.07Å
439	D	73.7	Confident	67.3	Low	69 Å²	69	55.7 Å²	55.7	37%	0.369	28%	0.28	S	S	.	.	H	α-helix	trans	-60.8	-43.9	177.6	-70.7	-13.1	0	0	0	111.7	Q435 M436 Q442 L443	Q435-D439 PolarHBondContact NE2-OD1 2.95Å; Q435-D439 WeakPolarHBondContact O-CB 3.43Å; Q435-D439 PolarHBondContact O-N 3.22Å; M436-D439 PolarHBondContact O-N 3.34Å; D439-Q442 PolarHBondContact O-N 3.47Å; D439-L443 WeakPolarHBondContact O-CG 3.18Å; D439-L443 PolarHBondContact O-N 2.91Å
440	Q	68.1	Low	65	Low	44 Å²	44	61.2 Å²	61.2	21%	0.206	31%	0.306	C	S	.	.	H	α-helix	trans	-70.2	-34.7	177.2	-63.7	-52	-53.8	0	0	112.1	T392 V396 M436 I437 D438 Q442 L443 A444	T392-Q440 HydrophobicContact CG2-CB 4.4Å; T392-Q440 HydrophobicContact CG2-CG 4.29Å; T392-Q440 VanDerWaalsContact CG2-OE1 3.23Å; V396-Q440 HydrophobicContact CG2-CG 3.67Å; M436-Q440 WeakPolarHBondContact O-CG 3.49Å; M436-Q440 PolarHBondContact O-N 3.04Å; M436-Q440 VanDerWaalsContact O-N 3.07Å; I437-Q440 PolarHBondContact O-N 3.33Å; D438-Q440 PolarHBondContact O-N 3.11Å; Q440-Q442 VanDerWaalsContact C-N 3.31Å; Q440-Q442 PolarHBondContact O-N 3.4Å; Q440-L443 PolarHBondContact O-N 3.32Å; Q440-A444 WeakPolarHBondContact O-CA 3.36Å; Q440-A444 WeakPolarHBondContact O-CB 3.37Å; Q440-A444 PolarHBondContact O-N 3.38Å
441	M	65.1	Low	62.8	Low	31 Å²	31	61.4 Å²	61.4	15%	0.153	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-33.4	174.2	-83.9	-169.5	72.3	0	0	113.4	I437 D438 A444 I447 L499 I503	I437-M441 HydrophobicContact CG2-CG 4.25Å; I437-M441 HydrophobicContact CG2-SD 4.23Å; I437-M441 WeakPolarHBondContact O-CB 3.28Å; I437-M441 VanDerWaalsContact O-CG 3.28Å; I437-M441 WeakPolarHBondContact O-CG 3.43Å; I437-M441 PolarHBondContact O-N 3.49Å; D438-M441 WeakPolarHBondContact O-CB 3.33Å; D438-M441 PolarHBondContact O-N 2.97Å; M441-A444 CarbonylContact C-O 3.58Å; M441-A444 VanDerWaalsContact CA-O 3.28Å; M441-A444 WeakPolarHBondContact CA-O 3.32Å; M441-A444 CarbonylContact O-C 3.58Å; M441-A444 VanDerWaalsContact O-C 3.31Å; M441-I447 HydrophobicContact CG-CD1 3.59Å; M441-I447 HydrophobicContact CG-CG1 3.51Å; M441-I447 HydrophobicContact SD-CD1 3.66Å; M441-I447 HydrophobicContact SD-CG1 4.23Å; M441-L499 HydrophobicContact SD-CD1 3.51Å; M441-L499 VanDerWaalsContact SD-CD1 3.51Å; M441-I503 HydrophobicContact CE-CD1 4.08Å; M441-I503 HydrophobicContact CE-CG1 3.31Å; M441-I503 HydrophobicContact SD-CD1 4.26Å; M441-I503 HydrophobicContact SD-CG1 4.06Å
442	Q	64.4	Low	60.7	Low	143 Å²	143	59.4 Å²	59.4	67%	0.668	29%	0.293	S	S	*	.	H	α-helix	trans	-70.1	-36.6	175.8	-70.7	-177.2	24.8	0	0	111.5	D438 D439 Q440	D438-Q442 WeakPolarHBondContact O-CG 3.05Å; D438-Q442 PolarHBondContact O-N 2.97Å; D438-Q442 PolarHBondContact OD2-NE2 3.2Å; D438-Q442 VanDerWaalsContact OD2-NE2 3.07Å; D439-Q442 PolarHBondContact O-N 3.47Å; Q440-Q442 VanDerWaalsContact C-N 3.31Å; Q440-Q442 PolarHBondContact O-N 3.4Å
443	L	57.2	Low	58.7	Low	95 Å²	95	60.6 Å²	60.6	50%	0.497	31%	0.305	S	S	.	.	H	α-helix	trans	-77.8	-41	178	-68.4	171.6	0	0	0	112.7	D439 Q440	D439-L443 WeakPolarHBondContact O-CG 3.18Å; D439-L443 PolarHBondContact O-N 2.91Å; Q440-L443 PolarHBondContact O-N 3.32Å
444	A	53.6	Low	57.1	Low	9 Å²	9	63.8 Å²	63.8	7%	0.074	32%	0.322	C	S	.	.			trans	-121.5	110.8	-179	0	0	0	0	0	106.8	F388 Q440 M441 E446	F388-A444 HydrophobicContact CE1-CB 3.49Å; F388-A444 VanDerWaalsContact CE1-CB 3.49Å; F388-A444 HydrophobicContact CZ-CB 3.94Å; Q440-A444 WeakPolarHBondContact O-CA 3.36Å; Q440-A444 WeakPolarHBondContact O-CB 3.37Å; Q440-A444 PolarHBondContact O-N 3.38Å; M441-A444 CarbonylContact C-O 3.58Å; M441-A444 VanDerWaalsContact CA-O 3.28Å; M441-A444 WeakPolarHBondContact CA-O 3.32Å; M441-A444 CarbonylContact O-C 3.58Å; M441-A444 VanDerWaalsContact O-C 3.31Å; A444-E446 WeakPolarHBondContact CB-O 3.42Å; A444-E446 PolarHBondContact O-N 3.22Å
445	K	51.9	Low	55.9	Low	160 Å²	160	62.7 Å²	62.7	70%	0.696	32%	0.319	S	S	*	.	S	Bend	trans	-62.2	13.5	169.3	-72.9	-172.4	174.9	-174.7	0	113.4
446	E	46.7	Very low	54.6	Low	84 Å²	84	58.5 Å²	58.5	39%	0.393	30%	0.299	S	S	.	.	S	Bend	trans	-137.5	119.1	-178.1	-62.7	-178.4	175.6	0	0	108.3	A444 L525	A444-E446 WeakPolarHBondContact CB-O 3.42Å; A444-E446 PolarHBondContact O-N 3.22Å; E446-L525 HydrophobicContact CB-CD2 4.45Å; E446-L525 HydrophobicContact CG-CD2 3.76Å
447	I	40.9	Very low	53.9	Low	48 Å²	48	61.7 Å²	61.7	25%	0.246	32%	0.317	C	S	.	.			trans	-81.5	129.1	168.5	-60.7	177.4	0	0	0	107.1	I437 M441 I503 L529	I437-I447 HydrophobicContact CG2-CD1 3.83Å; M441-I447 HydrophobicContact CG-CD1 3.59Å; M441-I447 HydrophobicContact CG-CG1 3.51Å; M441-I447 HydrophobicContact SD-CD1 3.66Å; M441-I447 HydrophobicContact SD-CG1 4.23Å; I447-I503 HydrophobicContact CD1-CD1 4.18Å; I447-L529 HydrophobicContact CB-CD1 3.74Å; I447-L529 HydrophobicContact CB-CD2 4.47Å; I447-L529 HydrophobicContact CD1-CD1 4.05Å; I447-L529 HydrophobicContact CD1-CD2 4.28Å; I447-L529 HydrophobicContact CG1-CD1 4.31Å; I447-L529 HydrophobicContact CG1-CD2 4.41Å; I447-L529 HydrophobicContact CG2-CD1 4.23Å
448	S	41.3	Very low	53.7	Low	11 Å²	11	62.4 Å²	62.4	8%	0.077	32%	0.32	C	S	.	.			trans	-72.9	155	-177.9	72.6	0	0	0	0	113.1	S393 E450	S393-S448 WeakPolarHBondContact CA-OG 3.31Å; S393-S448 VanDerWaalsContact CB-CB 3.48Å; S393-S448 WeakPolarHBondContact CB-OG 3.22Å; S393-S448 WeakPolarHBondContact OG-CB 3.18Å; S393-S448 PolarHBondContact OG-OG 3.16Å; S448-E450 VanDerWaalsContact C-N 3.33Å; S448-E450 PolarHBondContact O-N 3.45Å
449	N	37.6	Very low	53.6	Low	88 Å²	88	66.8 Å²	66.8	47%	0.471	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-13	-168.6	-77.5	-20.8	0	0	0	116.2	R532	N449-R532 VanDerWaalsContact CA-NH1 3.29Å; N449-R532 VanDerWaalsContact CG-NH2 3.33Å; N449-R532 PolarHBondContact O-NH1 2.88Å; N449-R532 PolarHBondContact OD1-NH1 3.36Å; N449-R532 PolarHBondContact OD1-NH2 2.65Å
450	E	39.3	Very low	53.6	Low	118 Å²	118	64 Å²	64	55%	0.551	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	-3	-163.4	-46.1	167.2	142.3	0	0	114.5	S393 S397 S448 P453	S393-E450 WeakPolarHBondContact CB-OE2 3.3Å; S393-E450 VanDerWaalsContact OG-CB 3.24Å; S393-E450 WeakPolarHBondContact OG-CB 3.41Å; S393-E450 PolarHBondContact OG-OE2 3.47Å; S397-E450 PolarHBondContact OG-O 3.07Å; S448-E450 VanDerWaalsContact C-N 3.33Å; S448-E450 PolarHBondContact O-N 3.45Å; E450-P453 WeakPolarHBondContact O-CD 3.48Å
451	A	40.5	Very low	54	Low	11 Å²	11	61.9 Å²	61.9	9%	0.091	32%	0.316	C	S	.	.	S	Bend	trans	-79.1	-17.8	180	0	0	0	0	0	114.2	V396 M400	V396-A451 HydrophobicContact CB-CB 4.23Å; V396-A451 HydrophobicContact CG1-CB 3.38Å; M400-A451 WeakPolarHBondContact CE-O 3.28Å
452	V	43.6	Very low	54.8	Low	32 Å²	32	64.1 Å²	64.1	19%	0.194	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-66.7	-29.9	-176.4	177.6	0	0	0	0	116.2	N454 M455 L536	V452-N454 PolarHBondContact O-N 3.43Å; V452-M455 WeakPolarHBondContact O-CG 3.41Å; V452-L536 HydrophobicContact CG1-CD1 3.85Å
453	P	43.1	Very low	55.6	Low	84 Å²	84	60.2 Å²	60.2	55%	0.545	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-73.7	-23	-172.2	-18.3	32.4	0	0	0	115.9	E450 M455	E450-P453 WeakPolarHBondContact O-CD 3.48Å; P453-M455 PolarHBondContact O-N 2.89Å
454	N	48.3	Very low	56.8	Low	79 Å²	79	55.7 Å²	55.7	42%	0.422	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-84.1	16.5	-171.1	-73.6	-6.2	0	0	0	114.2	S397 M400 L404 V452	S397-N454 PolarHBondContact O-ND2 3.06Å; M400-N454 HydrophobicContact CE-CB 3.45Å; M400-N454 VanDerWaalsContact CE-CB 3.45Å; L404-N454 WeakPolarHBondContact CD1-O 3.49Å; V452-N454 PolarHBondContact O-N 3.43Å
455	M	54.8	Low	58.1	Low	22 Å²	22	56.6 Å²	56.6	11%	0.108	29%	0.291	C	S	.	.	S	Bend	trans	-56.4	152.5	179.3	-64.2	-116.4	123.6	0	0	112.1	V452 P453 D457 L536 W540	V452-M455 WeakPolarHBondContact O-CG 3.41Å; P453-M455 PolarHBondContact O-N 2.89Å; M455-D457 PolarHBondContact O-N 3.32Å; M455-L536 HydrophobicContact CE-CD1 3.25Å; M455-L536 HydrophobicContact CE-CD2 3.76Å; M455-L536 HydrophobicContact CE-CG 3.55Å; M455-L536 HydrophobicContact CG-CD1 3.9Å; M455-L536 HydrophobicContact SD-CD1 3.18Å; M455-L536 WeakPolarHBondContact SD-CD1 3.42Å; M455-L536 HydrophobicContact SD-CD2 4.43Å; M455-L536 HydrophobicContact SD-CG 3.57Å; M455-L536 VanDerWaalsContact SD-CG 3.57Å; M455-W540 HydrophobicContact CE-CZ2 3.6Å; M455-W540 HydrophobicContact SD-CD2 4.21Å; M455-W540 HydrophobicContact SD-CZ2 3.59Å; M455-W540 VanDerWaalsContact SD-CZ2 3.59Å; M455-W540 PolarHBondContact SD-NE1 3.18Å
456	L	55.9	Low	59.7	Low	7 Å²	7	53 Å²	53	4%	0.037	28%	0.279	C	S	.	.			trans	-37.6	104.8	173.3	-107.2	162.6	0	0	0	110.4	L404 M408 W411 L429 I458 W540 N543	L404-L456 HydrophobicContact CD2-CD1 4.35Å; L404-L456 HydrophobicContact CD2-CG 3.96Å; M408-L456 HydrophobicContact CG-CD2 4.44Å; W411-L456 HydrophobicContact CH2-CD2 3.2Å; W411-L456 HydrophobicContact CZ2-CD1 4.36Å; W411-L456 HydrophobicContact CZ2-CD2 3.43Å; W411-L456 VanDerWaalsContact CZ2-CD2 3.43Å; W411-L456 HydrophobicContact CZ3-CD2 4.34Å; L429-L456 HydrophobicContact CD2-CD1 3.6Å; L456-I458 PolarHBondContact O-N 2.81Å; L456-W540 HydrophobicContact CB-CH2 3.97Å; L456-W540 HydrophobicContact CB-CZ3 3.8Å; L456-W540 HydrophobicContact CD1-CH2 3.91Å; L456-W540 HydrophobicContact CD1-CZ3 3.69Å; L456-W540 HydrophobicContact CG-CH2 4.36Å; L456-W540 HydrophobicContact CG-CZ3 4.32Å; L456-N543 PolarHBondContact O-ND2 3.44Å
457	D	62.8	Low	61.4	Low	84 Å²	84	52.3 Å²	52.3	45%	0.449	28%	0.275	S	S	.	.			trans	-67.1	135.5	-170.3	-161.1	-24.4	0	0	0	108.9	M455 E459 A460 V461	M455-D457 PolarHBondContact O-N 3.32Å; D457-E459 HydrophobicContact CB-CB 4.49Å; D457-E459 PolarHBondContact O-N 2.65Å; D457-E459 PolarHBondContact OD1-N 2.81Å; D457-A460 HydrophobicContact CB-CB 4.23Å; D457-A460 VanDerWaalsContact O-CB 3.32Å; D457-A460 WeakPolarHBondContact O-CB 3.44Å; D457-A460 PolarHBondContact O-N 2.9Å; D457-V461 PolarHBondContact O-N 2.86Å
458	I	66.1	Low	63.3	Low	55 Å²	55	50.4 Å²	50.4	28%	0.282	27%	0.265	S	S	.	.	H	α-helix	trans	-52.9	-37.4	171.6	-70.1	167.1	0	0	0	109.1	L456 A460 V461 Q462 L542 N543 I546	L456-I458 PolarHBondContact O-N 2.81Å; I458-A460 VanDerWaalsContact C-N 3.29Å; I458-A460 PolarHBondContact O-N 3.49Å; I458-V461 PolarHBondContact O-N 3.08Å; I458-Q462 HydrophobicContact CG2-CG 4.24Å; I458-Q462 VanDerWaalsContact CG2-NE2 3.33Å; I458-Q462 VanDerWaalsContact O-CB 3.31Å; I458-Q462 WeakPolarHBondContact O-CB 3.49Å; I458-Q462 VanDerWaalsContact O-CG 3.3Å; I458-Q462 WeakPolarHBondContact O-CG 3.4Å; I458-Q462 PolarHBondContact O-N 2.78Å; I458-L542 HydrophobicContact CD1-CD2 3.91Å; I458-N543 WeakPolarHBondContact CG1-OD1 3.35Å; I458-I546 HydrophobicContact CD1-CD1 4.24Å; I458-I546 HydrophobicContact CG1-CD1 4.03Å; I458-I546 HydrophobicContact CG2-CD1 3.81Å
459	E	71.2	Confident	65.3	Low	129 Å²	129	53.3 Å²	53.3	60%	0.603	28%	0.277	S	S	*	.	H	α-helix	trans	-62.1	-34.5	176.7	-63.7	-170.7	175	0	0	112.3	D457 T463	D457-E459 HydrophobicContact CB-CB 4.49Å; D457-E459 PolarHBondContact O-N 2.65Å; D457-E459 PolarHBondContact OD1-N 2.81Å; E459-T463 WeakPolarHBondContact O-CB 3.18Å; E459-T463 PolarHBondContact O-N 2.94Å; E459-T463 PolarHBondContact O-OG1 2.9Å
460	A	74.2	Confident	67.4	Low	9 Å²	9	56.2 Å²	56.2	7%	0.074	29%	0.287	C	S	.	.	H	α-helix	trans	-68.2	-47	178.8	0	0	0	0	0	111.8	M408 W411 D457 I458 T463 F464	M408-A460 HydrophobicContact CE-CB 3.49Å; M408-A460 VanDerWaalsContact CE-CB 3.49Å; M408-A460 HydrophobicContact SD-CB 3.81Å; W411-A460 HydrophobicContact CZ3-CB 4.47Å; D457-A460 HydrophobicContact CB-CB 4.23Å; D457-A460 VanDerWaalsContact O-CB 3.32Å; D457-A460 WeakPolarHBondContact O-CB 3.44Å; D457-A460 PolarHBondContact O-N 2.9Å; I458-A460 VanDerWaalsContact C-N 3.29Å; I458-A460 PolarHBondContact O-N 3.49Å; A460-T463 PolarHBondContact O-N 3.42Å; A460-F464 PolarHBondContact O-N 3.35Å
461	V	75.9	Confident	69.4	Low	1 Å²	1	54.2 Å²	54.2	1%	0.006	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-42.6	177.2	-172.9	0	0	0	0	110.4	W411 D457 I458 T463 F464 H465 M482 I485 F550	W411-V461 HydrophobicContact CH2-CG2 3.98Å; D457-V461 PolarHBondContact O-N 2.86Å; I458-V461 PolarHBondContact O-N 3.08Å; V461-T463 PolarHBondContact O-N 3.36Å; V461-F464 PolarHBondContact O-N 2.94Å; V461-H465 PolarHBondContact O-N 3.48Å; V461-M482 HydrophobicContact CG1-CE 4.29Å; V461-M482 HydrophobicContact CG1-SD 4.09Å; V461-I485 HydrophobicContact CG1-CG2 4.29Å; V461-I485 HydrophobicContact CG2-CG2 4.25Å; V461-F550 HydrophobicContact CG1-CD2 4.04Å; V461-F550 HydrophobicContact CG1-CE2 3.9Å
462	Q	80.9	Confident	71.4	Confident	78 Å²	78	58.2 Å²	58.2	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-61	-42.5	174.2	-80.3	173.9	0.1	0	0	112.4	I458 H465 N466 F550	I458-Q462 HydrophobicContact CG2-CG 4.24Å; I458-Q462 VanDerWaalsContact CG2-NE2 3.33Å; I458-Q462 VanDerWaalsContact O-CB 3.31Å; I458-Q462 WeakPolarHBondContact O-CB 3.49Å; I458-Q462 VanDerWaalsContact O-CG 3.3Å; I458-Q462 WeakPolarHBondContact O-CG 3.4Å; I458-Q462 PolarHBondContact O-N 2.78Å; Q462-H465 PolarHBondContact O-N 3.45Å; Q462-N466 WeakPolarHBondContact O-CB 3.32Å; Q462-N466 PolarHBondContact O-N 3Å; Q462-N466 PolarHBondContact O-ND2 3.11Å; Q462-N466 PolarHBondContact O-OD1 3.34Å; Q462-F550 HydrophobicContact CB-CZ 4.48Å; Q462-F550 HydrophobicContact CG-CE2 4.24Å; Q462-F550 HydrophobicContact CG-CZ 3.75Å
463	T	81.6	Confident	73.1	Confident	60 Å²	60	61.2 Å²	61.2	37%	0.368	32%	0.315	S	S	.	.	H	α-helix	trans	-64.9	-41.9	178.5	-63.3	0	0	0	0	111.2	E459 A460 V461 N466 K467	E459-T463 WeakPolarHBondContact O-CB 3.18Å; E459-T463 PolarHBondContact O-N 2.94Å; E459-T463 PolarHBondContact O-OG1 2.9Å; A460-T463 PolarHBondContact O-N 3.42Å; V461-T463 PolarHBondContact O-N 3.36Å; T463-N466 PolarHBondContact O-N 2.94Å; T463-K467 HydrophobicContact CG2-CD 4.2Å; T463-K467 WeakPolarHBondContact O-CB 3.48Å; T463-K467 VanDerWaalsContact O-CG 3.31Å; T463-K467 WeakPolarHBondContact O-CG 3.5Å; T463-K467 PolarHBondContact O-N 3.14Å
464	F	81.8	Confident	74.7	Confident	1 Å²	1	65.1 Å²	65.1	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-61.5	-47	175.5	-178.5	-114.9	0	0	0	111.5	W411 Y412 A460 V461 K467 H468 F475 F478 T481 M482 I485	W411-F464 HydrophobicContact CB-CD2 4.29Å; W411-F464 HydrophobicContact CB-CE2 3.99Å; W411-F464 HydrophobicContact CB-CZ 4.2Å; W411-F464 HydrophobicContact CE3-CB 4.21Å; W411-F464 HydrophobicContact CE3-CG 4.21Å; W411-F464 HydrophobicContact CZ3-CB 4.42Å; Y412-F464 HydrophobicContact CD1-CD2 4.14Å; Y412-F464 HydrophobicContact CD1-CE2 4.22Å; Y412-F464 AromaticContact CE1-CD2 3.68Å; Y412-F464 HydrophobicContact CE1-CD2 3.68Å; Y412-F464 HydrophobicContact CE1-CE2 4.21Å; Y412-F464 AromaticContact CZ-CD2 3.96Å; A460-F464 PolarHBondContact O-N 3.35Å; V461-F464 PolarHBondContact O-N 2.94Å; F464-K467 PolarHBondContact O-N 3.11Å; F464-H468 PolarHBondContact O-N 3.25Å; F464-F475 HydrophobicContact CE2-CD1 4.33Å; F464-F475 HydrophobicContact CE2-CG 4.47Å; F464-F478 HydrophobicContact CD1-CD2 4.04Å; F464-F478 AromaticContact CD1-CE2 3.87Å; F464-F478 HydrophobicContact CD1-CE2 3.87Å; F464-F478 AromaticContact CE1-CD2 3.47Å; F464-F478 HydrophobicContact CE1-CD2 3.47Å; F464-F478 VanDerWaalsContact CE1-CD2 3.47Å; F464-F478 AromaticContact CE1-CE2 3.75Å; F464-F478 HydrophobicContact CE1-CE2 3.75Å; F464-F478 AromaticContact CZ-CD2 3.88Å; F464-F478 HydrophobicContact CZ-CD2 3.88Å; F464-T481 HydrophobicContact CE1-CG2 3.84Å; F464-T481 HydrophobicContact CZ-CG2 3.88Å; F464-M482 HydrophobicContact CD1-CE 3.87Å; F464-M482 HydrophobicContact CE1-CE 4.33Å; F464-I485 HydrophobicContact CD1-CD1 4.29Å; F464-I485 HydrophobicContact CE1-CD1 4.48Å
465	H	82.9	Confident	76.3	Confident	28 Å²	28	62 Å²	62	13%	0.13	30%	0.302	C	S	.	.	H	α-helix	trans	-55.6	-52.9	172.5	169	-87.4	0	0	0	112.2	V461 Q462 K467 H468 F469 M482 F550	V461-H465 PolarHBondContact O-N 3.48Å; Q462-H465 PolarHBondContact O-N 3.45Å; H465-K467 VanDerWaalsContact C-N 3.32Å; H465-K467 PolarHBondContact O-N 2.89Å; H465-H468 WeakPolarHBondContact O-CB 3.21Å; H465-H468 PolarHBondContact O-N 3.27Å; H465-H468 VanDerWaalsContact O-N 3.08Å; H465-F469 AromaticContact CD2-CD2 3.71Å; H465-F469 AromaticContact CD2-CE2 3.39Å; H465-F469 WeakPolarHBondContact CD2-CE2 3.27Å; H465-F469 AromaticContact CE1-CD2 3.63Å; H465-F469 AromaticContact CE1-CE2 3.78Å; H465-F469 AromaticContact NE2-CD2 3.42Å; H465-F469 WeakPolarHBondContact NE2-CD2 3.38Å; H465-F469 AromaticContact NE2-CE2 3.08Å; H465-F469 WeakPolarHBondContact NE2-CE2 3.44Å; H465-F469 AromaticContact NE2-CZ 3.92Å; H465-F469 WeakPolarHBondContact O-CD2 3.31Å; H465-F469 PolarHBondContact O-N 3.13Å; H465-F469 VanDerWaalsContact O-N 3.14Å; H465-M482 HydrophobicContact CB-CE 4.39Å; H465-F550 HydrophobicContact CB-CD1 4.18Å; H465-F550 HydrophobicContact CB-CD2 3.8Å; H465-F550 HydrophobicContact CB-CE1 4.26Å; H465-F550 HydrophobicContact CB-CE2 3.86Å; H465-F550 HydrophobicContact CB-CG 3.98Å; H465-F550 HydrophobicContact CB-CZ 4.12Å; H465-F550 AromaticContact CD2-CD1 3.16Å; H465-F550 WeakPolarHBondContact CD2-CD1 3.27Å; H465-F550 AromaticContact CD2-CE1 3.84Å; H465-F550 AromaticContact CD2-CG 3.3Å; H465-F550 WeakPolarHBondContact CD2-CG 3.29Å; H465-F550 AromaticContact CE1-CD1 3.85Å; H465-F550 AromaticContact CE1-CE1 3.99Å; H465-F550 AromaticContact CG-CD1 3.52Å; H465-F550 AromaticContact CG-CE1 3.73Å; H465-F550 AromaticContact CG-CG 3.71Å; H465-F550 AromaticContact ND1-CD1 3.93Å; H465-F550 AromaticContact ND1-CE1 3.83Å; H465-F550 AromaticContact NE2-CD1 3.37Å; H465-F550 WeakPolarHBondContact NE2-CD1 3.35Å; H465-F550 AromaticContact NE2-CE1 3.97Å; H465-F550 AromaticContact NE2-CG 3.98Å
466	N	84.9	Confident	77.6	Confident	84 Å²	84	65.6 Å²	65.6	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-61	-41.6	-176.1	-66.6	-14.4	0	0	0	111.9	Q462 T463 H468 F469 E470	Q462-N466 WeakPolarHBondContact O-CB 3.32Å; Q462-N466 PolarHBondContact O-N 3Å; Q462-N466 PolarHBondContact O-ND2 3.11Å; Q462-N466 PolarHBondContact O-OD1 3.34Å; T463-N466 PolarHBondContact O-N 2.94Å; N466-H468 VanDerWaalsContact C-N 3.3Å; N466-H468 PolarHBondContact O-N 3.33Å; N466-F469 PolarHBondContact O-N 2.6Å; N466-E470 WeakPolarHBondContact O-CG 3.5Å; N466-E470 PolarHBondContact O-N 3.15Å
467	K	83	Confident	79.1	Confident	70 Å²	70	66.3 Å²	66.3	30%	0.304	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-34.9	175.8	-74.4	175.5	-179.3	171.8	0	113	Y412 T463 F464 H465 E470 D471 F475	Y412-K467 HydrophobicContact CE1-CD 3.92Å; Y412-K467 PolarHBondContact OH-NZ 2.97Å; Y412-K467 VanDerWaalsContact OH-NZ 3.14Å; T463-K467 HydrophobicContact CG2-CD 4.2Å; T463-K467 WeakPolarHBondContact O-CB 3.48Å; T463-K467 VanDerWaalsContact O-CG 3.31Å; T463-K467 WeakPolarHBondContact O-CG 3.5Å; T463-K467 PolarHBondContact O-N 3.14Å; F464-K467 PolarHBondContact O-N 3.11Å; H465-K467 VanDerWaalsContact C-N 3.32Å; H465-K467 PolarHBondContact O-N 2.89Å; K467-E470 PolarHBondContact O-N 3.4Å; K467-D471 PolarHBondContact O-N 3.01Å; K467-F475 HydrophobicContact CB-CE2 3.7Å; K467-F475 HydrophobicContact CB-CZ 4.11Å; K467-F475 WeakPolarHBondContact O-CE2 3.5Å
468	H	80.8	Confident	80.4	Confident	7 Å²	7	62.4 Å²	62.4	3%	0.032	31%	0.311	C	S	.	.	H	α-helix	trans	-67	-42	174.4	177.5	66.2	0	0	0	112.7	F464 H465 N466 E470 D471 R472 F475 F478 E554	F464-H468 PolarHBondContact O-N 3.25Å; H465-H468 WeakPolarHBondContact O-CB 3.21Å; H465-H468 PolarHBondContact O-N 3.27Å; H465-H468 VanDerWaalsContact O-N 3.08Å; N466-H468 VanDerWaalsContact C-N 3.3Å; N466-H468 PolarHBondContact O-N 3.33Å; H468-E470 VanDerWaalsContact C-N 3.3Å; H468-E470 PolarHBondContact O-N 3.16Å; H468-D471 CarbonylContact O-C 3.47Å; H468-D471 PolarHBondContact O-N 3.33Å; H468-R472 VanDerWaalsContact O-CA 3.26Å; H468-R472 WeakPolarHBondContact O-CA 3.32Å; H468-R472 WeakPolarHBondContact O-CG 3.48Å; H468-R472 PolarHBondContact O-N 2.95Å; H468-F475 HydrophobicContact CB-CD2 4.14Å; H468-F478 HydrophobicContact CB-CD2 3.47Å; H468-F478 VanDerWaalsContact CB-CD2 3.47Å; H468-F478 HydrophobicContact CB-CE2 3.69Å; H468-F478 HydrophobicContact CB-CG 3.99Å; H468-F478 HydrophobicContact CB-CZ 4.35Å; H468-F478 AromaticContact CD2-CD1 3.27Å; H468-F478 WeakPolarHBondContact CD2-CD1 3.35Å; H468-F478 AromaticContact CD2-CD2 3.71Å; H468-F478 AromaticContact CD2-CE1 3.53Å; H468-F478 AromaticContact CD2-CE2 3.95Å; H468-F478 AromaticContact CD2-CG 3.35Å; H468-F478 WeakPolarHBondContact CD2-CG 3.33Å; H468-F478 AromaticContact CD2-CZ 3.86Å; H468-F478 VanDerWaalsContact CE1-CB 3.41Å; H468-F478 WeakPolarHBondContact CE1-CB 3.4Å; H468-F478 AromaticContact CE1-CD1 3.92Å; H468-F478 AromaticContact CE1-CG 3.67Å; H468-F478 AromaticContact CG-CD1 3.87Å; H468-F478 AromaticContact CG-CD2 3.48Å; H468-F478 VanDerWaalsContact CG-CD2 3.48Å; H468-F478 AromaticContact CG-CE2 3.95Å; H468-F478 AromaticContact CG-CG 3.42Å; H468-F478 VanDerWaalsContact CG-CG 3.42Å; H468-F478 WeakPolarHBondContact ND1-CB 3.42Å; H468-F478 AromaticContact ND1-CG 3.67Å; H468-F478 AromaticContact NE2-CD1 3.29Å; H468-F478 VanDerWaalsContact NE2-CD1 3.29Å; H468-F478 WeakPolarHBondContact NE2-CD1 3.3Å; H468-F478 AromaticContact NE2-CE1 3.93Å; H468-F478 AromaticContact NE2-CG 3.5Å; H468-F478 WeakPolarHBondContact NE2-CG 3.49Å; H468-E554 IonicContact CD2-OE1 3.12Å; H468-E554 IonicContact CE1-OE1 3.3Å; H468-E554 IonicContact NE2-OE1 3.68Å; H468-E554 PolarHBondContact NE2-OE1 3.34Å
469	F	81.8	Confident	81.7	Confident	73 Å²	73	60.4 Å²	60.4	32%	0.32	30%	0.302	S	S	.	.	H	α-helix	trans	-75.7	-17.8	177	-76.9	-90.2	0	0	0	113.8	H465 N466 E554 A557	H465-F469 AromaticContact CD2-CD2 3.71Å; H465-F469 AromaticContact CD2-CE2 3.39Å; H465-F469 WeakPolarHBondContact CD2-CE2 3.27Å; H465-F469 AromaticContact CE1-CD2 3.63Å; H465-F469 AromaticContact CE1-CE2 3.78Å; H465-F469 AromaticContact NE2-CD2 3.42Å; H465-F469 WeakPolarHBondContact NE2-CD2 3.38Å; H465-F469 AromaticContact NE2-CE2 3.08Å; H465-F469 WeakPolarHBondContact NE2-CE2 3.44Å; H465-F469 AromaticContact NE2-CZ 3.92Å; H465-F469 WeakPolarHBondContact O-CD2 3.31Å; H465-F469 PolarHBondContact O-N 3.13Å; H465-F469 VanDerWaalsContact O-N 3.14Å; N466-F469 PolarHBondContact O-N 2.6Å; F469-E554 HydrophobicContact CZ-CB 4.04Å; F469-E554 HydrophobicContact CZ-CG 4.41Å; F469-A557 HydrophobicContact CE1-CB 4.29Å
470	E	82.9	Confident	82.7	Confident	148 Å²	148	55.8 Å²	55.8	69%	0.692	28%	0.28	S	S	*	.	H	α-helix	trans	-68	-43.9	166.8	-75	171.4	-172.6	0	0	111.8	N466 K467 H468	N466-E470 WeakPolarHBondContact O-CG 3.5Å; N466-E470 PolarHBondContact O-N 3.15Å; K467-E470 PolarHBondContact O-N 3.4Å; H468-E470 VanDerWaalsContact C-N 3.3Å; H468-E470 PolarHBondContact O-N 3.16Å
471	D	81.1	Confident	83.6	Confident	77 Å²	77	55.7 Å²	55.7	41%	0.412	28%	0.278	S	S	.	.			trans	-152.1	97.4	176.3	-177	1.6	0	0	0	111.5	K467 H468 S473 R474	K467-D471 PolarHBondContact O-N 3.01Å; H468-D471 CarbonylContact O-C 3.47Å; H468-D471 PolarHBondContact O-N 3.33Å; D471-S473 VanDerWaalsContact CG-OG 3.3Å; D471-S473 PolarHBondContact O-N 3.01Å; D471-S473 VanDerWaalsContact O-N 3.11Å; D471-S473 WeakPolarHBondContact OD1-CB 3.46Å; D471-S473 PolarHBondContact OD1-N 3.49Å; D471-S473 PolarHBondContact OD1-OG 2.9Å; D471-S473 PolarHBondContact OD2-OG 3.24Å; D471-R474 HydrophobicContact CB-CB 4.36Å; D471-R474 WeakPolarHBondContact O-CB 3.41Å; D471-R474 PolarHBondContact O-N 3.43Å; D471-R474 VanDerWaalsContact O-N 3.1Å
472	R	81.9	Confident	84.4	Confident	94 Å²	94	55.6 Å²	55.6	36%	0.355	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.3	-178.9	-68.7	-171.7	176.3	-178.1	0.1	113.4	H468 R474 D558	H468-R472 VanDerWaalsContact O-CA 3.26Å; H468-R472 WeakPolarHBondContact O-CA 3.32Å; H468-R472 WeakPolarHBondContact O-CG 3.48Å; H468-R472 PolarHBondContact O-N 2.95Å; R472-R474 VanDerWaalsContact C-N 3.26Å; R472-R474 PolarHBondContact O-N 3.18Å; R472-D558 IonicContact CZ-OD1 2.74Å; R472-D558 VanDerWaalsContact CZ-OD1 3.24Å; R472-D558 IonicContact NH1-OD1 3.26Å; R472-D558 PolarHBondContact NH1-OD1 3.21Å; R472-D558 IonicContact NH1-OD2 3.72Å; R472-D558 PolarHBondContact NH1-OD2 3.1Å; R472-D558 IonicContact NH2-OD1 3.81Å; R472-D558 PolarHBondContact NH2-OD1 2.97Å
473	S	78.8	Confident	85	Confident	95 Å²	95	51.9 Å²	51.9	66%	0.664	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-20.4	179.5	75.2	0	0	0	0	112.8	D471	D471-S473 VanDerWaalsContact CG-OG 3.3Å; D471-S473 PolarHBondContact O-N 3.01Å; D471-S473 VanDerWaalsContact O-N 3.11Å; D471-S473 WeakPolarHBondContact OD1-CB 3.46Å; D471-S473 PolarHBondContact OD1-N 3.49Å; D471-S473 PolarHBondContact OD1-OG 2.9Å; D471-S473 PolarHBondContact OD2-OG 3.24Å
474	R	77.4	Confident	85.6	Confident	167 Å²	167	49.3 Å²	49.3	63%	0.63	25%	0.245	S	C	*	.	S	Bend	trans	-77.8	-24.3	-174.6	-167.3	174.7	177.6	-177.8	1.5	113.3	D471 R472	D471-R474 HydrophobicContact CB-CB 4.36Å; D471-R474 WeakPolarHBondContact O-CB 3.41Å; D471-R474 PolarHBondContact O-N 3.43Å; D471-R474 VanDerWaalsContact O-N 3.1Å; R472-R474 VanDerWaalsContact C-N 3.26Å; R472-R474 PolarHBondContact O-N 3.18Å
475	F	82.7	Confident	86	Confident	14 Å²	14	49.3 Å²	49.3	6%	0.061	25%	0.245	C	C	.	.			trans	-127.8	74.4	-175.9	-51.4	-66.5	0	0	0	110.4	Y412 F464 K467 H468 C477 F478	Y412-F475 HydrophobicContact CD1-CD1 4.19Å; Y412-F475 AromaticContact CD1-CE1 3.52Å; Y412-F475 HydrophobicContact CD1-CE1 3.52Å; Y412-F475 HydrophobicContact CD1-CZ 4.12Å; Y412-F475 HydrophobicContact CE1-CE1 4.08Å; Y412-F475 HydrophobicContact CE1-CZ 4.24Å; F464-F475 HydrophobicContact CE2-CD1 4.33Å; F464-F475 HydrophobicContact CE2-CG 4.47Å; K467-F475 HydrophobicContact CB-CE2 3.7Å; K467-F475 HydrophobicContact CB-CZ 4.11Å; K467-F475 WeakPolarHBondContact O-CE2 3.5Å; H468-F475 HydrophobicContact CB-CD2 4.14Å; F475-C477 PolarHBondContact O-N 3.49Å; F475-C477 VanDerWaalsContact O-N 3.12Å; F475-F478 HydrophobicContact CB-CB 4.28Å; F475-F478 WeakPolarHBondContact O-CB 3.28Å; F475-F478 PolarHBondContact O-N 3.43Å; F475-F478 VanDerWaalsContact O-N 3.09Å
476	P	80.8	Confident	86.6	Confident	97 Å²	97	48 Å²	48	63%	0.63	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.6	-172.7	25.6	-35.4	0	0	0	113.6
477	C	87.6	Confident	87	Confident	22 Å²	22	44 Å²	44	15%	0.149	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	22.5	178.6	-62.5	0	0	0	0	113.7	G414 F475 T479 Q480 T481	G414-C477 PolarHBondContact O-SG 2.94Å; G414-C477 VanDerWaalsContact O-SG 3.38Å; F475-C477 PolarHBondContact O-N 3.49Å; F475-C477 VanDerWaalsContact O-N 3.12Å; C477-T479 PolarHBondContact O-N 3.47Å; C477-Q480 VanDerWaalsContact C-OE1 3.31Å; C477-Q480 PolarHBondContact O-N 3.48Å; C477-Q480 PolarHBondContact O-OE1 3.36Å; C477-T481 WeakPolarHBondContact O-CB 3.34Å; C477-T481 PolarHBondContact O-N 2.7Å; C477-T481 PolarHBondContact O-OG1 3.22Å
478	F	90.8	Very high	87.4	Confident	1 Å²	1	40.7 Å²	40.7	0%	0.004	20%	0.203	C	C	.	.	H	α-helix	trans	-53.5	-49.7	-175.9	172.9	-96.1	0	0	0	112.8	F464 H468 F475 T481 M482 E554	F464-F478 HydrophobicContact CD1-CD2 4.04Å; F464-F478 AromaticContact CD1-CE2 3.87Å; F464-F478 HydrophobicContact CD1-CE2 3.87Å; F464-F478 AromaticContact CE1-CD2 3.47Å; F464-F478 HydrophobicContact CE1-CD2 3.47Å; F464-F478 VanDerWaalsContact CE1-CD2 3.47Å; F464-F478 AromaticContact CE1-CE2 3.75Å; F464-F478 HydrophobicContact CE1-CE2 3.75Å; F464-F478 AromaticContact CZ-CD2 3.88Å; F464-F478 HydrophobicContact CZ-CD2 3.88Å; H468-F478 HydrophobicContact CB-CD2 3.47Å; H468-F478 VanDerWaalsContact CB-CD2 3.47Å; H468-F478 HydrophobicContact CB-CE2 3.69Å; H468-F478 HydrophobicContact CB-CG 3.99Å; H468-F478 HydrophobicContact CB-CZ 4.35Å; H468-F478 AromaticContact CD2-CD1 3.27Å; H468-F478 WeakPolarHBondContact CD2-CD1 3.35Å; H468-F478 AromaticContact CD2-CD2 3.71Å; H468-F478 AromaticContact CD2-CE1 3.53Å; H468-F478 AromaticContact CD2-CE2 3.95Å; H468-F478 AromaticContact CD2-CG 3.35Å; H468-F478 WeakPolarHBondContact CD2-CG 3.33Å; H468-F478 AromaticContact CD2-CZ 3.86Å; H468-F478 VanDerWaalsContact CE1-CB 3.41Å; H468-F478 WeakPolarHBondContact CE1-CB 3.4Å; H468-F478 AromaticContact CE1-CD1 3.92Å; H468-F478 AromaticContact CE1-CG 3.67Å; H468-F478 AromaticContact CG-CD1 3.87Å; H468-F478 AromaticContact CG-CD2 3.48Å; H468-F478 VanDerWaalsContact CG-CD2 3.48Å; H468-F478 AromaticContact CG-CE2 3.95Å; H468-F478 AromaticContact CG-CG 3.42Å; H468-F478 VanDerWaalsContact CG-CG 3.42Å; H468-F478 WeakPolarHBondContact ND1-CB 3.42Å; H468-F478 AromaticContact ND1-CG 3.67Å; H468-F478 AromaticContact NE2-CD1 3.29Å; H468-F478 VanDerWaalsContact NE2-CD1 3.29Å; H468-F478 WeakPolarHBondContact NE2-CD1 3.3Å; H468-F478 AromaticContact NE2-CE1 3.93Å; H468-F478 AromaticContact NE2-CG 3.5Å; H468-F478 WeakPolarHBondContact NE2-CG 3.49Å; F475-F478 HydrophobicContact CB-CB 4.28Å; F475-F478 WeakPolarHBondContact O-CB 3.28Å; F475-F478 PolarHBondContact O-N 3.43Å; F475-F478 VanDerWaalsContact O-N 3.09Å; F478-T481 PolarHBondContact O-N 3.41Å; F478-M482 HydrophobicContact CE1-CB 4.47Å; F478-M482 HydrophobicContact CE2-CE 3.54Å; F478-M482 HydrophobicContact CZ-CB 4.45Å; F478-M482 HydrophobicContact CZ-CE 3.52Å; F478-M482 VanDerWaalsContact O-CB 3.32Å; F478-M482 WeakPolarHBondContact O-CB 3.31Å; F478-M482 PolarHBondContact O-N 3.27Å; F478-E554 WeakPolarHBondContact CD1-OE1 3.33Å; F478-E554 WeakPolarHBondContact CD1-OE2 3.41Å; F478-E554 WeakPolarHBondContact CE1-OE2 3.5Å
479	T	91.8	Very high	87.9	Confident	14 Å²	14	40.3 Å²	40.3	9%	0.086	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-45.5	-176.9	-49.7	0	0	0	0	110.9	C477 T481 M482 V483 L551 E554 Y588 D591	C477-T479 PolarHBondContact O-N 3.47Å; T479-T481 PolarHBondContact O-N 3.25Å; T479-M482 PolarHBondContact O-N 3.43Å; T479-V483 VanDerWaalsContact O-CG2 3.28Å; T479-V483 WeakPolarHBondContact O-CG2 3.23Å; T479-V483 PolarHBondContact O-N 2.9Å; T479-L551 HydrophobicContact CG2-CD2 4Å; T479-E554 PolarHBondContact OG1-OE2 3.23Å; T479-Y588 HydrophobicContact CG2-CD1 4.22Å; T479-D591 HydrophobicContact CG2-CB 3.77Å
480	Q	93.5	Very high	88.4	Confident	32 Å²	32	38.2 Å²	38.2	15%	0.15	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-43.3	176.3	-58.7	89.9	0.4	0	0	111.9	P417 Y425 C477 M482 V483 S484 D591	P417-Q480 HydrophobicContact CG-CB 4.38Å; Y425-Q480 HydrophobicContact CD2-CB 3.99Å; Y425-Q480 HydrophobicContact CD2-CG 4.39Å; Y425-Q480 HydrophobicContact CE2-CB 3.61Å; Y425-Q480 HydrophobicContact CE2-CG 3.52Å; C477-Q480 VanDerWaalsContact C-OE1 3.31Å; C477-Q480 PolarHBondContact O-N 3.48Å; C477-Q480 PolarHBondContact O-OE1 3.36Å; Q480-M482 PolarHBondContact O-N 3.37Å; Q480-V483 PolarHBondContact O-N 3.37Å; Q480-S484 PolarHBondContact O-N 2.99Å; Q480-D591 HydrophobicContact CG-CB 4.49Å; Q480-D591 WeakPolarHBondContact CG-OD1 3.15Å; Q480-D591 VanDerWaalsContact NE2-CG 3.32Å; Q480-D591 PolarHBondContact NE2-OD1 3.19Å; Q480-D591 PolarHBondContact NE2-OD2 3.13Å
481	T	92.1	Very high	88.8	Confident	6 Å²	6	32.7 Å²	32.7	4%	0.037	17%	0.168	C	C	.	.	H	α-helix	trans	-62.4	-41.9	176.7	-59.9	0	0	0	0	111.6	W411 F464 C477 F478 T479 S484 I485	W411-T481 HydrophobicContact CB-CG2 3.78Å; W411-T481 HydrophobicContact CG-CG2 3.78Å; F464-T481 HydrophobicContact CE1-CG2 3.84Å; F464-T481 HydrophobicContact CZ-CG2 3.88Å; C477-T481 WeakPolarHBondContact O-CB 3.34Å; C477-T481 PolarHBondContact O-N 2.7Å; C477-T481 PolarHBondContact O-OG1 3.22Å; F478-T481 PolarHBondContact O-N 3.41Å; T479-T481 PolarHBondContact O-N 3.25Å; T481-S484 WeakPolarHBondContact O-CB 3.39Å; T481-S484 PolarHBondContact O-N 3.42Å; T481-I485 HydrophobicContact CG2-CD1 4.05Å; T481-I485 VanDerWaalsContact O-CG1 3.28Å; T481-I485 WeakPolarHBondContact O-CG1 3.48Å; T481-I485 PolarHBondContact O-N 3.01Å
482	M	93.3	Very high	89.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-69.4	-35.2	179.1	-169.8	63.9	69.8	0	0	112.1	V461 F464 H465 F478 T479 Q480 I485 A486 A547 F550 L551	V461-M482 HydrophobicContact CG1-CE 4.29Å; V461-M482 HydrophobicContact CG1-SD 4.09Å; F464-M482 HydrophobicContact CD1-CE 3.87Å; F464-M482 HydrophobicContact CE1-CE 4.33Å; H465-M482 HydrophobicContact CB-CE 4.39Å; F478-M482 HydrophobicContact CE1-CB 4.47Å; F478-M482 HydrophobicContact CE2-CE 3.54Å; F478-M482 HydrophobicContact CZ-CB 4.45Å; F478-M482 HydrophobicContact CZ-CE 3.52Å; F478-M482 VanDerWaalsContact O-CB 3.32Å; F478-M482 WeakPolarHBondContact O-CB 3.31Å; F478-M482 PolarHBondContact O-N 3.27Å; T479-M482 PolarHBondContact O-N 3.43Å; Q480-M482 PolarHBondContact O-N 3.37Å; M482-I485 PolarHBondContact O-N 3.19Å; M482-I485 HydrophobicContact SD-CD1 4.29Å; M482-A486 WeakPolarHBondContact O-CB 3.41Å; M482-A486 PolarHBondContact O-N 2.92Å; M482-A547 HydrophobicContact CG-CB 4.38Å; M482-A547 HydrophobicContact SD-CB 3.66Å; M482-F550 HydrophobicContact CE-CB 4.14Å; M482-F550 HydrophobicContact CE-CD2 3.92Å; M482-F550 HydrophobicContact CE-CG 4.46Å; M482-F550 HydrophobicContact CG-CB 4.35Å; M482-F550 HydrophobicContact SD-CB 4.24Å; M482-F550 HydrophobicContact SD-CD2 4.15Å; M482-L551 HydrophobicContact CB-CD2 3.7Å; M482-L551 HydrophobicContact CB-CG 4.19Å; M482-L551 HydrophobicContact CG-CD1 4.4Å; M482-L551 HydrophobicContact CG-CD2 3.77Å; M482-L551 HydrophobicContact CG-CG 3.7Å
483	V	94	Very high	89.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60.7	-45.6	169.1	168.1	0	0	0	0	111	Y425 T479 Q480 A486 N487 L551 H594 L595	Y425-V483 HydrophobicContact CD2-CB 4.04Å; Y425-V483 HydrophobicContact CD2-CG1 3.7Å; Y425-V483 HydrophobicContact CG-CG1 4.41Å; T479-V483 VanDerWaalsContact O-CG2 3.28Å; T479-V483 WeakPolarHBondContact O-CG2 3.23Å; T479-V483 PolarHBondContact O-N 2.9Å; Q480-V483 PolarHBondContact O-N 3.37Å; V483-A486 PolarHBondContact O-N 3.34Å; V483-N487 PolarHBondContact O-N 3.07Å; V483-L551 HydrophobicContact CG2-CD1 3.77Å; V483-L551 HydrophobicContact CG2-CD2 3.99Å; V483-H594 HydrophobicContact CG1-CB 4.1Å; V483-L595 HydrophobicContact CB-CD2 4.23Å; V483-L595 HydrophobicContact CB-CG 4.42Å; V483-L595 HydrophobicContact CG1-CB 4.48Å; V483-L595 HydrophobicContact CG1-CD2 3.78Å; V483-L595 HydrophobicContact CG1-CG 3.78Å; V483-L595 HydrophobicContact CG2-CD2 4.22Å; V483-L595 HydrophobicContact CG2-CG 4.07Å
484	S	92.9	Very high	90.1	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.035	13%	0.128	C	C	.	.	H	α-helix	trans	-57.4	-49.3	173.4	159.2	0	0	0	0	111.7	Q480 T481 A486 N487 V488	Q480-S484 PolarHBondContact O-N 2.99Å; T481-S484 WeakPolarHBondContact O-CB 3.39Å; T481-S484 PolarHBondContact O-N 3.42Å; S484-A486 VanDerWaalsContact C-N 3.31Å; S484-A486 PolarHBondContact O-N 3.41Å; S484-N487 PolarHBondContact O-N 2.96Å; S484-N487 VanDerWaalsContact O-N 3.16Å; S484-V488 WeakPolarHBondContact O-CB 3.41Å; S484-V488 WeakPolarHBondContact O-CG2 3.06Å; S484-V488 PolarHBondContact O-N 3.02Å
485	I	91.9	Very high	90.5	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-57.8	-45.2	178.9	-67.9	164.4	0	0	0	110.7	W411 V461 F464 T481 M482 N487 V488 C489 A547	W411-I485 HydrophobicContact CD2-CD1 3.78Å; W411-I485 HydrophobicContact CD2-CG1 4.35Å; W411-I485 HydrophobicContact CE3-CD1 4.11Å; W411-I485 HydrophobicContact CG-CD1 4.32Å; W411-I485 HydrophobicContact CH2-CD1 3.96Å; W411-I485 HydrophobicContact CH2-CG1 4.34Å; W411-I485 HydrophobicContact CZ2-CD1 3.67Å; W411-I485 HydrophobicContact CZ2-CG1 3.63Å; W411-I485 HydrophobicContact CZ3-CD1 4.2Å; V461-I485 HydrophobicContact CG1-CG2 4.29Å; V461-I485 HydrophobicContact CG2-CG2 4.25Å; F464-I485 HydrophobicContact CD1-CD1 4.29Å; F464-I485 HydrophobicContact CE1-CD1 4.48Å; T481-I485 HydrophobicContact CG2-CD1 4.05Å; T481-I485 VanDerWaalsContact O-CG1 3.28Å; T481-I485 WeakPolarHBondContact O-CG1 3.48Å; T481-I485 PolarHBondContact O-N 3.01Å; M482-I485 PolarHBondContact O-N 3.19Å; M482-I485 HydrophobicContact SD-CD1 4.29Å; I485-N487 PolarHBondContact O-N 2.98Å; I485-V488 PolarHBondContact O-N 3.48Å; I485-C489 WeakPolarHBondContact O-CB 3.41Å; I485-C489 PolarHBondContact O-N 3.41Å; I485-C489 PolarHBondContact O-SG 3.37Å; I485-A547 HydrophobicContact CG2-CB 4.03Å
486	A	93.7	Very high	90.7	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-60.7	-44.9	178.6	0	0	0	0	0	111.7	M482 V483 S484 L490 S544 A547 L595 L599	M482-A486 WeakPolarHBondContact O-CB 3.41Å; M482-A486 PolarHBondContact O-N 2.92Å; V483-A486 PolarHBondContact O-N 3.34Å; S484-A486 VanDerWaalsContact C-N 3.31Å; S484-A486 PolarHBondContact O-N 3.41Å; A486-L490 PolarHBondContact O-N 3.46Å; A486-L490 VanDerWaalsContact O-N 3.12Å; A486-S544 PolarHBondContact O-OG 2.8Å; A486-A547 HydrophobicContact CB-CB 3.82Å; A486-L595 HydrophobicContact CB-CD2 3.96Å; A486-L599 HydrophobicContact CB-CD1 4.01Å; A486-L599 WeakPolarHBondContact O-CD1 3.46Å
487	N	94.1	Very high	91	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-65.9	-46.1	176.9	-73.4	-16.5	0	0	0	112.5	Y425 V483 S484 I485 C489 L490 M491 H594 L595 K596	Y425-N487 WeakPolarHBondContact O-CB 3.4Å; Y425-N487 PolarHBondContact O-ND2 3.4Å; V483-N487 PolarHBondContact O-N 3.07Å; S484-N487 PolarHBondContact O-N 2.96Å; S484-N487 VanDerWaalsContact O-N 3.16Å; I485-N487 PolarHBondContact O-N 2.98Å; N487-C489 VanDerWaalsContact C-N 3.32Å; N487-C489 PolarHBondContact O-N 2.91Å; N487-L490 PolarHBondContact O-N 2.93Å; N487-M491 WeakPolarHBondContact O-CG 3.25Å; N487-M491 PolarHBondContact O-N 3.38Å; N487-H594 PolarHBondContact ND2-O 3.42Å; N487-L595 WeakPolarHBondContact OD1-CA 3.06Å; N487-K596 HydrophobicContact CB-CG 4.41Å; N487-K596 PolarHBondContact OD1-N 2.78Å
488	V	91.8	Very high	90.8	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-59.9	-42.2	178.9	164.6	0	0	0	0	111.3	S427 L429 P430 S484 I485 M491 S492	S427-V488 WeakPolarHBondContact OG-CG2 3.5Å; L429-V488 HydrophobicContact CB-CG1 4.21Å; L429-V488 HydrophobicContact CD2-CG1 3.88Å; L429-V488 HydrophobicContact CG-CG1 4.47Å; P430-V488 HydrophobicContact CG-CB 4.35Å; P430-V488 HydrophobicContact CG-CG1 3.89Å; P430-V488 HydrophobicContact CG-CG2 4.46Å; S484-V488 WeakPolarHBondContact O-CB 3.41Å; S484-V488 WeakPolarHBondContact O-CG2 3.06Å; S484-V488 PolarHBondContact O-N 3.02Å; I485-V488 PolarHBondContact O-N 3.48Å; V488-M491 HydrophobicContact CG2-CE 4.24Å; V488-S492 WeakPolarHBondContact O-CB 3.49Å; V488-S492 PolarHBondContact O-N 3.33Å; V488-S492 PolarHBondContact O-OG 3.39Å
489	C	91.4	Very high	90.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-66.2	-42.4	175.7	-68.8	0	0	0	0	111.6	I485 N487 S492 S493 W540 N543	I485-C489 WeakPolarHBondContact O-CB 3.41Å; I485-C489 PolarHBondContact O-N 3.41Å; I485-C489 PolarHBondContact O-SG 3.37Å; N487-C489 VanDerWaalsContact C-N 3.32Å; N487-C489 PolarHBondContact O-N 2.91Å; C489-S492 PolarHBondContact O-N 3.36Å; C489-S493 PolarHBondContact O-N 3Å; C489-W540 HydrophobicContact CB-CE3 4.1Å; C489-W540 WeakPolarHBondContact CB-O 3.47Å; C489-W540 WeakPolarHBondContact O-CB 3.31Å; C489-N543 HydrophobicContact CB-CB 4.27Å
490	L	92.4	Very high	89.8	Confident	28 Å²	28	24.1 Å²	24.1	15%	0.147	11%	0.112	C	C	.	.	H	α-helix	trans	-62.9	-48.1	175.6	177.6	64.6	0	0	0	111.8	A486 N487 S492 S493 E494 K596 T598 L599	A486-L490 PolarHBondContact O-N 3.46Å; A486-L490 VanDerWaalsContact O-N 3.12Å; N487-L490 PolarHBondContact O-N 2.93Å; L490-S492 VanDerWaalsContact C-N 3.3Å; L490-S492 PolarHBondContact O-N 2.86Å; L490-S493 WeakPolarHBondContact O-CA 3.34Å; L490-S493 VanDerWaalsContact O-CB 3.25Å; L490-S493 WeakPolarHBondContact O-CB 3.47Å; L490-S493 PolarHBondContact O-N 3.01Å; L490-S493 VanDerWaalsContact O-N 3.09Å; L490-E494 PolarHBondContact O-N 3.3Å; L490-K596 HydrophobicContact CD2-CB 3.9Å; L490-K596 HydrophobicContact CD2-CG 4.22Å; L490-T598 VanDerWaalsContact CD2-OG1 3.28Å; L490-T598 WeakPolarHBondContact CD2-OG1 3.47Å; L490-L599 HydrophobicContact CB-CD1 4.13Å; L490-L599 HydrophobicContact CD2-CD1 3.95Å; L490-L599 HydrophobicContact CD2-CG 3.92Å
491	M	91.2	Very high	89.2	Confident	33 Å²	33	25.6 Å²	25.6	16%	0.163	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-39.2	178.4	-69.9	-171.6	-67.2	0	0	112	P430 N487 V488 S493 E494 L495	P430-M491 HydrophobicContact CB-CB 4.22Å; P430-M491 HydrophobicContact CG-CB 4.11Å; P430-M491 HydrophobicContact CG-CE 4.11Å; N487-M491 WeakPolarHBondContact O-CG 3.25Å; N487-M491 PolarHBondContact O-N 3.38Å; V488-M491 HydrophobicContact CG2-CE 4.24Å; M491-S493 VanDerWaalsContact C-N 3.3Å; M491-S493 PolarHBondContact O-N 3.5Å; M491-E494 PolarHBondContact O-N 3.37Å; M491-L495 WeakPolarHBondContact O-CG 3.33Å; M491-L495 PolarHBondContact O-N 2.97Å
492	S	89.1	Confident	88.4	Confident	7 Å²	7	28.3 Å²	28.3	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-63.4	-36.1	175.1	-60.7	0	0	0	0	112.2	V488 C489 L490 L495 A496 W540	V488-S492 WeakPolarHBondContact O-CB 3.49Å; V488-S492 PolarHBondContact O-N 3.33Å; V488-S492 PolarHBondContact O-OG 3.39Å; C489-S492 PolarHBondContact O-N 3.36Å; L490-S492 VanDerWaalsContact C-N 3.3Å; L490-S492 PolarHBondContact O-N 2.86Å; S492-L495 PolarHBondContact O-N 3.34Å; S492-A496 WeakPolarHBondContact O-CB 3.44Å; S492-A496 PolarHBondContact O-N 3.33Å; S492-W540 VanDerWaalsContact CB-CD2 3.44Å
493	S	89.6	Confident	87.2	Confident	7 Å²	7	28.3 Å²	28.3	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-63.9	-43.5	172.8	-171.9	0	0	0	0	112	C489 L490 M491 A496 E497 K537 T541	C489-S493 PolarHBondContact O-N 3Å; L490-S493 WeakPolarHBondContact O-CA 3.34Å; L490-S493 VanDerWaalsContact O-CB 3.25Å; L490-S493 WeakPolarHBondContact O-CB 3.47Å; L490-S493 PolarHBondContact O-N 3.01Å; L490-S493 VanDerWaalsContact O-N 3.09Å; M491-S493 VanDerWaalsContact C-N 3.3Å; M491-S493 PolarHBondContact O-N 3.5Å; S493-A496 WeakPolarHBondContact O-CB 3.46Å; S493-A496 PolarHBondContact O-N 3.46Å; S493-E497 PolarHBondContact O-N 3.02Å; S493-K537 WeakPolarHBondContact OG-CG 3.44Å; S493-K537 PolarHBondContact OG-O 2.83Å; S493-T541 PolarHBondContact OG-OG1 2.84Å
494	E	89.8	Confident	86.2	Confident	106 Å²	106	33 Å²	33	50%	0.495	16%	0.155	S	C	.	.	H	α-helix	trans	-65.6	-40.1	176.6	-67.9	174.4	176.2	0	0	112.3	L490 M491 E497 R498	L490-E494 PolarHBondContact O-N 3.3Å; M491-E494 PolarHBondContact O-N 3.37Å; E494-E497 PolarHBondContact O-N 2.96Å; E494-R498 PolarHBondContact O-N 3.38Å; E494-R498 VanDerWaalsContact O-N 3.1Å
495	L	87	Confident	85.1	Confident	36 Å²	36	37.6 Å²	37.6	19%	0.188	18%	0.178	C	C	.	.	H	α-helix	trans	-66.1	-37.5	175.6	-72	172.2	0	0	0	112.2	P430 Y434 M491 S492 E497 R498 L499	P430-L495 HydrophobicContact CB-CD1 3.5Å; P430-L495 VanDerWaalsContact CB-CD1 3.5Å; P430-L495 VanDerWaalsContact O-CD1 3.27Å; P430-L495 WeakPolarHBondContact O-CD1 3.49Å; Y434-L495 HydrophobicContact CD2-CB 4.13Å; Y434-L495 HydrophobicContact CD2-CD2 3.94Å; Y434-L495 HydrophobicContact CD2-CG 4.5Å; Y434-L495 HydrophobicContact CE2-CD2 4.43Å; Y434-L495 HydrophobicContact CG-CD2 4.18Å; M491-L495 WeakPolarHBondContact O-CG 3.33Å; M491-L495 PolarHBondContact O-N 2.97Å; S492-L495 PolarHBondContact O-N 3.34Å; L495-E497 VanDerWaalsContact C-N 3.3Å; L495-E497 PolarHBondContact O-N 3.22Å; L495-R498 PolarHBondContact O-N 3.25Å; L495-L499 WeakPolarHBondContact O-CB 3.44Å; L495-L499 PolarHBondContact O-N 3.4Å
496	A	85.4	Confident	83.7	Confident	6 Å²	6	41 Å²	41	5%	0.05	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-40.3	172.9	0	0	0	0	0	111.6	S492 S493 L499 K500 I533 K537	S492-A496 WeakPolarHBondContact O-CB 3.44Å; S492-A496 PolarHBondContact O-N 3.33Å; S493-A496 WeakPolarHBondContact O-CB 3.46Å; S493-A496 PolarHBondContact O-N 3.46Å; A496-L499 WeakPolarHBondContact O-CB 3.33Å; A496-L499 PolarHBondContact O-N 3.19Å; A496-K500 PolarHBondContact O-N 3.14Å; A496-I533 HydrophobicContact CB-CG2 4.21Å; A496-I533 WeakPolarHBondContact O-CG2 3.43Å; A496-K537 HydrophobicContact CB-CB 4.19Å
497	E	86.8	Confident	81.9	Confident	56 Å²	56	43.7 Å²	43.7	26%	0.262	22%	0.216	S	C	.	.	H	α-helix	trans	-65.8	-39.1	175	-167	66.2	-143.6	0	0	112	S493 E494 L495 K500 V501 K537	S493-E497 PolarHBondContact O-N 3.02Å; E494-E497 PolarHBondContact O-N 2.96Å; L495-E497 VanDerWaalsContact C-N 3.3Å; L495-E497 PolarHBondContact O-N 3.22Å; E497-K500 WeakPolarHBondContact O-CB 3.27Å; E497-K500 PolarHBondContact O-N 3.32Å; E497-V501 WeakPolarHBondContact O-CG2 3.16Å; E497-V501 PolarHBondContact O-N 3.48Å; E497-V501 VanDerWaalsContact O-N 3.13Å; E497-K537 WeakPolarHBondContact OE2-CD 3.48Å; E497-K537 WeakPolarHBondContact OE2-CE 3.47Å; E497-K537 IonicContact OE2-NZ 3.63Å; E497-K537 PolarHBondContact OE2-NZ 2.99Å
498	R	84.8	Confident	79.7	Confident	155 Å²	155	49.6 Å²	49.6	59%	0.585	24%	0.244	S	C	*	.	H	α-helix	trans	-63.7	-42.9	174.7	-69.7	179	65.8	175.5	-0.2	112.1	E494 L495 K500 V501 N502	E494-R498 PolarHBondContact O-N 3.38Å; E494-R498 VanDerWaalsContact O-N 3.1Å; L495-R498 PolarHBondContact O-N 3.25Å; R498-K500 VanDerWaalsContact C-N 3.3Å; R498-K500 PolarHBondContact O-N 3.28Å; R498-V501 PolarHBondContact O-N 3.33Å; R498-V501 VanDerWaalsContact O-N 3.16Å; R498-N502 PolarHBondContact O-N 3.49Å
499	L	79.3	Confident	77.1	Confident	8 Å²	8	61 Å²	61	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-58.9	-43.2	175.6	-175.3	68.7	0	0	0	111.4	I437 M441 L495 A496 V501 N502 I503 I533	I437-L499 HydrophobicContact CD1-CD2 4.45Å; I437-L499 HydrophobicContact CG2-CD1 3.86Å; I437-L499 HydrophobicContact CG2-CD2 3.79Å; I437-L499 HydrophobicContact CG2-CG 4.49Å; M441-L499 HydrophobicContact SD-CD1 3.51Å; M441-L499 VanDerWaalsContact SD-CD1 3.51Å; L495-L499 WeakPolarHBondContact O-CB 3.44Å; L495-L499 PolarHBondContact O-N 3.4Å; A496-L499 WeakPolarHBondContact O-CB 3.33Å; A496-L499 PolarHBondContact O-N 3.19Å; L499-V501 VanDerWaalsContact C-N 3.31Å; L499-V501 PolarHBondContact O-N 3.47Å; L499-N502 PolarHBondContact O-N 3.2Å; L499-I503 HydrophobicContact CD1-CD1 4.4Å; L499-I503 HydrophobicContact CG-CD1 3.95Å; L499-I503 WeakPolarHBondContact O-CG1 3.45Å; L499-I503 PolarHBondContact O-N 3.28Å; L499-I533 HydrophobicContact CD2-CD1 3.95Å; L499-I533 HydrophobicContact CD2-CG1 4.3Å; L499-I533 HydrophobicContact CG-CD1 4.13Å
500	K	81.6	Confident	74.6	Confident	19 Å²	19	67.6 Å²	67.6	8%	0.083	32%	0.318	C	S	.	.	H	α-helix	trans	-57.1	-43.5	174.9	-169.2	-177.4	-179.3	179.9	0	112.1	A496 E497 R498 R504 L530 I533 D534	A496-K500 PolarHBondContact O-N 3.14Å; E497-K500 WeakPolarHBondContact O-CB 3.27Å; E497-K500 PolarHBondContact O-N 3.32Å; R498-K500 VanDerWaalsContact C-N 3.3Å; R498-K500 PolarHBondContact O-N 3.28Å; K500-R504 VanDerWaalsContact CE-NH2 3.26Å; K500-R504 WeakPolarHBondContact O-CB 3.46Å; K500-R504 VanDerWaalsContact O-CG 3.28Å; K500-R504 WeakPolarHBondContact O-CG 3.36Å; K500-R504 PolarHBondContact O-N 2.87Å; K500-R504 VanDerWaalsContact O-N 3.11Å; K500-L530 HydrophobicContact CG-CD2 3.67Å; K500-I533 HydrophobicContact CB-CG2 3.93Å; K500-D534 VanDerWaalsContact CE-OD1 3.3Å; K500-D534 WeakPolarHBondContact CE-OD1 3.37Å; K500-D534 WeakPolarHBondContact CE-OD2 3.36Å; K500-D534 IonicContact NZ-OD1 2.86Å; K500-D534 PolarHBondContact NZ-OD1 3.39Å; K500-D534 IonicContact NZ-OD2 3.67Å; K500-D534 PolarHBondContact NZ-OD2 3.39Å
501	V	80.7	Confident	71.8	Confident	64 Å²	64	72.2 Å²	72.2	39%	0.388	35%	0.349	S	S	.	.	H	α-helix	trans	-65.4	-44.3	176	175	0	0	0	0	111	E497 R498 L499 I503 R504 L505	E497-V501 WeakPolarHBondContact O-CG2 3.16Å; E497-V501 PolarHBondContact O-N 3.48Å; E497-V501 VanDerWaalsContact O-N 3.13Å; R498-V501 PolarHBondContact O-N 3.33Å; R498-V501 VanDerWaalsContact O-N 3.16Å; L499-V501 VanDerWaalsContact C-N 3.31Å; L499-V501 PolarHBondContact O-N 3.47Å; V501-I503 PolarHBondContact O-N 3.24Å; V501-R504 WeakPolarHBondContact O-CB 3.3Å; V501-R504 PolarHBondContact O-N 2.7Å; V501-R504 VanDerWaalsContact O-N 3.14Å; V501-L505 HydrophobicContact CG1-CD1 4Å; V501-L505 WeakPolarHBondContact O-CG 3.32Å; V501-L505 PolarHBondContact O-N 3.24Å; V501-L505 VanDerWaalsContact O-N 3.11Å
502	N	75.5	Confident	69.2	Low	62 Å²	62	76.5 Å²	76.5	33%	0.332	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-47.2	179	-71.4	-14.7	0	0	0	112.4	Y434 R498 L499 R504 L505 S506	Y434-N502 PolarHBondContact OH-ND2 2.98Å; R498-N502 PolarHBondContact O-N 3.49Å; L499-N502 PolarHBondContact O-N 3.2Å; N502-R504 PolarHBondContact O-N 2.86Å; N502-L505 PolarHBondContact O-N 3.03Å; N502-L505 VanDerWaalsContact O-N 3.15Å; N502-S506 WeakPolarHBondContact O-CB 3.19Å; N502-S506 PolarHBondContact O-N 3.1Å; N502-S506 PolarHBondContact O-OG 2.9Å; N502-S506 VanDerWaalsContact O-OG 3.14Å
503	I	69.2	Low	66.8	Low	0 Å²	0	80 Å²	80	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-60.2	-37.9	175.6	-70.9	162.2	0	0	0	110.9	M441 I447 L499 V501 L505 L507 R526 L529 L530 I533	M441-I503 HydrophobicContact CE-CD1 4.08Å; M441-I503 HydrophobicContact CE-CG1 3.31Å; M441-I503 HydrophobicContact SD-CD1 4.26Å; M441-I503 HydrophobicContact SD-CG1 4.06Å; I447-I503 HydrophobicContact CD1-CD1 4.18Å; L499-I503 HydrophobicContact CD1-CD1 4.4Å; L499-I503 HydrophobicContact CG-CD1 3.95Å; L499-I503 WeakPolarHBondContact O-CG1 3.45Å; L499-I503 PolarHBondContact O-N 3.28Å; V501-I503 PolarHBondContact O-N 3.24Å; I503-L505 VanDerWaalsContact C-N 3.29Å; I503-L505 PolarHBondContact O-N 3.15Å; I503-L507 HydrophobicContact CG2-CD1 3.9Å; I503-L507 PolarHBondContact O-N 2.59Å; I503-R526 PolarHBondContact O-NH1 2.95Å; I503-L529 HydrophobicContact CD1-CD2 3.77Å; I503-L529 HydrophobicContact CD1-CG 4.15Å; I503-L529 HydrophobicContact CG1-CD2 4.33Å; I503-L529 HydrophobicContact CG2-CD2 4.02Å; I503-L530 HydrophobicContact CG2-CD2 4.16Å; I503-I533 HydrophobicContact CD1-CD1 3.18Å
504	R	71.8	Confident	64.1	Low	100 Å²	100	85.2 Å²	85.2	38%	0.377	44%	0.443	S	S	.	.	H	α-helix	trans	-62.9	-38.3	178.3	-79.8	172.9	175.2	176	-4.9	112.1	K500 V501 N502 Q508 R526 L530	K500-R504 VanDerWaalsContact CE-NH2 3.26Å; K500-R504 WeakPolarHBondContact O-CB 3.46Å; K500-R504 VanDerWaalsContact O-CG 3.28Å; K500-R504 WeakPolarHBondContact O-CG 3.36Å; K500-R504 PolarHBondContact O-N 2.87Å; K500-R504 VanDerWaalsContact O-N 3.11Å; V501-R504 WeakPolarHBondContact O-CB 3.3Å; V501-R504 PolarHBondContact O-N 2.7Å; V501-R504 VanDerWaalsContact O-N 3.14Å; N502-R504 PolarHBondContact O-N 2.86Å; R504-Q508 WeakPolarHBondContact O-CG 3.08Å; R504-R526 PolarHBondContact O-NH1 3.05Å; R504-R526 PolarHBondContact O-NH2 3.17Å; R504-L530 HydrophobicContact CG-CD1 4.27Å; R504-L530 HydrophobicContact CG-CD2 3.99Å
505	L	69.7	Low	61.7	Low	100 Å²	100	85.3 Å²	85.3	52%	0.524	45%	0.451	S	S	.	.	H	α-helix	trans	-82	-40.4	-178.2	-65.3	171.1	0	0	0	113	V501 N502 I503 L507 Q508	V501-L505 HydrophobicContact CG1-CD1 4Å; V501-L505 WeakPolarHBondContact O-CG 3.32Å; V501-L505 PolarHBondContact O-N 3.24Å; V501-L505 VanDerWaalsContact O-N 3.11Å; N502-L505 PolarHBondContact O-N 3.03Å; N502-L505 VanDerWaalsContact O-N 3.15Å; I503-L505 VanDerWaalsContact C-N 3.29Å; I503-L505 PolarHBondContact O-N 3.15Å; L505-L507 PolarHBondContact O-N 3.48Å; L505-Q508 PolarHBondContact O-N 3.26Å
506	S	63.4	Low	59.4	Low	72 Å²	72	88.1 Å²	88.1	50%	0.503	49%	0.488	S	S	.	.	H	α-helix	trans	-71.6	-28.6	-174.2	62.1	0	0	0	0	114.2	N502	N502-S506 WeakPolarHBondContact O-CB 3.19Å; N502-S506 PolarHBondContact O-N 3.1Å; N502-S506 PolarHBondContact O-OG 2.9Å; N502-S506 VanDerWaalsContact O-OG 3.14Å
507	L	56.1	Low	57.2	Low	58 Å²	58	96 Å²	96	30%	0.304	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	14.3	-179.8	-74.2	166	0	0	0	113.6	I503 L505 W509 R526	I503-L507 HydrophobicContact CG2-CD1 3.9Å; I503-L507 PolarHBondContact O-N 2.59Å; L505-L507 PolarHBondContact O-N 3.48Å; L507-W509 VanDerWaalsContact C-N 3.3Å; L507-W509 PolarHBondContact O-N 2.89Å; L507-R526 HydrophobicContact CD1-CB 4.38Å; L507-R526 HydrophobicContact CD1-CG 4.16Å
508	Q	47.8	Very low	55	Low	124 Å²	124	98.1 Å²	98.1	58%	0.579	55%	0.552	S	S	*	*			trans	-81.2	-1.8	179.3	-89.4	172.8	-1.1	0	0	114.7	R504 L505 E510	R504-Q508 WeakPolarHBondContact O-CG 3.08Å; L505-Q508 PolarHBondContact O-N 3.26Å; Q508-E510 PolarHBondContact O-N 3.02Å
509	W	36.3	Very low	52.9	Low	239 Å²	239	92.4 Å²	92.4	91%	0.905	54%	0.541	S	S	*	.			trans	-96.5	68.3	-176.3	-73.9	38.6	0	0	0	111.6	L507	L507-W509 VanDerWaalsContact C-N 3.3Å; L507-W509 PolarHBondContact O-N 2.89Å
510	E	38.2	Very low	51.4	Low	139 Å²	139	94.1 Å²	94.1	65%	0.65	55%	0.553	S	S	*	*	S	Bend	trans	-144	125.3	152.4	-106.4	179.1	-168.6	0	0	108.9	Q508 V512	Q508-E510 PolarHBondContact O-N 3.02Å; E510-V512 PolarHBondContact O-N 3.19Å
511	P	35.4	Very low	49.8	Very low	125 Å²	125	98.3 Å²	98.3	81%	0.812	58%	0.582	S	S	*	*			trans	-60.5	127.1	172.3	-11.2	24.7	0	0	0	107.8	A513	P511-A513 VanDerWaalsContact C-N 3.27Å; P511-A513 PolarHBondContact O-N 3.07Å
512	V	36.3	Very low	48.3	Very low	124 Å²	124	98.6 Å²	98.6	75%	0.752	58%	0.584	S	S	*	*			trans	-57.7	95.2	171.1	-177.4	0	0	0	0	107.3	E510 S514	E510-V512 PolarHBondContact O-N 3.19Å; V512-S514 PolarHBondContact O-N 3.45Å
513	A	37.5	Very low	47.3	Very low	80 Å²	80	100.5 Å²	100.5	66%	0.661	59%	0.591	S	S	*	*			trans	-62.5	111.2	167.6	0	0	0	0	0	106.1	P511 T515	P511-A513 VanDerWaalsContact C-N 3.27Å; P511-A513 PolarHBondContact O-N 3.07Å; A513-T515 VanDerWaalsContact C-N 3.26Å; A513-T515 PolarHBondContact O-N 2.83Å
514	S	33.1	Very low	46.6	Very low	117 Å²	117	106.1 Å²	106.1	82%	0.818	62%	0.621	S	S	*	*	S	Bend	trans	-61.2	79.4	-178.2	34	0	0	0	0	111.5	V512	V512-S514 PolarHBondContact O-N 3.45Å
515	T	39.3	Very low	46.1	Very low	108 Å²	108	105.1 Å²	105.1	66%	0.663	62%	0.622	S	S	*	*			trans	-141.2	114.7	162.7	42.7	0	0	0	0	108.1	A513 Q517	A513-T515 VanDerWaalsContact C-N 3.26Å; A513-T515 PolarHBondContact O-N 2.83Å; T515-Q517 PolarHBondContact O-N 2.94Å
516	G	39.8	Very low	45.8	Very low	94 Å²	94	102.9 Å²	102.9	97%	0.969	61%	0.607	S	S	*	*			trans	-71.3	50.8	-175.7	0	0	0	0	0	114.3
517	Q	39.1	Very low	46	Very low	172 Å²	172	103.4 Å²	103.4	80%	0.804	61%	0.61	S	S	*	*	S	Bend	trans	-108.8	145.6	171.2	-72.5	-175.2	-15.2	0	0	109.5	T515	T515-Q517 PolarHBondContact O-N 2.94Å
518	A	39.2	Very low	46.6	Very low	101 Å²	101	103.3 Å²	103.3	84%	0.835	61%	0.61	S	S	*	*	S	Bend	trans	-34.5	136.8	-174.2	0	0	0	0	0	113.5
519	G	42	Very low	47.5	Very low	35 Å²	35	98.6 Å²	98.6	36%	0.361	59%	0.588	S	S	.	*			trans	-37.3	136.7	-165.9	0	0	0	0	0	114.6
520	S	46.7	Very low	49.5	Very low	43 Å²	43	88.3 Å²	88.3	30%	0.301	55%	0.551	S	S	.	*			trans	-44.3	140.2	174.8	160.6	0	0	0	0	109.8	V522 Q523 L524	S520-V522 PolarHBondContact O-N 3.39Å; S520-V522 PolarHBondContact OG-N 3.46Å; S520-Q523 WeakPolarHBondContact O-CA 3.39Å; S520-Q523 WeakPolarHBondContact O-CB 3.42Å; S520-Q523 PolarHBondContact O-N 3.4Å; S520-L524 PolarHBondContact O-N 2.98Å; S520-L524 VanDerWaalsContact O-N 3.14Å
521	P	47.9	Very low	51.5	Low	107 Å²	107	87.2 Å²	87.2	70%	0.695	55%	0.546	S	S	*	.	H	α-helix	trans	-47.4	-32.7	175.8	-27.5	33.4	0	0	0	112.9	L524 L525	P521-L524 PolarHBondContact O-N 3.19Å; P521-L525 WeakPolarHBondContact O-CB 3.28Å; P521-L525 PolarHBondContact O-N 3.43Å
522	V	50.4	Low	53.3	Low	71 Å²	71	83.7 Å²	83.7	43%	0.43	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-38.4	176.4	-176.4	0	0	0	0	112.4	S520 R526	S520-V522 PolarHBondContact O-N 3.39Å; S520-V522 PolarHBondContact OG-N 3.46Å; V522-R526 WeakPolarHBondContact O-CB 3.32Å; V522-R526 PolarHBondContact O-N 3.09Å
523	Q	53.4	Low	55.3	Low	102 Å²	102	78.2 Å²	78.2	48%	0.477	48%	0.482	S	S	.	.	H	α-helix	trans	-68.6	-41.2	176.1	-74.4	172.7	-25.3	0	0	111.7	S520 R526 C527	S520-Q523 WeakPolarHBondContact O-CA 3.39Å; S520-Q523 WeakPolarHBondContact O-CB 3.42Å; S520-Q523 PolarHBondContact O-N 3.4Å; Q523-R526 PolarHBondContact O-N 3.38Å; Q523-C527 PolarHBondContact O-N 3.41Å; Q523-C527 PolarHBondContact O-SG 3.35Å
524	L	56	Low	57.5	Low	117 Å²	117	76.9 Å²	76.9	61%	0.613	46%	0.464	S	S	*	.	H	α-helix	trans	-62.4	-45.3	175.3	-75.1	164.6	0	0	0	111.2	S520 P521 R526 C527 D528	S520-L524 PolarHBondContact O-N 2.98Å; S520-L524 VanDerWaalsContact O-N 3.14Å; P521-L524 PolarHBondContact O-N 3.19Å; L524-R526 VanDerWaalsContact C-N 3.33Å; L524-R526 PolarHBondContact O-N 3.12Å; L524-C527 PolarHBondContact O-N 3.07Å; L524-D528 PolarHBondContact O-N 3.43Å
525	L	59.4	Low	59.9	Low	79 Å²	79	75.1 Å²	75.1	41%	0.414	44%	0.443	S	S	.	.	H	α-helix	trans	-61	-41	176.4	-158.3	82	0	0	0	112	E446 P521 D528 L529	E446-L525 HydrophobicContact CB-CD2 4.45Å; E446-L525 HydrophobicContact CG-CD2 3.76Å; P521-L525 WeakPolarHBondContact O-CB 3.28Å; P521-L525 PolarHBondContact O-N 3.43Å; L525-D528 PolarHBondContact O-N 3.16Å; L525-L529 WeakPolarHBondContact O-CB 3.21Å; L525-L529 PolarHBondContact O-N 3.42Å
526	R	64.2	Low	61.8	Low	53 Å²	53	70.9 Å²	70.9	20%	0.2	42%	0.416	C	S	.	.	H	α-helix	trans	-64	-42.3	176.1	177.3	178.2	163.2	133.2	-3	112.3	I503 R504 L507 V522 Q523 L524 L529 L530	I503-R526 PolarHBondContact O-NH1 2.95Å; R504-R526 PolarHBondContact O-NH1 3.05Å; R504-R526 PolarHBondContact O-NH2 3.17Å; L507-R526 HydrophobicContact CD1-CB 4.38Å; L507-R526 HydrophobicContact CD1-CG 4.16Å; V522-R526 WeakPolarHBondContact O-CB 3.32Å; V522-R526 PolarHBondContact O-N 3.09Å; Q523-R526 PolarHBondContact O-N 3.38Å; L524-R526 VanDerWaalsContact C-N 3.33Å; L524-R526 PolarHBondContact O-N 3.12Å; R526-L529 PolarHBondContact O-N 2.94Å; R526-L530 HydrophobicContact CG-CD1 4.13Å; R526-L530 VanDerWaalsContact O-CG 3.28Å; R526-L530 WeakPolarHBondContact O-CG 3.2Å; R526-L530 PolarHBondContact O-N 2.86Å
527	C	68.8	Low	64	Low	84 Å²	84	69.7 Å²	69.7	57%	0.568	38%	0.384	S	S	*	.	H	α-helix	trans	-63.6	-44.5	177.4	-77.9	0	0	0	0	111.7	Q523 L524 L529 L530 Q531	Q523-C527 PolarHBondContact O-N 3.41Å; Q523-C527 PolarHBondContact O-SG 3.35Å; L524-C527 PolarHBondContact O-N 3.07Å; C527-L529 VanDerWaalsContact C-N 3.35Å; C527-L530 PolarHBondContact O-N 2.97Å; C527-Q531 PolarHBondContact O-N 3.33Å
528	D	66.8	Low	66.3	Low	56 Å²	56	67.9 Å²	67.9	30%	0.299	38%	0.376	S	S	.	.	H	α-helix	trans	-60.2	-45.4	175.5	-171.8	17.4	0	0	0	110.9	L524 L525 L530 Q531 R532	L524-D528 PolarHBondContact O-N 3.43Å; L525-D528 PolarHBondContact O-N 3.16Å; D528-L530 PolarHBondContact O-N 2.97Å; D528-Q531 PolarHBondContact O-N 3.44Å; D528-R532 VanDerWaalsContact CG-NE 3.32Å; D528-R532 VanDerWaalsContact O-CG 3.29Å; D528-R532 WeakPolarHBondContact O-CG 3.39Å; D528-R532 PolarHBondContact O-N 2.79Å; D528-R532 IonicContact OD1-CZ 2.97Å; D528-R532 IonicContact OD1-NE 2.71Å; D528-R532 PolarHBondContact OD1-NE 3.3Å; D528-R532 IonicContact OD1-NH2 3.07Å; D528-R532 IonicContact OD2-CZ 2.83Å; D528-R532 IonicContact OD2-NE 3.88Å; D528-R532 PolarHBondContact OD2-NE 3.23Å; D528-R532 IonicContact OD2-NH2 3.06Å; D528-R532 PolarHBondContact OD2-NH2 3.45Å
529	L	68.2	Low	68.5	Low	24 Å²	24	68.7 Å²	68.7	13%	0.126	36%	0.357	C	S	.	.	H	α-helix	trans	-60.9	-43.6	178	-174.9	60.8	0	0	0	113.1	I447 I503 L525 R526 C527 R532 I533	I447-L529 HydrophobicContact CB-CD1 3.74Å; I447-L529 HydrophobicContact CB-CD2 4.47Å; I447-L529 HydrophobicContact CD1-CD1 4.05Å; I447-L529 HydrophobicContact CD1-CD2 4.28Å; I447-L529 HydrophobicContact CG1-CD1 4.31Å; I447-L529 HydrophobicContact CG1-CD2 4.41Å; I447-L529 HydrophobicContact CG2-CD1 4.23Å; I503-L529 HydrophobicContact CD1-CD2 3.77Å; I503-L529 HydrophobicContact CD1-CG 4.15Å; I503-L529 HydrophobicContact CG1-CD2 4.33Å; I503-L529 HydrophobicContact CG2-CD2 4.02Å; L525-L529 WeakPolarHBondContact O-CB 3.21Å; L525-L529 PolarHBondContact O-N 3.42Å; R526-L529 PolarHBondContact O-N 2.94Å; C527-L529 VanDerWaalsContact C-N 3.35Å; L529-R532 PolarHBondContact O-N 3.47Å; L529-I533 HydrophobicContact CG-CD1 4.37Å; L529-I533 WeakPolarHBondContact O-CG1 3.1Å; L529-I533 PolarHBondContact O-N 3.21Å; L529-I533 VanDerWaalsContact O-N 3.15Å
530	L	77.4	Confident	70.6	Confident	23 Å²	23	67.2 Å²	67.2	12%	0.12	34%	0.341	C	S	.	.	H	α-helix	trans	-65.2	-40.1	178	-70.6	171.7	0	0	0	111.9	K500 I503 R504 R526 C527 D528 R532 I533 D534	K500-L530 HydrophobicContact CG-CD2 3.67Å; I503-L530 HydrophobicContact CG2-CD2 4.16Å; R504-L530 HydrophobicContact CG-CD1 4.27Å; R504-L530 HydrophobicContact CG-CD2 3.99Å; R526-L530 HydrophobicContact CG-CD1 4.13Å; R526-L530 VanDerWaalsContact O-CG 3.28Å; R526-L530 WeakPolarHBondContact O-CG 3.2Å; R526-L530 PolarHBondContact O-N 2.86Å; C527-L530 PolarHBondContact O-N 2.97Å; D528-L530 PolarHBondContact O-N 2.97Å; L530-R532 VanDerWaalsContact C-N 3.31Å; L530-R532 PolarHBondContact O-N 2.89Å; L530-I533 PolarHBondContact O-N 3.46Å; L530-D534 PolarHBondContact O-N 3.14Å; L530-D534 VanDerWaalsContact O-N 3.11Å
531	Q	79.9	Confident	72.7	Confident	116 Å²	116	67.9 Å²	67.9	54%	0.542	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-39.2	176.6	-175.3	177.1	10.1	0	0	111.6	C527 D528 D534 Q535	C527-Q531 PolarHBondContact O-N 3.33Å; D528-Q531 PolarHBondContact O-N 3.44Å; Q531-D534 PolarHBondContact O-N 3.08Å; Q531-Q535 WeakPolarHBondContact O-CG 3.26Å; Q531-Q535 PolarHBondContact O-N 3.15Å
532	R	73.6	Confident	74.7	Confident	52 Å²	52	67.1 Å²	67.1	20%	0.196	33%	0.333	C	S	.	.	H	α-helix	trans	-65.6	-38.7	177.2	-70.1	167.5	-173.2	-121.2	10.5	112.6	N449 D528 L529 L530 D534 Q535 L536	N449-R532 VanDerWaalsContact CA-NH1 3.29Å; N449-R532 VanDerWaalsContact CG-NH2 3.33Å; N449-R532 PolarHBondContact O-NH1 2.88Å; N449-R532 PolarHBondContact OD1-NH1 3.36Å; N449-R532 PolarHBondContact OD1-NH2 2.65Å; D528-R532 VanDerWaalsContact CG-NE 3.32Å; D528-R532 VanDerWaalsContact O-CG 3.29Å; D528-R532 WeakPolarHBondContact O-CG 3.39Å; D528-R532 PolarHBondContact O-N 2.79Å; D528-R532 IonicContact OD1-CZ 2.97Å; D528-R532 IonicContact OD1-NE 2.71Å; D528-R532 PolarHBondContact OD1-NE 3.3Å; D528-R532 IonicContact OD1-NH2 3.07Å; D528-R532 IonicContact OD2-CZ 2.83Å; D528-R532 IonicContact OD2-NE 3.88Å; D528-R532 PolarHBondContact OD2-NE 3.23Å; D528-R532 IonicContact OD2-NH2 3.06Å; D528-R532 PolarHBondContact OD2-NH2 3.45Å; L529-R532 PolarHBondContact O-N 3.47Å; L530-R532 VanDerWaalsContact C-N 3.31Å; L530-R532 PolarHBondContact O-N 2.89Å; R532-D534 VanDerWaalsContact C-N 3.3Å; R532-D534 PolarHBondContact O-N 2.96Å; R532-Q535 PolarHBondContact O-N 3.33Å; R532-L536 PolarHBondContact O-N 2.91Å
533	I	78.6	Confident	76.5	Confident	8 Å²	8	64 Å²	64	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-66	-36.6	175.7	-67.4	168	0	0	0	111	A496 L499 K500 I503 L529 L530 L536 K537	A496-I533 HydrophobicContact CB-CG2 4.21Å; A496-I533 WeakPolarHBondContact O-CG2 3.43Å; L499-I533 HydrophobicContact CD2-CD1 3.95Å; L499-I533 HydrophobicContact CD2-CG1 4.3Å; L499-I533 HydrophobicContact CG-CD1 4.13Å; K500-I533 HydrophobicContact CB-CG2 3.93Å; I503-I533 HydrophobicContact CD1-CD1 3.18Å; L529-I533 HydrophobicContact CG-CD1 4.37Å; L529-I533 WeakPolarHBondContact O-CG1 3.1Å; L529-I533 PolarHBondContact O-N 3.21Å; L529-I533 VanDerWaalsContact O-N 3.15Å; L530-I533 PolarHBondContact O-N 3.46Å; I533-L536 WeakPolarHBondContact O-CB 3.43Å; I533-L536 PolarHBondContact O-N 3.23Å; I533-K537 WeakPolarHBondContact O-CB 3.44Å; I533-K537 PolarHBondContact O-N 3.48Å
534	D	83.7	Confident	78.3	Confident	52 Å²	52	59.2 Å²	59.2	28%	0.278	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-44.4	174.1	-78.4	-28.5	0	0	0	111.8	K500 L530 Q531 R532 L536 K537 E538	K500-D534 VanDerWaalsContact CE-OD1 3.3Å; K500-D534 WeakPolarHBondContact CE-OD1 3.37Å; K500-D534 WeakPolarHBondContact CE-OD2 3.36Å; K500-D534 IonicContact NZ-OD1 2.86Å; K500-D534 PolarHBondContact NZ-OD1 3.39Å; K500-D534 IonicContact NZ-OD2 3.67Å; K500-D534 PolarHBondContact NZ-OD2 3.39Å; L530-D534 PolarHBondContact O-N 3.14Å; L530-D534 VanDerWaalsContact O-N 3.11Å; Q531-D534 PolarHBondContact O-N 3.08Å; R532-D534 VanDerWaalsContact C-N 3.3Å; R532-D534 PolarHBondContact O-N 2.96Å; D534-L536 VanDerWaalsContact C-N 3.26Å; D534-L536 PolarHBondContact O-N 3.11Å; D534-K537 WeakPolarHBondContact O-CB 3.37Å; D534-K537 PolarHBondContact O-N 3.1Å; D534-E538 WeakPolarHBondContact O-CG 3.28Å; D534-E538 PolarHBondContact O-N 3.32Å
535	Q	82.9	Confident	80	Confident	81 Å²	81	56.7 Å²	56.7	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-60.3	-37.1	172.8	-68.6	173.3	1	0	0	112.3	Q531 R532 E538 R539	Q531-Q535 WeakPolarHBondContact O-CG 3.26Å; Q531-Q535 PolarHBondContact O-N 3.15Å; R532-Q535 PolarHBondContact O-N 3.33Å; Q535-E538 PolarHBondContact O-N 2.6Å; Q535-R539 WeakPolarHBondContact O-CG 3.34Å; Q535-R539 PolarHBondContact O-N 3.02Å; Q535-R539 VanDerWaalsContact O-N 3.11Å
536	L	79.3	Confident	81.5	Confident	18 Å²	18	54.1 Å²	54.1	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-49.4	176.6	-149.8	69.7	0	0	0	111.8	V452 M455 R532 I533 D534 E538 R539 W540	V452-L536 HydrophobicContact CG1-CD1 3.85Å; M455-L536 HydrophobicContact CE-CD1 3.25Å; M455-L536 HydrophobicContact CE-CD2 3.76Å; M455-L536 HydrophobicContact CE-CG 3.55Å; M455-L536 HydrophobicContact CG-CD1 3.9Å; M455-L536 HydrophobicContact SD-CD1 3.18Å; M455-L536 WeakPolarHBondContact SD-CD1 3.42Å; M455-L536 HydrophobicContact SD-CD2 4.43Å; M455-L536 HydrophobicContact SD-CG 3.57Å; M455-L536 VanDerWaalsContact SD-CG 3.57Å; R532-L536 PolarHBondContact O-N 2.91Å; I533-L536 WeakPolarHBondContact O-CB 3.43Å; I533-L536 PolarHBondContact O-N 3.23Å; D534-L536 VanDerWaalsContact C-N 3.26Å; D534-L536 PolarHBondContact O-N 3.11Å; L536-E538 VanDerWaalsContact C-N 3.33Å; L536-E538 PolarHBondContact O-N 3.31Å; L536-R539 PolarHBondContact O-N 3.4Å; L536-W540 PolarHBondContact O-N 3.41Å
537	K	86.3	Confident	82.9	Confident	69 Å²	69	51.6 Å²	51.6	30%	0.3	25%	0.254	S	S	.	.	H	α-helix	trans	-60.2	-44.7	179.5	-177	-169.6	175.3	-178.4	0	111.1	S493 A496 E497 I533 D534 R539 W540 T541	S493-K537 WeakPolarHBondContact OG-CG 3.44Å; S493-K537 PolarHBondContact OG-O 2.83Å; A496-K537 HydrophobicContact CB-CB 4.19Å; E497-K537 WeakPolarHBondContact OE2-CD 3.48Å; E497-K537 WeakPolarHBondContact OE2-CE 3.47Å; E497-K537 IonicContact OE2-NZ 3.63Å; E497-K537 PolarHBondContact OE2-NZ 2.99Å; I533-K537 WeakPolarHBondContact O-CB 3.44Å; I533-K537 PolarHBondContact O-N 3.48Å; D534-K537 WeakPolarHBondContact O-CB 3.37Å; D534-K537 PolarHBondContact O-N 3.1Å; K537-R539 VanDerWaalsContact C-N 3.34Å; K537-R539 PolarHBondContact O-N 3.16Å; K537-W540 PolarHBondContact O-N 3.42Å; K537-T541 WeakPolarHBondContact O-CB 3.34Å; K537-T541 PolarHBondContact O-N 3.45Å; K537-T541 PolarHBondContact O-OG1 3.25Å
538	E	87.5	Confident	84.1	Confident	135 Å²	135	47.6 Å²	47.6	63%	0.631	23%	0.227	S	C	*	.	H	α-helix	trans	-59.6	-44.1	176.8	-74.3	177.7	179.6	0	0	111.7	D534 Q535 L536 T541 L542	D534-E538 WeakPolarHBondContact O-CG 3.28Å; D534-E538 PolarHBondContact O-N 3.32Å; Q535-E538 PolarHBondContact O-N 2.6Å; L536-E538 VanDerWaalsContact C-N 3.33Å; L536-E538 PolarHBondContact O-N 3.31Å; E538-T541 PolarHBondContact O-N 3.08Å; E538-L542 WeakPolarHBondContact O-CB 3.49Å; E538-L542 PolarHBondContact O-N 2.82Å
539	R	84.8	Confident	85.4	Confident	117 Å²	117	51 Å²	51	44%	0.442	24%	0.239	S	C	.	.	H	α-helix	trans	-62.9	-47.3	177.3	-72.4	176.2	-179.3	-161.8	-1.6	112.6	Q535 L536 K537 T541 L542 N543	Q535-R539 WeakPolarHBondContact O-CG 3.34Å; Q535-R539 PolarHBondContact O-N 3.02Å; Q535-R539 VanDerWaalsContact O-N 3.11Å; L536-R539 PolarHBondContact O-N 3.4Å; K537-R539 VanDerWaalsContact C-N 3.34Å; K537-R539 PolarHBondContact O-N 3.16Å; R539-T541 VanDerWaalsContact C-N 3.31Å; R539-T541 PolarHBondContact O-N 2.84Å; R539-L542 PolarHBondContact O-N 3.02Å; R539-N543 PolarHBondContact O-N 2.93Å
540	W	87.9	Confident	86.6	Confident	5 Å²	5	51.4 Å²	51.4	2%	0.019	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-42.2	176.1	-77.8	125.7	0	0	0	112.4	L429 L433 M455 L456 C489 S492 L536 K537 L542 N543 S544	L429-W540 HydrophobicContact CD2-CH2 4.45Å; L433-W540 HydrophobicContact CD1-CH2 4.37Å; L433-W540 HydrophobicContact CD1-CZ2 3.98Å; M455-W540 HydrophobicContact CE-CZ2 3.6Å; M455-W540 HydrophobicContact SD-CD2 4.21Å; M455-W540 HydrophobicContact SD-CZ2 3.59Å; M455-W540 VanDerWaalsContact SD-CZ2 3.59Å; M455-W540 PolarHBondContact SD-NE1 3.18Å; L456-W540 HydrophobicContact CB-CH2 3.97Å; L456-W540 HydrophobicContact CB-CZ3 3.8Å; L456-W540 HydrophobicContact CD1-CH2 3.91Å; L456-W540 HydrophobicContact CD1-CZ3 3.69Å; L456-W540 HydrophobicContact CG-CH2 4.36Å; L456-W540 HydrophobicContact CG-CZ3 4.32Å; C489-W540 HydrophobicContact CB-CE3 4.1Å; C489-W540 WeakPolarHBondContact CB-O 3.47Å; C489-W540 WeakPolarHBondContact O-CB 3.31Å; S492-W540 VanDerWaalsContact CB-CD2 3.44Å; L536-W540 PolarHBondContact O-N 3.41Å; K537-W540 PolarHBondContact O-N 3.42Å; W540-L542 VanDerWaalsContact C-N 3.35Å; W540-L542 PolarHBondContact O-N 3.16Å; W540-N543 PolarHBondContact O-N 3.29Å; W540-S544 PolarHBondContact O-N 2.92Å
541	T	89.9	Confident	87.4	Confident	56 Å²	56	50.3 Å²	50.3	34%	0.344	23%	0.234	S	C	.	.	H	α-helix	trans	-63.3	-42.8	177.1	-52.9	0	0	0	0	111	S493 K537 E538 R539 S544 Q545	S493-T541 PolarHBondContact OG-OG1 2.84Å; K537-T541 WeakPolarHBondContact O-CB 3.34Å; K537-T541 PolarHBondContact O-N 3.45Å; K537-T541 PolarHBondContact O-OG1 3.25Å; E538-T541 PolarHBondContact O-N 3.08Å; R539-T541 VanDerWaalsContact C-N 3.31Å; R539-T541 PolarHBondContact O-N 2.84Å; T541-S544 PolarHBondContact O-N 3.46Å; T541-Q545 WeakPolarHBondContact O-CG 3.32Å; T541-Q545 PolarHBondContact O-N 3.49Å; T541-Q545 VanDerWaalsContact O-N 3.07Å
542	L	89.9	Confident	88.1	Confident	91 Å²	91	45.3 Å²	45.3	48%	0.476	21%	0.211	S	C	.	.	H	α-helix	trans	-62	-45.2	175.7	179.9	62.3	0	0	0	111.8	I458 E538 R539 W540 S544 Q545 I546	I458-L542 HydrophobicContact CD1-CD2 3.91Å; E538-L542 WeakPolarHBondContact O-CB 3.49Å; E538-L542 PolarHBondContact O-N 2.82Å; R539-L542 PolarHBondContact O-N 3.02Å; W540-L542 VanDerWaalsContact C-N 3.35Å; W540-L542 PolarHBondContact O-N 3.16Å; L542-S544 VanDerWaalsContact C-N 3.34Å; L542-S544 PolarHBondContact O-N 2.94Å; L542-Q545 WeakPolarHBondContact O-CB 3.35Å; L542-Q545 PolarHBondContact O-N 3.49Å; L542-I546 HydrophobicContact CD1-CD1 4.24Å; L542-I546 HydrophobicContact CD1-CG1 4.44Å; L542-I546 HydrophobicContact CG-CD1 3.95Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.48Å
543	N	87.7	Confident	89	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.027	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-40.8	177.9	-74.9	-2.9	0	0	0	112.2	L456 I458 C489 R539 W540 Q545 I546 A547	L456-N543 PolarHBondContact O-ND2 3.44Å; I458-N543 WeakPolarHBondContact CG1-OD1 3.35Å; C489-N543 HydrophobicContact CB-CB 4.27Å; R539-N543 PolarHBondContact O-N 2.93Å; W540-N543 PolarHBondContact O-N 3.29Å; N543-Q545 VanDerWaalsContact C-N 3.31Å; N543-Q545 PolarHBondContact O-N 2.95Å; N543-I546 PolarHBondContact O-N 2.76Å; N543-A547 PolarHBondContact O-N 3.35Å
544	S	92.3	Very high	89.7	Confident	3 Å²	3	44 Å²	44	2%	0.021	21%	0.214	C	C	.	.	H	α-helix	trans	-59.3	-43.8	174	-172.8	0	0	0	0	111.3	A486 W540 T541 L542 A547 L548 L599	A486-S544 PolarHBondContact O-OG 2.8Å; W540-S544 PolarHBondContact O-N 2.92Å; T541-S544 PolarHBondContact O-N 3.46Å; L542-S544 VanDerWaalsContact C-N 3.34Å; L542-S544 PolarHBondContact O-N 2.94Å; S544-A547 PolarHBondContact O-N 3.36Å; S544-L548 WeakPolarHBondContact O-CB 3.5Å; S544-L548 PolarHBondContact O-N 3.33Å; S544-L599 WeakPolarHBondContact OG-CD2 3.35Å
545	Q	91.6	Very high	90.2	Very high	63 Å²	63	41.6 Å²	41.6	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-68.5	-33.2	177.5	-72	-66.5	-23.1	0	0	113.4	T541 L542 N543 K549 D602	T541-Q545 WeakPolarHBondContact O-CG 3.32Å; T541-Q545 PolarHBondContact O-N 3.49Å; T541-Q545 VanDerWaalsContact O-N 3.07Å; L542-Q545 WeakPolarHBondContact O-CB 3.35Å; L542-Q545 PolarHBondContact O-N 3.49Å; N543-Q545 VanDerWaalsContact C-N 3.31Å; N543-Q545 PolarHBondContact O-N 2.95Å; Q545-K549 WeakPolarHBondContact O-CG 3.48Å; Q545-K549 PolarHBondContact O-N 2.85Å; Q545-D602 PolarHBondContact NE2-OD2 3.2Å
546	I	91.1	Very high	90.8	Very high	25 Å²	25	39.5 Å²	39.5	13%	0.128	19%	0.192	C	C	.	.	H	α-helix	trans	-67.4	-46.5	173.5	-70.8	167.7	0	0	0	110.4	I458 L542 N543 L548 K549 F550	I458-I546 HydrophobicContact CD1-CD1 4.24Å; I458-I546 HydrophobicContact CG1-CD1 4.03Å; I458-I546 HydrophobicContact CG2-CD1 3.81Å; L542-I546 HydrophobicContact CD1-CD1 4.24Å; L542-I546 HydrophobicContact CD1-CG1 4.44Å; L542-I546 HydrophobicContact CG-CD1 3.95Å; L542-I546 WeakPolarHBondContact O-CG1 3.28Å; L542-I546 PolarHBondContact O-N 3.48Å; N543-I546 PolarHBondContact O-N 2.76Å; I546-L548 VanDerWaalsContact C-N 3.3Å; I546-L548 PolarHBondContact O-N 2.85Å; I546-K549 WeakPolarHBondContact O-CB 3.41Å; I546-K549 PolarHBondContact O-N 2.79Å; I546-F550 HydrophobicContact CG2-CD2 4.02Å; I546-F550 HydrophobicContact CG2-CE2 3.34Å; I546-F550 HydrophobicContact CG2-CZ 3.62Å; I546-F550 WeakPolarHBondContact O-CD2 3.48Å; I546-F550 WeakPolarHBondContact O-CG 3.5Å; I546-F550 PolarHBondContact O-N 2.78Å
547	A	92.5	Very high	91.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-41.6	175.1	0	0	0	0	0	111.7	M482 I485 A486 N543 S544 K549 F550 L551	M482-A547 HydrophobicContact CG-CB 4.38Å; M482-A547 HydrophobicContact SD-CB 3.66Å; I485-A547 HydrophobicContact CG2-CB 4.03Å; A486-A547 HydrophobicContact CB-CB 3.82Å; N543-A547 PolarHBondContact O-N 3.35Å; S544-A547 PolarHBondContact O-N 3.36Å; A547-K549 PolarHBondContact O-N 3.04Å; A547-F550 WeakPolarHBondContact O-CB 3.33Å; A547-F550 PolarHBondContact O-N 3.3Å; A547-F550 VanDerWaalsContact O-N 3.16Å; A547-L551 PolarHBondContact O-N 3.34Å; A547-L551 VanDerWaalsContact O-N 3.08Å
548	L	94.2	Very high	91.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-60.3	-43.5	174.9	-160.7	69.8	0	0	0	112.3	S544 I546 F550 L551 I552 L595 L599 D602 L603	S544-L548 WeakPolarHBondContact O-CB 3.5Å; S544-L548 PolarHBondContact O-N 3.33Å; I546-L548 VanDerWaalsContact C-N 3.3Å; I546-L548 PolarHBondContact O-N 2.85Å; L548-F550 VanDerWaalsContact C-N 3.28Å; L548-F550 PolarHBondContact O-N 2.93Å; L548-L551 PolarHBondContact O-N 3.09Å; L548-I552 HydrophobicContact CG-CD1 4.27Å; L548-I552 VanDerWaalsContact O-CG1 3.31Å; L548-I552 WeakPolarHBondContact O-CG1 3.29Å; L548-I552 PolarHBondContact O-N 3.31Å; L548-L595 HydrophobicContact CD1-CD1 4.21Å; L548-L599 HydrophobicContact CD1-CB 4.11Å; L548-L599 HydrophobicContact CD2-CD2 4.45Å; L548-D602 HydrophobicContact CD2-CB 3.94Å; L548-D602 WeakPolarHBondContact CD2-OD2 3.37Å; L548-L603 HydrophobicContact CD1-CB 3.86Å; L548-L603 HydrophobicContact CD1-CD1 4.03Å; L548-L603 HydrophobicContact CG-CB 4.36Å
549	K	93.4	Very high	92.1	Very high	129 Å²	129	33.4 Å²	33.4	56%	0.561	17%	0.173	S	C	*	.	H	α-helix	trans	-62.6	-34	175.5	-76.8	176.3	-178.5	179.9	0	112.7	Q545 I546 A547 G553	Q545-K549 WeakPolarHBondContact O-CG 3.48Å; Q545-K549 PolarHBondContact O-N 2.85Å; I546-K549 WeakPolarHBondContact O-CB 3.41Å; I546-K549 PolarHBondContact O-N 2.79Å; A547-K549 PolarHBondContact O-N 3.04Å; K549-G553 PolarHBondContact O-N 3.42Å
550	F	93.3	Very high	92.5	Very high	31 Å²	31	29.9 Å²	29.9	14%	0.136	17%	0.169	C	C	.	.	H	α-helix	trans	-68.9	-41.7	175.7	-68.9	-30.3	0	0	0	112.6	V461 Q462 H465 M482 I546 A547 L548 G553 E554	V461-F550 HydrophobicContact CG1-CD2 4.04Å; V461-F550 HydrophobicContact CG1-CE2 3.9Å; Q462-F550 HydrophobicContact CB-CZ 4.48Å; Q462-F550 HydrophobicContact CG-CE2 4.24Å; Q462-F550 HydrophobicContact CG-CZ 3.75Å; H465-F550 HydrophobicContact CB-CD1 4.18Å; H465-F550 HydrophobicContact CB-CD2 3.8Å; H465-F550 HydrophobicContact CB-CE1 4.26Å; H465-F550 HydrophobicContact CB-CE2 3.86Å; H465-F550 HydrophobicContact CB-CG 3.98Å; H465-F550 HydrophobicContact CB-CZ 4.12Å; H465-F550 AromaticContact CD2-CD1 3.16Å; H465-F550 WeakPolarHBondContact CD2-CD1 3.27Å; H465-F550 AromaticContact CD2-CE1 3.84Å; H465-F550 AromaticContact CD2-CG 3.3Å; H465-F550 WeakPolarHBondContact CD2-CG 3.29Å; H465-F550 AromaticContact CE1-CD1 3.85Å; H465-F550 AromaticContact CE1-CE1 3.99Å; H465-F550 AromaticContact CG-CD1 3.52Å; H465-F550 AromaticContact CG-CE1 3.73Å; H465-F550 AromaticContact CG-CG 3.71Å; H465-F550 AromaticContact ND1-CD1 3.93Å; H465-F550 AromaticContact ND1-CE1 3.83Å; H465-F550 AromaticContact NE2-CD1 3.37Å; H465-F550 WeakPolarHBondContact NE2-CD1 3.35Å; H465-F550 AromaticContact NE2-CE1 3.97Å; H465-F550 AromaticContact NE2-CG 3.98Å; M482-F550 HydrophobicContact CE-CB 4.14Å; M482-F550 HydrophobicContact CE-CD2 3.92Å; M482-F550 HydrophobicContact CE-CG 4.46Å; M482-F550 HydrophobicContact CG-CB 4.35Å; M482-F550 HydrophobicContact SD-CB 4.24Å; M482-F550 HydrophobicContact SD-CD2 4.15Å; I546-F550 HydrophobicContact CG2-CD2 4.02Å; I546-F550 HydrophobicContact CG2-CE2 3.34Å; I546-F550 HydrophobicContact CG2-CZ 3.62Å; I546-F550 WeakPolarHBondContact O-CD2 3.48Å; I546-F550 WeakPolarHBondContact O-CG 3.5Å; I546-F550 PolarHBondContact O-N 2.78Å; A547-F550 WeakPolarHBondContact O-CB 3.33Å; A547-F550 PolarHBondContact O-N 3.3Å; A547-F550 VanDerWaalsContact O-N 3.16Å; L548-F550 VanDerWaalsContact C-N 3.28Å; L548-F550 PolarHBondContact O-N 2.93Å; F550-G553 PolarHBondContact O-N 2.89Å; F550-E554 PolarHBondContact O-N 3.35Å
551	L	94.9	Very high	92.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-47.3	171.4	-68.1	170.4	0	0	0	111.4	T479 M482 V483 A547 L548 G553 E554 V555 L595 L603	T479-L551 HydrophobicContact CG2-CD2 4Å; M482-L551 HydrophobicContact CB-CD2 3.7Å; M482-L551 HydrophobicContact CB-CG 4.19Å; M482-L551 HydrophobicContact CG-CD1 4.4Å; M482-L551 HydrophobicContact CG-CD2 3.77Å; M482-L551 HydrophobicContact CG-CG 3.7Å; V483-L551 HydrophobicContact CG2-CD1 3.77Å; V483-L551 HydrophobicContact CG2-CD2 3.99Å; A547-L551 PolarHBondContact O-N 3.34Å; A547-L551 VanDerWaalsContact O-N 3.08Å; L548-L551 PolarHBondContact O-N 3.09Å; L551-G553 VanDerWaalsContact C-N 3.32Å; L551-G553 PolarHBondContact O-N 2.7Å; L551-E554 PolarHBondContact O-N 2.84Å; L551-V555 PolarHBondContact O-N 2.98Å; L551-L595 HydrophobicContact CD1-CD1 4.26Å; L551-L595 HydrophobicContact CD1-CD2 4.19Å; L551-L603 HydrophobicContact CB-CD1 3.81Å; L551-L603 HydrophobicContact CD1-CD1 4.25Å
552	I	94.7	Very high	93	Very high	11 Å²	11	33.5 Å²	33.5	6%	0.056	19%	0.189	C	C	.	.	H	α-helix	trans	-60.8	-43.1	176.2	-68	162.6	0	0	0	110.9	L548 E554 V555 I556 L603 Q606 L607	L548-I552 HydrophobicContact CG-CD1 4.27Å; L548-I552 VanDerWaalsContact O-CG1 3.31Å; L548-I552 WeakPolarHBondContact O-CG1 3.29Å; L548-I552 PolarHBondContact O-N 3.31Å; I552-E554 VanDerWaalsContact C-N 3.33Å; I552-E554 PolarHBondContact O-N 3.46Å; I552-V555 PolarHBondContact O-N 3.12Å; I552-I556 HydrophobicContact CG2-CD1 3.44Å; I552-I556 VanDerWaalsContact CG2-CD1 3.44Å; I552-I556 HydrophobicContact CG2-CG1 4.14Å; I552-I556 WeakPolarHBondContact O-CB 2.9Å; I552-I556 WeakPolarHBondContact O-CG1 3.49Å; I552-I556 PolarHBondContact O-N 3.38Å; I552-L603 HydrophobicContact CG1-CD1 4.24Å; I552-L603 HydrophobicContact CG1-CG 3.95Å; I552-Q606 HydrophobicContact CD1-CB 3.72Å; I552-Q606 HydrophobicContact CD1-CG 4.28Å; I552-L607 HydrophobicContact CG2-CD2 4.09Å
553	G	92.9	Very high	93.1	Very high	28 Å²	28	29.3 Å²	29.3	29%	0.289	17%	0.167	S	C	.	.	H	α-helix	trans	-61.8	-38.6	178.4	0	0	0	0	0	113.1	K549 F550 L551 I556 A557	K549-G553 PolarHBondContact O-N 3.42Å; F550-G553 PolarHBondContact O-N 2.89Å; L551-G553 VanDerWaalsContact C-N 3.32Å; L551-G553 PolarHBondContact O-N 2.7Å; G553-I556 PolarHBondContact O-N 2.74Å; G553-A557 WeakPolarHBondContact O-CB 3.49Å; G553-A557 PolarHBondContact O-N 3.43Å
554	E	93	Very high	93.3	Very high	6 Å²	6	31.6 Å²	31.6	3%	0.028	19%	0.187	C	C	.	.	H	α-helix	trans	-60.9	-51.2	174.7	-175.1	171.3	-137.1	0	0	111.5	H468 F469 F478 T479 F550 L551 I552 I556 A557 D558 Y588	H468-E554 IonicContact CD2-OE1 3.12Å; H468-E554 IonicContact CE1-OE1 3.3Å; H468-E554 IonicContact NE2-OE1 3.68Å; H468-E554 PolarHBondContact NE2-OE1 3.34Å; F469-E554 HydrophobicContact CZ-CB 4.04Å; F469-E554 HydrophobicContact CZ-CG 4.41Å; F478-E554 WeakPolarHBondContact CD1-OE1 3.33Å; F478-E554 WeakPolarHBondContact CD1-OE2 3.41Å; F478-E554 WeakPolarHBondContact CE1-OE2 3.5Å; T479-E554 PolarHBondContact OG1-OE2 3.23Å; F550-E554 PolarHBondContact O-N 3.35Å; L551-E554 PolarHBondContact O-N 2.84Å; I552-E554 VanDerWaalsContact C-N 3.33Å; I552-E554 PolarHBondContact O-N 3.46Å; E554-I556 PolarHBondContact O-N 3.14Å; E554-A557 PolarHBondContact O-N 3.46Å; E554-D558 PolarHBondContact O-N 3.07Å; E554-Y588 HydrophobicContact CG-CE1 3.9Å; E554-Y588 WeakPolarHBondContact CG-OH 3.39Å
555	V	95	Very high	93.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-49	175.8	-178.4	0	0	0	0	111.1	L551 I552 A557 D558 I559 I585 Y588 L607	L551-V555 PolarHBondContact O-N 2.98Å; I552-V555 PolarHBondContact O-N 3.12Å; V555-A557 VanDerWaalsContact C-N 3.29Å; V555-A557 PolarHBondContact O-N 3.3Å; V555-D558 PolarHBondContact O-N 3.08Å; V555-D558 VanDerWaalsContact O-N 3.12Å; V555-I559 HydrophobicContact CG1-CD1 4.42Å; V555-I559 HydrophobicContact CG1-CG2 4.47Å; V555-I559 WeakPolarHBondContact O-CG1 3.38Å; V555-I559 PolarHBondContact O-N 3.45Å; V555-I585 HydrophobicContact CG1-CG1 3.98Å; V555-Y588 HydrophobicContact CB-CD2 4.42Å; V555-Y588 HydrophobicContact CG1-CD2 4.37Å; V555-Y588 HydrophobicContact CG2-CD1 4.13Å; V555-Y588 HydrophobicContact CG2-CD2 3.86Å; V555-Y588 HydrophobicContact CG2-CE2 4.36Å; V555-Y588 HydrophobicContact CG2-CG 3.75Å; V555-L607 HydrophobicContact CB-CD2 3.95Å; V555-L607 HydrophobicContact CG1-CD1 4.27Å; V555-L607 HydrophobicContact CG1-CD2 3.81Å; V555-L607 HydrophobicContact CG2-CD1 4.5Å
556	I	94.3	Very high	93.2	Very high	37 Å²	37	30.6 Å²	30.6	19%	0.19	18%	0.183	C	C	.	.	H	α-helix	trans	-59.4	-40.5	-178.1	-71.3	172.1	0	0	0	111.2	I552 G553 E554 D558 I559 A560 L607 R610	I552-I556 HydrophobicContact CG2-CD1 3.44Å; I552-I556 VanDerWaalsContact CG2-CD1 3.44Å; I552-I556 HydrophobicContact CG2-CG1 4.14Å; I552-I556 WeakPolarHBondContact O-CB 2.9Å; I552-I556 WeakPolarHBondContact O-CG1 3.49Å; I552-I556 PolarHBondContact O-N 3.38Å; G553-I556 PolarHBondContact O-N 2.74Å; E554-I556 PolarHBondContact O-N 3.14Å; I556-D558 PolarHBondContact O-N 3.02Å; I556-I559 PolarHBondContact O-N 3.27Å; I556-A560 WeakPolarHBondContact O-CA 3.35Å; I556-A560 WeakPolarHBondContact O-CB 3.49Å; I556-A560 PolarHBondContact O-N 3.05Å; I556-L607 HydrophobicContact CG1-CD2 4.28Å; I556-R610 HydrophobicContact CD1-CB 4.27Å; I556-R610 HydrophobicContact CD1-CG 3.71Å; I556-R610 HydrophobicContact CG1-CG 4.07Å
557	A	92.5	Very high	93.1	Very high	44 Å²	44	29.4 Å²	29.4	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-59.8	-38.3	178.9	0	0	0	0	0	111.8	F469 G553 E554 V555	F469-A557 HydrophobicContact CE1-CB 4.29Å; G553-A557 WeakPolarHBondContact O-CB 3.49Å; G553-A557 PolarHBondContact O-N 3.43Å; E554-A557 PolarHBondContact O-N 3.46Å; V555-A557 VanDerWaalsContact C-N 3.29Å; V555-A557 PolarHBondContact O-N 3.3Å
558	D	93.2	Very high	92.9	Very high	49 Å²	49	30.9 Å²	30.9	26%	0.262	19%	0.186	S	C	.	.	H	α-helix	trans	-79.6	-34.5	-177.3	-69.4	1.9	0	0	0	112.5	R472 E554 V555 I556 P561 T584 Y588	R472-D558 IonicContact CZ-OD1 2.74Å; R472-D558 VanDerWaalsContact CZ-OD1 3.24Å; R472-D558 IonicContact NH1-OD1 3.26Å; R472-D558 PolarHBondContact NH1-OD1 3.21Å; R472-D558 IonicContact NH1-OD2 3.72Å; R472-D558 PolarHBondContact NH1-OD2 3.1Å; R472-D558 IonicContact NH2-OD1 3.81Å; R472-D558 PolarHBondContact NH2-OD1 2.97Å; E554-D558 PolarHBondContact O-N 3.07Å; V555-D558 PolarHBondContact O-N 3.08Å; V555-D558 VanDerWaalsContact O-N 3.12Å; I556-D558 PolarHBondContact O-N 3.02Å; D558-P561 WeakPolarHBondContact O-CD 3.48Å; D558-T584 HydrophobicContact CB-CG2 4.23Å; D558-Y588 HydrophobicContact CB-CE2 4.39Å; D558-Y588 PolarHBondContact OD2-OH 3.4Å
559	I	95.2	Very high	92.4	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-86.4	-13.2	176.9	68.3	173.3	0	0	0	113.5	V555 I556 P561 H562 L563 I581 T584	V555-I559 HydrophobicContact CG1-CD1 4.42Å; V555-I559 HydrophobicContact CG1-CG2 4.47Å; V555-I559 WeakPolarHBondContact O-CG1 3.38Å; V555-I559 PolarHBondContact O-N 3.45Å; I556-I559 PolarHBondContact O-N 3.27Å; I559-P561 VanDerWaalsContact C-CD 3.43Å; I559-H562 PolarHBondContact O-N 3.42Å; I559-L563 HydrophobicContact CD1-CD1 3.83Å; I559-L563 HydrophobicContact CD1-CG 4.22Å; I559-L563 HydrophobicContact CG1-CD1 3.74Å; I559-L563 HydrophobicContact CG1-CG 4.1Å; I559-L563 WeakPolarHBondContact O-CG 3.45Å; I559-L563 PolarHBondContact O-N 2.86Å; I559-I581 HydrophobicContact CB-CG1 4.19Å; I559-I581 HydrophobicContact CB-CG2 4.44Å; I559-I581 HydrophobicContact CD1-CG2 4.15Å; I559-I581 HydrophobicContact CG2-CG2 4.34Å; I559-T584 HydrophobicContact CG2-CG2 3.7Å
560	A	94	Very high	92	Very high	43 Å²	43	35.7 Å²	35.7	36%	0.355	22%	0.217	S	C	.	.	H	α-helix	trans	-52.3	-42.2	-177.1	0	0	0	0	0	114.6	I556 H562 L563 A564	I556-A560 WeakPolarHBondContact O-CA 3.35Å; I556-A560 WeakPolarHBondContact O-CB 3.49Å; I556-A560 PolarHBondContact O-N 3.05Å; A560-H562 VanDerWaalsContact C-N 3.27Å; A560-H562 PolarHBondContact O-N 2.79Å; A560-L563 PolarHBondContact O-N 3.26Å; A560-A564 PolarHBondContact O-N 2.97Å
561	P	92.9	Very high	91.8	Very high	81 Å²	81	34.2 Å²	34.2	53%	0.526	21%	0.211	S	C	.	.	H	α-helix	trans	-61.4	-35.4	176.5	-23.1	34.7	0	0	0	112.9	D558 I559 I565	D558-P561 WeakPolarHBondContact O-CD 3.48Å; I559-P561 VanDerWaalsContact C-CD 3.43Å; P561-I565 WeakPolarHBondContact O-CG1 3.17Å
562	H	93.6	Very high	91.2	Very high	56 Å²	56	35.9 Å²	35.9	26%	0.259	22%	0.22	S	C	.	.	H	α-helix	trans	-80.4	-37.3	179.6	-63.5	-77.4	0	0	0	111.9	I559 A560 A564 I565 T580 I581	I559-H562 PolarHBondContact O-N 3.42Å; A560-H562 VanDerWaalsContact C-N 3.27Å; A560-H562 PolarHBondContact O-N 2.79Å; H562-A564 VanDerWaalsContact C-N 3.26Å; H562-A564 PolarHBondContact O-N 3.36Å; H562-I565 WeakPolarHBondContact O-CB 3.39Å; H562-I565 PolarHBondContact O-N 2.65Å; H562-T580 WeakPolarHBondContact NE2-CG2 3.08Å; H562-I581 HydrophobicContact CB-CD1 3.98Å; H562-I581 HydrophobicContact CB-CG1 3.69Å
563	L	92.9	Very high	90.5	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-56.3	-40.3	170.5	-79	-179.2	0	0	0	111.7	I559 A560 I565 I566 I581 I611 E614 R623	I559-L563 HydrophobicContact CD1-CD1 3.83Å; I559-L563 HydrophobicContact CD1-CG 4.22Å; I559-L563 HydrophobicContact CG1-CD1 3.74Å; I559-L563 HydrophobicContact CG1-CG 4.1Å; I559-L563 WeakPolarHBondContact O-CG 3.45Å; I559-L563 PolarHBondContact O-N 2.86Å; A560-L563 PolarHBondContact O-N 3.26Å; L563-I565 PolarHBondContact O-N 3.49Å; L563-I566 HydrophobicContact CD2-CD1 3.81Å; L563-I566 WeakPolarHBondContact O-CB 3.08Å; L563-I566 PolarHBondContact O-N 2.82Å; L563-I581 HydrophobicContact CD2-CD1 3.87Å; L563-I581 HydrophobicContact CG-CD1 4.22Å; L563-I611 HydrophobicContact CD2-CG1 4.34Å; L563-E614 HydrophobicContact CB-CG 3.92Å; L563-E614 HydrophobicContact CD2-CB 3.99Å; L563-E614 HydrophobicContact CD2-CG 4.11Å; L563-E614 HydrophobicContact CG-CG 4.5Å; L563-E614 WeakPolarHBondContact O-CG 3.37Å; L563-R623 PolarHBondContact O-NH1 3.06Å
564	A	92.2	Very high	89.8	Confident	53 Å²	53	43.6 Å²	43.6	44%	0.438	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.5	177.6	0	0	0	0	0	114	A560 H562	A560-A564 PolarHBondContact O-N 2.97Å; H562-A564 VanDerWaalsContact C-N 3.26Å; H562-A564 PolarHBondContact O-N 3.36Å
565	I	91.6	Very high	88.8	Confident	45 Å²	45	48.2 Å²	48.2	23%	0.231	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-24	178.9	-61.3	167.7	0	0	0	111.3	P561 H562 L563 L567 T568 K570 W571 P577	P561-I565 WeakPolarHBondContact O-CG1 3.17Å; H562-I565 WeakPolarHBondContact O-CB 3.39Å; H562-I565 PolarHBondContact O-N 2.65Å; L563-I565 PolarHBondContact O-N 3.49Å; I565-L567 PolarHBondContact O-N 3.16Å; I565-T568 VanDerWaalsContact O-CB 3.3Å; I565-T568 WeakPolarHBondContact O-CB 3.43Å; I565-T568 VanDerWaalsContact O-CG2 3.28Å; I565-T568 WeakPolarHBondContact O-CG2 3.11Å; I565-T568 PolarHBondContact O-N 3.47Å; I565-T568 VanDerWaalsContact O-N 3.07Å; I565-T568 PolarHBondContact O-OG1 2.79Å; I565-K570 HydrophobicContact CG2-CB 3.88Å; I565-W571 HydrophobicContact CG2-CB 4.3Å; I565-W571 WeakPolarHBondContact O-CB 3.27Å; I565-P577 HydrophobicContact CB-CB 4.18Å; I565-P577 HydrophobicContact CB-CG 4.06Å; I565-P577 HydrophobicContact CD1-CG 4.46Å; I565-P577 HydrophobicContact CG2-CB 4.15Å; I565-P577 HydrophobicContact CG2-CG 3.5Å; I565-P577 VanDerWaalsContact CG2-CG 3.5Å
566	I	90.7	Very high	88.2	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	133.6	-178.5	-63.4	175.4	0	0	0	110.7	L563 T568 I581 Y615	L563-I566 HydrophobicContact CD2-CD1 3.81Å; L563-I566 WeakPolarHBondContact O-CB 3.08Å; L563-I566 PolarHBondContact O-N 2.82Å; I566-T568 PolarHBondContact O-N 2.96Å; I566-I581 HydrophobicContact CD1-CD1 4.01Å; I566-Y615 HydrophobicContact CD1-CD2 4.37Å; I566-Y615 HydrophobicContact CD1-CE2 3.86Å; I566-Y615 HydrophobicContact CG2-CD1 3.51Å; I566-Y615 HydrophobicContact CG2-CD2 4.11Å; I566-Y615 HydrophobicContact CG2-CE1 3.44Å; I566-Y615 VanDerWaalsContact CG2-CE1 3.44Å; I566-Y615 HydrophobicContact CG2-CE2 4.06Å; I566-Y615 HydrophobicContact CG2-CG 3.85Å
567	L	89.1	Confident	88	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	38.5	-177.5	-69.7	164.6	0	0	0	113	I565 W571 Y615 A618 F619 R623 V624 F626 M639	I565-L567 PolarHBondContact O-N 3.16Å; L567-W571 HydrophobicContact CD2-CE3 4.13Å; L567-W571 HydrophobicContact CD2-CH2 3.83Å; L567-W571 HydrophobicContact CD2-CZ2 4.4Å; L567-W571 HydrophobicContact CD2-CZ3 3.67Å; L567-Y615 HydrophobicContact CD1-CD1 3.98Å; L567-Y615 WeakPolarHBondContact CD1-O 3.17Å; L567-Y615 HydrophobicContact CG-CD1 4.34Å; L567-A618 HydrophobicContact CB-CB 3.71Å; L567-A618 HydrophobicContact CD1-CB 3.83Å; L567-A618 HydrophobicContact CG-CB 4.38Å; L567-F619 HydrophobicContact CD1-CD2 3.62Å; L567-F619 HydrophobicContact CD1-CE1 4.4Å; L567-F619 HydrophobicContact CD1-CE2 3.39Å; L567-F619 HydrophobicContact CD1-CG 4.22Å; L567-F619 HydrophobicContact CD1-CZ 3.82Å; L567-F619 HydrophobicContact CD2-CE2 4.39Å; L567-F619 HydrophobicContact CD2-CZ 4.03Å; L567-R623 CarbonylContact O-C 3.23Å; L567-R623 VanDerWaalsContact O-C 3.23Å; L567-R623 WeakPolarHBondContact O-CB 3.4Å; L567-V624 HydrophobicContact CB-CG1 4.07Å; L567-V624 HydrophobicContact CD2-CG1 4.06Å; L567-V624 VanDerWaalsContact O-CB 3.26Å; L567-V624 WeakPolarHBondContact O-CB 3.13Å; L567-V624 PolarHBondContact O-N 3.37Å; L567-F626 HydrophobicContact CD2-CZ 4.07Å; L567-M639 HydrophobicContact CD2-SD 4.42Å
568	T	87.8	Confident	87.9	Confident	32 Å²	32	46.2 Å²	46.2	20%	0.196	28%	0.275	C	S	.	.	S	Bend	trans	-108.8	173	163.5	69.2	0	0	0	0	110	I565 I566 K570 W571 L572 R623	I565-T568 VanDerWaalsContact O-CB 3.3Å; I565-T568 WeakPolarHBondContact O-CB 3.43Å; I565-T568 VanDerWaalsContact O-CG2 3.28Å; I565-T568 WeakPolarHBondContact O-CG2 3.11Å; I565-T568 PolarHBondContact O-N 3.47Å; I565-T568 VanDerWaalsContact O-N 3.07Å; I565-T568 PolarHBondContact O-OG1 2.79Å; I566-T568 PolarHBondContact O-N 2.96Å; T568-K570 PolarHBondContact O-N 2.94Å; T568-K570 PolarHBondContact OG1-N 3.43Å; T568-W571 WeakPolarHBondContact O-CB 3.45Å; T568-W571 PolarHBondContact O-N 3.28Å; T568-L572 PolarHBondContact O-N 2.96Å; T568-R623 HydrophobicContact CG2-CB 4.24Å
569	S	82.8	Confident	87.9	Confident	82 Å²	82	47.9 Å²	47.9	57%	0.573	28%	0.281	S	S	*	.	H	α-helix	trans	-57.7	-37.7	175.1	65.4	0	0	0	0	112.6	W571 L572 D573	S569-W571 PolarHBondContact O-N 3.36Å; S569-L572 PolarHBondContact O-N 3.49Å; S569-L572 VanDerWaalsContact O-N 3.1Å; S569-D573 PolarHBondContact O-N 2.96Å
570	K	85.6	Confident	87.8	Confident	147 Å²	147	50.2 Å²	50.2	64%	0.639	30%	0.296	S	S	*	.	H	α-helix	trans	-63.4	-30.8	176.5	-70.5	-175.6	178.5	-178.1	0	112.9	I565 T568 D573 S574	I565-K570 HydrophobicContact CG2-CB 3.88Å; T568-K570 PolarHBondContact O-N 2.94Å; T568-K570 PolarHBondContact OG1-N 3.43Å; K570-D573 PolarHBondContact O-N 3.43Å; K570-S574 PolarHBondContact O-N 2.94Å
571	W	88.6	Confident	87.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-71.1	-34.8	175	169.9	89.2	0	0	0	111.1	I565 L567 T568 S569 D573 A635 R638 M639 E642	I565-W571 HydrophobicContact CG2-CB 4.3Å; I565-W571 WeakPolarHBondContact O-CB 3.27Å; L567-W571 HydrophobicContact CD2-CE3 4.13Å; L567-W571 HydrophobicContact CD2-CH2 3.83Å; L567-W571 HydrophobicContact CD2-CZ2 4.4Å; L567-W571 HydrophobicContact CD2-CZ3 3.67Å; T568-W571 WeakPolarHBondContact O-CB 3.45Å; T568-W571 PolarHBondContact O-N 3.28Å; S569-W571 PolarHBondContact O-N 3.36Å; W571-D573 VanDerWaalsContact C-N 3.26Å; W571-D573 PolarHBondContact O-N 2.89Å; W571-A635 HydrophobicContact CH2-CB 4.12Å; W571-A635 HydrophobicContact CZ3-CB 3.99Å; W571-R638 HydrophobicContact CH2-CB 4.09Å; W571-R638 HydrophobicContact CH2-CG 4.01Å; W571-R638 HydrophobicContact CZ2-CB 4.11Å; W571-R638 VanDerWaalsContact CZ2-CD 3.49Å; W571-R638 HydrophobicContact CZ2-CG 3.58Å; W571-R638 PolarHBondContact O-NE 2.86Å; W571-R638 PolarHBondContact O-NH1 3.29Å; W571-R638 PolarHBondContact O-NH2 2.92Å; W571-M639 HydrophobicContact CH2-CG 3.85Å; W571-M639 HydrophobicContact CZ2-CG 3.97Å; W571-E642 VanDerWaalsContact CE2-OE2 3.3Å; W571-E642 VanDerWaalsContact CZ2-OE2 3.24Å; W571-E642 WeakPolarHBondContact CZ2-OE2 3.3Å; W571-E642 VanDerWaalsContact NE1-CD 3.26Å; W571-E642 PolarHBondContact NE1-OE1 3.48Å; W571-E642 PolarHBondContact NE1-OE2 3.29Å
572	L	81.9	Confident	87.9	Confident	35 Å²	35	44.9 Å²	44.9	18%	0.183	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-33.6	174.5	-72.1	169.5	0	0	0	112.6	T568 S569 V624 F626 V634 A635	T568-L572 PolarHBondContact O-N 2.96Å; S569-L572 PolarHBondContact O-N 3.49Å; S569-L572 VanDerWaalsContact O-N 3.1Å; L572-V624 HydrophobicContact CD1-CG2 4.13Å; L572-F626 HydrophobicContact CD1-CE1 4.37Å; L572-F626 HydrophobicContact CD2-CE1 4.25Å; L572-V634 HydrophobicContact CD2-CG1 4.37Å; L572-A635 HydrophobicContact CD2-CB 4.04Å
573	D	80.3	Confident	87.9	Confident	142 Å²	142	44.8 Å²	44.8	76%	0.759	26%	0.262	S	S	*	.	H	α-helix	trans	-90.4	-9	-172.8	-62.3	-32.2	0	0	0	114.8	S569 K570 W571	S569-D573 PolarHBondContact O-N 2.96Å; K570-D573 PolarHBondContact O-N 3.43Å; W571-D573 VanDerWaalsContact C-N 3.26Å; W571-D573 PolarHBondContact O-N 2.89Å
574	S	77.9	Confident	88	Confident	60 Å²	60	46 Å²	46	42%	0.42	27%	0.27	S	S	.	.			trans	-152.9	129.6	-172.2	-178.8	0	0	0	0	114.4	K570 G576 P577 R638	K570-S574 PolarHBondContact O-N 2.94Å; S574-G576 PolarHBondContact O-N 3.07Å; S574-G576 PolarHBondContact OG-N 2.72Å; S574-P577 WeakPolarHBondContact O-CD 3.29Å; S574-R638 PolarHBondContact O-NH1 3.26Å; S574-R638 VanDerWaalsContact O-NH1 3.09Å; S574-R638 PolarHBondContact O-NH2 3.42Å
575	D	72.1	Confident	88.2	Confident	103 Å²	103	43.7 Å²	43.7	55%	0.551	25%	0.25	S	S	*	.	S	Bend	trans	-69.7	-5.6	172.7	-68.5	-4.5	0	0	0	114.5	R638	D575-R638 VanDerWaalsContact CA-NH2 3.32Å; D575-R638 IonicContact OD1-CZ 3.91Å; D575-R638 IonicContact OD1-NH1 3.12Å; D575-R638 PolarHBondContact OD1-NH1 3.08Å; D575-R638 IonicContact OD1-NH2 3.34Å
576	G	83.8	Confident	88.3	Confident	29 Å²	29	44.9 Å²	44.9	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-60.9	-40.7	-172.4	0	0	0	0	0	116.7	S574 T580	S574-G576 PolarHBondContact O-N 3.07Å; S574-G576 PolarHBondContact OG-N 2.72Å; G576-T580 WeakPolarHBondContact O-CB 3.49Å; G576-T580 PolarHBondContact O-N 3.05Å; G576-T580 PolarHBondContact O-OG1 2.92Å
577	P	88.7	Confident	88.5	Confident	7 Å²	7	49.5 Å²	49.5	5%	0.045	28%	0.28	C	S	.	.	H	α-helix	trans	-64	-49.9	-171.7	-24.5	34.6	0	0	0	113.7	I565 S574 T580 I581	I565-P577 HydrophobicContact CB-CB 4.18Å; I565-P577 HydrophobicContact CB-CG 4.06Å; I565-P577 HydrophobicContact CD1-CG 4.46Å; I565-P577 HydrophobicContact CG2-CB 4.15Å; I565-P577 HydrophobicContact CG2-CG 3.5Å; I565-P577 VanDerWaalsContact CG2-CG 3.5Å; S574-P577 WeakPolarHBondContact O-CD 3.29Å; P577-T580 PolarHBondContact O-N 3.38Å; P577-I581 VanDerWaalsContact O-CG1 3.27Å; P577-I581 WeakPolarHBondContact O-CG1 3.31Å; P577-I581 PolarHBondContact O-N 3.47Å; P577-I581 VanDerWaalsContact O-N 3.11Å
578	L	91.9	Very high	88.8	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-70.3	-40.1	-179.8	-169.2	77.8	0	0	0	111.9	T580 I581 C582 E642 K645 L646	L578-T580 PolarHBondContact O-N 2.67Å; L578-I581 HydrophobicContact CD1-CD1 4.41Å; L578-I581 WeakPolarHBondContact O-CB 3.29Å; L578-I581 PolarHBondContact O-N 3.39Å; L578-I581 VanDerWaalsContact O-N 3.08Å; L578-C582 PolarHBondContact O-N 2.86Å; L578-C582 PolarHBondContact O-SG 3.12Å; L578-C582 VanDerWaalsContact O-SG 3.38Å; L578-E642 HydrophobicContact CB-CG 4.41Å; L578-E642 HydrophobicContact CD2-CB 3.43Å; L578-E642 VanDerWaalsContact CD2-CB 3.43Å; L578-E642 HydrophobicContact CD2-CG 3.4Å; L578-E642 VanDerWaalsContact CD2-CG 3.4Å; L578-E642 HydrophobicContact CG-CG 4.49Å; L578-K645 HydrophobicContact CD2-CB 4.39Å; L578-K645 HydrophobicContact CD2-CD 4.43Å; L578-L646 HydrophobicContact CD1-CD1 4.18Å; L578-L646 HydrophobicContact CD1-CD2 4.05Å; L578-L646 HydrophobicContact CD1-CG 4.18Å; L578-L646 HydrophobicContact CD2-CG 4.33Å
579	E	91.7	Very high	89.1	Confident	85 Å²	85	51 Å²	51	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-43.2	177.5	-162.2	65.6	-153.9	0	0	110.4	I581 C582 C583 K645	E579-I581 PolarHBondContact O-N 3.36Å; E579-C582 PolarHBondContact O-N 3.44Å; E579-C583 PolarHBondContact O-N 3.38Å; E579-C583 PolarHBondContact O-SG 2.9Å; E579-K645 IonicContact OE2-NZ 2.97Å; E579-K645 PolarHBondContact OE2-NZ 2.89Å
580	T	93	Very high	89.5	Confident	50 Å²	50	53.1 Å²	53.1	31%	0.307	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-44.7	175.3	-48.3	0	0	0	0	111.7	H562 G576 P577 L578 C582 C583 T584	H562-T580 WeakPolarHBondContact NE2-CG2 3.08Å; G576-T580 WeakPolarHBondContact O-CB 3.49Å; G576-T580 PolarHBondContact O-N 3.05Å; G576-T580 PolarHBondContact O-OG1 2.92Å; P577-T580 PolarHBondContact O-N 3.38Å; L578-T580 PolarHBondContact O-N 2.67Å; T580-C582 VanDerWaalsContact C-N 3.34Å; T580-C582 PolarHBondContact O-N 3.05Å; T580-C583 PolarHBondContact O-N 3.02Å; T580-T584 WeakPolarHBondContact O-CB 3.43Å; T580-T584 PolarHBondContact O-N 2.82Å; T580-T584 PolarHBondContact O-OG1 2.83Å
581	I	94.5	Very high	89.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.9	-47.2	176.4	-66.2	163.9	0	0	0	110.8	I559 H562 L563 I566 P577 L578 E579 T584 I585 I611	I559-I581 HydrophobicContact CB-CG1 4.19Å; I559-I581 HydrophobicContact CB-CG2 4.44Å; I559-I581 HydrophobicContact CD1-CG2 4.15Å; I559-I581 HydrophobicContact CG2-CG2 4.34Å; H562-I581 HydrophobicContact CB-CD1 3.98Å; H562-I581 HydrophobicContact CB-CG1 3.69Å; L563-I581 HydrophobicContact CD2-CD1 3.87Å; L563-I581 HydrophobicContact CG-CD1 4.22Å; I566-I581 HydrophobicContact CD1-CD1 4.01Å; P577-I581 VanDerWaalsContact O-CG1 3.27Å; P577-I581 WeakPolarHBondContact O-CG1 3.31Å; P577-I581 PolarHBondContact O-N 3.47Å; P577-I581 VanDerWaalsContact O-N 3.11Å; L578-I581 HydrophobicContact CD1-CD1 4.41Å; L578-I581 WeakPolarHBondContact O-CB 3.29Å; L578-I581 PolarHBondContact O-N 3.39Å; L578-I581 VanDerWaalsContact O-N 3.08Å; E579-I581 PolarHBondContact O-N 3.36Å; I581-T584 PolarHBondContact O-N 3.34Å; I581-I585 HydrophobicContact CG2-CD1 3.76Å; I581-I585 VanDerWaalsContact O-CG1 3.3Å; I581-I585 WeakPolarHBondContact O-CG1 3.28Å; I581-I585 PolarHBondContact O-N 3.35Å; I581-I611 HydrophobicContact CG2-CD1 4.11Å; I581-I611 HydrophobicContact CG2-CG1 4.44Å
582	C	94.5	Very high	90.2	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.074	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-47.3	179.2	-70.4	0	0	0	0	111.7	L578 E579 T580 I585 E586 L649	L578-C582 PolarHBondContact O-N 2.86Å; L578-C582 PolarHBondContact O-SG 3.12Å; L578-C582 VanDerWaalsContact O-SG 3.38Å; E579-C582 PolarHBondContact O-N 3.44Å; T580-C582 VanDerWaalsContact C-N 3.34Å; T580-C582 PolarHBondContact O-N 3.05Å; C582-I585 PolarHBondContact O-N 3.25Å; C582-E586 WeakPolarHBondContact O-CB 3.41Å; C582-E586 PolarHBondContact O-N 3.37Å; C582-L649 HydrophobicContact CB-CD2 3.88Å
583	C	94.4	Very high	90.7	Very high	55 Å²	55	48.9 Å²	48.9	37%	0.372	27%	0.272	S	S	.	.	H	α-helix	trans	-60.4	-46.4	176.8	-67.7	0	0	0	0	111.7	E579 T580 I585 E586 D587	E579-C583 PolarHBondContact O-N 3.38Å; E579-C583 PolarHBondContact O-SG 2.9Å; T580-C583 PolarHBondContact O-N 3.02Å; C583-I585 PolarHBondContact O-N 3.47Å; C583-E586 PolarHBondContact O-N 3.14Å; C583-D587 VanDerWaalsContact O-CG 3.27Å; C583-D587 PolarHBondContact O-N 2.86Å
584	T	95.1	Very high	91.3	Very high	29 Å²	29	44.2 Å²	44.2	18%	0.178	25%	0.246	C	C	.	.	H	α-helix	trans	-61.4	-43.4	178.8	-57.9	0	0	0	0	111.9	D558 I559 T580 I581 E586 D587 Y588	D558-T584 HydrophobicContact CB-CG2 4.23Å; I559-T584 HydrophobicContact CG2-CG2 3.7Å; T580-T584 WeakPolarHBondContact O-CB 3.43Å; T580-T584 PolarHBondContact O-N 2.82Å; T580-T584 PolarHBondContact O-OG1 2.83Å; I581-T584 PolarHBondContact O-N 3.34Å; T584-E586 VanDerWaalsContact C-N 3.3Å; T584-E586 PolarHBondContact O-N 3.33Å; T584-D587 PolarHBondContact O-N 3.46Å; T584-Y588 HydrophobicContact CG2-CD2 3.84Å; T584-Y588 HydrophobicContact CG2-CE2 3.83Å; T584-Y588 VanDerWaalsContact O-CD2 3.29Å; T584-Y588 WeakPolarHBondContact O-CD2 3.42Å; T584-Y588 PolarHBondContact O-N 3.21Å
585	I	96	Very high	92.1	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.015	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-39	176.9	-69.1	169.5	0	0	0	111.1	V555 I581 C582 C583 H589 L607 I611 L649 F650 L653	V555-I585 HydrophobicContact CG1-CG1 3.98Å; I581-I585 HydrophobicContact CG2-CD1 3.76Å; I581-I585 VanDerWaalsContact O-CG1 3.3Å; I581-I585 WeakPolarHBondContact O-CG1 3.28Å; I581-I585 PolarHBondContact O-N 3.35Å; C582-I585 PolarHBondContact O-N 3.25Å; C583-I585 PolarHBondContact O-N 3.47Å; I585-H589 WeakPolarHBondContact O-CB 3.22Å; I585-H589 PolarHBondContact O-N 3.31Å; I585-L607 HydrophobicContact CG2-CD1 4.49Å; I585-I611 HydrophobicContact CD1-CD1 3.6Å; I585-L649 HydrophobicContact CG2-CD2 4.41Å; I585-F650 HydrophobicContact CD1-CZ 4.31Å; I585-L653 HydrophobicContact CG2-CD1 3.76Å
586	E	94.7	Very high	93	Very high	71 Å²	71	38.6 Å²	38.6	33%	0.332	21%	0.21	S	C	.	.	H	α-helix	trans	-67.4	-37.9	176.9	-177.9	166	-163	0	0	112.8	C582 C583 T584 H589 L649 R652	C582-E586 WeakPolarHBondContact O-CB 3.41Å; C582-E586 PolarHBondContact O-N 3.37Å; C583-E586 PolarHBondContact O-N 3.14Å; T584-E586 VanDerWaalsContact C-N 3.3Å; T584-E586 PolarHBondContact O-N 3.33Å; E586-H589 WeakPolarHBondContact O-CB 3.41Å; E586-H589 PolarHBondContact O-N 2.81Å; E586-L649 HydrophobicContact CB-CD1 4.45Å; E586-R652 IonicContact OE1-CZ 2.82Å; E586-R652 IonicContact OE1-NH1 2.9Å; E586-R652 PolarHBondContact OE1-NH1 3.29Å; E586-R652 IonicContact OE1-NH2 3.29Å; E586-R652 PolarHBondContact OE1-NH2 3.04Å; E586-R652 IonicContact OE2-CZ 3.66Å; E586-R652 IonicContact OE2-NH2 3.5Å; E586-R652 PolarHBondContact OE2-NH2 3.28Å
587	D	94.7	Very high	93.3	Very high	97 Å²	97	41.5 Å²	41.5	52%	0.519	22%	0.223	S	C	.	.	H	α-helix	trans	-63.2	-49.9	174.8	-70	-27.5	0	0	0	110.8	C583 T584 H589 Q590	C583-D587 VanDerWaalsContact O-CG 3.27Å; C583-D587 PolarHBondContact O-N 2.86Å; T584-D587 PolarHBondContact O-N 3.46Å; D587-H589 PolarHBondContact O-N 3.22Å; D587-Q590 WeakPolarHBondContact O-CB 3.4Å; D587-Q590 WeakPolarHBondContact O-CG 3.4Å; D587-Q590 PolarHBondContact O-N 2.8Å
588	Y	94.9	Very high	93.4	Very high	34 Å²	34	45.5 Å²	45.5	13%	0.133	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-29.4	174.4	-86.3	-71.7	0	0	0	113	T479 E554 V555 D558 T584 Q590 D591 H592	T479-Y588 HydrophobicContact CG2-CD1 4.22Å; E554-Y588 HydrophobicContact CG-CE1 3.9Å; E554-Y588 WeakPolarHBondContact CG-OH 3.39Å; V555-Y588 HydrophobicContact CB-CD2 4.42Å; V555-Y588 HydrophobicContact CG1-CD2 4.37Å; V555-Y588 HydrophobicContact CG2-CD1 4.13Å; V555-Y588 HydrophobicContact CG2-CD2 3.86Å; V555-Y588 HydrophobicContact CG2-CE2 4.36Å; V555-Y588 HydrophobicContact CG2-CG 3.75Å; D558-Y588 HydrophobicContact CB-CE2 4.39Å; D558-Y588 PolarHBondContact OD2-OH 3.4Å; T584-Y588 HydrophobicContact CG2-CD2 3.84Å; T584-Y588 HydrophobicContact CG2-CE2 3.83Å; T584-Y588 VanDerWaalsContact O-CD2 3.29Å; T584-Y588 WeakPolarHBondContact O-CD2 3.42Å; T584-Y588 PolarHBondContact O-N 3.21Å; Y588-Q590 PolarHBondContact O-N 2.95Å; Y588-D591 PolarHBondContact O-N 2.69Å; Y588-H592 PolarHBondContact O-N 2.55Å; Y588-H592 PolarHBondContact O-ND1 2.85Å
589	H	94.2	Very high	93.4	Very high	28 Å²	28	45.7 Å²	45.7	13%	0.13	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-24	178.5	-177.7	76	0	0	0	112.9	I585 E586 D587 D591 H592 S593 L653	I585-H589 WeakPolarHBondContact O-CB 3.22Å; I585-H589 PolarHBondContact O-N 3.31Å; E586-H589 WeakPolarHBondContact O-CB 3.41Å; E586-H589 PolarHBondContact O-N 2.81Å; D587-H589 PolarHBondContact O-N 3.22Å; H589-D591 VanDerWaalsContact C-N 3.27Å; H589-D591 PolarHBondContact O-N 3.44Å; H589-H592 PolarHBondContact O-N 3.24Å; H589-S593 VanDerWaalsContact O-CB 3.23Å; H589-S593 WeakPolarHBondContact O-CB 3.48Å; H589-S593 PolarHBondContact O-N 3.2Å; H589-L653 HydrophobicContact CB-CD1 4.34Å; H589-L653 HydrophobicContact CB-CD2 4.03Å; H589-L653 PolarHBondContact CE1-O 3.07Å
590	Q	92.2	Very high	93.5	Very high	127 Å²	127	42.5 Å²	42.5	59%	0.593	23%	0.234	S	C	*	.	H	α-helix	trans	-56.3	-46.1	174.5	-61.6	179.6	23	0	0	110.6	D587 Y588 S593 H594	D587-Q590 WeakPolarHBondContact O-CB 3.4Å; D587-Q590 WeakPolarHBondContact O-CG 3.4Å; D587-Q590 PolarHBondContact O-N 2.8Å; Y588-Q590 PolarHBondContact O-N 2.95Å; Q590-S593 PolarHBondContact O-OG 3.13Å; Q590-H594 PolarHBondContact O-CD2 2.97Å; Q590-H594 VanDerWaalsContact O-CD2 3.31Å
591	D	93	Very high	93.3	Very high	34 Å²	34	42.1 Å²	42.1	18%	0.182	23%	0.23	C	C	.	.	H	α-helix	trans	-78.6	-41.2	175.5	-66.6	-44.6	0	0	0	112.3	T479 Q480 Y588 H589 S593 H594	T479-D591 HydrophobicContact CG2-CB 3.77Å; Q480-D591 HydrophobicContact CG-CB 4.49Å; Q480-D591 WeakPolarHBondContact CG-OD1 3.15Å; Q480-D591 VanDerWaalsContact NE2-CG 3.32Å; Q480-D591 PolarHBondContact NE2-OD1 3.19Å; Q480-D591 PolarHBondContact NE2-OD2 3.13Å; Y588-D591 PolarHBondContact O-N 2.69Å; H589-D591 VanDerWaalsContact C-N 3.27Å; H589-D591 PolarHBondContact O-N 3.44Å; D591-S593 PolarHBondContact O-N 3.34Å; D591-H594 WeakPolarHBondContact O-CB 3.25Å; D591-H594 PolarHBondContact O-CD2 3.3Å; D591-H594 PolarHBondContact O-N 2.98Å; D591-H594 VanDerWaalsContact O-N 3.14Å
592	H	94.7	Very high	93.1	Very high	3 Å²	3	43.3 Å²	43.3	1%	0.014	24%	0.236	C	C	.	.	H	α-helix	trans	-66.1	-23.1	179.9	-60.8	150.6	0	0	0	113.5	Y588 H589 H594 L595 L600 L603	Y588-H592 PolarHBondContact O-N 2.55Å; Y588-H592 PolarHBondContact O-ND1 2.85Å; H589-H592 PolarHBondContact O-N 3.24Å; H592-H594 PolarHBondContact O-N 3.32Å; H592-H594 VanDerWaalsContact O-N 3.09Å; H592-L595 HydrophobicContact CB-CD1 4.19Å; H592-L595 VanDerWaalsContact O-CB 3.25Å; H592-L595 WeakPolarHBondContact O-CB 3.45Å; H592-L595 WeakPolarHBondContact O-CG 3.2Å; H592-L595 PolarHBondContact O-N 2.85Å; H592-L600 HydrophobicContact CB-CD1 4.26Å; H592-L600 WeakPolarHBondContact O-CD1 3.39Å; H592-L603 HydrophobicContact CB-CD2 4.44Å
593	S	92.8	Very high	93.1	Very high	56 Å²	56	42.8 Å²	42.8	39%	0.392	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-19.8	174.9	73.1	0	0	0	0	112.8	H589 Q590 D591 L595	H589-S593 VanDerWaalsContact O-CB 3.23Å; H589-S593 WeakPolarHBondContact O-CB 3.48Å; H589-S593 PolarHBondContact O-N 3.2Å; Q590-S593 PolarHBondContact O-OG 3.13Å; D591-S593 PolarHBondContact O-N 3.34Å; S593-L595 VanDerWaalsContact C-N 3.31Å
594	H	93.8	Very high	93.1	Very high	45 Å²	45	40.2 Å²	40.2	21%	0.208	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	2.2	173.7	-61.6	-81.4	0	0	0	113.8	G423 A424 Y425 V483 N487 Q590 D591 H592	G423-H594 PolarHBondContact O-ND1 3.24Å; A424-H594 CarbonylContact C-O 3.56Å; A424-H594 WeakPolarHBondContact CA-O 3.4Å; A424-H594 WeakPolarHBondContact CB-O 3.37Å; Y425-H594 HydrophobicContact CD1-CB 4.21Å; Y425-H594 HydrophobicContact CD2-CB 3.31Å; Y425-H594 AromaticContact CD2-CG 3.79Å; Y425-H594 HydrophobicContact CE1-CB 4.32Å; Y425-H594 AromaticContact CE1-CG 3.83Å; Y425-H594 AromaticContact CE1-ND1 3.79Å; Y425-H594 HydrophobicContact CE2-CB 3.46Å; Y425-H594 VanDerWaalsContact CE2-CB 3.46Å; Y425-H594 AromaticContact CE2-CD2 3.39Å; Y425-H594 WeakPolarHBondContact CE2-CD2 3.28Å; Y425-H594 AromaticContact CE2-CG 3.43Å; Y425-H594 VanDerWaalsContact CE2-CG 3.43Å; Y425-H594 HydrophobicContact CG-CB 3.69Å; Y425-H594 AromaticContact CZ-CD2 3.29Å; Y425-H594 AromaticContact CZ-CE1 3.91Å; Y425-H594 AromaticContact CZ-CG 3.43Å; Y425-H594 VanDerWaalsContact CZ-CG 3.43Å; Y425-H594 AromaticContact CZ-ND1 3.8Å; Y425-H594 AromaticContact CZ-NE2 3.62Å; Y425-H594 PolarHBondContact N-O 2.97Å; Y425-H594 PolarHBondContact OH-CD2 3.01Å; Y425-H594 VanDerWaalsContact OH-CD2 3.23Å; Y425-H594 PolarHBondContact OH-NE2 2.85Å; V483-H594 HydrophobicContact CG1-CB 4.1Å; N487-H594 PolarHBondContact ND2-O 3.42Å; Q590-H594 PolarHBondContact O-CD2 2.97Å; Q590-H594 VanDerWaalsContact O-CD2 3.31Å; D591-H594 WeakPolarHBondContact O-CB 3.25Å; D591-H594 PolarHBondContact O-CD2 3.3Å; D591-H594 PolarHBondContact O-N 2.98Å; D591-H594 VanDerWaalsContact O-N 3.14Å; H592-H594 PolarHBondContact O-N 3.32Å; H592-H594 VanDerWaalsContact O-N 3.09Å
595	L	94.1	Very high	92.8	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.037	22%	0.215	C	C	.	.	S	Bend	trans	-72.1	150.4	168.4	-76.3	165.7	0	0	0	111	V483 A486 N487 L548 L551 H592 S593 L599 L600 L603	V483-L595 HydrophobicContact CB-CD2 4.23Å; V483-L595 HydrophobicContact CB-CG 4.42Å; V483-L595 HydrophobicContact CG1-CB 4.48Å; V483-L595 HydrophobicContact CG1-CD2 3.78Å; V483-L595 HydrophobicContact CG1-CG 3.78Å; V483-L595 HydrophobicContact CG2-CD2 4.22Å; V483-L595 HydrophobicContact CG2-CG 4.07Å; A486-L595 HydrophobicContact CB-CD2 3.96Å; N487-L595 WeakPolarHBondContact OD1-CA 3.06Å; L548-L595 HydrophobicContact CD1-CD1 4.21Å; L551-L595 HydrophobicContact CD1-CD1 4.26Å; L551-L595 HydrophobicContact CD1-CD2 4.19Å; H592-L595 HydrophobicContact CB-CD1 4.19Å; H592-L595 VanDerWaalsContact O-CB 3.25Å; H592-L595 WeakPolarHBondContact O-CB 3.45Å; H592-L595 WeakPolarHBondContact O-CG 3.2Å; H592-L595 PolarHBondContact O-N 2.85Å; S593-L595 VanDerWaalsContact C-N 3.31Å; L595-L599 HydrophobicContact CB-CB 4.29Å; L595-L599 HydrophobicContact CD2-CB 4.06Å; L595-L599 HydrophobicContact CD2-CD1 4.18Å; L595-L600 HydrophobicContact CB-CB 4.01Å; L595-L603 HydrophobicContact CD1-CB 4.43Å; L595-L603 HydrophobicContact CD1-CD1 3.81Å
596	K	91.6	Very high	92.6	Very high	38 Å²	38	41.9 Å²	41.9	17%	0.165	22%	0.222	C	C	.	.			trans	-58.6	146	166.6	-69.9	-65.8	-171	-172.1	0	109.9	D420 A424 N487 L490 T598 L599 L600	D420-K596 IonicContact OD2-NZ 2.77Å; D420-K596 PolarHBondContact OD2-NZ 3.2Å; A424-K596 HydrophobicContact CB-CD 4.09Å; N487-K596 HydrophobicContact CB-CG 4.41Å; N487-K596 PolarHBondContact OD1-N 2.78Å; L490-K596 HydrophobicContact CD2-CB 3.9Å; L490-K596 HydrophobicContact CD2-CG 4.22Å; K596-T598 PolarHBondContact O-N 3.42Å; K596-L599 PolarHBondContact O-N 2.94Å; K596-L600 PolarHBondContact O-N 3.44Å
597	P	89.6	Confident	92.6	Very high	90 Å²	90	38.6 Å²	38.6	58%	0.584	21%	0.207	S	C	*	.	H	α-helix	trans	-53.5	-37.2	-172.4	-29.8	35.2	0	0	0	114.9	N601	P597-N601 WeakPolarHBondContact O-CB 3.36Å; P597-N601 VanDerWaalsContact O-CG 3.26Å; P597-N601 PolarHBondContact O-N 3.42Å; P597-N601 PolarHBondContact O-ND2 3.02Å
598	T	89.6	Confident	92.6	Very high	91 Å²	91	34.1 Å²	34.1	56%	0.558	18%	0.183	S	C	*	.	H	α-helix	trans	-62.7	-42.3	177.5	49.5	0	0	0	0	112.5	L490 K596 D602	L490-T598 VanDerWaalsContact CD2-OG1 3.28Å; L490-T598 WeakPolarHBondContact CD2-OG1 3.47Å; K596-T598 PolarHBondContact O-N 3.42Å; T598-D602 PolarHBondContact O-N 3.31Å
599	L	92.7	Very high	92.4	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-75.2	-41.4	178.6	-63.2	174.4	0	0	0	111.6	A486 L490 S544 L548 L595 K596 N601 D602 L603	A486-L599 HydrophobicContact CB-CD1 4.01Å; A486-L599 WeakPolarHBondContact O-CD1 3.46Å; L490-L599 HydrophobicContact CB-CD1 4.13Å; L490-L599 HydrophobicContact CD2-CD1 3.95Å; L490-L599 HydrophobicContact CD2-CG 3.92Å; S544-L599 WeakPolarHBondContact OG-CD2 3.35Å; L548-L599 HydrophobicContact CD1-CB 4.11Å; L548-L599 HydrophobicContact CD2-CD2 4.45Å; L595-L599 HydrophobicContact CB-CB 4.29Å; L595-L599 HydrophobicContact CD2-CB 4.06Å; L595-L599 HydrophobicContact CD2-CD1 4.18Å; K596-L599 PolarHBondContact O-N 2.94Å; L599-N601 VanDerWaalsContact C-N 3.32Å; L599-N601 PolarHBondContact O-N 2.97Å; L599-D602 PolarHBondContact O-N 2.93Å; L599-L603 WeakPolarHBondContact O-CB 3.35Å; L599-L603 PolarHBondContact O-N 2.64Å
600	L	93.2	Very high	92.4	Very high	18 Å²	18	35.1 Å²	35.1	9%	0.094	19%	0.187	C	C	.	.	H	α-helix	trans	-58.2	-46.3	177.5	178.9	57.1	0	0	0	111.2	H592 L595 K596 D602 L603 L604	H592-L600 HydrophobicContact CB-CD1 4.26Å; H592-L600 WeakPolarHBondContact O-CD1 3.39Å; L595-L600 HydrophobicContact CB-CB 4.01Å; K596-L600 PolarHBondContact O-N 3.44Å; L600-D602 PolarHBondContact O-N 3.36Å; L600-L603 PolarHBondContact O-N 2.86Å; L600-L604 HydrophobicContact CD1-CD1 3.85Å; L600-L604 HydrophobicContact CD1-CG 4.01Å; L600-L604 HydrophobicContact CG-CD1 3.98Å; L600-L604 WeakPolarHBondContact O-CB 3.24Å; L600-L604 VanDerWaalsContact O-CG 3.32Å; L600-L604 WeakPolarHBondContact O-CG 3.46Å; L600-L604 PolarHBondContact O-N 3.21Å
601	N	89.6	Confident	92.5	Very high	43 Å²	43	29.1 Å²	29.1	23%	0.23	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-42.4	179	-74.7	-25.9	0	0	0	112.3	P597 L599 L605 F663	P597-N601 WeakPolarHBondContact O-CB 3.36Å; P597-N601 VanDerWaalsContact O-CG 3.26Å; P597-N601 PolarHBondContact O-N 3.42Å; P597-N601 PolarHBondContact O-ND2 3.02Å; L599-N601 VanDerWaalsContact C-N 3.32Å; L599-N601 PolarHBondContact O-N 2.97Å; N601-L605 VanDerWaalsContact O-CB 3.24Å; N601-L605 WeakPolarHBondContact O-CB 3.49Å; N601-L605 PolarHBondContact O-N 2.96Å; N601-F663 HydrophobicContact CB-CE1 4.26Å
602	D	90.2	Very high	92.5	Very high	24 Å²	24	27.6 Å²	27.6	13%	0.128	15%	0.15	C	C	.	.	H	α-helix	trans	-66.6	-40.7	177.8	-166	26	0	0	0	111.5	Q545 L548 T598 L599 L600 L605 Q606 R739	Q545-D602 PolarHBondContact NE2-OD2 3.2Å; L548-D602 HydrophobicContact CD2-CB 3.94Å; L548-D602 WeakPolarHBondContact CD2-OD2 3.37Å; T598-D602 PolarHBondContact O-N 3.31Å; L599-D602 PolarHBondContact O-N 2.93Å; L600-D602 PolarHBondContact O-N 3.36Å; D602-L605 PolarHBondContact O-N 3.27Å; D602-Q606 WeakPolarHBondContact O-CB 3.32Å; D602-Q606 VanDerWaalsContact O-CG 3.28Å; D602-Q606 WeakPolarHBondContact O-CG 3.46Å; D602-Q606 PolarHBondContact O-N 3.07Å; D602-Q606 PolarHBondContact OD1-NE2 3.16Å; D602-Q606 PolarHBondContact OD2-NE2 3.45Å; D602-R739 IonicContact OD1-CZ 3.58Å; D602-R739 IonicContact OD1-NH2 3.41Å; D602-R739 PolarHBondContact OD1-NH2 3.26Å
603	L	94.2	Very high	92.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59.6	-52	174.1	-179.8	144.3	0	0	0	111.7	L548 L551 I552 H592 L595 L599 L600 L605 Q606 L607	L548-L603 HydrophobicContact CD1-CB 3.86Å; L548-L603 HydrophobicContact CD1-CD1 4.03Å; L548-L603 HydrophobicContact CG-CB 4.36Å; L551-L603 HydrophobicContact CB-CD1 3.81Å; L551-L603 HydrophobicContact CD1-CD1 4.25Å; I552-L603 HydrophobicContact CG1-CD1 4.24Å; I552-L603 HydrophobicContact CG1-CG 3.95Å; H592-L603 HydrophobicContact CB-CD2 4.44Å; L595-L603 HydrophobicContact CD1-CB 4.43Å; L595-L603 HydrophobicContact CD1-CD1 3.81Å; L599-L603 WeakPolarHBondContact O-CB 3.35Å; L599-L603 PolarHBondContact O-N 2.64Å; L600-L603 PolarHBondContact O-N 2.86Å; L603-L605 VanDerWaalsContact C-N 3.33Å; L603-L605 PolarHBondContact O-N 3.47Å; L603-Q606 PolarHBondContact O-N 3.49Å; L603-L607 HydrophobicContact CD2-CD1 3.6Å; L603-L607 HydrophobicContact CD2-CG 4.4Å; L603-L607 HydrophobicContact CG-CD1 4.34Å; L603-L607 WeakPolarHBondContact O-CG 3.19Å; L603-L607 PolarHBondContact O-N 2.87Å
604	L	93.3	Very high	92.4	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-64.2	-39.1	-177.9	-70.6	175.5	0	0	0	111.6	L600 L607 E608 F650 L653 R654	L600-L604 HydrophobicContact CD1-CD1 3.85Å; L600-L604 HydrophobicContact CD1-CG 4.01Å; L600-L604 HydrophobicContact CG-CD1 3.98Å; L600-L604 WeakPolarHBondContact O-CB 3.24Å; L600-L604 VanDerWaalsContact O-CG 3.32Å; L600-L604 WeakPolarHBondContact O-CG 3.46Å; L600-L604 PolarHBondContact O-N 3.21Å; L604-L607 PolarHBondContact O-N 3.43Å; L604-E608 WeakPolarHBondContact O-CB 3.43Å; L604-E608 PolarHBondContact O-N 3.3Å; L604-F650 HydrophobicContact CB-CD1 4.14Å; L604-F650 HydrophobicContact CB-CE1 4.38Å; L604-F650 HydrophobicContact CD2-CD1 4.22Å; L604-F650 HydrophobicContact CD2-CE1 4.2Å; L604-F650 WeakPolarHBondContact O-CE1 3.49Å; L604-L653 HydrophobicContact CD1-CB 3.86Å; L604-L653 HydrophobicContact CD2-CB 4.06Å; L604-L653 HydrophobicContact CD2-CD1 3.95Å; L604-R654 HydrophobicContact CB-CG 4.36Å; L604-R654 HydrophobicContact CD1-CB 4.48Å; L604-R654 HydrophobicContact CD1-CG 3.61Å
605	L	90.3	Very high	92.4	Very high	33 Å²	33	24.1 Å²	24.1	17%	0.173	13%	0.128	C	C	.	.	H	α-helix	trans	-66.9	-40	176.5	-172.9	63.9	0	0	0	112.5	N601 D602 L603 E608 M609 L666 R739	N601-L605 VanDerWaalsContact O-CB 3.24Å; N601-L605 WeakPolarHBondContact O-CB 3.49Å; N601-L605 PolarHBondContact O-N 2.96Å; D602-L605 PolarHBondContact O-N 3.27Å; L603-L605 VanDerWaalsContact C-N 3.33Å; L603-L605 PolarHBondContact O-N 3.47Å; L605-E608 PolarHBondContact O-N 3.05Å; L605-M609 VanDerWaalsContact O-CB 3.29Å; L605-M609 WeakPolarHBondContact O-CB 3.46Å; L605-M609 PolarHBondContact O-N 3.35Å; L605-L666 HydrophobicContact CD1-CD1 3.84Å; L605-L666 HydrophobicContact CD1-CG 4.08Å; L605-R739 HydrophobicContact CD2-CB 3.94Å; L605-R739 HydrophobicContact CD2-CG 3.62Å
606	Q	91.8	Very high	92.3	Very high	35 Å²	35	24 Å²	24	16%	0.164	13%	0.128	C	C	.	.	H	α-helix	trans	-68.8	-35.9	176.4	-73.1	-177.1	54.5	0	0	112.4	I552 D602 L603 M609 R610	I552-Q606 HydrophobicContact CD1-CB 3.72Å; I552-Q606 HydrophobicContact CD1-CG 4.28Å; D602-Q606 WeakPolarHBondContact O-CB 3.32Å; D602-Q606 VanDerWaalsContact O-CG 3.28Å; D602-Q606 WeakPolarHBondContact O-CG 3.46Å; D602-Q606 PolarHBondContact O-N 3.07Å; D602-Q606 PolarHBondContact OD1-NE2 3.16Å; D602-Q606 PolarHBondContact OD2-NE2 3.45Å; L603-Q606 PolarHBondContact O-N 3.49Å; Q606-M609 HydrophobicContact CG-CE 4.44Å; Q606-R610 WeakPolarHBondContact O-CB 3.31Å; Q606-R610 PolarHBondContact O-N 3.17Å
607	L	94	Very high	92.3	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.01	13%	0.131	C	C	.	.	H	α-helix	trans	-64.6	-48.2	171.8	-71.8	176.1	0	0	0	111.6	I552 V555 I556 I585 L603 L604 M609 R610 I611 F650	I552-L607 HydrophobicContact CG2-CD2 4.09Å; V555-L607 HydrophobicContact CB-CD2 3.95Å; V555-L607 HydrophobicContact CG1-CD1 4.27Å; V555-L607 HydrophobicContact CG1-CD2 3.81Å; V555-L607 HydrophobicContact CG2-CD1 4.5Å; I556-L607 HydrophobicContact CG1-CD2 4.28Å; I585-L607 HydrophobicContact CG2-CD1 4.49Å; L603-L607 HydrophobicContact CD2-CD1 3.6Å; L603-L607 HydrophobicContact CD2-CG 4.4Å; L603-L607 HydrophobicContact CG-CD1 4.34Å; L603-L607 WeakPolarHBondContact O-CG 3.19Å; L603-L607 PolarHBondContact O-N 2.87Å; L604-L607 PolarHBondContact O-N 3.43Å; L607-M609 VanDerWaalsContact C-N 3.3Å; L607-M609 PolarHBondContact O-N 3Å; L607-R610 PolarHBondContact O-N 3.1Å; L607-R610 VanDerWaalsContact O-N 3.17Å; L607-I611 WeakPolarHBondContact O-CG1 3.38Å; L607-I611 PolarHBondContact O-N 3.12Å; L607-I611 VanDerWaalsContact O-N 3.08Å; L607-F650 HydrophobicContact CB-CE1 4.14Å; L607-F650 HydrophobicContact CB-CZ 4.17Å
608	E	93.8	Very high	92.3	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	10%	0.103	C	C	.	.	H	α-helix	trans	-56.3	-46.9	175.4	-169.8	-174.7	-176.9	0	0	110.6	L604 L605 R610 I611 V612 F650 R654 S665 L666	L604-E608 WeakPolarHBondContact O-CB 3.43Å; L604-E608 PolarHBondContact O-N 3.3Å; L605-E608 PolarHBondContact O-N 3.05Å; E608-R610 VanDerWaalsContact C-N 3.35Å; E608-R610 PolarHBondContact O-N 3.3Å; E608-I611 PolarHBondContact O-N 3.49Å; E608-V612 WeakPolarHBondContact O-CG2 3.42Å; E608-V612 PolarHBondContact O-N 3.39Å; E608-F650 HydrophobicContact CB-CD1 4.2Å; E608-F650 HydrophobicContact CB-CD2 3.88Å; E608-F650 HydrophobicContact CB-CE1 4Å; E608-F650 HydrophobicContact CB-CE2 3.67Å; E608-F650 HydrophobicContact CB-CG 4.15Å; E608-F650 HydrophobicContact CB-CZ 3.73Å; E608-F650 HydrophobicContact CG-CD2 3.7Å; E608-F650 HydrophobicContact CG-CE2 3.81Å; E608-F650 HydrophobicContact CG-CG 4.23Å; E608-F650 HydrophobicContact CG-CZ 4.39Å; E608-R654 IonicContact OE2-CZ 2.65Å; E608-R654 IonicContact OE2-NH1 3.87Å; E608-R654 IonicContact OE2-NH2 3.89Å; E608-R654 PolarHBondContact OE2-NH2 3.14Å; E608-S665 PolarHBondContact OE1-OG 2.99Å; E608-L666 HydrophobicContact CB-CD1 4.49Å; E608-L666 HydrophobicContact CG-CB 4.08Å; E608-L666 HydrophobicContact CG-CD1 4.46Å; E608-L666 HydrophobicContact CG-CG 4.48Å; E608-L666 PolarHBondContact OE1-N 3.35Å
609	M	92.4	Very high	92.4	Very high	25 Å²	25	16.2 Å²	16.2	12%	0.123	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-44.2	177.1	-177.5	167.1	64	0	0	111.9	L605 Q606 L607 I611 V612 Q613 L666 E742 V743	L605-M609 VanDerWaalsContact O-CB 3.29Å; L605-M609 WeakPolarHBondContact O-CB 3.46Å; L605-M609 PolarHBondContact O-N 3.35Å; Q606-M609 HydrophobicContact CG-CE 4.44Å; L607-M609 VanDerWaalsContact C-N 3.3Å; L607-M609 PolarHBondContact O-N 3Å; M609-I611 VanDerWaalsContact C-N 3.32Å; M609-I611 PolarHBondContact O-N 3.4Å; M609-V612 PolarHBondContact O-N 2.94Å; M609-Q613 HydrophobicContact CG-CG 4.38Å; M609-Q613 VanDerWaalsContact O-CB 3.3Å; M609-Q613 WeakPolarHBondContact O-CB 3.47Å; M609-Q613 VanDerWaalsContact O-CG 3.27Å; M609-Q613 WeakPolarHBondContact O-CG 3.49Å; M609-Q613 PolarHBondContact O-N 3.39Å; M609-L666 HydrophobicContact CB-CD1 3.56Å; M609-L666 HydrophobicContact CG-CD1 4.24Å; M609-E742 HydrophobicContact SD-CB 3.8Å; M609-V743 HydrophobicContact CG-CG2 4.15Å
610	R	92.9	Very high	92.1	Very high	59 Å²	59	18.9 Å²	18.9	22%	0.223	9%	0.091	C	C	.	.	H	α-helix	trans	-63.6	-38.4	-179.6	-177.3	66.7	-176	97.6	5.5	112.2	I556 Q606 L607 E608 E614	I556-R610 HydrophobicContact CD1-CB 4.27Å; I556-R610 HydrophobicContact CD1-CG 3.71Å; I556-R610 HydrophobicContact CG1-CG 4.07Å; Q606-R610 WeakPolarHBondContact O-CB 3.31Å; Q606-R610 PolarHBondContact O-N 3.17Å; L607-R610 PolarHBondContact O-N 3.1Å; L607-R610 VanDerWaalsContact O-N 3.17Å; E608-R610 VanDerWaalsContact C-N 3.35Å; E608-R610 PolarHBondContact O-N 3.3Å; R610-E614 IonicContact CZ-OE2 3.22Å; R610-E614 IonicContact NH1-OE2 2.62Å; R610-E614 PolarHBondContact NH1-OE2 3.29Å; R610-E614 IonicContact NH2-OE2 3.18Å; R610-E614 PolarHBondContact NH2-OE2 3.38Å; R610-E614 VanDerWaalsContact NH2-OE2 3.16Å; R610-E614 PolarHBondContact O-N 3.37Å; R610-E614 VanDerWaalsContact O-N 3.16Å
611	I	94.1	Very high	91.8	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-65	-51.7	176.8	-64.1	163.8	0	0	0	109.7	L563 I581 I585 L607 E608 M609 Q613 E614 Y615 L646 F650	L563-I611 HydrophobicContact CD2-CG1 4.34Å; I581-I611 HydrophobicContact CG2-CD1 4.11Å; I581-I611 HydrophobicContact CG2-CG1 4.44Å; I585-I611 HydrophobicContact CD1-CD1 3.6Å; L607-I611 WeakPolarHBondContact O-CG1 3.38Å; L607-I611 PolarHBondContact O-N 3.12Å; L607-I611 VanDerWaalsContact O-N 3.08Å; E608-I611 PolarHBondContact O-N 3.49Å; M609-I611 VanDerWaalsContact C-N 3.32Å; M609-I611 PolarHBondContact O-N 3.4Å; I611-Q613 VanDerWaalsContact C-N 3.31Å; I611-Q613 PolarHBondContact O-N 3.19Å; I611-E614 WeakPolarHBondContact O-CB 3.3Å; I611-E614 PolarHBondContact O-N 2.87Å; I611-Y615 HydrophobicContact CG2-CD2 4.43Å; I611-Y615 HydrophobicContact CG2-CE2 3.97Å; I611-Y615 WeakPolarHBondContact O-CD2 3.31Å; I611-Y615 PolarHBondContact O-N 3.43Å; I611-L646 HydrophobicContact CD1-CD2 3.99Å; I611-L646 HydrophobicContact CG2-CD1 3.83Å; I611-L646 HydrophobicContact CG2-CD2 4.16Å; I611-F650 HydrophobicContact CD1-CE2 3.93Å; I611-F650 HydrophobicContact CD1-CZ 3.89Å
612	V	93.6	Very high	91.6	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-40.7	179.4	176.8	0	0	0	0	111.5	E608 M609 E614 Y615 L616 L666 V669 V743	E608-V612 WeakPolarHBondContact O-CG2 3.42Å; E608-V612 PolarHBondContact O-N 3.39Å; M609-V612 PolarHBondContact O-N 2.94Å; V612-E614 PolarHBondContact O-N 2.85Å; V612-Y615 PolarHBondContact O-N 3.43Å; V612-L616 PolarHBondContact O-N 3.46Å; V612-L666 HydrophobicContact CG2-CB 4.15Å; V612-V669 HydrophobicContact CG1-CB 3.75Å; V612-V669 HydrophobicContact CG1-CG1 3.88Å; V612-V669 HydrophobicContact CG1-CG2 4.15Å; V612-V743 HydrophobicContact CB-CG1 4.28Å; V612-V743 HydrophobicContact CG1-CG1 3.6Å
613	Q	92.9	Very high	91.4	Very high	21 Å²	21	27.3 Å²	27.3	10%	0.098	13%	0.127	C	C	.	.	H	α-helix	trans	-57.6	-34.1	172.7	-83.2	179.3	-11	0	0	112.7	M609 I611 L616 K617 E742 V743 F746	M609-Q613 HydrophobicContact CG-CG 4.38Å; M609-Q613 VanDerWaalsContact O-CB 3.3Å; M609-Q613 WeakPolarHBondContact O-CB 3.47Å; M609-Q613 VanDerWaalsContact O-CG 3.27Å; M609-Q613 WeakPolarHBondContact O-CG 3.49Å; M609-Q613 PolarHBondContact O-N 3.39Å; I611-Q613 VanDerWaalsContact C-N 3.31Å; I611-Q613 PolarHBondContact O-N 3.19Å; Q613-L616 PolarHBondContact O-N 2.73Å; Q613-K617 WeakPolarHBondContact O-CB 3.36Å; Q613-K617 VanDerWaalsContact O-CG 3.29Å; Q613-K617 WeakPolarHBondContact O-CG 3.25Å; Q613-K617 PolarHBondContact O-N 3.24Å; Q613-E742 PolarHBondContact NE2-O 3.43Å; Q613-V743 HydrophobicContact CG-CG1 4.41Å; Q613-V743 WeakPolarHBondContact CG-O 3.36Å; Q613-F746 HydrophobicContact CB-CD1 4.43Å; Q613-F746 HydrophobicContact CG-CD1 4.07Å
614	E	93.3	Very high	90.8	Very high	11 Å²	11	28.2 Å²	28.2	5%	0.051	13%	0.132	C	C	.	.	H	α-helix	trans	-69.7	-37	178.6	-163.4	66.6	-152.4	0	0	112.5	L563 R610 I611 V612 K617 A618 R623	L563-E614 HydrophobicContact CB-CG 3.92Å; L563-E614 HydrophobicContact CD2-CB 3.99Å; L563-E614 HydrophobicContact CD2-CG 4.11Å; L563-E614 HydrophobicContact CG-CG 4.5Å; L563-E614 WeakPolarHBondContact O-CG 3.37Å; R610-E614 IonicContact CZ-OE2 3.22Å; R610-E614 IonicContact NH1-OE2 2.62Å; R610-E614 PolarHBondContact NH1-OE2 3.29Å; R610-E614 IonicContact NH2-OE2 3.18Å; R610-E614 PolarHBondContact NH2-OE2 3.38Å; R610-E614 VanDerWaalsContact NH2-OE2 3.16Å; R610-E614 PolarHBondContact O-N 3.37Å; R610-E614 VanDerWaalsContact O-N 3.16Å; I611-E614 WeakPolarHBondContact O-CB 3.3Å; I611-E614 PolarHBondContact O-N 2.87Å; V612-E614 PolarHBondContact O-N 2.85Å; E614-K617 PolarHBondContact O-N 3.49Å; E614-A618 WeakPolarHBondContact O-CB 3.39Å; E614-A618 PolarHBondContact O-N 3.09Å; E614-R623 IonicContact OE1-CZ 3.29Å; E614-R623 VanDerWaalsContact OE1-CZ 3.28Å; E614-R623 IonicContact OE1-NH1 3.92Å; E614-R623 PolarHBondContact OE1-NH1 3.2Å; E614-R623 IonicContact OE1-NH2 3.26Å; E614-R623 PolarHBondContact OE1-NH2 3.5Å
615	Y	92.3	Very high	90.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.3	-47.1	171	-76.5	-96.6	0	0	0	111	I566 L567 I611 V612 K617 A618 F619 E642 L670	I566-Y615 HydrophobicContact CD1-CD2 4.37Å; I566-Y615 HydrophobicContact CD1-CE2 3.86Å; I566-Y615 HydrophobicContact CG2-CD1 3.51Å; I566-Y615 HydrophobicContact CG2-CD2 4.11Å; I566-Y615 HydrophobicContact CG2-CE1 3.44Å; I566-Y615 VanDerWaalsContact CG2-CE1 3.44Å; I566-Y615 HydrophobicContact CG2-CE2 4.06Å; I566-Y615 HydrophobicContact CG2-CG 3.85Å; L567-Y615 HydrophobicContact CD1-CD1 3.98Å; L567-Y615 WeakPolarHBondContact CD1-O 3.17Å; L567-Y615 HydrophobicContact CG-CD1 4.34Å; I611-Y615 HydrophobicContact CG2-CD2 4.43Å; I611-Y615 HydrophobicContact CG2-CE2 3.97Å; I611-Y615 WeakPolarHBondContact O-CD2 3.31Å; I611-Y615 PolarHBondContact O-N 3.43Å; V612-Y615 PolarHBondContact O-N 3.43Å; Y615-K617 PolarHBondContact O-N 2.98Å; Y615-A618 PolarHBondContact O-N 3.19Å; Y615-F619 VanDerWaalsContact O-CD2 3.27Å; Y615-F619 WeakPolarHBondContact O-CD2 3.38Å; Y615-F619 PolarHBondContact O-N 2.9Å; Y615-F619 VanDerWaalsContact O-N 3.12Å; Y615-E642 PolarHBondContact OH-OE2 2.89Å; Y615-L670 HydrophobicContact CD1-CD2 3.8Å; Y615-L670 HydrophobicContact CD2-CD1 4.23Å; Y615-L670 HydrophobicContact CD2-CD2 3.68Å; Y615-L670 HydrophobicContact CE1-CD2 4.38Å; Y615-L670 HydrophobicContact CE2-CD1 4.05Å; Y615-L670 HydrophobicContact CE2-CD2 4.27Å; Y615-L670 HydrophobicContact CG-CD2 3.41Å; Y615-L670 VanDerWaalsContact CG-CD2 3.41Å
616	L	91.8	Very high	90	Very high	5 Å²	5	28.5 Å²	28.5	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-42.2	178.2	-67.8	172.4	0	0	0	112.1	V612 Q613 A618 F619 D620 V669 L673 I707 V743 F744 F746	V612-L616 PolarHBondContact O-N 3.46Å; Q613-L616 PolarHBondContact O-N 2.73Å; L616-A618 VanDerWaalsContact C-N 3.29Å; L616-A618 PolarHBondContact O-N 3.18Å; L616-F619 PolarHBondContact O-N 3.35Å; L616-D620 WeakPolarHBondContact O-CB 3.42Å; L616-D620 PolarHBondContact O-N 3.16Å; L616-V669 HydrophobicContact CD1-CG1 4.26Å; L616-V669 HydrophobicContact CD2-CG1 4.14Å; L616-V669 HydrophobicContact CG-CG1 4.4Å; L616-L673 HydrophobicContact CD2-CD1 3.83Å; L616-L673 HydrophobicContact CD2-CD2 4.22Å; L616-I707 HydrophobicContact CD2-CD1 4.21Å; L616-V743 HydrophobicContact CD1-CG1 3.71Å; L616-F744 HydrophobicContact CD1-CD1 3.82Å; L616-F744 HydrophobicContact CD1-CE1 3.63Å; L616-F744 HydrophobicContact CD1-CZ 4.32Å; L616-F744 HydrophobicContact CD2-CE1 4.07Å; L616-F746 HydrophobicContact CB-CE1 3.51Å; L616-F746 HydrophobicContact CB-CZ 3.6Å; L616-F746 HydrophobicContact CD1-CE1 3.96Å; L616-F746 HydrophobicContact CG-CE1 4.4Å
617	K	91.7	Very high	89.6	Confident	52 Å²	52	35.9 Å²	35.9	23%	0.226	17%	0.166	C	C	.	.	H	α-helix	trans	-60.1	-38.9	173.3	-79	176.9	-176.9	179.3	0	112.1	Q613 E614 Y615 D620 S621 F746	Q613-K617 WeakPolarHBondContact O-CB 3.36Å; Q613-K617 VanDerWaalsContact O-CG 3.29Å; Q613-K617 WeakPolarHBondContact O-CG 3.25Å; Q613-K617 PolarHBondContact O-N 3.24Å; E614-K617 PolarHBondContact O-N 3.49Å; Y615-K617 PolarHBondContact O-N 2.98Å; K617-D620 PolarHBondContact O-N 3.06Å; K617-S621 VanDerWaalsContact O-CB 3.31Å; K617-S621 WeakPolarHBondContact O-CB 3.49Å; K617-S621 PolarHBondContact O-N 3.08Å; K617-S621 PolarHBondContact O-OG 3.4Å; K617-F746 HydrophobicContact CB-CE2 4.3Å; K617-F746 HydrophobicContact CD-CD2 4.09Å; K617-F746 HydrophobicContact CD-CG 4.47Å; K617-F746 HydrophobicContact CG-CD2 3.31Å; K617-F746 HydrophobicContact CG-CE2 3.43Å; K617-F746 VanDerWaalsContact CG-CE2 3.43Å; K617-F746 HydrophobicContact CG-CG 3.96Å; K617-F746 HydrophobicContact CG-CZ 4.13Å
618	A	91.1	Very high	89.2	Confident	1 Å²	1	39 Å²	39	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-67.9	-35.8	179.6	0	0	0	0	0	112.3	L567 E614 Y615 L616 R622 R623	L567-A618 HydrophobicContact CB-CB 3.71Å; L567-A618 HydrophobicContact CD1-CB 3.83Å; L567-A618 HydrophobicContact CG-CB 4.38Å; E614-A618 WeakPolarHBondContact O-CB 3.39Å; E614-A618 PolarHBondContact O-N 3.09Å; Y615-A618 PolarHBondContact O-N 3.19Å; L616-A618 VanDerWaalsContact C-N 3.29Å; L616-A618 PolarHBondContact O-N 3.18Å; A618-R622 PolarHBondContact O-N 2.95Å; A618-R622 VanDerWaalsContact O-N 3.09Å; A618-R623 HydrophobicContact CB-CB 4.32Å; A618-R623 HydrophobicContact CB-CG 4.16Å; A618-R623 PolarHBondContact O-N 2.95Å
619	F	90.1	Very high	88.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.009	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-47.6	169.4	-79.3	-67.1	0	0	0	112.6	L567 Y615 L616 S621 R622 F626 M639 L673 M677 I707 A710	L567-F619 HydrophobicContact CD1-CD2 3.62Å; L567-F619 HydrophobicContact CD1-CE1 4.4Å; L567-F619 HydrophobicContact CD1-CE2 3.39Å; L567-F619 HydrophobicContact CD1-CG 4.22Å; L567-F619 HydrophobicContact CD1-CZ 3.82Å; L567-F619 HydrophobicContact CD2-CE2 4.39Å; L567-F619 HydrophobicContact CD2-CZ 4.03Å; Y615-F619 VanDerWaalsContact O-CD2 3.27Å; Y615-F619 WeakPolarHBondContact O-CD2 3.38Å; Y615-F619 PolarHBondContact O-N 2.9Å; Y615-F619 VanDerWaalsContact O-N 3.12Å; L616-F619 PolarHBondContact O-N 3.35Å; F619-S621 VanDerWaalsContact C-N 3.33Å; F619-S621 PolarHBondContact O-N 3.41Å; F619-R622 PolarHBondContact O-N 2.96Å; F619-R622 VanDerWaalsContact O-N 3.1Å; F619-F626 HydrophobicContact CE1-CE2 4.16Å; F619-M639 HydrophobicContact CE2-CE 3.9Å; F619-M639 HydrophobicContact CE2-SD 4.2Å; F619-M639 HydrophobicContact CZ-CE 4.18Å; F619-M639 HydrophobicContact CZ-SD 3.92Å; F619-L673 HydrophobicContact CD2-CD1 4.22Å; F619-L673 HydrophobicContact CE2-CD1 3.96Å; F619-L673 HydrophobicContact CE2-CD2 4.44Å; F619-M677 HydrophobicContact CE1-CE 4.47Å; F619-M677 HydrophobicContact CE1-SD 4.18Å; F619-M677 HydrophobicContact CZ-CG 4.42Å; F619-I707 HydrophobicContact CB-CG1 3.69Å; F619-I707 HydrophobicContact CD1-CG1 4.48Å; F619-I707 HydrophobicContact CD2-CG1 4.35Å; F619-I707 HydrophobicContact CG-CG1 3.95Å; F619-A710 HydrophobicContact CD1-CB 3.71Å; F619-A710 HydrophobicContact CE1-CB 3.82Å
620	D	87.4	Confident	88.5	Confident	60 Å²	60	46.8 Å²	46.8	32%	0.321	22%	0.22	S	C	.	.	H	α-helix	trans	-61.3	-41.3	-179.3	-169.4	45.1	0	0	0	111.8	L616 K617 R622 Q703 F746	L616-D620 WeakPolarHBondContact O-CB 3.42Å; L616-D620 PolarHBondContact O-N 3.16Å; K617-D620 PolarHBondContact O-N 3.06Å; D620-R622 VanDerWaalsContact C-N 3.33Å; D620-R622 PolarHBondContact O-N 3.28Å; D620-Q703 WeakPolarHBondContact OD1-CA 3.48Å; D620-F746 HydrophobicContact CB-CE2 4.49Å
621	S	86.9	Confident	88.2	Confident	68 Å²	68	46.6 Å²	46.6	48%	0.476	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.8	176	61.3	0	0	0	0	114.9	K617 F619 R623	K617-S621 VanDerWaalsContact O-CB 3.31Å; K617-S621 WeakPolarHBondContact O-CB 3.49Å; K617-S621 PolarHBondContact O-N 3.08Å; K617-S621 PolarHBondContact O-OG 3.4Å; F619-S621 VanDerWaalsContact C-N 3.33Å; F619-S621 PolarHBondContact O-N 3.41Å; S621-R623 PolarHBondContact O-N 3.17Å; S621-R623 WeakPolarHBondContact OG-CG 3.24Å
622	R	84.7	Confident	87.9	Confident	112 Å²	112	47 Å²	47	42%	0.423	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	48.2	179.2	-52.4	-178.7	-168.9	-148.3	-6.8	114.1	A618 F619 D620 V624	A618-R622 PolarHBondContact O-N 2.95Å; A618-R622 VanDerWaalsContact O-N 3.09Å; F619-R622 PolarHBondContact O-N 2.96Å; F619-R622 VanDerWaalsContact O-N 3.1Å; D620-R622 VanDerWaalsContact C-N 3.33Å; D620-R622 PolarHBondContact O-N 3.28Å; R622-V624 PolarHBondContact O-N 2.97Å
623	R	86.6	Confident	87.7	Confident	83 Å²	83	51.5 Å²	51.5	31%	0.313	24%	0.242	S	C	.	.	S	Bend	trans	-62.8	-23.5	176.2	-65.3	-172.6	-167.7	164.8	1	113.2	L563 L567 T568 E614 A618 S621	L563-R623 PolarHBondContact O-NH1 3.06Å; L567-R623 CarbonylContact O-C 3.23Å; L567-R623 VanDerWaalsContact O-C 3.23Å; L567-R623 WeakPolarHBondContact O-CB 3.4Å; T568-R623 HydrophobicContact CG2-CB 4.24Å; E614-R623 IonicContact OE1-CZ 3.29Å; E614-R623 VanDerWaalsContact OE1-CZ 3.28Å; E614-R623 IonicContact OE1-NH1 3.92Å; E614-R623 PolarHBondContact OE1-NH1 3.2Å; E614-R623 IonicContact OE1-NH2 3.26Å; E614-R623 PolarHBondContact OE1-NH2 3.5Å; A618-R623 HydrophobicContact CB-CB 4.32Å; A618-R623 HydrophobicContact CB-CG 4.16Å; A618-R623 PolarHBondContact O-N 2.95Å; S621-R623 PolarHBondContact O-N 3.17Å; S621-R623 WeakPolarHBondContact OG-CG 3.24Å
624	V	80.9	Confident	87.5	Confident	18 Å²	18	53.8 Å²	53.8	11%	0.109	26%	0.258	C	S	.	.			trans	-136.1	148.9	173.9	68.6	0	0	0	0	110.6	L567 L572 R622 F626	L567-V624 HydrophobicContact CB-CG1 4.07Å; L567-V624 HydrophobicContact CD2-CG1 4.06Å; L567-V624 VanDerWaalsContact O-CB 3.26Å; L567-V624 WeakPolarHBondContact O-CB 3.13Å; L567-V624 PolarHBondContact O-N 3.37Å; L572-V624 HydrophobicContact CD1-CG2 4.13Å; R622-V624 PolarHBondContact O-N 2.97Å; V624-F626 HydrophobicContact CB-CE1 4.36Å; V624-F626 HydrophobicContact CG1-CE1 3.76Å; V624-F626 HydrophobicContact CG1-CE2 4.05Å; V624-F626 HydrophobicContact CG1-CZ 3.5Å; V624-F626 VanDerWaalsContact CG1-CZ 3.5Å; V624-F626 HydrophobicContact CG2-CD1 3.89Å; V624-F626 HydrophobicContact CG2-CE1 3.62Å; V624-F626 HydrophobicContact CG2-CZ 4.26Å
625	A	83.1	Confident	87.3	Confident	40 Å²	40	53.3 Å²	53.3	33%	0.331	26%	0.255	S	S	.	.			trans	-131.8	119	167.9	0	0	0	0	0	107.2	R627 E712	A625-R627 PolarHBondContact O-N 3.25Å; A625-E712 HydrophobicContact CB-CG 3.76Å; A625-E712 VanDerWaalsContact CB-OE1 3.24Å; A625-E712 WeakPolarHBondContact CB-OE1 3.48Å
626	F	85.5	Confident	87.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.			trans	-85.3	104.8	-174.6	-55.3	-62.9	0	0	0	109.4	L567 L572 F619 V624 N628 E631 R632 A635 M677 A710 R711	L567-F626 HydrophobicContact CD2-CZ 4.07Å; L572-F626 HydrophobicContact CD1-CE1 4.37Å; L572-F626 HydrophobicContact CD2-CE1 4.25Å; F619-F626 HydrophobicContact CE1-CE2 4.16Å; V624-F626 HydrophobicContact CB-CE1 4.36Å; V624-F626 HydrophobicContact CG1-CE1 3.76Å; V624-F626 HydrophobicContact CG1-CE2 4.05Å; V624-F626 HydrophobicContact CG1-CZ 3.5Å; V624-F626 VanDerWaalsContact CG1-CZ 3.5Å; V624-F626 HydrophobicContact CG2-CD1 3.89Å; V624-F626 HydrophobicContact CG2-CE1 3.62Å; V624-F626 HydrophobicContact CG2-CZ 4.26Å; F626-N628 PolarHBondContact O-N 3.03Å; F626-E631 WeakPolarHBondContact CA-OE2 3.2Å; F626-E631 HydrophobicContact CB-CB 4.17Å; F626-E631 HydrophobicContact CD1-CB 4.21Å; F626-R632 HydrophobicContact CB-CB 4.47Å; F626-R632 HydrophobicContact CB-CG 3.4Å; F626-R632 VanDerWaalsContact CB-CG 3.4Å; F626-R632 HydrophobicContact CD2-CG 4.06Å; F626-R632 HydrophobicContact CG-CG 3.91Å; F626-A635 HydrophobicContact CD1-CB 4.12Å; F626-A635 HydrophobicContact CE1-CB 3.37Å; F626-A635 HydrophobicContact CE2-CB 4.23Å; F626-A635 HydrophobicContact CZ-CB 3.43Å; F626-A635 VanDerWaalsContact CZ-CB 3.43Å; F626-M677 HydrophobicContact CD2-SD 4.06Å; F626-M677 HydrophobicContact CE2-CG 4.45Å; F626-M677 HydrophobicContact CE2-SD 3.92Å; F626-A710 WeakPolarHBondContact CB-O 3.47Å; F626-A710 HydrophobicContact CD2-CB 4.27Å; F626-A710 VanDerWaalsContact CD2-O 3.23Å; F626-A710 WeakPolarHBondContact CD2-O 3.39Å; F626-A710 HydrophobicContact CE2-CB 4.28Å; F626-A710 PolarHBondContact N-O 3.19Å; F626-R711 CarbonylContact O-C 3.49Å
627	R	83.1	Confident	87.1	Confident	190 Å²	190	59.3 Å²	59.3	72%	0.717	29%	0.285	S	S	*	.			trans	-71.4	-21.6	-168.6	-61.8	177	176	175.3	1.2	113.7	A625 E631 E712	A625-R627 PolarHBondContact O-N 3.25Å; R627-E631 PolarHBondContact N-OE2 3.42Å; R627-E712 WeakPolarHBondContact CA-OE2 3.36Å; R627-E712 WeakPolarHBondContact CG-OE2 3.25Å
628	N	84.3	Confident	87	Confident	68 Å²	68	57.9 Å²	57.9	36%	0.364	28%	0.278	S	S	.	.	S	Bend	trans	-149.8	167.3	-175.7	59.7	66.5	0	0	0	110.6	F626 N630 E631 R632	F626-N628 PolarHBondContact O-N 3.03Å; N628-N630 VanDerWaalsContact C-N 3.26Å; N628-N630 PolarHBondContact O-N 3.26Å; N628-N630 WeakPolarHBondContact OD1-CA 3.38Å; N628-N630 WeakPolarHBondContact OD1-CB 3.49Å; N628-N630 PolarHBondContact OD1-N 2.88Å; N628-E631 PolarHBondContact ND2-OE1 3.06Å; N628-E631 PolarHBondContact O-N 3.09Å; N628-E631 PolarHBondContact OD1-N 3.01Å; N628-R632 PolarHBondContact O-N 3.12Å
629	Y	86.2	Confident	87.1	Confident	74 Å²	74	57.8 Å²	57.8	29%	0.29	28%	0.278	S	S	.	.	H	α-helix	trans	-60.9	-33.2	179.6	178.1	-104.1	0	0	0	113.4	R632 K633 S678 Q680	Y629-R632 PolarHBondContact O-N 2.99Å; Y629-K633 HydrophobicContact CE1-CB 4.26Å; Y629-K633 HydrophobicContact CE1-CD 4.24Å; Y629-K633 WeakPolarHBondContact O-CB 3.32Å; Y629-K633 PolarHBondContact O-N 3.39Å; Y629-S678 WeakPolarHBondContact CE2-O 3.3Å; Y629-Q680 HydrophobicContact CD2-CG 3.72Å; Y629-Q680 HydrophobicContact CE1-CG 4.03Å; Y629-Q680 VanDerWaalsContact CE1-NE2 3.34Å; Y629-Q680 HydrophobicContact CE2-CB 4.28Å; Y629-Q680 HydrophobicContact CE2-CG 3.13Å; Y629-Q680 HydrophobicContact CG-CG 4.37Å; Y629-Q680 PolarHBondContact OH-NE2 2.92Å
630	N	86	Confident	87.1	Confident	117 Å²	117	62.1 Å²	62.1	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-65.9	-42.9	179.9	-68.6	-27.1	0	0	0	111.2	N628 R632 K633 V634	N628-N630 VanDerWaalsContact C-N 3.26Å; N628-N630 PolarHBondContact O-N 3.26Å; N628-N630 WeakPolarHBondContact OD1-CA 3.38Å; N628-N630 WeakPolarHBondContact OD1-CB 3.49Å; N628-N630 PolarHBondContact OD1-N 2.88Å; N630-R632 VanDerWaalsContact C-N 3.34Å; N630-R632 PolarHBondContact O-N 3.34Å; N630-K633 PolarHBondContact O-N 2.97Å; N630-V634 WeakPolarHBondContact O-CG2 3.37Å; N630-V634 PolarHBondContact O-N 3.24Å
631	E	87.1	Confident	87.3	Confident	55 Å²	55	62.1 Å²	62.1	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-60.7	-43	174.1	-73.6	172.8	-152.6	0	0	111.5	F626 R627 N628 K633 V634 A635	F626-E631 WeakPolarHBondContact CA-OE2 3.2Å; F626-E631 HydrophobicContact CB-CB 4.17Å; F626-E631 HydrophobicContact CD1-CB 4.21Å; R627-E631 PolarHBondContact N-OE2 3.42Å; N628-E631 PolarHBondContact ND2-OE1 3.06Å; N628-E631 PolarHBondContact O-N 3.09Å; N628-E631 PolarHBondContact OD1-N 3.01Å; E631-K633 PolarHBondContact O-N 3.2Å; E631-V634 PolarHBondContact O-N 2.79Å; E631-A635 WeakPolarHBondContact O-CB 3.47Å; E631-A635 PolarHBondContact O-N 3.34Å
632	R	88.6	Confident	87.6	Confident	10 Å²	10	59.2 Å²	59.2	4%	0.038	28%	0.281	C	S	.	.	H	α-helix	trans	-62.4	-41.9	174.4	-67.4	-162.3	-51.2	-137.9	8.4	112.5	F626 N628 Y629 N630 A635 T636 M677 S679 R711 D713	F626-R632 HydrophobicContact CB-CB 4.47Å; F626-R632 HydrophobicContact CB-CG 3.4Å; F626-R632 VanDerWaalsContact CB-CG 3.4Å; F626-R632 HydrophobicContact CD2-CG 4.06Å; F626-R632 HydrophobicContact CG-CG 3.91Å; N628-R632 PolarHBondContact O-N 3.12Å; Y629-R632 PolarHBondContact O-N 2.99Å; N630-R632 VanDerWaalsContact C-N 3.34Å; N630-R632 PolarHBondContact O-N 3.34Å; R632-A635 PolarHBondContact O-N 3.45Å; R632-T636 VanDerWaalsContact O-CB 3.28Å; R632-T636 WeakPolarHBondContact O-CB 3.42Å; R632-T636 PolarHBondContact O-N 3.06Å; R632-T636 PolarHBondContact O-OG1 2.93Å; R632-M677 WeakPolarHBondContact CD-O 3.33Å; R632-M677 PolarHBondContact NE-O 3.07Å; R632-S679 PolarHBondContact NH2-O 3.29Å; R632-S679 VanDerWaalsContact NH2-O 3.12Å; R632-R711 VanDerWaalsContact CZ-CZ 3.43Å; R632-R711 VanDerWaalsContact NH1-CZ 3.33Å; R632-R711 VanDerWaalsContact NH1-NH2 3.15Å; R632-R711 PolarHBondContact NH1-O 3.25Å; R632-D713 IonicContact CZ-OD2 3.61Å; R632-D713 IonicContact NH1-OD1 3.19Å; R632-D713 PolarHBondContact NH1-OD1 2.64Å; R632-D713 IonicContact NH1-OD2 3.76Å; R632-D713 PolarHBondContact NH1-OD2 3.15Å; R632-D713 IonicContact NH2-OD2 2.72Å
633	K	88.4	Confident	88	Confident	94 Å²	94	53.9 Å²	53.9	41%	0.409	26%	0.261	S	S	.	.	H	α-helix	trans	-63	-46.7	179.4	-175.3	-176	170.4	-172.4	0	110.8	Y629 N630 E631 A635 T636 E637	Y629-K633 HydrophobicContact CE1-CB 4.26Å; Y629-K633 HydrophobicContact CE1-CD 4.24Å; Y629-K633 WeakPolarHBondContact O-CB 3.32Å; Y629-K633 PolarHBondContact O-N 3.39Å; N630-K633 PolarHBondContact O-N 2.97Å; E631-K633 PolarHBondContact O-N 3.2Å; K633-A635 VanDerWaalsContact C-N 3.35Å; K633-A635 PolarHBondContact O-N 3.37Å; K633-T636 WeakPolarHBondContact O-CB 3.28Å; K633-T636 PolarHBondContact O-N 3.31Å; K633-E637 WeakPolarHBondContact CE-OE1 3.32Å; K633-E637 IonicContact NZ-OE1 3.78Å; K633-E637 WeakPolarHBondContact O-CG 3.35Å; K633-E637 PolarHBondContact O-N 2.67Å
634	V	88.3	Confident	88.2	Confident	70 Å²	70	53.4 Å²	53.4	42%	0.424	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-45.3	175.5	172.8	0	0	0	0	110.6	L572 N630 E631 T636 R638	L572-V634 HydrophobicContact CD2-CG1 4.37Å; N630-V634 WeakPolarHBondContact O-CG2 3.37Å; N630-V634 PolarHBondContact O-N 3.24Å; E631-V634 PolarHBondContact O-N 2.79Å; V634-T636 VanDerWaalsContact C-N 3.33Å; V634-T636 PolarHBondContact O-N 2.78Å; V634-R638 WeakPolarHBondContact O-CB 3.43Å; V634-R638 PolarHBondContact O-N 3.23Å
635	A	89.4	Confident	88.8	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-38.9	176.5	0	0	0	0	0	112.8	W571 L572 F626 E631 R632 K633 R638 M639	W571-A635 HydrophobicContact CH2-CB 4.12Å; W571-A635 HydrophobicContact CZ3-CB 3.99Å; L572-A635 HydrophobicContact CD2-CB 4.04Å; F626-A635 HydrophobicContact CD1-CB 4.12Å; F626-A635 HydrophobicContact CE1-CB 3.37Å; F626-A635 HydrophobicContact CE2-CB 4.23Å; F626-A635 HydrophobicContact CZ-CB 3.43Å; F626-A635 VanDerWaalsContact CZ-CB 3.43Å; E631-A635 WeakPolarHBondContact O-CB 3.47Å; E631-A635 PolarHBondContact O-N 3.34Å; R632-A635 PolarHBondContact O-N 3.45Å; K633-A635 VanDerWaalsContact C-N 3.35Å; K633-A635 PolarHBondContact O-N 3.37Å; A635-R638 PolarHBondContact O-N 2.92Å; A635-M639 WeakPolarHBondContact O-CB 3.5Å; A635-M639 VanDerWaalsContact O-CG 3.25Å; A635-M639 WeakPolarHBondContact O-CG 3.3Å; A635-M639 PolarHBondContact O-N 3.06Å
636	T	90.2	Very high	89.3	Confident	20 Å²	20	54.2 Å²	54.2	12%	0.123	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-53.7	177.6	-61.9	0	0	0	0	110.9	R632 K633 V634 R638 M639 H640 S674 S678	R632-T636 VanDerWaalsContact O-CB 3.28Å; R632-T636 WeakPolarHBondContact O-CB 3.42Å; R632-T636 PolarHBondContact O-N 3.06Å; R632-T636 PolarHBondContact O-OG1 2.93Å; K633-T636 WeakPolarHBondContact O-CB 3.28Å; K633-T636 PolarHBondContact O-N 3.31Å; V634-T636 VanDerWaalsContact C-N 3.33Å; V634-T636 PolarHBondContact O-N 2.78Å; T636-R638 PolarHBondContact O-N 3.23Å; T636-M639 PolarHBondContact O-N 3.06Å; T636-H640 WeakPolarHBondContact O-CB 3.49Å; T636-H640 PolarHBondContact O-N 3.19Å; T636-S674 WeakPolarHBondContact CA-OG 3.48Å; T636-S674 WeakPolarHBondContact CG2-OG 3.31Å; T636-S674 PolarHBondContact O-OG 2.9Å; T636-S678 PolarHBondContact OG1-N 3.41Å
637	E	90	Very high	89.6	Confident	112 Å²	112	57.1 Å²	57.1	52%	0.523	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-39.8	178	-72.9	173.2	173.9	0	0	110.7	K633 S641	K633-E637 WeakPolarHBondContact CE-OE1 3.32Å; K633-E637 IonicContact NZ-OE1 3.78Å; K633-E637 WeakPolarHBondContact O-CG 3.35Å; K633-E637 PolarHBondContact O-N 2.67Å; E637-S641 WeakPolarHBondContact O-CB 3.42Å; E637-S641 PolarHBondContact O-N 2.92Å
638	R	90.1	Very high	89.9	Confident	21 Å²	21	52.1 Å²	52.1	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-67.9	-51.5	176.9	-172.5	172	176.9	112.2	13.1	112.9	W571 S574 D575 V634 A635 T636 H640 S641 E642	W571-R638 HydrophobicContact CH2-CB 4.09Å; W571-R638 HydrophobicContact CH2-CG 4.01Å; W571-R638 HydrophobicContact CZ2-CB 4.11Å; W571-R638 VanDerWaalsContact CZ2-CD 3.49Å; W571-R638 HydrophobicContact CZ2-CG 3.58Å; W571-R638 PolarHBondContact O-NE 2.86Å; W571-R638 PolarHBondContact O-NH1 3.29Å; W571-R638 PolarHBondContact O-NH2 2.92Å; S574-R638 PolarHBondContact O-NH1 3.26Å; S574-R638 VanDerWaalsContact O-NH1 3.09Å; S574-R638 PolarHBondContact O-NH2 3.42Å; D575-R638 VanDerWaalsContact CA-NH2 3.32Å; D575-R638 IonicContact OD1-CZ 3.91Å; D575-R638 IonicContact OD1-NH1 3.12Å; D575-R638 PolarHBondContact OD1-NH1 3.08Å; D575-R638 IonicContact OD1-NH2 3.34Å; V634-R638 WeakPolarHBondContact O-CB 3.43Å; V634-R638 PolarHBondContact O-N 3.23Å; A635-R638 PolarHBondContact O-N 2.92Å; T636-R638 PolarHBondContact O-N 3.23Å; R638-H640 PolarHBondContact O-N 3.17Å; R638-S641 WeakPolarHBondContact O-CB 3.45Å; R638-S641 PolarHBondContact O-N 3.4Å; R638-S641 VanDerWaalsContact O-N 3.16Å; R638-E642 HydrophobicContact CG-CG 4.17Å; R638-E642 IonicContact CZ-OE1 2.77Å; R638-E642 IonicContact NE-OE1 3.47Å; R638-E642 PolarHBondContact NE-OE1 3.09Å; R638-E642 VanDerWaalsContact NE-OE1 3.09Å; R638-E642 IonicContact NH2-OE1 2.76Å; R638-E642 PolarHBondContact NH2-OE1 3.33Å; R638-E642 VanDerWaalsContact O-CB 3.26Å; R638-E642 WeakPolarHBondContact O-CB 3.49Å; R638-E642 VanDerWaalsContact O-CG 3.24Å; R638-E642 WeakPolarHBondContact O-CG 3.42Å; R638-E642 PolarHBondContact O-N 2.91Å
639	M	91.6	Very high	90.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.7	-37	177.6	-76.4	-180	68.1	0	0	112.1	L567 W571 F619 A635 T636 S643 L670 L673	L567-M639 HydrophobicContact CD2-SD 4.42Å; W571-M639 HydrophobicContact CH2-CG 3.85Å; W571-M639 HydrophobicContact CZ2-CG 3.97Å; F619-M639 HydrophobicContact CE2-CE 3.9Å; F619-M639 HydrophobicContact CE2-SD 4.2Å; F619-M639 HydrophobicContact CZ-CE 4.18Å; F619-M639 HydrophobicContact CZ-SD 3.92Å; A635-M639 WeakPolarHBondContact O-CB 3.5Å; A635-M639 VanDerWaalsContact O-CG 3.25Å; A635-M639 WeakPolarHBondContact O-CG 3.3Å; A635-M639 PolarHBondContact O-N 3.06Å; T636-M639 PolarHBondContact O-N 3.06Å; M639-S643 WeakPolarHBondContact O-CB 3.36Å; M639-S643 PolarHBondContact O-N 3.47Å; M639-L670 HydrophobicContact CE-CD2 4.43Å; M639-L673 HydrophobicContact CE-CB 3.46Å; M639-L673 VanDerWaalsContact CE-CB 3.46Å; M639-L673 HydrophobicContact CE-CD1 3.95Å; M639-L673 HydrophobicContact CE-CG 4.36Å
640	H	90.9	Very high	90.6	Very high	92 Å²	92	45.9 Å²	45.9	43%	0.426	23%	0.231	S	C	.	.	H	α-helix	trans	-70.5	-44.1	176.7	-168.9	49.8	0	0	0	112.2	T636 R638 E642 S643 E644 D671	T636-H640 WeakPolarHBondContact O-CB 3.49Å; T636-H640 PolarHBondContact O-N 3.19Å; R638-H640 PolarHBondContact O-N 3.17Å; H640-E642 VanDerWaalsContact C-N 3.32Å; H640-E642 PolarHBondContact O-N 2.91Å; H640-S643 WeakPolarHBondContact O-CB 3.41Å; H640-S643 PolarHBondContact O-N 3.35Å; H640-E644 PolarHBondContact O-N 3.35Å; H640-D671 IonicContact CE1-OD1 2.92Å; H640-D671 IonicContact ND1-OD1 2.7Å; H640-D671 PolarHBondContact ND1-OD1 3.24Å
641	S	91.1	Very high	90.7	Very high	61 Å²	61	42.1 Å²	42.1	43%	0.427	21%	0.213	S	C	.	.	H	α-helix	trans	-58.7	-44.2	172.7	-179.7	0	0	0	0	111.8	E637 R638 E644 K645	E637-S641 WeakPolarHBondContact O-CB 3.42Å; E637-S641 PolarHBondContact O-N 2.92Å; R638-S641 WeakPolarHBondContact O-CB 3.45Å; R638-S641 PolarHBondContact O-N 3.4Å; R638-S641 VanDerWaalsContact O-N 3.16Å; S641-E644 PolarHBondContact O-N 3.06Å; S641-K645 WeakPolarHBondContact O-CG 3.29Å; S641-K645 PolarHBondContact O-N 3.2Å
642	E	93.1	Very high	90.9	Very high	6 Å²	6	45 Å²	45	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-67.3	-38.1	178.2	-73.2	-170.6	162.2	0	0	112.2	W571 L578 Y615 R638 H640 K645 L646	W571-E642 VanDerWaalsContact CE2-OE2 3.3Å; W571-E642 VanDerWaalsContact CZ2-OE2 3.24Å; W571-E642 WeakPolarHBondContact CZ2-OE2 3.3Å; W571-E642 VanDerWaalsContact NE1-CD 3.26Å; W571-E642 PolarHBondContact NE1-OE1 3.48Å; W571-E642 PolarHBondContact NE1-OE2 3.29Å; L578-E642 HydrophobicContact CB-CG 4.41Å; L578-E642 HydrophobicContact CD2-CB 3.43Å; L578-E642 VanDerWaalsContact CD2-CB 3.43Å; L578-E642 HydrophobicContact CD2-CG 3.4Å; L578-E642 VanDerWaalsContact CD2-CG 3.4Å; L578-E642 HydrophobicContact CG-CG 4.49Å; Y615-E642 PolarHBondContact OH-OE2 2.89Å; R638-E642 HydrophobicContact CG-CG 4.17Å; R638-E642 IonicContact CZ-OE1 2.77Å; R638-E642 IonicContact NE-OE1 3.47Å; R638-E642 PolarHBondContact NE-OE1 3.09Å; R638-E642 VanDerWaalsContact NE-OE1 3.09Å; R638-E642 IonicContact NH2-OE1 2.76Å; R638-E642 PolarHBondContact NH2-OE1 3.33Å; R638-E642 VanDerWaalsContact O-CB 3.26Å; R638-E642 WeakPolarHBondContact O-CB 3.49Å; R638-E642 VanDerWaalsContact O-CG 3.24Å; R638-E642 WeakPolarHBondContact O-CG 3.42Å; R638-E642 PolarHBondContact O-N 2.91Å; H640-E642 VanDerWaalsContact C-N 3.32Å; H640-E642 PolarHBondContact O-N 2.91Å; E642-K645 PolarHBondContact O-N 3.34Å; E642-L646 WeakPolarHBondContact O-CB 3.44Å; E642-L646 WeakPolarHBondContact O-CG 3.43Å; E642-L646 PolarHBondContact O-N 3.36Å
643	S	93.2	Very high	91	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.7	-49.2	171.9	178	0	0	0	0	111.8	M639 H640 L646 R647 T667 D671	M639-S643 WeakPolarHBondContact O-CB 3.36Å; M639-S643 PolarHBondContact O-N 3.47Å; H640-S643 WeakPolarHBondContact O-CB 3.41Å; H640-S643 PolarHBondContact O-N 3.35Å; S643-L646 PolarHBondContact O-N 3.36Å; S643-R647 WeakPolarHBondContact O-CB 3.39Å; S643-R647 PolarHBondContact O-N 3.24Å; S643-T667 PolarHBondContact OG-O 3.43Å; S643-D671 WeakPolarHBondContact CB-OD1 3.23Å; S643-D671 VanDerWaalsContact OG-CG 3.25Å; S643-D671 PolarHBondContact OG-OD1 2.92Å; S643-D671 PolarHBondContact OG-OD2 3.28Å
644	E	92.2	Very high	90.8	Very high	74 Å²	74	41 Å²	41	35%	0.346	20%	0.204	S	C	.	.	H	α-helix	trans	-64.2	-39.7	177.1	-77.4	-64	140.3	0	0	112.6	H640 S641 R647 T648	H640-E644 PolarHBondContact O-N 3.35Å; S641-E644 PolarHBondContact O-N 3.06Å; E644-R647 PolarHBondContact O-N 2.97Å; E644-R647 IonicContact OE1-CZ 3.73Å; E644-R647 IonicContact OE1-NH1 3.67Å; E644-R647 PolarHBondContact OE1-NH1 3.24Å; E644-T648 VanDerWaalsContact O-CB 3.31Å; E644-T648 WeakPolarHBondContact O-CB 3.39Å; E644-T648 PolarHBondContact O-N 2.83Å; E644-T648 PolarHBondContact O-OG1 3.19Å
645	K	92.3	Very high	90.2	Very high	73 Å²	73	43 Å²	43	32%	0.317	21%	0.212	S	C	.	.	H	α-helix	trans	-60.8	-48.9	174	-77.5	-177.2	177.1	-164.6	0	111.7	L578 E579 S641 E642 T648 L649	L578-K645 HydrophobicContact CD2-CB 4.39Å; L578-K645 HydrophobicContact CD2-CD 4.43Å; E579-K645 IonicContact OE2-NZ 2.97Å; E579-K645 PolarHBondContact OE2-NZ 2.89Å; S641-K645 WeakPolarHBondContact O-CG 3.29Å; S641-K645 PolarHBondContact O-N 3.2Å; E642-K645 PolarHBondContact O-N 3.34Å; K645-T648 PolarHBondContact O-N 3.28Å; K645-L649 WeakPolarHBondContact O-CB 3.35Å; K645-L649 PolarHBondContact O-N 2.85Å
646	L	93.4	Very high	88.8	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-62.4	-44.2	178.6	-75.3	170.1	0	0	0	111.4	L578 I611 E642 S643 L649 F650 T667 L670	L578-L646 HydrophobicContact CD1-CD1 4.18Å; L578-L646 HydrophobicContact CD1-CD2 4.05Å; L578-L646 HydrophobicContact CD1-CG 4.18Å; L578-L646 HydrophobicContact CD2-CG 4.33Å; I611-L646 HydrophobicContact CD1-CD2 3.99Å; I611-L646 HydrophobicContact CG2-CD1 3.83Å; I611-L646 HydrophobicContact CG2-CD2 4.16Å; E642-L646 WeakPolarHBondContact O-CB 3.44Å; E642-L646 WeakPolarHBondContact O-CG 3.43Å; E642-L646 PolarHBondContact O-N 3.36Å; S643-L646 PolarHBondContact O-N 3.36Å; L646-L649 PolarHBondContact O-N 3.34Å; L646-F650 HydrophobicContact CD2-CE2 4.1Å; L646-F650 VanDerWaalsContact O-CD2 3.28Å; L646-F650 WeakPolarHBondContact O-CD2 3.33Å; L646-F650 PolarHBondContact O-N 2.72Å; L646-T667 HydrophobicContact CB-CG2 3.62Å; L646-L670 HydrophobicContact CD1-CD1 3.8Å
647	R	91.7	Very high	87	Confident	60 Å²	60	53.6 Å²	53.6	23%	0.226	26%	0.257	C	S	.	.	H	α-helix	trans	-58.8	-51.6	176.5	-175.6	-179.6	-57.7	162.3	4.2	110.8	S643 E644 L649 F650 C651 T667 D671	S643-R647 WeakPolarHBondContact O-CB 3.39Å; S643-R647 PolarHBondContact O-N 3.24Å; E644-R647 PolarHBondContact O-N 2.97Å; E644-R647 IonicContact OE1-CZ 3.73Å; E644-R647 IonicContact OE1-NH1 3.67Å; E644-R647 PolarHBondContact OE1-NH1 3.24Å; R647-L649 VanDerWaalsContact C-N 3.29Å; R647-L649 PolarHBondContact O-N 3.19Å; R647-F650 PolarHBondContact O-N 2.7Å; R647-C651 VanDerWaalsContact O-CB 3.26Å; R647-C651 WeakPolarHBondContact O-CB 3.28Å; R647-C651 PolarHBondContact O-N 3.37Å; R647-C651 PolarHBondContact O-SG 3.36Å; R647-T667 HydrophobicContact CB-CG2 4.29Å; R647-T667 PolarHBondContact NE-OG1 2.92Å; R647-T667 PolarHBondContact NH2-OG1 3.06Å; R647-D671 IonicContact CZ-OD2 2.64Å; R647-D671 IonicContact NH1-OD2 2.87Å; R647-D671 IonicContact NH2-OD2 2.82Å; R647-D671 PolarHBondContact NH2-OD2 3.42Å
648	T	91	Very high	85.3	Confident	86 Å²	86	56.6 Å²	56.6	53%	0.528	27%	0.271	S	S	.	.	H	α-helix	trans	-58.9	-41.4	179	-58.3	0	0	0	0	111.7	E644 K645 R652	E644-T648 VanDerWaalsContact O-CB 3.31Å; E644-T648 WeakPolarHBondContact O-CB 3.39Å; E644-T648 PolarHBondContact O-N 2.83Å; E644-T648 PolarHBondContact O-OG1 3.19Å; K645-T648 PolarHBondContact O-N 3.28Å; T648-R652 WeakPolarHBondContact O-CB 3.44Å; T648-R652 PolarHBondContact O-N 3.23Å; T648-R652 VanDerWaalsContact O-N 3.15Å
649	L	92.6	Very high	83.5	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-61.2	-61	175.6	179.2	66.3	0	0	0	110.8	C582 I585 E586 K645 L646 R647 C651 R652 L653	C582-L649 HydrophobicContact CB-CD2 3.88Å; I585-L649 HydrophobicContact CG2-CD2 4.41Å; E586-L649 HydrophobicContact CB-CD1 4.45Å; K645-L649 WeakPolarHBondContact O-CB 3.35Å; K645-L649 PolarHBondContact O-N 2.85Å; L646-L649 PolarHBondContact O-N 3.34Å; R647-L649 VanDerWaalsContact C-N 3.29Å; R647-L649 PolarHBondContact O-N 3.19Å; L649-C651 PolarHBondContact O-N 2.98Å; L649-R652 WeakPolarHBondContact O-CA 3.36Å; L649-R652 WeakPolarHBondContact O-CB 3.32Å; L649-R652 PolarHBondContact O-N 3.37Å; L649-L653 HydrophobicContact CD1-CD1 3.87Å; L649-L653 HydrophobicContact CD1-CD2 4.16Å; L649-L653 HydrophobicContact CD1-CG 3.97Å; L649-L653 HydrophobicContact CG-CD1 3.91Å; L649-L653 HydrophobicContact CG-CG 4.25Å; L649-L653 WeakPolarHBondContact O-CG 3.49Å; L649-L653 PolarHBondContact O-N 3.31Å
650	F	92	Very high	81.7	Confident	3 Å²	3	64.4 Å²	64.4	1%	0.013	32%	0.32	C	S	.	.	H	α-helix	trans	-65	-36.5	-174.1	-76.8	-71	0	0	0	113.2	I585 L604 L607 E608 I611 L646 R647 R652 L653 R654	I585-F650 HydrophobicContact CD1-CZ 4.31Å; L604-F650 HydrophobicContact CB-CD1 4.14Å; L604-F650 HydrophobicContact CB-CE1 4.38Å; L604-F650 HydrophobicContact CD2-CD1 4.22Å; L604-F650 HydrophobicContact CD2-CE1 4.2Å; L604-F650 WeakPolarHBondContact O-CE1 3.49Å; L607-F650 HydrophobicContact CB-CE1 4.14Å; L607-F650 HydrophobicContact CB-CZ 4.17Å; E608-F650 HydrophobicContact CB-CD1 4.2Å; E608-F650 HydrophobicContact CB-CD2 3.88Å; E608-F650 HydrophobicContact CB-CE1 4Å; E608-F650 HydrophobicContact CB-CE2 3.67Å; E608-F650 HydrophobicContact CB-CG 4.15Å; E608-F650 HydrophobicContact CB-CZ 3.73Å; E608-F650 HydrophobicContact CG-CD2 3.7Å; E608-F650 HydrophobicContact CG-CE2 3.81Å; E608-F650 HydrophobicContact CG-CG 4.23Å; E608-F650 HydrophobicContact CG-CZ 4.39Å; I611-F650 HydrophobicContact CD1-CE2 3.93Å; I611-F650 HydrophobicContact CD1-CZ 3.89Å; L646-F650 HydrophobicContact CD2-CE2 4.1Å; L646-F650 VanDerWaalsContact O-CD2 3.28Å; L646-F650 WeakPolarHBondContact O-CD2 3.33Å; L646-F650 PolarHBondContact O-N 2.72Å; R647-F650 PolarHBondContact O-N 2.7Å; F650-R652 VanDerWaalsContact C-N 3.28Å; F650-R652 PolarHBondContact O-N 3.32Å; F650-L653 PolarHBondContact O-N 2.83Å; F650-R654 WeakPolarHBondContact O-CB 3.37Å; F650-R654 VanDerWaalsContact O-CG 3.3Å; F650-R654 WeakPolarHBondContact O-CG 3.47Å; F650-R654 PolarHBondContact O-N 3.41Å
651	C	88.3	Confident	79.9	Confident	37 Å²	37	64.7 Å²	64.7	25%	0.25	34%	0.338	C	S	.	.	H	α-helix	trans	-60.5	-39.6	172.6	-68.5	0	0	0	0	111.7	R647 L649 E656	R647-C651 VanDerWaalsContact O-CB 3.26Å; R647-C651 WeakPolarHBondContact O-CB 3.28Å; R647-C651 PolarHBondContact O-N 3.37Å; R647-C651 PolarHBondContact O-SG 3.36Å; L649-C651 PolarHBondContact O-N 2.98Å; C651-E656 WeakPolarHBondContact CB-OE2 3.42Å; C651-E656 PolarHBondContact O-N 3.49Å; C651-E656 PolarHBondContact SG-OE2 2.92Å
652	R	89.6	Confident	78.4	Confident	117 Å²	117	68.2 Å²	68.2	44%	0.442	35%	0.348	S	S	.	.	H	α-helix	trans	-69.3	-46.2	176.7	179.4	175.6	62.6	106.9	-9	111.8	E586 T648 L649 F650 R654 N655	E586-R652 IonicContact OE1-CZ 2.82Å; E586-R652 IonicContact OE1-NH1 2.9Å; E586-R652 PolarHBondContact OE1-NH1 3.29Å; E586-R652 IonicContact OE1-NH2 3.29Å; E586-R652 PolarHBondContact OE1-NH2 3.04Å; E586-R652 IonicContact OE2-CZ 3.66Å; E586-R652 IonicContact OE2-NH2 3.5Å; E586-R652 PolarHBondContact OE2-NH2 3.28Å; T648-R652 WeakPolarHBondContact O-CB 3.44Å; T648-R652 PolarHBondContact O-N 3.23Å; T648-R652 VanDerWaalsContact O-N 3.15Å; L649-R652 WeakPolarHBondContact O-CA 3.36Å; L649-R652 WeakPolarHBondContact O-CB 3.32Å; L649-R652 PolarHBondContact O-N 3.37Å; F650-R652 VanDerWaalsContact C-N 3.28Å; F650-R652 PolarHBondContact O-N 3.32Å; R652-R654 VanDerWaalsContact C-N 3.28Å; R652-R654 PolarHBondContact O-N 3.38Å; R652-N655 PolarHBondContact O-N 2.89Å; R652-N655 PolarHBondContact O-OD1 3.4Å
653	L	91	Very high	77	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-67.6	-27	-179.3	-58.9	-175.8	0	0	0	112.8	I585 H589 L604 L649 F650 N655	I585-L653 HydrophobicContact CG2-CD1 3.76Å; H589-L653 HydrophobicContact CB-CD1 4.34Å; H589-L653 HydrophobicContact CB-CD2 4.03Å; H589-L653 PolarHBondContact CE1-O 3.07Å; L604-L653 HydrophobicContact CD1-CB 3.86Å; L604-L653 HydrophobicContact CD2-CB 4.06Å; L604-L653 HydrophobicContact CD2-CD1 3.95Å; L649-L653 HydrophobicContact CD1-CD1 3.87Å; L649-L653 HydrophobicContact CD1-CD2 4.16Å; L649-L653 HydrophobicContact CD1-CG 3.97Å; L649-L653 HydrophobicContact CG-CD1 3.91Å; L649-L653 HydrophobicContact CG-CG 4.25Å; L649-L653 WeakPolarHBondContact O-CG 3.49Å; L649-L653 PolarHBondContact O-N 3.31Å; F650-L653 PolarHBondContact O-N 2.83Å; L653-N655 VanDerWaalsContact C-N 3.34Å
654	R	85.5	Confident	76	Confident	16 Å²	16	76.5 Å²	76.5	6%	0.06	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-8	175.8	-73.6	179.1	-173.8	159.6	9.8	114.3	L604 E608 F650 R652 E656	L604-R654 HydrophobicContact CB-CG 4.36Å; L604-R654 HydrophobicContact CD1-CB 4.48Å; L604-R654 HydrophobicContact CD1-CG 3.61Å; E608-R654 IonicContact OE2-CZ 2.65Å; E608-R654 IonicContact OE2-NH1 3.87Å; E608-R654 IonicContact OE2-NH2 3.89Å; E608-R654 PolarHBondContact OE2-NH2 3.14Å; F650-R654 WeakPolarHBondContact O-CB 3.37Å; F650-R654 VanDerWaalsContact O-CG 3.3Å; F650-R654 WeakPolarHBondContact O-CG 3.47Å; F650-R654 PolarHBondContact O-N 3.41Å; R652-R654 VanDerWaalsContact C-N 3.28Å; R652-R654 PolarHBondContact O-N 3.38Å; R654-E656 VanDerWaalsContact C-N 3.28Å; R654-E656 HydrophobicContact CB-CG 3.94Å; R654-E656 IonicContact NH1-OE1 3.67Å; R654-E656 PolarHBondContact O-N 2.62Å
655	N	74.5	Confident	75.6	Confident	111 Å²	111	73.9 Å²	73.9	59%	0.594	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	41.5	-170.8	-69	-32.8	0	0	0	113.4	R652 L653 K657 E658	R652-N655 PolarHBondContact O-N 2.89Å; R652-N655 PolarHBondContact O-OD1 3.4Å; L653-N655 VanDerWaalsContact C-N 3.34Å; N655-K657 PolarHBondContact O-N 3.11Å; N655-E658 PolarHBondContact O-N 3.45Å
656	E	60.1	Low	75.5	Confident	32 Å²	32	70.5 Å²	70.5	15%	0.15	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-57.7	-9.5	-177.1	-77.2	179.5	-174.4	0	0	115.2	C651 R654 E658 N659 F663	C651-E656 WeakPolarHBondContact CB-OE2 3.42Å; C651-E656 PolarHBondContact O-N 3.49Å; C651-E656 PolarHBondContact SG-OE2 2.92Å; R654-E656 VanDerWaalsContact C-N 3.28Å; R654-E656 HydrophobicContact CB-CG 3.94Å; R654-E656 IonicContact NH1-OE1 3.67Å; R654-E656 PolarHBondContact O-N 2.62Å; E656-E658 PolarHBondContact O-N 3.44Å; E656-E658 VanDerWaalsContact O-N 3.08Å; E656-N659 CarbonylContact O-C 3.34Å; E656-N659 PolarHBondContact O-N 2.85Å; E656-F663 HydrophobicContact CG-CD2 3.76Å; E656-F663 HydrophobicContact CG-CE2 4.33Å; E656-F663 HydrophobicContact CG-CG 4.44Å; E656-F663 VanDerWaalsContact OE1-CB 3.31Å; E656-F663 WeakPolarHBondContact OE1-CB 3.49Å
657	K	53.1	Low	75.3	Confident	211 Å²	211	70.4 Å²	70.4	92%	0.917	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-55.9	-23.6	173.4	-70.6	-175.1	178.4	177.2	0	113.2	N655	N655-K657 PolarHBondContact O-N 3.11Å
658	E	54.3	Low	75.3	Confident	175 Å²	175	70 Å²	70	82%	0.818	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-92.1	-20.8	177.6	-65.7	-173	166	0	0	113.6	N655 E656	N655-E658 PolarHBondContact O-N 3.45Å; E656-E658 PolarHBondContact O-N 3.44Å; E656-E658 VanDerWaalsContact O-N 3.08Å
659	N	51.6	Low	75.3	Confident	83 Å²	83	65.9 Å²	65.9	44%	0.444	34%	0.339	S	S	.	.			trans	-155.4	78.3	179.5	-112.9	1.8	0	0	0	112.9	E656 A661 E662	E656-N659 CarbonylContact O-C 3.34Å; E656-N659 PolarHBondContact O-N 2.85Å; N659-A661 PolarHBondContact O-N 3.31Å; N659-E662 PolarHBondContact ND2-OE2 3.08Å
660	P	54.3	Low	75.3	Confident	103 Å²	103	65.5 Å²	65.5	67%	0.669	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-11.7	-174.4	26.8	-33.7	0	0	0	114.4
661	A	52.3	Low	75.2	Confident	98 Å²	98	66.5 Å²	66.5	81%	0.81	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.3	-171.9	0	0	0	0	0	114.5	N659	N659-A661 PolarHBondContact O-N 3.31Å
662	E	60.1	Low	75.3	Confident	134 Å²	134	65 Å²	65	63%	0.626	33%	0.333	S	S	*	.	S	Bend	trans	-98.9	-7.7	-168.7	-72.2	-176.6	153.3	0	0	114.7	N659	N659-E662 PolarHBondContact ND2-OE2 3.08Å
663	F	65	Low	75.4	Confident	56 Å²	56	59.4 Å²	59.4	25%	0.246	31%	0.312	C	S	.	.			trans	-122.7	112.5	-169.6	-57.9	-75.3	0	0	0	112.7	N601 E656	N601-F663 HydrophobicContact CB-CE1 4.26Å; E656-F663 HydrophobicContact CG-CD2 3.76Å; E656-F663 HydrophobicContact CG-CE2 4.33Å; E656-F663 HydrophobicContact CG-CG 4.44Å; E656-F663 VanDerWaalsContact OE1-CB 3.31Å; E656-F663 WeakPolarHBondContact OE1-CB 3.49Å
664	E	72.1	Confident	75.2	Confident	125 Å²	125	59.4 Å²	59.4	58%	0.584	31%	0.312	S	S	*	.			trans	-85.2	113.1	168.4	-170.9	175.1	-160	0	0	108.7	I740	E664-I740 HydrophobicContact CG-CD1 4.28Å; E664-I740 WeakPolarHBondContact OE1-CD1 3.44Å
665	S	83.3	Confident	75.3	Confident	18 Å²	18	62 Å²	62	13%	0.126	33%	0.327	C	S	.	.			trans	-70.3	132.5	176.8	177.4	0	0	0	0	110.8	E608 T667 V668	E608-S665 PolarHBondContact OE1-OG 2.99Å; S665-T667 PolarHBondContact O-N 3.49Å; S665-T667 WeakPolarHBondContact OG-CB 3.48Å; S665-T667 WeakPolarHBondContact OG-CG2 3.49Å; S665-T667 PolarHBondContact OG-N 3.03Å; S665-T667 PolarHBondContact OG-OG1 2.91Å; S665-V668 WeakPolarHBondContact O-CG2 3.32Å
666	L	89.9	Confident	75.9	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-11.5	178.8	-54.7	178.4	0	0	0	111.9	L605 E608 M609 V612 V668 V669 I740 V743	L605-L666 HydrophobicContact CD1-CD1 3.84Å; L605-L666 HydrophobicContact CD1-CG 4.08Å; E608-L666 HydrophobicContact CB-CD1 4.49Å; E608-L666 HydrophobicContact CG-CB 4.08Å; E608-L666 HydrophobicContact CG-CD1 4.46Å; E608-L666 HydrophobicContact CG-CG 4.48Å; E608-L666 PolarHBondContact OE1-N 3.35Å; M609-L666 HydrophobicContact CB-CD1 3.56Å; M609-L666 HydrophobicContact CG-CD1 4.24Å; V612-L666 HydrophobicContact CG2-CB 4.15Å; L666-V668 PolarHBondContact O-N 3.32Å; L666-V669 WeakPolarHBondContact O-CB 3.32Å; L666-V669 WeakPolarHBondContact O-CG2 3.26Å; L666-V669 PolarHBondContact O-N 2.98Å; L666-I740 HydrophobicContact CD2-CB 4.11Å; L666-I740 HydrophobicContact CD2-CG1 4.08Å; L666-V743 HydrophobicContact CB-CG2 4.49Å; L666-V743 HydrophobicContact CD1-CG2 4.09Å; L666-V743 HydrophobicContact CD2-CG2 3.94Å; L666-V743 HydrophobicContact CG-CG2 4.41Å
667	T	90.2	Very high	77.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-20.3	175.2	62.5	0	0	0	0	113.8	S643 L646 R647 S665 V669 L670 D671	S643-T667 PolarHBondContact OG-O 3.43Å; L646-T667 HydrophobicContact CB-CG2 3.62Å; R647-T667 HydrophobicContact CB-CG2 4.29Å; R647-T667 PolarHBondContact NE-OG1 2.92Å; R647-T667 PolarHBondContact NH2-OG1 3.06Å; S665-T667 PolarHBondContact O-N 3.49Å; S665-T667 WeakPolarHBondContact OG-CB 3.48Å; S665-T667 WeakPolarHBondContact OG-CG2 3.49Å; S665-T667 PolarHBondContact OG-N 3.03Å; S665-T667 PolarHBondContact OG-OG1 2.91Å; T667-V669 PolarHBondContact O-N 2.85Å; T667-L670 WeakPolarHBondContact O-CA 3.41Å; T667-L670 WeakPolarHBondContact O-CB 3.46Å; T667-L670 PolarHBondContact O-N 3.25Å; T667-D671 PolarHBondContact O-N 3Å
668	V	89.8	Confident	78.8	Confident	51 Å²	51	47.3 Å²	47.3	31%	0.309	26%	0.263	S	S	.	.	H	α-helix	trans	-56.9	-25.6	174.9	178.8	0	0	0	0	112.2	S665 L666 S672 F696	S665-V668 WeakPolarHBondContact O-CG2 3.32Å; L666-V668 PolarHBondContact O-N 3.32Å; V668-S672 PolarHBondContact O-N 3.4Å; V668-S672 VanDerWaalsContact O-N 3.11Å; V668-S672 PolarHBondContact O-OG 2.64Å; V668-F696 HydrophobicContact CG1-CZ 4.27Å
669	V	91.5	Very high	80.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-43.8	171.7	179	0	0	0	0	110.8	V612 L616 L666 T667 S672 L673 F696 V743 F744	V612-V669 HydrophobicContact CG1-CB 3.75Å; V612-V669 HydrophobicContact CG1-CG1 3.88Å; V612-V669 HydrophobicContact CG1-CG2 4.15Å; L616-V669 HydrophobicContact CD1-CG1 4.26Å; L616-V669 HydrophobicContact CD2-CG1 4.14Å; L616-V669 HydrophobicContact CG-CG1 4.4Å; L666-V669 WeakPolarHBondContact O-CB 3.32Å; L666-V669 WeakPolarHBondContact O-CG2 3.26Å; L666-V669 PolarHBondContact O-N 2.98Å; T667-V669 PolarHBondContact O-N 2.85Å; V669-S672 PolarHBondContact O-N 3.18Å; V669-L673 HydrophobicContact CG1-CD1 4.15Å; V669-L673 HydrophobicContact CG1-CG 4.44Å; V669-L673 VanDerWaalsContact O-CG 3.26Å; V669-L673 WeakPolarHBondContact O-CG 3.37Å; V669-L673 PolarHBondContact O-N 2.93Å; V669-F696 HydrophobicContact CB-CZ 4.23Å; V669-F696 HydrophobicContact CG2-CD1 4.15Å; V669-F696 HydrophobicContact CG2-CE1 3.54Å; V669-F696 HydrophobicContact CG2-CE2 4.4Å; V669-F696 HydrophobicContact CG2-CZ 3.68Å; V669-V743 HydrophobicContact CG2-CG1 4.42Å; V669-F744 HydrophobicContact CG1-CZ 4.42Å
670	L	92.1	Very high	81.6	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.5	-41.2	-179.8	-59	-177.5	0	0	0	111.8	Y615 M639 L646 T667 S672 L673 S674	Y615-L670 HydrophobicContact CD1-CD2 3.8Å; Y615-L670 HydrophobicContact CD2-CD1 4.23Å; Y615-L670 HydrophobicContact CD2-CD2 3.68Å; Y615-L670 HydrophobicContact CE1-CD2 4.38Å; Y615-L670 HydrophobicContact CE2-CD1 4.05Å; Y615-L670 HydrophobicContact CE2-CD2 4.27Å; Y615-L670 HydrophobicContact CG-CD2 3.41Å; Y615-L670 VanDerWaalsContact CG-CD2 3.41Å; M639-L670 HydrophobicContact CE-CD2 4.43Å; L646-L670 HydrophobicContact CD1-CD1 3.8Å; T667-L670 WeakPolarHBondContact O-CA 3.41Å; T667-L670 WeakPolarHBondContact O-CB 3.46Å; T667-L670 PolarHBondContact O-N 3.25Å; L670-S672 VanDerWaalsContact C-N 3.34Å; L670-S672 PolarHBondContact O-N 3.18Å; L670-L673 HydrophobicContact CD2-CD1 4.27Å; L670-L673 PolarHBondContact O-N 2.62Å; L670-S674 WeakPolarHBondContact O-CB 3.43Å; L670-S674 PolarHBondContact O-N 2.84Å
671	D	91.1	Very high	82.9	Confident	24 Å²	24	40.9 Å²	40.9	13%	0.128	23%	0.225	C	C	.	.	H	α-helix	trans	-61.3	-44.6	174.7	-67.9	-27.1	0	0	0	111.3	H640 S643 R647 T667 L673 S674 D675	H640-D671 IonicContact CE1-OD1 2.92Å; H640-D671 IonicContact ND1-OD1 2.7Å; H640-D671 PolarHBondContact ND1-OD1 3.24Å; S643-D671 WeakPolarHBondContact CB-OD1 3.23Å; S643-D671 VanDerWaalsContact OG-CG 3.25Å; S643-D671 PolarHBondContact OG-OD1 2.92Å; S643-D671 PolarHBondContact OG-OD2 3.28Å; R647-D671 IonicContact CZ-OD2 2.64Å; R647-D671 IonicContact NH1-OD2 2.87Å; R647-D671 IonicContact NH2-OD2 2.82Å; R647-D671 PolarHBondContact NH2-OD2 3.42Å; T667-D671 PolarHBondContact O-N 3Å; D671-L673 VanDerWaalsContact C-N 3.34Å; D671-L673 PolarHBondContact O-N 3.18Å; D671-S674 WeakPolarHBondContact O-CA 3.27Å; D671-S674 WeakPolarHBondContact O-CB 3.46Å; D671-S674 PolarHBondContact O-N 3.16Å; D671-S674 VanDerWaalsContact O-N 3.1Å; D671-D675 PolarHBondContact O-N 2.83Å
672	S	90.3	Very high	84.4	Confident	5 Å²	5	42.1 Å²	42.1	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-70.1	-30.9	180	-53.4	0	0	0	0	112.4	V668 V669 L670 S674 M676 K695	V668-S672 PolarHBondContact O-N 3.4Å; V668-S672 VanDerWaalsContact O-N 3.11Å; V668-S672 PolarHBondContact O-OG 2.64Å; V669-S672 PolarHBondContact O-N 3.18Å; L670-S672 VanDerWaalsContact C-N 3.34Å; L670-S672 PolarHBondContact O-N 3.18Å; S672-S674 VanDerWaalsContact C-N 3.34Å; S672-M676 WeakPolarHBondContact O-CG 3.26Å; S672-M676 PolarHBondContact O-N 2.88Å; S672-K695 PolarHBondContact OG-NZ 3.31Å
673	L	90.6	Very high	85.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.5	-39.2	169.5	-71.3	170.3	0	0	0	111.2	L616 F619 M639 V669 L670 D671 M676 M677 F692 I707	L616-L673 HydrophobicContact CD2-CD1 3.83Å; L616-L673 HydrophobicContact CD2-CD2 4.22Å; F619-L673 HydrophobicContact CD2-CD1 4.22Å; F619-L673 HydrophobicContact CE2-CD1 3.96Å; F619-L673 HydrophobicContact CE2-CD2 4.44Å; M639-L673 HydrophobicContact CE-CB 3.46Å; M639-L673 VanDerWaalsContact CE-CB 3.46Å; M639-L673 HydrophobicContact CE-CD1 3.95Å; M639-L673 HydrophobicContact CE-CG 4.36Å; V669-L673 HydrophobicContact CG1-CD1 4.15Å; V669-L673 HydrophobicContact CG1-CG 4.44Å; V669-L673 VanDerWaalsContact O-CG 3.26Å; V669-L673 WeakPolarHBondContact O-CG 3.37Å; V669-L673 PolarHBondContact O-N 2.93Å; L670-L673 HydrophobicContact CD2-CD1 4.27Å; L670-L673 PolarHBondContact O-N 2.62Å; D671-L673 VanDerWaalsContact C-N 3.34Å; D671-L673 PolarHBondContact O-N 3.18Å; L673-M676 WeakPolarHBondContact O-CB 3.24Å; L673-M676 PolarHBondContact O-N 3.25Å; L673-M677 WeakPolarHBondContact O-CG 3.41Å; L673-M677 PolarHBondContact O-N 3.29Å; L673-F692 HydrophobicContact CD2-CE2 3.72Å; L673-F692 HydrophobicContact CD2-CZ 3.99Å; L673-F692 HydrophobicContact CG-CE2 3.9Å; L673-F692 HydrophobicContact CG-CZ 4.47Å; L673-I707 HydrophobicContact CD2-CD1 3.58Å; L673-I707 HydrophobicContact CD2-CG1 3.98Å; L673-I707 HydrophobicContact CD2-CG2 3.76Å
674	S	88.5	Confident	86.5	Confident	4 Å²	4	41 Å²	41	3%	0.028	22%	0.217	C	C	.	.	H	α-helix	trans	-60.8	-47.2	176	-163.2	0	0	0	0	111	T636 L670 D671 S672 M676 M677 S678	T636-S674 WeakPolarHBondContact CA-OG 3.48Å; T636-S674 WeakPolarHBondContact CG2-OG 3.31Å; T636-S674 PolarHBondContact O-OG 2.9Å; L670-S674 WeakPolarHBondContact O-CB 3.43Å; L670-S674 PolarHBondContact O-N 2.84Å; D671-S674 WeakPolarHBondContact O-CA 3.27Å; D671-S674 WeakPolarHBondContact O-CB 3.46Å; D671-S674 PolarHBondContact O-N 3.16Å; D671-S674 VanDerWaalsContact O-N 3.1Å; S672-S674 VanDerWaalsContact C-N 3.34Å; S674-M676 VanDerWaalsContact C-N 3.3Å; S674-M676 PolarHBondContact O-N 3.18Å; S674-M677 PolarHBondContact O-N 3.26Å; S674-S678 WeakPolarHBondContact O-CB 3.28Å; S674-S678 PolarHBondContact O-N 3.03Å
675	D	86.7	Confident	87.2	Confident	71 Å²	71	35.1 Å²	35.1	38%	0.38	19%	0.189	S	C	.	.	H	α-helix	trans	-54.4	-46	175.4	-66.6	-24.7	0	0	0	111.4	D671 M677 S678 S679	D671-D675 PolarHBondContact O-N 2.83Å; D675-M677 PolarHBondContact O-N 2.83Å; D675-S678 PolarHBondContact O-N 3.33Å; D675-S678 PolarHBondContact O-OG 3.3Å; D675-S679 PolarHBondContact O-N 3.43Å
676	M	87.4	Confident	87.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-35.6	176.4	-71.6	180	57.3	0	0	113.7	S672 L673 S674 E688 V689 F692 L704 I707 I708 R711	S672-M676 WeakPolarHBondContact O-CG 3.26Å; S672-M676 PolarHBondContact O-N 2.88Å; L673-M676 WeakPolarHBondContact O-CB 3.24Å; L673-M676 PolarHBondContact O-N 3.25Å; S674-M676 VanDerWaalsContact C-N 3.3Å; S674-M676 PolarHBondContact O-N 3.18Å; M676-E688 HydrophobicContact CG-CB 4.25Å; M676-V689 HydrophobicContact CE-CB 4.42Å; M676-V689 HydrophobicContact CE-CG2 3.68Å; M676-F692 HydrophobicContact CG-CB 4.22Å; M676-F692 HydrophobicContact SD-CB 3.44Å; M676-F692 WeakPolarHBondContact SD-CB 3.37Å; M676-F692 HydrophobicContact SD-CD1 4.09Å; M676-F692 HydrophobicContact SD-CD2 3.59Å; M676-F692 VanDerWaalsContact SD-CD2 3.59Å; M676-F692 HydrophobicContact SD-CE2 4.41Å; M676-F692 HydrophobicContact SD-CG 3.42Å; M676-F692 WeakPolarHBondContact SD-CG 3.43Å; M676-L704 HydrophobicContact CE-CD1 4.17Å; M676-I707 HydrophobicContact CE-CG2 3.7Å; M676-I707 HydrophobicContact SD-CG2 4.42Å; M676-I708 HydrophobicContact CE-CG1 4.2Å; M676-R711 PolarHBondContact O-NH1 2.75Å
677	M	87.3	Confident	87.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-75.9	-33.4	177.3	-67.9	-56.1	109.7	0	0	112.2	F619 F626 R632 L673 S674 D675 S679 I707 A710 R711	F619-M677 HydrophobicContact CE1-CE 4.47Å; F619-M677 HydrophobicContact CE1-SD 4.18Å; F619-M677 HydrophobicContact CZ-CG 4.42Å; F626-M677 HydrophobicContact CD2-SD 4.06Å; F626-M677 HydrophobicContact CE2-CG 4.45Å; F626-M677 HydrophobicContact CE2-SD 3.92Å; R632-M677 WeakPolarHBondContact CD-O 3.33Å; R632-M677 PolarHBondContact NE-O 3.07Å; L673-M677 WeakPolarHBondContact O-CG 3.41Å; L673-M677 PolarHBondContact O-N 3.29Å; S674-M677 PolarHBondContact O-N 3.26Å; D675-M677 PolarHBondContact O-N 2.83Å; M677-S679 VanDerWaalsContact C-N 3.33Å; M677-S679 PolarHBondContact O-N 3.32Å; M677-I707 HydrophobicContact CE-CG2 3.73Å; M677-I707 WeakPolarHBondContact CE-O 3.21Å; M677-A710 HydrophobicContact SD-CB 4.46Å; M677-R711 HydrophobicContact CE-CG 3.86Å; M677-R711 PolarHBondContact O-NH1 2.82Å; M677-R711 HydrophobicContact SD-CG 3.78Å
678	S	86.4	Confident	87.4	Confident	44 Å²	44	44.6 Å²	44.6	31%	0.308	24%	0.241	S	C	.	.	H	α-helix	trans	-68.6	-26.8	-176.3	81.3	0	0	0	0	114.1	Y629 T636 S674 D675 Q680	Y629-S678 WeakPolarHBondContact CE2-O 3.3Å; T636-S678 PolarHBondContact OG1-N 3.41Å; S674-S678 WeakPolarHBondContact O-CB 3.28Å; S674-S678 PolarHBondContact O-N 3.03Å; D675-S678 PolarHBondContact O-N 3.33Å; D675-S678 PolarHBondContact O-OG 3.3Å; S678-Q680 PolarHBondContact O-N 3.29Å; S678-Q680 VanDerWaalsContact O-N 3.12Å
679	S	84.1	Confident	87.5	Confident	14 Å²	14	42.2 Å²	42.2	10%	0.098	23%	0.226	C	C	.	.			trans	-58.9	117.9	-173.8	179.7	0	0	0	0	111.8	R632 D675 M677 D681 R711	R632-S679 PolarHBondContact NH2-O 3.29Å; R632-S679 VanDerWaalsContact NH2-O 3.12Å; D675-S679 PolarHBondContact O-N 3.43Å; M677-S679 VanDerWaalsContact C-N 3.33Å; M677-S679 PolarHBondContact O-N 3.32Å; S679-D681 PolarHBondContact OG-O 3.49Å; S679-R711 VanDerWaalsContact O-CZ 3.26Å; S679-R711 PolarHBondContact O-NH1 3.27Å; S679-R711 PolarHBondContact O-NH2 2.82Å
680	Q	80.5	Confident	87.5	Confident	135 Å²	135	43.6 Å²	43.6	63%	0.631	24%	0.236	S	C	*	.			trans	-76.2	-42	175.8	-77.5	-178.9	15.9	0	0	111.7	Y629 S678 R682	Y629-Q680 HydrophobicContact CD2-CG 3.72Å; Y629-Q680 HydrophobicContact CE1-CG 4.03Å; Y629-Q680 VanDerWaalsContact CE1-NE2 3.34Å; Y629-Q680 HydrophobicContact CE2-CB 4.28Å; Y629-Q680 HydrophobicContact CE2-CG 3.13Å; Y629-Q680 HydrophobicContact CG-CG 4.37Å; Y629-Q680 PolarHBondContact OH-NE2 2.92Å; S678-Q680 PolarHBondContact O-N 3.29Å; S678-Q680 VanDerWaalsContact O-N 3.12Å; Q680-R682 PolarHBondContact O-N 2.91Å
681	D	81.6	Confident	87.3	Confident	77 Å²	77	46 Å²	46	41%	0.412	25%	0.253	S	S	.	.			trans	-85.8	110.9	-172.4	-169.8	-14.1	0	0	0	110.4	S679 S683 L684 L685	S679-D681 PolarHBondContact OG-O 3.49Å; D681-S683 PolarHBondContact O-N 3.23Å; D681-S683 VanDerWaalsContact O-N 3.15Å; D681-S683 VanDerWaalsContact OD1-CB 3.27Å; D681-S683 WeakPolarHBondContact OD1-CB 3.38Å; D681-S683 PolarHBondContact OD1-N 2.83Å; D681-S683 PolarHBondContact OD1-OG 3.27Å; D681-S683 PolarHBondContact OD2-OG 2.88Å; D681-L684 HydrophobicContact CB-CB 4.24Å; D681-L684 HydrophobicContact CB-CD1 3.97Å; D681-L684 HydrophobicContact CB-CG 3.98Å; D681-L684 PolarHBondContact O-N 3.29Å; D681-L685 PolarHBondContact O-N 3.11Å
682	R	83.4	Confident	87.3	Confident	124 Å²	124	45 Å²	45	47%	0.468	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-27.4	175.8	-179.6	169.2	162.6	-176.7	-16.9	112.3	Q680 L684 D713 E718	Q680-R682 PolarHBondContact O-N 2.91Å; R682-L684 VanDerWaalsContact C-N 3.3Å; R682-L684 PolarHBondContact O-N 2.65Å; R682-D713 PolarHBondContact NH1-O 3.1Å; R682-E718 IonicContact CZ-OE1 2.95Å; R682-E718 VanDerWaalsContact CZ-OE1 3.22Å; R682-E718 IonicContact CZ-OE2 3.51Å; R682-E718 VanDerWaalsContact CZ-OE2 3.3Å; R682-E718 IonicContact NE-OE1 3.09Å; R682-E718 PolarHBondContact NE-OE1 3.12Å; R682-E718 IonicContact NE-OE2 3.68Å; R682-E718 IonicContact NH1-OE2 3.46Å; R682-E718 IonicContact NH2-OE1 2.77Å; R682-E718 PolarHBondContact NH2-OE1 3.39Å; R682-E718 IonicContact NH2-OE2 3.4Å; R682-E718 PolarHBondContact NH2-OE2 2.85Å
683	S	82.2	Confident	87.3	Confident	87 Å²	87	44.7 Å²	44.7	61%	0.608	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-25.1	176.7	76.6	0	0	0	0	113.2	D681	D681-S683 PolarHBondContact O-N 3.23Å; D681-S683 VanDerWaalsContact O-N 3.15Å; D681-S683 VanDerWaalsContact OD1-CB 3.27Å; D681-S683 WeakPolarHBondContact OD1-CB 3.38Å; D681-S683 PolarHBondContact OD1-N 2.83Å; D681-S683 PolarHBondContact OD1-OG 3.27Å; D681-S683 PolarHBondContact OD2-OG 2.88Å
684	L	86.4	Confident	87.2	Confident	80 Å²	80	51.5 Å²	51.5	42%	0.419	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.3	178.8	-61.1	179.2	0	0	0	113.2	D681 R682 A686 L687 E688	D681-L684 HydrophobicContact CB-CB 4.24Å; D681-L684 HydrophobicContact CB-CD1 3.97Å; D681-L684 HydrophobicContact CB-CG 3.98Å; D681-L684 PolarHBondContact O-N 3.29Å; R682-L684 VanDerWaalsContact C-N 3.3Å; R682-L684 PolarHBondContact O-N 2.65Å; L684-A686 PolarHBondContact O-N 3.25Å; L684-A686 VanDerWaalsContact O-N 3.16Å; L684-L687 HydrophobicContact CD2-CD1 3.9Å; L684-L687 WeakPolarHBondContact O-CB 3.41Å; L684-L687 PolarHBondContact O-N 2.77Å; L684-E688 PolarHBondContact O-N 3.14Å
685	L	87.9	Confident	87	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-57.6	-34.9	-177.9	-176	68.2	0	0	0	112.7	D681 L687 E688 V689 I708 I714 L722	D681-L685 PolarHBondContact O-N 3.11Å; L685-L687 PolarHBondContact O-N 3.2Å; L685-E688 PolarHBondContact O-N 3.05Å; L685-V689 HydrophobicContact CD1-CG2 4.15Å; L685-V689 HydrophobicContact CG-CG2 3.91Å; L685-V689 WeakPolarHBondContact O-CB 3.32Å; L685-V689 VanDerWaalsContact O-CG2 3.23Å; L685-V689 WeakPolarHBondContact O-CG2 3.27Å; L685-V689 PolarHBondContact O-N 3.38Å; L685-I708 HydrophobicContact CD2-CG2 4.21Å; L685-I714 HydrophobicContact CD2-CD1 3Å; L685-I714 HydrophobicContact CD2-CG1 4.46Å; L685-I714 HydrophobicContact CG-CD1 4.43Å; L685-L722 HydrophobicContact CD2-CD2 4.11Å; L685-L722 HydrophobicContact CG-CD2 4.43Å
686	A	89	Confident	87.1	Confident	40 Å²	40	52.6 Å²	52.6	33%	0.331	28%	0.276	S	S	.	.	H	α-helix	trans	-59	-32.6	176.6	0	0	0	0	0	112.6	L684 S690 L722 I726	L684-A686 PolarHBondContact O-N 3.25Å; L684-A686 VanDerWaalsContact O-N 3.16Å; A686-S690 WeakPolarHBondContact O-CB 3.3Å; A686-S690 PolarHBondContact O-N 3.19Å; A686-L722 HydrophobicContact CB-CD1 3.92Å; A686-I726 HydrophobicContact CB-CD1 4.34Å; A686-I726 WeakPolarHBondContact O-CD1 3.47Å
687	L	89.6	Confident	86.9	Confident	114 Å²	114	53.7 Å²	53.7	60%	0.597	28%	0.282	S	S	*	.	H	α-helix	trans	-71.6	-43.6	176.4	-62.4	174.1	0	0	0	111.4	L684 L685 S690 S691	L684-L687 HydrophobicContact CD2-CD1 3.9Å; L684-L687 WeakPolarHBondContact O-CB 3.41Å; L684-L687 PolarHBondContact O-N 2.77Å; L685-L687 PolarHBondContact O-N 3.2Å; L687-S690 PolarHBondContact O-N 2.8Å; L687-S691 WeakPolarHBondContact O-CB 3.22Å; L687-S691 PolarHBondContact O-N 3.28Å
688	E	89.1	Confident	86.9	Confident	65 Å²	65	55.4 Å²	55.4	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-65.8	-43.8	177.8	-61.6	-54	153.4	0	0	111.9	M676 L684 L685 S690 S691 F692	M676-E688 HydrophobicContact CG-CB 4.25Å; L684-E688 PolarHBondContact O-N 3.14Å; L685-E688 PolarHBondContact O-N 3.05Å; E688-S690 VanDerWaalsContact C-N 3.3Å; E688-S690 PolarHBondContact O-N 3.38Å; E688-S691 WeakPolarHBondContact O-CB 3.44Å; E688-S691 PolarHBondContact O-N 2.8Å; E688-F692 WeakPolarHBondContact O-CB 3.15Å; E688-F692 PolarHBondContact O-N 3.05Å
689	V	91.4	Very high	87	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-40.8	174.5	177.2	0	0	0	0	110.4	M676 L685 F692 V693 L704 I708 L722 I726	M676-V689 HydrophobicContact CE-CB 4.42Å; M676-V689 HydrophobicContact CE-CG2 3.68Å; L685-V689 HydrophobicContact CD1-CG2 4.15Å; L685-V689 HydrophobicContact CG-CG2 3.91Å; L685-V689 WeakPolarHBondContact O-CB 3.32Å; L685-V689 VanDerWaalsContact O-CG2 3.23Å; L685-V689 WeakPolarHBondContact O-CG2 3.27Å; L685-V689 PolarHBondContact O-N 3.38Å; V689-F692 PolarHBondContact O-N 3.08Å; V689-V693 HydrophobicContact CG1-CG2 4.5Å; V689-V693 WeakPolarHBondContact O-CB 3.43Å; V689-V693 WeakPolarHBondContact O-CG2 3.23Å; V689-V693 PolarHBondContact O-N 3.23Å; V689-L704 HydrophobicContact CG1-CD1 4.12Å; V689-L704 HydrophobicContact CG1-CD2 4Å; V689-L704 HydrophobicContact CG1-CG 4.35Å; V689-I708 HydrophobicContact CG1-CD1 4.12Å; V689-I708 HydrophobicContact CG2-CD1 4.08Å; V689-I708 HydrophobicContact CG2-CG1 4.04Å; V689-L722 HydrophobicContact CG2-CD2 4.32Å; V689-I726 HydrophobicContact CB-CD1 3.53Å; V689-I726 HydrophobicContact CG1-CB 4.35Å; V689-I726 HydrophobicContact CG1-CD1 3.38Å; V689-I726 HydrophobicContact CG1-CG1 4.44Å; V689-I726 HydrophobicContact CG1-CG2 4.19Å
690	S	90.8	Very high	87.3	Confident	29 Å²	29	59 Å²	59	20%	0.203	30%	0.296	C	S	.	.	H	α-helix	trans	-66.1	-39.5	176.2	-173.4	0	0	0	0	112.4	A686 L687 E688 V693 K694 H730	A686-S690 WeakPolarHBondContact O-CB 3.3Å; A686-S690 PolarHBondContact O-N 3.19Å; L687-S690 PolarHBondContact O-N 2.8Å; E688-S690 VanDerWaalsContact C-N 3.3Å; E688-S690 PolarHBondContact O-N 3.38Å; S690-V693 PolarHBondContact O-N 2.83Å; S690-K694 VanDerWaalsContact O-CB 3.28Å; S690-K694 WeakPolarHBondContact O-CB 3.09Å; S690-K694 PolarHBondContact O-N 3.31Å; S690-H730 PolarHBondContact OG-NE2 3.45Å
691	S	89.6	Confident	87.8	Confident	51 Å²	51	54 Å²	54	36%	0.357	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-45.1	173.4	-175.3	0	0	0	0	111.6	L687 E688 K694 K695	L687-S691 WeakPolarHBondContact O-CB 3.22Å; L687-S691 PolarHBondContact O-N 3.28Å; E688-S691 WeakPolarHBondContact O-CB 3.44Å; E688-S691 PolarHBondContact O-N 2.8Å; S691-K694 PolarHBondContact O-N 3.44Å; S691-K695 PolarHBondContact O-N 2.89Å
692	F	90.8	Very high	88.3	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.009	28%	0.277	C	S	.	.	H	α-helix	trans	-61	-51.7	175.2	-177.2	-84.3	0	0	0	111.7	L673 M676 E688 V689 K694 K695 F696 I699 L704 F744	L673-F692 HydrophobicContact CD2-CE2 3.72Å; L673-F692 HydrophobicContact CD2-CZ 3.99Å; L673-F692 HydrophobicContact CG-CE2 3.9Å; L673-F692 HydrophobicContact CG-CZ 4.47Å; M676-F692 HydrophobicContact CG-CB 4.22Å; M676-F692 HydrophobicContact SD-CB 3.44Å; M676-F692 WeakPolarHBondContact SD-CB 3.37Å; M676-F692 HydrophobicContact SD-CD1 4.09Å; M676-F692 HydrophobicContact SD-CD2 3.59Å; M676-F692 VanDerWaalsContact SD-CD2 3.59Å; M676-F692 HydrophobicContact SD-CE2 4.41Å; M676-F692 HydrophobicContact SD-CG 3.42Å; M676-F692 WeakPolarHBondContact SD-CG 3.43Å; E688-F692 WeakPolarHBondContact O-CB 3.15Å; E688-F692 PolarHBondContact O-N 3.05Å; V689-F692 PolarHBondContact O-N 3.08Å; F692-K694 VanDerWaalsContact C-N 3.28Å; F692-K694 PolarHBondContact O-N 2.97Å; F692-K695 PolarHBondContact O-N 3.4Å; F692-K695 VanDerWaalsContact O-N 3.08Å; F692-F696 HydrophobicContact CD1-CB 4.46Å; F692-F696 HydrophobicContact CD1-CD2 4.11Å; F692-F696 AromaticContact CD2-CD2 3.78Å; F692-F696 HydrophobicContact CD2-CD2 3.78Å; F692-F696 HydrophobicContact CD2-CE2 4.07Å; F692-F696 HydrophobicContact CE1-CB 4.04Å; F692-F696 AromaticContact CE1-CD2 3.9Å; F692-F696 HydrophobicContact CE1-CD2 3.9Å; F692-F696 HydrophobicContact CE1-CG 4.39Å; F692-F696 AromaticContact CE2-CD2 3.56Å; F692-F696 HydrophobicContact CE2-CD2 3.56Å; F692-F696 AromaticContact CE2-CE2 3.86Å; F692-F696 HydrophobicContact CE2-CE2 3.86Å; F692-F696 HydrophobicContact CG-CD2 4.04Å; F692-F696 HydrophobicContact CZ-CB 4.36Å; F692-F696 AromaticContact CZ-CD2 3.62Å; F692-F696 HydrophobicContact CZ-CD2 3.62Å; F692-F696 HydrophobicContact CZ-CE2 4.32Å; F692-F696 HydrophobicContact CZ-CG 4.27Å; F692-F696 WeakPolarHBondContact O-CD2 3.45Å; F692-F696 PolarHBondContact O-N 3.15Å; F692-I699 HydrophobicContact CE1-CD1 3.66Å; F692-I699 HydrophobicContact CE1-CG2 4.46Å; F692-I699 HydrophobicContact CZ-CD1 4.3Å; F692-L704 HydrophobicContact CD1-CD1 4.31Å; F692-F744 HydrophobicContact CE1-CE1 4.5Å; F692-F744 HydrophobicContact CZ-CE1 4.27Å; F692-F744 HydrophobicContact CZ-CZ 4.23Å
693	V	90.8	Very high	88.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-40.1	179.8	168.9	0	0	0	0	110.9	V689 S690 K695 F696 L697 I699 L704 I726 L727 H730	V689-V693 HydrophobicContact CG1-CG2 4.5Å; V689-V693 WeakPolarHBondContact O-CB 3.43Å; V689-V693 WeakPolarHBondContact O-CG2 3.23Å; V689-V693 PolarHBondContact O-N 3.23Å; S690-V693 PolarHBondContact O-N 2.83Å; V693-K695 VanDerWaalsContact C-N 3.26Å; V693-K695 PolarHBondContact O-N 3.47Å; V693-F696 CarbonylContact O-C 3.58Å; V693-F696 VanDerWaalsContact O-C 3.24Å; V693-F696 PolarHBondContact O-N 2.9Å; V693-L697 WeakPolarHBondContact O-CA 3.5Å; V693-L697 WeakPolarHBondContact O-CG 3.42Å; V693-L697 PolarHBondContact O-N 3.36Å; V693-I699 HydrophobicContact CG2-CG2 4.44Å; V693-L704 HydrophobicContact CG2-CD2 3.59Å; V693-I726 HydrophobicContact CB-CG2 4.02Å; V693-I726 HydrophobicContact CG1-CG2 4.36Å; V693-I726 HydrophobicContact CG2-CG2 3.9Å; V693-L727 HydrophobicContact CG1-CD2 3.78Å; V693-L727 HydrophobicContact CG2-CD2 4.06Å; V693-L727 HydrophobicContact CG2-CG 4.43Å; V693-H730 HydrophobicContact CG1-CB 3.78Å
694	K	87.2	Confident	89.1	Confident	142 Å²	142	44.6 Å²	44.6	62%	0.617	23%	0.227	S	C	*	.	H	α-helix	trans	-59	-35.7	176.9	-173.9	179.4	178.6	-177.3	0	112.8	S690 S691 F692	S690-K694 VanDerWaalsContact O-CB 3.28Å; S690-K694 WeakPolarHBondContact O-CB 3.09Å; S690-K694 PolarHBondContact O-N 3.31Å; S691-K694 PolarHBondContact O-N 3.44Å; F692-K694 VanDerWaalsContact C-N 3.28Å; F692-K694 PolarHBondContact O-N 2.97Å
695	K	85.5	Confident	89.4	Confident	95 Å²	95	41.1 Å²	41.1	41%	0.413	21%	0.209	S	C	.	.	H	α-helix	trans	-77.9	-33.5	174.1	-64.9	178.3	-171.5	175.7	0	112	S672 S691 F692 V693	S672-K695 PolarHBondContact OG-NZ 3.31Å; S691-K695 PolarHBondContact O-N 2.89Å; F692-K695 PolarHBondContact O-N 3.4Å; F692-K695 VanDerWaalsContact O-N 3.08Å; V693-K695 VanDerWaalsContact C-N 3.26Å; V693-K695 PolarHBondContact O-N 3.47Å
696	F	87.2	Confident	89.5	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.018	21%	0.209	C	C	.	.			trans	-130.9	59	-167.2	-54.1	-60.5	0	0	0	113.6	V668 V669 F692 V693 N698 I699 I740 F744	V668-F696 HydrophobicContact CG1-CZ 4.27Å; V669-F696 HydrophobicContact CB-CZ 4.23Å; V669-F696 HydrophobicContact CG2-CD1 4.15Å; V669-F696 HydrophobicContact CG2-CE1 3.54Å; V669-F696 HydrophobicContact CG2-CE2 4.4Å; V669-F696 HydrophobicContact CG2-CZ 3.68Å; F692-F696 HydrophobicContact CD1-CB 4.46Å; F692-F696 HydrophobicContact CD1-CD2 4.11Å; F692-F696 AromaticContact CD2-CD2 3.78Å; F692-F696 HydrophobicContact CD2-CD2 3.78Å; F692-F696 HydrophobicContact CD2-CE2 4.07Å; F692-F696 HydrophobicContact CE1-CB 4.04Å; F692-F696 AromaticContact CE1-CD2 3.9Å; F692-F696 HydrophobicContact CE1-CD2 3.9Å; F692-F696 HydrophobicContact CE1-CG 4.39Å; F692-F696 AromaticContact CE2-CD2 3.56Å; F692-F696 HydrophobicContact CE2-CD2 3.56Å; F692-F696 AromaticContact CE2-CE2 3.86Å; F692-F696 HydrophobicContact CE2-CE2 3.86Å; F692-F696 HydrophobicContact CG-CD2 4.04Å; F692-F696 HydrophobicContact CZ-CB 4.36Å; F692-F696 AromaticContact CZ-CD2 3.62Å; F692-F696 HydrophobicContact CZ-CD2 3.62Å; F692-F696 HydrophobicContact CZ-CE2 4.32Å; F692-F696 HydrophobicContact CZ-CG 4.27Å; F692-F696 WeakPolarHBondContact O-CD2 3.45Å; F692-F696 PolarHBondContact O-N 3.15Å; V693-F696 CarbonylContact O-C 3.58Å; V693-F696 VanDerWaalsContact O-C 3.24Å; V693-F696 PolarHBondContact O-N 2.9Å; F696-N698 PolarHBondContact O-N 3.06Å; F696-I699 WeakPolarHBondContact O-CG2 3.2Å; F696-I699 PolarHBondContact O-N 2.91Å; F696-I740 HydrophobicContact CD1-CG1 4.39Å; F696-I740 HydrophobicContact CE1-CD1 3.78Å; F696-I740 HydrophobicContact CE1-CG1 4Å; F696-F744 HydrophobicContact CB-CE2 3.62Å; F696-F744 HydrophobicContact CB-CZ 3.51Å; F696-F744 AromaticContact CD1-CE2 3.87Å; F696-F744 HydrophobicContact CD1-CE2 3.87Å; F696-F744 HydrophobicContact CD1-CZ 4.01Å; F696-F744 HydrophobicContact CD2-CZ 4.49Å; F696-F744 AromaticContact CG-CE2 3.96Å; F696-F744 HydrophobicContact CG-CE2 3.96Å; F696-F744 AromaticContact CG-CZ 3.75Å; F696-F744 HydrophobicContact CG-CZ 3.75Å
697	L	84.7	Confident	89.6	Confident	24 Å²	24	39.3 Å²	39.3	13%	0.126	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-12.8	-175.8	-80	135.2	0	0	0	115.7	V693 I699 H730 H733 P734 K735	V693-L697 WeakPolarHBondContact O-CA 3.5Å; V693-L697 WeakPolarHBondContact O-CG 3.42Å; V693-L697 PolarHBondContact O-N 3.36Å; L697-I699 VanDerWaalsContact C-N 3.34Å; L697-H730 HydrophobicContact CD2-CB 3.84Å; L697-H730 WeakPolarHBondContact CD2-O 3.36Å; L697-H733 HydrophobicContact CD1-CB 3.99Å; L697-H733 HydrophobicContact CD2-CB 3.82Å; L697-P734 WeakPolarHBondContact CD1-O 3.42Å; L697-K735 HydrophobicContact CB-CG 4.35Å
698	N	85.7	Confident	89.7	Confident	35 Å²	35	33.9 Å²	33.9	19%	0.187	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.5	-178.9	-66.7	-20.1	0	0	0	114	F696 K735 P736 A741 F744	F696-N698 PolarHBondContact O-N 3.06Å; N698-K735 WeakPolarHBondContact OD1-CB 3.46Å; N698-K735 WeakPolarHBondContact OD1-CD 3.45Å; N698-K735 WeakPolarHBondContact OD1-CG 3.35Å; N698-P736 PolarHBondContact ND2-O 2.8Å; N698-A741 WeakPolarHBondContact ND2-CA 3.36Å; N698-A741 WeakPolarHBondContact ND2-CB 3.19Å; N698-F744 HydrophobicContact CB-CD2 4.31Å
699	I	89.5	Confident	89.7	Confident	8 Å²	8	31.5 Å²	31.5	4%	0.041	16%	0.155	C	C	.	.			trans	-64.8	136.8	176.4	-166.8	166.4	0	0	0	111.7	F692 V693 F696 L697 Q703 L704 I707 L727 F744	F692-I699 HydrophobicContact CE1-CD1 3.66Å; F692-I699 HydrophobicContact CE1-CG2 4.46Å; F692-I699 HydrophobicContact CZ-CD1 4.3Å; V693-I699 HydrophobicContact CG2-CG2 4.44Å; F696-I699 WeakPolarHBondContact O-CG2 3.2Å; F696-I699 PolarHBondContact O-N 2.91Å; L697-I699 VanDerWaalsContact C-N 3.34Å; I699-Q703 HydrophobicContact CD1-CB 4.07Å; I699-Q703 HydrophobicContact CG1-CB 3.71Å; I699-L704 HydrophobicContact CD1-CB 3.99Å; I699-L704 HydrophobicContact CD1-CD1 4.17Å; I699-L704 HydrophobicContact CG1-CB 4.26Å; I699-L704 HydrophobicContact CG2-CB 4.5Å; I699-I707 HydrophobicContact CD1-CD1 3.62Å; I699-L727 HydrophobicContact CG2-CD2 4.05Å; I699-F744 HydrophobicContact CB-CD1 3.83Å; I699-F744 HydrophobicContact CB-CE1 3.98Å; I699-F744 HydrophobicContact CB-CG 4.37Å; I699-F744 HydrophobicContact CD1-CD1 4.23Å; I699-F744 HydrophobicContact CD1-CE1 3.96Å; I699-F744 HydrophobicContact CG1-CD1 3.88Å; I699-F744 HydrophobicContact CG1-CE1 4.07Å
700	R	90.3	Very high	89.6	Confident	126 Å²	126	31.7 Å²	31.7	48%	0.475	16%	0.156	S	C	.	.			trans	-79.1	152.5	175.8	-63.7	178.7	-70.8	179.3	-9	111.1	D702 Q703 L704 F746	R700-D702 PolarHBondContact O-N 3.35Å; R700-Q703 HydrophobicContact CB-CB 4.49Å; R700-Q703 HydrophobicContact CB-CG 4.33Å; R700-Q703 PolarHBondContact O-N 3.38Å; R700-Q703 VanDerWaalsContact O-N 3.14Å; R700-L704 PolarHBondContact O-N 3.33Å; R700-F746 PolarHBondContact NH2-O 3.35Å
701	V	91.9	Very high	89.4	Confident	30 Å²	30	30.5 Å²	30.5	18%	0.182	15%	0.147	C	C	.	.	H	α-helix	trans	-53.3	-43.4	177.1	179.1	0	0	0	0	111.2	L704 T705 A723 L727	V701-L704 PolarHBondContact O-N 2.83Å; V701-T705 WeakPolarHBondContact O-CB 3.45Å; V701-T705 PolarHBondContact O-N 3.1Å; V701-T705 PolarHBondContact O-OG1 3.03Å; V701-A723 HydrophobicContact CG1-CB 4.33Å; V701-L727 HydrophobicContact CB-CD1 4.14Å; V701-L727 HydrophobicContact CG2-CD1 3.57Å
702	D	90.6	Very high	89.3	Confident	86 Å²	86	33 Å²	33	46%	0.46	15%	0.154	S	C	.	.	H	α-helix	trans	-67.5	-40.7	-178.9	-62.7	-52.6	0	0	0	112.4	R700 T705 G706 R720	R700-D702 PolarHBondContact O-N 3.35Å; D702-T705 WeakPolarHBondContact O-CB 3.38Å; D702-T705 PolarHBondContact O-N 2.82Å; D702-G706 PolarHBondContact O-N 3.09Å; D702-R720 IonicContact OD1-CZ 3.23Å; D702-R720 IonicContact OD1-NH1 2.67Å; D702-R720 PolarHBondContact OD1-NH1 3.44Å; D702-R720 IonicContact OD1-NH2 3.43Å; D702-R720 PolarHBondContact OD1-NH2 3.12Å
703	Q	91.3	Very high	89.1	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.023	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-48.3	174.8	-72.9	167.1	-35.1	0	0	111.1	D620 I699 R700 T705 G706 I707 F744 F746	D620-Q703 WeakPolarHBondContact OD1-CA 3.48Å; I699-Q703 HydrophobicContact CD1-CB 4.07Å; I699-Q703 HydrophobicContact CG1-CB 3.71Å; R700-Q703 HydrophobicContact CB-CB 4.49Å; R700-Q703 HydrophobicContact CB-CG 4.33Å; R700-Q703 PolarHBondContact O-N 3.38Å; R700-Q703 VanDerWaalsContact O-N 3.14Å; Q703-T705 VanDerWaalsContact C-N 3.3Å; Q703-T705 PolarHBondContact O-N 3.09Å; Q703-G706 PolarHBondContact O-N 2.8Å; Q703-I707 WeakPolarHBondContact O-CG1 3.23Å; Q703-I707 PolarHBondContact O-N 3.37Å; Q703-I707 VanDerWaalsContact O-N 3.07Å; Q703-F744 PolarHBondContact NE2-O 2.69Å; Q703-F744 VanDerWaalsContact NE2-O 3.08Å; Q703-F746 HydrophobicContact CG-CZ 4.1Å
704	L	92.3	Very high	88.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-63.9	-38.8	178.3	-174	59.7	0	0	0	111.6	M676 V689 F692 V693 I699 R700 V701 G706 I707 I708 A723 L727	M676-L704 HydrophobicContact CE-CD1 4.17Å; V689-L704 HydrophobicContact CG1-CD1 4.12Å; V689-L704 HydrophobicContact CG1-CD2 4Å; V689-L704 HydrophobicContact CG1-CG 4.35Å; F692-L704 HydrophobicContact CD1-CD1 4.31Å; V693-L704 HydrophobicContact CG2-CD2 3.59Å; I699-L704 HydrophobicContact CD1-CB 3.99Å; I699-L704 HydrophobicContact CD1-CD1 4.17Å; I699-L704 HydrophobicContact CG1-CB 4.26Å; I699-L704 HydrophobicContact CG2-CB 4.5Å; R700-L704 PolarHBondContact O-N 3.33Å; V701-L704 PolarHBondContact O-N 2.83Å; L704-G706 VanDerWaalsContact C-N 3.33Å; L704-G706 PolarHBondContact O-N 2.93Å; L704-I707 PolarHBondContact O-N 3.38Å; L704-I708 HydrophobicContact CD1-CD1 4.47Å; L704-I708 HydrophobicContact CG-CD1 4.06Å; L704-I708 WeakPolarHBondContact O-CG1 3.42Å; L704-I708 PolarHBondContact O-N 2.95Å; L704-A723 HydrophobicContact CB-CB 4.13Å; L704-A723 HydrophobicContact CD2-CB 3.89Å; L704-A723 HydrophobicContact CG-CB 3.92Å; L704-L727 HydrophobicContact CD2-CD1 3.92Å; L704-L727 HydrophobicContact CD2-CG 3.94Å
705	T	91.9	Very high	88.8	Confident	6 Å²	6	30.9 Å²	30.9	4%	0.037	16%	0.158	C	C	.	.	H	α-helix	trans	-61.5	-41.2	174.4	-63.7	0	0	0	0	111.4	V701 D702 Q703 Q709 A719 R720	V701-T705 WeakPolarHBondContact O-CB 3.45Å; V701-T705 PolarHBondContact O-N 3.1Å; V701-T705 PolarHBondContact O-OG1 3.03Å; D702-T705 WeakPolarHBondContact O-CB 3.38Å; D702-T705 PolarHBondContact O-N 2.82Å; Q703-T705 VanDerWaalsContact C-N 3.3Å; Q703-T705 PolarHBondContact O-N 3.09Å; T705-Q709 WeakPolarHBondContact O-CB 3.35Å; T705-Q709 VanDerWaalsContact O-CG 3.25Å; T705-Q709 WeakPolarHBondContact O-CG 3.47Å; T705-Q709 PolarHBondContact O-N 2.77Å; T705-A719 HydrophobicContact CG2-CB 4.46Å; T705-R720 HydrophobicContact CG2-CB 3.96Å; T705-R720 HydrophobicContact CG2-CG 4.41Å
706	G	90.4	Very high	88.9	Confident	2 Å²	2	34.6 Å²	34.6	2%	0.021	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-47.1	175.1	0	0	0	0	0	112.3	D702 Q703 L704 Q709 A710	D702-G706 PolarHBondContact O-N 3.09Å; Q703-G706 PolarHBondContact O-N 2.8Å; L704-G706 VanDerWaalsContact C-N 3.33Å; L704-G706 PolarHBondContact O-N 2.93Å; G706-Q709 PolarHBondContact O-N 3.49Å; G706-A710 PolarHBondContact O-N 2.71Å
707	I	91	Very high	89.2	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-50.1	177	-63.2	159.9	0	0	0	110.9	L616 F619 L673 M676 M677 I699 Q703 L704 Q709 A710	L616-I707 HydrophobicContact CD2-CD1 4.21Å; F619-I707 HydrophobicContact CB-CG1 3.69Å; F619-I707 HydrophobicContact CD1-CG1 4.48Å; F619-I707 HydrophobicContact CD2-CG1 4.35Å; F619-I707 HydrophobicContact CG-CG1 3.95Å; L673-I707 HydrophobicContact CD2-CD1 3.58Å; L673-I707 HydrophobicContact CD2-CG1 3.98Å; L673-I707 HydrophobicContact CD2-CG2 3.76Å; M676-I707 HydrophobicContact CE-CG2 3.7Å; M676-I707 HydrophobicContact SD-CG2 4.42Å; M677-I707 HydrophobicContact CE-CG2 3.73Å; M677-I707 WeakPolarHBondContact CE-O 3.21Å; I699-I707 HydrophobicContact CD1-CD1 3.62Å; Q703-I707 WeakPolarHBondContact O-CG1 3.23Å; Q703-I707 PolarHBondContact O-N 3.37Å; Q703-I707 VanDerWaalsContact O-N 3.07Å; L704-I707 PolarHBondContact O-N 3.38Å; I707-Q709 VanDerWaalsContact C-N 3.3Å; I707-Q709 PolarHBondContact O-N 3.32Å; I707-A710 WeakPolarHBondContact O-CB 3.4Å; I707-A710 PolarHBondContact O-N 2.92Å
708	I	91	Very high	89.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-40.2	-178.9	-65.2	164.2	0	0	0	111.1	M676 L685 V689 L704 A710 R711 I714 A719 L722 A723	M676-I708 HydrophobicContact CE-CG1 4.2Å; L685-I708 HydrophobicContact CD2-CG2 4.21Å; V689-I708 HydrophobicContact CG1-CD1 4.12Å; V689-I708 HydrophobicContact CG2-CD1 4.08Å; V689-I708 HydrophobicContact CG2-CG1 4.04Å; L704-I708 HydrophobicContact CD1-CD1 4.47Å; L704-I708 HydrophobicContact CG-CD1 4.06Å; L704-I708 WeakPolarHBondContact O-CG1 3.42Å; L704-I708 PolarHBondContact O-N 2.95Å; I708-A710 VanDerWaalsContact C-N 3.27Å; I708-A710 PolarHBondContact O-N 3.45Å; I708-R711 WeakPolarHBondContact O-CB 3.17Å; I708-R711 PolarHBondContact O-N 3.34Å; I708-I714 HydrophobicContact CG2-CB 4.4Å; I708-I714 HydrophobicContact CG2-CD1 3.95Å; I708-I714 HydrophobicContact CG2-CG2 4.05Å; I708-A719 HydrophobicContact CB-CB 3.98Å; I708-A719 HydrophobicContact CG2-CB 3.55Å; I708-L722 HydrophobicContact CD1-CD2 4.21Å; I708-L722 HydrophobicContact CD1-CG 4.33Å; I708-L722 HydrophobicContact CG2-CD2 4.42Å; I708-A723 HydrophobicContact CD1-CB 4.07Å
709	Q	89.7	Confident	89.8	Confident	16 Å²	16	40 Å²	40	8%	0.075	20%	0.204	C	C	.	.	H	α-helix	trans	-71.3	-19.1	-178.5	-74.5	-176.8	47.5	0	0	114.4	T705 G706 I707 R711 E712 R716 A719	T705-Q709 WeakPolarHBondContact O-CB 3.35Å; T705-Q709 VanDerWaalsContact O-CG 3.25Å; T705-Q709 WeakPolarHBondContact O-CG 3.47Å; T705-Q709 PolarHBondContact O-N 2.77Å; G706-Q709 PolarHBondContact O-N 3.49Å; I707-Q709 VanDerWaalsContact C-N 3.3Å; I707-Q709 PolarHBondContact O-N 3.32Å; Q709-R711 PolarHBondContact O-N 3.19Å; Q709-E712 PolarHBondContact O-N 3.32Å; Q709-R716 VanDerWaalsContact CD-CA 3.47Å; Q709-R716 PolarHBondContact NE2-O 3.33Å; Q709-R716 VanDerWaalsContact NE2-O 3.16Å; Q709-A719 HydrophobicContact CG-CB 3.31Å
710	A	88.9	Confident	90	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.033	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-18	175.1	0	0	0	0	0	112.6	F619 F626 M677 G706 I707 I708	F619-A710 HydrophobicContact CD1-CB 3.71Å; F619-A710 HydrophobicContact CE1-CB 3.82Å; F626-A710 WeakPolarHBondContact CB-O 3.47Å; F626-A710 HydrophobicContact CD2-CB 4.27Å; F626-A710 VanDerWaalsContact CD2-O 3.23Å; F626-A710 WeakPolarHBondContact CD2-O 3.39Å; F626-A710 HydrophobicContact CE2-CB 4.28Å; F626-A710 PolarHBondContact N-O 3.19Å; M677-A710 HydrophobicContact SD-CB 4.46Å; G706-A710 PolarHBondContact O-N 2.71Å; I707-A710 WeakPolarHBondContact O-CB 3.4Å; I707-A710 PolarHBondContact O-N 2.92Å; I708-A710 VanDerWaalsContact C-N 3.27Å; I708-A710 PolarHBondContact O-N 3.45Å
711	R	88.1	Confident	90.1	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.011	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-11.5	-179.4	-64.4	176.1	50.3	102.3	-1.3	115.8	F626 R632 M676 M677 S679 I708 Q709 D713	F626-R711 CarbonylContact O-C 3.49Å; R632-R711 VanDerWaalsContact CZ-CZ 3.43Å; R632-R711 VanDerWaalsContact NH1-CZ 3.33Å; R632-R711 VanDerWaalsContact NH1-NH2 3.15Å; R632-R711 PolarHBondContact NH1-O 3.25Å; M676-R711 PolarHBondContact O-NH1 2.75Å; M677-R711 HydrophobicContact CE-CG 3.86Å; M677-R711 PolarHBondContact O-NH1 2.82Å; M677-R711 HydrophobicContact SD-CG 3.78Å; S679-R711 VanDerWaalsContact O-CZ 3.26Å; S679-R711 PolarHBondContact O-NH1 3.27Å; S679-R711 PolarHBondContact O-NH2 2.82Å; I708-R711 WeakPolarHBondContact O-CB 3.17Å; I708-R711 PolarHBondContact O-N 3.34Å; Q709-R711 PolarHBondContact O-N 3.19Å; R711-D713 WeakPolarHBondContact CB-OD1 3.24Å; R711-D713 IonicContact CZ-OD2 3.65Å; R711-D713 IonicContact NE-OD1 2.82Å; R711-D713 PolarHBondContact NE-OD1 2.84Å; R711-D713 IonicContact NE-OD2 3.73Å; R711-D713 IonicContact NH2-OD1 3.87Å; R711-D713 IonicContact NH2-OD2 3.62Å; R711-D713 PolarHBondContact NH2-OD2 3.49Å; R711-D713 PolarHBondContact O-N 2.87Å
712	E	86.1	Confident	90.2	Very high	105 Å²	105	44.6 Å²	44.6	49%	0.491	23%	0.225	S	C	.	.	S	Bend	trans	52.2	-21	-172.6	-66.9	-152.5	152	0	0	118.1	A625 R627 Q709 I714	A625-E712 HydrophobicContact CB-CG 3.76Å; A625-E712 VanDerWaalsContact CB-OE1 3.24Å; A625-E712 WeakPolarHBondContact CB-OE1 3.48Å; R627-E712 WeakPolarHBondContact CA-OE2 3.36Å; R627-E712 WeakPolarHBondContact CG-OE2 3.25Å; Q709-E712 PolarHBondContact O-N 3.32Å; E712-I714 PolarHBondContact O-N 2.97Å
713	D	86.2	Confident	90.3	Very high	52 Å²	52	40.5 Å²	40.5	28%	0.278	20%	0.203	S	C	.	.	S	Bend	trans	-72.6	-1.8	176.3	65.5	-14.7	0	0	0	114	R632 R682 R711	R632-D713 IonicContact CZ-OD2 3.61Å; R632-D713 IonicContact NH1-OD1 3.19Å; R632-D713 PolarHBondContact NH1-OD1 2.64Å; R632-D713 IonicContact NH1-OD2 3.76Å; R632-D713 PolarHBondContact NH1-OD2 3.15Å; R632-D713 IonicContact NH2-OD2 2.72Å; R682-D713 PolarHBondContact NH1-O 3.1Å; R711-D713 WeakPolarHBondContact CB-OD1 3.24Å; R711-D713 IonicContact CZ-OD2 3.65Å; R711-D713 IonicContact NE-OD1 2.82Å; R711-D713 PolarHBondContact NE-OD1 2.84Å; R711-D713 IonicContact NE-OD2 3.73Å; R711-D713 IonicContact NH2-OD1 3.87Å; R711-D713 IonicContact NH2-OD2 3.62Å; R711-D713 PolarHBondContact NH2-OD2 3.49Å; R711-D713 PolarHBondContact O-N 2.87Å
714	I	86.3	Confident	90.4	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.036	22%	0.216	C	C	.	.	S	Bend	trans	-130.1	121.9	179.9	-64.1	175.6	0	0	0	109.5	L685 I708 E712 E718 A719	L685-I714 HydrophobicContact CD2-CD1 3Å; L685-I714 HydrophobicContact CD2-CG1 4.46Å; L685-I714 HydrophobicContact CG-CD1 4.43Å; I708-I714 HydrophobicContact CG2-CB 4.4Å; I708-I714 HydrophobicContact CG2-CD1 3.95Å; I708-I714 HydrophobicContact CG2-CG2 4.05Å; E712-I714 PolarHBondContact O-N 2.97Å; I714-E718 HydrophobicContact CG2-CB 3.83Å; I714-E718 HydrophobicContact CG2-CG 3.83Å; I714-A719 HydrophobicContact CG2-CB 3.77Å
715	G	86.2	Confident	90.4	Very high	39 Å²	39	46.7 Å²	46.7	40%	0.402	23%	0.234	S	C	.	.			trans	-66.5	160.2	179.3	0	0	0	0	0	112.7	S717 E718 A719	G715-S717 VanDerWaalsContact C-N 3.32Å; G715-S717 PolarHBondContact O-N 2.97Å; G715-E718 PolarHBondContact O-N 2.77Å; G715-E718 VanDerWaalsContact O-N 3.17Å; G715-A719 PolarHBondContact O-N 3.42Å
716	R	88.5	Confident	90.4	Very high	173 Å²	173	46.6 Å²	46.6	65%	0.653	23%	0.233	S	C	*	.	H	α-helix	trans	-56.5	-42.8	-176.6	178.7	174	-170	172.9	3.5	114.2	Q709 R720	Q709-R716 VanDerWaalsContact CD-CA 3.47Å; Q709-R716 PolarHBondContact NE2-O 3.33Å; Q709-R716 VanDerWaalsContact NE2-O 3.16Å; R716-R720 WeakPolarHBondContact O-CB 3.26Å; R716-R720 PolarHBondContact O-N 3.33Å
717	S	91.6	Very high	90.4	Very high	101 Å²	101	47.5 Å²	47.5	71%	0.706	24%	0.237	S	C	*	.	H	α-helix	trans	-66.6	-44.5	178.8	48.6	0	0	0	0	111.5	G715 R720 Q721	G715-S717 VanDerWaalsContact C-N 3.32Å; G715-S717 PolarHBondContact O-N 2.97Å; S717-R720 PolarHBondContact O-N 2.72Å; S717-Q721 WeakPolarHBondContact O-CB 3.46Å; S717-Q721 PolarHBondContact O-N 3.43Å
718	E	92.5	Very high	90.4	Very high	75 Å²	75	50.6 Å²	50.6	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-65.6	-43.7	-179.4	-173.8	-179.5	-172.9	0	0	111.8	R682 I714 G715 R720 Q721 L722	R682-E718 IonicContact CZ-OE1 2.95Å; R682-E718 VanDerWaalsContact CZ-OE1 3.22Å; R682-E718 IonicContact CZ-OE2 3.51Å; R682-E718 VanDerWaalsContact CZ-OE2 3.3Å; R682-E718 IonicContact NE-OE1 3.09Å; R682-E718 PolarHBondContact NE-OE1 3.12Å; R682-E718 IonicContact NE-OE2 3.68Å; R682-E718 IonicContact NH1-OE2 3.46Å; R682-E718 IonicContact NH2-OE1 2.77Å; R682-E718 PolarHBondContact NH2-OE1 3.39Å; R682-E718 IonicContact NH2-OE2 3.4Å; R682-E718 PolarHBondContact NH2-OE2 2.85Å; I714-E718 HydrophobicContact CG2-CB 3.83Å; I714-E718 HydrophobicContact CG2-CG 3.83Å; G715-E718 PolarHBondContact O-N 2.77Å; G715-E718 VanDerWaalsContact O-N 3.17Å; E718-R720 VanDerWaalsContact C-N 3.34Å; E718-R720 PolarHBondContact O-N 3.3Å; E718-Q721 PolarHBondContact O-N 3.29Å; E718-L722 WeakPolarHBondContact O-CB 3.35Å; E718-L722 PolarHBondContact O-N 2.84Å
719	A	91.4	Very high	90.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-40.9	176	0	0	0	0	0	112.5	T705 I708 Q709 I714 G715 A723	T705-A719 HydrophobicContact CG2-CB 4.46Å; I708-A719 HydrophobicContact CB-CB 3.98Å; I708-A719 HydrophobicContact CG2-CB 3.55Å; Q709-A719 HydrophobicContact CG-CB 3.31Å; I714-A719 HydrophobicContact CG2-CB 3.77Å; G715-A719 PolarHBondContact O-N 3.42Å; A719-A723 VanDerWaalsContact O-CB 3.3Å; A719-A723 WeakPolarHBondContact O-CB 3.38Å; A719-A723 PolarHBondContact O-N 3.31Å
720	R	93.1	Very high	90.1	Very high	119 Å²	119	56.9 Å²	56.9	45%	0.449	28%	0.283	S	S	.	.	H	α-helix	trans	-67	-40.8	177.6	-168.2	179	-174.8	99.7	4.6	111.3	D702 T705 R716 S717 E718 Q724	D702-R720 IonicContact OD1-CZ 3.23Å; D702-R720 IonicContact OD1-NH1 2.67Å; D702-R720 PolarHBondContact OD1-NH1 3.44Å; D702-R720 IonicContact OD1-NH2 3.43Å; D702-R720 PolarHBondContact OD1-NH2 3.12Å; T705-R720 HydrophobicContact CG2-CB 3.96Å; T705-R720 HydrophobicContact CG2-CG 4.41Å; R716-R720 WeakPolarHBondContact O-CB 3.26Å; R716-R720 PolarHBondContact O-N 3.33Å; S717-R720 PolarHBondContact O-N 2.72Å; E718-R720 VanDerWaalsContact C-N 3.34Å; E718-R720 PolarHBondContact O-N 3.3Å; R720-Q724 WeakPolarHBondContact O-CB 3.39Å; R720-Q724 PolarHBondContact O-N 3.41Å
721	Q	93.7	Very high	89.6	Confident	107 Å²	107	63.2 Å²	63.2	50%	0.5	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-48.3	176.1	-171.9	61.6	45.4	0	0	110.9	S717 E718 A723 Q724 D725	S717-Q721 WeakPolarHBondContact O-CB 3.46Å; S717-Q721 PolarHBondContact O-N 3.43Å; E718-Q721 PolarHBondContact O-N 3.29Å; Q721-A723 PolarHBondContact O-N 2.87Å; Q721-Q724 PolarHBondContact O-N 3.33Å; Q721-D725 VanDerWaalsContact NE2-CG 3.28Å; Q721-D725 PolarHBondContact NE2-OD1 2.81Å; Q721-D725 PolarHBondContact NE2-OD2 3.31Å; Q721-D725 VanDerWaalsContact NE2-OD2 3.13Å; Q721-D725 WeakPolarHBondContact O-CB 3.49Å; Q721-D725 VanDerWaalsContact O-CG 3.23Å; Q721-D725 PolarHBondContact O-N 2.78Å
722	L	92.6	Very high	89.2	Confident	36 Å²	36	71.3 Å²	71.3	19%	0.188	35%	0.353	C	S	.	.	H	α-helix	trans	-59	-45.2	177.2	-177.9	62	0	0	0	112.1	L685 A686 V689 I708 E718 I726	L685-L722 HydrophobicContact CD2-CD2 4.11Å; L685-L722 HydrophobicContact CG-CD2 4.43Å; A686-L722 HydrophobicContact CB-CD1 3.92Å; V689-L722 HydrophobicContact CG2-CD2 4.32Å; I708-L722 HydrophobicContact CD1-CD2 4.21Å; I708-L722 HydrophobicContact CD1-CG 4.33Å; I708-L722 HydrophobicContact CG2-CD2 4.42Å; E718-L722 WeakPolarHBondContact O-CB 3.35Å; E718-L722 PolarHBondContact O-N 2.84Å; L722-I726 HydrophobicContact CD1-CD1 3.57Å; L722-I726 HydrophobicContact CD1-CG1 4.2Å; L722-I726 HydrophobicContact CG-CD1 3.98Å; L722-I726 WeakPolarHBondContact O-CB 3.45Å; L722-I726 WeakPolarHBondContact O-CG1 3.35Å; L722-I726 PolarHBondContact O-N 2.68Å; L722-I726 VanDerWaalsContact O-N 3.09Å
723	A	93	Very high	88.9	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-45.4	176.2	0	0	0	0	0	111.8	V701 L704 I708 A719 Q721 L727	V701-A723 HydrophobicContact CG1-CB 4.33Å; L704-A723 HydrophobicContact CB-CB 4.13Å; L704-A723 HydrophobicContact CD2-CB 3.89Å; L704-A723 HydrophobicContact CG-CB 3.92Å; I708-A723 HydrophobicContact CD1-CB 4.07Å; A719-A723 VanDerWaalsContact O-CB 3.3Å; A719-A723 WeakPolarHBondContact O-CB 3.38Å; A719-A723 PolarHBondContact O-N 3.31Å; Q721-A723 PolarHBondContact O-N 2.87Å; A723-L727 VanDerWaalsContact O-CB 3.31Å; A723-L727 WeakPolarHBondContact O-CB 3.26Å; A723-L727 WeakPolarHBondContact O-CD1 3.39Å; A723-L727 VanDerWaalsContact O-CG 3.31Å; A723-L727 WeakPolarHBondContact O-CG 3.22Å; A723-L727 PolarHBondContact O-N 3.31Å
724	Q	93.4	Very high	88.4	Confident	64 Å²	64	73.6 Å²	73.6	30%	0.299	37%	0.371	S	S	.	.	H	α-helix	trans	-65.4	-47	179.4	-170.1	67.1	58.9	0	0	111.6	R720 Q721 I726 L727 D728	R720-Q724 WeakPolarHBondContact O-CB 3.39Å; R720-Q724 PolarHBondContact O-N 3.41Å; Q721-Q724 PolarHBondContact O-N 3.33Å; Q724-I726 VanDerWaalsContact C-N 3.35Å; Q724-I726 PolarHBondContact O-N 3.24Å; Q724-L727 PolarHBondContact O-N 3.49Å; Q724-D728 PolarHBondContact NE2-OD1 3.04Å; Q724-D728 WeakPolarHBondContact O-CB 3.48Å; Q724-D728 PolarHBondContact O-N 2.92Å
725	D	92.7	Very high	87.8	Confident	70 Å²	70	80.1 Å²	80.1	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-42.7	-177.4	-70.1	-21.1	0	0	0	111.5	Q721 D728 Q729	Q721-D725 VanDerWaalsContact NE2-CG 3.28Å; Q721-D725 PolarHBondContact NE2-OD1 2.81Å; Q721-D725 PolarHBondContact NE2-OD2 3.31Å; Q721-D725 VanDerWaalsContact NE2-OD2 3.13Å; Q721-D725 WeakPolarHBondContact O-CB 3.49Å; Q721-D725 VanDerWaalsContact O-CG 3.23Å; Q721-D725 PolarHBondContact O-N 2.78Å; D725-D728 PolarHBondContact O-N 3.23Å; D725-Q729 VanDerWaalsContact O-CG 3.24Å; D725-Q729 WeakPolarHBondContact O-CG 3.18Å; D725-Q729 PolarHBondContact O-N 3.36Å
726	I	92.4	Very high	87	Confident	4 Å²	4	80.1 Å²	80.1	2%	0.021	39%	0.392	C	S	.	.	H	α-helix	trans	-71.4	-44.8	179.3	-67.7	174.9	0	0	0	111	A686 V689 V693 L722 Q724 D728 Q729 H730	A686-I726 HydrophobicContact CB-CD1 4.34Å; A686-I726 WeakPolarHBondContact O-CD1 3.47Å; V689-I726 HydrophobicContact CB-CD1 3.53Å; V689-I726 HydrophobicContact CG1-CB 4.35Å; V689-I726 HydrophobicContact CG1-CD1 3.38Å; V689-I726 HydrophobicContact CG1-CG1 4.44Å; V689-I726 HydrophobicContact CG1-CG2 4.19Å; V693-I726 HydrophobicContact CB-CG2 4.02Å; V693-I726 HydrophobicContact CG1-CG2 4.36Å; V693-I726 HydrophobicContact CG2-CG2 3.9Å; L722-I726 HydrophobicContact CD1-CD1 3.57Å; L722-I726 HydrophobicContact CD1-CG1 4.2Å; L722-I726 HydrophobicContact CG-CD1 3.98Å; L722-I726 WeakPolarHBondContact O-CB 3.45Å; L722-I726 WeakPolarHBondContact O-CG1 3.35Å; L722-I726 PolarHBondContact O-N 2.68Å; L722-I726 VanDerWaalsContact O-N 3.09Å; Q724-I726 VanDerWaalsContact C-N 3.35Å; Q724-I726 PolarHBondContact O-N 3.24Å; I726-D728 PolarHBondContact O-N 2.7Å; I726-Q729 WeakPolarHBondContact O-CB 3.27Å; I726-Q729 PolarHBondContact O-N 2.9Å; I726-H730 PolarHBondContact O-CD2 2.89Å; I726-H730 PolarHBondContact O-N 3.03Å; I726-H730 VanDerWaalsContact O-N 3.13Å
727	L	90.6	Very high	85.9	Confident	21 Å²	21	78.4 Å²	78.4	11%	0.11	40%	0.401	C	S	.	.	H	α-helix	trans	-61.1	-35.9	175.6	-76	166.7	0	0	0	111.3	V693 I699 V701 L704 A723 Q724 H730 K731	V693-L727 HydrophobicContact CG1-CD2 3.78Å; V693-L727 HydrophobicContact CG2-CD2 4.06Å; V693-L727 HydrophobicContact CG2-CG 4.43Å; I699-L727 HydrophobicContact CG2-CD2 4.05Å; V701-L727 HydrophobicContact CB-CD1 4.14Å; V701-L727 HydrophobicContact CG2-CD1 3.57Å; L704-L727 HydrophobicContact CD2-CD1 3.92Å; L704-L727 HydrophobicContact CD2-CG 3.94Å; A723-L727 VanDerWaalsContact O-CB 3.31Å; A723-L727 WeakPolarHBondContact O-CB 3.26Å; A723-L727 WeakPolarHBondContact O-CD1 3.39Å; A723-L727 VanDerWaalsContact O-CG 3.31Å; A723-L727 WeakPolarHBondContact O-CG 3.22Å; A723-L727 PolarHBondContact O-N 3.31Å; Q724-L727 PolarHBondContact O-N 3.49Å; L727-H730 CarbonylContact O-C 3.58Å; L727-H730 PolarHBondContact O-N 2.94Å; L727-K731 WeakPolarHBondContact O-CG 3.04Å; L727-K731 PolarHBondContact O-N 2.94Å
728	D	89.8	Confident	85	Confident	66 Å²	66	75.8 Å²	75.8	35%	0.353	39%	0.39	S	S	.	.	H	α-helix	trans	-67.5	-40.2	176.6	-79.6	20.6	0	0	0	112.9	Q724 D725 I726 H730 K731	Q724-D728 PolarHBondContact NE2-OD1 3.04Å; Q724-D728 WeakPolarHBondContact O-CB 3.48Å; Q724-D728 PolarHBondContact O-N 2.92Å; D725-D728 PolarHBondContact O-N 3.23Å; I726-D728 PolarHBondContact O-N 2.7Å; D728-H730 PolarHBondContact O-N 3.49Å; D728-K731 HydrophobicContact CB-CD 4.34Å; D728-K731 WeakPolarHBondContact O-CB 3.28Å; D728-K731 PolarHBondContact O-N 3.48Å; D728-K731 WeakPolarHBondContact OD1-CE 3.42Å; D728-K731 IonicContact OD1-NZ 2.65Å; D728-K731 PolarHBondContact OD1-NZ 3.27Å; D728-K731 IonicContact OD2-NZ 3.94Å; D728-K731 PolarHBondContact OD2-NZ 3.47Å
729	Q	88.7	Confident	84.2	Confident	133 Å²	133	76.7 Å²	76.7	62%	0.621	39%	0.39	S	S	*	.	H	α-helix	trans	-59	-32.8	171.4	-73.2	167.6	20.8	0	0	111.8	D725 I726	D725-Q729 VanDerWaalsContact O-CG 3.24Å; D725-Q729 WeakPolarHBondContact O-CG 3.18Å; D725-Q729 PolarHBondContact O-N 3.36Å; I726-Q729 WeakPolarHBondContact O-CB 3.27Å; I726-Q729 PolarHBondContact O-N 2.9Å
730	H	86.3	Confident	83.5	Confident	16 Å²	16	77.2 Å²	77.2	7%	0.074	39%	0.393	C	S	.	.	H	α-helix	trans	-97.3	-0.1	-176.6	-73.2	-74.3	0	0	0	115.1	S690 V693 L697 I726 L727 D728 L732 H733	S690-H730 PolarHBondContact OG-NE2 3.45Å; V693-H730 HydrophobicContact CG1-CB 3.78Å; L697-H730 HydrophobicContact CD2-CB 3.84Å; L697-H730 WeakPolarHBondContact CD2-O 3.36Å; I726-H730 PolarHBondContact O-CD2 2.89Å; I726-H730 PolarHBondContact O-N 3.03Å; I726-H730 VanDerWaalsContact O-N 3.13Å; L727-H730 CarbonylContact O-C 3.58Å; L727-H730 PolarHBondContact O-N 2.94Å; D728-H730 PolarHBondContact O-N 3.49Å; H730-L732 PolarHBondContact O-N 2.99Å; H730-H733 AromaticContact ND1-CD2 3.23Å; H730-H733 PolarHBondContact ND1-CD2 3.43Å; H730-H733 AromaticContact ND1-NE2 3.72Å; H730-H733 WeakPolarHBondContact O-CB 3.36Å; H730-H733 PolarHBondContact O-N 2.94Å
731	K	78.9	Confident	82.8	Confident	137 Å²	137	72.1 Å²	72.1	60%	0.596	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-29.1	-177.7	-90.2	173.2	177.2	164.6	0	114.7	L727 D728	L727-K731 WeakPolarHBondContact O-CG 3.04Å; L727-K731 PolarHBondContact O-N 2.94Å; D728-K731 HydrophobicContact CB-CD 4.34Å; D728-K731 WeakPolarHBondContact O-CB 3.28Å; D728-K731 PolarHBondContact O-N 3.48Å; D728-K731 WeakPolarHBondContact OD1-CE 3.42Å; D728-K731 IonicContact OD1-NZ 2.65Å; D728-K731 PolarHBondContact OD1-NZ 3.27Å; D728-K731 IonicContact OD2-NZ 3.94Å; D728-K731 PolarHBondContact OD2-NZ 3.47Å
732	L	79.4	Confident	82.3	Confident	173 Å²	173	70.3 Å²	70.3	91%	0.906	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.2	-177.4	-65.3	172.5	0	0	0	113.6	H730	H730-L732 PolarHBondContact O-N 2.99Å
733	H	79.8	Confident	82	Confident	94 Å²	94	68.6 Å²	68.6	44%	0.435	36%	0.358	S	S	.	.	S	Bend	trans	-75.9	142.2	176.9	-77.4	-71.6	0	0	0	111.2	L697 H730 K735	L697-H733 HydrophobicContact CD1-CB 3.99Å; L697-H733 HydrophobicContact CD2-CB 3.82Å; H730-H733 AromaticContact ND1-CD2 3.23Å; H730-H733 PolarHBondContact ND1-CD2 3.43Å; H730-H733 AromaticContact ND1-NE2 3.72Å; H730-H733 WeakPolarHBondContact O-CB 3.36Å; H730-H733 PolarHBondContact O-N 2.94Å; H733-K735 PolarHBondContact O-N 2.96Å
734	P	76.5	Confident	81.7	Confident	111 Å²	111	68.7 Å²	68.7	72%	0.721	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-62.6	124	177.4	24.2	-30.9	0	0	0	109.7	L697	L697-P734 WeakPolarHBondContact CD1-O 3.42Å
735	K	72.1	Confident	81.2	Confident	144 Å²	144	71.4 Å²	71.4	63%	0.626	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-62.6	136.3	176.4	-71.6	-179.7	171.3	-167.5	0	109.8	L697 N698 H733 T737	L697-K735 HydrophobicContact CB-CG 4.35Å; N698-K735 WeakPolarHBondContact OD1-CB 3.46Å; N698-K735 WeakPolarHBondContact OD1-CD 3.45Å; N698-K735 WeakPolarHBondContact OD1-CG 3.35Å; H733-K735 PolarHBondContact O-N 2.96Å; K735-T737 PolarHBondContact O-N 3.24Å
736	P	69.6	Low	80.7	Confident	38 Å²	38	71.5 Å²	71.5	25%	0.247	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-60.9	136.6	175.2	24.2	-30	0	0	0	109.6	N698 I740 A741	N698-P736 PolarHBondContact ND2-O 2.8Å; P736-I740 HydrophobicContact CB-CG2 4.4Å; P736-A741 WeakPolarHBondContact O-CB 3.43Å
737	T	65.9	Low	80.1	Confident	138 Å²	138	74.9 Å²	74.9	85%	0.847	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-103.6	142.9	173	53	0	0	0	0	109.3	K735	K735-T737 PolarHBondContact O-N 3.24Å
738	G	73.1	Confident	79.6	Confident	45 Å²	45	77.7 Å²	77.7	46%	0.464	41%	0.405	S	S	.	.	S	Bend	trans	120.9	-173.6	179.4	0	0	0	0	0	112.5	I740 A741	G738-I740 VanDerWaalsContact C-N 3.29Å; G738-I740 PolarHBondContact O-N 3.44Å; G738-A741 WeakPolarHBondContact O-CB 3.49Å; G738-A741 PolarHBondContact O-N 3.16Å; G738-A741 VanDerWaalsContact O-N 3.07Å
739	R	74.8	Confident	79	Confident	94 Å²	94	78.3 Å²	78.3	36%	0.355	41%	0.408	S	S	.	.	H	α-helix	trans	-67.1	-27.4	-172.2	-67.2	-74.3	-153.5	-173.6	6.3	113.4	D602 L605 A741 E742	D602-R739 IonicContact OD1-CZ 3.58Å; D602-R739 IonicContact OD1-NH2 3.41Å; D602-R739 PolarHBondContact OD1-NH2 3.26Å; L605-R739 HydrophobicContact CD2-CB 3.94Å; L605-R739 HydrophobicContact CD2-CG 3.62Å; R739-A741 PolarHBondContact O-N 2.99Å; R739-E742 WeakPolarHBondContact CD-OE2 3.24Å; R739-E742 IonicContact CZ-OE2 3.92Å; R739-E742 IonicContact NE-OE2 3.89Å; R739-E742 IonicContact NH1-OE1 3.85Å; R739-E742 IonicContact NH1-OE2 2.64Å; R739-E742 PolarHBondContact NH1-OE2 2.99Å; R739-E742 WeakPolarHBondContact O-CB 3.35Å; R739-E742 PolarHBondContact O-N 2.97Å
740	I	77.7	Confident	78.4	Confident	12 Å²	12	75.1 Å²	75.1	6%	0.062	40%	0.395	C	S	.	.	H	α-helix	trans	-63.2	-27.3	173.7	-151.6	162.4	0	0	0	112.8	E664 L666 F696 P736 G738 E742	E664-I740 HydrophobicContact CG-CD1 4.28Å; E664-I740 WeakPolarHBondContact OE1-CD1 3.44Å; L666-I740 HydrophobicContact CD2-CB 4.11Å; L666-I740 HydrophobicContact CD2-CG1 4.08Å; F696-I740 HydrophobicContact CD1-CG1 4.39Å; F696-I740 HydrophobicContact CE1-CD1 3.78Å; F696-I740 HydrophobicContact CE1-CG1 4Å; P736-I740 HydrophobicContact CB-CG2 4.4Å; G738-I740 VanDerWaalsContact C-N 3.29Å; G738-I740 PolarHBondContact O-N 3.44Å; I740-E742 VanDerWaalsContact C-N 3.34Å
741	A	77.7	Confident	77.9	Confident	12 Å²	12	78.8 Å²	78.8	10%	0.099	42%	0.415	C	S	.	.	H	α-helix	trans	-66.8	-36.4	173.9	0	0	0	0	0	112.2	N698 P736 G738 R739 V743	N698-A741 WeakPolarHBondContact ND2-CA 3.36Å; N698-A741 WeakPolarHBondContact ND2-CB 3.19Å; P736-A741 WeakPolarHBondContact O-CB 3.43Å; G738-A741 WeakPolarHBondContact O-CB 3.49Å; G738-A741 PolarHBondContact O-N 3.16Å; G738-A741 VanDerWaalsContact O-N 3.07Å; R739-A741 PolarHBondContact O-N 2.99Å; A741-V743 VanDerWaalsContact C-N 3.27Å; A741-V743 PolarHBondContact O-N 2.78Å
742	E	83.7	Confident	77.9	Confident	68 Å²	68	74.9 Å²	74.9	32%	0.318	40%	0.403	S	S	.	.	H	α-helix	trans	-75.1	-18.4	-174.6	-62.5	176.4	-177.1	0	0	112.2	M609 Q613 R739 I740 F744 N745	M609-E742 HydrophobicContact SD-CB 3.8Å; Q613-E742 PolarHBondContact NE2-O 3.43Å; R739-E742 WeakPolarHBondContact CD-OE2 3.24Å; R739-E742 IonicContact CZ-OE2 3.92Å; R739-E742 IonicContact NE-OE2 3.89Å; R739-E742 IonicContact NH1-OE1 3.85Å; R739-E742 IonicContact NH1-OE2 2.64Å; R739-E742 PolarHBondContact NH1-OE2 2.99Å; R739-E742 WeakPolarHBondContact O-CB 3.35Å; R739-E742 PolarHBondContact O-N 2.97Å; I740-E742 VanDerWaalsContact C-N 3.34Å; E742-F744 PolarHBondContact O-N 2.98Å; E742-F744 VanDerWaalsContact O-N 3.1Å; E742-N745 WeakPolarHBondContact O-CB 3.31Å; E742-N745 PolarHBondContact O-N 2.9Å
743	V	85.9	Confident	77.7	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.4	177.5	-179	0	0	0	0	112.2	M609 V612 Q613 L616 L666 V669 A741 F746	M609-V743 HydrophobicContact CG-CG2 4.15Å; V612-V743 HydrophobicContact CB-CG1 4.28Å; V612-V743 HydrophobicContact CG1-CG1 3.6Å; Q613-V743 HydrophobicContact CG-CG1 4.41Å; Q613-V743 WeakPolarHBondContact CG-O 3.36Å; L616-V743 HydrophobicContact CD1-CG1 3.71Å; L666-V743 HydrophobicContact CB-CG2 4.49Å; L666-V743 HydrophobicContact CD1-CG2 4.09Å; L666-V743 HydrophobicContact CD2-CG2 3.94Å; L666-V743 HydrophobicContact CG-CG2 4.41Å; V669-V743 HydrophobicContact CG2-CG1 4.42Å; A741-V743 VanDerWaalsContact C-N 3.27Å; A741-V743 PolarHBondContact O-N 2.78Å; V743-F746 WeakPolarHBondContact O-CD1 2.96Å
744	F	86.3	Confident	77.6	Confident	3 Å²	3	65.9 Å²	65.9	1%	0.013	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-3.9	-179.3	-60.7	-80.6	0	0	0	114.4	L616 V669 F692 F696 N698 I699 Q703 E742 F746	L616-F744 HydrophobicContact CD1-CD1 3.82Å; L616-F744 HydrophobicContact CD1-CE1 3.63Å; L616-F744 HydrophobicContact CD1-CZ 4.32Å; L616-F744 HydrophobicContact CD2-CE1 4.07Å; V669-F744 HydrophobicContact CG1-CZ 4.42Å; F692-F744 HydrophobicContact CE1-CE1 4.5Å; F692-F744 HydrophobicContact CZ-CE1 4.27Å; F692-F744 HydrophobicContact CZ-CZ 4.23Å; F696-F744 HydrophobicContact CB-CE2 3.62Å; F696-F744 HydrophobicContact CB-CZ 3.51Å; F696-F744 AromaticContact CD1-CE2 3.87Å; F696-F744 HydrophobicContact CD1-CE2 3.87Å; F696-F744 HydrophobicContact CD1-CZ 4.01Å; F696-F744 HydrophobicContact CD2-CZ 4.49Å; F696-F744 AromaticContact CG-CE2 3.96Å; F696-F744 HydrophobicContact CG-CE2 3.96Å; F696-F744 AromaticContact CG-CZ 3.75Å; F696-F744 HydrophobicContact CG-CZ 3.75Å; N698-F744 HydrophobicContact CB-CD2 4.31Å; I699-F744 HydrophobicContact CB-CD1 3.83Å; I699-F744 HydrophobicContact CB-CE1 3.98Å; I699-F744 HydrophobicContact CB-CG 4.37Å; I699-F744 HydrophobicContact CD1-CD1 4.23Å; I699-F744 HydrophobicContact CD1-CE1 3.96Å; I699-F744 HydrophobicContact CG1-CD1 3.88Å; I699-F744 HydrophobicContact CG1-CE1 4.07Å; Q703-F744 PolarHBondContact NE2-O 2.69Å; Q703-F744 VanDerWaalsContact NE2-O 3.08Å; E742-F744 PolarHBondContact O-N 2.98Å; E742-F744 VanDerWaalsContact O-N 3.1Å; F744-F746 PolarHBondContact O-N 2.7Å
745	N	82.9	Confident	77.7	Confident	121 Å²	121	62.2 Å²	62.2	65%	0.647	33%	0.332	S	S	*	.			trans	-88.2	79.4	-179.7	-67.1	-22.7	0	0	0	110.7	E742	E742-N745 WeakPolarHBondContact O-CB 3.31Å; E742-N745 PolarHBondContact O-N 2.9Å
746	F	82.5	Confident	78.2	Confident	71 Å²	71	54.7 Å²	54.7	31%	0.311	31%	0.306	S	S	.	.			trans	-143.2	0	179.3	67.3	-105.8	0	0	0	115	Q613 L616 K617 D620 R700 Q703 V743 F744	Q613-F746 HydrophobicContact CB-CD1 4.43Å; Q613-F746 HydrophobicContact CG-CD1 4.07Å; L616-F746 HydrophobicContact CB-CE1 3.51Å; L616-F746 HydrophobicContact CB-CZ 3.6Å; L616-F746 HydrophobicContact CD1-CE1 3.96Å; L616-F746 HydrophobicContact CG-CE1 4.4Å; K617-F746 HydrophobicContact CB-CE2 4.3Å; K617-F746 HydrophobicContact CD-CD2 4.09Å; K617-F746 HydrophobicContact CD-CG 4.47Å; K617-F746 HydrophobicContact CG-CD2 3.31Å; K617-F746 HydrophobicContact CG-CE2 3.43Å; K617-F746 VanDerWaalsContact CG-CE2 3.43Å; K617-F746 HydrophobicContact CG-CG 3.96Å; K617-F746 HydrophobicContact CG-CZ 4.13Å; D620-F746 HydrophobicContact CB-CE2 4.49Å; R700-F746 PolarHBondContact NH2-O 3.35Å; Q703-F746 HydrophobicContact CG-CZ 4.1Å; V743-F746 WeakPolarHBondContact O-CD1 2.96Å; F744-F746 PolarHBondContact O-N 2.7Å

Retrieved 746 of 746 residues in 350.9 ms (Link to these results)

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