A0A077Z4T1_TRITR Loading...

Innexin

Structural component of the gap junctions.

AlphaFold DB , UniProt , Accession A0A077Z4T1, Species TRITR (Trichuris trichiura, Whipworm), Gene inx, Length 541 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	48.4	Very low	67	Low	194 Å²	194	117.1 Å²	117.1	96%	0.956	64%	0.637	S	S	*	*				0	-56.4	0	-103.6	-160.2	-94	0	0	112.5	A3 V4 I5	M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.11Å; M1-V4 PolarHBondContact O-N 3.3Å; M1-I5 WeakPolarHBondContact O-CG1 3.5Å; M1-I5 PolarHBondContact O-N 2.94Å
2	L	62.2	Low	66.3	Low	138 Å²	138	124.3 Å²	124.3	72%	0.723	65%	0.65	S	S	*	*	H	α-helix	trans	-52	-42.3	179.1	-116.4	147.9	0	0	0	114.2	I5 L6	L2-I5 PolarHBondContact O-N 2.7Å; L2-L6 HydrophobicContact CD2-CD1 4.21Å; L2-L6 WeakPolarHBondContact O-CB 3.42Å; L2-L6 PolarHBondContact O-N 2.87Å
3	A	70.5	Confident	65.6	Low	74 Å²	74	119 Å²	119	61%	0.612	64%	0.644	S	S	*	*	H	α-helix	trans	-66.9	-35.7	176.5	0	0	0	0	0	113.8	M1 L6 H7	M1-A3 VanDerWaalsContact C-N 3.31Å; M1-A3 PolarHBondContact O-N 3.11Å; A3-L6 PolarHBondContact O-N 3.11Å; A3-H7 WeakPolarHBondContact O-CB 3.49Å; A3-H7 PolarHBondContact O-N 3.41Å
4	V	75.2	Confident	64.9	Low	108 Å²	108	124.1 Å²	124.1	66%	0.655	66%	0.658	S	S	*	*	H	α-helix	trans	-71.7	-39	177.5	178.5	0	0	0	0	110.3	M1 H7 A8	M1-V4 PolarHBondContact O-N 3.3Å; V4-H7 PolarHBondContact O-N 2.7Å; V4-A8 WeakPolarHBondContact O-CB 3.47Å; V4-A8 PolarHBondContact O-N 3.48Å
5	I	69	Low	64.2	Low	94 Å²	94	129.2 Å²	129.2	48%	0.482	67%	0.667	S	S	.	*	H	α-helix	trans	-65	-44.4	174.3	-64.3	168.4	0	0	0	110.1	M1 L2 H7 A8 L9	M1-I5 WeakPolarHBondContact O-CG1 3.5Å; M1-I5 PolarHBondContact O-N 2.94Å; L2-I5 PolarHBondContact O-N 2.7Å; I5-H7 VanDerWaalsContact C-N 3.33Å; I5-H7 PolarHBondContact O-N 3.06Å; I5-A8 PolarHBondContact O-N 3.3Å; I5-L9 HydrophobicContact CG2-CD1 3.83Å; I5-L9 HydrophobicContact CG2-CG 4.33Å; I5-L9 WeakPolarHBondContact O-CB 3.29Å; I5-L9 WeakPolarHBondContact O-CG 3.16Å; I5-L9 PolarHBondContact O-N 2.92Å
6	L	75.9	Confident	63.3	Low	109 Å²	109	130.2 Å²	130.2	57%	0.571	67%	0.667	S	S	*	*	H	α-helix	trans	-60.6	-39.2	174.4	-93.1	154.8	0	0	0	112.6	L2 A3 L9 R10	L2-L6 HydrophobicContact CD2-CD1 4.21Å; L2-L6 WeakPolarHBondContact O-CB 3.42Å; L2-L6 PolarHBondContact O-N 2.87Å; A3-L6 PolarHBondContact O-N 3.11Å; L6-L9 PolarHBondContact O-N 2.91Å; L6-R10 WeakPolarHBondContact O-CB 3.47Å; L6-R10 PolarHBondContact O-N 3.29Å
7	H	73.9	Confident	62.5	Low	147 Å²	147	131.8 Å²	131.8	68%	0.681	68%	0.677	S	S	*	*	H	α-helix	trans	-72.2	-36.8	178.3	-140.6	-70.8	0	0	0	112.5	A3 V4 I5 R10 A11	A3-H7 WeakPolarHBondContact O-CB 3.49Å; A3-H7 PolarHBondContact O-N 3.41Å; V4-H7 PolarHBondContact O-N 2.7Å; I5-H7 VanDerWaalsContact C-N 3.33Å; I5-H7 PolarHBondContact O-N 3.06Å; H7-R10 PolarHBondContact O-N 2.93Å; H7-A11 PolarHBondContact O-N 2.79Å; H7-A11 VanDerWaalsContact O-N 3.08Å
8	A	69.5	Low	62.1	Low	60 Å²	60	133.6 Å²	133.6	50%	0.496	69%	0.688	S	S	.	*	H	α-helix	trans	-66.4	-40.2	172.8	0	0	0	0	0	111.7	V4 I5 R10 A11 Y12	V4-A8 WeakPolarHBondContact O-CB 3.47Å; V4-A8 PolarHBondContact O-N 3.48Å; I5-A8 PolarHBondContact O-N 3.3Å; A8-R10 VanDerWaalsContact C-N 3.35Å; A8-R10 PolarHBondContact O-N 3.43Å; A8-A11 PolarHBondContact O-N 3.41Å; A8-Y12 PolarHBondContact O-N 3.33Å
9	L	58.5	Low	61.7	Low	84 Å²	84	131.2 Å²	131.2	44%	0.44	68%	0.68	S	S	.	*	H	α-helix	trans	-64.5	-37.8	175.2	-74.2	168.4	0	0	0	112.3	I5 L6 Y12 G13	I5-L9 HydrophobicContact CG2-CD1 3.83Å; I5-L9 HydrophobicContact CG2-CG 4.33Å; I5-L9 WeakPolarHBondContact O-CB 3.29Å; I5-L9 WeakPolarHBondContact O-CG 3.16Å; I5-L9 PolarHBondContact O-N 2.92Å; L6-L9 PolarHBondContact O-N 2.91Å; L9-Y12 PolarHBondContact O-N 2.92Å; L9-G13 PolarHBondContact O-N 2.95Å
10	R	70	Confident	61.6	Low	206 Å²	206	130.8 Å²	130.8	78%	0.777	68%	0.679	S	S	*	*	H	α-helix	trans	-70.9	-32.6	176.9	-147.4	177.2	-164.3	165.4	3.9	112.4	L6 H7 A8	L6-R10 WeakPolarHBondContact O-CB 3.47Å; L6-R10 PolarHBondContact O-N 3.29Å; H7-R10 PolarHBondContact O-N 2.93Å; A8-R10 VanDerWaalsContact C-N 3.35Å; A8-R10 PolarHBondContact O-N 3.43Å
11	A	64.4	Low	61.7	Low	74 Å²	74	129.4 Å²	129.4	61%	0.612	68%	0.681	S	S	*	*	H	α-helix	trans	-73.5	-33.1	175.2	0	0	0	0	0	112.7	H7 A8	H7-A11 PolarHBondContact O-N 2.79Å; H7-A11 VanDerWaalsContact O-N 3.08Å; A8-A11 PolarHBondContact O-N 3.41Å
12	Y	58.4	Low	62.7	Low	203 Å²	203	124.6 Å²	124.6	80%	0.796	66%	0.662	S	S	*	*	H	α-helix	trans	-79.5	-23.5	179.7	-136.7	-90.2	0	0	0	113.5	A8 L9 F14	A8-Y12 PolarHBondContact O-N 3.33Å; L9-Y12 PolarHBondContact O-N 2.92Å; Y12-F14 PolarHBondContact O-N 3.02Å
13	G	56.7	Low	62.5	Low	56 Å²	56	122.3 Å²	122.3	58%	0.577	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-6	-178.4	0	0	0	0	0	116	L9	L9-G13 PolarHBondContact O-N 2.95Å
14	F	55.6	Low	62.1	Low	191 Å²	191	126 Å²	126	84%	0.838	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	4.1	-173.4	-111.7	-81.9	0	0	0	115	Y12	Y12-F14 PolarHBondContact O-N 3.02Å
15	Y	54.4	Low	61.8	Low	200 Å²	200	124.9 Å²	124.9	78%	0.784	64%	0.639	S	S	*	*	S	Bend	trans	-115.8	9.5	-165.3	-144.7	-95.8	0	0	0	117.3
16	Q	50.7	Low	61.9	Low	145 Å²	145	126.2 Å²	126.2	68%	0.678	64%	0.643	S	S	*	*			trans	-155.3	109.3	176.7	-119.5	144.2	-19.8	0	0	113.2
17	D	48.9	Very low	61.6	Low	157 Å²	157	130.7 Å²	130.7	84%	0.84	65%	0.653	S	S	*	*			trans	-102.3	7.6	-175.5	-92.5	-27.5	0	0	0	114.8
18	D	55.3	Low	61.4	Low	164 Å²	164	131.2 Å²	131.2	88%	0.877	65%	0.649	S	S	*	*			trans	-126.4	40	-170.5	-88.5	-30.7	0	0	0	115.9
19	V	54.4	Low	61.8	Low	88 Å²	88	132.2 Å²	132.2	53%	0.533	65%	0.645	S	S	.	*	S	Bend	trans	-128.8	130.8	178.1	-162.3	0	0	0	0	112.4	D23	V19-D23 HydrophobicContact CG1-CB 3.73Å
20	D	59.8	Low	62.9	Low	124 Å²	124	130.4 Å²	130.4	66%	0.663	64%	0.638	S	S	*	*			trans	-43.6	140.2	-177.7	-88.8	-32.1	0	0	0	113.3	V22 D23 R24	D20-V22 PolarHBondContact O-N 3Å; D20-D23 PolarHBondContact O-N 3.49Å; D20-R24 PolarHBondContact O-N 3.34Å; D20-R24 VanDerWaalsContact O-N 3.08Å
21	S	64.1	Low	63.2	Low	102 Å²	102	123.1 Å²	123.1	71%	0.713	62%	0.619	S	S	*	*	H	α-helix	trans	-56.9	-24.1	-178.5	38.4	0	0	0	0	114.1	L25	S21-L25 PolarHBondContact O-N 3.38Å
22	V	68.7	Low	63.8	Low	92 Å²	92	122.6 Å²	122.6	56%	0.558	61%	0.606	S	S	*	*	H	α-helix	trans	-75.9	-40.5	176.7	-179.7	0	0	0	0	111.5	D20 R24 L25 H26	D20-V22 PolarHBondContact O-N 3Å; V22-R24 VanDerWaalsContact C-N 3.34Å; V22-L25 WeakPolarHBondContact O-CB 3.36Å; V22-L25 PolarHBondContact O-N 3.01Å; V22-H26 PolarHBondContact O-N 3.19Å
23	D	59	Low	64.9	Low	90 Å²	90	117.9 Å²	117.9	48%	0.481	59%	0.594	S	S	.	*	H	α-helix	trans	-69.3	-34.8	175.6	-77.9	-18.4	0	0	0	111.3	V19 D20 L25 H26 Y27	V19-D23 HydrophobicContact CG1-CB 3.73Å; D20-D23 PolarHBondContact O-N 3.49Å; D23-L25 VanDerWaalsContact C-N 3.28Å; D23-L25 PolarHBondContact O-N 3.39Å; D23-H26 PolarHBondContact O-N 2.89Å; D23-Y27 VanDerWaalsContact O-CB 3.3Å; D23-Y27 WeakPolarHBondContact O-CB 3.4Å; D23-Y27 PolarHBondContact O-N 3.35Å
24	R	60.8	Low	66.2	Low	153 Å²	153	120.9 Å²	120.9	58%	0.577	60%	0.596	S	S	*	*	I	π-helix	trans	-62.6	-35.3	171.4	-140.8	177.6	-164.3	179.1	9.1	111.8	D20 V22 W28 I29	D20-R24 PolarHBondContact O-N 3.34Å; D20-R24 VanDerWaalsContact O-N 3.08Å; V22-R24 VanDerWaalsContact C-N 3.34Å; R24-W28 VanDerWaalsContact O-CB 3.27Å; R24-W28 WeakPolarHBondContact O-CB 3.48Å; R24-W28 PolarHBondContact O-N 3.37Å; R24-I29 PolarHBondContact O-N 3.5Å
25	L	70.6	Confident	67.4	Low	84 Å²	84	115.8 Å²	115.8	44%	0.44	58%	0.577	S	S	.	*	I	π-helix	trans	-68.9	-47.4	175.6	-167.1	80.1	0	0	0	111.4	S21 V22 D23 I29 T30	S21-L25 PolarHBondContact O-N 3.38Å; V22-L25 WeakPolarHBondContact O-CB 3.36Å; V22-L25 PolarHBondContact O-N 3.01Å; D23-L25 VanDerWaalsContact C-N 3.28Å; D23-L25 PolarHBondContact O-N 3.39Å; L25-I29 HydrophobicContact CD1-CB 4.18Å; L25-I29 HydrophobicContact CD1-CD1 3.72Å; L25-I29 HydrophobicContact CD1-CG1 4.47Å; L25-I29 HydrophobicContact CD1-CG2 4.26Å; L25-I29 WeakPolarHBondContact O-CB 3.29Å; L25-I29 PolarHBondContact O-N 3.43Å; L25-T30 PolarHBondContact O-N 2.84Å; L25-T30 PolarHBondContact O-OG1 3.34Å
26	H	70.1	Confident	68.5	Low	122 Å²	122	108.5 Å²	108.5	57%	0.565	56%	0.558	S	S	*	*	I	π-helix	trans	-79.5	-30.7	-175.2	-83.8	-73.3	0	0	0	115	V22 D23 T30	V22-H26 PolarHBondContact O-N 3.19Å; D23-H26 PolarHBondContact O-N 2.89Å; H26-T30 VanDerWaalsContact C-OG1 3.24Å; H26-T30 WeakPolarHBondContact CA-OG1 3.5Å; H26-T30 PolarHBondContact O-OG1 3.01Å
27	Y	69.8	Low	69.9	Low	202 Å²	202	105.8 Å²	105.8	79%	0.792	55%	0.547	S	S	*	.	I	π-helix	trans	-91.2	-39.3	-179.2	-155.8	-87.8	0	0	0	111.7	D23 S31	D23-Y27 VanDerWaalsContact O-CB 3.3Å; D23-Y27 WeakPolarHBondContact O-CB 3.4Å; D23-Y27 PolarHBondContact O-N 3.35Å; Y27-S31 WeakPolarHBondContact O-CB 3.39Å
28	W	70.1	Confident	71.4	Confident	158 Å²	158	101.4 Å²	101.4	60%	0.598	53%	0.529	S	S	*	.	I	π-helix	trans	-98.7	-52.4	-175.2	-162.3	82.7	0	0	0	112.5	R24 N32	R24-W28 VanDerWaalsContact O-CB 3.27Å; R24-W28 WeakPolarHBondContact O-CB 3.48Å; R24-W28 PolarHBondContact O-N 3.37Å; W28-N32 VanDerWaalsContact O-CB 3.24Å; W28-N32 WeakPolarHBondContact O-CB 3.1Å; W28-N32 PolarHBondContact O-N 3.15Å; W28-N32 PolarHBondContact O-ND2 3.36Å
29	I	78.3	Confident	72.4	Confident	81 Å²	81	98.9 Å²	98.9	42%	0.415	52%	0.515	S	S	.	.	I	π-helix	trans	-73.6	-53.9	-172.7	-65	174	0	0	0	111.5	R24 L25 S31 L33	R24-I29 PolarHBondContact O-N 3.5Å; L25-I29 HydrophobicContact CD1-CB 4.18Å; L25-I29 HydrophobicContact CD1-CD1 3.72Å; L25-I29 HydrophobicContact CD1-CG1 4.47Å; L25-I29 HydrophobicContact CD1-CG2 4.26Å; L25-I29 WeakPolarHBondContact O-CB 3.29Å; L25-I29 PolarHBondContact O-N 3.43Å; I29-S31 PolarHBondContact O-N 3.01Å; I29-L33 WeakPolarHBondContact O-CB 3.37Å; I29-L33 PolarHBondContact O-N 2.89Å
30	T	79.9	Confident	73.4	Confident	47 Å²	47	100.3 Å²	100.3	29%	0.288	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-40.2	-177.2	54.6	0	0	0	0	112.1	L25 H26 L33 L34	L25-T30 PolarHBondContact O-N 2.84Å; L25-T30 PolarHBondContact O-OG1 3.34Å; H26-T30 VanDerWaalsContact C-OG1 3.24Å; H26-T30 WeakPolarHBondContact CA-OG1 3.5Å; H26-T30 PolarHBondContact O-OG1 3.01Å; T30-L33 PolarHBondContact O-N 3.37Å; T30-L34 WeakPolarHBondContact O-CB 3.39Å; T30-L34 VanDerWaalsContact O-CG 3.28Å; T30-L34 WeakPolarHBondContact O-CG 3.22Å; T30-L34 PolarHBondContact O-N 3.43Å
31	S	76.7	Confident	74	Confident	52 Å²	52	98 Å²	98	36%	0.364	51%	0.509	S	S	.	.	H	α-helix	trans	-65	-47.2	178.5	-165.8	0	0	0	0	111.6	Y27 I29 L33 L34 I35	Y27-S31 WeakPolarHBondContact O-CB 3.39Å; I29-S31 PolarHBondContact O-N 3.01Å; S31-L33 PolarHBondContact O-N 2.93Å; S31-L34 PolarHBondContact O-N 2.96Å; S31-I35 VanDerWaalsContact O-CG1 3.26Å; S31-I35 WeakPolarHBondContact O-CG1 3.47Å; S31-I35 PolarHBondContact O-N 2.89Å
32	N	77.7	Confident	74.3	Confident	64 Å²	64	95.5 Å²	95.5	34%	0.342	49%	0.491	S	S	.	.	H	α-helix	trans	-67.6	-34.8	176.1	-74.6	-64.1	0	0	0	112.4	W28 I35 A36	W28-N32 VanDerWaalsContact O-CB 3.24Å; W28-N32 WeakPolarHBondContact O-CB 3.1Å; W28-N32 PolarHBondContact O-N 3.15Å; W28-N32 PolarHBondContact O-ND2 3.36Å; N32-I35 PolarHBondContact O-N 3.41Å; N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.38Å; N32-A36 PolarHBondContact O-N 2.92Å
33	L	82.3	Confident	74.4	Confident	103 Å²	103	99 Å²	99	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-42.9	174.5	-166.8	81.7	0	0	0	111.1	I29 T30 S31 A36 I37	I29-L33 WeakPolarHBondContact O-CB 3.37Å; I29-L33 PolarHBondContact O-N 2.89Å; T30-L33 PolarHBondContact O-N 3.37Å; S31-L33 PolarHBondContact O-N 2.93Å; L33-A36 PolarHBondContact O-N 3.06Å; L33-I37 HydrophobicContact CD2-CD1 4.19Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CB 3.44Å; L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 3.17Å
34	L	82.6	Confident	74.6	Confident	119 Å²	119	102.8 Å²	102.8	62%	0.623	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-41.5	175.6	-78.3	166.7	0	0	0	111.7	T30 S31 I37 S38	T30-L34 WeakPolarHBondContact O-CB 3.39Å; T30-L34 VanDerWaalsContact O-CG 3.28Å; T30-L34 WeakPolarHBondContact O-CG 3.22Å; T30-L34 PolarHBondContact O-N 3.43Å; S31-L34 PolarHBondContact O-N 2.96Å; L34-I37 PolarHBondContact O-N 3.3Å; L34-S38 WeakPolarHBondContact O-CB 3.29Å; L34-S38 PolarHBondContact O-N 3.22Å
35	I	80.2	Confident	74.6	Confident	85 Å²	85	101 Å²	101	44%	0.436	51%	0.506	S	S	.	.	H	α-helix	trans	-64.7	-43.7	174.5	-67.5	165.5	0	0	0	110.4	S31 N32 S38 L39	S31-I35 VanDerWaalsContact O-CG1 3.26Å; S31-I35 WeakPolarHBondContact O-CG1 3.47Å; S31-I35 PolarHBondContact O-N 2.89Å; N32-I35 PolarHBondContact O-N 3.41Å; I35-S38 PolarHBondContact O-N 3.38Å; I35-L39 HydrophobicContact CG2-CD1 3.89Å; I35-L39 HydrophobicContact CG2-CG 4.34Å; I35-L39 WeakPolarHBondContact O-CB 3.41Å; I35-L39 VanDerWaalsContact O-CG 3.3Å; I35-L39 WeakPolarHBondContact O-CG 3.11Å; I35-L39 PolarHBondContact O-N 3.47Å
36	A	78.6	Confident	74	Confident	47 Å²	47	105.4 Å²	105.4	39%	0.388	52%	0.522	S	S	.	.	H	α-helix	trans	-64.6	-42.7	177.8	0	0	0	0	0	112.1	N32 L33 L39 L40	N32-A36 VanDerWaalsContact O-CB 3.24Å; N32-A36 WeakPolarHBondContact O-CB 3.38Å; N32-A36 PolarHBondContact O-N 2.92Å; L33-A36 PolarHBondContact O-N 3.06Å; A36-L39 PolarHBondContact O-N 3.12Å; A36-L40 VanDerWaalsContact O-CB 3.31Å; A36-L40 WeakPolarHBondContact O-CB 3.43Å; A36-L40 PolarHBondContact O-N 2.94Å
37	I	80.6	Confident	72.9	Confident	87 Å²	87	101.9 Å²	101.9	45%	0.446	52%	0.519	S	S	.	.	H	α-helix	trans	-65.4	-43.4	174.5	-69.3	168	0	0	0	110.1	L33 L34 L39 L40 V41	L33-I37 HydrophobicContact CD2-CD1 4.19Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CB 3.44Å; L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 3.17Å; L34-I37 PolarHBondContact O-N 3.3Å; I37-L39 PolarHBondContact O-N 3.14Å; I37-L40 PolarHBondContact O-N 3.03Å; I37-V41 HydrophobicContact CG2-CG2 4.16Å; I37-V41 VanDerWaalsContact O-CB 3.32Å; I37-V41 WeakPolarHBondContact O-CB 3.29Å; I37-V41 WeakPolarHBondContact O-CG2 3.46Å; I37-V41 PolarHBondContact O-N 3.24Å
38	S	79.7	Confident	71.8	Confident	66 Å²	66	94 Å²	94	46%	0.462	50%	0.499	S	S	.	.	H	α-helix	trans	-59.4	-44.9	175.5	167.2	0	0	0	0	112	L34 I35 S42	L34-S38 WeakPolarHBondContact O-CB 3.29Å; L34-S38 PolarHBondContact O-N 3.22Å; I35-S38 PolarHBondContact O-N 3.38Å; S38-S42 WeakPolarHBondContact O-CB 3.46Å; S38-S42 PolarHBondContact O-N 3.24Å; S38-S42 PolarHBondContact O-OG 3.01Å
39	L	76.3	Confident	71.1	Confident	111 Å²	111	95.8 Å²	95.8	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-69.6	-36.8	176.7	-73.2	173.3	0	0	0	112	I35 A36 I37 Y43	I35-L39 HydrophobicContact CG2-CD1 3.89Å; I35-L39 HydrophobicContact CG2-CG 4.34Å; I35-L39 WeakPolarHBondContact O-CB 3.41Å; I35-L39 VanDerWaalsContact O-CG 3.3Å; I35-L39 WeakPolarHBondContact O-CG 3.11Å; I35-L39 PolarHBondContact O-N 3.47Å; A36-L39 PolarHBondContact O-N 3.12Å; I37-L39 PolarHBondContact O-N 3.14Å; L39-Y43 WeakPolarHBondContact O-CA 3.34Å; L39-Y43 WeakPolarHBondContact O-CB 3.46Å; L39-Y43 PolarHBondContact O-N 3.2Å
40	L	74.7	Confident	69.5	Low	117 Å²	117	95.8 Å²	95.8	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-67.9	-43.3	174.1	-97.2	162.7	0	0	0	111.8	A36 I37 Y43 K44	A36-L40 VanDerWaalsContact O-CB 3.31Å; A36-L40 WeakPolarHBondContact O-CB 3.43Å; A36-L40 PolarHBondContact O-N 2.94Å; I37-L40 PolarHBondContact O-N 3.03Å; L40-Y43 PolarHBondContact O-N 2.76Å; L40-K44 WeakPolarHBondContact O-CB 3.35Å; L40-K44 PolarHBondContact O-N 3.24Å
41	V	72.5	Confident	68	Low	76 Å²	76	100 Å²	100	46%	0.461	54%	0.536	S	S	.	.	H	α-helix	trans	-63.6	-45.9	175.3	170.7	0	0	0	0	109.3	I37 K44 Q45	I37-V41 HydrophobicContact CG2-CG2 4.16Å; I37-V41 VanDerWaalsContact O-CB 3.32Å; I37-V41 WeakPolarHBondContact O-CB 3.29Å; I37-V41 WeakPolarHBondContact O-CG2 3.46Å; I37-V41 PolarHBondContact O-N 3.24Å; V41-K44 PolarHBondContact O-N 2.92Å; V41-Q45 WeakPolarHBondContact O-CB 3.48Å; V41-Q45 PolarHBondContact O-N 3.08Å
42	S	72	Confident	66.6	Low	49 Å²	49	106.2 Å²	106.2	34%	0.343	56%	0.559	S	S	.	*	H	α-helix	trans	-65.3	-42	176.2	-69.2	0	0	0	0	112.3	S38 K44 Q45 F46	S38-S42 WeakPolarHBondContact O-CB 3.46Å; S38-S42 PolarHBondContact O-N 3.24Å; S38-S42 PolarHBondContact O-OG 3.01Å; S42-K44 PolarHBondContact O-N 3.43Å; S42-Q45 PolarHBondContact O-N 2.7Å; S42-F46 WeakPolarHBondContact O-CB 3.34Å; S42-F46 VanDerWaalsContact O-CD2 3.3Å; S42-F46 WeakPolarHBondContact O-CD2 3.43Å; S42-F46 PolarHBondContact O-N 2.97Å
43	Y	70.3	Confident	65.2	Low	165 Å²	165	107.8 Å²	107.8	65%	0.647	57%	0.574	S	S	*	*	H	α-helix	trans	-64.5	-40	175	179.8	-98.6	0	0	0	111.4	L39 L40 Q45 G47	L39-Y43 WeakPolarHBondContact O-CA 3.34Å; L39-Y43 WeakPolarHBondContact O-CB 3.46Å; L39-Y43 PolarHBondContact O-N 3.2Å; L40-Y43 PolarHBondContact O-N 2.76Å; Y43-Q45 VanDerWaalsContact C-N 3.31Å; Y43-G47 WeakPolarHBondContact O-CA 3.18Å; Y43-G47 PolarHBondContact O-N 2.92Å
44	K	62.9	Low	63.2	Low	170 Å²	170	111.6 Å²	111.6	74%	0.739	59%	0.591	S	S	*	*	H	α-helix	trans	-67.9	-33.4	173.2	-112.9	-158.8	174.6	-174.7	0	112.5	L40 V41 S42	L40-K44 WeakPolarHBondContact O-CB 3.35Å; L40-K44 PolarHBondContact O-N 3.24Å; V41-K44 PolarHBondContact O-N 2.92Å; S42-K44 PolarHBondContact O-N 3.43Å
45	Q	60.1	Low	61.4	Low	116 Å²	116	108.6 Å²	108.6	54%	0.542	58%	0.578	S	S	.	*	H	α-helix	trans	-76.3	-28	-179.2	-166.4	156.9	-21.7	0	0	112.8	V41 S42 Y43	V41-Q45 WeakPolarHBondContact O-CB 3.48Å; V41-Q45 PolarHBondContact O-N 3.08Å; S42-Q45 PolarHBondContact O-N 2.7Å; Y43-Q45 VanDerWaalsContact C-N 3.31Å
46	F	58.3	Low	59.5	Low	176 Å²	176	109 Å²	109	77%	0.772	59%	0.586	S	S	*	*	H	α-helix	trans	-113.6	-20.2	-177.4	-72.7	-77.9	0	0	0	115.2	S42	S42-F46 WeakPolarHBondContact O-CB 3.34Å; S42-F46 VanDerWaalsContact O-CD2 3.3Å; S42-F46 WeakPolarHBondContact O-CD2 3.43Å; S42-F46 PolarHBondContact O-N 2.97Å
47	G	47.8	Very low	57.8	Low	49 Å²	49	116.8 Å²	116.8	51%	0.505	61%	0.611	S	S	.	*	H	α-helix	trans	-111.9	-9.9	-175.4	0	0	0	0	0	115.6	Y43	Y43-G47 WeakPolarHBondContact O-CA 3.18Å; Y43-G47 PolarHBondContact O-N 2.92Å
48	G	45.8	Very low	56.3	Low	37 Å²	37	121.2 Å²	121.2	38%	0.381	63%	0.632	S	S	.	*	S	Bend	trans	-97.5	163.1	169.1	0	0	0	0	0	111.6	P50	G48-P50 VanDerWaalsContact O-N 3.13Å
49	K	55.7	Low	54.5	Low	194 Å²	194	124.4 Å²	124.4	84%	0.843	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-49.2	124.6	167.7	-69	-178.4	178.8	-179.5	0	107.5	I51	K49-I51 PolarHBondContact O-N 3.5Å
50	P	45.5	Very low	52.7	Low	82 Å²	82	124 Å²	124	53%	0.532	64%	0.644	S	S	.	*	P	Polyproline II helix	trans	-56.8	139.8	-177.4	23.6	-32.3	0	0	0	108.5	G48 E52	G48-P50 VanDerWaalsContact O-N 3.13Å; P50-E52 PolarHBondContact O-N 3.28Å
51	I	48.6	Very low	51.3	Low	136 Å²	136	121 Å²	121	70%	0.697	64%	0.642	S	S	*	*			trans	-28.8	111.4	174.7	-65.9	161.1	0	0	0	109.8	K49 C53	K49-I51 PolarHBondContact O-N 3.5Å; I51-C53 PolarHBondContact O-N 3.09Å
52	E	46.4	Very low	50.1	Low	182 Å²	182	120.7 Å²	120.7	85%	0.85	64%	0.643	S	S	*	*			trans	-64.1	93	160.6	-74.9	-179.5	178.2	0	0	105.4	P50 M54	P50-E52 PolarHBondContact O-N 3.28Å; E52-M54 PolarHBondContact O-N 3.46Å
53	C	48.9	Very low	48.7	Very low	96 Å²	96	125.6 Å²	125.6	65%	0.649	65%	0.654	S	S	*	*			trans	-59.1	113.2	168.9	-65.7	0	0	0	0	106.1	I51 V55	I51-C53 PolarHBondContact O-N 3.09Å; C53-V55 PolarHBondContact O-N 3.44Å
54	M	40.8	Very low	47.5	Very low	183 Å²	183	122.7 Å²	122.7	90%	0.901	65%	0.646	S	S	*	*			trans	-65.5	88.6	170.2	-165	167	148	0	0	106.7	E52	E52-M54 PolarHBondContact O-N 3.46Å
55	V	44.6	Very low	47	Very low	57 Å²	57	119.6 Å²	119.6	35%	0.345	64%	0.635	S	S	.	*			trans	-60.5	128.6	173.1	-169.3	0	0	0	0	105.8	C53 K57 F59 E64	C53-V55 PolarHBondContact O-N 3.44Å; V55-K57 PolarHBondContact O-N 2.85Å; V55-K57 VanDerWaalsContact O-N 3.12Å; V55-F59 HydrophobicContact CG1-CB 4.49Å; V55-E64 HydrophobicContact CG2-CG 4.2Å
56	P	39	Very low	46.5	Very low	93 Å²	93	118.1 Å²	118.1	60%	0.604	63%	0.625	S	S	*	*			trans	-52.8	126.4	175.1	-21.9	30.8	0	0	0	108.2	M58 F59	P56-M58 PolarHBondContact O-N 3.16Å; P56-F59 PolarHBondContact O-N 3.41Å
57	K	43.7	Very low	46.3	Very low	211 Å²	211	113.7 Å²	113.7	92%	0.917	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	4.8	-178.6	-71.3	-176.2	175.9	178.5	0	114.9	V55	V55-K57 PolarHBondContact O-N 2.85Å; V55-K57 VanDerWaalsContact O-N 3.12Å
58	M	49.6	Very low	46.4	Very low	179 Å²	179	114.1 Å²	114.1	88%	0.882	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-16.3	175.6	-153.3	170	-129.7	0	0	113.1	P56	P56-M58 PolarHBondContact O-N 3.16Å
59	F	41.4	Very low	46.9	Very low	133 Å²	133	114.9 Å²	114.9	58%	0.583	61%	0.605	S	S	*	*	S	Bend	trans	-102.5	89.9	170.1	-79.9	-87.6	0	0	0	110	V55 P56 G61 W63	V55-F59 HydrophobicContact CG1-CB 4.49Å; P56-F59 PolarHBondContact O-N 3.41Å; F59-G61 PolarHBondContact O-N 3.09Å; F59-W63 AromaticContact CD1-CD1 3.97Å
60	S	38.8	Very low	47	Very low	103 Å²	103	106.2 Å²	106.2	72%	0.72	57%	0.568	S	S	*	*			trans	-65.3	121.1	-177.3	56.2	0	0	0	0	112.7	S62	S60-S62 VanDerWaalsContact C-N 3.25Å; S60-S62 PolarHBondContact O-N 3.49Å
61	G	45	Very low	47.6	Very low	55 Å²	55	109.4 Å²	109.4	57%	0.567	57%	0.569	S	S	*	*	S	Bend	trans	57.9	-40.2	150.5	0	0	0	0	0	120.9	F59	F59-G61 PolarHBondContact O-N 3.09Å
62	S	47.8	Very low	48.3	Very low	68 Å²	68	103.1 Å²	103.1	48%	0.476	54%	0.537	S	S	.	.	H	α-helix	trans	-77.5	-43.1	-169.9	-173.7	0	0	0	0	112.1	S60 Y66	S60-S62 VanDerWaalsContact C-N 3.25Å; S60-S62 PolarHBondContact O-N 3.49Å; S62-Y66 WeakPolarHBondContact O-CD2 3.48Å; S62-Y66 WeakPolarHBondContact O-CE2 3.38Å
63	W	41.6	Very low	49.6	Very low	153 Å²	153	94.8 Å²	94.8	58%	0.58	50%	0.498	S	S	*	.	H	α-helix	trans	-76	-29.3	-173.2	-62.2	98.2	0	0	0	114.1	F59 E65 Y66 V67	F59-W63 AromaticContact CD1-CD1 3.97Å; W63-E65 VanDerWaalsContact C-N 3.31Å; W63-E65 PolarHBondContact O-N 3.33Å; W63-Y66 PolarHBondContact O-N 2.88Å; W63-V67 WeakPolarHBondContact O-CG2 3.41Å; W63-V67 PolarHBondContact O-N 2.64Å
64	E	45.5	Very low	51.1	Low	103 Å²	103	91.8 Å²	91.8	48%	0.481	48%	0.476	S	S	.	.	H	α-helix	trans	-60.9	-40.4	179.7	-75.3	177.4	166	0	0	111.7	V55 Y66 V67 S68	V55-E64 HydrophobicContact CG2-CG 4.2Å; E64-Y66 PolarHBondContact O-N 2.84Å; E64-V67 PolarHBondContact O-N 2.92Å; E64-S68 PolarHBondContact O-N 3.24Å
65	E	52.1	Low	53.2	Low	106 Å²	106	88.9 Å²	88.9	50%	0.495	46%	0.463	S	S	.	.	H	α-helix	trans	-64	-31.8	175.5	-172.8	171.8	-175.8	0	0	112	W63 S68 K176	W63-E65 VanDerWaalsContact C-N 3.31Å; W63-E65 PolarHBondContact O-N 3.33Å; E65-S68 PolarHBondContact O-OG 3.04Å; E65-K176 PolarHBondContact O-NZ 2.77Å
66	Y	50.8	Low	55.4	Low	85 Å²	85	86.4 Å²	86.4	33%	0.333	45%	0.448	S	S	.	.	H	α-helix	trans	-74.3	-35.7	175.4	-68.8	-73.6	0	0	0	112.7	S62 W63 E64 R169 F173 K176	S62-Y66 WeakPolarHBondContact O-CD2 3.48Å; S62-Y66 WeakPolarHBondContact O-CE2 3.38Å; W63-Y66 PolarHBondContact O-N 2.88Å; E64-Y66 PolarHBondContact O-N 2.84Å; Y66-R169 PolarHBondContact O-NH1 3.48Å; Y66-R169 PolarHBondContact O-NH2 2.97Å; Y66-F173 AromaticContact CD1-CD1 3.61Å; Y66-F173 HydrophobicContact CD1-CD1 3.61Å; Y66-F173 AromaticContact CD1-CE1 3.37Å; Y66-F173 HydrophobicContact CD1-CE1 3.37Å; Y66-F173 HydrophobicContact CE1-CD1 4.05Å; Y66-F173 HydrophobicContact CE1-CE1 4.14Å; Y66-F173 HydrophobicContact CG-CD1 4.34Å; Y66-F173 AromaticContact CG-CE1 3.63Å; Y66-F173 HydrophobicContact CG-CE1 3.63Å; Y66-K176 HydrophobicContact CD1-CD 3.81Å; Y66-K176 HydrophobicContact CE1-CD 3.97Å
67	V	52.2	Low	57.7	Low	82 Å²	82	82.2 Å²	82.2	50%	0.497	42%	0.421	S	S	.	.	H	α-helix	trans	-81.5	-30.3	-175.5	178.4	0	0	0	0	112.7	W63 E64 R169	W63-V67 WeakPolarHBondContact O-CG2 3.41Å; W63-V67 PolarHBondContact O-N 2.64Å; E64-V67 PolarHBondContact O-N 2.92Å; V67-R169 VanDerWaalsContact CA-NH2 3.26Å
68	S	51.7	Low	59.8	Low	59 Å²	59	78.2 Å²	78.2	41%	0.413	40%	0.4	S	S	.	.	S	Bend	trans	-61.9	142.9	179.4	68.9	0	0	0	0	112.8	E64 E65 I70	E64-S68 PolarHBondContact O-N 3.24Å; E65-S68 PolarHBondContact O-OG 3.04Å; S68-I70 PolarHBondContact O-N 3.23Å; S68-I70 VanDerWaalsContact O-N 3.13Å
69	P	54.7	Low	61.7	Low	52 Å²	52	71.7 Å²	71.7	34%	0.338	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-61.3	118.8	176.8	25.1	-33	0	0	0	109.3	R71 Y82	P69-R71 PolarHBondContact O-N 3.35Å; P69-Y82 HydrophobicContact CB-CD2 4.45Å
70	I	57.7	Low	64.1	Low	13 Å²	13	65.3 Å²	65.3	7%	0.067	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-69.6	117.9	-177.8	-58.7	151.6	0	0	0	107.2	S68 D72 E73 K176	S68-I70 PolarHBondContact O-N 3.23Å; S68-I70 VanDerWaalsContact O-N 3.13Å; I70-D72 HydrophobicContact CG2-CB 4.17Å; I70-D72 PolarHBondContact O-N 3.46Å; I70-E73 HydrophobicContact CB-CG 3.85Å; I70-E73 WeakPolarHBondContact CD1-OE1 3.37Å; I70-E73 HydrophobicContact CG2-CG 3.79Å; I70-E73 PolarHBondContact O-N 3.48Å; I70-K176 HydrophobicContact CD1-CD 4.15Å; I70-K176 HydrophobicContact CD1-CG 4.48Å; I70-K176 VanDerWaalsContact CG1-CE 3.45Å
71	R	59.5	Low	66.4	Low	148 Å²	148	60.5 Å²	60.5	56%	0.558	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-11	-175.1	-70.5	-175.4	177.2	-167.2	-1.7	113.3	P69 R414	P69-R71 PolarHBondContact O-N 3.35Å; R71-R414 WeakPolarHBondContact O-CD 3.43Å; R71-R414 WeakPolarHBondContact O-CG 3.33Å; R71-R414 PolarHBondContact O-NE 3.09Å
72	D	63.4	Low	68.3	Low	5 Å²	5	60.7 Å²	60.7	3%	0.027	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-8.4	-174.6	-39.8	-25.3	0	0	0	112.2	I70 H187 V190 L410	I70-D72 HydrophobicContact CG2-CB 4.17Å; I70-D72 PolarHBondContact O-N 3.46Å; D72-H187 IonicContact OD1-ND1 3.12Å; D72-H187 VanDerWaalsContact OD2-CA 3.22Å; D72-H187 WeakPolarHBondContact OD2-CA 3.47Å; D72-H187 IonicContact OD2-CE1 2.71Å; D72-H187 IonicContact OD2-CG 2.79Å; D72-H187 IonicContact OD2-ND1 3.52Å; D72-H187 PolarHBondContact OD2-ND1 3.41Å; D72-V190 HydrophobicContact CB-CB 4.43Å; D72-V190 HydrophobicContact CB-CG1 4.34Å; D72-V190 HydrophobicContact CB-CG2 4.34Å; D72-V190 WeakPolarHBondContact OD1-CB 3.41Å; D72-V190 WeakPolarHBondContact OD1-CG1 3.41Å; D72-L410 HydrophobicContact CB-CD2 4.24Å; D72-L410 VanDerWaalsContact O-CD1 3.23Å; D72-L410 WeakPolarHBondContact O-CD1 3.41Å
73	E	72	Confident	70.1	Confident	6 Å²	6	59.6 Å²	59.6	3%	0.028	28%	0.281	C	S	.	.	S	Bend	trans	-103	134.5	-161.8	-69.9	-170.7	174	0	0	114.4	I70 D77 H81 R414	I70-E73 HydrophobicContact CB-CG 3.85Å; I70-E73 WeakPolarHBondContact CD1-OE1 3.37Å; I70-E73 HydrophobicContact CG2-CG 3.79Å; I70-E73 PolarHBondContact O-N 3.48Å; E73-D77 HydrophobicContact CB-CB 3.94Å; E73-H81 IonicContact OE2-CE1 3.92Å; E73-H81 PolarHBondContact OE2-CE1 3.45Å; E73-H81 IonicContact OE2-ND1 2.9Å; E73-H81 PolarHBondContact OE2-ND1 2.91Å; E73-H81 VanDerWaalsContact OE2-ND1 3.11Å; E73-H81 IonicContact OE2-NE2 2.62Å; E73-R414 PolarHBondContact O-NH1 3.19Å; E73-R414 PolarHBondContact O-NH2 2.74Å
74	D	81.8	Confident	72.5	Confident	34 Å²	34	52.3 Å²	52.3	18%	0.182	25%	0.253	C	S	.	.			trans	-50.8	153.7	-179.5	-166.4	4.5	0	0	0	111.7	A76 D77 R78 K256 S354 W358 R414	D74-A76 PolarHBondContact O-N 2.98Å; D74-A76 VanDerWaalsContact O-N 3.16Å; D74-D77 WeakPolarHBondContact CB-OD2 3.45Å; D74-D77 PolarHBondContact N-OD2 3.49Å; D74-D77 WeakPolarHBondContact O-CB 3.34Å; D74-D77 PolarHBondContact O-N 2.88Å; D74-R78 PolarHBondContact O-N 3.29Å; D74-K256 IonicContact OD2-NZ 3.74Å; D74-K256 PolarHBondContact OD2-NZ 2.91Å; D74-S354 PolarHBondContact OD2-OG 2.96Å; D74-W358 PolarHBondContact OD2-NE1 2.82Å; D74-R414 VanDerWaalsContact CA-NH2 3.33Å
75	I	85.2	Confident	74.6	Confident	122 Å²	122	47.7 Å²	47.7	63%	0.626	23%	0.232	S	C	*	.	H	α-helix	trans	-54.6	-40.2	179.9	-62.1	171.8	0	0	0	110.2	D77 R78 L79	I75-D77 PolarHBondContact O-N 2.83Å; I75-R78 PolarHBondContact O-N 3.48Å; I75-L79 HydrophobicContact CG2-CD1 4.17Å; I75-L79 WeakPolarHBondContact O-CG 3.33Å; I75-L79 PolarHBondContact O-N 3.24Å
76	A	89.3	Confident	76.3	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-44.5	174.8	0	0	0	0	0	112.6	D74 R78 L79 N80 I350	D74-A76 PolarHBondContact O-N 2.98Å; D74-A76 VanDerWaalsContact O-N 3.16Å; A76-R78 PolarHBondContact O-N 3.2Å; A76-L79 PolarHBondContact O-N 2.85Å; A76-N80 PolarHBondContact O-N 3.36Å; A76-N80 VanDerWaalsContact O-N 3.16Å; A76-N80 PolarHBondContact O-ND2 2.85Å; A76-I350 HydrophobicContact CB-CG2 3.78Å
77	D	88.9	Confident	78.1	Confident	6 Å²	6	43.2 Å²	43.2	3%	0.032	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-44.3	179.4	-60	-27.5	0	0	0	110.2	E73 D74 I75 L79 N80 H81 Y252 K256 Y259	E73-D77 HydrophobicContact CB-CB 3.94Å; D74-D77 WeakPolarHBondContact CB-OD2 3.45Å; D74-D77 PolarHBondContact N-OD2 3.49Å; D74-D77 WeakPolarHBondContact O-CB 3.34Å; D74-D77 PolarHBondContact O-N 2.88Å; I75-D77 PolarHBondContact O-N 2.83Å; D77-L79 VanDerWaalsContact C-N 3.33Å; D77-L79 PolarHBondContact O-N 3.3Å; D77-N80 WeakPolarHBondContact O-CB 3.37Å; D77-N80 PolarHBondContact O-N 3.18Å; D77-N80 VanDerWaalsContact O-N 3.11Å; D77-H81 PolarHBondContact O-N 3.47Å; D77-H81 PolarHBondContact O-ND1 3.45Å; D77-Y252 PolarHBondContact OD2-OH 3.24Å; D77-K256 WeakPolarHBondContact OD1-CD 3.32Å; D77-K256 VanDerWaalsContact OD1-CE 3.26Å; D77-K256 WeakPolarHBondContact OD1-CE 3.26Å; D77-K256 IonicContact OD1-NZ 2.72Å; D77-K256 PolarHBondContact OD1-NZ 2.79Å; D77-K256 WeakPolarHBondContact OD2-CE 3.37Å; D77-K256 IonicContact OD2-NZ 3.34Å; D77-K256 PolarHBondContact OD2-NZ 2.69Å; D77-Y259 HydrophobicContact CB-CE2 4.08Å
78	R	87.1	Confident	80	Confident	127 Å²	127	39.3 Å²	39.3	48%	0.479	20%	0.198	S	C	.	.	H	α-helix	trans	-60.1	-39.4	175.8	-174.7	177.5	169.4	-168	-4.6	112.8	D74 I75 A76 N80 Y82 V83	D74-R78 PolarHBondContact O-N 3.29Å; I75-R78 PolarHBondContact O-N 3.48Å; A76-R78 PolarHBondContact O-N 3.2Å; R78-N80 VanDerWaalsContact C-N 3.3Å; R78-N80 PolarHBondContact O-N 2.97Å; R78-Y82 WeakPolarHBondContact O-CB 3.41Å; R78-Y82 PolarHBondContact O-N 3.34Å; R78-V83 PolarHBondContact O-N 2.72Å; R78-V83 VanDerWaalsContact O-N 3.09Å
79	L	89.5	Confident	81.7	Confident	41 Å²	41	40 Å²	40	22%	0.215	20%	0.196	C	C	.	.	I	π-helix	trans	-63.5	-37.8	175.5	-74	168.5	0	0	0	111.8	I75 A76 D77 V83 T84 I350	I75-L79 HydrophobicContact CG2-CD1 4.17Å; I75-L79 WeakPolarHBondContact O-CG 3.33Å; I75-L79 PolarHBondContact O-N 3.24Å; A76-L79 PolarHBondContact O-N 2.85Å; D77-L79 VanDerWaalsContact C-N 3.33Å; D77-L79 PolarHBondContact O-N 3.3Å; L79-V83 HydrophobicContact CD2-CB 4.27Å; L79-V83 HydrophobicContact CD2-CG1 4.45Å; L79-V83 HydrophobicContact CD2-CG2 4.12Å; L79-T84 WeakPolarHBondContact O-CB 3.39Å; L79-T84 PolarHBondContact O-N 3.02Å; L79-T84 PolarHBondContact O-OG1 3.23Å; L79-I350 HydrophobicContact CD1-CD1 4.02Å; L79-I350 HydrophobicContact CD1-CG2 4.15Å
80	N	90.6	Very high	83.2	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.202	C	C	.	.	I	π-helix	trans	-68.7	-68.4	177.9	-79.6	-98.8	0	0	0	112.3	A76 D77 R78 T84 F168 Y259 V263 L347 T351	A76-N80 PolarHBondContact O-N 3.36Å; A76-N80 VanDerWaalsContact O-N 3.16Å; A76-N80 PolarHBondContact O-ND2 2.85Å; D77-N80 WeakPolarHBondContact O-CB 3.37Å; D77-N80 PolarHBondContact O-N 3.18Å; D77-N80 VanDerWaalsContact O-N 3.11Å; R78-N80 VanDerWaalsContact C-N 3.3Å; R78-N80 PolarHBondContact O-N 2.97Å; N80-T84 VanDerWaalsContact O-CB 3.31Å; N80-T84 WeakPolarHBondContact O-CB 3.33Å; N80-F168 HydrophobicContact CB-CD1 4.47Å; N80-Y259 HydrophobicContact CB-CD1 3.49Å; N80-Y259 VanDerWaalsContact CB-CD1 3.49Å; N80-Y259 HydrophobicContact CB-CE1 3.62Å; N80-Y259 HydrophobicContact CB-CG 4.29Å; N80-V263 WeakPolarHBondContact OD1-CG2 3.25Å; N80-L347 VanDerWaalsContact OD1-CD2 3.26Å; N80-L347 WeakPolarHBondContact OD1-CD2 3.47Å; N80-T351 WeakPolarHBondContact ND2-CG2 3.42Å
81	H	87.7	Confident	84.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.009	20%	0.204	C	C	.	.	I	π-helix	trans	-80.3	-28.8	-166.4	76.6	-80.9	0	0	0	113.6	E73 D77 S85 F168 Y259	E73-H81 IonicContact OE2-CE1 3.92Å; E73-H81 PolarHBondContact OE2-CE1 3.45Å; E73-H81 IonicContact OE2-ND1 2.9Å; E73-H81 PolarHBondContact OE2-ND1 2.91Å; E73-H81 VanDerWaalsContact OE2-ND1 3.11Å; E73-H81 IonicContact OE2-NE2 2.62Å; D77-H81 PolarHBondContact O-N 3.47Å; D77-H81 PolarHBondContact O-ND1 3.45Å; H81-S85 WeakPolarHBondContact O-CB 3.42Å; H81-F168 WeakPolarHBondContact CA-O 3.47Å; H81-Y259 HydrophobicContact CB-CE1 4.09Å
82	Y	84.3	Confident	86.2	Confident	59 Å²	59	33.6 Å²	33.6	23%	0.231	18%	0.178	C	C	.	.	I	π-helix	trans	-99.5	-60.1	-175	-177.6	-98.2	0	0	0	111.3	P69 R78 S86	P69-Y82 HydrophobicContact CB-CD2 4.45Å; R78-Y82 WeakPolarHBondContact O-CB 3.41Å; R78-Y82 PolarHBondContact O-N 3.34Å; Y82-S86 WeakPolarHBondContact O-CB 3.4Å; Y82-S86 PolarHBondContact O-N 3.42Å; Y82-S86 PolarHBondContact O-OG 2.99Å
83	V	87.3	Confident	87.4	Confident	45 Å²	45	38.6 Å²	38.6	27%	0.273	20%	0.204	S	C	.	.	I	π-helix	trans	-68.3	-49.7	-174.3	-178.6	0	0	0	0	110.9	R78 L79 S86 L87 W343	R78-V83 PolarHBondContact O-N 2.72Å; R78-V83 VanDerWaalsContact O-N 3.09Å; L79-V83 HydrophobicContact CD2-CB 4.27Å; L79-V83 HydrophobicContact CD2-CG1 4.45Å; L79-V83 HydrophobicContact CD2-CG2 4.12Å; V83-S86 PolarHBondContact O-N 3.36Å; V83-L87 VanDerWaalsContact O-CB 3.26Å; V83-L87 WeakPolarHBondContact O-CB 3.34Å; V83-L87 PolarHBondContact O-N 3.36Å; V83-W343 HydrophobicContact CG1-CH2 3.91Å; V83-W343 HydrophobicContact CG1-CZ2 3.72Å
84	T	91.6	Very high	88.1	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.225	C	C	.	.	I	π-helix	trans	-69.2	-42.8	-177.6	-54.4	0	0	0	0	112	L79 N80 S86 L87 L88 F168 W343 Y344 L347	L79-T84 WeakPolarHBondContact O-CB 3.39Å; L79-T84 PolarHBondContact O-N 3.02Å; L79-T84 PolarHBondContact O-OG1 3.23Å; N80-T84 VanDerWaalsContact O-CB 3.31Å; N80-T84 WeakPolarHBondContact O-CB 3.33Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 3.19Å; T84-L87 PolarHBondContact O-N 2.92Å; T84-L88 HydrophobicContact CG2-CD1 3.96Å; T84-L88 HydrophobicContact CG2-CG 4.36Å; T84-L88 WeakPolarHBondContact O-CB 3.09Å; T84-L88 VanDerWaalsContact O-CG 3.24Å; T84-L88 WeakPolarHBondContact O-CG 3.07Å; T84-L88 PolarHBondContact O-N 3.47Å; T84-F168 HydrophobicContact CG2-CD1 4.21Å; T84-F168 HydrophobicContact CG2-CD2 3.88Å; T84-F168 HydrophobicContact CG2-CE1 4.09Å; T84-F168 HydrophobicContact CG2-CE2 3.73Å; T84-F168 HydrophobicContact CG2-CG 4.12Å; T84-F168 HydrophobicContact CG2-CZ 3.86Å; T84-W343 PolarHBondContact OG1-NE1 3.18Å; T84-Y344 HydrophobicContact CG2-CE1 3.83Å; T84-L347 HydrophobicContact CG2-CD1 4.39Å; T84-L347 WeakPolarHBondContact OG1-CD1 3.3Å
85	S	89.7	Confident	88.3	Confident	5 Å²	5	41.1 Å²	41.1	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-43.7	174.5	-168.2	0	0	0	0	111.8	H81 L88 I89 A165	H81-S85 WeakPolarHBondContact O-CB 3.42Å; S85-L88 PolarHBondContact O-N 2.99Å; S85-I89 VanDerWaalsContact O-CG1 3.26Å; S85-I89 WeakPolarHBondContact O-CG1 3.46Å; S85-I89 PolarHBondContact O-N 3.16Å; S85-A165 PolarHBondContact OG-O 3.36Å
86	S	86.9	Confident	88.4	Confident	57 Å²	57	36.9 Å²	36.9	40%	0.399	20%	0.198	S	C	.	.	H	α-helix	trans	-65.7	-40.8	177.3	-57.5	0	0	0	0	112.4	Y82 V83 T84 I89 A90	Y82-S86 WeakPolarHBondContact O-CB 3.4Å; Y82-S86 PolarHBondContact O-N 3.42Å; Y82-S86 PolarHBondContact O-OG 2.99Å; V83-S86 PolarHBondContact O-N 3.36Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 3.19Å; S86-I89 PolarHBondContact O-N 2.83Å; S86-A90 WeakPolarHBondContact O-CB 3.47Å; S86-A90 PolarHBondContact O-N 3.29Å
87	L	89.2	Confident	88.2	Confident	41 Å²	41	44.5 Å²	44.5	22%	0.215	23%	0.231	C	C	.	.	H	α-helix	trans	-60.6	-46.2	175.4	175.3	64.3	0	0	0	111.1	V83 T84 A90 L91 F339 W343	V83-L87 VanDerWaalsContact O-CB 3.26Å; V83-L87 WeakPolarHBondContact O-CB 3.34Å; V83-L87 PolarHBondContact O-N 3.36Å; T84-L87 PolarHBondContact O-N 2.92Å; L87-A90 PolarHBondContact O-N 3.41Å; L87-L91 HydrophobicContact CD1-CD1 4.16Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.08Å; L87-L91 WeakPolarHBondContact O-CB 3.34Å; L87-L91 VanDerWaalsContact O-CG 3.29Å; L87-L91 WeakPolarHBondContact O-CG 3.41Å; L87-L91 PolarHBondContact O-N 2.89Å; L87-F339 HydrophobicContact CD1-CE1 4.06Å; L87-F339 HydrophobicContact CD2-CE1 3.84Å; L87-F339 HydrophobicContact CD2-CZ 4.26Å; L87-F339 HydrophobicContact CG-CE1 4.38Å; L87-W343 HydrophobicContact CD2-CD2 4.06Å; L87-W343 HydrophobicContact CD2-CG 4.19Å; L87-W343 HydrophobicContact CD2-CZ2 4.49Å
88	L	91.5	Very high	88	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-42.1	178.7	-70.6	168.1	0	0	0	112.3	T84 S85 A90 L91 A92 L161 E164 A165 F168 L340 Y344	T84-L88 HydrophobicContact CG2-CD1 3.96Å; T84-L88 HydrophobicContact CG2-CG 4.36Å; T84-L88 WeakPolarHBondContact O-CB 3.09Å; T84-L88 VanDerWaalsContact O-CG 3.24Å; T84-L88 WeakPolarHBondContact O-CG 3.07Å; T84-L88 PolarHBondContact O-N 3.47Å; S85-L88 PolarHBondContact O-N 2.99Å; L88-A90 VanDerWaalsContact C-N 3.35Å; L88-L91 PolarHBondContact O-N 3.14Å; L88-A92 WeakPolarHBondContact O-CB 3.14Å; L88-A92 PolarHBondContact O-N 2.95Å; L88-L161 HydrophobicContact CD2-CD2 3.82Å; L88-E164 HydrophobicContact CD1-CB 3.93Å; L88-A165 HydrophobicContact CB-CB 3.76Å; L88-A165 HydrophobicContact CD1-CB 4.29Å; L88-F168 HydrophobicContact CD1-CD2 3.55Å; L88-F168 HydrophobicContact CD1-CE2 3.85Å; L88-L340 HydrophobicContact CD2-CD1 4.05Å; L88-L340 HydrophobicContact CD2-CD2 3.77Å; L88-Y344 WeakPolarHBondContact CD1-OH 3.38Å; L88-Y344 VanDerWaalsContact CD2-OH 3.27Å; L88-Y344 WeakPolarHBondContact CD2-OH 3.41Å
89	I	87.9	Confident	87.9	Confident	72 Å²	72	41.4 Å²	41.4	37%	0.369	22%	0.221	S	C	.	.	H	α-helix	trans	-61.7	-44.4	174.3	-68.4	165	0	0	0	110.5	S85 S86 L91 A92 I93 A165	S85-I89 VanDerWaalsContact O-CG1 3.26Å; S85-I89 WeakPolarHBondContact O-CG1 3.46Å; S85-I89 PolarHBondContact O-N 3.16Å; S86-I89 PolarHBondContact O-N 2.83Å; I89-L91 PolarHBondContact O-N 3.47Å; I89-A92 PolarHBondContact O-N 2.97Å; I89-I93 HydrophobicContact CG2-CD1 3.93Å; I89-I93 VanDerWaalsContact O-CG1 3.29Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.43Å; I89-A165 HydrophobicContact CD1-CB 4.44Å; I89-A165 HydrophobicContact CG1-CB 3.84Å
90	A	87.1	Confident	87.5	Confident	55 Å²	55	47 Å²	47	46%	0.455	24%	0.243	S	C	.	.	H	α-helix	trans	-62.4	-42.5	177.8	0	0	0	0	0	112.1	S86 L87 L88 I93 L94	S86-A90 WeakPolarHBondContact O-CB 3.47Å; S86-A90 PolarHBondContact O-N 3.29Å; L87-A90 PolarHBondContact O-N 3.41Å; L88-A90 VanDerWaalsContact C-N 3.35Å; A90-I93 PolarHBondContact O-N 2.96Å; A90-L94 WeakPolarHBondContact O-CB 3.41Å; A90-L94 PolarHBondContact O-N 3.5Å
91	L	89.3	Confident	86.8	Confident	23 Å²	23	49.9 Å²	49.9	12%	0.12	27%	0.273	C	S	.	.	H	α-helix	trans	-65.7	-40.7	175.3	-70.8	170.1	0	0	0	111.8	L87 L88 I89 I93 L94 V95 L161 I336 L340	L87-L91 HydrophobicContact CD1-CD1 4.16Å; L87-L91 HydrophobicContact CD1-CG 4.38Å; L87-L91 HydrophobicContact CG-CD1 4.08Å; L87-L91 WeakPolarHBondContact O-CB 3.34Å; L87-L91 VanDerWaalsContact O-CG 3.29Å; L87-L91 WeakPolarHBondContact O-CG 3.41Å; L87-L91 PolarHBondContact O-N 2.89Å; L88-L91 PolarHBondContact O-N 3.14Å; I89-L91 PolarHBondContact O-N 3.47Å; L91-I93 VanDerWaalsContact C-N 3.33Å; L91-I93 PolarHBondContact O-N 3.25Å; L91-L94 PolarHBondContact O-N 3.37Å; L91-V95 WeakPolarHBondContact O-CG2 3.37Å; L91-V95 PolarHBondContact O-N 3.46Å; L91-L161 HydrophobicContact CB-CD1 4.14Å; L91-I336 HydrophobicContact CD1-CG2 4.2Å; L91-I336 HydrophobicContact CD2-CD1 4.47Å; L91-I336 HydrophobicContact CD2-CG1 4.24Å; L91-I336 HydrophobicContact CD2-CG2 4.42Å; L91-L340 HydrophobicContact CD1-CD1 4.31Å; L91-L340 HydrophobicContact CD1-CD2 3.79Å; L91-L340 HydrophobicContact CD1-CG 4.15Å
92	A	89.7	Confident	86.4	Confident	2 Å²	2	51.5 Å²	51.5	2%	0.017	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-41.2	176	0	0	0	0	0	111.9	L88 I89 S96 L161 L162	L88-A92 WeakPolarHBondContact O-CB 3.14Å; L88-A92 PolarHBondContact O-N 2.95Å; I89-A92 PolarHBondContact O-N 2.97Å; A92-S96 VanDerWaalsContact O-CB 3.27Å; A92-S96 WeakPolarHBondContact O-CB 3.39Å; A92-S96 PolarHBondContact O-N 2.71Å; A92-S96 PolarHBondContact O-OG 3.12Å; A92-L161 HydrophobicContact CB-CB 3.9Å; A92-L161 HydrophobicContact CB-CD1 4.41Å; A92-L162 HydrophobicContact CB-CD2 3.97Å; A92-L162 HydrophobicContact CB-CG 3.95Å
93	I	88.7	Confident	86.4	Confident	109 Å²	109	51.9 Å²	51.9	56%	0.559	30%	0.3	S	S	*	.	H	α-helix	trans	-64.1	-44.4	174.5	-67.2	165.5	0	0	0	110.6	I89 A90 L91 S96 F97	I89-I93 HydrophobicContact CG2-CD1 3.93Å; I89-I93 VanDerWaalsContact O-CG1 3.29Å; I89-I93 WeakPolarHBondContact O-CG1 3.3Å; I89-I93 PolarHBondContact O-N 3.43Å; A90-I93 PolarHBondContact O-N 2.96Å; L91-I93 VanDerWaalsContact C-N 3.33Å; L91-I93 PolarHBondContact O-N 3.25Å; I93-S96 PolarHBondContact O-N 2.9Å; I93-F97 WeakPolarHBondContact O-CB 3.39Å; I93-F97 PolarHBondContact O-N 3.23Å
94	L	86.6	Confident	86.3	Confident	91 Å²	91	50.7 Å²	50.7	48%	0.476	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-46.2	179.5	-175.3	150.4	0	0	0	112.1	A90 L91 F97 K98	A90-L94 WeakPolarHBondContact O-CB 3.41Å; A90-L94 PolarHBondContact O-N 3.5Å; L91-L94 PolarHBondContact O-N 3.37Å; L94-F97 PolarHBondContact O-N 2.82Å; L94-K98 PolarHBondContact O-N 3.25Å; L94-K98 VanDerWaalsContact O-N 3.16Å
95	V	86.8	Confident	86.2	Confident	3 Å²	3	50.9 Å²	50.9	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-64.9	-43.1	177.2	179	0	0	0	0	110.4	L91 F97 K98 Q99 V157 P158 L161 I329 I336	L91-V95 WeakPolarHBondContact O-CG2 3.37Å; L91-V95 PolarHBondContact O-N 3.46Å; V95-F97 VanDerWaalsContact C-N 3.32Å; V95-F97 PolarHBondContact O-N 3.02Å; V95-K98 PolarHBondContact O-N 3.26Å; V95-K98 VanDerWaalsContact O-N 3.13Å; V95-Q99 WeakPolarHBondContact O-CB 3.44Å; V95-Q99 PolarHBondContact O-N 2.9Å; V95-V157 HydrophobicContact CG1-CG1 4.27Å; V95-P158 HydrophobicContact CB-CG 4.39Å; V95-P158 HydrophobicContact CG1-CG 3.85Å; V95-L161 HydrophobicContact CG2-CD1 4.46Å; V95-I329 HydrophobicContact CG1-CD1 4.21Å; V95-I336 HydrophobicContact CG2-CD1 3.34Å
96	S	86.9	Confident	86.4	Confident	32 Å²	32	54.4 Å²	54.4	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-42.1	176.6	-59.7	0	0	0	0	111.7	A92 I93 K98 Q99 F100 P158	A92-S96 VanDerWaalsContact O-CB 3.27Å; A92-S96 WeakPolarHBondContact O-CB 3.39Å; A92-S96 PolarHBondContact O-N 2.71Å; A92-S96 PolarHBondContact O-OG 3.12Å; I93-S96 PolarHBondContact O-N 2.9Å; S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 PolarHBondContact O-N 2.98Å; S96-Q99 PolarHBondContact O-N 3.07Å; S96-Q99 VanDerWaalsContact O-N 3.16Å; S96-F100 WeakPolarHBondContact O-CD2 3.41Å; S96-F100 PolarHBondContact O-N 3.33Å; S96-P158 WeakPolarHBondContact OG-CB 3.48Å
97	F	84.9	Confident	86.7	Confident	164 Å²	164	52 Å²	52	72%	0.719	29%	0.293	S	S	*	.	H	α-helix	trans	-59.7	-41.7	176	-178.9	-98.1	0	0	0	111.6	I93 L94 V95 G101	I93-F97 WeakPolarHBondContact O-CB 3.39Å; I93-F97 PolarHBondContact O-N 3.23Å; L94-F97 PolarHBondContact O-N 2.82Å; V95-F97 VanDerWaalsContact C-N 3.32Å; V95-F97 PolarHBondContact O-N 3.02Å; F97-G101 VanDerWaalsContact O-CA 3.24Å; F97-G101 WeakPolarHBondContact O-CA 3.19Å; F97-G101 PolarHBondContact O-N 3.36Å
98	K	85.4	Confident	86.9	Confident	52 Å²	52	57 Å²	57	23%	0.226	32%	0.317	C	S	.	.	H	α-helix	trans	-70	-31.8	176.1	-176.5	63.2	-171.2	78.9	0	113.1	L94 V95 S96 T103 F332	L94-K98 PolarHBondContact O-N 3.25Å; L94-K98 VanDerWaalsContact O-N 3.16Å; V95-K98 PolarHBondContact O-N 3.26Å; V95-K98 VanDerWaalsContact O-N 3.13Å; S96-K98 VanDerWaalsContact C-N 3.3Å; S96-K98 PolarHBondContact O-N 2.98Å; K98-T103 PolarHBondContact NZ-O 3.48Å; K98-F332 HydrophobicContact CD-CE2 4.2Å; K98-F332 HydrophobicContact CG-CD2 4.3Å; K98-F332 HydrophobicContact CG-CE2 4.26Å
99	Q	84.6	Confident	87	Confident	17 Å²	17	58.2 Å²	58.2	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-76.5	-38	-178.6	-176.9	170.2	-23.7	0	0	113	V95 S96 W126 P158 I329	V95-Q99 WeakPolarHBondContact O-CB 3.44Å; V95-Q99 PolarHBondContact O-N 2.9Å; S96-Q99 PolarHBondContact O-N 3.07Å; S96-Q99 VanDerWaalsContact O-N 3.16Å; Q99-W126 HydrophobicContact CG-CH2 4.35Å; Q99-W126 HydrophobicContact CG-CZ2 3.89Å; Q99-P158 VanDerWaalsContact OE1-CG 3.29Å; Q99-I329 HydrophobicContact CB-CD1 4.09Å; Q99-I329 HydrophobicContact CG-CD1 4.37Å
100	F	80.8	Confident	87.2	Confident	157 Å²	157	57.2 Å²	57.2	69%	0.689	32%	0.323	S	S	*	.	H	α-helix	trans	-101.3	-26.1	-178.2	-63.2	-67.9	0	0	0	113.7	S96	S96-F100 WeakPolarHBondContact O-CD2 3.41Å; S96-F100 PolarHBondContact O-N 3.33Å
101	G	76	Confident	87.3	Confident	61 Å²	61	62.8 Å²	62.8	63%	0.629	35%	0.345	S	S	*	.	S	Bend	trans	-89.8	-5.2	-177.8	0	0	0	0	0	114.6	F97	F97-G101 VanDerWaalsContact O-CA 3.24Å; F97-G101 WeakPolarHBondContact O-CA 3.19Å; F97-G101 PolarHBondContact O-N 3.36Å
102	G	79	Confident	87.3	Confident	37 Å²	37	68.3 Å²	68.3	38%	0.381	37%	0.371	S	S	.	.	S	Bend	trans	-148	-175.9	176.2	0	0	0	0	0	111.6	P104	G102-P104 WeakPolarHBondContact O-CD 3.46Å
103	T	83.6	Confident	87.2	Confident	67 Å²	67	69.4 Å²	69.4	41%	0.411	38%	0.376	S	S	.	.			trans	-78	116.3	173.6	46	0	0	0	0	109.4	K98 I105 E106	K98-T103 PolarHBondContact NZ-O 3.48Å; T103-I105 VanDerWaalsContact C-N 3.33Å; T103-E106 WeakPolarHBondContact CB-OE1 3.45Å; T103-E106 WeakPolarHBondContact CG2-OE1 3.22Å; T103-E106 PolarHBondContact OG1-OE1 2.76Å
104	P	85.8	Confident	87.4	Confident	20 Å²	20	67.1 Å²	67.1	13%	0.13	37%	0.369	C	S	.	.	S	Bend	trans	-76.7	-25.5	-179.5	30.6	-34.4	0	0	0	112.2	G102 W126 V328	G102-P104 WeakPolarHBondContact O-CD 3.46Å; P104-W126 HydrophobicContact CB-CD2 4.26Å; P104-W126 HydrophobicContact CB-CE3 3.86Å; P104-W126 HydrophobicContact CB-CH2 3.85Å; P104-W126 HydrophobicContact CB-CZ2 4.25Å; P104-W126 HydrophobicContact CB-CZ3 3.64Å; P104-W126 HydrophobicContact CG-CD2 3.73Å; P104-W126 HydrophobicContact CG-CE3 3.76Å; P104-W126 HydrophobicContact CG-CG 4.25Å; P104-W126 HydrophobicContact CG-CH2 4.33Å; P104-W126 HydrophobicContact CG-CZ2 4.31Å; P104-W126 HydrophobicContact CG-CZ3 4.06Å; P104-V328 PolarHBondContact O-N 3.46Å
105	I	90.6	Very high	87.6	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.021	38%	0.381	C	S	.	.			trans	-140.8	142	-178.2	-166.4	169.1	0	0	0	109.2	T103 C125 W126 T130 C325 L327	T103-I105 VanDerWaalsContact C-N 3.33Å; I105-C125 HydrophobicContact CD1-CB 4.31Å; I105-W126 HydrophobicContact CB-CE3 4.4Å; I105-W126 HydrophobicContact CG2-CB 3.94Å; I105-W126 HydrophobicContact CG2-CE3 4.3Å; I105-T130 HydrophobicContact CD1-CG2 3.94Å; I105-C325 HydrophobicContact CD1-CB 3.58Å; I105-C325 HydrophobicContact CG1-CB 3.66Å; I105-L327 HydrophobicContact CB-CD1 4.44Å; I105-L327 HydrophobicContact CD1-CD1 4.39Å; I105-L327 HydrophobicContact CG1-CD1 4.44Å
106	E	92.1	Very high	87.8	Confident	78 Å²	78	74.1 Å²	74.1	36%	0.364	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.2	176.8	-65.6	-80.6	158.4	0	0	107.5	T103 E122 C325 V326	T103-E106 WeakPolarHBondContact CB-OE1 3.45Å; T103-E106 WeakPolarHBondContact CG2-OE1 3.22Å; T103-E106 PolarHBondContact OG1-OE1 2.76Å; E106-E122 WeakPolarHBondContact CA-OE1 3.5Å; E106-C325 CarbonylContact O-C 3.56Å; E106-C325 VanDerWaalsContact O-CA 3.26Å; E106-C325 WeakPolarHBondContact O-CA 3.46Å; E106-V326 PolarHBondContact N-O 2.87Å; E106-V326 PolarHBondContact O-N 3.39Å
107	C	94.4	Very high	88.1	Confident	8 Å²	8	77.4 Å²	77.4	5%	0.054	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.4	-172	-66.2	0	0	0	0	112.8	V109 E122 V323 C325	C107-V109 PolarHBondContact O-N 3.47Å; C107-V109 VanDerWaalsContact O-N 3.13Å; C107-E122 HydrophobicContact CB-CG 3.92Å; C107-E122 PolarHBondContact N-OE1 3.02Å; C107-V323 HydrophobicContact CB-CG2 4.48Å; C107-C325 HydrophobicContact CB-CB 4.11Å; C107-C325 WeakPolarHBondContact CB-SG 3.28Å; C107-C325 WeakPolarHBondContact SG-CB 3.09Å; C107-C325 CovalentContact SG-SG 2.05Å; C107-C325 PolarHBondContact SG-SG 3.23Å
108	M	93.9	Very high	88.4	Confident	146 Å²	146	72.8 Å²	72.8	72%	0.719	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	98	171.1	-176.8	175.7	-87.9	0	0	109.4	Q324	M108-Q324 PolarHBondContact N-O 3.12Å
109	V	92.2	Very high	88.7	Confident	24 Å²	24	76 Å²	76	15%	0.145	41%	0.409	C	S	.	.			trans	-93.7	153	174.5	-63.3	0	0	0	0	111.4	C107 F113 E118 A121 V323	C107-V109 PolarHBondContact O-N 3.47Å; C107-V109 VanDerWaalsContact O-N 3.13Å; V109-F113 HydrophobicContact CB-CB 4.35Å; V109-F113 HydrophobicContact CB-CD2 3.94Å; V109-F113 HydrophobicContact CG1-CD2 4.25Å; V109-F113 HydrophobicContact CG2-CB 4.19Å; V109-E118 HydrophobicContact CG2-CB 3.88Å; V109-E118 HydrophobicContact CG2-CG 3.9Å; V109-A121 HydrophobicContact CG1-CB 3.8Å; V109-V323 HydrophobicContact CG1-CG1 4.34Å
110	P	91.7	Very high	89	Confident	52 Å²	52	80.2 Å²	80.2	34%	0.338	43%	0.425	S	S	.	.			trans	-60.9	144.6	175.4	-22.6	33.9	0	0	0	112.5	M112 F113	P110-M112 HydrophobicContact CB-CG 3.75Å; P110-M112 PolarHBondContact O-N 3.31Å; P110-F113 WeakPolarHBondContact O-CB 3.42Å; P110-F113 PolarHBondContact O-N 3.44Å
111	D	89.5	Confident	89.6	Confident	171 Å²	171	72.8 Å²	72.8	91%	0.914	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.5	-177.6	-64.6	-23.9	0	0	0	115	F113	D111-F113 PolarHBondContact O-N 3.08Å
112	M	89.6	Confident	90.3	Very high	139 Å²	139	71 Å²	71	69%	0.685	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-14.3	174.9	46.8	178.4	-93.4	0	0	113.7	P110	P110-M112 HydrophobicContact CB-CG 3.75Å; P110-M112 PolarHBondContact O-N 3.31Å
113	F	88.5	Confident	90.9	Very high	26 Å²	26	74.5 Å²	74.5	11%	0.114	38%	0.378	C	S	.	.	S	Bend	trans	-85.1	129.5	179	-78.7	14.5	0	0	0	110.5	V109 P110 D111 W117 F310 Y321	V109-F113 HydrophobicContact CB-CB 4.35Å; V109-F113 HydrophobicContact CB-CD2 3.94Å; V109-F113 HydrophobicContact CG1-CD2 4.25Å; V109-F113 HydrophobicContact CG2-CB 4.19Å; P110-F113 WeakPolarHBondContact O-CB 3.42Å; P110-F113 PolarHBondContact O-N 3.44Å; D111-F113 PolarHBondContact O-N 3.08Å; F113-W117 HydrophobicContact CB-CB 3.72Å; F113-W117 HydrophobicContact CD2-CB 3.79Å; F113-W117 HydrophobicContact CE2-CE3 4.41Å; F113-W117 HydrophobicContact CG-CB 3.84Å; F113-W117 HydrophobicContact CG-CG 4.39Å; F113-F310 AromaticContact CE2-CE2 3.99Å; F113-F310 HydrophobicContact CE2-CE2 3.99Å; F113-F310 AromaticContact CE2-CZ 3.61Å; F113-F310 HydrophobicContact CE2-CZ 3.61Å; F113-F310 HydrophobicContact CZ-CE2 4.28Å; F113-F310 HydrophobicContact CZ-CZ 4.15Å; F113-Y321 HydrophobicContact CZ-CD1 4.38Å; F113-Y321 HydrophobicContact CZ-CD2 4.41Å; F113-Y321 HydrophobicContact CZ-CE1 4.39Å; F113-Y321 HydrophobicContact CZ-CE2 4.45Å; F113-Y321 HydrophobicContact CZ-CG 4.39Å
114	S	92.2	Very high	91.3	Very high	60 Å²	60	74.3 Å²	74.3	42%	0.42	37%	0.37	S	S	.	.			trans	-69.1	163.6	170.5	66.6	0	0	0	0	110.6	S116 W117 E118	S114-S116 PolarHBondContact O-N 3.41Å; S114-S116 PolarHBondContact OG-OG 3.33Å; S114-W117 WeakPolarHBondContact O-CA 3.48Å; S114-W117 WeakPolarHBondContact O-CB 3.48Å; S114-W117 PolarHBondContact O-N 2.97Å; S114-W117 VanDerWaalsContact OG-CD1 3.31Å; S114-E118 PolarHBondContact O-N 3.24Å; S114-E118 VanDerWaalsContact O-N 3.08Å
115	K	91.5	Very high	91.6	Very high	167 Å²	167	73.4 Å²	73.4	73%	0.726	36%	0.364	S	S	*	.	H	α-helix	trans	-52.8	-29.1	175.6	-67	-171.7	174.4	-172	0	114.1	Q119	K115-Q119 WeakPolarHBondContact O-CG 3.41Å; K115-Q119 PolarHBondContact O-N 3.02Å; K115-Q119 VanDerWaalsContact O-N 3.07Å
116	S	91.4	Very high	91.5	Very high	74 Å²	74	75.4 Å²	75.4	52%	0.517	37%	0.371	S	S	.	.	H	α-helix	trans	-71.1	-33.5	175.2	57	0	0	0	0	112.7	S114 Y120	S114-S116 PolarHBondContact O-N 3.41Å; S114-S116 PolarHBondContact OG-OG 3.33Å; S116-Y120 WeakPolarHBondContact O-CB 3.16Å; S116-Y120 PolarHBondContact O-N 3.48Å
117	W	91.5	Very high	91.4	Very high	101 Å²	101	75 Å²	75	38%	0.383	38%	0.381	S	S	.	.	H	α-helix	trans	-72.3	-35.8	173.5	-79.6	101.4	0	0	0	111.8	F113 S114 Y120 A121 V312	F113-W117 HydrophobicContact CB-CB 3.72Å; F113-W117 HydrophobicContact CD2-CB 3.79Å; F113-W117 HydrophobicContact CE2-CE3 4.41Å; F113-W117 HydrophobicContact CG-CB 3.84Å; F113-W117 HydrophobicContact CG-CG 4.39Å; S114-W117 WeakPolarHBondContact O-CA 3.48Å; S114-W117 WeakPolarHBondContact O-CB 3.48Å; S114-W117 PolarHBondContact O-N 2.97Å; S114-W117 VanDerWaalsContact OG-CD1 3.31Å; W117-Y120 HydrophobicContact CE3-CD1 4.24Å; W117-Y120 HydrophobicContact CZ3-CD1 4.4Å; W117-Y120 PolarHBondContact O-N 2.86Å; W117-A121 WeakPolarHBondContact O-CB 3.48Å; W117-A121 PolarHBondContact O-N 3.49Å; W117-V312 HydrophobicContact CH2-CG1 3.66Å; W117-V312 HydrophobicContact CH2-CG2 4.37Å; W117-V312 HydrophobicContact CZ3-CG1 3.94Å; W117-V312 HydrophobicContact CZ3-CG2 3.77Å
118	E	92	Very high	90.9	Very high	67 Å²	67	79.5 Å²	79.5	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-58.5	-54.4	171.2	-174.3	179	-172.8	0	0	110.9	V109 S114 Y120 A121 E122	V109-E118 HydrophobicContact CG2-CB 3.88Å; V109-E118 HydrophobicContact CG2-CG 3.9Å; S114-E118 PolarHBondContact O-N 3.24Å; S114-E118 VanDerWaalsContact O-N 3.08Å; E118-Y120 VanDerWaalsContact C-N 3.29Å; E118-Y120 PolarHBondContact O-N 2.9Å; E118-A121 PolarHBondContact O-N 2.94Å; E118-A121 VanDerWaalsContact O-N 3.09Å; E118-E122 WeakPolarHBondContact O-CG 3.45Å; E118-E122 PolarHBondContact O-N 2.92Å
119	Q	91.5	Very high	90.5	Very high	120 Å²	120	74.8 Å²	74.8	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-60.4	-36.8	175.9	-71.3	177.1	-10.3	0	0	113	K115 N123	K115-Q119 WeakPolarHBondContact O-CG 3.41Å; K115-Q119 PolarHBondContact O-N 3.02Å; K115-Q119 VanDerWaalsContact O-N 3.07Å; Q119-N123 WeakPolarHBondContact O-CB 3.47Å; Q119-N123 VanDerWaalsContact O-CG 3.29Å; Q119-N123 PolarHBondContact O-N 2.63Å; Q119-N123 PolarHBondContact O-ND2 3Å
120	Y	91.6	Very high	90.4	Very high	106 Å²	106	73.6 Å²	73.6	42%	0.416	37%	0.372	S	S	.	.	H	α-helix	trans	-64	-47.3	174	173	-97.7	0	0	0	111.2	S116 W117 E118 N123 Y124	S116-Y120 WeakPolarHBondContact O-CB 3.16Å; S116-Y120 PolarHBondContact O-N 3.48Å; W117-Y120 HydrophobicContact CE3-CD1 4.24Å; W117-Y120 HydrophobicContact CZ3-CD1 4.4Å; W117-Y120 PolarHBondContact O-N 2.86Å; E118-Y120 VanDerWaalsContact C-N 3.29Å; E118-Y120 PolarHBondContact O-N 2.9Å; Y120-N123 PolarHBondContact O-N 2.91Å; Y120-Y124 WeakPolarHBondContact O-CB 3.47Å; Y120-Y124 PolarHBondContact O-N 3.42Å
121	A	92.5	Very high	90.4	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-46	179	0	0	0	0	0	111	V109 W117 E118 Y124 C125 F310	V109-A121 HydrophobicContact CG1-CB 3.8Å; W117-A121 WeakPolarHBondContact O-CB 3.48Å; W117-A121 PolarHBondContact O-N 3.49Å; E118-A121 PolarHBondContact O-N 2.94Å; E118-A121 VanDerWaalsContact O-N 3.09Å; A121-Y124 PolarHBondContact O-N 3.01Å; A121-C125 WeakPolarHBondContact O-CB 3.33Å; A121-C125 PolarHBondContact O-N 2.93Å; A121-C125 PolarHBondContact O-SG 3.25Å; A121-F310 HydrophobicContact CB-CD1 4.49Å; A121-F310 HydrophobicContact CB-CE1 4.07Å; A121-F310 HydrophobicContact CB-CZ 4.39Å
122	E	91.6	Very high	90.3	Very high	23 Å²	23	64.4 Å²	64.4	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-48.3	177.5	-70.9	177.3	158.8	0	0	112.5	E106 C107 E118 Y124 C125 W126	E106-E122 WeakPolarHBondContact CA-OE1 3.5Å; C107-E122 HydrophobicContact CB-CG 3.92Å; C107-E122 PolarHBondContact N-OE1 3.02Å; E118-E122 WeakPolarHBondContact O-CG 3.45Å; E118-E122 PolarHBondContact O-N 2.92Å; E122-Y124 PolarHBondContact O-N 3.33Å; E122-C125 PolarHBondContact O-N 3.44Å; E122-W126 VanDerWaalsContact O-CB 3.31Å; E122-W126 WeakPolarHBondContact O-CB 3.42Å; E122-W126 PolarHBondContact O-N 3.47Å
123	N	90.6	Very high	90.2	Very high	111 Å²	111	58.6 Å²	58.6	59%	0.594	29%	0.29	S	S	*	.	H	α-helix	trans	-66.1	-38.5	178.1	-74.6	-48.7	0	0	0	112.1	Q119 Y120 A127	Q119-N123 WeakPolarHBondContact O-CB 3.47Å; Q119-N123 VanDerWaalsContact O-CG 3.29Å; Q119-N123 PolarHBondContact O-N 2.63Å; Q119-N123 PolarHBondContact O-ND2 3Å; Y120-N123 PolarHBondContact O-N 2.91Å; N123-A127 WeakPolarHBondContact O-CB 3.06Å; N123-A127 PolarHBondContact O-N 3.19Å; N123-A127 VanDerWaalsContact O-N 3.1Å
124	Y	92.2	Very high	90.1	Very high	64 Å²	64	59 Å²	59	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-47.8	176.1	-175.2	-84	0	0	0	111	Y120 A121 E122 W126 A127 Q128 F310	Y120-Y124 WeakPolarHBondContact O-CB 3.47Å; Y120-Y124 PolarHBondContact O-N 3.42Å; A121-Y124 PolarHBondContact O-N 3.01Å; E122-Y124 PolarHBondContact O-N 3.33Å; Y124-W126 VanDerWaalsContact C-N 3.3Å; Y124-W126 PolarHBondContact O-N 3.05Å; Y124-A127 CarbonylContact O-C 3.59Å; Y124-A127 PolarHBondContact O-N 3.33Å; Y124-A127 VanDerWaalsContact O-N 3.07Å; Y124-Q128 HydrophobicContact CD1-CB 4.01Å; Y124-Q128 HydrophobicContact CE1-CB 3.69Å; Y124-Q128 HydrophobicContact CE1-CG 3.71Å; Y124-Q128 VanDerWaalsContact O-CB 3.26Å; Y124-Q128 WeakPolarHBondContact O-CB 3.42Å; Y124-Q128 PolarHBondContact O-N 2.97Å; Y124-F310 HydrophobicContact CD1-CB 3.35Å; Y124-F310 HydrophobicContact CD1-CG 4.46Å; Y124-F310 HydrophobicContact CE1-CB 3.3Å; Y124-F310 HydrophobicContact CG-CB 4.14Å
125	C	92.2	Very high	89.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.9	-32.2	179	-68.8	0	0	0	0	112.8	I105 A121 E122 A127 C308	I105-C125 HydrophobicContact CD1-CB 4.31Å; A121-C125 WeakPolarHBondContact O-CB 3.33Å; A121-C125 PolarHBondContact O-N 2.93Å; A121-C125 PolarHBondContact O-SG 3.25Å; E122-C125 PolarHBondContact O-N 3.44Å; C125-A127 VanDerWaalsContact C-N 3.32Å; C125-C308 WeakPolarHBondContact CA-SG 3.45Å; C125-C308 HydrophobicContact CB-CB 3.66Å; C125-C308 WeakPolarHBondContact CB-SG 3.31Å; C125-C308 WeakPolarHBondContact SG-CB 3.33Å; C125-C308 CovalentContact SG-SG 2.02Å; C125-C308 PolarHBondContact SG-SG 3.14Å
126	W	89.8	Confident	89.4	Confident	47 Å²	47	62.5 Å²	62.5	18%	0.178	31%	0.311	C	S	.	.	H	α-helix	trans	-63.9	-38.7	169.9	-179.8	-111.7	0	0	0	111.9	Q99 P104 I105 E122 Y124 Y154 Q155 L327 I329	Q99-W126 HydrophobicContact CG-CH2 4.35Å; Q99-W126 HydrophobicContact CG-CZ2 3.89Å; P104-W126 HydrophobicContact CB-CD2 4.26Å; P104-W126 HydrophobicContact CB-CE3 3.86Å; P104-W126 HydrophobicContact CB-CH2 3.85Å; P104-W126 HydrophobicContact CB-CZ2 4.25Å; P104-W126 HydrophobicContact CB-CZ3 3.64Å; P104-W126 HydrophobicContact CG-CD2 3.73Å; P104-W126 HydrophobicContact CG-CE3 3.76Å; P104-W126 HydrophobicContact CG-CG 4.25Å; P104-W126 HydrophobicContact CG-CH2 4.33Å; P104-W126 HydrophobicContact CG-CZ2 4.31Å; P104-W126 HydrophobicContact CG-CZ3 4.06Å; I105-W126 HydrophobicContact CB-CE3 4.4Å; I105-W126 HydrophobicContact CG2-CB 3.94Å; I105-W126 HydrophobicContact CG2-CE3 4.3Å; E122-W126 VanDerWaalsContact O-CB 3.31Å; E122-W126 WeakPolarHBondContact O-CB 3.42Å; E122-W126 PolarHBondContact O-N 3.47Å; Y124-W126 VanDerWaalsContact C-N 3.3Å; Y124-W126 PolarHBondContact O-N 3.05Å; W126-Y154 HydrophobicContact CE3-CD2 4.23Å; W126-Y154 AromaticContact CE3-CE2 3.82Å; W126-Y154 HydrophobicContact CE3-CE2 3.82Å; W126-Y154 AromaticContact CH2-CD2 3.63Å; W126-Y154 HydrophobicContact CH2-CD2 3.63Å; W126-Y154 HydrophobicContact CH2-CE2 4.03Å; W126-Y154 AromaticContact CZ3-CD2 3.34Å; W126-Y154 HydrophobicContact CZ3-CD2 3.34Å; W126-Y154 AromaticContact CZ3-CE2 3.4Å; W126-Y154 HydrophobicContact CZ3-CE2 3.4Å; W126-Q155 HydrophobicContact CH2-CG 4.21Å; W126-Q155 HydrophobicContact CZ2-CG 4.06Å; W126-Q155 PolarHBondContact O-NE2 3.05Å; W126-L327 HydrophobicContact CZ3-CD1 4.22Å; W126-I329 HydrophobicContact CH2-CD1 4.43Å; W126-I329 HydrophobicContact CZ3-CG2 4.39Å
127	A	89.5	Confident	89.1	Confident	69 Å²	69	64.1 Å²	64.1	57%	0.57	31%	0.31	S	S	*	.	H	α-helix	trans	-82.9	-33.2	-178	0	0	0	0	0	114.5	N123 Y124 C125	N123-A127 WeakPolarHBondContact O-CB 3.06Å; N123-A127 PolarHBondContact O-N 3.19Å; N123-A127 VanDerWaalsContact O-N 3.1Å; Y124-A127 CarbonylContact O-C 3.59Å; Y124-A127 PolarHBondContact O-N 3.33Å; Y124-A127 VanDerWaalsContact O-N 3.07Å; C125-A127 VanDerWaalsContact C-N 3.32Å
128	Q	83.6	Confident	88.8	Confident	102 Å²	102	65.3 Å²	65.3	48%	0.477	33%	0.329	S	S	.	.	S	Bend	trans	-102.3	23.8	-167.6	-164.6	57.6	26.5	0	0	113.9	Y124	Y124-Q128 HydrophobicContact CD1-CB 4.01Å; Y124-Q128 HydrophobicContact CE1-CB 3.69Å; Y124-Q128 HydrophobicContact CE1-CG 3.71Å; Y124-Q128 VanDerWaalsContact O-CB 3.26Å; Y124-Q128 WeakPolarHBondContact O-CB 3.42Å; Y124-Q128 PolarHBondContact O-N 2.97Å
129	D	85.4	Confident	88.5	Confident	47 Å²	47	65 Å²	65	25%	0.251	33%	0.332	S	S	.	.			trans	55.1	158	-175.9	-60.8	-30	0	0	0	114.6	S152 Q155	D129-S152 WeakPolarHBondContact OD1-CB 3.4Å; D129-S152 WeakPolarHBondContact OD2-CB 3.49Å; D129-Q155 PolarHBondContact OD1-NE2 3.37Å; D129-Q155 PolarHBondContact OD1-OE1 3.08Å
130	T	90.8	Very high	88.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	162.4	176.6	60.9	0	0	0	0	110.2	I105 R150 I151 Y154 T306 C308	I105-T130 HydrophobicContact CD1-CG2 3.94Å; T130-R150 CarbonylContact O-C 3.48Å; T130-R150 WeakPolarHBondContact O-CA 3.41Å; T130-I151 PolarHBondContact O-N 3.1Å; T130-Y154 PolarHBondContact N-OH 3.4Å; T130-Y154 PolarHBondContact OG1-OH 2.71Å; T130-Y154 VanDerWaalsContact OG1-OH 3.05Å; T130-T306 VanDerWaalsContact CB-OG1 3.23Å; T130-T306 WeakPolarHBondContact CB-OG1 3.45Å; T130-T306 WeakPolarHBondContact OG1-CB 2.97Å; T130-T306 PolarHBondContact OG1-OG1 3.49Å; T130-C308 HydrophobicContact CG2-CB 4.12Å
131	Y	90.3	Very high	87.7	Confident	11 Å²	11	65 Å²	65	4%	0.043	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	151.4	176.6	63.7	-82.7	0	0	0	111.1	R146 H149 T306 L307 D309	Y131-R146 HydrophobicContact CD2-CB 4.46Å; Y131-R146 HydrophobicContact CE2-CB 4.36Å; Y131-R146 HydrophobicContact CE2-CG 4.27Å; Y131-R146 PolarHBondContact OH-NH1 3.32Å; Y131-H149 VanDerWaalsContact CA-O 3.24Å; Y131-H149 WeakPolarHBondContact CA-O 3.17Å; Y131-H149 VanDerWaalsContact CB-O 3.29Å; Y131-H149 WeakPolarHBondContact CB-O 3.45Å; Y131-T306 WeakPolarHBondContact O-CA 3.26Å; Y131-T306 WeakPolarHBondContact O-CB 3.38Å; Y131-L307 HydrophobicContact CD1-CB 4.3Å; Y131-L307 WeakPolarHBondContact CD1-O 3.45Å; Y131-L307 HydrophobicContact CD2-CB 4.12Å; Y131-L307 HydrophobicContact CE1-CB 3.78Å; Y131-L307 WeakPolarHBondContact CE1-O 3.48Å; Y131-L307 HydrophobicContact CE2-CB 3.59Å; Y131-L307 HydrophobicContact CE2-CD1 3.69Å; Y131-L307 HydrophobicContact CE2-CG 4.28Å; Y131-L307 HydrophobicContact CG-CB 4.45Å; Y131-L307 PolarHBondContact N-O 2.97Å; Y131-L307 PolarHBondContact O-N 3.05Å; Y131-D309 VanDerWaalsContact CE1-OD2 3.28Å; Y131-D309 WeakPolarHBondContact CE1-OD2 3.33Å; Y131-D309 PolarHBondContact OH-OD1 3.26Å; Y131-D309 VanDerWaalsContact OH-OD1 3.05Å; Y131-D309 PolarHBondContact OH-OD2 3.47Å
132	F	88.6	Confident	87.4	Confident	19 Å²	19	70.6 Å²	70.6	8%	0.083	36%	0.361	C	S	.	.			trans	-105.7	134.8	176.9	171	-108.3	0	0	0	110.6	P134 H149 I151 W296 P303	F132-P134 HydrophobicContact CE1-CG 4.24Å; F132-P134 HydrophobicContact CZ-CG 4.38Å; F132-H149 PolarHBondContact N-O 2.92Å; F132-H149 WeakPolarHBondContact O-CB 3.33Å; F132-I151 HydrophobicContact CB-CD1 3.57Å; F132-W296 HydrophobicContact CE2-CE3 4.11Å; F132-W296 AromaticContact CE2-CZ3 3.79Å; F132-W296 HydrophobicContact CE2-CZ3 3.79Å; F132-P303 HydrophobicContact CB-CB 3.97Å; F132-P303 HydrophobicContact CB-CG 3.72Å; F132-P303 HydrophobicContact CD1-CB 4.41Å; F132-P303 HydrophobicContact CD2-CB 3.33Å; F132-P303 HydrophobicContact CD2-CG 4.08Å; F132-P303 HydrophobicContact CE2-CB 3.92Å; F132-P303 HydrophobicContact CG-CB 3.63Å; F132-P303 HydrophobicContact CG-CG 3.86Å
133	L	87.4	Confident	87	Confident	17 Å²	17	73 Å²	73	9%	0.089	37%	0.374	C	S	.	.			trans	-135.7	132.1	172	-167.6	71.2	0	0	0	108	E137 V139 L307	L133-E137 HydrophobicContact CD1-CB 3.96Å; L133-E137 VanDerWaalsContact CD1-OE2 3.24Å; L133-E137 WeakPolarHBondContact CD1-OE2 3.34Å; L133-E137 HydrophobicContact CD2-CB 4.23Å; L133-E137 WeakPolarHBondContact CD2-O 3.09Å; L133-E137 HydrophobicContact CG-CB 3.93Å; L133-V139 HydrophobicContact CD2-CB 4.4Å; L133-V139 HydrophobicContact CD2-CG2 4.17Å; L133-L307 HydrophobicContact CB-CD1 4.24Å
134	P	86.1	Confident	86.6	Confident	35 Å²	35	73 Å²	73	23%	0.227	37%	0.373	C	S	.	.			trans	-57.4	146.6	171.3	-22.3	33.5	0	0	0	111.3	F132 D136 E137	F132-P134 HydrophobicContact CE1-CG 4.24Å; F132-P134 HydrophobicContact CZ-CG 4.38Å; P134-D136 PolarHBondContact O-N 2.81Å; P134-D136 VanDerWaalsContact O-N 3.16Å; P134-E137 PolarHBondContact O-N 3Å; P134-E137 VanDerWaalsContact O-N 3.08Å
135	F	84.9	Confident	86.2	Confident	134 Å²	134	73.8 Å²	73.8	59%	0.588	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.1	-179.9	-72.9	-78.2	0	0	0	113.9	E137 W296 V305	F135-E137 VanDerWaalsContact C-N 3.28Å; F135-E137 PolarHBondContact O-N 3.39Å; F135-W296 HydrophobicContact CE2-CH2 4.44Å; F135-V305 HydrophobicContact CZ-CG1 4.3Å
136	D	84.7	Confident	85.7	Confident	165 Å²	165	75.2 Å²	75.2	88%	0.882	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.5	178.3	-61.2	-38.7	0	0	0	113	P134	P134-D136 PolarHBondContact O-N 2.81Å; P134-D136 VanDerWaalsContact O-N 3.16Å
137	E	84.1	Confident	85.3	Confident	108 Å²	108	76.9 Å²	76.9	51%	0.505	40%	0.395	S	S	.	.	S	Bend	trans	-101.3	135.4	-178.4	-68	-175.1	-174.9	0	0	111.7	L133 P134 F135	L133-E137 HydrophobicContact CD1-CB 3.96Å; L133-E137 VanDerWaalsContact CD1-OE2 3.24Å; L133-E137 WeakPolarHBondContact CD1-OE2 3.34Å; L133-E137 HydrophobicContact CD2-CB 4.23Å; L133-E137 WeakPolarHBondContact CD2-O 3.09Å; L133-E137 HydrophobicContact CG-CB 3.93Å; P134-E137 PolarHBondContact O-N 3Å; P134-E137 VanDerWaalsContact O-N 3.08Å; F135-E137 VanDerWaalsContact C-N 3.28Å; F135-E137 PolarHBondContact O-N 3.39Å
138	T	85.1	Confident	84.8	Confident	126 Å²	126	81.1 Å²	81.1	77%	0.773	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-75.5	136.8	175.9	57.9	0	0	0	0	110.6	P140	T138-P140 VanDerWaalsContact O-CD 3.24Å; T138-P140 WeakPolarHBondContact O-CD 3.45Å; T138-P140 VanDerWaalsContact O-N 3.11Å
139	V	85.5	Confident	84.6	Confident	61 Å²	61	80.1 Å²	80.1	37%	0.37	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-56.9	117	179	-167.9	0	0	0	0	110.7	L133 L307	L133-V139 HydrophobicContact CD2-CB 4.4Å; L133-V139 HydrophobicContact CD2-CG2 4.17Å; V139-L307 HydrophobicContact CG2-CD1 4.03Å
140	P	86.2	Confident	84.5	Confident	24 Å²	24	83.2 Å²	83.2	16%	0.156	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-57.1	142.9	-177.6	-27.6	35.3	0	0	0	112.6	T138 Q145 R146	T138-P140 VanDerWaalsContact O-CD 3.24Å; T138-P140 WeakPolarHBondContact O-CD 3.45Å; T138-P140 VanDerWaalsContact O-N 3.11Å; P140-Q145 HydrophobicContact CB-CB 3.93Å; P140-Q145 HydrophobicContact CG-CB 4.19Å; P140-R146 HydrophobicContact CB-CG 4.47Å; P140-R146 VanDerWaalsContact O-CZ 3.26Å; P140-R146 PolarHBondContact O-NE 3.03Å; P140-R146 PolarHBondContact O-NH2 3.02Å
141	K	81.2	Confident	84.2	Confident	203 Å²	203	84.1 Å²	84.1	88%	0.883	41%	0.411	S	S	*	.	S	Bend	trans	-73.4	-33.6	174.1	-68.7	-176.4	-179.8	178	0	111.8
142	E	84.9	Confident	84	Confident	117 Å²	117	85.9 Å²	85.9	55%	0.547	42%	0.424	S	S	.	.	S	Bend	trans	-74.7	134.4	179.5	-67.2	179.2	-177.6	0	0	111.1	Q145	E142-Q145 HydrophobicContact CB-CG 4.19Å; E142-Q145 PolarHBondContact OE2-NE2 3.23Å
143	I	83.3	Confident	83.9	Confident	74 Å²	74	86.4 Å²	86.4	38%	0.379	43%	0.426	S	S	.	.	H	α-helix	trans	-67.8	-43.3	-177.9	-47.9	-164.5	0	0	0	110.2	Q145 R146 E147	I143-Q145 VanDerWaalsContact C-N 3.27Å; I143-Q145 PolarHBondContact O-N 2.81Å; I143-R146 WeakPolarHBondContact O-CA 3.36Å; I143-R146 WeakPolarHBondContact O-CB 3.46Å; I143-R146 PolarHBondContact O-N 3.31Å; I143-E147 HydrophobicContact CG2-CG 4.1Å; I143-E147 VanDerWaalsContact O-CG 3.29Å; I143-E147 WeakPolarHBondContact O-CG 3.31Å; I143-E147 PolarHBondContact O-N 3.06Å
144	N	83.8	Confident	83.9	Confident	109 Å²	109	85.6 Å²	85.6	58%	0.583	42%	0.422	S	S	*	.	H	α-helix	trans	-55.3	-42	-175.3	-60.1	-7.1	0	0	0	112.1	R146 E147 E148	N144-R146 VanDerWaalsContact C-N 3.3Å; N144-R146 PolarHBondContact O-N 3.44Å; N144-E147 WeakPolarHBondContact O-CB 3.43Å; N144-E147 PolarHBondContact O-N 3.08Å; N144-E148 PolarHBondContact O-N 2.73Å; N144-E148 VanDerWaalsContact O-N 3.14Å
145	Q	82.6	Confident	84	Confident	82 Å²	82	85.5 Å²	85.5	38%	0.383	42%	0.418	S	S	.	.	H	α-helix	trans	-66.2	-32.1	178.3	-61.2	-176.5	8.3	0	0	112.6	P140 E142 I143 H149	P140-Q145 HydrophobicContact CB-CB 3.93Å; P140-Q145 HydrophobicContact CG-CB 4.19Å; E142-Q145 HydrophobicContact CB-CG 4.19Å; E142-Q145 PolarHBondContact OE2-NE2 3.23Å; I143-Q145 VanDerWaalsContact C-N 3.27Å; I143-Q145 PolarHBondContact O-N 2.81Å; Q145-H149 PolarHBondContact O-ND1 2.9Å
146	R	82.6	Confident	84.3	Confident	29 Å²	29	86.2 Å²	86.2	11%	0.109	42%	0.417	C	S	.	.	H	α-helix	trans	-72.1	-33.7	172.1	-58	-176.6	-171.6	-160.3	-4	111.5	Y131 P140 I143 N144 E148 H149 D309 S322	Y131-R146 HydrophobicContact CD2-CB 4.46Å; Y131-R146 HydrophobicContact CE2-CB 4.36Å; Y131-R146 HydrophobicContact CE2-CG 4.27Å; Y131-R146 PolarHBondContact OH-NH1 3.32Å; P140-R146 HydrophobicContact CB-CG 4.47Å; P140-R146 VanDerWaalsContact O-CZ 3.26Å; P140-R146 PolarHBondContact O-NE 3.03Å; P140-R146 PolarHBondContact O-NH2 3.02Å; I143-R146 WeakPolarHBondContact O-CA 3.36Å; I143-R146 WeakPolarHBondContact O-CB 3.46Å; I143-R146 PolarHBondContact O-N 3.31Å; N144-R146 VanDerWaalsContact C-N 3.3Å; N144-R146 PolarHBondContact O-N 3.44Å; R146-E148 VanDerWaalsContact C-N 3.33Å; R146-H149 PolarHBondContact O-N 3.02Å; R146-D309 VanDerWaalsContact CD-OD2 3.28Å; R146-D309 WeakPolarHBondContact CD-OD2 3.27Å; R146-D309 IonicContact CZ-OD2 2.87Å; R146-D309 IonicContact NE-OD2 2.69Å; R146-D309 VanDerWaalsContact NH1-CG 3.28Å; R146-D309 IonicContact NH1-OD1 3.19Å; R146-D309 PolarHBondContact NH1-OD1 3.23Å; R146-D309 VanDerWaalsContact NH1-OD1 3.12Å; R146-D309 IonicContact NH1-OD2 3.38Å; R146-D309 PolarHBondContact NH1-OD2 2.98Å; R146-S322 PolarHBondContact NH1-OG 2.77Å; R146-S322 VanDerWaalsContact NH1-OG 3.16Å
147	E	79.6	Confident	84.6	Confident	83 Å²	83	78.3 Å²	78.3	39%	0.388	38%	0.375	S	S	.	.	H	α-helix	trans	-67.3	-33.6	179	-51.6	-155.1	140.6	0	0	112.5	I143 N144 H149 R150	I143-E147 HydrophobicContact CG2-CG 4.1Å; I143-E147 VanDerWaalsContact O-CG 3.29Å; I143-E147 WeakPolarHBondContact O-CG 3.31Å; I143-E147 PolarHBondContact O-N 3.06Å; N144-E147 WeakPolarHBondContact O-CB 3.43Å; N144-E147 PolarHBondContact O-N 3.08Å; E147-H149 PolarHBondContact O-N 3.34Å; E147-R150 VanDerWaalsContact CD-CZ 3.48Å; E147-R150 VanDerWaalsContact CD-NH2 3.32Å; E147-R150 VanDerWaalsContact O-CB 3.31Å; E147-R150 WeakPolarHBondContact O-CB 3.1Å; E147-R150 VanDerWaalsContact O-CG 3.32Å; E147-R150 WeakPolarHBondContact O-CG 3.44Å; E147-R150 PolarHBondContact O-N 3.18Å; E147-R150 IonicContact OE1-CZ 3.82Å; E147-R150 IonicContact OE1-NH1 2.79Å; E147-R150 PolarHBondContact OE1-NH1 2.76Å; E147-R150 IonicContact OE1-NH2 3.33Å; E147-R150 PolarHBondContact OE1-NH2 3.33Å; E147-R150 IonicContact OE2-NH1 2.69Å
148	E	79.3	Confident	84.8	Confident	157 Å²	157	73.4 Å²	73.4	73%	0.734	35%	0.352	S	S	*	.	H	α-helix	trans	-62.2	-27	176.5	-72.2	176.1	-171.2	0	0	113.1	N144 R146	N144-E148 PolarHBondContact O-N 2.73Å; N144-E148 VanDerWaalsContact O-N 3.14Å; R146-E148 VanDerWaalsContact C-N 3.33Å
149	H	79.2	Confident	85.1	Confident	81 Å²	81	72.7 Å²	72.7	38%	0.375	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	10.8	-179.6	-67.2	85.4	0	0	0	113.5	Y131 F132 Q145 R146 E147	Y131-H149 VanDerWaalsContact CA-O 3.24Å; Y131-H149 WeakPolarHBondContact CA-O 3.17Å; Y131-H149 VanDerWaalsContact CB-O 3.29Å; Y131-H149 WeakPolarHBondContact CB-O 3.45Å; F132-H149 PolarHBondContact N-O 2.92Å; F132-H149 WeakPolarHBondContact O-CB 3.33Å; Q145-H149 PolarHBondContact O-ND1 2.9Å; R146-H149 PolarHBondContact O-N 3.02Å; E147-H149 PolarHBondContact O-N 3.34Å
150	R	84.7	Confident	85.4	Confident	112 Å²	112	71.2 Å²	71.2	42%	0.423	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.9	-178.9	-79.1	176.2	175.3	160.2	5.4	112.5	T130 E147	T130-R150 CarbonylContact O-C 3.48Å; T130-R150 WeakPolarHBondContact O-CA 3.41Å; E147-R150 VanDerWaalsContact CD-CZ 3.48Å; E147-R150 VanDerWaalsContact CD-NH2 3.32Å; E147-R150 VanDerWaalsContact O-CB 3.31Å; E147-R150 WeakPolarHBondContact O-CB 3.1Å; E147-R150 VanDerWaalsContact O-CG 3.32Å; E147-R150 WeakPolarHBondContact O-CG 3.44Å; E147-R150 PolarHBondContact O-N 3.18Å; E147-R150 IonicContact OE1-CZ 3.82Å; E147-R150 IonicContact OE1-NH1 2.79Å; E147-R150 PolarHBondContact OE1-NH1 2.76Å; E147-R150 IonicContact OE1-NH2 3.33Å; E147-R150 PolarHBondContact OE1-NH2 3.33Å; E147-R150 IonicContact OE2-NH1 2.69Å
151	I	84.9	Confident	85.7	Confident	20 Å²	20	70 Å²	70	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	113.7	-179.2	-55.5	-179.4	0	0	0	107.3	T130 F132 Y153 Y154 P303 T306	T130-I151 PolarHBondContact O-N 3.1Å; F132-I151 HydrophobicContact CB-CD1 3.57Å; I151-Y153 HydrophobicContact CG2-CD1 3.6Å; I151-Y153 HydrophobicContact CG2-CE1 3.26Å; I151-Y154 HydrophobicContact CB-CE1 4.26Å; I151-Y154 HydrophobicContact CG2-CD1 3.84Å; I151-Y154 HydrophobicContact CG2-CE1 3.85Å; I151-Y154 WeakPolarHBondContact O-CE1 3.28Å; I151-Y154 PolarHBondContact O-OH 3.05Å; I151-P303 HydrophobicContact CD1-CG 3.23Å; I151-T306 HydrophobicContact CD1-CG2 4.47Å
152	S	85.2	Confident	86.1	Confident	47 Å²	47	64.3 Å²	64.3	33%	0.329	30%	0.298	S	S	.	.			trans	-124.1	-9.3	-179.2	61	0	0	0	0	113.8	D129 Y154 Q155	D129-S152 WeakPolarHBondContact OD1-CB 3.4Å; D129-S152 WeakPolarHBondContact OD2-CB 3.49Å; S152-Y154 PolarHBondContact O-N 2.98Å; S152-Y154 VanDerWaalsContact O-N 3.12Å; S152-Q155 PolarHBondContact O-N 3.47Å
153	Y	86.8	Confident	86.5	Confident	30 Å²	30	63 Å²	63	12%	0.118	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-31.9	-172.2	66.5	-101.9	0	0	0	113.6	I151 Q155 W156 V157 F273 F302 N330	I151-Y153 HydrophobicContact CG2-CD1 3.6Å; I151-Y153 HydrophobicContact CG2-CE1 3.26Å; Y153-Q155 VanDerWaalsContact C-N 3.27Å; Y153-Q155 PolarHBondContact O-N 3.46Å; Y153-W156 PolarHBondContact O-N 2.83Å; Y153-V157 HydrophobicContact CD2-CG2 4.38Å; Y153-V157 WeakPolarHBondContact O-CG2 3.19Å; Y153-V157 PolarHBondContact O-N 3.04Å; Y153-F273 HydrophobicContact CD2-CE1 4.46Å; Y153-F273 WeakPolarHBondContact O-CZ 3.23Å; Y153-F302 HydrophobicContact CE2-CD1 4.05Å; Y153-F302 HydrophobicContact CE2-CE1 4.02Å; Y153-F302 AromaticContact CZ-CD1 3.91Å; Y153-F302 WeakPolarHBondContact OH-CD1 3.17Å; Y153-N330 PolarHBondContact OH-ND2 3.3Å; Y153-N330 VanDerWaalsContact OH-ND2 3.08Å; Y153-N330 PolarHBondContact OH-OD1 2.93Å
154	Y	87.5	Confident	87	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-29.8	-173	52.9	-101.3	0	0	0	113.3	W126 T130 I151 S152 W156 L327	W126-Y154 HydrophobicContact CE3-CD2 4.23Å; W126-Y154 AromaticContact CE3-CE2 3.82Å; W126-Y154 HydrophobicContact CE3-CE2 3.82Å; W126-Y154 AromaticContact CH2-CD2 3.63Å; W126-Y154 HydrophobicContact CH2-CD2 3.63Å; W126-Y154 HydrophobicContact CH2-CE2 4.03Å; W126-Y154 AromaticContact CZ3-CD2 3.34Å; W126-Y154 HydrophobicContact CZ3-CD2 3.34Å; W126-Y154 AromaticContact CZ3-CE2 3.4Å; W126-Y154 HydrophobicContact CZ3-CE2 3.4Å; T130-Y154 PolarHBondContact N-OH 3.4Å; T130-Y154 PolarHBondContact OG1-OH 2.71Å; T130-Y154 VanDerWaalsContact OG1-OH 3.05Å; I151-Y154 HydrophobicContact CB-CE1 4.26Å; I151-Y154 HydrophobicContact CG2-CD1 3.84Å; I151-Y154 HydrophobicContact CG2-CE1 3.85Å; I151-Y154 WeakPolarHBondContact O-CE1 3.28Å; I151-Y154 PolarHBondContact O-OH 3.05Å; S152-Y154 PolarHBondContact O-N 2.98Å; S152-Y154 VanDerWaalsContact O-N 3.12Å; Y154-W156 VanDerWaalsContact C-N 3.26Å; Y154-W156 PolarHBondContact O-N 2.98Å; Y154-L327 HydrophobicContact CD1-CD1 4.49Å; Y154-L327 HydrophobicContact CD1-CD2 3.47Å; Y154-L327 VanDerWaalsContact CD1-CD2 3.47Å; Y154-L327 HydrophobicContact CD2-CD1 4.15Å; Y154-L327 HydrophobicContact CD2-CD2 4.49Å; Y154-L327 HydrophobicContact CE1-CD1 4.41Å; Y154-L327 HydrophobicContact CE1-CD2 3.69Å; Y154-L327 HydrophobicContact CE2-CD1 4.09Å; Y154-L327 HydrophobicContact CG-CD1 4.36Å; Y154-L327 HydrophobicContact CG-CD2 3.91Å
155	Q	87.8	Confident	87.4	Confident	33 Å²	33	54.5 Å²	54.5	15%	0.154	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-30.5	175.2	-65.9	163	0.7	0	0	111.8	W126 D129 S152 Y153	W126-Q155 HydrophobicContact CH2-CG 4.21Å; W126-Q155 HydrophobicContact CZ2-CG 4.06Å; W126-Q155 PolarHBondContact O-NE2 3.05Å; D129-Q155 PolarHBondContact OD1-NE2 3.37Å; D129-Q155 PolarHBondContact OD1-OE1 3.08Å; S152-Q155 PolarHBondContact O-N 3.47Å; Y153-Q155 VanDerWaalsContact C-N 3.27Å; Y153-Q155 PolarHBondContact O-N 3.46Å
156	W	90.2	Very high	87.8	Confident	149 Å²	149	55.3 Å²	55.3	56%	0.564	26%	0.26	S	S	*	.	H	α-helix	trans	-95.3	-7.9	-171.3	-64.6	94.2	0	0	0	114	Y153 Y154 F159 F160 F273	Y153-W156 PolarHBondContact O-N 2.83Å; Y154-W156 VanDerWaalsContact C-N 3.26Å; Y154-W156 PolarHBondContact O-N 2.98Å; W156-F159 HydrophobicContact CE3-CD2 4.17Å; W156-F159 PolarHBondContact O-N 2.88Å; W156-F160 WeakPolarHBondContact O-CB 3.4Å; W156-F160 PolarHBondContact O-N 3.25Å; W156-F273 HydrophobicContact CB-CE2 4.17Å; W156-F273 HydrophobicContact CB-CZ 4.19Å
157	V	91.2	Very high	88.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-53.7	-48.2	-175	174.4	0	0	0	0	113.3	V95 Y153 F159 F160 L161 F273 F337	V95-V157 HydrophobicContact CG1-CG1 4.27Å; Y153-V157 HydrophobicContact CD2-CG2 4.38Å; Y153-V157 WeakPolarHBondContact O-CG2 3.19Å; Y153-V157 PolarHBondContact O-N 3.04Å; V157-F159 VanDerWaalsContact C-N 3.33Å; V157-F159 PolarHBondContact O-N 3.48Å; V157-F160 WeakPolarHBondContact O-CB 3.41Å; V157-F160 PolarHBondContact O-N 3.38Å; V157-L161 HydrophobicContact CG1-CD1 4.05Å; V157-L161 HydrophobicContact CG1-CG 4.34Å; V157-L161 WeakPolarHBondContact O-CG 3.38Å; V157-L161 PolarHBondContact O-N 2.86Å; V157-F273 HydrophobicContact CG2-CE1 3.99Å; V157-F273 HydrophobicContact CG2-CZ 4.19Å; V157-F337 HydrophobicContact CG1-CE2 4.11Å; V157-F337 HydrophobicContact CG1-CZ 4.06Å; V157-F337 HydrophobicContact CG2-CE2 4Å; V157-F337 HydrophobicContact CG2-CZ 4.22Å
158	P	89.6	Confident	88.9	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-61.6	-41.1	-179.8	-22.1	32.8	0	0	0	113.1	V95 S96 Q99 L161 L162	V95-P158 HydrophobicContact CB-CG 4.39Å; V95-P158 HydrophobicContact CG1-CG 3.85Å; S96-P158 WeakPolarHBondContact OG-CB 3.48Å; Q99-P158 VanDerWaalsContact OE1-CG 3.29Å; P158-L161 PolarHBondContact O-N 3.32Å; P158-L162 WeakPolarHBondContact O-CG 3.36Å; P158-L162 PolarHBondContact O-N 2.95Å; P158-L162 VanDerWaalsContact O-N 3.12Å
159	F	90.9	Very high	89.3	Confident	112 Å²	112	45.6 Å²	45.6	49%	0.491	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-40.3	178.6	-58.2	-65.8	0	0	0	111.4	W156 V157 L162 V163	W156-F159 HydrophobicContact CE3-CD2 4.17Å; W156-F159 PolarHBondContact O-N 2.88Å; V157-F159 VanDerWaalsContact C-N 3.33Å; V157-F159 PolarHBondContact O-N 3.48Å; F159-L162 PolarHBondContact O-N 3.27Å; F159-V163 WeakPolarHBondContact O-CG2 3.38Å; F159-V163 PolarHBondContact O-N 3.37Å
160	F	92.6	Very high	89.9	Confident	29 Å²	29	45.6 Å²	45.6	13%	0.127	22%	0.22	C	C	.	.	H	α-helix	trans	-57.2	-51.8	174.5	179.1	-101.2	0	0	0	110.8	W156 V157 L162 V163 E164 L269 F273 F337	W156-F160 WeakPolarHBondContact O-CB 3.4Å; W156-F160 PolarHBondContact O-N 3.25Å; V157-F160 WeakPolarHBondContact O-CB 3.41Å; V157-F160 PolarHBondContact O-N 3.38Å; F160-L162 VanDerWaalsContact C-N 3.3Å; F160-L162 PolarHBondContact O-N 3.43Å; F160-V163 PolarHBondContact O-N 3.39Å; F160-V163 VanDerWaalsContact O-N 3.1Å; F160-E164 HydrophobicContact CD1-CG 4.17Å; F160-E164 HydrophobicContact CE1-CG 3.83Å; F160-E164 WeakPolarHBondContact CE1-OE1 3.26Å; F160-E164 HydrophobicContact CE2-CG 4.38Å; F160-E164 HydrophobicContact CZ-CG 3.94Å; F160-E164 WeakPolarHBondContact CZ-OE1 3.24Å; F160-E164 WeakPolarHBondContact O-CG 3.41Å; F160-E164 PolarHBondContact O-N 3.02Å; F160-L269 HydrophobicContact CE2-CB 4.41Å; F160-L269 HydrophobicContact CZ-CB 4.38Å; F160-F273 HydrophobicContact CB-CE2 4Å; F160-F273 HydrophobicContact CB-CZ 4.01Å; F160-F273 HydrophobicContact CD1-CD1 4.21Å; F160-F273 HydrophobicContact CD1-CE1 4.31Å; F160-F273 HydrophobicContact CD1-CG 4.38Å; F160-F273 HydrophobicContact CD2-CB 4.43Å; F160-F273 AromaticContact CD2-CD2 3.61Å; F160-F273 HydrophobicContact CD2-CD2 3.61Å; F160-F273 AromaticContact CD2-CE2 3.94Å; F160-F273 HydrophobicContact CD2-CE2 3.94Å; F160-F273 AromaticContact CD2-CG 3.93Å; F160-F273 HydrophobicContact CD2-CG 3.93Å; F160-F273 HydrophobicContact CE1-CD1 4.27Å; F160-F273 HydrophobicContact CE1-CG 4.32Å; F160-F273 HydrophobicContact CE2-CB 3.88Å; F160-F273 AromaticContact CE2-CD2 3.92Å; F160-F273 HydrophobicContact CE2-CD2 3.92Å; F160-F273 AromaticContact CE2-CG 3.88Å; F160-F273 HydrophobicContact CE2-CG 3.88Å; F160-F273 HydrophobicContact CG-CD1 4.33Å; F160-F273 HydrophobicContact CG-CD2 4.01Å; F160-F273 HydrophobicContact CG-CE1 4.3Å; F160-F273 AromaticContact CG-CE2 3.98Å; F160-F273 HydrophobicContact CG-CE2 3.98Å; F160-F273 HydrophobicContact CG-CG 4.19Å; F160-F273 HydrophobicContact CG-CZ 4.12Å; F160-F273 HydrophobicContact CZ-CB 3.94Å; F160-F273 HydrophobicContact CZ-CD1 4.46Å; F160-F273 HydrophobicContact CZ-CG 4.07Å; F160-F337 HydrophobicContact CD1-CE1 4.28Å; F160-F337 HydrophobicContact CD1-CZ 4.39Å; F160-F337 HydrophobicContact CE1-CE1 4.06Å
161	L	91.3	Very high	90.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.3	-37.2	178.1	-67.1	174.8	0	0	0	113.1	L88 L91 A92 V95 V157 P158 E164 A165 L340	L88-L161 HydrophobicContact CD2-CD2 3.82Å; L91-L161 HydrophobicContact CB-CD1 4.14Å; A92-L161 HydrophobicContact CB-CB 3.9Å; A92-L161 HydrophobicContact CB-CD1 4.41Å; V95-L161 HydrophobicContact CG2-CD1 4.46Å; V157-L161 HydrophobicContact CG1-CD1 4.05Å; V157-L161 HydrophobicContact CG1-CG 4.34Å; V157-L161 WeakPolarHBondContact O-CG 3.38Å; V157-L161 PolarHBondContact O-N 2.86Å; P158-L161 PolarHBondContact O-N 3.32Å; L161-E164 PolarHBondContact O-N 3.24Å; L161-A165 WeakPolarHBondContact O-CB 3.27Å; L161-A165 PolarHBondContact O-N 3.44Å; L161-L340 HydrophobicContact CD2-CD1 3.63Å
162	L	90.5	Very high	90.3	Very high	82 Å²	82	39.6 Å²	39.6	43%	0.429	20%	0.197	S	C	.	.	H	α-helix	trans	-67.2	-40.1	175.3	-71.9	172.7	0	0	0	112.5	A92 P158 F159 F160 A165 L166	A92-L162 HydrophobicContact CB-CD2 3.97Å; A92-L162 HydrophobicContact CB-CG 3.95Å; P158-L162 WeakPolarHBondContact O-CG 3.36Å; P158-L162 PolarHBondContact O-N 2.95Å; P158-L162 VanDerWaalsContact O-N 3.12Å; F159-L162 PolarHBondContact O-N 3.27Å; F160-L162 VanDerWaalsContact C-N 3.3Å; F160-L162 PolarHBondContact O-N 3.43Å; L162-A165 PolarHBondContact O-N 3.36Å; L162-L166 PolarHBondContact O-N 3.09Å
163	V	93	Very high	90.3	Very high	89 Å²	89	40.1 Å²	40.1	54%	0.539	19%	0.193	S	C	.	.	H	α-helix	trans	-65.6	-44.1	175.2	172	0	0	0	0	110.4	F159 F160 A165 L166 C167	F159-V163 WeakPolarHBondContact O-CG2 3.38Å; F159-V163 PolarHBondContact O-N 3.37Å; F160-V163 PolarHBondContact O-N 3.39Å; F160-V163 VanDerWaalsContact O-N 3.1Å; V163-A165 VanDerWaalsContact C-N 3.31Å; V163-A165 PolarHBondContact O-N 3.09Å; V163-L166 WeakPolarHBondContact O-CB 3.35Å; V163-L166 PolarHBondContact O-N 3.24Å; V163-C167 PolarHBondContact O-N 3.08Å; V163-C167 PolarHBondContact O-SG 3.02Å; V163-C167 VanDerWaalsContact O-SG 3.35Å
164	E	93.8	Very high	90.4	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-57.9	-45.4	173.8	-62.9	-160.5	143	0	0	110.9	L88 F160 L161 L166 C167 F168 Q266 Y344	L88-E164 HydrophobicContact CD1-CB 3.93Å; F160-E164 HydrophobicContact CD1-CG 4.17Å; F160-E164 HydrophobicContact CE1-CG 3.83Å; F160-E164 WeakPolarHBondContact CE1-OE1 3.26Å; F160-E164 HydrophobicContact CE2-CG 4.38Å; F160-E164 HydrophobicContact CZ-CG 3.94Å; F160-E164 WeakPolarHBondContact CZ-OE1 3.24Å; F160-E164 WeakPolarHBondContact O-CG 3.41Å; F160-E164 PolarHBondContact O-N 3.02Å; L161-E164 PolarHBondContact O-N 3.24Å; E164-L166 VanDerWaalsContact C-N 3.3Å; E164-L166 PolarHBondContact O-N 3.2Å; E164-C167 WeakPolarHBondContact O-CB 3.43Å; E164-C167 PolarHBondContact O-N 3.38Å; E164-C167 VanDerWaalsContact O-N 3.15Å; E164-F168 VanDerWaalsContact O-CD2 3.3Å; E164-F168 WeakPolarHBondContact O-CD2 3.22Å; E164-F168 PolarHBondContact O-N 3.04Å; E164-Q266 VanDerWaalsContact CG-OE1 3.25Å; E164-Q266 PolarHBondContact OE1-OE1 3.41Å; E164-Y344 PolarHBondContact OE2-OH 2.91Å
165	A	91.1	Very high	90.5	Very high	3 Å²	3	42.1 Å²	42.1	3%	0.025	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-39.1	178.7	0	0	0	0	0	112.7	S85 L88 I89 L161 L162 V163 R169	S85-A165 PolarHBondContact OG-O 3.36Å; L88-A165 HydrophobicContact CB-CB 3.76Å; L88-A165 HydrophobicContact CD1-CB 4.29Å; I89-A165 HydrophobicContact CD1-CB 4.44Å; I89-A165 HydrophobicContact CG1-CB 3.84Å; L161-A165 WeakPolarHBondContact O-CB 3.27Å; L161-A165 PolarHBondContact O-N 3.44Å; L162-A165 PolarHBondContact O-N 3.36Å; V163-A165 VanDerWaalsContact C-N 3.31Å; V163-A165 PolarHBondContact O-N 3.09Å; A165-R169 PolarHBondContact O-N 2.99Å
166	L	91	Very high	90.2	Very high	100 Å²	100	42.4 Å²	42.4	52%	0.524	21%	0.205	S	C	.	.	H	α-helix	trans	-65.1	-47.6	174.6	-179.9	63.3	0	0	0	110.7	L162 V163 E164 F168 R169 L170	L162-L166 PolarHBondContact O-N 3.09Å; V163-L166 WeakPolarHBondContact O-CB 3.35Å; V163-L166 PolarHBondContact O-N 3.24Å; E164-L166 VanDerWaalsContact C-N 3.3Å; E164-L166 PolarHBondContact O-N 3.2Å; L166-F168 VanDerWaalsContact C-N 3.32Å; L166-F168 PolarHBondContact O-N 3.49Å; L166-R169 WeakPolarHBondContact O-CA 3.21Å; L166-R169 WeakPolarHBondContact O-CB 3.46Å; L166-R169 PolarHBondContact O-N 3.5Å; L166-L170 WeakPolarHBondContact O-CG 3.48Å; L166-L170 PolarHBondContact O-N 3.48Å
167	C	93.8	Very high	90	Very high	29 Å²	29	42.7 Å²	42.7	20%	0.196	21%	0.207	C	C	.	.	H	α-helix	trans	-58.9	-39.9	179.1	-70.8	0	0	0	0	112.9	V163 E164 R169 L170 P171 N262	V163-C167 PolarHBondContact O-N 3.08Å; V163-C167 PolarHBondContact O-SG 3.02Å; V163-C167 VanDerWaalsContact O-SG 3.35Å; E164-C167 WeakPolarHBondContact O-CB 3.43Å; E164-C167 PolarHBondContact O-N 3.38Å; E164-C167 VanDerWaalsContact O-N 3.15Å; C167-R169 PolarHBondContact O-N 2.87Å; C167-L170 PolarHBondContact O-N 3Å; C167-P171 VanDerWaalsContact O-CD 3.28Å; C167-P171 WeakPolarHBondContact O-CD 3.17Å; C167-N262 WeakPolarHBondContact CB-OD1 3.44Å
168	F	92.2	Very high	89.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-25.9	173.2	-85.8	-72.4	0	0	0	113.9	N80 H81 T84 L88 E164 L166 N262 V263 Q266 Y344 L347	N80-F168 HydrophobicContact CB-CD1 4.47Å; H81-F168 WeakPolarHBondContact CA-O 3.47Å; T84-F168 HydrophobicContact CG2-CD1 4.21Å; T84-F168 HydrophobicContact CG2-CD2 3.88Å; T84-F168 HydrophobicContact CG2-CE1 4.09Å; T84-F168 HydrophobicContact CG2-CE2 3.73Å; T84-F168 HydrophobicContact CG2-CG 4.12Å; T84-F168 HydrophobicContact CG2-CZ 3.86Å; L88-F168 HydrophobicContact CD1-CD2 3.55Å; L88-F168 HydrophobicContact CD1-CE2 3.85Å; E164-F168 VanDerWaalsContact O-CD2 3.3Å; E164-F168 WeakPolarHBondContact O-CD2 3.22Å; E164-F168 PolarHBondContact O-N 3.04Å; L166-F168 VanDerWaalsContact C-N 3.32Å; L166-F168 PolarHBondContact O-N 3.49Å; F168-N262 WeakPolarHBondContact CA-ND2 3.4Å; F168-N262 WeakPolarHBondContact CD1-ND2 3.34Å; F168-N262 WeakPolarHBondContact CE1-ND2 3.39Å; F168-N262 WeakPolarHBondContact CG-ND2 3.39Å; F168-V263 HydrophobicContact CE1-CG2 3.97Å; F168-Q266 HydrophobicContact CD2-CG 4.3Å; F168-Q266 HydrophobicContact CE2-CB 4.24Å; F168-Q266 HydrophobicContact CE2-CG 3.57Å; F168-Q266 HydrophobicContact CZ-CB 4.21Å; F168-Q266 HydrophobicContact CZ-CG 3.75Å; F168-Y344 HydrophobicContact CE2-CD1 4.43Å; F168-Y344 AromaticContact CE2-CE1 3.58Å; F168-Y344 HydrophobicContact CE2-CE1 3.58Å; F168-Y344 AromaticContact CE2-CZ 3.81Å; F168-Y344 HydrophobicContact CZ-CD1 4.01Å; F168-Y344 AromaticContact CZ-CE1 3.6Å; F168-Y344 HydrophobicContact CZ-CE1 3.6Å; F168-L347 HydrophobicContact CE1-CD2 4.19Å
169	R	88.6	Confident	89.4	Confident	35 Å²	35	45 Å²	45	13%	0.132	22%	0.221	C	C	.	.	H	α-helix	trans	-87.9	-26.6	-178.6	-154.5	163	155.1	63.9	6.1	112.8	Y66 V67 A165 L166 C167 S172 F173	Y66-R169 PolarHBondContact O-NH1 3.48Å; Y66-R169 PolarHBondContact O-NH2 2.97Å; V67-R169 VanDerWaalsContact CA-NH2 3.26Å; A165-R169 PolarHBondContact O-N 2.99Å; L166-R169 WeakPolarHBondContact O-CA 3.21Å; L166-R169 WeakPolarHBondContact O-CB 3.46Å; L166-R169 PolarHBondContact O-N 3.5Å; C167-R169 PolarHBondContact O-N 2.87Å; R169-S172 PolarHBondContact O-N 2.9Å; R169-S172 PolarHBondContact O-OG 2.89Å; R169-F173 HydrophobicContact CB-CE2 4.24Å; R169-F173 HydrophobicContact CG-CD2 4.15Å; R169-F173 HydrophobicContact CG-CE2 3.61Å; R169-F173 HydrophobicContact CG-CZ 4.42Å; R169-F173 WeakPolarHBondContact O-CD2 3.3Å; R169-F173 PolarHBondContact O-N 3.39Å
170	L	90.6	Very high	88.9	Confident	81 Å²	81	43.7 Å²	43.7	42%	0.424	23%	0.226	S	C	.	.	H	α-helix	trans	-52.8	-45.9	-177.9	-72	176.6	0	0	0	114.5	L166 C167 S172 F173 I174	L166-L170 WeakPolarHBondContact O-CG 3.48Å; L166-L170 PolarHBondContact O-N 3.48Å; C167-L170 PolarHBondContact O-N 3Å; L170-S172 VanDerWaalsContact C-N 3.27Å; L170-S172 PolarHBondContact O-N 2.77Å; L170-F173 WeakPolarHBondContact O-CB 3.34Å; L170-F173 PolarHBondContact O-N 3.29Å; L170-F173 VanDerWaalsContact O-N 3.13Å; L170-I174 WeakPolarHBondContact O-CG1 3.41Å; L170-I174 PolarHBondContact O-N 3.33Å
171	P	91.1	Very high	88.3	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.039	24%	0.244	C	C	.	.	H	α-helix	trans	-61.3	-34.3	-179.2	-23.4	33.7	0	0	0	113.2	C167 I174 W175 T255 L258 Y259	C167-P171 VanDerWaalsContact O-CD 3.28Å; C167-P171 WeakPolarHBondContact O-CD 3.17Å; P171-I174 PolarHBondContact O-N 3.44Å; P171-W175 PolarHBondContact O-N 3.29Å; P171-T255 HydrophobicContact CB-CG2 4.21Å; P171-L258 HydrophobicContact CB-CB 4.12Å; P171-L258 HydrophobicContact CG-CB 4.21Å; P171-Y259 HydrophobicContact CB-CD1 3.79Å; P171-Y259 HydrophobicContact CB-CD2 4.27Å; P171-Y259 HydrophobicContact CB-CE1 3.59Å; P171-Y259 HydrophobicContact CB-CE2 4.11Å; P171-Y259 HydrophobicContact CB-CG 4.12Å; P171-Y259 HydrophobicContact CG-CD1 3.81Å; P171-Y259 HydrophobicContact CG-CE1 3.88Å; P171-Y259 HydrophobicContact CG-CG 4.4Å
172	S	87	Confident	87.5	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.007	25%	0.245	C	C	.	.	H	α-helix	trans	-65.3	-38.7	176	73.7	0	0	0	0	112.4	R169 L170 W175 K176 Y259	R169-S172 PolarHBondContact O-N 2.9Å; R169-S172 PolarHBondContact O-OG 2.89Å; L170-S172 VanDerWaalsContact C-N 3.27Å; L170-S172 PolarHBondContact O-N 2.77Å; S172-W175 PolarHBondContact O-N 3Å; S172-K176 WeakPolarHBondContact O-CG 3.25Å; S172-K176 PolarHBondContact O-N 3.38Å; S172-Y259 WeakPolarHBondContact CB-OH 3.44Å; S172-Y259 PolarHBondContact N-OH 3.2Å
173	F	86.6	Confident	86.7	Confident	57 Å²	57	46 Å²	46	25%	0.25	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-41.1	174	-73.7	-69.1	0	0	0	111.4	Y66 R169 L170 K176 Y177	Y66-F173 AromaticContact CD1-CD1 3.61Å; Y66-F173 HydrophobicContact CD1-CD1 3.61Å; Y66-F173 AromaticContact CD1-CE1 3.37Å; Y66-F173 HydrophobicContact CD1-CE1 3.37Å; Y66-F173 HydrophobicContact CE1-CD1 4.05Å; Y66-F173 HydrophobicContact CE1-CE1 4.14Å; Y66-F173 HydrophobicContact CG-CD1 4.34Å; Y66-F173 AromaticContact CG-CE1 3.63Å; Y66-F173 HydrophobicContact CG-CE1 3.63Å; R169-F173 HydrophobicContact CB-CE2 4.24Å; R169-F173 HydrophobicContact CG-CD2 4.15Å; R169-F173 HydrophobicContact CG-CE2 3.61Å; R169-F173 HydrophobicContact CG-CZ 4.42Å; R169-F173 WeakPolarHBondContact O-CD2 3.3Å; R169-F173 PolarHBondContact O-N 3.39Å; L170-F173 WeakPolarHBondContact O-CB 3.34Å; L170-F173 PolarHBondContact O-N 3.29Å; L170-F173 VanDerWaalsContact O-N 3.13Å; F173-K176 PolarHBondContact O-N 3.25Å; F173-Y177 WeakPolarHBondContact O-CB 3.39Å; F173-Y177 PolarHBondContact O-N 2.98Å
174	I	88.8	Confident	86	Confident	61 Å²	61	42.2 Å²	42.2	31%	0.313	22%	0.223	S	C	.	.	H	α-helix	trans	-62.6	-44.2	176.6	-67	167.2	0	0	0	110.5	L170 P171 Y177 L178 F254 L258	L170-I174 WeakPolarHBondContact O-CG1 3.41Å; L170-I174 PolarHBondContact O-N 3.33Å; P171-I174 PolarHBondContact O-N 3.44Å; I174-Y177 PolarHBondContact O-N 3.48Å; I174-L178 HydrophobicContact CG2-CD1 3.58Å; I174-L178 HydrophobicContact CG2-CG 4.18Å; I174-L178 WeakPolarHBondContact O-CB 3.4Å; I174-L178 VanDerWaalsContact O-CG 3.31Å; I174-L178 WeakPolarHBondContact O-CG 3.35Å; I174-L178 PolarHBondContact O-N 2.99Å; I174-F254 HydrophobicContact CG2-CE1 4.32Å; I174-L258 HydrophobicContact CB-CD1 4.49Å; I174-L258 HydrophobicContact CD1-CD1 3.74Å; I174-L258 HydrophobicContact CG2-CD1 4.05Å
175	W	88.2	Confident	85.5	Confident	11 Å²	11	48.7 Å²	48.7	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-58.3	-51.8	174.9	171.3	-117	0	0	0	111.8	P171 S172 Y177 L178 A179 V248 V251 Y252 T255 F406	P171-W175 PolarHBondContact O-N 3.29Å; S172-W175 PolarHBondContact O-N 3Å; W175-Y177 VanDerWaalsContact C-N 3.35Å; W175-Y177 PolarHBondContact O-N 2.69Å; W175-L178 PolarHBondContact O-N 3.42Å; W175-A179 HydrophobicContact CD2-CB 4.3Å; W175-A179 HydrophobicContact CE3-CB 4.39Å; W175-A179 HydrophobicContact CH2-CB 4.31Å; W175-A179 HydrophobicContact CZ2-CB 4.26Å; W175-A179 HydrophobicContact CZ3-CB 4.36Å; W175-A179 WeakPolarHBondContact O-CB 3.25Å; W175-A179 PolarHBondContact O-N 2.92Å; W175-V248 HydrophobicContact CH2-CG1 4.15Å; W175-V251 HydrophobicContact CE3-CG1 3.75Å; W175-V251 HydrophobicContact CZ3-CB 4.21Å; W175-V251 HydrophobicContact CZ3-CG1 3.8Å; W175-Y252 HydrophobicContact CD2-CD2 4.33Å; W175-Y252 HydrophobicContact CE3-CD2 4.06Å; W175-Y252 AromaticContact CH2-CD2 3.62Å; W175-Y252 HydrophobicContact CH2-CD2 3.62Å; W175-Y252 HydrophobicContact CH2-CG 4.14Å; W175-Y252 AromaticContact CZ2-CD2 3.85Å; W175-Y252 HydrophobicContact CZ2-CD2 3.85Å; W175-Y252 VanDerWaalsContact CZ3-CA 3.41Å; W175-Y252 AromaticContact CZ3-CD2 3.74Å; W175-Y252 HydrophobicContact CZ3-CD2 3.74Å; W175-Y252 HydrophobicContact CZ3-CG 4.14Å; W175-T255 HydrophobicContact CB-CG2 3.78Å; W175-F406 HydrophobicContact CH2-CE1 4.35Å
176	K	83	Confident	85.1	Confident	40 Å²	40	48.8 Å²	48.8	17%	0.174	25%	0.248	C	C	.	.	H	α-helix	trans	-56.9	-47.5	178.3	-78.6	178.8	162.6	171.6	0	112.2	E65 Y66 I70 S172 F173 S180	E65-K176 PolarHBondContact O-NZ 2.77Å; Y66-K176 HydrophobicContact CD1-CD 3.81Å; Y66-K176 HydrophobicContact CE1-CD 3.97Å; I70-K176 HydrophobicContact CD1-CD 4.15Å; I70-K176 HydrophobicContact CD1-CG 4.48Å; I70-K176 VanDerWaalsContact CG1-CE 3.45Å; S172-K176 WeakPolarHBondContact O-CG 3.25Å; S172-K176 PolarHBondContact O-N 3.38Å; F173-K176 PolarHBondContact O-N 3.25Å; K176-S180 WeakPolarHBondContact O-CB 3.29Å; K176-S180 PolarHBondContact O-N 3.15Å
177	Y	85.2	Confident	84.7	Confident	154 Å²	154	47 Å²	47	60%	0.604	24%	0.237	S	C	*	.	H	α-helix	trans	-64	-51.9	-178.9	-179.3	-100.9	0	0	0	111.7	F173 I174 W175 S180 H181	F173-Y177 WeakPolarHBondContact O-CB 3.39Å; F173-Y177 PolarHBondContact O-N 2.98Å; I174-Y177 PolarHBondContact O-N 3.48Å; W175-Y177 VanDerWaalsContact C-N 3.35Å; W175-Y177 PolarHBondContact O-N 2.69Å; Y177-S180 PolarHBondContact O-N 3.25Å; Y177-H181 AromaticContact CE1-CD2 3.95Å; Y177-H181 AromaticContact CE1-NE2 3.77Å; Y177-H181 AromaticContact CE2-NE2 3.67Å; Y177-H181 AromaticContact CZ-NE2 3.36Å; Y177-H181 PolarHBondContact O-CD2 2.86Å; Y177-H181 PolarHBondContact OH-NE2 3.36Å
178	L	85.9	Confident	84.3	Confident	42 Å²	42	47.7 Å²	47.7	22%	0.22	24%	0.239	C	C	.	.	H	α-helix	trans	-70.8	-37.8	-177.4	-66	178.4	0	0	0	112.7	I174 W175 S180 H181 Y247 V251 F254	I174-L178 HydrophobicContact CG2-CD1 3.58Å; I174-L178 HydrophobicContact CG2-CG 4.18Å; I174-L178 WeakPolarHBondContact O-CB 3.4Å; I174-L178 VanDerWaalsContact O-CG 3.31Å; I174-L178 WeakPolarHBondContact O-CG 3.35Å; I174-L178 PolarHBondContact O-N 2.99Å; W175-L178 PolarHBondContact O-N 3.42Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 2.9Å; L178-H181 PolarHBondContact O-N 2.79Å; L178-Y247 PolarHBondContact O-OH 2.84Å; L178-V251 HydrophobicContact CB-CG1 3.42Å; L178-V251 VanDerWaalsContact CB-CG1 3.42Å; L178-V251 HydrophobicContact CB-CG2 4.25Å; L178-V251 HydrophobicContact CD1-CG1 3.96Å; L178-V251 HydrophobicContact CG-CG1 4.36Å; L178-F254 HydrophobicContact CD1-CD1 4.44Å
179	A	82.8	Confident	84	Confident	11 Å²	11	47.8 Å²	47.8	9%	0.091	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-35.7	177.2	0	0	0	0	0	111.9	W175 H181 S182	W175-A179 HydrophobicContact CD2-CB 4.3Å; W175-A179 HydrophobicContact CE3-CB 4.39Å; W175-A179 HydrophobicContact CH2-CB 4.31Å; W175-A179 HydrophobicContact CZ2-CB 4.26Å; W175-A179 HydrophobicContact CZ3-CB 4.36Å; W175-A179 WeakPolarHBondContact O-CB 3.25Å; W175-A179 PolarHBondContact O-N 2.92Å; A179-H181 PolarHBondContact O-N 2.98Å; A179-S182 WeakPolarHBondContact O-CB 3.36Å; A179-S182 PolarHBondContact O-N 3.28Å; A179-S182 VanDerWaalsContact O-N 3.13Å; A179-S182 PolarHBondContact O-OG 3.39Å
180	S	80.5	Confident	83.9	Confident	85 Å²	85	46.1 Å²	46.1	59%	0.594	23%	0.233	S	C	*	.	H	α-helix	trans	-59.5	-34.5	175.7	-171.5	0	0	0	0	112.6	K176 Y177 L178 S182	K176-S180 WeakPolarHBondContact O-CB 3.29Å; K176-S180 PolarHBondContact O-N 3.15Å; Y177-S180 PolarHBondContact O-N 3.25Å; L178-S180 VanDerWaalsContact C-N 3.3Å; L178-S180 PolarHBondContact O-N 2.9Å; S180-S182 VanDerWaalsContact C-N 3.31Å; S180-S182 PolarHBondContact O-N 2.66Å
181	H	80.1	Confident	83.7	Confident	111 Å²	111	50 Å²	50	51%	0.514	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-12.4	178.5	-74.5	-65.9	0	0	0	114.8	Y177 L178 A179 G183	Y177-H181 AromaticContact CE1-CD2 3.95Å; Y177-H181 AromaticContact CE1-NE2 3.77Å; Y177-H181 AromaticContact CE2-NE2 3.67Å; Y177-H181 AromaticContact CZ-NE2 3.36Å; Y177-H181 PolarHBondContact O-CD2 2.86Å; Y177-H181 PolarHBondContact OH-NE2 3.36Å; L178-H181 PolarHBondContact O-N 2.79Å; A179-H181 PolarHBondContact O-N 2.98Å; H181-G183 PolarHBondContact O-N 3.18Å
182	S	74.5	Confident	83.6	Confident	4 Å²	4	53 Å²	53	3%	0.028	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.5	-175.9	69.7	0	0	0	0	114.4	A179 S180 I184	A179-S182 WeakPolarHBondContact O-CB 3.36Å; A179-S182 PolarHBondContact O-N 3.28Å; A179-S182 VanDerWaalsContact O-N 3.13Å; A179-S182 PolarHBondContact O-OG 3.39Å; S180-S182 VanDerWaalsContact C-N 3.31Å; S180-S182 PolarHBondContact O-N 2.66Å; S182-I184 PolarHBondContact O-N 3.4Å; S182-I184 PolarHBondContact OG-N 3.22Å; S182-I184 VanDerWaalsContact OG-N 3.14Å; S182-I184 PolarHBondContact OG-O 3.44Å
183	G	73.4	Confident	83.5	Confident	45 Å²	45	53.1 Å²	53.1	46%	0.464	26%	0.258	S	S	.	.	S	Bend	trans	78.3	-16.9	-168.7	0	0	0	0	0	113.8	H181	H181-G183 PolarHBondContact O-N 3.18Å
184	I	78.3	Confident	83.5	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.041	26%	0.257	C	S	.	.			trans	-94.9	102.7	169.1	-61.9	167.6	0	0	0	107.4	S182 V186 I189 A218 V248 V407	S182-I184 PolarHBondContact O-N 3.4Å; S182-I184 PolarHBondContact OG-N 3.22Å; S182-I184 VanDerWaalsContact OG-N 3.14Å; S182-I184 PolarHBondContact OG-O 3.44Å; I184-V186 HydrophobicContact CG2-CG2 3.9Å; I184-V186 PolarHBondContact O-N 3.47Å; I184-I189 HydrophobicContact CG2-CD1 3.73Å; I184-A218 HydrophobicContact CD1-CB 4.4Å; I184-A218 HydrophobicContact CG1-CB 3.66Å; I184-V248 HydrophobicContact CB-CG2 4.42Å; I184-V248 HydrophobicContact CD1-CG2 4.17Å; I184-V407 HydrophobicContact CG2-CG2 4.1Å
185	R	82	Confident	83.4	Confident	139 Å²	139	51.3 Å²	51.3	53%	0.525	25%	0.252	S	S	.	.			trans	-73.1	77.9	173.4	-64.5	-171	-64.7	151	-8.2	110.6	H187 D188 I189	R185-H187 PolarHBondContact O-N 3.04Å; R185-D188 HydrophobicContact CB-CB 4.14Å; R185-D188 WeakPolarHBondContact CB-OD2 3.5Å; R185-D188 WeakPolarHBondContact CD-OD2 3.46Å; R185-D188 IonicContact CZ-OD2 3.9Å; R185-D188 IonicContact NE-OD2 3.35Å; R185-D188 PolarHBondContact NE-OD2 2.96Å; R185-D188 IonicContact NH1-OD2 3.93Å; R185-D188 PolarHBondContact NH1-OD2 3.08Å; R185-D188 PolarHBondContact O-N 3.38Å; R185-I189 WeakPolarHBondContact O-CG1 2.99Å; R185-I189 PolarHBondContact O-N 3.47Å; R185-I189 VanDerWaalsContact O-N 3.12Å
186	V	84.3	Confident	83.2	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.03	29%	0.286	C	S	.	.	H	α-helix	trans	-54.5	-39.7	-177.9	-178.4	0	0	0	0	111.1	I184 I189 V190 V248 V407 L410	I184-V186 HydrophobicContact CG2-CG2 3.9Å; I184-V186 PolarHBondContact O-N 3.47Å; V186-I189 WeakPolarHBondContact O-CB 3.14Å; V186-I189 PolarHBondContact O-N 3.26Å; V186-V190 HydrophobicContact CG1-CG2 4.34Å; V186-V190 WeakPolarHBondContact O-CG2 3.39Å; V186-V190 PolarHBondContact O-N 3.31Å; V186-V248 HydrophobicContact CG2-CG1 3.95Å; V186-V407 HydrophobicContact CG2-CG2 4.35Å; V186-L410 HydrophobicContact CG1-CD2 3.35Å
187	H	82.7	Confident	83.4	Confident	61 Å²	61	63.9 Å²	63.9	28%	0.282	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-47.6	179.8	-170.5	59.8	0	0	0	113.3	D72 R185 I189 V190 R191	D72-H187 IonicContact OD1-ND1 3.12Å; D72-H187 VanDerWaalsContact OD2-CA 3.22Å; D72-H187 WeakPolarHBondContact OD2-CA 3.47Å; D72-H187 IonicContact OD2-CE1 2.71Å; D72-H187 IonicContact OD2-CG 2.79Å; D72-H187 IonicContact OD2-ND1 3.52Å; D72-H187 PolarHBondContact OD2-ND1 3.41Å; R185-H187 PolarHBondContact O-N 3.04Å; H187-I189 VanDerWaalsContact C-N 3.33Å; H187-I189 PolarHBondContact O-N 2.89Å; H187-V190 PolarHBondContact O-N 3.46Å; H187-R191 VanDerWaalsContact O-CB 3.25Å; H187-R191 WeakPolarHBondContact O-CB 3.33Å; H187-R191 PolarHBondContact O-N 3.3Å
188	D	84.4	Confident	83.3	Confident	44 Å²	44	57.5 Å²	57.5	24%	0.235	28%	0.282	C	S	.	.	H	α-helix	trans	-67.4	-37.9	179.4	-64.4	-43.7	0	0	0	111.6	R185 R191 I192	R185-D188 HydrophobicContact CB-CB 4.14Å; R185-D188 WeakPolarHBondContact CB-OD2 3.5Å; R185-D188 WeakPolarHBondContact CD-OD2 3.46Å; R185-D188 IonicContact CZ-OD2 3.9Å; R185-D188 IonicContact NE-OD2 3.35Å; R185-D188 PolarHBondContact NE-OD2 2.96Å; R185-D188 IonicContact NH1-OD2 3.93Å; R185-D188 PolarHBondContact NH1-OD2 3.08Å; R185-D188 PolarHBondContact O-N 3.38Å; D188-R191 PolarHBondContact O-N 3.14Å; D188-I192 WeakPolarHBondContact O-CB 3.39Å; D188-I192 WeakPolarHBondContact O-CD1 3.34Å; D188-I192 WeakPolarHBondContact O-CG1 3.35Å; D188-I192 PolarHBondContact O-N 2.86Å
189	I	86.7	Confident	83.1	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	31%	0.309	C	S	.	.	H	α-helix	trans	-59.6	-50.3	176.2	-71.8	170.8	0	0	0	110.9	I184 R185 V186 H187 I192 S193 L211 I215 V407 I411	I184-I189 HydrophobicContact CG2-CD1 3.73Å; R185-I189 WeakPolarHBondContact O-CG1 2.99Å; R185-I189 PolarHBondContact O-N 3.47Å; R185-I189 VanDerWaalsContact O-N 3.12Å; V186-I189 WeakPolarHBondContact O-CB 3.14Å; V186-I189 PolarHBondContact O-N 3.26Å; H187-I189 VanDerWaalsContact C-N 3.33Å; H187-I189 PolarHBondContact O-N 2.89Å; I189-I192 PolarHBondContact O-N 2.88Å; I189-S193 PolarHBondContact O-N 3.18Å; I189-S193 VanDerWaalsContact O-N 3.07Å; I189-L211 HydrophobicContact CB-CD1 3.94Å; I189-L211 HydrophobicContact CD1-CD1 4.33Å; I189-L211 HydrophobicContact CG1-CD1 3.65Å; I189-L211 HydrophobicContact CG2-CD1 3.48Å; I189-L211 VanDerWaalsContact CG2-CD1 3.48Å; I189-L211 HydrophobicContact CG2-CD2 4.33Å; I189-I215 HydrophobicContact CD1-CG1 4.46Å; I189-V407 HydrophobicContact CD1-CG1 4.29Å; I189-V407 HydrophobicContact CG2-CG1 4.04Å; I189-I411 HydrophobicContact CG2-CD1 3.55Å; I189-I411 HydrophobicContact CG2-CG1 3.89Å
190	V	86.6	Confident	83.3	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-69.1	-40.6	-179.3	176.3	0	0	0	0	110.2	D72 V186 H187 I192 S193 V194 L410 R414	D72-V190 HydrophobicContact CB-CB 4.43Å; D72-V190 HydrophobicContact CB-CG1 4.34Å; D72-V190 HydrophobicContact CB-CG2 4.34Å; D72-V190 WeakPolarHBondContact OD1-CB 3.41Å; D72-V190 WeakPolarHBondContact OD1-CG1 3.41Å; V186-V190 HydrophobicContact CG1-CG2 4.34Å; V186-V190 WeakPolarHBondContact O-CG2 3.39Å; V186-V190 PolarHBondContact O-N 3.31Å; H187-V190 PolarHBondContact O-N 3.46Å; V190-I192 PolarHBondContact O-N 3.47Å; V190-S193 WeakPolarHBondContact CA-OG 3.31Å; V190-S193 PolarHBondContact O-N 3.26Å; V190-S193 VanDerWaalsContact O-N 3.07Å; V190-S193 PolarHBondContact O-OG 2.9Å; V190-V194 HydrophobicContact CG1-CG2 4.06Å; V190-V194 WeakPolarHBondContact O-CG2 3.32Å; V190-V194 PolarHBondContact O-N 3.38Å; V190-L410 HydrophobicContact CG2-CD2 3.87Å; V190-L410 HydrophobicContact CG2-CG 4.04Å; V190-R414 HydrophobicContact CG1-CB 4.01Å; V190-R414 HydrophobicContact CG1-CG 4.01Å
191	R	86.8	Confident	83.4	Confident	163 Å²	163	66.8 Å²	66.8	62%	0.615	34%	0.335	S	S	*	.	H	α-helix	trans	-55.9	-46.6	174.8	-177.9	-179.7	176.6	-177.9	1.2	112.3	H187 D188 S193 V194 D195	H187-R191 VanDerWaalsContact O-CB 3.25Å; H187-R191 WeakPolarHBondContact O-CB 3.33Å; H187-R191 PolarHBondContact O-N 3.3Å; D188-R191 PolarHBondContact O-N 3.14Å; R191-S193 VanDerWaalsContact C-N 3.31Å; R191-S193 PolarHBondContact O-N 3.38Å; R191-V194 PolarHBondContact O-N 3.49Å; R191-D195 PolarHBondContact O-N 3.35Å
192	I	87.6	Confident	83.6	Confident	67 Å²	67	68.8 Å²	68.8	34%	0.344	35%	0.345	S	S	.	.	H	α-helix	trans	-64.6	-37.3	177	-67.7	163.9	0	0	0	110.8	D188 I189 V190 N198 N207	D188-I192 WeakPolarHBondContact O-CB 3.39Å; D188-I192 WeakPolarHBondContact O-CD1 3.34Å; D188-I192 WeakPolarHBondContact O-CG1 3.35Å; D188-I192 PolarHBondContact O-N 2.86Å; I189-I192 PolarHBondContact O-N 2.88Å; V190-I192 PolarHBondContact O-N 3.47Å; I192-N198 PolarHBondContact O-ND2 2.7Å; I192-N207 HydrophobicContact CG2-CB 3.9Å
193	S	86.2	Confident	84.2	Confident	5 Å²	5	70 Å²	70	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-70.9	-29.1	179.5	74.9	0	0	0	0	114.5	I189 V190 R191 N198 S415	I189-S193 PolarHBondContact O-N 3.18Å; I189-S193 VanDerWaalsContact O-N 3.07Å; V190-S193 WeakPolarHBondContact CA-OG 3.31Å; V190-S193 PolarHBondContact O-N 3.26Å; V190-S193 VanDerWaalsContact O-N 3.07Å; V190-S193 PolarHBondContact O-OG 2.9Å; R191-S193 VanDerWaalsContact C-N 3.31Å; R191-S193 PolarHBondContact O-N 3.38Å; S193-N198 PolarHBondContact O-ND2 2.87Å; S193-S415 WeakPolarHBondContact O-CB 3.11Å
194	V	85.8	Confident	84.8	Confident	37 Å²	37	70 Å²	70	22%	0.224	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	2.8	-178.1	-176.8	0	0	0	0	111.9	V190 R191 E196 R414	V190-V194 HydrophobicContact CG1-CG2 4.06Å; V190-V194 WeakPolarHBondContact O-CG2 3.32Å; V190-V194 PolarHBondContact O-N 3.38Å; R191-V194 PolarHBondContact O-N 3.49Å; V194-E196 PolarHBondContact O-N 3.5Å; V194-R414 HydrophobicContact CG2-CB 3.69Å
195	D	87.1	Confident	85.2	Confident	42 Å²	42	73.3 Å²	73.3	23%	0.225	36%	0.357	C	S	.	.			trans	-59.5	128.4	177.4	-167.1	-6.8	0	0	0	110.8	R191 R197 N198	R191-D195 PolarHBondContact O-N 3.35Å; D195-R197 PolarHBondContact O-N 3.11Å; D195-R197 VanDerWaalsContact O-N 3.11Å; D195-R197 PolarHBondContact OD1-N 3.31Å; D195-R197 IonicContact OD1-NE 2.91Å; D195-R197 PolarHBondContact OD1-NE 3.27Å; D195-R197 IonicContact OD2-CZ 3.54Å; D195-R197 IonicContact OD2-NE 3.57Å; D195-R197 PolarHBondContact OD2-NE 2.97Å; D195-R197 IonicContact OD2-NH2 3.67Å; D195-R197 PolarHBondContact OD2-NH2 3.42Å; D195-N198 VanDerWaalsContact O-CB 3.26Å; D195-N198 WeakPolarHBondContact O-CB 3.45Å; D195-N198 PolarHBondContact O-N 2.97Å; D195-N198 PolarHBondContact O-ND2 3.13Å
196	E	84.4	Confident	85.5	Confident	161 Å²	161	72.9 Å²	72.9	75%	0.752	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-61.2	-23.3	-177.9	-65.7	177.9	-174.7	0	0	111.6	V194 N198 V199	V194-E196 PolarHBondContact O-N 3.5Å; E196-N198 PolarHBondContact O-N 3.35Å; E196-V199 WeakPolarHBondContact O-CG2 3.49Å
197	R	86	Confident	85.8	Confident	155 Å²	155	74.1 Å²	74.1	59%	0.585	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-69.1	-14.6	176.1	-59.7	179.7	-67.4	173.4	2.8	113.8	D195 V199 Q200 V203	D195-R197 PolarHBondContact O-N 3.11Å; D195-R197 VanDerWaalsContact O-N 3.11Å; D195-R197 PolarHBondContact OD1-N 3.31Å; D195-R197 IonicContact OD1-NE 2.91Å; D195-R197 PolarHBondContact OD1-NE 3.27Å; D195-R197 IonicContact OD2-CZ 3.54Å; D195-R197 IonicContact OD2-NE 3.57Å; D195-R197 PolarHBondContact OD2-NE 2.97Å; D195-R197 IonicContact OD2-NH2 3.67Å; D195-R197 PolarHBondContact OD2-NH2 3.42Å; R197-V199 PolarHBondContact O-N 3.32Å; R197-Q200 PolarHBondContact O-N 3.07Å; R197-V203 HydrophobicContact CB-CG1 4Å
198	N	83.7	Confident	86	Confident	20 Å²	20	72 Å²	72	11%	0.107	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-66.4	-2.1	176.5	-70.5	-29.3	0	0	0	114	I192 S193 D195 E196 Q200 N207 F419	I192-N198 PolarHBondContact O-ND2 2.7Å; S193-N198 PolarHBondContact O-ND2 2.87Å; D195-N198 VanDerWaalsContact O-CB 3.26Å; D195-N198 WeakPolarHBondContact O-CB 3.45Å; D195-N198 PolarHBondContact O-N 2.97Å; D195-N198 PolarHBondContact O-ND2 3.13Å; E196-N198 PolarHBondContact O-N 3.35Å; N198-Q200 VanDerWaalsContact C-N 3.31Å; N198-N207 PolarHBondContact OD1-ND2 3.39Å; N198-F419 HydrophobicContact CB-CD2 4.5Å
199	V	82.4	Confident	86.1	Confident	129 Å²	129	73.4 Å²	73.4	78%	0.782	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-69.8	-30.2	168.1	-179.6	0	0	0	0	111.2	E196 R197	E196-V199 WeakPolarHBondContact O-CG2 3.49Å; R197-V199 PolarHBondContact O-N 3.32Å
200	Q	86	Confident	86.2	Confident	122 Å²	122	75.9 Å²	75.9	57%	0.57	38%	0.383	S	S	*	.	S	Bend	trans	-79.8	127.9	176.8	-62.7	177.2	9.7	0	0	110.5	R197 N198 E202 V203 K204	R197-Q200 PolarHBondContact O-N 3.07Å; N198-Q200 VanDerWaalsContact C-N 3.31Å; Q200-E202 VanDerWaalsContact C-N 3.34Å; Q200-E202 PolarHBondContact O-N 3.07Å; Q200-V203 HydrophobicContact CB-CB 4.33Å; Q200-V203 HydrophobicContact CB-CG2 4.19Å; Q200-V203 PolarHBondContact O-N 2.87Å; Q200-K204 WeakPolarHBondContact O-CB 3.42Å; Q200-K204 PolarHBondContact O-N 2.81Å
201	A	83.4	Confident	86.3	Confident	81 Å²	81	76.1 Å²	76.1	67%	0.669	38%	0.384	S	S	*	.	H	α-helix	trans	-59.9	-40	-174.1	0	0	0	0	0	113.3	L205	A201-L205 VanDerWaalsContact O-CB 3.28Å; A201-L205 WeakPolarHBondContact O-CB 3.45Å; A201-L205 PolarHBondContact O-N 3.48Å
202	E	84.1	Confident	86.4	Confident	154 Å²	154	68.3 Å²	68.3	72%	0.72	36%	0.355	S	S	*	.	H	α-helix	trans	-66.1	-49.2	179.9	-66.6	173.4	-169.1	0	0	112	Q200 L205 Q206	Q200-E202 VanDerWaalsContact C-N 3.34Å; Q200-E202 PolarHBondContact O-N 3.07Å; E202-L205 PolarHBondContact O-N 3.48Å; E202-Q206 WeakPolarHBondContact O-CG 3.33Å; E202-Q206 PolarHBondContact O-N 2.89Å
203	V	86.5	Confident	86.3	Confident	30 Å²	30	67.9 Å²	67.9	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-64.7	-43.4	178.1	-179.2	0	0	0	0	110.5	R197 Q200 L205 Q206 N207	R197-V203 HydrophobicContact CB-CG1 4Å; Q200-V203 HydrophobicContact CB-CB 4.33Å; Q200-V203 HydrophobicContact CB-CG2 4.19Å; Q200-V203 PolarHBondContact O-N 2.87Å; V203-L205 VanDerWaalsContact C-N 3.3Å; V203-L205 PolarHBondContact O-N 3.31Å; V203-Q206 PolarHBondContact O-N 3.41Å; V203-N207 WeakPolarHBondContact O-CB 3.25Å; V203-N207 PolarHBondContact O-N 2.93Å
204	K	86.8	Confident	86.4	Confident	44 Å²	44	70.4 Å²	70.4	19%	0.191	37%	0.366	C	S	.	.	H	α-helix	trans	-55.3	-46.8	174.1	179.9	-178.5	171	-170.9	0	111	Q200 N207 L208 F419 D422	Q200-K204 WeakPolarHBondContact O-CB 3.42Å; Q200-K204 PolarHBondContact O-N 2.81Å; K204-N207 PolarHBondContact O-N 3.48Å; K204-L208 HydrophobicContact CG-CD1 4.01Å; K204-L208 HydrophobicContact CG-CG 4.42Å; K204-L208 WeakPolarHBondContact O-CB 3.34Å; K204-L208 VanDerWaalsContact O-CG 3.24Å; K204-L208 WeakPolarHBondContact O-CG 3.29Å; K204-L208 PolarHBondContact O-N 3.28Å; K204-F419 HydrophobicContact CD-CD2 4.42Å; K204-F419 HydrophobicContact CG-CD2 3.94Å; K204-F419 HydrophobicContact CG-CE2 4.05Å; K204-D422 WeakPolarHBondContact CE-OD2 3.43Å; K204-D422 IonicContact NZ-OD2 2.85Å; K204-D422 PolarHBondContact NZ-OD2 3.4Å
205	L	86	Confident	86.4	Confident	77 Å²	77	69.3 Å²	69.3	40%	0.403	36%	0.359	S	S	.	.	H	α-helix	trans	-65.5	-41.8	-179.1	-172.4	63.2	0	0	0	112.2	A201 E202 V203 L208 K209 I456	A201-L205 VanDerWaalsContact O-CB 3.28Å; A201-L205 WeakPolarHBondContact O-CB 3.45Å; A201-L205 PolarHBondContact O-N 3.48Å; E202-L205 PolarHBondContact O-N 3.48Å; V203-L205 VanDerWaalsContact C-N 3.3Å; V203-L205 PolarHBondContact O-N 3.31Å; L205-L208 PolarHBondContact O-N 3.45Å; L205-K209 WeakPolarHBondContact O-CB 3.47Å; L205-K209 PolarHBondContact O-N 3.4Å; L205-I456 HydrophobicContact CD1-CD1 3.85Å; L205-I456 HydrophobicContact CD1-CG1 3.89Å; L205-I456 HydrophobicContact CD2-CD1 3.89Å; L205-I456 HydrophobicContact CD2-CG2 4.38Å; L205-I456 HydrophobicContact CG-CD1 3.71Å; L205-I456 HydrophobicContact CG-CG1 4.32Å
206	Q	88.2	Confident	86.3	Confident	131 Å²	131	69.1 Å²	69.1	61%	0.612	36%	0.357	S	S	*	.	H	α-helix	trans	-62	-46.4	174.5	-71	175.2	1.4	0	0	111.5	E202 V203 K209 A210	E202-Q206 WeakPolarHBondContact O-CG 3.33Å; E202-Q206 PolarHBondContact O-N 2.89Å; V203-Q206 PolarHBondContact O-N 3.41Å; Q206-K209 PolarHBondContact O-N 3.19Å; Q206-A210 WeakPolarHBondContact O-CB 3.27Å; Q206-A210 PolarHBondContact O-N 3.34Å
207	N	89.6	Confident	86.3	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.16	35%	0.347	C	S	.	.	H	α-helix	trans	-63.9	-40.7	177.4	-75.6	-15.4	0	0	0	111.8	I192 N198 V203 K204 A210 L211	I192-N207 HydrophobicContact CG2-CB 3.9Å; N198-N207 PolarHBondContact OD1-ND2 3.39Å; V203-N207 WeakPolarHBondContact O-CB 3.25Å; V203-N207 PolarHBondContact O-N 2.93Å; K204-N207 PolarHBondContact O-N 3.48Å; N207-A210 PolarHBondContact O-N 2.95Å; N207-L211 WeakPolarHBondContact O-CB 3.48Å; N207-L211 PolarHBondContact O-N 2.84Å
208	L	87.8	Confident	86.2	Confident	16 Å²	16	59.3 Å²	59.3	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-61.9	-43.8	173.5	-77.2	172.5	0	0	0	111.8	K204 L205 L211 T212 F419 D422 L423	K204-L208 HydrophobicContact CG-CD1 4.01Å; K204-L208 HydrophobicContact CG-CG 4.42Å; K204-L208 WeakPolarHBondContact O-CB 3.34Å; K204-L208 VanDerWaalsContact O-CG 3.24Å; K204-L208 WeakPolarHBondContact O-CG 3.29Å; K204-L208 PolarHBondContact O-N 3.28Å; L205-L208 PolarHBondContact O-N 3.45Å; L208-L211 PolarHBondContact O-N 2.92Å; L208-T212 VanDerWaalsContact O-CB 3.27Å; L208-T212 WeakPolarHBondContact O-CB 3.28Å; L208-T212 PolarHBondContact O-N 2.98Å; L208-T212 PolarHBondContact O-OG1 2.89Å; L208-F419 HydrophobicContact CD2-CD1 4.49Å; L208-F419 HydrophobicContact CD2-CD2 4.2Å; L208-F419 HydrophobicContact CD2-CE1 4.08Å; L208-F419 HydrophobicContact CD2-CE2 3.77Å; L208-F419 HydrophobicContact CD2-CZ 3.7Å; L208-F419 HydrophobicContact CG-CD2 4.4Å; L208-F419 HydrophobicContact CG-CE2 3.82Å; L208-F419 HydrophobicContact CG-CZ 4.11Å; L208-D422 HydrophobicContact CD1-CB 3.83Å; L208-D422 HydrophobicContact CD2-CB 4.39Å; L208-L423 HydrophobicContact CD2-CB 3.68Å; L208-L423 HydrophobicContact CD2-CD1 4.04Å; L208-L423 HydrophobicContact CD2-CG 4.44Å
209	K	86.1	Confident	86.1	Confident	74 Å²	74	59.2 Å²	59.2	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-51.6	176.5	-173.5	179.2	-177.1	177.5	0	110.6	L205 Q206 L211 T212 T213 Q453 I456	L205-K209 WeakPolarHBondContact O-CB 3.47Å; L205-K209 PolarHBondContact O-N 3.4Å; Q206-K209 PolarHBondContact O-N 3.19Å; K209-L211 VanDerWaalsContact C-N 3.32Å; K209-L211 PolarHBondContact O-N 3.44Å; K209-T212 PolarHBondContact O-N 2.99Å; K209-T213 PolarHBondContact O-N 3.4Å; K209-T213 PolarHBondContact O-OG1 3.45Å; K209-Q453 WeakPolarHBondContact CE-O 3.47Å; K209-Q453 PolarHBondContact NZ-O 3.29Å; K209-I456 HydrophobicContact CD-CD1 4.33Å
210	A	88.4	Confident	86	Confident	56 Å²	56	57.4 Å²	57.4	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-58.1	-44.7	178.8	0	0	0	0	0	112	Q206 N207 T213 H214	Q206-A210 WeakPolarHBondContact O-CB 3.27Å; Q206-A210 PolarHBondContact O-N 3.34Å; N207-A210 PolarHBondContact O-N 2.95Å; A210-T213 PolarHBondContact O-N 3.36Å; A210-H214 WeakPolarHBondContact O-CB 3.32Å; A210-H214 PolarHBondContact O-N 2.95Å
211	L	90.1	Very high	85.6	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-39.6	-179.9	-176.9	55	0	0	0	112.3	I189 N207 L208 K209 H214 I215 I411 F419 L423	I189-L211 HydrophobicContact CB-CD1 3.94Å; I189-L211 HydrophobicContact CD1-CD1 4.33Å; I189-L211 HydrophobicContact CG1-CD1 3.65Å; I189-L211 HydrophobicContact CG2-CD1 3.48Å; I189-L211 VanDerWaalsContact CG2-CD1 3.48Å; I189-L211 HydrophobicContact CG2-CD2 4.33Å; N207-L211 WeakPolarHBondContact O-CB 3.48Å; N207-L211 PolarHBondContact O-N 2.84Å; L208-L211 PolarHBondContact O-N 2.92Å; K209-L211 VanDerWaalsContact C-N 3.32Å; K209-L211 PolarHBondContact O-N 3.44Å; L211-H214 PolarHBondContact O-N 3.48Å; L211-I215 HydrophobicContact CD1-CD1 3.84Å; L211-I215 HydrophobicContact CD1-CG1 4.01Å; L211-I215 HydrophobicContact CG-CD1 3.89Å; L211-I215 HydrophobicContact CG-CG1 4.45Å; L211-I215 WeakPolarHBondContact O-CB 3.33Å; L211-I215 VanDerWaalsContact O-CG1 3.32Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 3.3Å; L211-I411 HydrophobicContact CD2-CD1 4.13Å; L211-F419 HydrophobicContact CD2-CE1 4.13Å; L211-F419 HydrophobicContact CD2-CZ 4.45Å; L211-L423 HydrophobicContact CB-CD1 4.12Å; L211-L423 HydrophobicContact CD2-CD1 3.93Å; L211-L423 HydrophobicContact CD2-CD2 3.42Å; L211-L423 VanDerWaalsContact CD2-CD2 3.42Å; L211-L423 HydrophobicContact CD2-CG 4.3Å; L211-L423 HydrophobicContact CG-CD1 3.83Å; L211-L423 HydrophobicContact CG-CD2 3.95Å
212	T	87.3	Confident	85.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-58.6	-51.2	173.7	-59.8	0	0	0	0	110.1	L208 K209 H214 I215 Q216 S426 L427	L208-T212 VanDerWaalsContact O-CB 3.27Å; L208-T212 WeakPolarHBondContact O-CB 3.28Å; L208-T212 PolarHBondContact O-N 2.98Å; L208-T212 PolarHBondContact O-OG1 2.89Å; K209-T212 PolarHBondContact O-N 2.99Å; T212-H214 VanDerWaalsContact C-N 3.34Å; T212-H214 PolarHBondContact O-N 2.98Å; T212-I215 PolarHBondContact O-N 3.12Å; T212-Q216 HydrophobicContact CG2-CG 4.4Å; T212-Q216 VanDerWaalsContact O-CB 3.31Å; T212-Q216 WeakPolarHBondContact O-CB 3.47Å; T212-Q216 WeakPolarHBondContact O-CG 3.24Å; T212-Q216 PolarHBondContact O-N 2.99Å; T212-S426 WeakPolarHBondContact CG2-OG 3.22Å; T212-S426 WeakPolarHBondContact OG1-CB 3.47Å; T212-S426 PolarHBondContact OG1-OG 3.19Å; T212-L427 HydrophobicContact CG2-CD2 4.12Å
213	T	86.5	Confident	84.7	Confident	58 Å²	58	46 Å²	46	36%	0.356	24%	0.241	S	C	.	.	H	α-helix	trans	-61.2	-41.3	178.1	-57.4	0	0	0	0	111.9	K209 A210 Q216 N217	K209-T213 PolarHBondContact O-N 3.4Å; K209-T213 PolarHBondContact O-OG1 3.45Å; A210-T213 PolarHBondContact O-N 3.36Å; T213-Q216 PolarHBondContact O-N 2.83Å; T213-N217 WeakPolarHBondContact O-CB 3.22Å; T213-N217 PolarHBondContact O-N 3.41Å; T213-N217 PolarHBondContact O-ND2 3.33Å
214	H	87.4	Confident	84.2	Confident	58 Å²	58	50.6 Å²	50.6	27%	0.269	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-48.8	178.1	-175.3	-89	0	0	0	112.3	A210 L211 T212 Q216 N217 A218	A210-H214 WeakPolarHBondContact O-CB 3.32Å; A210-H214 PolarHBondContact O-N 2.95Å; L211-H214 PolarHBondContact O-N 3.48Å; T212-H214 VanDerWaalsContact C-N 3.34Å; T212-H214 PolarHBondContact O-N 2.98Å; H214-Q216 VanDerWaalsContact C-N 3.32Å; H214-Q216 PolarHBondContact O-N 3.45Å; H214-N217 PolarHBondContact O-N 3.37Å; H214-A218 WeakPolarHBondContact O-CB 3.35Å; H214-A218 PolarHBondContact O-N 2.87Å
215	I	86.8	Confident	83.5	Confident	14 Å²	14	50 Å²	50	7%	0.072	25%	0.254	C	S	.	.	H	α-helix	trans	-61.4	-43.3	177.8	-69.2	171.6	0	0	0	110.1	I189 L211 T212 A218 L219 L423 L427	I189-I215 HydrophobicContact CD1-CG1 4.46Å; L211-I215 HydrophobicContact CD1-CD1 3.84Å; L211-I215 HydrophobicContact CD1-CG1 4.01Å; L211-I215 HydrophobicContact CG-CD1 3.89Å; L211-I215 HydrophobicContact CG-CG1 4.45Å; L211-I215 WeakPolarHBondContact O-CB 3.33Å; L211-I215 VanDerWaalsContact O-CG1 3.32Å; L211-I215 WeakPolarHBondContact O-CG1 3.34Å; L211-I215 PolarHBondContact O-N 3.3Å; T212-I215 PolarHBondContact O-N 3.12Å; I215-A218 PolarHBondContact O-N 3.17Å; I215-L219 HydrophobicContact CG2-CD1 3.74Å; I215-L219 HydrophobicContact CG2-CG 4.13Å; I215-L219 WeakPolarHBondContact O-CB 3.48Å; I215-L219 VanDerWaalsContact O-CG 3.25Å; I215-L219 WeakPolarHBondContact O-CG 3.19Å; I215-L219 PolarHBondContact O-N 3.28Å; I215-L423 HydrophobicContact CD1-CD2 4.05Å; I215-L427 HydrophobicContact CB-CD2 4.26Å; I215-L427 HydrophobicContact CD1-CD1 4.32Å; I215-L427 HydrophobicContact CG2-CD1 4.22Å; I215-L427 HydrophobicContact CG2-CD2 3.9Å
216	Q	85.5	Confident	82.6	Confident	37 Å²	37	54.8 Å²	54.8	17%	0.173	27%	0.267	C	S	.	.	H	α-helix	trans	-60.4	-47.5	177.2	-75.7	174.5	-11.7	0	0	113	T212 T213 H214 A218 L219 H220 Y399 L427 S430	T212-Q216 HydrophobicContact CG2-CG 4.4Å; T212-Q216 VanDerWaalsContact O-CB 3.31Å; T212-Q216 WeakPolarHBondContact O-CB 3.47Å; T212-Q216 WeakPolarHBondContact O-CG 3.24Å; T212-Q216 PolarHBondContact O-N 2.99Å; T213-Q216 PolarHBondContact O-N 2.83Å; H214-Q216 VanDerWaalsContact C-N 3.32Å; H214-Q216 PolarHBondContact O-N 3.45Å; Q216-A218 VanDerWaalsContact C-N 3.28Å; Q216-A218 PolarHBondContact O-N 3.39Å; Q216-L219 PolarHBondContact O-N 3.42Å; Q216-H220 VanDerWaalsContact O-CB 3.27Å; Q216-H220 WeakPolarHBondContact O-CB 3.16Å; Q216-H220 PolarHBondContact O-N 2.88Å; Q216-Y399 WeakPolarHBondContact CG-OH 3.41Å; Q216-L427 HydrophobicContact CG-CD2 4.18Å; Q216-S430 PolarHBondContact NE2-OG 2.85Å
217	N	84.7	Confident	81.8	Confident	102 Å²	102	57.8 Å²	57.8	55%	0.545	27%	0.273	S	S	.	.	H	α-helix	trans	-61.4	-40.2	178.2	-74.2	-20.3	0	0	0	111.1	T213 H214 F221	T213-N217 WeakPolarHBondContact O-CB 3.22Å; T213-N217 PolarHBondContact O-N 3.41Å; T213-N217 PolarHBondContact O-ND2 3.33Å; H214-N217 PolarHBondContact O-N 3.37Å; N217-F221 VanDerWaalsContact O-CB 3.26Å; N217-F221 WeakPolarHBondContact O-CB 3.27Å; N217-F221 PolarHBondContact O-N 3.47Å
218	A	83.5	Confident	80.7	Confident	9 Å²	9	66.3 Å²	66.3	7%	0.074	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-47.7	175.9	0	0	0	0	0	112.4	I184 H214 I215 Q216 H220 F221 H222	I184-A218 HydrophobicContact CD1-CB 4.4Å; I184-A218 HydrophobicContact CG1-CB 3.66Å; H214-A218 WeakPolarHBondContact O-CB 3.35Å; H214-A218 PolarHBondContact O-N 2.87Å; I215-A218 PolarHBondContact O-N 3.17Å; Q216-A218 VanDerWaalsContact C-N 3.28Å; Q216-A218 PolarHBondContact O-N 3.39Å; A218-H220 VanDerWaalsContact C-N 3.32Å; A218-H220 PolarHBondContact O-N 3.31Å; A218-F221 WeakPolarHBondContact O-CB 3.38Å; A218-F221 PolarHBondContact O-N 2.93Å; A218-F221 VanDerWaalsContact O-N 3.15Å; A218-H222 PolarHBondContact O-CD2 2.89Å; A218-H222 PolarHBondContact O-N 3.33Å
219	L	81.1	Confident	79.5	Confident	17 Å²	17	75.8 Å²	75.8	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-41	176.5	-69.1	174.5	0	0	0	111.7	I215 Q216 H222 G223 Y399 L400	I215-L219 HydrophobicContact CG2-CD1 3.74Å; I215-L219 HydrophobicContact CG2-CG 4.13Å; I215-L219 WeakPolarHBondContact O-CB 3.48Å; I215-L219 VanDerWaalsContact O-CG 3.25Å; I215-L219 WeakPolarHBondContact O-CG 3.19Å; I215-L219 PolarHBondContact O-N 3.28Å; Q216-L219 PolarHBondContact O-N 3.42Å; L219-H222 PolarHBondContact O-N 2.95Å; L219-G223 PolarHBondContact O-N 2.98Å; L219-Y399 HydrophobicContact CD1-CE1 4.3Å; L219-L400 HydrophobicContact CD1-CD1 4.1Å; L219-L400 VanDerWaalsContact CD2-O 3.29Å; L219-L400 WeakPolarHBondContact CD2-O 3.3Å
220	H	79.6	Confident	78.4	Confident	91 Å²	91	75.5 Å²	75.5	42%	0.421	34%	0.341	S	S	.	.	H	α-helix	trans	-66.2	-39	175.1	-174.9	-108.2	0	0	0	111.8	Q216 A218 G223 R224	Q216-H220 VanDerWaalsContact O-CB 3.27Å; Q216-H220 WeakPolarHBondContact O-CB 3.16Å; Q216-H220 PolarHBondContact O-N 2.88Å; A218-H220 VanDerWaalsContact C-N 3.32Å; A218-H220 PolarHBondContact O-N 3.31Å; H220-G223 WeakPolarHBondContact O-CA 3.24Å; H220-G223 PolarHBondContact O-N 2.91Å; H220-R224 PolarHBondContact ND1-NE 3.37Å; H220-R224 WeakPolarHBondContact O-CG 3.24Å; H220-R224 PolarHBondContact O-N 3.49Å
221	F	78.6	Confident	77	Confident	91 Å²	91	77.9 Å²	77.9	40%	0.399	35%	0.35	S	S	.	.	H	α-helix	trans	-59.6	-48.9	173.1	179.3	-107.5	0	0	0	111.7	N217 A218 G223 R224 L225	N217-F221 VanDerWaalsContact O-CB 3.26Å; N217-F221 WeakPolarHBondContact O-CB 3.27Å; N217-F221 PolarHBondContact O-N 3.47Å; A218-F221 WeakPolarHBondContact O-CB 3.38Å; A218-F221 PolarHBondContact O-N 2.93Å; A218-F221 VanDerWaalsContact O-N 3.15Å; F221-G223 VanDerWaalsContact C-N 3.28Å; F221-G223 PolarHBondContact O-N 3.32Å; F221-R224 PolarHBondContact O-N 2.89Å; F221-R224 VanDerWaalsContact O-N 3.16Å; F221-L225 HydrophobicContact CD1-CD1 3.58Å; F221-L225 HydrophobicContact CD2-CD1 4.5Å; F221-L225 HydrophobicContact CE1-CD1 3.33Å; F221-L225 HydrophobicContact CE1-CG 4.39Å; F221-L225 HydrophobicContact CE2-CD1 4.28Å; F221-L225 HydrophobicContact CG-CD1 4.18Å; F221-L225 HydrophobicContact CZ-CD1 3.7Å; F221-L225 HydrophobicContact CZ-CD2 4.49Å; F221-L225 HydrophobicContact CZ-CG 4.35Å; F221-L225 WeakPolarHBondContact O-CG 3.31Å; F221-L225 PolarHBondContact O-N 3.47Å
222	H	75.9	Confident	75.5	Confident	6 Å²	6	80.4 Å²	80.4	3%	0.028	37%	0.367	C	S	.	.	H	α-helix	trans	-62.3	-34.5	173.2	-71.8	-73.8	0	0	0	112.7	A218 L219 R226	A218-H222 PolarHBondContact O-CD2 2.89Å; A218-H222 PolarHBondContact O-N 3.33Å; L219-H222 PolarHBondContact O-N 2.95Å; H222-R226 PolarHBondContact O-N 2.75Å; H222-R226 VanDerWaalsContact O-N 3.15Å
223	G	73.3	Confident	74.1	Confident	20 Å²	20	84.7 Å²	84.7	21%	0.206	39%	0.387	C	S	.	.	H	α-helix	trans	-61.7	-44.8	171.9	0	0	0	0	0	113	L219 H220 F221 R226 R227	L219-G223 PolarHBondContact O-N 2.98Å; H220-G223 WeakPolarHBondContact O-CA 3.24Å; H220-G223 PolarHBondContact O-N 2.91Å; F221-G223 VanDerWaalsContact C-N 3.28Å; F221-G223 PolarHBondContact O-N 3.32Å; G223-R226 PolarHBondContact O-N 3.17Å; G223-R227 PolarHBondContact O-N 3.48Å; G223-R227 VanDerWaalsContact O-N 3.14Å
224	R	75.1	Confident	72.6	Confident	128 Å²	128	93.7 Å²	93.7	48%	0.483	42%	0.415	S	S	.	.	H	α-helix	trans	-65.2	-43	177.1	-74.3	-172.2	-69.3	174.2	-0.4	112.3	H220 F221 R226 R227 R228	H220-R224 PolarHBondContact ND1-NE 3.37Å; H220-R224 WeakPolarHBondContact O-CG 3.24Å; H220-R224 PolarHBondContact O-N 3.49Å; F221-R224 PolarHBondContact O-N 2.89Å; F221-R224 VanDerWaalsContact O-N 3.16Å; R224-R226 VanDerWaalsContact C-N 3.33Å; R224-R226 PolarHBondContact O-N 3.4Å; R224-R227 PolarHBondContact O-N 2.82Å; R224-R228 PolarHBondContact O-N 2.94Å
225	L	71.9	Confident	71	Confident	31 Å²	31	100.4 Å²	100.4	16%	0.162	44%	0.443	C	S	.	.	H	α-helix	trans	-58.5	-45.2	176.2	-75.3	156.4	0	0	0	111.4	F221 R227 R228 R229 Y243	F221-L225 HydrophobicContact CD1-CD1 3.58Å; F221-L225 HydrophobicContact CD2-CD1 4.5Å; F221-L225 HydrophobicContact CE1-CD1 3.33Å; F221-L225 HydrophobicContact CE1-CG 4.39Å; F221-L225 HydrophobicContact CE2-CD1 4.28Å; F221-L225 HydrophobicContact CG-CD1 4.18Å; F221-L225 HydrophobicContact CZ-CD1 3.7Å; F221-L225 HydrophobicContact CZ-CD2 4.49Å; F221-L225 HydrophobicContact CZ-CG 4.35Å; F221-L225 WeakPolarHBondContact O-CG 3.31Å; F221-L225 PolarHBondContact O-N 3.47Å; L225-R227 PolarHBondContact O-N 3.2Å; L225-R228 PolarHBondContact O-N 3.31Å; L225-R229 PolarHBondContact O-N 3.19Å; L225-Y243 HydrophobicContact CD2-CD1 3.68Å; L225-Y243 HydrophobicContact CD2-CE1 4.06Å
226	R	68	Low	69.5	Low	177 Å²	177	103.5 Å²	103.5	67%	0.668	46%	0.46	S	S	*	.	H	α-helix	trans	-61	-43.1	175.9	-174	179.1	176.6	-172.6	-0.2	112.2	H222 G223 R224 R229	H222-R226 PolarHBondContact O-N 2.75Å; H222-R226 VanDerWaalsContact O-N 3.15Å; G223-R226 PolarHBondContact O-N 3.17Å; R224-R226 VanDerWaalsContact C-N 3.33Å; R224-R226 PolarHBondContact O-N 3.4Å; R226-R229 PolarHBondContact O-N 2.87Å
227	R	70.4	Confident	68.2	Low	194 Å²	194	111.7 Å²	111.7	73%	0.732	49%	0.489	S	S	*	.	H	α-helix	trans	-64.2	-39.4	178.4	-73.2	-174.4	-163.6	168.5	5.2	112.4	G223 R224 L225 R229	G223-R227 PolarHBondContact O-N 3.48Å; G223-R227 VanDerWaalsContact O-N 3.14Å; R224-R227 PolarHBondContact O-N 2.82Å; L225-R227 PolarHBondContact O-N 3.2Å; R227-R229 PolarHBondContact O-N 3.47Å
228	R	66.5	Low	67	Low	209 Å²	209	113 Å²	113	79%	0.789	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.2	179.2	-74.2	-167.3	177.1	-164	-0.2	114.3	R224 L225 V230	R224-R228 PolarHBondContact O-N 2.94Å; L225-R228 PolarHBondContact O-N 3.31Å; R228-V230 HydrophobicContact CB-CG2 3.68Å; R228-V230 PolarHBondContact O-N 2.84Å
229	R	63.5	Low	65.8	Low	216 Å²	216	116 Å²	116	82%	0.815	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	42	44.6	-178.9	-82.7	-166.8	-88.7	-165.1	-6.3	112.6	L225 R226 R227 T231	L225-R229 PolarHBondContact O-N 3.19Å; R226-R229 PolarHBondContact O-N 2.87Å; R227-R229 PolarHBondContact O-N 3.47Å; R229-T231 PolarHBondContact O-N 2.69Å
230	V	61.6	Low	64.8	Low	67 Å²	67	116.6 Å²	116.6	41%	0.406	51%	0.507	S	S	.	.			trans	-74.3	103.2	180	-170.6	0	0	0	0	108.1	R228 P232	R228-V230 HydrophobicContact CB-CG2 3.68Å; R228-V230 PolarHBondContact O-N 2.84Å; V230-P232 WeakPolarHBondContact O-CD 3.26Å
231	T	59.1	Low	64	Low	106 Å²	106	115.1 Å²	115.1	65%	0.65	50%	0.503	S	S	*	.			trans	-108.5	86.8	170.3	53.4	0	0	0	0	108.2	R229 H233	R229-T231 PolarHBondContact O-N 2.69Å; T231-H233 VanDerWaalsContact C-N 3.32Å; T231-H233 PolarHBondContact O-N 3.34Å
232	P	59.7	Low	63	Low	57 Å²	57	112.9 Å²	112.9	37%	0.37	50%	0.497	S	S	.	.			trans	-67.4	-31.1	-172.7	25.1	-32.3	0	0	0	112.9	V230 N240 Y243	V230-P232 WeakPolarHBondContact O-CD 3.26Å; P232-N240 VanDerWaalsContact CD-OD1 3.3Å; P232-N240 WeakPolarHBondContact CD-OD1 3.11Å; P232-Y243 HydrophobicContact CG-CD2 4.06Å; P232-Y243 HydrophobicContact CG-CE2 3.57Å
233	H	58	Low	62.3	Low	90 Å²	90	117.2 Å²	117.2	42%	0.417	51%	0.514	S	S	.	.			trans	-117.2	111.5	-176.7	-62.6	-63.4	0	0	0	112.3	T231 L239 N240	T231-H233 VanDerWaalsContact C-N 3.32Å; T231-H233 PolarHBondContact O-N 3.34Å; H233-L239 HydrophobicContact CB-CB 4.42Å; H233-N240 PolarHBondContact N-OD1 3.49Å; H233-N240 PolarHBondContact O-ND2 3.47Å; H233-N240 PolarHBondContact O-OD1 2.82Å
234	R	54.7	Low	62	Low	248 Å²	248	119 Å²	119	94%	0.936	52%	0.523	S	S	*	.	S	Bend	trans	-74.8	-30.2	178.5	-158.2	172.2	-174.1	173.9	0.5	113
235	F	53.3	Low	61.7	Low	199 Å²	199	113.9 Å²	113.9	87%	0.873	51%	0.507	S	S	*	.	S	Bend	trans	-92.1	-45.5	-174	-158.5	-102.2	0	0	0	113.1	R237	F235-R237 PolarHBondContact O-N 2.83Å
236	L	56.6	Low	62.1	Low	79 Å²	79	115.1 Å²	115.1	41%	0.414	51%	0.511	S	S	.	.			trans	-100.7	79.5	-178.4	-71.1	154.8	0	0	0	110	F238 L239	L236-F238 HydrophobicContact CB-CD1 4.47Å; L236-F238 HydrophobicContact CB-CE1 4.16Å; L236-F238 HydrophobicContact CD2-CD1 4.2Å; L236-F238 HydrophobicContact CD2-CE1 3.32Å; L236-F238 HydrophobicContact CD2-CZ 3.91Å; L236-F238 HydrophobicContact CG-CE1 4.32Å; L236-F238 PolarHBondContact O-N 3.46Å; L236-F238 VanDerWaalsContact O-N 3.11Å; L236-L239 HydrophobicContact CB-CB 4.33Å; L236-L239 HydrophobicContact CB-CD1 3.67Å; L236-L239 HydrophobicContact CB-CG 3.97Å; L236-L239 HydrophobicContact CD1-CD1 3.7Å; L236-L239 HydrophobicContact CG-CD1 4.26Å; L236-L239 WeakPolarHBondContact O-CB 3.3Å; L236-L239 PolarHBondContact O-N 3.29Å
237	R	57.8	Low	62.9	Low	208 Å²	208	107.5 Å²	107.5	79%	0.785	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-56.3	-28.1	-176.9	-89.1	-170.5	-96.6	-177.4	-6	113.9	F235 L239 N240	F235-R237 PolarHBondContact O-N 2.83Å; R237-L239 VanDerWaalsContact C-N 3.31Å; R237-L239 PolarHBondContact O-N 2.72Å; R237-N240 WeakPolarHBondContact O-CB 3.35Å; R237-N240 PolarHBondContact O-N 3.45Å; R237-N240 VanDerWaalsContact O-N 3.15Å
238	F	60	Low	63.7	Low	131 Å²	131	98.3 Å²	98.3	58%	0.575	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-68.4	-29.2	176.7	74.6	-97	0	0	0	112.8	L236 N240 L241	L236-F238 HydrophobicContact CB-CD1 4.47Å; L236-F238 HydrophobicContact CB-CE1 4.16Å; L236-F238 HydrophobicContact CD2-CD1 4.2Å; L236-F238 HydrophobicContact CD2-CE1 3.32Å; L236-F238 HydrophobicContact CD2-CZ 3.91Å; L236-F238 HydrophobicContact CG-CE1 4.32Å; L236-F238 PolarHBondContact O-N 3.46Å; L236-F238 VanDerWaalsContact O-N 3.11Å; F238-N240 PolarHBondContact O-N 2.83Å; F238-N240 VanDerWaalsContact O-N 3.17Å; F238-L241 HydrophobicContact CB-CD1 4.2Å; F238-L241 VanDerWaalsContact O-CB 3.3Å; F238-L241 WeakPolarHBondContact O-CB 3.48Å; F238-L241 WeakPolarHBondContact O-CD1 3.4Å; F238-L241 PolarHBondContact O-N 3.31Å
239	L	58.1	Low	64.7	Low	71 Å²	71	88.4 Å²	88.4	37%	0.372	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-69.7	-8.5	174.4	-66.6	176.5	0	0	0	112.6	H233 L236 R237 P242	H233-L239 HydrophobicContact CB-CB 4.42Å; L236-L239 HydrophobicContact CB-CB 4.33Å; L236-L239 HydrophobicContact CB-CD1 3.67Å; L236-L239 HydrophobicContact CB-CG 3.97Å; L236-L239 HydrophobicContact CD1-CD1 3.7Å; L236-L239 HydrophobicContact CG-CD1 4.26Å; L236-L239 WeakPolarHBondContact O-CB 3.3Å; L236-L239 PolarHBondContact O-N 3.29Å; R237-L239 VanDerWaalsContact C-N 3.31Å; R237-L239 PolarHBondContact O-N 2.72Å; L239-P242 VanDerWaalsContact O-CD 3.31Å; L239-P242 WeakPolarHBondContact O-CD 3.21Å; L239-P242 WeakPolarHBondContact O-CG 3.21Å
240	N	59.3	Low	65.9	Low	29 Å²	29	80 Å²	80	16%	0.155	38%	0.383	C	S	.	.	G	3₁₀ helix	trans	-87.8	-6.8	170.7	-58.4	-36.2	0	0	0	112.9	P232 H233 R237 F238 P242 Y243	P232-N240 VanDerWaalsContact CD-OD1 3.3Å; P232-N240 WeakPolarHBondContact CD-OD1 3.11Å; H233-N240 PolarHBondContact N-OD1 3.49Å; H233-N240 PolarHBondContact O-ND2 3.47Å; H233-N240 PolarHBondContact O-OD1 2.82Å; R237-N240 WeakPolarHBondContact O-CB 3.35Å; R237-N240 PolarHBondContact O-N 3.45Å; R237-N240 VanDerWaalsContact O-N 3.15Å; F238-N240 PolarHBondContact O-N 2.83Å; F238-N240 VanDerWaalsContact O-N 3.17Å; N240-P242 VanDerWaalsContact C-CD 3.43Å; N240-Y243 WeakPolarHBondContact O-CB 3.25Å; N240-Y243 PolarHBondContact O-N 2.84Å; N240-Y243 VanDerWaalsContact O-N 3.16Å
241	L	62.5	Low	67.2	Low	61 Å²	61	77.2 Å²	77.2	32%	0.319	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-55	-38.2	175.2	-98.8	95.3	0	0	0	115.8	F238 Y243 S244 Y247 T250	F238-L241 HydrophobicContact CB-CD1 4.2Å; F238-L241 VanDerWaalsContact O-CB 3.3Å; F238-L241 WeakPolarHBondContact O-CB 3.48Å; F238-L241 WeakPolarHBondContact O-CD1 3.4Å; F238-L241 PolarHBondContact O-N 3.31Å; L241-Y243 PolarHBondContact O-N 3.44Å; L241-S244 VanDerWaalsContact O-CB 3.32Å; L241-S244 WeakPolarHBondContact O-CB 3.3Å; L241-S244 PolarHBondContact O-N 3.18Å; L241-Y247 HydrophobicContact CB-CD2 4.15Å; L241-Y247 WeakPolarHBondContact O-CD2 3.09Å; L241-T250 HydrophobicContact CD2-CG2 3.42Å; L241-T250 VanDerWaalsContact CD2-CG2 3.42Å
242	P	58.9	Low	68.7	Low	44 Å²	44	72.4 Å²	72.4	29%	0.286	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-58.5	-17.1	177.7	19.7	-32.3	0	0	0	114.1	L239 N240 Y247	L239-P242 VanDerWaalsContact O-CD 3.31Å; L239-P242 WeakPolarHBondContact O-CD 3.21Å; L239-P242 WeakPolarHBondContact O-CG 3.21Å; N240-P242 VanDerWaalsContact C-CD 3.43Å; P242-Y247 HydrophobicContact CB-CD2 4.15Å; P242-Y247 HydrophobicContact CB-CE2 3.88Å
243	Y	60.4	Low	70.3	Confident	97 Å²	97	70.9 Å²	70.9	38%	0.38	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-93.4	-2.2	178.6	-59.6	-89.4	0	0	0	113.1	L225 P232 N240 L241	L225-Y243 HydrophobicContact CD2-CD1 3.68Å; L225-Y243 HydrophobicContact CD2-CE1 4.06Å; P232-Y243 HydrophobicContact CG-CD2 4.06Å; P232-Y243 HydrophobicContact CG-CE2 3.57Å; N240-Y243 WeakPolarHBondContact O-CB 3.25Å; N240-Y243 PolarHBondContact O-N 2.84Å; N240-Y243 VanDerWaalsContact O-N 3.16Å; L241-Y243 PolarHBondContact O-N 3.44Å
244	S	65.8	Low	71.9	Confident	58 Å²	58	71.5 Å²	71.5	41%	0.406	33%	0.327	S	S	.	.	S	Bend	trans	-85.9	152.5	178.5	-170.4	0	0	0	0	111.8	L241 F246	L241-S244 VanDerWaalsContact O-CB 3.32Å; L241-S244 WeakPolarHBondContact O-CB 3.3Å; L241-S244 PolarHBondContact O-N 3.18Å; S244-F246 PolarHBondContact O-N 2.72Å
245	S	69.4	Low	73.7	Confident	20 Å²	20	60 Å²	60	14%	0.14	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	16.6	174.4	-53.1	0	0	0	0	114.2	K401 D403	S245-K401 PolarHBondContact OG-NZ 3.42Å; S245-D403 VanDerWaalsContact O-OD2 3.14Å
246	F	80.3	Confident	75.7	Confident	57 Å²	57	50.7 Å²	50.7	25%	0.25	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.9	19.6	-179.1	-175.3	-112.9	0	0	0	110.5	S244 C249 T250 L253 I362 P402 D403	S244-F246 PolarHBondContact O-N 2.72Å; F246-C249 HydrophobicContact CD2-CB 3.49Å; F246-C249 VanDerWaalsContact CD2-CB 3.49Å; F246-C249 HydrophobicContact CE1-CB 4.44Å; F246-C249 HydrophobicContact CE2-CB 3.26Å; F246-C249 HydrophobicContact CG-CB 4.22Å; F246-C249 HydrophobicContact CZ-CB 3.77Å; F246-T250 WeakPolarHBondContact CD1-OG1 3.41Å; F246-T250 WeakPolarHBondContact CE1-OG1 3Å; F246-T250 WeakPolarHBondContact O-CB 3.44Å; F246-T250 PolarHBondContact O-N 2.99Å; F246-T250 PolarHBondContact O-OG1 2.93Å; F246-L253 HydrophobicContact CZ-CD1 4.4Å; F246-I362 HydrophobicContact CE2-CG2 3.4Å; F246-I362 VanDerWaalsContact CE2-CG2 3.4Å; F246-I362 HydrophobicContact CZ-CG2 3.5Å; F246-I362 VanDerWaalsContact CZ-CG2 3.5Å; F246-P402 HydrophobicContact CB-CG 4.37Å; F246-P402 HydrophobicContact CD2-CB 3.73Å; F246-P402 HydrophobicContact CD2-CG 3.6Å; F246-P402 HydrophobicContact CE2-CB 4.12Å; F246-P402 HydrophobicContact CE2-CG 4.41Å; F246-P402 HydrophobicContact CG-CG 4.44Å; F246-D403 VanDerWaalsContact C-OD1 3.28Å; F246-D403 WeakPolarHBondContact CA-OD1 3.48Å; F246-D403 WeakPolarHBondContact CA-OD2 3.49Å; F246-D403 PolarHBondContact N-OD2 2.88Å
247	Y	85	Confident	77.5	Confident	17 Å²	17	50 Å²	50	7%	0.067	24%	0.244	C	C	.	.	H	α-helix	trans	-69.4	-50.4	-171.2	175.6	-108.8	0	0	0	111	L178 L241 P242 C249 T250 V251 D403	L178-Y247 PolarHBondContact O-OH 2.84Å; L241-Y247 HydrophobicContact CB-CD2 4.15Å; L241-Y247 WeakPolarHBondContact O-CD2 3.09Å; P242-Y247 HydrophobicContact CB-CD2 4.15Å; P242-Y247 HydrophobicContact CB-CE2 3.88Å; Y247-C249 VanDerWaalsContact C-N 3.32Å; Y247-C249 PolarHBondContact O-N 3.46Å; Y247-T250 PolarHBondContact O-N 3.41Å; Y247-T250 VanDerWaalsContact O-N 3.14Å; Y247-V251 HydrophobicContact CD1-CG2 4.32Å; Y247-V251 HydrophobicContact CD2-CG2 3.93Å; Y247-V251 HydrophobicContact CE1-CG2 3.95Å; Y247-V251 HydrophobicContact CE2-CG2 3.55Å; Y247-V251 HydrophobicContact CG-CG2 4.34Å; Y247-V251 WeakPolarHBondContact O-CG2 3.34Å; Y247-V251 PolarHBondContact O-N 3.47Å; Y247-D403 PolarHBondContact N-OD2 3.18Å
248	V	86.6	Confident	79.3	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-45.4	-177.4	-179.2	0	0	0	0	110.1	W175 I184 V186 T250 V251 Y252 D403 F406	W175-V248 HydrophobicContact CH2-CG1 4.15Å; I184-V248 HydrophobicContact CB-CG2 4.42Å; I184-V248 HydrophobicContact CD1-CG2 4.17Å; V186-V248 HydrophobicContact CG2-CG1 3.95Å; V248-T250 PolarHBondContact O-N 2.98Å; V248-V251 PolarHBondContact O-N 3.34Å; V248-Y252 WeakPolarHBondContact O-CB 3.42Å; V248-Y252 PolarHBondContact O-N 3.12Å; V248-D403 HydrophobicContact CB-CB 4.48Å; V248-D403 PolarHBondContact N-OD1 2.95Å; V248-D403 PolarHBondContact N-OD2 3.14Å; V248-F406 HydrophobicContact CG1-CD1 3.91Å; V248-F406 HydrophobicContact CG1-CE1 3.88Å
249	C	89	Confident	80.9	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-44.4	175.1	-68.7	0	0	0	0	112.7	F246 Y247 Y252 L253 I362 D403 F406	F246-C249 HydrophobicContact CD2-CB 3.49Å; F246-C249 VanDerWaalsContact CD2-CB 3.49Å; F246-C249 HydrophobicContact CE1-CB 4.44Å; F246-C249 HydrophobicContact CE2-CB 3.26Å; F246-C249 HydrophobicContact CG-CB 4.22Å; F246-C249 HydrophobicContact CZ-CB 3.77Å; Y247-C249 VanDerWaalsContact C-N 3.32Å; Y247-C249 PolarHBondContact O-N 3.46Å; C249-Y252 PolarHBondContact O-N 2.89Å; C249-L253 PolarHBondContact O-N 3.45Å; C249-I362 HydrophobicContact CB-CG2 3.69Å; C249-D403 WeakPolarHBondContact CB-OD1 3.49Å; C249-D403 PolarHBondContact N-OD1 3.43Å; C249-D403 PolarHBondContact SG-OD1 3.07Å; C249-F406 WeakPolarHBondContact SG-CB 3.46Å
250	T	88	Confident	82.7	Confident	39 Å²	39	34.9 Å²	34.9	24%	0.239	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-44	180	-54.4	0	0	0	0	111.5	L241 F246 Y247 V248 Y252 L253 F254	L241-T250 HydrophobicContact CD2-CG2 3.42Å; L241-T250 VanDerWaalsContact CD2-CG2 3.42Å; F246-T250 WeakPolarHBondContact CD1-OG1 3.41Å; F246-T250 WeakPolarHBondContact CE1-OG1 3Å; F246-T250 WeakPolarHBondContact O-CB 3.44Å; F246-T250 PolarHBondContact O-N 2.99Å; F246-T250 PolarHBondContact O-OG1 2.93Å; Y247-T250 PolarHBondContact O-N 3.41Å; Y247-T250 VanDerWaalsContact O-N 3.14Å; V248-T250 PolarHBondContact O-N 2.98Å; T250-Y252 VanDerWaalsContact C-N 3.25Å; T250-Y252 PolarHBondContact O-N 3.21Å; T250-L253 PolarHBondContact O-N 3.36Å; T250-F254 VanDerWaalsContact O-CB 3.23Å; T250-F254 WeakPolarHBondContact O-CB 3.36Å; T250-F254 PolarHBondContact O-N 2.96Å
251	V	89.2	Confident	84.5	Confident	9 Å²	9	36.1 Å²	36.1	6%	0.055	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-37.6	177.5	173.2	0	0	0	0	110.5	W175 L178 Y247 V248 F254 T255	W175-V251 HydrophobicContact CE3-CG1 3.75Å; W175-V251 HydrophobicContact CZ3-CB 4.21Å; W175-V251 HydrophobicContact CZ3-CG1 3.8Å; L178-V251 HydrophobicContact CB-CG1 3.42Å; L178-V251 VanDerWaalsContact CB-CG1 3.42Å; L178-V251 HydrophobicContact CB-CG2 4.25Å; L178-V251 HydrophobicContact CD1-CG1 3.96Å; L178-V251 HydrophobicContact CG-CG1 4.36Å; Y247-V251 HydrophobicContact CD1-CG2 4.32Å; Y247-V251 HydrophobicContact CD2-CG2 3.93Å; Y247-V251 HydrophobicContact CE1-CG2 3.95Å; Y247-V251 HydrophobicContact CE2-CG2 3.55Å; Y247-V251 HydrophobicContact CG-CG2 4.34Å; Y247-V251 WeakPolarHBondContact O-CG2 3.34Å; Y247-V251 PolarHBondContact O-N 3.47Å; V248-V251 PolarHBondContact O-N 3.34Å; V251-F254 PolarHBondContact O-N 3Å; V251-T255 WeakPolarHBondContact O-CB 3.26Å; V251-T255 PolarHBondContact O-N 3.16Å; V251-T255 PolarHBondContact O-OG1 3.28Å
252	Y	90.7	Very high	86.1	Confident	5 Å²	5	34 Å²	34	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-48.8	177.3	-171.2	-107.4	0	0	0	111.6	D77 W175 V248 C249 T250 F254 T255 K256 W358 I362 F406	D77-Y252 PolarHBondContact OD2-OH 3.24Å; W175-Y252 HydrophobicContact CD2-CD2 4.33Å; W175-Y252 HydrophobicContact CE3-CD2 4.06Å; W175-Y252 AromaticContact CH2-CD2 3.62Å; W175-Y252 HydrophobicContact CH2-CD2 3.62Å; W175-Y252 HydrophobicContact CH2-CG 4.14Å; W175-Y252 AromaticContact CZ2-CD2 3.85Å; W175-Y252 HydrophobicContact CZ2-CD2 3.85Å; W175-Y252 VanDerWaalsContact CZ3-CA 3.41Å; W175-Y252 AromaticContact CZ3-CD2 3.74Å; W175-Y252 HydrophobicContact CZ3-CD2 3.74Å; W175-Y252 HydrophobicContact CZ3-CG 4.14Å; V248-Y252 WeakPolarHBondContact O-CB 3.42Å; V248-Y252 PolarHBondContact O-N 3.12Å; C249-Y252 PolarHBondContact O-N 2.89Å; T250-Y252 VanDerWaalsContact C-N 3.25Å; T250-Y252 PolarHBondContact O-N 3.21Å; Y252-F254 VanDerWaalsContact C-N 3.3Å; Y252-F254 PolarHBondContact O-N 2.92Å; Y252-T255 WeakPolarHBondContact O-CB 3.33Å; Y252-T255 PolarHBondContact O-N 2.57Å; Y252-K256 HydrophobicContact CD1-CG 4.36Å; Y252-K256 HydrophobicContact CE1-CD 4.5Å; Y252-K256 VanDerWaalsContact CE1-CE 3.5Å; Y252-K256 HydrophobicContact CE1-CG 4.13Å; Y252-K256 WeakPolarHBondContact O-CG 3.32Å; Y252-K256 PolarHBondContact O-N 2.82Å; Y252-K256 WeakPolarHBondContact OH-CE 3.43Å; Y252-K256 PolarHBondContact OH-NZ 3.16Å; Y252-W358 HydrophobicContact CD1-CD2 4.48Å; Y252-W358 HydrophobicContact CD1-CE3 4.47Å; Y252-W358 HydrophobicContact CE1-CB 4.31Å; Y252-W358 AromaticContact CE1-CD2 3.57Å; Y252-W358 HydrophobicContact CE1-CD2 3.57Å; Y252-W358 AromaticContact CE1-CE2 3.86Å; Y252-W358 AromaticContact CE1-CE3 3.87Å; Y252-W358 HydrophobicContact CE1-CE3 3.87Å; Y252-W358 AromaticContact CE1-CG 3.76Å; Y252-W358 HydrophobicContact CE1-CG 3.76Å; Y252-W358 HydrophobicContact CE1-CZ2 4.38Å; Y252-W358 HydrophobicContact CE1-CZ3 4.38Å; Y252-I362 HydrophobicContact CD1-CD1 4.06Å; Y252-F406 AromaticContact CD1-CE2 3.46Å; Y252-F406 HydrophobicContact CD1-CE2 3.46Å; Y252-F406 VanDerWaalsContact CD1-CE2 3.46Å; Y252-F406 AromaticContact CD1-CZ 3.54Å; Y252-F406 HydrophobicContact CD1-CZ 3.54Å; Y252-F406 HydrophobicContact CD2-CE2 4.49Å; Y252-F406 AromaticContact CD2-CZ 3.75Å; Y252-F406 HydrophobicContact CD2-CZ 3.75Å; Y252-F406 AromaticContact CE1-CE2 3.79Å; Y252-F406 HydrophobicContact CE1-CE2 3.79Å; Y252-F406 AromaticContact CE1-CZ 3.98Å; Y252-F406 HydrophobicContact CE1-CZ 3.98Å; Y252-F406 HydrophobicContact CE2-CZ 4.18Å; Y252-F406 HydrophobicContact CG-CE1 4.34Å; Y252-F406 AromaticContact CG-CE2 3.85Å; Y252-F406 HydrophobicContact CG-CE2 3.85Å; Y252-F406 AromaticContact CG-CZ 3.41Å; Y252-F406 HydrophobicContact CG-CZ 3.41Å; Y252-F406 VanDerWaalsContact CG-CZ 3.41Å
253	L	92.2	Very high	87.8	Confident	25 Å²	25	31.9 Å²	31.9	13%	0.131	17%	0.174	C	C	.	.	H	α-helix	trans	-60.6	-39.4	174.5	-74.7	178.4	0	0	0	112.1	F246 C249 T250 K256 C257 W358 I362 L363	F246-L253 HydrophobicContact CZ-CD1 4.4Å; C249-L253 PolarHBondContact O-N 3.45Å; T250-L253 PolarHBondContact O-N 3.36Å; L253-K256 WeakPolarHBondContact O-CB 2.97Å; L253-K256 PolarHBondContact O-N 2.87Å; L253-C257 PolarHBondContact O-N 3.11Å; L253-C257 PolarHBondContact O-SG 3.49Å; L253-W358 HydrophobicContact CD2-CB 4.34Å; L253-I362 HydrophobicContact CD1-CB 4.14Å; L253-I362 HydrophobicContact CD1-CD1 4.42Å; L253-I362 HydrophobicContact CD1-CG2 3.69Å; L253-I362 HydrophobicContact CD2-CD1 3.93Å; L253-I362 HydrophobicContact CG-CD1 3.88Å; L253-I362 HydrophobicContact CG-CG2 4.28Å; L253-L363 HydrophobicContact CD1-CD2 4.2Å; L253-L363 HydrophobicContact CD1-CG 4.43Å
254	F	92.6	Very high	89.4	Confident	103 Å²	103	29.6 Å²	29.6	45%	0.452	17%	0.172	S	C	.	.	H	α-helix	trans	-61.6	-44.6	174.9	177.1	-109.7	0	0	0	111.4	I174 L178 T250 V251 Y252 K256 C257 L258	I174-F254 HydrophobicContact CG2-CE1 4.32Å; L178-F254 HydrophobicContact CD1-CD1 4.44Å; T250-F254 VanDerWaalsContact O-CB 3.23Å; T250-F254 WeakPolarHBondContact O-CB 3.36Å; T250-F254 PolarHBondContact O-N 2.96Å; V251-F254 PolarHBondContact O-N 3Å; Y252-F254 VanDerWaalsContact C-N 3.3Å; Y252-F254 PolarHBondContact O-N 2.92Å; F254-K256 VanDerWaalsContact C-N 3.34Å; F254-K256 PolarHBondContact O-N 2.67Å; F254-C257 WeakPolarHBondContact O-CB 3.23Å; F254-C257 PolarHBondContact O-N 2.94Å; F254-L258 HydrophobicContact CD1-CD1 3.93Å; F254-L258 HydrophobicContact CD1-CG 4.39Å; F254-L258 HydrophobicContact CE1-CD1 3.45Å; F254-L258 VanDerWaalsContact CE1-CD1 3.45Å; F254-L258 HydrophobicContact CE1-CG 4.05Å; F254-L258 HydrophobicContact CE2-CD2 4.4Å; F254-L258 HydrophobicContact CE2-CG 4.37Å; F254-L258 HydrophobicContact CZ-CD1 3.84Å; F254-L258 HydrophobicContact CZ-CD2 4.06Å; F254-L258 HydrophobicContact CZ-CG 4.03Å; F254-L258 WeakPolarHBondContact O-CG 3.5Å; F254-L258 PolarHBondContact O-N 2.97Å
255	T	92.6	Very high	90.8	Very high	5 Å²	5	30.8 Å²	30.8	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-42.5	175.3	-55.6	0	0	0	0	111.5	P171 W175 V251 Y252 C257 L258 Y259	P171-T255 HydrophobicContact CB-CG2 4.21Å; W175-T255 HydrophobicContact CB-CG2 3.78Å; V251-T255 WeakPolarHBondContact O-CB 3.26Å; V251-T255 PolarHBondContact O-N 3.16Å; V251-T255 PolarHBondContact O-OG1 3.28Å; Y252-T255 WeakPolarHBondContact O-CB 3.33Å; Y252-T255 PolarHBondContact O-N 2.57Å; T255-C257 VanDerWaalsContact C-N 3.34Å; T255-C257 PolarHBondContact O-N 3.15Å; T255-L258 WeakPolarHBondContact O-CB 3.38Å; T255-L258 PolarHBondContact O-N 3.16Å; T255-L258 VanDerWaalsContact O-N 3.12Å; T255-Y259 HydrophobicContact CG2-CD2 4.09Å; T255-Y259 HydrophobicContact CG2-CE2 3.73Å; T255-Y259 WeakPolarHBondContact O-CD2 3.41Å; T255-Y259 PolarHBondContact O-N 3.36Å
256	K	93.6	Very high	91.9	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.017	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-44.2	174.6	-72.3	-72.9	-176.2	178.4	0	112	D74 D77 Y252 L253 F254 L258 Y259 L260 S354 V355	D74-K256 IonicContact OD2-NZ 3.74Å; D74-K256 PolarHBondContact OD2-NZ 2.91Å; D77-K256 WeakPolarHBondContact OD1-CD 3.32Å; D77-K256 VanDerWaalsContact OD1-CE 3.26Å; D77-K256 WeakPolarHBondContact OD1-CE 3.26Å; D77-K256 IonicContact OD1-NZ 2.72Å; D77-K256 PolarHBondContact OD1-NZ 2.79Å; D77-K256 WeakPolarHBondContact OD2-CE 3.37Å; D77-K256 IonicContact OD2-NZ 3.34Å; D77-K256 PolarHBondContact OD2-NZ 2.69Å; Y252-K256 HydrophobicContact CD1-CG 4.36Å; Y252-K256 HydrophobicContact CE1-CD 4.5Å; Y252-K256 VanDerWaalsContact CE1-CE 3.5Å; Y252-K256 HydrophobicContact CE1-CG 4.13Å; Y252-K256 WeakPolarHBondContact O-CG 3.32Å; Y252-K256 PolarHBondContact O-N 2.82Å; Y252-K256 WeakPolarHBondContact OH-CE 3.43Å; Y252-K256 PolarHBondContact OH-NZ 3.16Å; L253-K256 WeakPolarHBondContact O-CB 2.97Å; L253-K256 PolarHBondContact O-N 2.87Å; F254-K256 VanDerWaalsContact C-N 3.34Å; F254-K256 PolarHBondContact O-N 2.67Å; K256-L258 VanDerWaalsContact C-N 3.33Å; K256-L258 PolarHBondContact O-N 2.86Å; K256-Y259 PolarHBondContact O-N 3.33Å; K256-L260 PolarHBondContact O-N 3.24Å; K256-S354 PolarHBondContact NZ-OG 2.83Å; K256-V355 HydrophobicContact CB-CG2 3.95Å
257	C	94.6	Very high	92.4	Very high	65 Å²	65	28.3 Å²	28.3	44%	0.439	16%	0.161	S	C	.	.	H	α-helix	trans	-64	-36.9	173.8	-69.1	0	0	0	0	112.2	L253 F254 T255 L260 A261	L253-C257 PolarHBondContact O-N 3.11Å; L253-C257 PolarHBondContact O-SG 3.49Å; F254-C257 WeakPolarHBondContact O-CB 3.23Å; F254-C257 PolarHBondContact O-N 2.94Å; T255-C257 VanDerWaalsContact C-N 3.34Å; T255-C257 PolarHBondContact O-N 3.15Å; C257-L260 PolarHBondContact O-N 3.09Å; C257-A261 VanDerWaalsContact O-CB 3.26Å; C257-A261 WeakPolarHBondContact O-CB 3.47Å; C257-A261 PolarHBondContact O-N 3.4Å
258	L	95.4	Very high	92.6	Very high	46 Å²	46	33.8 Å²	33.8	24%	0.241	19%	0.189	C	C	.	.	H	α-helix	trans	-64.7	-39.7	174.2	-73	177.9	0	0	0	112.3	P171 I174 F254 T255 K256 N262	P171-L258 HydrophobicContact CB-CB 4.12Å; P171-L258 HydrophobicContact CG-CB 4.21Å; I174-L258 HydrophobicContact CB-CD1 4.49Å; I174-L258 HydrophobicContact CD1-CD1 3.74Å; I174-L258 HydrophobicContact CG2-CD1 4.05Å; F254-L258 HydrophobicContact CD1-CD1 3.93Å; F254-L258 HydrophobicContact CD1-CG 4.39Å; F254-L258 HydrophobicContact CE1-CD1 3.45Å; F254-L258 VanDerWaalsContact CE1-CD1 3.45Å; F254-L258 HydrophobicContact CE1-CG 4.05Å; F254-L258 HydrophobicContact CE2-CD2 4.4Å; F254-L258 HydrophobicContact CE2-CG 4.37Å; F254-L258 HydrophobicContact CZ-CD1 3.84Å; F254-L258 HydrophobicContact CZ-CD2 4.06Å; F254-L258 HydrophobicContact CZ-CG 4.03Å; F254-L258 WeakPolarHBondContact O-CG 3.5Å; F254-L258 PolarHBondContact O-N 2.97Å; T255-L258 WeakPolarHBondContact O-CB 3.38Å; T255-L258 PolarHBondContact O-N 3.16Å; T255-L258 VanDerWaalsContact O-N 3.12Å; K256-L258 VanDerWaalsContact C-N 3.33Å; K256-L258 PolarHBondContact O-N 2.86Å; L258-N262 VanDerWaalsContact O-CB 3.22Å; L258-N262 WeakPolarHBondContact O-CB 3.46Å; L258-N262 PolarHBondContact O-N 3.43Å
259	Y	95.1	Very high	92.8	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.016	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-49.2	172.2	-77.9	-58.8	0	0	0	111.2	D77 N80 H81 P171 S172 T255 K256 A261 N262 V263	D77-Y259 HydrophobicContact CB-CE2 4.08Å; N80-Y259 HydrophobicContact CB-CD1 3.49Å; N80-Y259 VanDerWaalsContact CB-CD1 3.49Å; N80-Y259 HydrophobicContact CB-CE1 3.62Å; N80-Y259 HydrophobicContact CB-CG 4.29Å; H81-Y259 HydrophobicContact CB-CE1 4.09Å; P171-Y259 HydrophobicContact CB-CD1 3.79Å; P171-Y259 HydrophobicContact CB-CD2 4.27Å; P171-Y259 HydrophobicContact CB-CE1 3.59Å; P171-Y259 HydrophobicContact CB-CE2 4.11Å; P171-Y259 HydrophobicContact CB-CG 4.12Å; P171-Y259 HydrophobicContact CG-CD1 3.81Å; P171-Y259 HydrophobicContact CG-CE1 3.88Å; P171-Y259 HydrophobicContact CG-CG 4.4Å; S172-Y259 WeakPolarHBondContact CB-OH 3.44Å; S172-Y259 PolarHBondContact N-OH 3.2Å; T255-Y259 HydrophobicContact CG2-CD2 4.09Å; T255-Y259 HydrophobicContact CG2-CE2 3.73Å; T255-Y259 WeakPolarHBondContact O-CD2 3.41Å; T255-Y259 PolarHBondContact O-N 3.36Å; K256-Y259 PolarHBondContact O-N 3.33Å; Y259-A261 PolarHBondContact O-N 2.84Å; Y259-N262 PolarHBondContact O-N 2.93Å; Y259-V263 VanDerWaalsContact O-CG2 3.29Å; Y259-V263 WeakPolarHBondContact O-CG2 3.38Å; Y259-V263 PolarHBondContact O-N 3.04Å
260	L	95.7	Very high	92.8	Very high	42 Å²	42	36.7 Å²	36.7	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-46.3	178.1	-179.2	61.4	0	0	0	112.1	K256 C257 N262 V263 C264 F348 V352 V355	K256-L260 PolarHBondContact O-N 3.24Å; C257-L260 PolarHBondContact O-N 3.09Å; L260-N262 VanDerWaalsContact C-N 3.33Å; L260-N262 PolarHBondContact O-N 3.46Å; L260-V263 PolarHBondContact O-N 3.47Å; L260-C264 PolarHBondContact O-N 3.37Å; L260-C264 PolarHBondContact O-SG 3.16Å; L260-C264 VanDerWaalsContact O-SG 3.39Å; L260-F348 HydrophobicContact CD1-CD2 3.81Å; L260-F348 HydrophobicContact CD1-CE2 3.61Å; L260-V352 HydrophobicContact CD1-CG2 3.52Å; L260-V355 HydrophobicContact CB-CG2 4.26Å; L260-V355 HydrophobicContact CD2-CG2 4.44Å
261	A	96.3	Very high	92.7	Very high	56 Å²	56	36.8 Å²	36.8	46%	0.463	20%	0.203	S	C	.	.	H	α-helix	trans	-62.7	-39.7	177.1	0	0	0	0	0	111.8	C257 Y259 C264 L265	C257-A261 VanDerWaalsContact O-CB 3.26Å; C257-A261 WeakPolarHBondContact O-CB 3.47Å; C257-A261 PolarHBondContact O-N 3.4Å; Y259-A261 PolarHBondContact O-N 2.84Å; A261-C264 PolarHBondContact O-N 3.45Å; A261-L265 VanDerWaalsContact O-CB 3.26Å; A261-L265 WeakPolarHBondContact O-CB 3.33Å; A261-L265 PolarHBondContact O-N 3.45Å
262	N	96.4	Very high	92.5	Very high	15 Å²	15	46.1 Å²	46.1	8%	0.08	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-46.8	175.4	-177.9	57.5	0	0	0	110.8	C167 F168 L258 Y259 L260 C264 L265 Q266	C167-N262 WeakPolarHBondContact CB-OD1 3.44Å; F168-N262 WeakPolarHBondContact CA-ND2 3.4Å; F168-N262 WeakPolarHBondContact CD1-ND2 3.34Å; F168-N262 WeakPolarHBondContact CE1-ND2 3.39Å; F168-N262 WeakPolarHBondContact CG-ND2 3.39Å; L258-N262 VanDerWaalsContact O-CB 3.22Å; L258-N262 WeakPolarHBondContact O-CB 3.46Å; L258-N262 PolarHBondContact O-N 3.43Å; Y259-N262 PolarHBondContact O-N 2.93Å; L260-N262 VanDerWaalsContact C-N 3.33Å; L260-N262 PolarHBondContact O-N 3.46Å; N262-C264 PolarHBondContact O-N 3.34Å; N262-L265 CarbonylContact O-C 3.55Å; N262-L265 WeakPolarHBondContact O-CA 3.22Å; N262-L265 WeakPolarHBondContact O-CB 3.45Å; N262-L265 PolarHBondContact O-N 2.91Å; N262-L265 VanDerWaalsContact O-N 3.1Å; N262-Q266 VanDerWaalsContact O-CG 3.28Å; N262-Q266 WeakPolarHBondContact O-CG 3.08Å; N262-Q266 PolarHBondContact O-N 3.32Å; N262-Q266 PolarHBondContact OD1-NE2 3.12Å; N262-Q266 VanDerWaalsContact OD1-NE2 3.09Å
263	V	95.3	Very high	92.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-44	178.9	179.9	0	0	0	0	112	N80 F168 Y259 L260 L265 Q266 L267 L347 F348 T351	N80-V263 WeakPolarHBondContact OD1-CG2 3.25Å; F168-V263 HydrophobicContact CE1-CG2 3.97Å; Y259-V263 VanDerWaalsContact O-CG2 3.29Å; Y259-V263 WeakPolarHBondContact O-CG2 3.38Å; Y259-V263 PolarHBondContact O-N 3.04Å; L260-V263 PolarHBondContact O-N 3.47Å; V263-L265 VanDerWaalsContact C-N 3.32Å; V263-L265 PolarHBondContact O-N 3.48Å; V263-Q266 PolarHBondContact O-N 3.03Å; V263-L267 HydrophobicContact CG1-CD1 4.34Å; V263-L267 WeakPolarHBondContact O-CG 2.9Å; V263-L267 PolarHBondContact O-N 2.83Å; V263-L347 HydrophobicContact CB-CD2 4.23Å; V263-L347 HydrophobicContact CG1-CD2 3.97Å; V263-L347 HydrophobicContact CG2-CD2 3.16Å; V263-F348 HydrophobicContact CG1-CB 3.74Å; V263-F348 HydrophobicContact CG1-CD2 4.29Å; V263-T351 HydrophobicContact CG2-CG2 4.47Å
264	C	93.9	Very high	91.7	Very high	49 Å²	49	47.6 Å²	47.6	33%	0.331	24%	0.243	S	C	.	.	H	α-helix	trans	-59.2	-44.8	173.1	-69.3	0	0	0	0	111.6	L260 A261 N262 L267 M268 F348	L260-C264 PolarHBondContact O-N 3.37Å; L260-C264 PolarHBondContact O-SG 3.16Å; L260-C264 VanDerWaalsContact O-SG 3.39Å; A261-C264 PolarHBondContact O-N 3.45Å; N262-C264 PolarHBondContact O-N 3.34Å; C264-L267 PolarHBondContact O-N 2.99Å; C264-M268 WeakPolarHBondContact O-CG 3.36Å; C264-M268 PolarHBondContact O-N 3.46Å; C264-F348 VanDerWaalsContact SG-CE2 3.54Å
265	L	93.9	Very high	90.5	Very high	84 Å²	84	44.8 Å²	44.8	44%	0.44	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-44	178	179.9	64.1	0	0	0	111.2	A261 N262 V263 M268 L269	A261-L265 VanDerWaalsContact O-CB 3.26Å; A261-L265 WeakPolarHBondContact O-CB 3.33Å; A261-L265 PolarHBondContact O-N 3.45Å; N262-L265 CarbonylContact O-C 3.55Å; N262-L265 WeakPolarHBondContact O-CA 3.22Å; N262-L265 WeakPolarHBondContact O-CB 3.45Å; N262-L265 PolarHBondContact O-N 2.91Å; N262-L265 VanDerWaalsContact O-N 3.1Å; V263-L265 VanDerWaalsContact C-N 3.32Å; V263-L265 PolarHBondContact O-N 3.48Å; L265-M268 CarbonylContact O-C 3.58Å; L265-M268 PolarHBondContact O-N 2.97Å; L265-L269 HydrophobicContact CD1-CD1 4.25Å; L265-L269 HydrophobicContact CD1-CG 4.09Å; L265-L269 HydrophobicContact CD2-CD1 4.4Å; L265-L269 HydrophobicContact CG-CD1 3.85Å; L265-L269 HydrophobicContact CG-CG 4.15Å; L265-L269 WeakPolarHBondContact O-CB 3.3Å; L265-L269 VanDerWaalsContact O-CG 3.25Å; L265-L269 WeakPolarHBondContact O-CG 3.35Å; L265-L269 PolarHBondContact O-N 2.95Å
266	Q	94	Very high	88.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-65.1	-40.9	178	-61.6	-53.1	-21.5	0	0	111.9	E164 F168 N262 V263 M268 L269 M270 Y344	E164-Q266 VanDerWaalsContact CG-OE1 3.25Å; E164-Q266 PolarHBondContact OE1-OE1 3.41Å; F168-Q266 HydrophobicContact CD2-CG 4.3Å; F168-Q266 HydrophobicContact CE2-CB 4.24Å; F168-Q266 HydrophobicContact CE2-CG 3.57Å; F168-Q266 HydrophobicContact CZ-CB 4.21Å; F168-Q266 HydrophobicContact CZ-CG 3.75Å; N262-Q266 VanDerWaalsContact O-CG 3.28Å; N262-Q266 WeakPolarHBondContact O-CG 3.08Å; N262-Q266 PolarHBondContact O-N 3.32Å; N262-Q266 PolarHBondContact OD1-NE2 3.12Å; N262-Q266 VanDerWaalsContact OD1-NE2 3.09Å; V263-Q266 PolarHBondContact O-N 3.03Å; Q266-M268 VanDerWaalsContact C-N 3.3Å; Q266-M268 PolarHBondContact O-N 3.02Å; Q266-L269 PolarHBondContact O-N 3.46Å; Q266-M270 VanDerWaalsContact O-CB 3.3Å; Q266-M270 WeakPolarHBondContact O-CB 3.17Å; Q266-M270 PolarHBondContact O-N 3.14Å; Q266-Y344 HydrophobicContact CB-CE2 4.2Å
267	L	91.2	Very high	87	Confident	23 Å²	23	55.9 Å²	55.9	12%	0.12	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-40.8	172.6	-76.9	169.1	0	0	0	112	V263 C264 M270 N271 Y344 V345 F348	V263-L267 HydrophobicContact CG1-CD1 4.34Å; V263-L267 WeakPolarHBondContact O-CG 2.9Å; V263-L267 PolarHBondContact O-N 2.83Å; C264-L267 PolarHBondContact O-N 2.99Å; L267-M270 HydrophobicContact CD2-CE 4.22Å; L267-N271 WeakPolarHBondContact O-CB 3.28Å; L267-N271 PolarHBondContact O-N 2.71Å; L267-Y344 HydrophobicContact CD2-CD2 4.35Å; L267-Y344 HydrophobicContact CD2-CG 4.48Å; L267-V345 HydrophobicContact CD2-CG2 4.42Å; L267-F348 HydrophobicContact CD1-CB 4.46Å
268	M	88.9	Confident	85.2	Confident	132 Å²	132	59.5 Å²	59.5	65%	0.65	30%	0.296	S	S	*	.	H	α-helix	trans	-70.5	-41.3	175.9	-71.5	178.4	65.1	0	0	112.7	C264 L265 Q266 N271 R272	C264-M268 WeakPolarHBondContact O-CG 3.36Å; C264-M268 PolarHBondContact O-N 3.46Å; L265-M268 CarbonylContact O-C 3.58Å; L265-M268 PolarHBondContact O-N 2.97Å; Q266-M268 VanDerWaalsContact C-N 3.3Å; Q266-M268 PolarHBondContact O-N 3.02Å; M268-N271 PolarHBondContact O-N 3.19Å; M268-R272 WeakPolarHBondContact O-CB 3.32Å; M268-R272 PolarHBondContact O-N 3.15Å
269	L	90.8	Very high	83.4	Confident	62 Å²	62	59.8 Å²	59.8	33%	0.325	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-46.4	178.7	-77.3	174.7	0	0	0	110.6	F160 L265 Q266 N271 R272 F273	F160-L269 HydrophobicContact CE2-CB 4.41Å; F160-L269 HydrophobicContact CZ-CB 4.38Å; L265-L269 HydrophobicContact CD1-CD1 4.25Å; L265-L269 HydrophobicContact CD1-CG 4.09Å; L265-L269 HydrophobicContact CD2-CD1 4.4Å; L265-L269 HydrophobicContact CG-CD1 3.85Å; L265-L269 HydrophobicContact CG-CG 4.15Å; L265-L269 WeakPolarHBondContact O-CB 3.3Å; L265-L269 VanDerWaalsContact O-CG 3.25Å; L265-L269 WeakPolarHBondContact O-CG 3.35Å; L265-L269 PolarHBondContact O-N 2.95Å; Q266-L269 PolarHBondContact O-N 3.46Å; L269-N271 VanDerWaalsContact C-N 3.33Å; L269-N271 PolarHBondContact O-N 3.45Å; L269-R272 CarbonylContact O-C 3.59Å; L269-R272 PolarHBondContact O-N 3.45Å; L269-F273 WeakPolarHBondContact O-CB 3.21Å; L269-F273 PolarHBondContact O-N 3.14Å
270	M	88.3	Confident	82	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-43.1	175.3	-175.7	-178.8	59.8	0	0	111.5	Q266 L267 R272 F273 L274 F337 L340 W341 Y344	Q266-M270 VanDerWaalsContact O-CB 3.3Å; Q266-M270 WeakPolarHBondContact O-CB 3.17Å; Q266-M270 PolarHBondContact O-N 3.14Å; L267-M270 HydrophobicContact CD2-CE 4.22Å; M270-R272 VanDerWaalsContact C-N 3.32Å; M270-R272 PolarHBondContact O-N 3.22Å; M270-F273 PolarHBondContact O-N 3.36Å; M270-L274 HydrophobicContact CG-CD1 4.08Å; M270-L274 WeakPolarHBondContact O-CG 3.36Å; M270-L274 PolarHBondContact O-N 3.22Å; M270-L274 VanDerWaalsContact O-N 3.14Å; M270-F337 HydrophobicContact CG-CD1 3.98Å; M270-F337 HydrophobicContact CG-CE1 4.37Å; M270-F337 HydrophobicContact SD-CD1 4.05Å; M270-L340 HydrophobicContact SD-CB 4.5Å; M270-W341 HydrophobicContact CE-CB 3.82Å; M270-W341 VanDerWaalsContact CE-CD1 3.44Å; M270-W341 HydrophobicContact CE-CG 4.01Å; M270-W341 HydrophobicContact SD-CB 4.47Å; M270-Y344 HydrophobicContact CE-CD2 4.26Å; M270-Y344 HydrophobicContact SD-CD2 4.33Å; M270-Y344 HydrophobicContact SD-CE2 4.38Å
271	N	85.8	Confident	80.8	Confident	40 Å²	40	75.4 Å²	75.4	21%	0.214	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-37	176.3	-168.3	57.2	0	0	0	112.5	L267 M268 L269 R280 Y282	L267-N271 WeakPolarHBondContact O-CB 3.28Å; L267-N271 PolarHBondContact O-N 2.71Å; M268-N271 PolarHBondContact O-N 3.19Å; L269-N271 VanDerWaalsContact C-N 3.33Å; L269-N271 PolarHBondContact O-N 3.45Å; N271-R280 PolarHBondContact ND2-O 3Å; N271-Y282 VanDerWaalsContact OD1-CB 3.27Å; N271-Y282 WeakPolarHBondContact OD1-CB 3.42Å; N271-Y282 PolarHBondContact OD1-N 3.02Å
272	R	85.6	Confident	79.6	Confident	206 Å²	206	73 Å²	73	78%	0.777	33%	0.33	S	S	*	.	H	α-helix	trans	-74.5	-38.7	176.6	-176.1	173.8	176.5	105	0.4	112.3	M268 L269 M270 G275	M268-R272 WeakPolarHBondContact O-CB 3.32Å; M268-R272 PolarHBondContact O-N 3.15Å; L269-R272 CarbonylContact O-C 3.59Å; L269-R272 PolarHBondContact O-N 3.45Å; M270-R272 VanDerWaalsContact C-N 3.32Å; M270-R272 PolarHBondContact O-N 3.22Å; R272-G275 PolarHBondContact O-N 2.9Å
273	F	86.7	Confident	78.5	Confident	48 Å²	48	72.4 Å²	72.4	21%	0.211	33%	0.327	C	S	.	.	H	α-helix	trans	-66.1	-38.2	-177.9	-178.9	-98.9	0	0	0	111.9	Y153 W156 V157 F160 L269 M270 G275 F337	Y153-F273 HydrophobicContact CD2-CE1 4.46Å; Y153-F273 WeakPolarHBondContact O-CZ 3.23Å; W156-F273 HydrophobicContact CB-CE2 4.17Å; W156-F273 HydrophobicContact CB-CZ 4.19Å; V157-F273 HydrophobicContact CG2-CE1 3.99Å; V157-F273 HydrophobicContact CG2-CZ 4.19Å; F160-F273 HydrophobicContact CB-CE2 4Å; F160-F273 HydrophobicContact CB-CZ 4.01Å; F160-F273 HydrophobicContact CD1-CD1 4.21Å; F160-F273 HydrophobicContact CD1-CE1 4.31Å; F160-F273 HydrophobicContact CD1-CG 4.38Å; F160-F273 HydrophobicContact CD2-CB 4.43Å; F160-F273 AromaticContact CD2-CD2 3.61Å; F160-F273 HydrophobicContact CD2-CD2 3.61Å; F160-F273 AromaticContact CD2-CE2 3.94Å; F160-F273 HydrophobicContact CD2-CE2 3.94Å; F160-F273 AromaticContact CD2-CG 3.93Å; F160-F273 HydrophobicContact CD2-CG 3.93Å; F160-F273 HydrophobicContact CE1-CD1 4.27Å; F160-F273 HydrophobicContact CE1-CG 4.32Å; F160-F273 HydrophobicContact CE2-CB 3.88Å; F160-F273 AromaticContact CE2-CD2 3.92Å; F160-F273 HydrophobicContact CE2-CD2 3.92Å; F160-F273 AromaticContact CE2-CG 3.88Å; F160-F273 HydrophobicContact CE2-CG 3.88Å; F160-F273 HydrophobicContact CG-CD1 4.33Å; F160-F273 HydrophobicContact CG-CD2 4.01Å; F160-F273 HydrophobicContact CG-CE1 4.3Å; F160-F273 AromaticContact CG-CE2 3.98Å; F160-F273 HydrophobicContact CG-CE2 3.98Å; F160-F273 HydrophobicContact CG-CG 4.19Å; F160-F273 HydrophobicContact CG-CZ 4.12Å; F160-F273 HydrophobicContact CZ-CB 3.94Å; F160-F273 HydrophobicContact CZ-CD1 4.46Å; F160-F273 HydrophobicContact CZ-CG 4.07Å; L269-F273 WeakPolarHBondContact O-CB 3.21Å; L269-F273 PolarHBondContact O-N 3.14Å; M270-F273 PolarHBondContact O-N 3.36Å; F273-G275 PolarHBondContact O-N 3.03Å; F273-F337 HydrophobicContact CD1-CZ 4.09Å; F273-F337 HydrophobicContact CE1-CE2 4.48Å; F273-F337 AromaticContact CE1-CZ 3.91Å; F273-F337 HydrophobicContact CE1-CZ 3.91Å
274	L	79.4	Confident	77.5	Confident	12 Å²	12	79.1 Å²	79.1	6%	0.063	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-2.6	176.7	-68.9	168.4	0	0	0	113.8	M270 T276 Y282 F302 F337	M270-L274 HydrophobicContact CG-CD1 4.08Å; M270-L274 WeakPolarHBondContact O-CG 3.36Å; M270-L274 PolarHBondContact O-N 3.22Å; M270-L274 VanDerWaalsContact O-N 3.14Å; L274-T276 PolarHBondContact O-N 3.3Å; L274-Y282 HydrophobicContact CD1-CD1 3.84Å; L274-Y282 HydrophobicContact CD1-CD2 3.81Å; L274-Y282 HydrophobicContact CD1-CE1 3.78Å; L274-Y282 HydrophobicContact CD1-CE2 3.76Å; L274-Y282 HydrophobicContact CD1-CG 3.86Å; L274-F302 HydrophobicContact CD1-CZ 4.2Å; L274-F302 HydrophobicContact CD2-CE1 3.49Å; L274-F302 VanDerWaalsContact CD2-CE1 3.49Å; L274-F302 HydrophobicContact CD2-CE2 4.37Å; L274-F302 HydrophobicContact CD2-CZ 3.28Å; L274-F302 HydrophobicContact CG-CZ 4.35Å; L274-F337 HydrophobicContact CD1-CB 4.29Å; L274-F337 HydrophobicContact CD1-CD1 4.39Å; L274-F337 HydrophobicContact CD1-CG 4.26Å; L274-F337 HydrophobicContact CD2-CD2 3.99Å; L274-F337 HydrophobicContact CD2-CE2 4.2Å; L274-F337 HydrophobicContact CD2-CG 4.28Å
275	G	67	Low	76.7	Confident	45 Å²	45	77.1 Å²	77.1	46%	0.464	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	13.6	168.4	0	0	0	0	0	115.2	R272 F273 Y277	R272-G275 PolarHBondContact O-N 2.9Å; F273-G275 PolarHBondContact O-N 3.03Å; G275-Y277 VanDerWaalsContact C-N 3.32Å; G275-Y277 PolarHBondContact O-N 3.32Å
276	T	58.7	Low	75.7	Confident	16 Å²	16	74.2 Å²	74.2	10%	0.098	33%	0.333	C	S	.	.			trans	-78.8	79.5	-178.8	44.7	0	0	0	0	110.9	L274 K278 Y279 I301	L274-T276 PolarHBondContact O-N 3.3Å; T276-K278 PolarHBondContact O-N 3.02Å; T276-Y279 PolarHBondContact O-N 3.22Å; T276-Y279 VanDerWaalsContact O-O 3.06Å; T276-I301 HydrophobicContact CG2-CD1 3.51Å; T276-I301 HydrophobicContact CG2-CG1 3.78Å; T276-I301 HydrophobicContact CG2-CG2 4.23Å
277	Y	53.2	Low	74.7	Confident	225 Å²	225	76.2 Å²	76.2	88%	0.882	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-23.2	165.2	-66.9	-78.4	0	0	0	112.1	G275 Y279	G275-Y277 VanDerWaalsContact C-N 3.32Å; G275-Y277 PolarHBondContact O-N 3.32Å; Y277-Y279 VanDerWaalsContact C-N 3.31Å; Y277-Y279 PolarHBondContact O-N 3.08Å
278	K	56.8	Low	74.1	Confident	141 Å²	141	78.4 Å²	78.4	61%	0.613	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.2	179.7	-162.5	172.8	-179.4	178.9	0	113.5	T276	T276-K278 PolarHBondContact O-N 3.02Å
279	Y	58.9	Low	73.4	Confident	53 Å²	53	73.3 Å²	73.3	21%	0.208	34%	0.335	C	S	.	.			trans	-125.1	124.4	-177.8	-62.4	-64.8	0	0	0	111.1	T276 Y277 W281 D289 I301	T276-Y279 PolarHBondContact O-N 3.22Å; T276-Y279 VanDerWaalsContact O-O 3.06Å; Y277-Y279 VanDerWaalsContact C-N 3.31Å; Y277-Y279 PolarHBondContact O-N 3.08Å; Y279-W281 PolarHBondContact O-N 3.36Å; Y279-D289 PolarHBondContact OH-OD1 2.79Å; Y279-D289 VanDerWaalsContact OH-OD1 3.12Å; Y279-D289 PolarHBondContact OH-OD2 2.94Å; Y279-I301 HydrophobicContact CD2-CD1 3.65Å; Y279-I301 HydrophobicContact CE2-CD1 3.42Å; Y279-I301 VanDerWaalsContact CE2-CD1 3.42Å
280	R	65.2	Low	72.5	Confident	222 Å²	222	76.2 Å²	76.2	84%	0.838	35%	0.349	S	S	*	.	S	Bend	trans	-60.6	-28.1	172	-73.4	179.6	71.9	176.4	3	112.1	N271	N271-R280 PolarHBondContact ND2-O 3Å
281	W	69.8	Low	72.1	Confident	151 Å²	151	83 Å²	83	57%	0.572	39%	0.385	S	S	*	.	S	Bend	trans	-139.8	101.5	-178.3	-64.9	88.7	0	0	0	110	Y279 G283 F284 G285	Y279-W281 PolarHBondContact O-N 3.36Å; W281-G283 VanDerWaalsContact C-N 3.35Å; W281-G283 PolarHBondContact O-N 3.4Å; W281-F284 HydrophobicContact CB-CD2 4.14Å; W281-F284 PolarHBondContact O-N 2.85Å; W281-G285 PolarHBondContact O-N 2.68Å
282	Y	71.3	Confident	71.9	Confident	6 Å²	6	85 Å²	85	2%	0.024	40%	0.402	C	S	.	.	H	α-helix	trans	-44.3	-52.8	-178.7	165.7	-104.8	0	0	0	113.6	N271 L274 F284 G285 A286 I301 F302	N271-Y282 VanDerWaalsContact OD1-CB 3.27Å; N271-Y282 WeakPolarHBondContact OD1-CB 3.42Å; N271-Y282 PolarHBondContact OD1-N 3.02Å; L274-Y282 HydrophobicContact CD1-CD1 3.84Å; L274-Y282 HydrophobicContact CD1-CD2 3.81Å; L274-Y282 HydrophobicContact CD1-CE1 3.78Å; L274-Y282 HydrophobicContact CD1-CE2 3.76Å; L274-Y282 HydrophobicContact CD1-CG 3.86Å; Y282-F284 PolarHBondContact O-N 3.38Å; Y282-G285 PolarHBondContact O-N 2.92Å; Y282-A286 HydrophobicContact CE2-CB 4.15Å; Y282-A286 WeakPolarHBondContact O-CB 3.17Å; Y282-A286 PolarHBondContact O-N 2.84Å; Y282-I301 HydrophobicContact CE2-CG2 4.34Å; Y282-F302 AromaticContact CE2-CE2 3.81Å; Y282-F302 HydrophobicContact CE2-CE2 3.81Å; Y282-F302 HydrophobicContact CE2-CZ 4.35Å; Y282-F302 AromaticContact CZ-CE2 3.88Å; Y282-F302 WeakPolarHBondContact OH-CE2 3.17Å
283	G	73	Confident	71.5	Confident	2 Å²	2	78.1 Å²	78.1	2%	0.021	39%	0.394	C	S	.	.	H	α-helix	trans	-72.9	-33.4	-169.6	0	0	0	0	0	115.4	W281 G285 A286 I287	W281-G283 VanDerWaalsContact C-N 3.35Å; W281-G283 PolarHBondContact O-N 3.4Å; G283-G285 VanDerWaalsContact C-N 3.34Å; G283-A286 PolarHBondContact O-N 3.17Å; G283-I287 WeakPolarHBondContact O-CB 3.32Å; G283-I287 WeakPolarHBondContact O-CD1 3.22Å; G283-I287 WeakPolarHBondContact O-CG1 3.14Å; G283-I287 PolarHBondContact O-N 3.5Å
284	F	75.5	Confident	70.9	Confident	141 Å²	141	77.6 Å²	77.6	62%	0.618	40%	0.399	S	S	*	.	H	α-helix	trans	-67.1	-39.1	171.9	-73.3	-69.3	0	0	0	111.3	W281 Y282 S288 W341	W281-F284 HydrophobicContact CB-CD2 4.14Å; W281-F284 PolarHBondContact O-N 2.85Å; Y282-F284 PolarHBondContact O-N 3.38Å; F284-S288 WeakPolarHBondContact O-CB 3.14Å; F284-S288 PolarHBondContact O-N 3.5Å; F284-W341 HydrophobicContact CD2-CZ2 4.14Å; F284-W341 HydrophobicContact CE1-CH2 4.42Å; F284-W341 HydrophobicContact CE2-CH2 4.46Å; F284-W341 HydrophobicContact CE2-CZ2 4.15Å; F284-W341 HydrophobicContact CG-CZ2 4.49Å; F284-W341 HydrophobicContact CZ-CH2 4.38Å
285	G	76.9	Confident	70.8	Confident	8 Å²	8	80 Å²	80	8%	0.082	41%	0.414	C	S	.	.	H	α-helix	trans	-62.5	-49.3	173.5	0	0	0	0	0	112	W281 Y282 G283 I287 S288 D289	W281-G285 PolarHBondContact O-N 2.68Å; Y282-G285 PolarHBondContact O-N 2.92Å; G283-G285 VanDerWaalsContact C-N 3.34Å; G285-I287 VanDerWaalsContact C-N 3.34Å; G285-I287 PolarHBondContact O-N 2.82Å; G285-S288 WeakPolarHBondContact O-CB 3.2Å; G285-S288 PolarHBondContact O-N 3.34Å; G285-S288 VanDerWaalsContact O-N 3.16Å; G285-D289 WeakPolarHBondContact O-CB 3.18Å; G285-D289 VanDerWaalsContact O-CG 3.3Å; G285-D289 PolarHBondContact O-N 2.92Å
286	A	72.5	Confident	71.3	Confident	23 Å²	23	79.9 Å²	79.9	19%	0.19	40%	0.4	C	S	.	.	H	α-helix	trans	-62	-38.7	179.8	0	0	0	0	0	112.7	Y282 G283 M290	Y282-A286 HydrophobicContact CE2-CB 4.15Å; Y282-A286 WeakPolarHBondContact O-CB 3.17Å; Y282-A286 PolarHBondContact O-N 2.84Å; G283-A286 PolarHBondContact O-N 3.17Å; A286-M290 VanDerWaalsContact O-CB 3.29Å; A286-M290 WeakPolarHBondContact O-CB 3.38Å; A286-M290 PolarHBondContact O-N 2.82Å
287	I	73.8	Confident	72	Confident	42 Å²	42	83.4 Å²	83.4	22%	0.215	42%	0.415	C	S	.	.	H	α-helix	trans	-68.3	-42.7	175.1	-68	164.2	0	0	0	110.8	G283 G285 D289 M290 L291 W341 F342	G283-I287 WeakPolarHBondContact O-CB 3.32Å; G283-I287 WeakPolarHBondContact O-CD1 3.22Å; G283-I287 WeakPolarHBondContact O-CG1 3.14Å; G283-I287 PolarHBondContact O-N 3.5Å; G285-I287 VanDerWaalsContact C-N 3.34Å; G285-I287 PolarHBondContact O-N 2.82Å; I287-D289 VanDerWaalsContact C-N 3.32Å; I287-D289 PolarHBondContact O-N 3.34Å; I287-M290 PolarHBondContact O-N 2.79Å; I287-L291 HydrophobicContact CG2-CD1 3.71Å; I287-L291 HydrophobicContact CG2-CG 4.24Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 VanDerWaalsContact O-CG 3.3Å; I287-L291 WeakPolarHBondContact O-CG 3.44Å; I287-L291 PolarHBondContact O-N 3.39Å; I287-W341 HydrophobicContact CD1-CE3 4.29Å; I287-W341 HydrophobicContact CD1-CH2 3.97Å; I287-W341 HydrophobicContact CD1-CZ3 3.55Å; I287-F342 HydrophobicContact CD1-CE1 3.66Å; I287-F342 HydrophobicContact CD1-CZ 3.47Å; I287-F342 VanDerWaalsContact CD1-CZ 3.47Å; I287-F342 HydrophobicContact CG1-CZ 3.85Å
288	S	78.2	Confident	73	Confident	70 Å²	70	80.8 Å²	80.8	49%	0.49	41%	0.408	S	S	.	.	H	α-helix	trans	-61.8	-41.5	176	-175.9	0	0	0	0	111.6	F284 G285 L291 S292	F284-S288 WeakPolarHBondContact O-CB 3.14Å; F284-S288 PolarHBondContact O-N 3.5Å; G285-S288 WeakPolarHBondContact O-CB 3.2Å; G285-S288 PolarHBondContact O-N 3.34Å; G285-S288 VanDerWaalsContact O-N 3.16Å; S288-L291 PolarHBondContact O-N 3.04Å; S288-S292 VanDerWaalsContact O-CB 3.31Å; S288-S292 WeakPolarHBondContact O-CB 3.07Å; S288-S292 PolarHBondContact O-N 2.64Å; S288-S292 PolarHBondContact O-OG 3.13Å
289	D	74.1	Confident	73.8	Confident	24 Å²	24	75 Å²	75	13%	0.128	39%	0.386	C	S	.	.	H	α-helix	trans	-67.4	-39.2	177.4	-71	-6.5	0	0	0	110.8	Y279 G285 I287 S292 G293 A294	Y279-D289 PolarHBondContact OH-OD1 2.79Å; Y279-D289 VanDerWaalsContact OH-OD1 3.12Å; Y279-D289 PolarHBondContact OH-OD2 2.94Å; G285-D289 WeakPolarHBondContact O-CB 3.18Å; G285-D289 VanDerWaalsContact O-CG 3.3Å; G285-D289 PolarHBondContact O-N 2.92Å; I287-D289 VanDerWaalsContact C-N 3.32Å; I287-D289 PolarHBondContact O-N 3.34Å; D289-S292 WeakPolarHBondContact CA-OG 3.36Å; D289-S292 PolarHBondContact O-N 3.2Å; D289-S292 PolarHBondContact O-OG 2.78Å; D289-S292 VanDerWaalsContact O-OG 3.06Å; D289-G293 PolarHBondContact O-N 3.31Å; D289-A294 HydrophobicContact CB-CB 4.26Å; D289-A294 PolarHBondContact O-N 3.47Å
290	M	72	Confident	74.5	Confident	123 Å²	123	74 Å²	74	61%	0.606	39%	0.391	S	S	*	.	H	α-helix	trans	-69.1	-38.7	175.8	-168.3	168.5	71	0	0	112.8	A286 I287 G293	A286-M290 VanDerWaalsContact O-CB 3.29Å; A286-M290 WeakPolarHBondContact O-CB 3.38Å; A286-M290 PolarHBondContact O-N 2.82Å; I287-M290 PolarHBondContact O-N 2.79Å; M290-G293 PolarHBondContact O-N 2.82Å
291	L	80.5	Confident	74.9	Confident	146 Å²	146	64.6 Å²	64.6	76%	0.764	36%	0.357	S	S	*	.	H	α-helix	trans	-71.3	-33.2	176.6	-75.5	169.4	0	0	0	112.5	I287 S288 G293	I287-L291 HydrophobicContact CG2-CD1 3.71Å; I287-L291 HydrophobicContact CG2-CG 4.24Å; I287-L291 WeakPolarHBondContact O-CB 3.41Å; I287-L291 VanDerWaalsContact O-CG 3.3Å; I287-L291 WeakPolarHBondContact O-CG 3.44Å; I287-L291 PolarHBondContact O-N 3.39Å; S288-L291 PolarHBondContact O-N 3.04Å; L291-G293 PolarHBondContact O-N 3.16Å
292	S	80.1	Confident	75.5	Confident	82 Å²	82	57.8 Å²	57.8	57%	0.573	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.8	174.6	58.9	0	0	0	0	113.3	S288 D289 A294	S288-S292 VanDerWaalsContact O-CB 3.31Å; S288-S292 WeakPolarHBondContact O-CB 3.07Å; S288-S292 PolarHBondContact O-N 2.64Å; S288-S292 PolarHBondContact O-OG 3.13Å; D289-S292 WeakPolarHBondContact CA-OG 3.36Å; D289-S292 PolarHBondContact O-N 3.2Å; D289-S292 PolarHBondContact O-OG 2.78Å; D289-S292 VanDerWaalsContact O-OG 3.06Å; S292-A294 PolarHBondContact O-N 3.34Å
293	G	78	Confident	76.3	Confident	60 Å²	60	57.6 Å²	57.6	62%	0.619	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.2	21.4	-177.2	0	0	0	0	0	113.2	D289 M290 L291 T295	D289-G293 PolarHBondContact O-N 3.31Å; M290-G293 PolarHBondContact O-N 2.82Å; L291-G293 PolarHBondContact O-N 3.16Å; G293-T295 PolarHBondContact O-N 3.11Å
294	A	73.9	Confident	77.1	Confident	37 Å²	37	61.4 Å²	61.4	31%	0.306	35%	0.345	S	S	.	.			trans	-67.9	123.4	178	0	0	0	0	0	110	D289 S292	D289-A294 HydrophobicContact CB-CB 4.26Å; D289-A294 PolarHBondContact O-N 3.47Å; S292-A294 PolarHBondContact O-N 3.34Å
295	T	77.4	Confident	77.9	Confident	64 Å²	64	56 Å²	56	39%	0.393	32%	0.324	S	S	.	.			trans	-75.8	156	174.6	52.9	0	0	0	0	110.8	G293 E297 K298 S299	G293-T295 PolarHBondContact O-N 3.11Å; T295-E297 PolarHBondContact O-N 2.7Å; T295-K298 PolarHBondContact O-N 2.97Å; T295-S299 PolarHBondContact O-N 3.41Å
296	W	76.6	Confident	78.6	Confident	42 Å²	42	55.7 Å²	55.7	16%	0.159	32%	0.32	C	S	.	.	H	α-helix	trans	-53.8	-26.3	176.3	56.2	-91.3	0	0	0	112.8	F132 F135 K298 G300 P303 R304 V305	F132-W296 HydrophobicContact CE2-CE3 4.11Å; F132-W296 AromaticContact CE2-CZ3 3.79Å; F132-W296 HydrophobicContact CE2-CZ3 3.79Å; F135-W296 HydrophobicContact CE2-CH2 4.44Å; W296-K298 PolarHBondContact O-N 3.28Å; W296-G300 WeakPolarHBondContact O-CA 3.46Å; W296-G300 PolarHBondContact O-N 2.74Å; W296-P303 HydrophobicContact CE3-CB 4.07Å; W296-P303 HydrophobicContact CZ3-CB 4.36Å; W296-R304 HydrophobicContact CZ2-CB 4.35Å; W296-V305 HydrophobicContact CH2-CB 3.96Å; W296-V305 HydrophobicContact CH2-CG2 3.91Å; W296-V305 HydrophobicContact CZ2-CG2 4.45Å; W296-V305 HydrophobicContact CZ3-CB 4.38Å
297	E	75.1	Confident	79.5	Confident	90 Å²	90	56.1 Å²	56.1	42%	0.421	32%	0.319	S	S	.	.	H	α-helix	trans	-58.4	-34.7	175	-64.2	169.3	-177.4	0	0	112.6	T295	T295-E297 PolarHBondContact O-N 2.7Å
298	K	73.1	Confident	80.5	Confident	169 Å²	169	54.2 Å²	54.2	74%	0.735	31%	0.309	S	S	*	.	H	α-helix	trans	-94.5	-35.2	-179.9	-66.2	-173.1	178.8	-179	0	113.2	T295 W296	T295-K298 PolarHBondContact O-N 2.97Å; W296-K298 PolarHBondContact O-N 3.28Å
299	S	73.5	Confident	81.1	Confident	20 Å²	20	52.1 Å²	52.1	14%	0.14	29%	0.293	C	S	.	.	H	α-helix	trans	-76.6	-30.2	-179.6	67.5	0	0	0	0	111.7	T295 I301	T295-S299 PolarHBondContact O-N 3.41Å; S299-I301 PolarHBondContact O-N 3.11Å; S299-I301 PolarHBondContact OG-N 2.7Å
300	G	73.9	Confident	81.8	Confident	31 Å²	31	51 Å²	51	32%	0.32	29%	0.287	S	S	.	.			trans	70.8	6.2	-171	0	0	0	0	0	113.4	W296	W296-G300 WeakPolarHBondContact O-CA 3.46Å; W296-G300 PolarHBondContact O-N 2.74Å
301	I	74.8	Confident	82.6	Confident	25 Å²	25	50 Å²	50	13%	0.128	28%	0.28	C	S	.	.	S	Bend	trans	-98	129.9	-177.5	-52.6	178.5	0	0	0	108.5	T276 Y279 Y282 S299	T276-I301 HydrophobicContact CG2-CD1 3.51Å; T276-I301 HydrophobicContact CG2-CG1 3.78Å; T276-I301 HydrophobicContact CG2-CG2 4.23Å; Y279-I301 HydrophobicContact CD2-CD1 3.65Å; Y279-I301 HydrophobicContact CE2-CD1 3.42Å; Y279-I301 VanDerWaalsContact CE2-CD1 3.42Å; Y282-I301 HydrophobicContact CE2-CG2 4.34Å; S299-I301 PolarHBondContact O-N 3.11Å; S299-I301 PolarHBondContact OG-N 2.7Å
302	F	82.1	Confident	83	Confident	9 Å²	9	43.9 Å²	43.9	4%	0.039	25%	0.249	C	C	.	.	S	Bend	trans	50.2	61.5	-173.3	-55.1	-74.6	0	0	0	114.5	Y153 L274 Y282 R304 N330 N333 E334 F337	Y153-F302 HydrophobicContact CE2-CD1 4.05Å; Y153-F302 HydrophobicContact CE2-CE1 4.02Å; Y153-F302 AromaticContact CZ-CD1 3.91Å; Y153-F302 WeakPolarHBondContact OH-CD1 3.17Å; L274-F302 HydrophobicContact CD1-CZ 4.2Å; L274-F302 HydrophobicContact CD2-CE1 3.49Å; L274-F302 VanDerWaalsContact CD2-CE1 3.49Å; L274-F302 HydrophobicContact CD2-CE2 4.37Å; L274-F302 HydrophobicContact CD2-CZ 3.28Å; L274-F302 HydrophobicContact CG-CZ 4.35Å; Y282-F302 AromaticContact CE2-CE2 3.81Å; Y282-F302 HydrophobicContact CE2-CE2 3.81Å; Y282-F302 HydrophobicContact CE2-CZ 4.35Å; Y282-F302 AromaticContact CZ-CE2 3.88Å; Y282-F302 WeakPolarHBondContact OH-CE2 3.17Å; F302-R304 PolarHBondContact O-N 3.18Å; F302-N330 WeakPolarHBondContact CA-ND2 3.4Å; F302-N330 WeakPolarHBondContact CD1-OD1 3.32Å; F302-N333 HydrophobicContact CE1-CB 4.35Å; F302-E334 HydrophobicContact CB-CB 4.21Å; F302-E334 HydrophobicContact CB-CG 4.34Å; F302-E334 HydrophobicContact CD1-CB 4.47Å; F302-E334 HydrophobicContact CD2-CB 4.07Å; F302-E334 HydrophobicContact CD2-CG 3.88Å; F302-E334 HydrophobicContact CE2-CG 4.48Å; F302-E334 HydrophobicContact CG-CB 4.01Å; F302-E334 HydrophobicContact CG-CG 4.23Å; F302-F337 HydrophobicContact CE1-CD2 4.06Å; F302-F337 HydrophobicContact CZ-CB 4.22Å; F302-F337 HydrophobicContact CZ-CD2 4.09Å; F302-F337 HydrophobicContact CZ-CG 4.5Å
303	P	88.5	Confident	83.5	Confident	1 Å²	1	50.7 Å²	50.7	1%	0.006	26%	0.262	C	S	.	.			trans	-65.1	134.8	176.6	27.4	-31.9	0	0	0	110.8	F132 I151 W296 T306 N330	F132-P303 HydrophobicContact CB-CB 3.97Å; F132-P303 HydrophobicContact CB-CG 3.72Å; F132-P303 HydrophobicContact CD1-CB 4.41Å; F132-P303 HydrophobicContact CD2-CB 3.33Å; F132-P303 HydrophobicContact CD2-CG 4.08Å; F132-P303 HydrophobicContact CE2-CB 3.92Å; F132-P303 HydrophobicContact CG-CB 3.63Å; F132-P303 HydrophobicContact CG-CG 3.86Å; I151-P303 HydrophobicContact CD1-CG 3.23Å; W296-P303 HydrophobicContact CE3-CB 4.07Å; W296-P303 HydrophobicContact CZ3-CB 4.36Å; P303-T306 HydrophobicContact CB-CG2 4.39Å; P303-T306 HydrophobicContact CG-CG2 4.13Å; P303-N330 PolarHBondContact O-ND2 3.46Å
304	R	88.8	Confident	83.8	Confident	82 Å²	82	51.6 Å²	51.6	31%	0.309	26%	0.256	S	S	.	.	S	Bend	trans	-90.5	-17.5	178.6	-61.4	179.2	-173.7	169.1	4	112.1	W296 F302 V326 L327 E334	W296-R304 HydrophobicContact CZ2-CB 4.35Å; F302-R304 PolarHBondContact O-N 3.18Å; R304-V326 CarbonylContact O-C 3.57Å; R304-V326 WeakPolarHBondContact O-CA 3.23Å; R304-L327 PolarHBondContact O-N 2.93Å; R304-E334 IonicContact CZ-OE2 2.63Å; R304-E334 IonicContact NE-OE2 3.2Å; R304-E334 IonicContact NH2-OE1 3.4Å; R304-E334 IonicContact NH2-OE2 3.5Å; R304-E334 PolarHBondContact NH2-OE2 3.09Å
305	V	91.4	Very high	84.1	Confident	28 Å²	28	59.2 Å²	59.2	17%	0.17	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.5	176.8	179.9	0	0	0	0	107.5	F135 W296 Q324 C325	F135-V305 HydrophobicContact CZ-CG1 4.3Å; W296-V305 HydrophobicContact CH2-CB 3.96Å; W296-V305 HydrophobicContact CH2-CG2 3.91Å; W296-V305 HydrophobicContact CZ2-CG2 4.45Å; W296-V305 HydrophobicContact CZ3-CB 4.38Å; V305-Q324 HydrophobicContact CG1-CG 3.52Å; V305-Q324 VanDerWaalsContact CG1-NE2 3.27Å; V305-C325 WeakPolarHBondContact CA-O 3.44Å
306	T	92	Very high	84.3	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.012	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.3	177.7	58	0	0	0	0	110.3	T130 Y131 I151 P303 C325	T130-T306 VanDerWaalsContact CB-OG1 3.23Å; T130-T306 WeakPolarHBondContact CB-OG1 3.45Å; T130-T306 WeakPolarHBondContact OG1-CB 2.97Å; T130-T306 PolarHBondContact OG1-OG1 3.49Å; Y131-T306 WeakPolarHBondContact O-CA 3.26Å; Y131-T306 WeakPolarHBondContact O-CB 3.38Å; I151-T306 HydrophobicContact CD1-CG2 4.47Å; P303-T306 HydrophobicContact CB-CG2 4.39Å; P303-T306 HydrophobicContact CG-CG2 4.13Å; T306-C325 PolarHBondContact N-O 2.81Å; T306-C325 PolarHBondContact O-N 2.98Å
307	L	92.7	Very high	84.9	Confident	32 Å²	32	63.3 Å²	63.3	17%	0.168	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	142.6	172.8	-67.4	169.5	0	0	0	109.1	Y131 L133 V139 Q324	Y131-L307 HydrophobicContact CD1-CB 4.3Å; Y131-L307 WeakPolarHBondContact CD1-O 3.45Å; Y131-L307 HydrophobicContact CD2-CB 4.12Å; Y131-L307 HydrophobicContact CE1-CB 3.78Å; Y131-L307 WeakPolarHBondContact CE1-O 3.48Å; Y131-L307 HydrophobicContact CE2-CB 3.59Å; Y131-L307 HydrophobicContact CE2-CD1 3.69Å; Y131-L307 HydrophobicContact CE2-CG 4.28Å; Y131-L307 HydrophobicContact CG-CB 4.45Å; Y131-L307 PolarHBondContact N-O 2.97Å; Y131-L307 PolarHBondContact O-N 3.05Å; L133-L307 HydrophobicContact CB-CD1 4.24Å; V139-L307 HydrophobicContact CG2-CD1 4.03Å; L307-Q324 HydrophobicContact CD2-CB 4.23Å
308	C	93.1	Very high	85.6	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.5	175.3	172.8	0	0	0	0	109.6	C125 T130 S322 V323	C125-C308 WeakPolarHBondContact CA-SG 3.45Å; C125-C308 HydrophobicContact CB-CB 3.66Å; C125-C308 WeakPolarHBondContact CB-SG 3.31Å; C125-C308 WeakPolarHBondContact SG-CB 3.33Å; C125-C308 CovalentContact SG-SG 2.02Å; C125-C308 PolarHBondContact SG-SG 3.14Å; T130-C308 HydrophobicContact CG2-CB 4.12Å; C308-S322 CarbonylContact O-C 3.6Å; C308-S322 WeakPolarHBondContact O-CA 3.28Å; C308-V323 HydrophobicContact CB-CG2 4.07Å; C308-V323 PolarHBondContact N-O 3.29Å; C308-V323 PolarHBondContact O-N 3.09Å
309	D	91.4	Very high	86.3	Confident	27 Å²	27	58 Å²	58	14%	0.144	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.3	175.9	-61.7	-33.3	0	0	0	110	Y131 R146 R320 Y321 S322	Y131-D309 VanDerWaalsContact CE1-OD2 3.28Å; Y131-D309 WeakPolarHBondContact CE1-OD2 3.33Å; Y131-D309 PolarHBondContact OH-OD1 3.26Å; Y131-D309 VanDerWaalsContact OH-OD1 3.05Å; Y131-D309 PolarHBondContact OH-OD2 3.47Å; R146-D309 VanDerWaalsContact CD-OD2 3.28Å; R146-D309 WeakPolarHBondContact CD-OD2 3.27Å; R146-D309 IonicContact CZ-OD2 2.87Å; R146-D309 IonicContact NE-OD2 2.69Å; R146-D309 VanDerWaalsContact NH1-CG 3.28Å; R146-D309 IonicContact NH1-OD1 3.19Å; R146-D309 PolarHBondContact NH1-OD1 3.23Å; R146-D309 VanDerWaalsContact NH1-OD1 3.12Å; R146-D309 IonicContact NH1-OD2 3.38Å; R146-D309 PolarHBondContact NH1-OD2 2.98Å; D309-R320 HydrophobicContact CB-CG 4.46Å; D309-R320 IonicContact OD2-CZ 2.67Å; D309-R320 IonicContact OD2-NE 3.69Å; D309-R320 PolarHBondContact OD2-NE 3.32Å; D309-R320 IonicContact OD2-NH2 3.04Å; D309-R320 PolarHBondContact OD2-NH2 2.71Å; D309-Y321 WeakPolarHBondContact CA-O 3.36Å; D309-S322 VanDerWaalsContact OD1-CB 3.23Å; D309-S322 WeakPolarHBondContact OD1-CB 3.38Å; D309-S322 PolarHBondContact OD1-OG 3.29Å
310	F	89.8	Confident	87	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.4	172.1	65.5	-88.9	0	0	0	111	F113 A121 Y124 V312 Y321 V323	F113-F310 AromaticContact CE2-CE2 3.99Å; F113-F310 HydrophobicContact CE2-CE2 3.99Å; F113-F310 AromaticContact CE2-CZ 3.61Å; F113-F310 HydrophobicContact CE2-CZ 3.61Å; F113-F310 HydrophobicContact CZ-CE2 4.28Å; F113-F310 HydrophobicContact CZ-CZ 4.15Å; A121-F310 HydrophobicContact CB-CD1 4.49Å; A121-F310 HydrophobicContact CB-CE1 4.07Å; A121-F310 HydrophobicContact CB-CZ 4.39Å; Y124-F310 HydrophobicContact CD1-CB 3.35Å; Y124-F310 HydrophobicContact CD1-CG 4.46Å; Y124-F310 HydrophobicContact CE1-CB 3.3Å; Y124-F310 HydrophobicContact CG-CB 4.14Å; F310-V312 HydrophobicContact CD2-CG2 3.75Å; F310-V312 HydrophobicContact CE2-CG2 3.69Å; F310-Y321 AromaticContact CE2-CD2 3.91Å; F310-Y321 HydrophobicContact CE2-CD2 3.91Å; F310-Y321 HydrophobicContact CE2-CG 4.1Å; F310-Y321 VanDerWaalsContact CZ-CB 3.4Å; F310-Y321 HydrophobicContact CZ-CD2 4.31Å; F310-Y321 HydrophobicContact CZ-CG 4.03Å; F310-Y321 PolarHBondContact N-O 3.35Å; F310-Y321 PolarHBondContact O-N 3.46Å; F310-V323 HydrophobicContact CD1-CG2 4.11Å; F310-V323 HydrophobicContact CE1-CB 4.36Å; F310-V323 HydrophobicContact CE1-CG1 3.67Å; F310-V323 HydrophobicContact CE1-CG2 3.76Å; F310-V323 HydrophobicContact CZ-CG1 4.29Å
311	Q	89.3	Confident	87.7	Confident	102 Å²	102	62.3 Å²	62.3	48%	0.477	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	121.1	-176	-66.1	-178.7	8.2	0	0	109.9	V318 Q319 R320	Q311-V318 HydrophobicContact CB-CG1 3.8Å; Q311-V318 HydrophobicContact CG-CG1 4.19Å; Q311-Q319 WeakPolarHBondContact CA-O 3.4Å; Q311-R320 HydrophobicContact CG-CB 4.39Å; Q311-R320 HydrophobicContact CG-CG 4.41Å
312	V	88.5	Confident	88.5	Confident	18 Å²	18	64 Å²	64	11%	0.109	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	130.4	176.2	-176	0	0	0	0	108.8	W117 F310 V314 Q319 Y321	W117-V312 HydrophobicContact CH2-CG1 3.66Å; W117-V312 HydrophobicContact CH2-CG2 4.37Å; W117-V312 HydrophobicContact CZ3-CG1 3.94Å; W117-V312 HydrophobicContact CZ3-CG2 3.77Å; F310-V312 HydrophobicContact CD2-CG2 3.75Å; F310-V312 HydrophobicContact CE2-CG2 3.69Å; V312-V314 HydrophobicContact CG1-CG2 4.17Å; V312-Q319 PolarHBondContact N-O 3.13Å; V312-Q319 PolarHBondContact O-N 2.98Å; V312-Y321 HydrophobicContact CB-CE2 4.37Å; V312-Y321 HydrophobicContact CG2-CD2 4.11Å; V312-Y321 HydrophobicContact CG2-CE2 4.27Å
313	R	89.3	Confident	89	Confident	224 Å²	224	63.9 Å²	63.9	85%	0.845	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	117.8	174.8	-65.8	-174.3	178.4	-179.5	0.1	109.5	V318	R313-V318 HydrophobicContact CG-CG2 4.34Å
314	V	85.8	Confident	89.2	Confident	79 Å²	79	67.5 Å²	67.5	48%	0.479	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	113.5	172.1	-175.2	0	0	0	0	107.1	V312 G316 N317	V312-V314 HydrophobicContact CG1-CG2 4.17Å; V314-G316 PolarHBondContact O-N 2.89Å; V314-G316 VanDerWaalsContact O-N 3.1Å; V314-N317 PolarHBondContact N-O 3.43Å; V314-N317 PolarHBondContact O-N 3.41Å
315	M	78.8	Confident	89.5	Confident	197 Å²	197	63.6 Å²	63.6	97%	0.97	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	4.5	86.7	-177.7	-63.5	-60.5	179.4	0	0	115.6
316	G	82.3	Confident	89.6	Confident	95 Å²	95	65.5 Å²	65.5	98%	0.979	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	-13.3	174.7	0	0	0	0	0	116.2	V314	V314-G316 PolarHBondContact O-N 2.89Å; V314-G316 VanDerWaalsContact O-N 3.1Å
317	N	89.6	Confident	89.5	Confident	97 Å²	97	65.5 Å²	65.5	52%	0.519	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.4	177.7	-164.9	17.5	0	0	0	111.9	V314	V314-N317 PolarHBondContact N-O 3.43Å; V314-N317 PolarHBondContact O-N 3.41Å
318	V	88.8	Confident	89.3	Confident	73 Å²	73	66.5 Å²	66.5	44%	0.442	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.3	174.3	-176.5	0	0	0	0	107.7	Q311 R313	Q311-V318 HydrophobicContact CB-CG1 3.8Å; Q311-V318 HydrophobicContact CG-CG1 4.19Å; R313-V318 HydrophobicContact CG-CG2 4.34Å
319	Q	87.8	Confident	89	Confident	76 Å²	76	66.5 Å²	66.5	36%	0.355	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	126.8	176.1	-68.2	-177.8	-19.9	0	0	109.4	Q311 V312 Y321	Q311-Q319 WeakPolarHBondContact CA-O 3.4Å; V312-Q319 PolarHBondContact N-O 3.13Å; V312-Q319 PolarHBondContact O-N 2.98Å; Q319-Y321 HydrophobicContact CB-CE2 3.84Å; Q319-Y321 PolarHBondContact OE1-OH 3.49Å
320	R	87.9	Confident	88.9	Confident	84 Å²	84	65.2 Å²	65.2	32%	0.317	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.6	174.8	-176.3	-176.3	-174.6	160.6	6.9	109.2	D309 Q311	D309-R320 HydrophobicContact CB-CG 4.46Å; D309-R320 IonicContact OD2-CZ 2.67Å; D309-R320 IonicContact OD2-NE 3.69Å; D309-R320 PolarHBondContact OD2-NE 3.32Å; D309-R320 IonicContact OD2-NH2 3.04Å; D309-R320 PolarHBondContact OD2-NH2 2.71Å; Q311-R320 HydrophobicContact CG-CB 4.39Å; Q311-R320 HydrophobicContact CG-CG 4.41Å
321	Y	90	Very high	88.8	Confident	57 Å²	57	68.5 Å²	68.5	22%	0.224	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	136.5	171.8	-67.3	-85.5	0	0	0	108.8	F113 D309 F310 V312 Q319	F113-Y321 HydrophobicContact CZ-CD1 4.38Å; F113-Y321 HydrophobicContact CZ-CD2 4.41Å; F113-Y321 HydrophobicContact CZ-CE1 4.39Å; F113-Y321 HydrophobicContact CZ-CE2 4.45Å; F113-Y321 HydrophobicContact CZ-CG 4.39Å; D309-Y321 WeakPolarHBondContact CA-O 3.36Å; F310-Y321 AromaticContact CE2-CD2 3.91Å; F310-Y321 HydrophobicContact CE2-CD2 3.91Å; F310-Y321 HydrophobicContact CE2-CG 4.1Å; F310-Y321 VanDerWaalsContact CZ-CB 3.4Å; F310-Y321 HydrophobicContact CZ-CD2 4.31Å; F310-Y321 HydrophobicContact CZ-CG 4.03Å; F310-Y321 PolarHBondContact N-O 3.35Å; F310-Y321 PolarHBondContact O-N 3.46Å; V312-Y321 HydrophobicContact CB-CE2 4.37Å; V312-Y321 HydrophobicContact CG2-CD2 4.11Å; V312-Y321 HydrophobicContact CG2-CE2 4.27Å; Q319-Y321 HydrophobicContact CB-CE2 3.84Å; Q319-Y321 PolarHBondContact OE1-OH 3.49Å
322	S	90.8	Very high	88.6	Confident	61 Å²	61	67.8 Å²	67.8	43%	0.427	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.6	172.2	-66.4	0	0	0	0	107.6	R146 C308 D309	R146-S322 PolarHBondContact NH1-OG 2.77Å; R146-S322 VanDerWaalsContact NH1-OG 3.16Å; C308-S322 CarbonylContact O-C 3.6Å; C308-S322 WeakPolarHBondContact O-CA 3.28Å; D309-S322 VanDerWaalsContact OD1-CB 3.23Å; D309-S322 WeakPolarHBondContact OD1-CB 3.38Å; D309-S322 PolarHBondContact OD1-OG 3.29Å
323	V	92.3	Very high	88.7	Confident	6 Å²	6	67 Å²	67	4%	0.036	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	147.9	179.6	-68	0	0	0	0	110.4	C107 V109 C308 F310	C107-V323 HydrophobicContact CB-CG2 4.48Å; V109-V323 HydrophobicContact CG1-CG1 4.34Å; C308-V323 HydrophobicContact CB-CG2 4.07Å; C308-V323 PolarHBondContact N-O 3.29Å; C308-V323 PolarHBondContact O-N 3.09Å; F310-V323 HydrophobicContact CD1-CG2 4.11Å; F310-V323 HydrophobicContact CE1-CB 4.36Å; F310-V323 HydrophobicContact CE1-CG1 3.67Å; F310-V323 HydrophobicContact CE1-CG2 3.76Å; F310-V323 HydrophobicContact CZ-CG1 4.29Å
324	Q	93.7	Very high	88.5	Confident	76 Å²	76	58 Å²	58	36%	0.355	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.1	175.9	-178.3	177	-30.1	0	0	109.1	M108 V305 L307	M108-Q324 PolarHBondContact N-O 3.12Å; V305-Q324 HydrophobicContact CG1-CG 3.52Å; V305-Q324 VanDerWaalsContact CG1-NE2 3.27Å; L307-Q324 HydrophobicContact CD2-CB 4.23Å
325	C	94.4	Very high	88.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	142.5	-177.9	-56.6	0	0	0	0	111.4	I105 E106 C107 V305 T306	I105-C325 HydrophobicContact CD1-CB 3.58Å; I105-C325 HydrophobicContact CG1-CB 3.66Å; E106-C325 CarbonylContact O-C 3.56Å; E106-C325 VanDerWaalsContact O-CA 3.26Å; E106-C325 WeakPolarHBondContact O-CA 3.46Å; C107-C325 HydrophobicContact CB-CB 4.11Å; C107-C325 WeakPolarHBondContact CB-SG 3.28Å; C107-C325 WeakPolarHBondContact SG-CB 3.09Å; C107-C325 CovalentContact SG-SG 2.05Å; C107-C325 PolarHBondContact SG-SG 3.23Å; V305-C325 WeakPolarHBondContact CA-O 3.44Å; T306-C325 PolarHBondContact N-O 2.81Å; T306-C325 PolarHBondContact O-N 2.98Å
326	V	92.7	Very high	89.1	Confident	69 Å²	69	51 Å²	51	42%	0.418	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	117.6	174.2	-179.1	0	0	0	0	108.6	E106 R304 V328	E106-V326 PolarHBondContact N-O 2.87Å; E106-V326 PolarHBondContact O-N 3.39Å; R304-V326 CarbonylContact O-C 3.57Å; R304-V326 WeakPolarHBondContact O-CA 3.23Å; V326-V328 HydrophobicContact CG1-CG2 4.23Å; V326-V328 PolarHBondContact O-N 2.82Å
327	L	90.8	Very high	89.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.233	C	C	.	.			trans	-91.9	81.6	-178.4	-168.4	67.4	0	0	0	110.2	I105 W126 Y154 R304 I329 N330	I105-L327 HydrophobicContact CB-CD1 4.44Å; I105-L327 HydrophobicContact CD1-CD1 4.39Å; I105-L327 HydrophobicContact CG1-CD1 4.44Å; W126-L327 HydrophobicContact CZ3-CD1 4.22Å; Y154-L327 HydrophobicContact CD1-CD1 4.49Å; Y154-L327 HydrophobicContact CD1-CD2 3.47Å; Y154-L327 VanDerWaalsContact CD1-CD2 3.47Å; Y154-L327 HydrophobicContact CD2-CD1 4.15Å; Y154-L327 HydrophobicContact CD2-CD2 4.49Å; Y154-L327 HydrophobicContact CE1-CD1 4.41Å; Y154-L327 HydrophobicContact CE1-CD2 3.69Å; Y154-L327 HydrophobicContact CE2-CD1 4.09Å; Y154-L327 HydrophobicContact CG-CD1 4.36Å; Y154-L327 HydrophobicContact CG-CD2 3.91Å; R304-L327 PolarHBondContact O-N 2.93Å; L327-I329 HydrophobicContact CD1-CG2 3.77Å; L327-I329 HydrophobicContact CD2-CG2 4.48Å; L327-I329 HydrophobicContact CG-CG2 3.83Å; L327-I329 PolarHBondContact O-N 3.23Å; L327-N330 HydrophobicContact CB-CB 4.44Å; L327-N330 HydrophobicContact CD2-CB 3.9Å; L327-N330 HydrophobicContact CG-CB 4.08Å; L327-N330 WeakPolarHBondContact O-CB 3.32Å; L327-N330 PolarHBondContact O-N 3.31Å; L327-N330 VanDerWaalsContact O-N 3.09Å
328	V	88.5	Confident	89.2	Confident	52 Å²	52	43.5 Å²	43.5	32%	0.315	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.3	-175.5	-177.7	0	0	0	0	112	P104 V326 N330 I331	P104-V328 PolarHBondContact O-N 3.46Å; V326-V328 HydrophobicContact CG1-CG2 4.23Å; V326-V328 PolarHBondContact O-N 2.82Å; V328-N330 PolarHBondContact O-N 3.49Å; V328-I331 WeakPolarHBondContact O-CG2 3.49Å
329	I	87.3	Confident	89.3	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-25.4	179.2	-165.8	165.1	0	0	0	113	V95 Q99 W126 L327 I331 F332 N333	V95-I329 HydrophobicContact CG1-CD1 4.21Å; Q99-I329 HydrophobicContact CB-CD1 4.09Å; Q99-I329 HydrophobicContact CG-CD1 4.37Å; W126-I329 HydrophobicContact CH2-CD1 4.43Å; W126-I329 HydrophobicContact CZ3-CG2 4.39Å; L327-I329 HydrophobicContact CD1-CG2 3.77Å; L327-I329 HydrophobicContact CD2-CG2 4.48Å; L327-I329 HydrophobicContact CG-CG2 3.83Å; L327-I329 PolarHBondContact O-N 3.23Å; I329-I331 VanDerWaalsContact C-N 3.33Å; I329-I331 PolarHBondContact O-N 3.31Å; I329-F332 PolarHBondContact O-N 2.92Å; I329-N333 PolarHBondContact O-N 3.41Å
330	N	88.7	Confident	89.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-72.4	-27.2	-171.6	-140.9	18.9	0	0	0	113.7	Y153 F302 P303 L327 V328 F332 N333 E334	Y153-N330 PolarHBondContact OH-ND2 3.3Å; Y153-N330 VanDerWaalsContact OH-ND2 3.08Å; Y153-N330 PolarHBondContact OH-OD1 2.93Å; F302-N330 WeakPolarHBondContact CA-ND2 3.4Å; F302-N330 WeakPolarHBondContact CD1-OD1 3.32Å; P303-N330 PolarHBondContact O-ND2 3.46Å; L327-N330 HydrophobicContact CB-CB 4.44Å; L327-N330 HydrophobicContact CD2-CB 3.9Å; L327-N330 HydrophobicContact CG-CB 4.08Å; L327-N330 WeakPolarHBondContact O-CB 3.32Å; L327-N330 PolarHBondContact O-N 3.31Å; L327-N330 VanDerWaalsContact O-N 3.09Å; V328-N330 PolarHBondContact O-N 3.49Å; N330-F332 VanDerWaalsContact C-N 3.26Å; N330-F332 PolarHBondContact O-N 3.4Å; N330-N333 PolarHBondContact O-N 2.96Å; N330-E334 WeakPolarHBondContact O-CB 3.35Å; N330-E334 PolarHBondContact O-N 3.07Å
331	I	86.6	Confident	89.6	Confident	68 Å²	68	38.1 Å²	38.1	35%	0.349	19%	0.19	S	C	.	.	H	α-helix	trans	-62.5	-36.7	173.9	-162.8	175.3	0	0	0	111.4	V328 I329 K335	V328-I331 WeakPolarHBondContact O-CG2 3.49Å; I329-I331 VanDerWaalsContact C-N 3.33Å; I329-I331 PolarHBondContact O-N 3.31Å; I331-K335 WeakPolarHBondContact O-CG 3.35Å; I331-K335 PolarHBondContact O-N 3.18Å
332	F	86.8	Confident	89.7	Confident	88 Å²	88	40 Å²	40	39%	0.386	20%	0.2	S	C	.	.	H	α-helix	trans	-73.5	-44.6	177.8	-68.1	-82.6	0	0	0	110.5	K98 I329 N330 E334 K335 I336	K98-F332 HydrophobicContact CD-CE2 4.2Å; K98-F332 HydrophobicContact CG-CD2 4.3Å; K98-F332 HydrophobicContact CG-CE2 4.26Å; I329-F332 PolarHBondContact O-N 2.92Å; N330-F332 VanDerWaalsContact C-N 3.26Å; N330-F332 PolarHBondContact O-N 3.4Å; F332-E334 VanDerWaalsContact C-N 3.34Å; F332-E334 PolarHBondContact O-N 3.46Å; F332-K335 PolarHBondContact O-N 2.81Å; F332-I336 WeakPolarHBondContact O-CB 3.01Å; F332-I336 VanDerWaalsContact O-CG1 3.27Å; F332-I336 WeakPolarHBondContact O-CG1 3.26Å; F332-I336 PolarHBondContact O-N 3.38Å
333	N	89.1	Confident	89.8	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.4	-45.3	177.7	-69.7	-20.2	0	0	0	111.8	F302 I329 N330 K335 I336 F337	F302-N333 HydrophobicContact CE1-CB 4.35Å; I329-N333 PolarHBondContact O-N 3.41Å; N330-N333 PolarHBondContact O-N 2.96Å; N333-K335 VanDerWaalsContact C-N 3.31Å; N333-K335 PolarHBondContact O-N 3.41Å; N333-I336 PolarHBondContact O-N 2.91Å; N333-F337 HydrophobicContact CB-CD2 4.25Å; N333-F337 HydrophobicContact CB-CE2 4.3Å; N333-F337 WeakPolarHBondContact O-CD2 3.3Å; N333-F337 PolarHBondContact O-N 2.91Å
334	E	86.4	Confident	89.9	Confident	35 Å²	35	40.1 Å²	40.1	16%	0.164	19%	0.19	C	C	.	.	H	α-helix	trans	-51.5	-50.1	175.4	-171.4	-157.2	128.2	0	0	110.9	F302 R304 N330 F332 V338	F302-E334 HydrophobicContact CB-CB 4.21Å; F302-E334 HydrophobicContact CB-CG 4.34Å; F302-E334 HydrophobicContact CD1-CB 4.47Å; F302-E334 HydrophobicContact CD2-CB 4.07Å; F302-E334 HydrophobicContact CD2-CG 3.88Å; F302-E334 HydrophobicContact CE2-CG 4.48Å; F302-E334 HydrophobicContact CG-CB 4.01Å; F302-E334 HydrophobicContact CG-CG 4.23Å; R304-E334 IonicContact CZ-OE2 2.63Å; R304-E334 IonicContact NE-OE2 3.2Å; R304-E334 IonicContact NH2-OE1 3.4Å; R304-E334 IonicContact NH2-OE2 3.5Å; R304-E334 PolarHBondContact NH2-OE2 3.09Å; N330-E334 WeakPolarHBondContact O-CB 3.35Å; N330-E334 PolarHBondContact O-N 3.07Å; F332-E334 VanDerWaalsContact C-N 3.34Å; F332-E334 PolarHBondContact O-N 3.46Å; E334-V338 WeakPolarHBondContact O-CB 3.31Å; E334-V338 WeakPolarHBondContact O-CG2 3.2Å; E334-V338 PolarHBondContact O-N 2.99Å; E334-V338 VanDerWaalsContact O-N 3.14Å
335	K	85.9	Confident	89.8	Confident	114 Å²	114	38.8 Å²	38.8	50%	0.496	19%	0.187	S	C	.	.	H	α-helix	trans	-70.3	-39.8	-178.6	-59.2	-46.3	179.1	-161.1	0	113	I331 F332 N333 F339	I331-K335 WeakPolarHBondContact O-CG 3.35Å; I331-K335 PolarHBondContact O-N 3.18Å; F332-K335 PolarHBondContact O-N 2.81Å; N333-K335 VanDerWaalsContact C-N 3.31Å; N333-K335 PolarHBondContact O-N 3.41Å; K335-F339 WeakPolarHBondContact O-CB 3.02Å; K335-F339 PolarHBondContact O-N 3.46Å
336	I	89.9	Confident	89.8	Confident	15 Å²	15	41 Å²	41	8%	0.077	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-49.5	178.9	-69.9	169.8	0	0	0	110.4	L91 V95 F332 N333 V338 F339 L340	L91-I336 HydrophobicContact CD1-CG2 4.2Å; L91-I336 HydrophobicContact CD2-CD1 4.47Å; L91-I336 HydrophobicContact CD2-CG1 4.24Å; L91-I336 HydrophobicContact CD2-CG2 4.42Å; V95-I336 HydrophobicContact CG2-CD1 3.34Å; F332-I336 WeakPolarHBondContact O-CB 3.01Å; F332-I336 VanDerWaalsContact O-CG1 3.27Å; F332-I336 WeakPolarHBondContact O-CG1 3.26Å; F332-I336 PolarHBondContact O-N 3.38Å; N333-I336 PolarHBondContact O-N 2.91Å; I336-V338 PolarHBondContact O-N 3.16Å; I336-F339 PolarHBondContact O-N 3.06Å; I336-L340 HydrophobicContact CG2-CD1 3.79Å; I336-L340 HydrophobicContact CG2-CG 4.27Å; I336-L340 WeakPolarHBondContact O-CB 3.4Å; I336-L340 WeakPolarHBondContact O-CG 3.48Å; I336-L340 PolarHBondContact O-N 3.01Å
337	F	89.9	Confident	89.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-69.3	-33.2	-178	-76.6	-64.8	0	0	0	113	V157 F160 M270 F273 L274 F302 N333 L340 W341	V157-F337 HydrophobicContact CG1-CE2 4.11Å; V157-F337 HydrophobicContact CG1-CZ 4.06Å; V157-F337 HydrophobicContact CG2-CE2 4Å; V157-F337 HydrophobicContact CG2-CZ 4.22Å; F160-F337 HydrophobicContact CD1-CE1 4.28Å; F160-F337 HydrophobicContact CD1-CZ 4.39Å; F160-F337 HydrophobicContact CE1-CE1 4.06Å; M270-F337 HydrophobicContact CG-CD1 3.98Å; M270-F337 HydrophobicContact CG-CE1 4.37Å; M270-F337 HydrophobicContact SD-CD1 4.05Å; F273-F337 HydrophobicContact CD1-CZ 4.09Å; F273-F337 HydrophobicContact CE1-CE2 4.48Å; F273-F337 AromaticContact CE1-CZ 3.91Å; F273-F337 HydrophobicContact CE1-CZ 3.91Å; L274-F337 HydrophobicContact CD1-CB 4.29Å; L274-F337 HydrophobicContact CD1-CD1 4.39Å; L274-F337 HydrophobicContact CD1-CG 4.26Å; L274-F337 HydrophobicContact CD2-CD2 3.99Å; L274-F337 HydrophobicContact CD2-CE2 4.2Å; L274-F337 HydrophobicContact CD2-CG 4.28Å; F302-F337 HydrophobicContact CE1-CD2 4.06Å; F302-F337 HydrophobicContact CZ-CB 4.22Å; F302-F337 HydrophobicContact CZ-CD2 4.09Å; F302-F337 HydrophobicContact CZ-CG 4.5Å; N333-F337 HydrophobicContact CB-CD2 4.25Å; N333-F337 HydrophobicContact CB-CE2 4.3Å; N333-F337 WeakPolarHBondContact O-CD2 3.3Å; N333-F337 PolarHBondContact O-N 2.91Å; F337-L340 HydrophobicContact CD1-CD1 4.5Å; F337-W341 WeakPolarHBondContact O-CB 2.93Å; F337-W341 PolarHBondContact O-N 3.32Å
338	V	86.2	Confident	90.1	Very high	36 Å²	36	41.1 Å²	41.1	22%	0.218	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-47.5	171.3	170.1	0	0	0	0	110.7	E334 I336 W341 F342	E334-V338 WeakPolarHBondContact O-CB 3.31Å; E334-V338 WeakPolarHBondContact O-CG2 3.2Å; E334-V338 PolarHBondContact O-N 2.99Å; E334-V338 VanDerWaalsContact O-N 3.14Å; I336-V338 PolarHBondContact O-N 3.16Å; V338-W341 PolarHBondContact O-N 3.33Å; V338-F342 HydrophobicContact CG1-CD2 4.1Å; V338-F342 HydrophobicContact CG1-CE2 3.76Å; V338-F342 WeakPolarHBondContact O-CD2 3.19Å; V338-F342 PolarHBondContact O-N 3.33Å
339	F	90	Very high	90.4	Very high	99 Å²	99	43.5 Å²	43.5	43%	0.434	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-46.3	177.2	170	-102.3	0	0	0	112.4	L87 K335 I336 W341 F342 W343	L87-F339 HydrophobicContact CD1-CE1 4.06Å; L87-F339 HydrophobicContact CD2-CE1 3.84Å; L87-F339 HydrophobicContact CD2-CZ 4.26Å; L87-F339 HydrophobicContact CG-CE1 4.38Å; K335-F339 WeakPolarHBondContact O-CB 3.02Å; K335-F339 PolarHBondContact O-N 3.46Å; I336-F339 PolarHBondContact O-N 3.06Å; F339-W341 VanDerWaalsContact C-N 3.3Å; F339-W341 PolarHBondContact O-N 3.01Å; F339-F342 PolarHBondContact O-N 3.05Å; F339-W343 PolarHBondContact O-N 3.31Å
340	L	91.9	Very high	90.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61.8	-36.8	177.7	-74.2	176.7	0	0	0	112.3	L88 L91 L161 M270 I336 F337 W343 Y344	L88-L340 HydrophobicContact CD2-CD1 4.05Å; L88-L340 HydrophobicContact CD2-CD2 3.77Å; L91-L340 HydrophobicContact CD1-CD1 4.31Å; L91-L340 HydrophobicContact CD1-CD2 3.79Å; L91-L340 HydrophobicContact CD1-CG 4.15Å; L161-L340 HydrophobicContact CD2-CD1 3.63Å; M270-L340 HydrophobicContact SD-CB 4.5Å; I336-L340 HydrophobicContact CG2-CD1 3.79Å; I336-L340 HydrophobicContact CG2-CG 4.27Å; I336-L340 WeakPolarHBondContact O-CB 3.4Å; I336-L340 WeakPolarHBondContact O-CG 3.48Å; I336-L340 PolarHBondContact O-N 3.01Å; F337-L340 HydrophobicContact CD1-CD1 4.5Å; L340-W343 PolarHBondContact O-N 2.88Å; L340-Y344 HydrophobicContact CB-CE2 4.48Å; L340-Y344 WeakPolarHBondContact O-CB 3.4Å; L340-Y344 VanDerWaalsContact O-CG 3.27Å; L340-Y344 PolarHBondContact O-N 2.87Å
341	W	90.7	Very high	91.1	Very high	20 Å²	20	47 Å²	47	8%	0.076	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-48.9	176	-175.3	91.5	0	0	0	111.9	M270 F284 I287 F337 V338 F339 W343 Y344 V345	M270-W341 HydrophobicContact CE-CB 3.82Å; M270-W341 VanDerWaalsContact CE-CD1 3.44Å; M270-W341 HydrophobicContact CE-CG 4.01Å; M270-W341 HydrophobicContact SD-CB 4.47Å; F284-W341 HydrophobicContact CD2-CZ2 4.14Å; F284-W341 HydrophobicContact CE1-CH2 4.42Å; F284-W341 HydrophobicContact CE2-CH2 4.46Å; F284-W341 HydrophobicContact CE2-CZ2 4.15Å; F284-W341 HydrophobicContact CG-CZ2 4.49Å; F284-W341 HydrophobicContact CZ-CH2 4.38Å; I287-W341 HydrophobicContact CD1-CE3 4.29Å; I287-W341 HydrophobicContact CD1-CH2 3.97Å; I287-W341 HydrophobicContact CD1-CZ3 3.55Å; F337-W341 WeakPolarHBondContact O-CB 2.93Å; F337-W341 PolarHBondContact O-N 3.32Å; V338-W341 PolarHBondContact O-N 3.33Å; F339-W341 VanDerWaalsContact C-N 3.3Å; F339-W341 PolarHBondContact O-N 3.01Å; W341-W343 VanDerWaalsContact C-N 3.32Å; W341-W343 PolarHBondContact O-N 2.67Å; W341-Y344 PolarHBondContact O-N 3.22Å; W341-V345 HydrophobicContact CD2-CG2 4Å; W341-V345 HydrophobicContact CE3-CG2 4.21Å; W341-V345 HydrophobicContact CH2-CG2 4.03Å; W341-V345 HydrophobicContact CZ2-CG2 3.79Å; W341-V345 HydrophobicContact CZ3-CG2 4.21Å; W341-V345 WeakPolarHBondContact O-CG2 3.42Å; W341-V345 PolarHBondContact O-N 3.43Å
342	F	90.4	Very high	91.6	Very high	98 Å²	98	46.3 Å²	46.3	43%	0.43	23%	0.228	S	C	.	.	H	α-helix	trans	-62.4	-40.6	176.4	-73.7	-68.8	0	0	0	112	I287 V338 F339 V345 A346	I287-F342 HydrophobicContact CD1-CE1 3.66Å; I287-F342 HydrophobicContact CD1-CZ 3.47Å; I287-F342 VanDerWaalsContact CD1-CZ 3.47Å; I287-F342 HydrophobicContact CG1-CZ 3.85Å; V338-F342 HydrophobicContact CG1-CD2 4.1Å; V338-F342 HydrophobicContact CG1-CE2 3.76Å; V338-F342 WeakPolarHBondContact O-CD2 3.19Å; V338-F342 PolarHBondContact O-N 3.33Å; F339-F342 PolarHBondContact O-N 3.05Å; F342-V345 PolarHBondContact O-N 3.2Å; F342-A346 WeakPolarHBondContact O-CB 3.39Å; F342-A346 PolarHBondContact O-N 3.34Å
343	W	93.4	Very high	92	Very high	69 Å²	69	48.1 Å²	48.1	26%	0.261	24%	0.241	S	C	.	.	H	α-helix	trans	-60.7	-47.9	176.4	-177.1	-97.8	0	0	0	111.9	V83 T84 L87 F339 L340 W341 V345 A346 L347	V83-W343 HydrophobicContact CG1-CH2 3.91Å; V83-W343 HydrophobicContact CG1-CZ2 3.72Å; T84-W343 PolarHBondContact OG1-NE1 3.18Å; L87-W343 HydrophobicContact CD2-CD2 4.06Å; L87-W343 HydrophobicContact CD2-CG 4.19Å; L87-W343 HydrophobicContact CD2-CZ2 4.49Å; F339-W343 PolarHBondContact O-N 3.31Å; L340-W343 PolarHBondContact O-N 2.88Å; W341-W343 VanDerWaalsContact C-N 3.32Å; W341-W343 PolarHBondContact O-N 2.67Å; W343-V345 PolarHBondContact O-N 2.99Å; W343-A346 PolarHBondContact O-N 2.73Å; W343-L347 WeakPolarHBondContact O-CB 3.41Å; W343-L347 PolarHBondContact O-N 2.66Å
344	Y	93.9	Very high	92.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.1	-36.1	178.7	-68.7	-17.7	0	0	0	113	T84 L88 E164 F168 Q266 L267 M270 L340 W341 L347 F348	T84-Y344 HydrophobicContact CG2-CE1 3.83Å; L88-Y344 WeakPolarHBondContact CD1-OH 3.38Å; L88-Y344 VanDerWaalsContact CD2-OH 3.27Å; L88-Y344 WeakPolarHBondContact CD2-OH 3.41Å; E164-Y344 PolarHBondContact OE2-OH 2.91Å; F168-Y344 HydrophobicContact CE2-CD1 4.43Å; F168-Y344 AromaticContact CE2-CE1 3.58Å; F168-Y344 HydrophobicContact CE2-CE1 3.58Å; F168-Y344 AromaticContact CE2-CZ 3.81Å; F168-Y344 HydrophobicContact CZ-CD1 4.01Å; F168-Y344 AromaticContact CZ-CE1 3.6Å; F168-Y344 HydrophobicContact CZ-CE1 3.6Å; Q266-Y344 HydrophobicContact CB-CE2 4.2Å; L267-Y344 HydrophobicContact CD2-CD2 4.35Å; L267-Y344 HydrophobicContact CD2-CG 4.48Å; M270-Y344 HydrophobicContact CE-CD2 4.26Å; M270-Y344 HydrophobicContact SD-CD2 4.33Å; M270-Y344 HydrophobicContact SD-CE2 4.38Å; L340-Y344 HydrophobicContact CB-CE2 4.48Å; L340-Y344 WeakPolarHBondContact O-CB 3.4Å; L340-Y344 VanDerWaalsContact O-CG 3.27Å; L340-Y344 PolarHBondContact O-N 2.87Å; W341-Y344 PolarHBondContact O-N 3.22Å; Y344-L347 PolarHBondContact O-N 3.02Å; Y344-F348 VanDerWaalsContact O-CB 3.31Å; Y344-F348 WeakPolarHBondContact O-CB 3.19Å; Y344-F348 PolarHBondContact O-N 2.97Å
345	V	92.5	Very high	92.6	Very high	47 Å²	47	48.1 Å²	48.1	29%	0.285	24%	0.244	S	C	.	.	H	α-helix	trans	-65.7	-46.4	173.6	171.9	0	0	0	0	111.1	L267 W341 F342 W343 L347 F348 L349	L267-V345 HydrophobicContact CD2-CG2 4.42Å; W341-V345 HydrophobicContact CD2-CG2 4Å; W341-V345 HydrophobicContact CE3-CG2 4.21Å; W341-V345 HydrophobicContact CH2-CG2 4.03Å; W341-V345 HydrophobicContact CZ2-CG2 3.79Å; W341-V345 HydrophobicContact CZ3-CG2 4.21Å; W341-V345 WeakPolarHBondContact O-CG2 3.42Å; W341-V345 PolarHBondContact O-N 3.43Å; F342-V345 PolarHBondContact O-N 3.2Å; W343-V345 PolarHBondContact O-N 2.99Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.39Å; V345-F348 WeakPolarHBondContact O-CB 3.42Å; V345-F348 PolarHBondContact O-N 3.13Å; V345-L349 WeakPolarHBondContact O-CG 3.34Å; V345-L349 PolarHBondContact O-N 3.44Å; V345-L349 VanDerWaalsContact O-N 3.09Å
346	A	93.3	Very high	93	Very high	46 Å²	46	45.6 Å²	45.6	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-42.5	176.4	0	0	0	0	0	111.4	F342 W343 L349 I350	F342-A346 WeakPolarHBondContact O-CB 3.39Å; F342-A346 PolarHBondContact O-N 3.34Å; W343-A346 PolarHBondContact O-N 2.73Å; A346-L349 PolarHBondContact O-N 3.44Å; A346-I350 WeakPolarHBondContact O-CG1 3.29Å; A346-I350 PolarHBondContact O-N 3.18Å
347	L	95.1	Very high	93.2	Very high	5 Å²	5	50 Å²	50	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-69.7	-33.4	179.4	-172.3	149.9	0	0	0	112.3	N80 T84 F168 V263 W343 Y344 V345 I350 T351	N80-L347 VanDerWaalsContact OD1-CD2 3.26Å; N80-L347 WeakPolarHBondContact OD1-CD2 3.47Å; T84-L347 HydrophobicContact CG2-CD1 4.39Å; T84-L347 WeakPolarHBondContact OG1-CD1 3.3Å; F168-L347 HydrophobicContact CE1-CD2 4.19Å; V263-L347 HydrophobicContact CB-CD2 4.23Å; V263-L347 HydrophobicContact CG1-CD2 3.97Å; V263-L347 HydrophobicContact CG2-CD2 3.16Å; W343-L347 WeakPolarHBondContact O-CB 3.41Å; W343-L347 PolarHBondContact O-N 2.66Å; Y344-L347 PolarHBondContact O-N 3.02Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 3.39Å; L347-I350 PolarHBondContact O-N 3.42Å; L347-T351 HydrophobicContact CD2-CG2 4.16Å; L347-T351 WeakPolarHBondContact O-CB 3.35Å; L347-T351 VanDerWaalsContact O-CG2 3.27Å; L347-T351 WeakPolarHBondContact O-CG2 3.48Å; L347-T351 PolarHBondContact O-N 2.94Å; L347-T351 PolarHBondContact O-OG1 3.39Å
348	F	95.4	Very high	93.3	Very high	69 Å²	69	50.2 Å²	50.2	30%	0.303	26%	0.261	S	S	.	.	H	α-helix	trans	-59.9	-47.7	169.2	175.1	-101.3	0	0	0	111.4	L260 V263 C264 L267 Y344 V345 I350 T351 V352	L260-F348 HydrophobicContact CD1-CD2 3.81Å; L260-F348 HydrophobicContact CD1-CE2 3.61Å; V263-F348 HydrophobicContact CG1-CB 3.74Å; V263-F348 HydrophobicContact CG1-CD2 4.29Å; C264-F348 VanDerWaalsContact SG-CE2 3.54Å; L267-F348 HydrophobicContact CD1-CB 4.46Å; Y344-F348 VanDerWaalsContact O-CB 3.31Å; Y344-F348 WeakPolarHBondContact O-CB 3.19Å; Y344-F348 PolarHBondContact O-N 2.97Å; V345-F348 WeakPolarHBondContact O-CB 3.42Å; V345-F348 PolarHBondContact O-N 3.13Å; F348-I350 PolarHBondContact O-N 3.2Å; F348-T351 WeakPolarHBondContact CA-OG1 3.29Å; F348-T351 PolarHBondContact O-N 3.44Å; F348-T351 PolarHBondContact O-OG1 3.05Å; F348-V352 HydrophobicContact CD1-CG2 4.36Å; F348-V352 HydrophobicContact CD2-CG2 4.24Å; F348-V352 HydrophobicContact CE1-CG2 3.98Å; F348-V352 HydrophobicContact CE2-CG2 3.84Å; F348-V352 HydrophobicContact CG-CG2 4.49Å; F348-V352 HydrophobicContact CZ-CG2 3.71Å; F348-V352 VanDerWaalsContact O-CG2 3.28Å; F348-V352 WeakPolarHBondContact O-CG2 3.31Å; F348-V352 PolarHBondContact O-N 3.27Å
349	L	95.8	Very high	93.6	Very high	103 Å²	103	49.2 Å²	49.2	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-62.5	-45.3	178.4	-64.9	175.4	0	0	0	111.9	V345 A346 T351 V352 L353	V345-L349 WeakPolarHBondContact O-CG 3.34Å; V345-L349 PolarHBondContact O-N 3.44Å; V345-L349 VanDerWaalsContact O-N 3.09Å; A346-L349 PolarHBondContact O-N 3.44Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.22Å; L349-V352 PolarHBondContact O-N 3.3Å; L349-L353 WeakPolarHBondContact O-CG 3.22Å; L349-L353 PolarHBondContact O-N 3.34Å; L349-L353 VanDerWaalsContact O-N 3.09Å
350	I	95.3	Very high	93.8	Very high	70 Å²	70	50.3 Å²	50.3	36%	0.359	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-41.6	178.3	-66.8	166.8	0	0	0	111.1	A76 L79 A346 L347 F348 S354	A76-I350 HydrophobicContact CB-CG2 3.78Å; L79-I350 HydrophobicContact CD1-CD1 4.02Å; L79-I350 HydrophobicContact CD1-CG2 4.15Å; A346-I350 WeakPolarHBondContact O-CG1 3.29Å; A346-I350 PolarHBondContact O-N 3.18Å; L347-I350 PolarHBondContact O-N 3.42Å; F348-I350 PolarHBondContact O-N 3.2Å; I350-S354 PolarHBondContact O-N 3.4Å
351	T	95.1	Very high	93.8	Very high	4 Å²	4	50.9 Å²	50.9	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-43.8	178.6	48.2	0	0	0	0	112.3	N80 V263 L347 F348 L349 L353 S354 V355	N80-T351 WeakPolarHBondContact ND2-CG2 3.42Å; V263-T351 HydrophobicContact CG2-CG2 4.47Å; L347-T351 HydrophobicContact CD2-CG2 4.16Å; L347-T351 WeakPolarHBondContact O-CB 3.35Å; L347-T351 VanDerWaalsContact O-CG2 3.27Å; L347-T351 WeakPolarHBondContact O-CG2 3.48Å; L347-T351 PolarHBondContact O-N 2.94Å; L347-T351 PolarHBondContact O-OG1 3.39Å; F348-T351 WeakPolarHBondContact CA-OG1 3.29Å; F348-T351 PolarHBondContact O-N 3.44Å; F348-T351 PolarHBondContact O-OG1 3.05Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.22Å; T351-L353 VanDerWaalsContact C-N 3.32Å; T351-L353 PolarHBondContact O-N 3.31Å; T351-S354 PolarHBondContact O-N 2.99Å; T351-S354 VanDerWaalsContact O-N 3.16Å; T351-V355 VanDerWaalsContact O-CG2 3.22Å; T351-V355 WeakPolarHBondContact O-CG2 3.16Å; T351-V355 PolarHBondContact O-N 2.85Å
352	V	96.3	Very high	93.7	Very high	55 Å²	55	50.8 Å²	50.8	33%	0.333	27%	0.267	S	S	.	.	H	α-helix	trans	-56.7	-46.4	175.2	169.5	0	0	0	0	111.1	L260 F348 L349 S354 V355 A356	L260-V352 HydrophobicContact CD1-CG2 3.52Å; F348-V352 HydrophobicContact CD1-CG2 4.36Å; F348-V352 HydrophobicContact CD2-CG2 4.24Å; F348-V352 HydrophobicContact CE1-CG2 3.98Å; F348-V352 HydrophobicContact CE2-CG2 3.84Å; F348-V352 HydrophobicContact CG-CG2 4.49Å; F348-V352 HydrophobicContact CZ-CG2 3.71Å; F348-V352 VanDerWaalsContact O-CG2 3.28Å; F348-V352 WeakPolarHBondContact O-CG2 3.31Å; F348-V352 PolarHBondContact O-N 3.27Å; L349-V352 PolarHBondContact O-N 3.3Å; V352-S354 VanDerWaalsContact C-N 3.33Å; V352-S354 PolarHBondContact O-N 3.44Å; V352-V355 PolarHBondContact O-N 3.3Å; V352-A356 WeakPolarHBondContact O-CB 3.4Å; V352-A356 PolarHBondContact O-N 3.34Å
353	L	95.5	Very high	93.7	Very high	125 Å²	125	51.8 Å²	51.8	65%	0.654	28%	0.276	S	S	*	.	H	α-helix	trans	-62	-41.1	177.5	-69	173.6	0	0	0	111.9	L349 T351 Y357	L349-L353 WeakPolarHBondContact O-CG 3.22Å; L349-L353 PolarHBondContact O-N 3.34Å; L349-L353 VanDerWaalsContact O-N 3.09Å; T351-L353 VanDerWaalsContact C-N 3.32Å; T351-L353 PolarHBondContact O-N 3.31Å; L353-Y357 WeakPolarHBondContact O-CB 3.4Å; L353-Y357 PolarHBondContact O-N 3.43Å
354	S	94	Very high	93.4	Very high	9 Å²	9	51.7 Å²	51.7	6%	0.063	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-45.9	176.5	-176.8	0	0	0	0	112	D74 K256 I350 T351 V352 A356 Y357 W358	D74-S354 PolarHBondContact OD2-OG 2.96Å; K256-S354 PolarHBondContact NZ-OG 2.83Å; I350-S354 PolarHBondContact O-N 3.4Å; T351-S354 PolarHBondContact O-N 2.99Å; T351-S354 VanDerWaalsContact O-N 3.16Å; V352-S354 VanDerWaalsContact C-N 3.33Å; V352-S354 PolarHBondContact O-N 3.44Å; S354-A356 VanDerWaalsContact C-N 3.34Å; S354-A356 PolarHBondContact O-N 3.4Å; S354-Y357 PolarHBondContact O-N 3.27Å; S354-W358 PolarHBondContact O-N 2.8Å
355	V	94.3	Very high	93	Very high	26 Å²	26	55 Å²	55	16%	0.158	30%	0.302	C	S	.	.	H	α-helix	trans	-60.5	-44.3	176.5	179.7	0	0	0	0	110.6	K256 L260 T351 V352 G359	K256-V355 HydrophobicContact CB-CG2 3.95Å; L260-V355 HydrophobicContact CB-CG2 4.26Å; L260-V355 HydrophobicContact CD2-CG2 4.44Å; T351-V355 VanDerWaalsContact O-CG2 3.22Å; T351-V355 WeakPolarHBondContact O-CG2 3.16Å; T351-V355 PolarHBondContact O-N 2.85Å; V352-V355 PolarHBondContact O-N 3.3Å; V355-G359 WeakPolarHBondContact O-CA 3.31Å; V355-G359 PolarHBondContact O-N 3.19Å
356	A	94.7	Very high	92.8	Very high	61 Å²	61	62.5 Å²	62.5	50%	0.504	33%	0.326	S	S	.	.	H	α-helix	trans	-63.6	-44.6	178.1	0	0	0	0	0	112.1	V352 S354 G359 F360	V352-A356 WeakPolarHBondContact O-CB 3.4Å; V352-A356 PolarHBondContact O-N 3.34Å; S354-A356 VanDerWaalsContact C-N 3.34Å; S354-A356 PolarHBondContact O-N 3.4Å; A356-G359 PolarHBondContact O-N 3.45Å; A356-F360 WeakPolarHBondContact O-CB 3.45Å; A356-F360 PolarHBondContact O-N 3.33Å
357	Y	93.7	Very high	92.7	Very high	109 Å²	109	61 Å²	61	43%	0.427	31%	0.312	S	S	.	.	H	α-helix	trans	-61.2	-51.5	177.3	171.3	-102.8	0	0	0	111.9	L353 S354 F360 V361	L353-Y357 WeakPolarHBondContact O-CB 3.4Å; L353-Y357 PolarHBondContact O-N 3.43Å; S354-Y357 PolarHBondContact O-N 3.27Å; Y357-F360 PolarHBondContact O-N 3.27Å; Y357-V361 HydrophobicContact CD2-CG2 4.29Å; Y357-V361 HydrophobicContact CE1-CG2 4.3Å; Y357-V361 HydrophobicContact CE2-CG2 3.87Å; Y357-V361 WeakPolarHBondContact O-CB 3.48Å; Y357-V361 VanDerWaalsContact O-CG2 3.3Å; Y357-V361 WeakPolarHBondContact O-CG2 3.37Å; Y357-V361 PolarHBondContact O-N 2.89Å
358	W	92.4	Very high	92.5	Very high	4 Å²	4	61.3 Å²	61.3	2%	0.015	32%	0.315	C	S	.	.	H	α-helix	trans	-68.4	-35.6	179.7	-75.1	106.3	0	0	0	112.2	D74 Y252 L253 S354 V361 I362 F406 L413	D74-W358 PolarHBondContact OD2-NE1 2.82Å; Y252-W358 HydrophobicContact CD1-CD2 4.48Å; Y252-W358 HydrophobicContact CD1-CE3 4.47Å; Y252-W358 HydrophobicContact CE1-CB 4.31Å; Y252-W358 AromaticContact CE1-CD2 3.57Å; Y252-W358 HydrophobicContact CE1-CD2 3.57Å; Y252-W358 AromaticContact CE1-CE2 3.86Å; Y252-W358 AromaticContact CE1-CE3 3.87Å; Y252-W358 HydrophobicContact CE1-CE3 3.87Å; Y252-W358 AromaticContact CE1-CG 3.76Å; Y252-W358 HydrophobicContact CE1-CG 3.76Å; Y252-W358 HydrophobicContact CE1-CZ2 4.38Å; Y252-W358 HydrophobicContact CE1-CZ3 4.38Å; L253-W358 HydrophobicContact CD2-CB 4.34Å; S354-W358 PolarHBondContact O-N 2.8Å; W358-V361 PolarHBondContact O-N 2.91Å; W358-I362 HydrophobicContact CB-CD1 4.42Å; W358-I362 HydrophobicContact CE3-CD1 4.08Å; W358-I362 HydrophobicContact CE3-CG1 4.4Å; W358-I362 VanDerWaalsContact O-CB 3.22Å; W358-I362 WeakPolarHBondContact O-CB 3.31Å; W358-I362 VanDerWaalsContact O-CG1 3.24Å; W358-I362 WeakPolarHBondContact O-CG1 3.4Å; W358-I362 PolarHBondContact O-N 2.98Å; W358-F406 HydrophobicContact CE3-CD2 4.27Å; W358-F406 AromaticContact CE3-CE2 3.87Å; W358-F406 HydrophobicContact CE3-CE2 3.87Å; W358-F406 HydrophobicContact CH2-CE2 4.17Å; W358-F406 AromaticContact CZ3-CD2 3.8Å; W358-F406 HydrophobicContact CZ3-CD2 3.8Å; W358-F406 AromaticContact CZ3-CE2 3.48Å; W358-F406 HydrophobicContact CZ3-CE2 3.48Å; W358-F406 VanDerWaalsContact CZ3-CE2 3.48Å; W358-L413 HydrophobicContact CH2-CD1 3.65Å; W358-L413 HydrophobicContact CZ2-CD1 3.83Å
359	G	93	Very high	92.2	Very high	14 Å²	14	59.6 Å²	59.6	14%	0.144	31%	0.308	C	S	.	.	H	α-helix	trans	-58.3	-48.7	171	0	0	0	0	0	111.8	V355 A356 V361 I362 L363	V355-G359 WeakPolarHBondContact O-CA 3.31Å; V355-G359 PolarHBondContact O-N 3.19Å; A356-G359 PolarHBondContact O-N 3.45Å; G359-V361 PolarHBondContact O-N 3.47Å; G359-I362 PolarHBondContact O-N 3.3Å; G359-L363 WeakPolarHBondContact O-CB 3.35Å; G359-L363 WeakPolarHBondContact O-CG 3.26Å; G359-L363 PolarHBondContact O-N 2.98Å
360	F	93.3	Very high	92	Very high	123 Å²	123	62 Å²	62	54%	0.539	31%	0.311	S	S	.	.	H	α-helix	trans	-60.3	-45.2	176.5	177.9	-94.8	0	0	0	112.2	A356 Y357 L364 P367	A356-F360 WeakPolarHBondContact O-CB 3.45Å; A356-F360 PolarHBondContact O-N 3.33Å; Y357-F360 PolarHBondContact O-N 3.27Å; F360-L364 HydrophobicContact CD2-CD1 3.35Å; F360-L364 HydrophobicContact CE2-CD1 3.25Å; F360-L364 HydrophobicContact CG-CD1 4.11Å; F360-L364 HydrophobicContact CZ-CD1 3.96Å; F360-L364 WeakPolarHBondContact O-CB 3.33Å; F360-L364 PolarHBondContact O-N 3.33Å; F360-P367 HydrophobicContact CE1-CB 4.29Å; F360-P367 HydrophobicContact CE1-CG 4.32Å
361	V	91	Very high	91.8	Very high	12 Å²	12	59.4 Å²	59.4	7%	0.073	30%	0.297	C	S	.	.	H	α-helix	trans	-68.2	-38.1	-177.8	164.5	0	0	0	0	113.2	Y357 W358 G359	Y357-V361 HydrophobicContact CD2-CG2 4.29Å; Y357-V361 HydrophobicContact CE1-CG2 4.3Å; Y357-V361 HydrophobicContact CE2-CG2 3.87Å; Y357-V361 WeakPolarHBondContact O-CB 3.48Å; Y357-V361 VanDerWaalsContact O-CG2 3.3Å; Y357-V361 WeakPolarHBondContact O-CG2 3.37Å; Y357-V361 PolarHBondContact O-N 2.89Å; W358-V361 PolarHBondContact O-N 2.91Å; G359-V361 PolarHBondContact O-N 3.47Å
362	I	89.9	Confident	91.5	Very high	17 Å²	17	59.2 Å²	59.2	9%	0.087	30%	0.296	C	S	.	.	H	α-helix	trans	-88.7	-39.6	-173	-68.1	173.2	0	0	0	111.4	F246 C249 Y252 L253 W358 G359 F406	F246-I362 HydrophobicContact CE2-CG2 3.4Å; F246-I362 VanDerWaalsContact CE2-CG2 3.4Å; F246-I362 HydrophobicContact CZ-CG2 3.5Å; F246-I362 VanDerWaalsContact CZ-CG2 3.5Å; C249-I362 HydrophobicContact CB-CG2 3.69Å; Y252-I362 HydrophobicContact CD1-CD1 4.06Å; L253-I362 HydrophobicContact CD1-CB 4.14Å; L253-I362 HydrophobicContact CD1-CD1 4.42Å; L253-I362 HydrophobicContact CD1-CG2 3.69Å; L253-I362 HydrophobicContact CD2-CD1 3.93Å; L253-I362 HydrophobicContact CG-CD1 3.88Å; L253-I362 HydrophobicContact CG-CG2 4.28Å; W358-I362 HydrophobicContact CB-CD1 4.42Å; W358-I362 HydrophobicContact CE3-CD1 4.08Å; W358-I362 HydrophobicContact CE3-CG1 4.4Å; W358-I362 VanDerWaalsContact O-CB 3.22Å; W358-I362 WeakPolarHBondContact O-CB 3.31Å; W358-I362 VanDerWaalsContact O-CG1 3.24Å; W358-I362 WeakPolarHBondContact O-CG1 3.4Å; W358-I362 PolarHBondContact O-N 2.98Å; G359-I362 PolarHBondContact O-N 3.3Å; I362-F406 HydrophobicContact CD1-CD2 3.88Å; I362-F406 HydrophobicContact CD1-CE2 3.98Å; I362-F406 HydrophobicContact CG1-CD2 4.21Å
363	L	88.9	Confident	91.1	Very high	119 Å²	119	57.6 Å²	57.6	62%	0.623	29%	0.287	S	S	*	.	H	α-helix	trans	-78.7	-28	-175.4	-62.9	173.2	0	0	0	112.7	L253 G359	L253-L363 HydrophobicContact CD1-CD2 4.2Å; L253-L363 HydrophobicContact CD1-CG 4.43Å; G359-L363 WeakPolarHBondContact O-CB 3.35Å; G359-L363 WeakPolarHBondContact O-CG 3.26Å; G359-L363 PolarHBondContact O-N 2.98Å
364	L	89.1	Confident	90.8	Very high	68 Å²	68	58.4 Å²	58.4	36%	0.356	28%	0.281	S	S	.	.			trans	-98.8	134.6	-178.8	-59	176.2	0	0	0	111.3	F360 P367	F360-L364 HydrophobicContact CD2-CD1 3.35Å; F360-L364 HydrophobicContact CE2-CD1 3.25Å; F360-L364 HydrophobicContact CG-CD1 4.11Å; F360-L364 HydrophobicContact CZ-CD1 3.96Å; F360-L364 WeakPolarHBondContact O-CB 3.33Å; F360-L364 PolarHBondContact O-N 3.33Å; L364-P367 HydrophobicContact CB-CG 3.97Å; L364-P367 VanDerWaalsContact O-CD 3.25Å; L364-P367 WeakPolarHBondContact O-CD 3.3Å; L364-P367 VanDerWaalsContact O-CG 3.25Å; L364-P367 WeakPolarHBondContact O-CG 3.3Å
365	P	85.1	Confident	90.5	Very high	70 Å²	70	58.8 Å²	58.8	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-75.5	-25.5	176.5	28.4	-34.6	0	0	0	113.3	A368 I369	P365-A368 WeakPolarHBondContact O-CB 3.38Å; P365-A368 PolarHBondContact O-N 2.84Å; P365-A368 VanDerWaalsContact O-N 3.14Å; P365-I369 WeakPolarHBondContact O-CG1 3.33Å; P365-I369 PolarHBondContact O-N 3.37Å
366	W	88.1	Confident	90	Very high	204 Å²	204	57.5 Å²	57.5	77%	0.773	27%	0.274	S	S	*	.	H	α-helix	trans	-54.5	-52.8	-179.9	-55.4	74	0	0	0	113.5	A368 I369 W370	W366-A368 PolarHBondContact O-N 3.47Å; W366-I369 PolarHBondContact O-N 3.46Å; W366-W370 WeakPolarHBondContact O-CB 3.42Å; W366-W370 PolarHBondContact O-N 2.92Å
367	P	90.4	Very high	89.5	Confident	15 Å²	15	59.2 Å²	59.2	10%	0.097	27%	0.272	C	S	.	.	H	α-helix	trans	-65.3	-25.5	177.7	25.8	-36.6	0	0	0	113.1	F360 L364 F371 R409	F360-P367 HydrophobicContact CE1-CB 4.29Å; F360-P367 HydrophobicContact CE1-CG 4.32Å; L364-P367 HydrophobicContact CB-CG 3.97Å; L364-P367 VanDerWaalsContact O-CD 3.25Å; L364-P367 WeakPolarHBondContact O-CD 3.3Å; L364-P367 VanDerWaalsContact O-CG 3.25Å; L364-P367 WeakPolarHBondContact O-CG 3.3Å; P367-F371 WeakPolarHBondContact O-CB 3.46Å; P367-F371 PolarHBondContact O-N 3.12Å; P367-R409 PolarHBondContact O-NH2 3.23Å; P367-R409 VanDerWaalsContact O-NH2 3.08Å
368	A	90.6	Very high	88.9	Confident	10 Å²	10	59.3 Å²	59.3	8%	0.083	28%	0.279	C	S	.	.	H	α-helix	trans	-69.7	-50	174.7	0	0	0	0	0	111	P365 W366 F371 I372 V396 V405	P365-A368 WeakPolarHBondContact O-CB 3.38Å; P365-A368 PolarHBondContact O-N 2.84Å; P365-A368 VanDerWaalsContact O-N 3.14Å; W366-A368 PolarHBondContact O-N 3.47Å; A368-F371 PolarHBondContact O-N 2.86Å; A368-I372 WeakPolarHBondContact O-CG1 3.36Å; A368-I372 PolarHBondContact O-N 3.47Å; A368-I372 VanDerWaalsContact O-N 3.1Å; A368-V396 HydrophobicContact CB-CG1 4.12Å; A368-V405 HydrophobicContact CB-CG1 3.84Å; A368-V405 HydrophobicContact CB-CG2 4.34Å
369	I	89.7	Confident	88.1	Confident	33 Å²	33	59.9 Å²	59.9	17%	0.169	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-46.4	178.5	-64.2	159.5	0	0	0	110.5	P365 W366 F371 I372 S373 V392 E393 V396	P365-I369 WeakPolarHBondContact O-CG1 3.33Å; P365-I369 PolarHBondContact O-N 3.37Å; W366-I369 PolarHBondContact O-N 3.46Å; I369-F371 PolarHBondContact O-N 3.18Å; I369-I372 PolarHBondContact O-N 3.37Å; I369-S373 WeakPolarHBondContact O-CB 3.29Å; I369-S373 PolarHBondContact O-N 3.06Å; I369-V392 HydrophobicContact CG2-CG1 4.16Å; I369-E393 HydrophobicContact CD1-CG 3.87Å; I369-E393 HydrophobicContact CG1-CG 4.34Å; I369-E393 HydrophobicContact CG2-CG 4.36Å; I369-V396 HydrophobicContact CG1-CB 4.45Å; I369-V396 HydrophobicContact CG1-CG1 4.26Å
370	W	90.8	Very high	86.7	Confident	154 Å²	154	64.9 Å²	64.9	58%	0.583	30%	0.303	S	S	*	.	H	α-helix	trans	-62.5	-42.9	178.8	179.9	81.5	0	0	0	112.5	W366 I372 S373 R374	W366-W370 WeakPolarHBondContact O-CB 3.42Å; W366-W370 PolarHBondContact O-N 2.92Å; W370-I372 PolarHBondContact O-N 2.8Å; W370-S373 PolarHBondContact O-N 2.91Å; W370-R374 WeakPolarHBondContact O-CB 3.49Å; W370-R374 PolarHBondContact O-N 3.49Å
371	F	91.2	Very high	85.4	Confident	16 Å²	16	60.7 Å²	60.7	7%	0.07	29%	0.286	C	S	.	.	H	α-helix	trans	-59.3	-45.8	176.9	171.1	-95.4	0	0	0	111.6	P367 A368 I369 H375 V405 L408 R409 T412	P367-F371 WeakPolarHBondContact O-CB 3.46Å; P367-F371 PolarHBondContact O-N 3.12Å; A368-F371 PolarHBondContact O-N 2.86Å; I369-F371 PolarHBondContact O-N 3.18Å; F371-H375 AromaticContact CD2-CE1 3.42Å; F371-H375 VanDerWaalsContact CD2-CE1 3.42Å; F371-H375 WeakPolarHBondContact CD2-CE1 3.47Å; F371-H375 AromaticContact CD2-ND1 3.78Å; F371-H375 AromaticContact CE2-CE1 3.06Å; F371-H375 WeakPolarHBondContact CE2-CE1 3.27Å; F371-H375 AromaticContact CE2-ND1 3.73Å; F371-H375 AromaticContact CE2-NE2 3.69Å; F371-H375 AromaticContact CZ-CE1 3.51Å; F371-H375 AromaticContact CZ-ND1 3.95Å; F371-H375 AromaticContact CZ-NE2 3.84Å; F371-H375 PolarHBondContact O-N 2.83Å; F371-H375 PolarHBondContact O-ND1 3.48Å; F371-V405 HydrophobicContact CD1-CG1 4.45Å; F371-L408 HydrophobicContact CE1-CD2 4.13Å; F371-L408 HydrophobicContact CE1-CG 4.24Å; F371-R409 HydrophobicContact CE1-CB 4.29Å; F371-R409 HydrophobicContact CE2-CB 4.36Å; F371-R409 HydrophobicContact CE2-CG 4.19Å; F371-R409 HydrophobicContact CZ-CB 3.99Å; F371-R409 HydrophobicContact CZ-CG 4.31Å; F371-T412 HydrophobicContact CZ-CG2 4.02Å; F371-T412 WeakPolarHBondContact CZ-OG1 3.27Å
372	I	90.1	Very high	83.9	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.9	-45.8	179.8	-62.6	-63.7	0	0	0	111.6	A368 I369 W370 R374 H375 L376 V392 F395 V396 L400 L408 L424	A368-I372 WeakPolarHBondContact O-CG1 3.36Å; A368-I372 PolarHBondContact O-N 3.47Å; A368-I372 VanDerWaalsContact O-N 3.1Å; I369-I372 PolarHBondContact O-N 3.37Å; W370-I372 PolarHBondContact O-N 2.8Å; I372-R374 VanDerWaalsContact C-N 3.3Å; I372-R374 PolarHBondContact O-N 3.45Å; I372-H375 PolarHBondContact O-N 3.3Å; I372-L376 HydrophobicContact CG2-CD1 3.87Å; I372-L376 HydrophobicContact CG2-CG 4.37Å; I372-L376 WeakPolarHBondContact O-CG 3.04Å; I372-L376 PolarHBondContact O-N 2.83Å; I372-V392 HydrophobicContact CB-CG1 4.35Å; I372-V392 HydrophobicContact CG2-CG1 4.02Å; I372-F395 HydrophobicContact CG2-CD1 4.12Å; I372-F395 HydrophobicContact CG2-CE1 4.23Å; I372-V396 HydrophobicContact CB-CG2 4.1Å; I372-V396 HydrophobicContact CG1-CG2 3.83Å; I372-V396 HydrophobicContact CG2-CG2 4.29Å; I372-L400 HydrophobicContact CD1-CD2 3.99Å; I372-L408 HydrophobicContact CD1-CD2 3.58Å; I372-L424 HydrophobicContact CD1-CD1 3.81Å; I372-L424 HydrophobicContact CD1-CD2 4.16Å; I372-L424 HydrophobicContact CG2-CD1 4.2Å; I372-L424 HydrophobicContact CG2-CD2 4.26Å
373	S	87.8	Confident	82.7	Confident	21 Å²	21	65 Å²	65	15%	0.147	31%	0.312	C	S	.	.	H	α-helix	trans	-54.1	-48.4	176	-168.7	0	0	0	0	111.1	I369 W370 H375 L376 E377	I369-S373 WeakPolarHBondContact O-CB 3.29Å; I369-S373 PolarHBondContact O-N 3.06Å; W370-S373 PolarHBondContact O-N 2.91Å; S373-H375 VanDerWaalsContact C-N 3.34Å; S373-H375 PolarHBondContact O-N 2.91Å; S373-L376 PolarHBondContact O-N 3.16Å; S373-E377 VanDerWaalsContact O-CG 3.32Å; S373-E377 WeakPolarHBondContact O-CG 3.27Å; S373-E377 PolarHBondContact O-N 3.38Å; S373-E377 PolarHBondContact OG-OE1 2.96Å
374	R	88.7	Confident	81.4	Confident	141 Å²	141	65.1 Å²	65.1	53%	0.532	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-36.4	-179.3	-174.6	173	179.3	174.5	0.4	113.4	W370 I372 L378	W370-R374 WeakPolarHBondContact O-CB 3.49Å; W370-R374 PolarHBondContact O-N 3.49Å; I372-R374 VanDerWaalsContact C-N 3.3Å; I372-R374 PolarHBondContact O-N 3.45Å; R374-L378 PolarHBondContact O-N 3.24Å; R374-L378 VanDerWaalsContact O-N 3.16Å
375	H	87.5	Confident	80.2	Confident	17 Å²	17	64.8 Å²	64.8	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-75.5	-29.6	177.3	-75.2	73.5	0	0	0	112.2	F371 I372 S373 S379 T421 L424	F371-H375 AromaticContact CD2-CE1 3.42Å; F371-H375 VanDerWaalsContact CD2-CE1 3.42Å; F371-H375 WeakPolarHBondContact CD2-CE1 3.47Å; F371-H375 AromaticContact CD2-ND1 3.78Å; F371-H375 AromaticContact CE2-CE1 3.06Å; F371-H375 WeakPolarHBondContact CE2-CE1 3.27Å; F371-H375 AromaticContact CE2-ND1 3.73Å; F371-H375 AromaticContact CE2-NE2 3.69Å; F371-H375 AromaticContact CZ-CE1 3.51Å; F371-H375 AromaticContact CZ-ND1 3.95Å; F371-H375 AromaticContact CZ-NE2 3.84Å; F371-H375 PolarHBondContact O-N 2.83Å; F371-H375 PolarHBondContact O-ND1 3.48Å; I372-H375 PolarHBondContact O-N 3.3Å; S373-H375 VanDerWaalsContact C-N 3.34Å; S373-H375 PolarHBondContact O-N 2.91Å; H375-S379 PolarHBondContact O-N 3.49Å; H375-T421 HydrophobicContact CB-CG2 4.13Å; H375-L424 HydrophobicContact CB-CD2 3.37Å
376	L	84.3	Confident	79.1	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-71.8	-39.7	172.3	-70	170.5	0	0	0	111.5	I372 S373 L378 S379 M381 F383 V392 L424 W428	I372-L376 HydrophobicContact CG2-CD1 3.87Å; I372-L376 HydrophobicContact CG2-CG 4.37Å; I372-L376 WeakPolarHBondContact O-CG 3.04Å; I372-L376 PolarHBondContact O-N 2.83Å; S373-L376 PolarHBondContact O-N 3.16Å; L376-L378 VanDerWaalsContact C-N 3.28Å; L376-L378 PolarHBondContact O-N 3.28Å; L376-S379 WeakPolarHBondContact O-CB 3.5Å; L376-S379 PolarHBondContact O-N 3.43Å; L376-S379 VanDerWaalsContact O-N 3.09Å; L376-S379 PolarHBondContact O-OG 3.01Å; L376-M381 HydrophobicContact CD2-CE 4.4Å; L376-F383 HydrophobicContact CB-CD1 3.99Å; L376-F383 HydrophobicContact CB-CD2 4.26Å; L376-F383 HydrophobicContact CB-CE1 4.22Å; L376-F383 HydrophobicContact CB-CE2 4.46Å; L376-F383 HydrophobicContact CB-CG 4.03Å; L376-F383 HydrophobicContact CB-CZ 4.47Å; L376-F383 HydrophobicContact CD1-CD2 4.46Å; L376-F383 HydrophobicContact CD1-CE2 4.06Å; L376-F383 HydrophobicContact CD1-CZ 4.27Å; L376-V392 HydrophobicContact CD1-CG2 4.09Å; L376-L424 HydrophobicContact CD2-CD2 4.24Å; L376-L424 HydrophobicContact CD2-CG 4.21Å; L376-L424 HydrophobicContact CG-CD2 4.1Å; L376-W428 HydrophobicContact CD1-CD2 4.02Å; L376-W428 HydrophobicContact CD1-CE3 3.76Å; L376-W428 HydrophobicContact CD1-CH2 3.95Å; L376-W428 HydrophobicContact CD1-CZ2 4.14Å; L376-W428 HydrophobicContact CD1-CZ3 3.73Å; L376-W428 HydrophobicContact CD2-CB 4.28Å; L376-W428 HydrophobicContact CD2-CD2 4.06Å; L376-W428 HydrophobicContact CD2-CE3 4.41Å; L376-W428 HydrophobicContact CD2-CG 4.04Å
377	E	83.5	Confident	78	Confident	97 Å²	97	67.5 Å²	67.5	45%	0.453	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-34.7	173	-73.2	163.7	-146.2	0	0	112.6	S373 S379 F383 P385	S373-E377 VanDerWaalsContact O-CG 3.32Å; S373-E377 WeakPolarHBondContact O-CG 3.27Å; S373-E377 PolarHBondContact O-N 3.38Å; S373-E377 PolarHBondContact OG-OE1 2.96Å; E377-S379 VanDerWaalsContact C-N 3.26Å; E377-S379 PolarHBondContact O-N 3.49Å; E377-F383 HydrophobicContact CG-CD1 3.86Å; E377-F383 HydrophobicContact CG-CE1 4.19Å; E377-P385 HydrophobicContact CG-CB 4.47Å; E377-P385 HydrophobicContact CG-CG 4.42Å; E377-P385 WeakPolarHBondContact OE1-CB 3.24Å
378	L	82.6	Confident	77.1	Confident	111 Å²	111	68 Å²	68	58%	0.581	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-15.7	176.5	-169.2	61.3	0	0	0	112.7	R374 L376 I417 T421	R374-L378 PolarHBondContact O-N 3.24Å; R374-L378 VanDerWaalsContact O-N 3.16Å; L376-L378 VanDerWaalsContact C-N 3.28Å; L376-L378 PolarHBondContact O-N 3.28Å; L378-I417 HydrophobicContact CD2-CD1 4.19Å; L378-I417 HydrophobicContact CD2-CG1 4.42Å; L378-T421 HydrophobicContact CB-CG2 4.49Å; L378-T421 HydrophobicContact CD2-CG2 4.16Å
379	S	74.4	Confident	76.5	Confident	16 Å²	16	73.4 Å²	73.4	11%	0.112	35%	0.352	C	S	.	.	S	Bend	trans	-75.7	158.3	178.7	80.3	0	0	0	0	111.8	H375 L376 E377 M381 V425	H375-S379 PolarHBondContact O-N 3.49Å; L376-S379 WeakPolarHBondContact O-CB 3.5Å; L376-S379 PolarHBondContact O-N 3.43Å; L376-S379 VanDerWaalsContact O-N 3.09Å; L376-S379 PolarHBondContact O-OG 3.01Å; E377-S379 VanDerWaalsContact C-N 3.26Å; E377-S379 PolarHBondContact O-N 3.49Å; S379-M381 PolarHBondContact O-N 3.46Å; S379-M381 VanDerWaalsContact O-N 3.09Å; S379-M381 PolarHBondContact OG-N 3.06Å; S379-V425 VanDerWaalsContact CB-CG2 3.48Å
380	E	63.8	Low	75.9	Confident	119 Å²	119	79.9 Å²	79.9	56%	0.556	38%	0.379	S	S	*	.	S	Bend	trans	-70.7	-0.8	178	-61.9	-176.7	-173.6	0	0	114	R463	E380-R463 IonicContact OE1-CZ 3.57Å; E380-R463 IonicContact OE1-NH2 2.7Å; E380-R463 PolarHBondContact OE1-NH2 3.24Å; E380-R463 IonicContact OE2-CZ 3.87Å; E380-R463 IonicContact OE2-NE 2.78Å; E380-R463 PolarHBondContact OE2-NE 3.39Å; E380-R463 IonicContact OE2-NH2 3.52Å; E380-R463 PolarHBondContact OE2-NH2 2.89Å
381	M	65.6	Low	75.4	Confident	35 Å²	35	75.3 Å²	75.3	17%	0.172	37%	0.366	C	S	.	.	S	Bend	trans	-77.3	145.1	177.8	-62.9	-158.3	-57.3	0	0	110.8	L376 S379 F383 V425 W428 C462	L376-M381 HydrophobicContact CD2-CE 4.4Å; S379-M381 PolarHBondContact O-N 3.46Å; S379-M381 VanDerWaalsContact O-N 3.09Å; S379-M381 PolarHBondContact OG-N 3.06Å; M381-F383 VanDerWaalsContact C-N 3.33Å; M381-F383 PolarHBondContact O-N 2.83Å; M381-V425 HydrophobicContact CE-CB 4.43Å; M381-V425 HydrophobicContact CE-CG1 3.73Å; M381-V425 HydrophobicContact CE-CG2 4.17Å; M381-V425 HydrophobicContact CG-CG1 4.31Å; M381-V425 HydrophobicContact SD-CG1 3.74Å; M381-W428 HydrophobicContact CE-CG 4.47Å; M381-C462 HydrophobicContact SD-CB 4.36Å
382	P	59.6	Low	75	Confident	92 Å²	92	74.6 Å²	74.6	60%	0.597	36%	0.363	S	S	*	.			trans	-74.4	93.8	175.2	30.5	-24.3	0	0	0	106.8	S466	P382-S466 VanDerWaalsContact CD-CB 3.49Å
383	F	64.2	Low	74.7	Confident	28 Å²	28	78 Å²	78	12%	0.123	38%	0.379	C	S	.	.			trans	-115.5	114	-179.9	-179.7	-95.7	0	0	0	109.1	L376 E377 M381 P385 V392 W428	L376-F383 HydrophobicContact CB-CD1 3.99Å; L376-F383 HydrophobicContact CB-CD2 4.26Å; L376-F383 HydrophobicContact CB-CE1 4.22Å; L376-F383 HydrophobicContact CB-CE2 4.46Å; L376-F383 HydrophobicContact CB-CG 4.03Å; L376-F383 HydrophobicContact CB-CZ 4.47Å; L376-F383 HydrophobicContact CD1-CD2 4.46Å; L376-F383 HydrophobicContact CD1-CE2 4.06Å; L376-F383 HydrophobicContact CD1-CZ 4.27Å; E377-F383 HydrophobicContact CG-CD1 3.86Å; E377-F383 HydrophobicContact CG-CE1 4.19Å; M381-F383 VanDerWaalsContact C-N 3.33Å; M381-F383 PolarHBondContact O-N 2.83Å; F383-P385 HydrophobicContact CE1-CB 4.04Å; F383-V392 HydrophobicContact CE2-CG2 3.81Å; F383-V392 HydrophobicContact CZ-CG2 3.45Å; F383-V392 VanDerWaalsContact CZ-CG2 3.45Å; F383-W428 HydrophobicContact CE2-CH2 4.46Å; F383-W428 HydrophobicContact CE2-CZ2 4.14Å
384	E	61.5	Low	74.4	Confident	121 Å²	121	82.8 Å²	82.8	57%	0.565	39%	0.393	S	S	*	.			trans	-98.1	112.6	173.8	-67.9	-172.7	-169.6	0	0	109.4	H386 E387 S388	E384-H386 PolarHBondContact O-N 3.01Å; E384-H386 VanDerWaalsContact O-N 3.17Å; E384-E387 PolarHBondContact O-N 3.46Å; E384-S388 PolarHBondContact O-N 2.97Å
385	P	64	Low	74.3	Confident	60 Å²	60	76 Å²	76	39%	0.39	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-26.1	-170.8	22.8	-32.8	0	0	0	113.6	E377 F383	E377-P385 HydrophobicContact CG-CB 4.47Å; E377-P385 HydrophobicContact CG-CG 4.42Å; E377-P385 WeakPolarHBondContact OE1-CB 3.24Å; F383-P385 HydrophobicContact CE1-CB 4.04Å
386	H	61.8	Low	74.2	Confident	178 Å²	178	75.6 Å²	75.6	82%	0.824	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-38.6	-178.6	-167.2	-82.3	0	0	0	112.4	E384	E384-H386 PolarHBondContact O-N 3.01Å; E384-H386 VanDerWaalsContact O-N 3.17Å
387	E	66.5	Low	74.2	Confident	153 Å²	153	79.4 Å²	79.4	72%	0.715	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-39.4	-178.7	-61.8	-160.4	151.9	0	0	112	E384 K389	E384-E387 PolarHBondContact O-N 3.46Å; E387-K389 PolarHBondContact O-N 3.15Å
388	S	71.2	Confident	73.9	Confident	26 Å²	26	78.2 Å²	78.2	18%	0.182	40%	0.395	C	S	.	.	S	Bend	trans	-91.7	8.8	-172.7	-55.7	0	0	0	0	114.9	E384 K390 D391 V392	E384-S388 PolarHBondContact O-N 2.97Å; S388-K390 VanDerWaalsContact C-N 3.31Å; S388-K390 PolarHBondContact O-N 3.17Å; S388-D391 PolarHBondContact O-N 3.45Å; S388-V392 PolarHBondContact O-N 3Å
389	K	77.2	Confident	73.9	Confident	124 Å²	124	74.6 Å²	74.6	54%	0.539	37%	0.374	S	S	.	.	H	α-helix	trans	-54.7	-43.7	-176.6	-172.8	-179.6	177.4	-175.7	0	113.1	E387 D391 V392 E393	E387-K389 PolarHBondContact O-N 3.15Å; K389-D391 VanDerWaalsContact C-N 3.32Å; K389-D391 PolarHBondContact O-N 3.41Å; K389-V392 PolarHBondContact O-N 2.8Å; K389-E393 VanDerWaalsContact CE-OE1 3.3Å; K389-E393 WeakPolarHBondContact CE-OE1 3.45Å; K389-E393 WeakPolarHBondContact O-CG 3.47Å; K389-E393 PolarHBondContact O-N 3.4Å
390	K	77.5	Confident	74.4	Confident	169 Å²	169	73.9 Å²	73.9	74%	0.735	37%	0.369	S	S	*	.	H	α-helix	trans	-64.6	-36.6	178.7	-70.5	-178.6	-179.8	174.3	0	112.2	S388 E393 R394	S388-K390 VanDerWaalsContact C-N 3.31Å; S388-K390 PolarHBondContact O-N 3.17Å; K390-E393 PolarHBondContact O-N 2.91Å; K390-R394 WeakPolarHBondContact O-CB 3.37Å; K390-R394 PolarHBondContact O-N 3.36Å
391	D	79.6	Confident	75.4	Confident	57 Å²	57	69.3 Å²	69.3	31%	0.305	35%	0.347	S	S	.	.	H	α-helix	trans	-72.1	-39.1	178.8	-66	-14.7	0	0	0	111.3	S388 K389 R394 F395 W428 Y432	S388-D391 PolarHBondContact O-N 3.45Å; K389-D391 VanDerWaalsContact C-N 3.32Å; K389-D391 PolarHBondContact O-N 3.41Å; D391-R394 PolarHBondContact O-N 3.11Å; D391-F395 WeakPolarHBondContact O-CB 3.49Å; D391-F395 PolarHBondContact O-N 2.78Å; D391-W428 HydrophobicContact CB-CH2 4.28Å; D391-Y432 WeakPolarHBondContact CB-OH 3.18Å; D391-Y432 PolarHBondContact OD2-OH 3.35Å
392	V	83.6	Confident	76.3	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.012	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-45.9	172.8	178.2	0	0	0	0	110.7	I369 I372 L376 F383 S388 K389 R394 F395 V396 W428	I369-V392 HydrophobicContact CG2-CG1 4.16Å; I372-V392 HydrophobicContact CB-CG1 4.35Å; I372-V392 HydrophobicContact CG2-CG1 4.02Å; L376-V392 HydrophobicContact CD1-CG2 4.09Å; F383-V392 HydrophobicContact CE2-CG2 3.81Å; F383-V392 HydrophobicContact CZ-CG2 3.45Å; F383-V392 VanDerWaalsContact CZ-CG2 3.45Å; S388-V392 PolarHBondContact O-N 3Å; K389-V392 PolarHBondContact O-N 2.8Å; V392-R394 VanDerWaalsContact C-N 3.28Å; V392-R394 PolarHBondContact O-N 3.05Å; V392-F395 PolarHBondContact O-N 3.06Å; V392-V396 HydrophobicContact CG1-CG2 4.25Å; V392-V396 WeakPolarHBondContact O-CB 3.49Å; V392-V396 VanDerWaalsContact O-CG2 3.31Å; V392-V396 WeakPolarHBondContact O-CG2 3.35Å; V392-V396 PolarHBondContact O-N 3.46Å; V392-W428 HydrophobicContact CB-CH2 4.38Å; V392-W428 HydrophobicContact CG2-CH2 3.67Å; V392-W428 HydrophobicContact CG2-CZ3 4.11Å
393	E	84.9	Confident	77.7	Confident	72 Å²	72	66.2 Å²	66.2	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-58.5	-42.2	175.3	-76.8	176.6	-171.5	0	0	111.4	I369 K389 K390 V396 C397	I369-E393 HydrophobicContact CD1-CG 3.87Å; I369-E393 HydrophobicContact CG1-CG 4.34Å; I369-E393 HydrophobicContact CG2-CG 4.36Å; K389-E393 VanDerWaalsContact CE-OE1 3.3Å; K389-E393 WeakPolarHBondContact CE-OE1 3.45Å; K389-E393 WeakPolarHBondContact O-CG 3.47Å; K389-E393 PolarHBondContact O-N 3.4Å; K390-E393 PolarHBondContact O-N 2.91Å; E393-V396 PolarHBondContact O-N 2.97Å; E393-C397 VanDerWaalsContact O-CB 3.23Å; E393-C397 WeakPolarHBondContact O-CB 3.41Å; E393-C397 PolarHBondContact O-N 3.44Å; E393-C397 PolarHBondContact O-SG 3.48Å
394	R	81.5	Confident	78.8	Confident	120 Å²	120	65.1 Å²	65.1	45%	0.453	33%	0.326	S	S	.	.	H	α-helix	trans	-65.7	-43.2	176.9	-168.9	176.6	-174.6	-172.7	-6.2	112.1	K390 D391 V392 S398 F431 E435	K390-R394 WeakPolarHBondContact O-CB 3.37Å; K390-R394 PolarHBondContact O-N 3.36Å; D391-R394 PolarHBondContact O-N 3.11Å; V392-R394 VanDerWaalsContact C-N 3.28Å; V392-R394 PolarHBondContact O-N 3.05Å; R394-S398 WeakPolarHBondContact O-CA 3.34Å; R394-S398 WeakPolarHBondContact O-CB 3.5Å; R394-S398 PolarHBondContact O-N 3.31Å; R394-S398 PolarHBondContact O-OG 2.93Å; R394-F431 HydrophobicContact CG-CZ 4.27Å; R394-E435 IonicContact CZ-OE1 3.5Å; R394-E435 IonicContact NH1-OE1 3.11Å; R394-E435 PolarHBondContact NH1-OE1 3.27Å; R394-E435 IonicContact NH1-OE2 2.7Å; R394-E435 IonicContact NH2-OE1 4Å
395	F	84.9	Confident	80.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.301	C	S	.	.	I	π-helix	trans	-60.7	-47.4	176	177.2	-105.7	0	0	0	111.5	I372 D391 V392 Y399 L400 L424 L427 W428 F431	I372-F395 HydrophobicContact CG2-CD1 4.12Å; I372-F395 HydrophobicContact CG2-CE1 4.23Å; D391-F395 WeakPolarHBondContact O-CB 3.49Å; D391-F395 PolarHBondContact O-N 2.78Å; V392-F395 PolarHBondContact O-N 3.06Å; F395-Y399 AromaticContact CD2-CD1 3.82Å; F395-Y399 HydrophobicContact CD2-CD1 3.82Å; F395-Y399 HydrophobicContact CD2-CG 4.42Å; F395-Y399 AromaticContact CE2-CD1 3.44Å; F395-Y399 HydrophobicContact CE2-CD1 3.44Å; F395-Y399 VanDerWaalsContact CE2-CD1 3.44Å; F395-Y399 AromaticContact CE2-CE1 3.87Å; F395-Y399 HydrophobicContact CE2-CE1 3.87Å; F395-Y399 HydrophobicContact CE2-CG 4.43Å; F395-Y399 HydrophobicContact CZ-CD1 4.22Å; F395-Y399 WeakPolarHBondContact O-CB 3.44Å; F395-Y399 PolarHBondContact O-N 3.4Å; F395-L400 HydrophobicContact CE1-CB 4.39Å; F395-L400 HydrophobicContact CE1-CD2 4.01Å; F395-L400 PolarHBondContact O-N 3.37Å; F395-L424 HydrophobicContact CE1-CD1 3.73Å; F395-L424 HydrophobicContact CZ-CD1 4.07Å; F395-L427 HydrophobicContact CZ-CB 4.23Å; F395-W428 HydrophobicContact CB-CE3 3.96Å; F395-W428 HydrophobicContact CB-CH2 4.41Å; F395-W428 HydrophobicContact CB-CZ3 3.44Å; F395-W428 VanDerWaalsContact CB-CZ3 3.44Å; F395-W428 AromaticContact CD1-CE3 3.6Å; F395-W428 HydrophobicContact CD1-CE3 3.6Å; F395-W428 AromaticContact CD1-CZ3 3.71Å; F395-W428 HydrophobicContact CD1-CZ3 3.71Å; F395-W428 AromaticContact CD2-CE3 3.75Å; F395-W428 HydrophobicContact CD2-CE3 3.75Å; F395-W428 HydrophobicContact CD2-CZ3 4.15Å; F395-W428 AromaticContact CE1-CE3 3.95Å; F395-W428 HydrophobicContact CE1-CE3 3.95Å; F395-W428 HydrophobicContact CE1-CZ3 4.49Å; F395-W428 HydrophobicContact CE2-CE3 4.08Å; F395-W428 AromaticContact CG-CE3 3.49Å; F395-W428 HydrophobicContact CG-CE3 3.49Å; F395-W428 VanDerWaalsContact CG-CE3 3.49Å; F395-W428 AromaticContact CG-CZ3 3.51Å; F395-W428 HydrophobicContact CG-CZ3 3.51Å; F395-W428 HydrophobicContact CZ-CB 4.49Å; F395-W428 HydrophobicContact CZ-CE3 4.17Å; F395-F431 HydrophobicContact CB-CD1 4.34Å; F395-F431 HydrophobicContact CB-CE1 4.28Å; F395-F431 HydrophobicContact CD2-CB 3.68Å; F395-F431 AromaticContact CD2-CD1 3.67Å; F395-F431 HydrophobicContact CD2-CD1 3.67Å; F395-F431 HydrophobicContact CD2-CD2 4.27Å; F395-F431 HydrophobicContact CD2-CE1 4.37Å; F395-F431 AromaticContact CD2-CG 3.59Å; F395-F431 HydrophobicContact CD2-CG 3.59Å; F395-F431 HydrophobicContact CE2-CB 3.71Å; F395-F431 HydrophobicContact CE2-CG 4.16Å; F395-F431 HydrophobicContact CG-CD1 4.48Å
396	V	87	Confident	81.4	Confident	8 Å²	8	57.1 Å²	57.1	5%	0.048	28%	0.284	C	S	.	.	I	π-helix	trans	-66.2	-50.5	179.5	172.4	0	0	0	0	111.5	A368 I369 I372 V392 E393 K401 V405	A368-V396 HydrophobicContact CB-CG1 4.12Å; I369-V396 HydrophobicContact CG1-CB 4.45Å; I369-V396 HydrophobicContact CG1-CG1 4.26Å; I372-V396 HydrophobicContact CB-CG2 4.1Å; I372-V396 HydrophobicContact CG1-CG2 3.83Å; I372-V396 HydrophobicContact CG2-CG2 4.29Å; V392-V396 HydrophobicContact CG1-CG2 4.25Å; V392-V396 WeakPolarHBondContact O-CB 3.49Å; V392-V396 VanDerWaalsContact O-CG2 3.31Å; V392-V396 WeakPolarHBondContact O-CG2 3.35Å; V392-V396 PolarHBondContact O-N 3.46Å; E393-V396 PolarHBondContact O-N 2.97Å; V396-K401 VanDerWaalsContact O-CA 3.29Å; V396-K401 WeakPolarHBondContact O-CA 3.22Å; V396-K401 PolarHBondContact O-N 2.9Å; V396-V405 HydrophobicContact CG1-CG2 4.1Å
397	C	83.8	Confident	82.7	Confident	80 Å²	80	48.9 Å²	48.9	54%	0.541	25%	0.246	S	C	.	.	I	π-helix	trans	-79	-35.5	-173	-68.7	0	0	0	0	113.7	E393	E393-C397 VanDerWaalsContact O-CB 3.23Å; E393-C397 WeakPolarHBondContact O-CB 3.41Å; E393-C397 PolarHBondContact O-N 3.44Å; E393-C397 PolarHBondContact O-SG 3.48Å
398	S	76.6	Confident	83.9	Confident	72 Å²	72	41.7 Å²	41.7	50%	0.503	21%	0.212	S	C	.	.	I	π-helix	trans	-97.2	-42.9	-172.6	-52.8	0	0	0	0	113	R394	R394-S398 WeakPolarHBondContact O-CA 3.34Å; R394-S398 WeakPolarHBondContact O-CB 3.5Å; R394-S398 PolarHBondContact O-N 3.31Å; R394-S398 PolarHBondContact O-OG 2.93Å
399	Y	82.5	Confident	84.8	Confident	35 Å²	35	41.3 Å²	41.3	14%	0.137	21%	0.207	C	C	.	.	I	π-helix	trans	-95.8	-63.8	-172	-177.5	-106.7	0	0	0	112.1	Q216 L219 F395 F431 I434	Q216-Y399 WeakPolarHBondContact CG-OH 3.41Å; L219-Y399 HydrophobicContact CD1-CE1 4.3Å; F395-Y399 AromaticContact CD2-CD1 3.82Å; F395-Y399 HydrophobicContact CD2-CD1 3.82Å; F395-Y399 HydrophobicContact CD2-CG 4.42Å; F395-Y399 AromaticContact CE2-CD1 3.44Å; F395-Y399 HydrophobicContact CE2-CD1 3.44Å; F395-Y399 VanDerWaalsContact CE2-CD1 3.44Å; F395-Y399 AromaticContact CE2-CE1 3.87Å; F395-Y399 HydrophobicContact CE2-CE1 3.87Å; F395-Y399 HydrophobicContact CE2-CG 4.43Å; F395-Y399 HydrophobicContact CZ-CD1 4.22Å; F395-Y399 WeakPolarHBondContact O-CB 3.44Å; F395-Y399 PolarHBondContact O-N 3.4Å; Y399-F431 VanDerWaalsContact CB-CD2 3.45Å; Y399-F431 HydrophobicContact CD1-CB 4.04Å; Y399-F431 HydrophobicContact CD1-CD2 4.07Å; Y399-F431 HydrophobicContact CD1-CG 4.33Å; Y399-F431 AromaticContact CD2-CD2 3.57Å; Y399-F431 HydrophobicContact CD2-CD2 3.57Å; Y399-F431 HydrophobicContact CD2-CE2 4.31Å; Y399-F431 HydrophobicContact CD2-CG 4.48Å; Y399-F431 HydrophobicContact CE1-CB 4.07Å; Y399-F431 HydrophobicContact CE2-CD2 4.26Å; Y399-F431 HydrophobicContact CG-CB 4.24Å; Y399-F431 AromaticContact CG-CD2 3.43Å; Y399-F431 HydrophobicContact CG-CD2 3.43Å; Y399-F431 VanDerWaalsContact CG-CD2 3.43Å; Y399-F431 HydrophobicContact CG-CE2 4.13Å; Y399-F431 HydrophobicContact CG-CG 4.14Å; Y399-I434 HydrophobicContact CE2-CD1 4.02Å
400	L	84.8	Confident	85.3	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.182	C	C	.	.	I	π-helix	trans	-74.5	-38.2	-171.6	-168.8	61.6	0	0	0	111.9	L219 I372 F395 G404 V405 L408 L427	L219-L400 HydrophobicContact CD1-CD1 4.1Å; L219-L400 VanDerWaalsContact CD2-O 3.29Å; L219-L400 WeakPolarHBondContact CD2-O 3.3Å; I372-L400 HydrophobicContact CD1-CD2 3.99Å; F395-L400 HydrophobicContact CE1-CB 4.39Å; F395-L400 HydrophobicContact CE1-CD2 4.01Å; F395-L400 PolarHBondContact O-N 3.37Å; L400-G404 VanDerWaalsContact CG-C 3.5Å; L400-G404 VanDerWaalsContact O-CA 3.28Å; L400-G404 WeakPolarHBondContact O-CA 3.42Å; L400-G404 PolarHBondContact O-N 3.48Å; L400-G404 VanDerWaalsContact O-N 3.17Å; L400-V405 HydrophobicContact CB-CG2 4.46Å; L400-V405 HydrophobicContact CD2-CB 4.3Å; L400-V405 HydrophobicContact CD2-CG2 3.54Å; L400-V405 HydrophobicContact CG-CG2 3.95Å; L400-L408 HydrophobicContact CD2-CD2 4.48Å; L400-L427 HydrophobicContact CD1-CD1 4.5Å
401	K	84.8	Confident	85.9	Confident	23 Å²	23	27.5 Å²	27.5	10%	0.1	15%	0.147	C	C	.	.	H	α-helix	trans	59.8	169.7	-177.2	-62.6	-172.8	-169.2	164.7	0	112	S245 V396 D403 G404 V405	S245-K401 PolarHBondContact OG-NZ 3.42Å; V396-K401 VanDerWaalsContact O-CA 3.29Å; V396-K401 WeakPolarHBondContact O-CA 3.22Å; V396-K401 PolarHBondContact O-N 2.9Å; K401-D403 VanDerWaalsContact C-N 3.31Å; K401-D403 PolarHBondContact O-N 3.29Å; K401-G404 PolarHBondContact O-N 2.92Å; K401-V405 WeakPolarHBondContact O-CG2 3.28Å; K401-V405 PolarHBondContact O-N 3.33Å; K401-V405 VanDerWaalsContact O-N 3.12Å
402	P	85.8	Confident	86.3	Confident	58 Å²	58	25.7 Å²	25.7	38%	0.377	14%	0.138	S	C	.	.	H	α-helix	trans	-56.4	-40.4	179.5	19	-35	0	0	0	113.8	F246 G404 V405 F406	F246-P402 HydrophobicContact CB-CG 4.37Å; F246-P402 HydrophobicContact CD2-CB 3.73Å; F246-P402 HydrophobicContact CD2-CG 3.6Å; F246-P402 HydrophobicContact CE2-CB 4.12Å; F246-P402 HydrophobicContact CE2-CG 4.41Å; F246-P402 HydrophobicContact CG-CG 4.44Å; P402-G404 PolarHBondContact O-N 3.26Å; P402-V405 PolarHBondContact O-N 2.65Å; P402-F406 WeakPolarHBondContact O-CB 3.4Å; P402-F406 PolarHBondContact O-N 3.15Å
403	D	87.2	Confident	86.4	Confident	4 Å²	4	30 Å²	30	2%	0.021	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-42	179.1	-75.4	-14.5	0	0	0	112.4	S245 F246 Y247 V248 C249 K401 F406 V407	S245-D403 VanDerWaalsContact O-OD2 3.14Å; F246-D403 VanDerWaalsContact C-OD1 3.28Å; F246-D403 WeakPolarHBondContact CA-OD1 3.48Å; F246-D403 WeakPolarHBondContact CA-OD2 3.49Å; F246-D403 PolarHBondContact N-OD2 2.88Å; Y247-D403 PolarHBondContact N-OD2 3.18Å; V248-D403 HydrophobicContact CB-CB 4.48Å; V248-D403 PolarHBondContact N-OD1 2.95Å; V248-D403 PolarHBondContact N-OD2 3.14Å; C249-D403 WeakPolarHBondContact CB-OD1 3.49Å; C249-D403 PolarHBondContact N-OD1 3.43Å; C249-D403 PolarHBondContact SG-OD1 3.07Å; K401-D403 VanDerWaalsContact C-N 3.31Å; K401-D403 PolarHBondContact O-N 3.29Å; D403-F406 PolarHBondContact O-N 3Å; D403-V407 WeakPolarHBondContact O-CG2 3.21Å; D403-V407 PolarHBondContact O-N 3.36Å
404	G	87.9	Confident	86.5	Confident	5 Å²	5	30.5 Å²	30.5	5%	0.052	16%	0.159	C	C	.	.	H	α-helix	trans	-69	-37.4	177.3	0	0	0	0	0	112.8	L400 K401 P402 F406 V407 L408	L400-G404 VanDerWaalsContact CG-C 3.5Å; L400-G404 VanDerWaalsContact O-CA 3.28Å; L400-G404 WeakPolarHBondContact O-CA 3.42Å; L400-G404 PolarHBondContact O-N 3.48Å; L400-G404 VanDerWaalsContact O-N 3.17Å; K401-G404 PolarHBondContact O-N 2.92Å; P402-G404 PolarHBondContact O-N 3.26Å; G404-F406 VanDerWaalsContact C-N 3.32Å; G404-V407 PolarHBondContact O-N 3.39Å; G404-L408 WeakPolarHBondContact O-CB 3.3Å; G404-L408 PolarHBondContact O-N 3.06Å
405	V	91	Very high	86.6	Confident	7 Å²	7	25.3 Å²	25.3	4%	0.042	14%	0.141	C	C	.	.	H	α-helix	trans	-64.9	-41.1	174.5	176.9	0	0	0	0	110.2	A368 F371 V396 L400 K401 P402 L408 R409	A368-V405 HydrophobicContact CB-CG1 3.84Å; A368-V405 HydrophobicContact CB-CG2 4.34Å; F371-V405 HydrophobicContact CD1-CG1 4.45Å; V396-V405 HydrophobicContact CG1-CG2 4.1Å; L400-V405 HydrophobicContact CB-CG2 4.46Å; L400-V405 HydrophobicContact CD2-CB 4.3Å; L400-V405 HydrophobicContact CD2-CG2 3.54Å; L400-V405 HydrophobicContact CG-CG2 3.95Å; K401-V405 WeakPolarHBondContact O-CG2 3.28Å; K401-V405 PolarHBondContact O-N 3.33Å; K401-V405 VanDerWaalsContact O-N 3.12Å; P402-V405 PolarHBondContact O-N 2.65Å; V405-L408 PolarHBondContact O-N 3.02Å; V405-R409 WeakPolarHBondContact O-CB 3.28Å; V405-R409 PolarHBondContact O-N 3.3Å
406	F	90.3	Very high	86.5	Confident	6 Å²	6	31.2 Å²	31.2	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-61.9	-48.2	177.3	173.7	-100	0	0	0	111.7	W175 V248 C249 Y252 W358 I362 P402 D403 G404 L408 R409 L410	W175-F406 HydrophobicContact CH2-CE1 4.35Å; V248-F406 HydrophobicContact CG1-CD1 3.91Å; V248-F406 HydrophobicContact CG1-CE1 3.88Å; C249-F406 WeakPolarHBondContact SG-CB 3.46Å; Y252-F406 AromaticContact CD1-CE2 3.46Å; Y252-F406 HydrophobicContact CD1-CE2 3.46Å; Y252-F406 VanDerWaalsContact CD1-CE2 3.46Å; Y252-F406 AromaticContact CD1-CZ 3.54Å; Y252-F406 HydrophobicContact CD1-CZ 3.54Å; Y252-F406 HydrophobicContact CD2-CE2 4.49Å; Y252-F406 AromaticContact CD2-CZ 3.75Å; Y252-F406 HydrophobicContact CD2-CZ 3.75Å; Y252-F406 AromaticContact CE1-CE2 3.79Å; Y252-F406 HydrophobicContact CE1-CE2 3.79Å; Y252-F406 AromaticContact CE1-CZ 3.98Å; Y252-F406 HydrophobicContact CE1-CZ 3.98Å; Y252-F406 HydrophobicContact CE2-CZ 4.18Å; Y252-F406 HydrophobicContact CG-CE1 4.34Å; Y252-F406 AromaticContact CG-CE2 3.85Å; Y252-F406 HydrophobicContact CG-CE2 3.85Å; Y252-F406 AromaticContact CG-CZ 3.41Å; Y252-F406 HydrophobicContact CG-CZ 3.41Å; Y252-F406 VanDerWaalsContact CG-CZ 3.41Å; W358-F406 HydrophobicContact CE3-CD2 4.27Å; W358-F406 AromaticContact CE3-CE2 3.87Å; W358-F406 HydrophobicContact CE3-CE2 3.87Å; W358-F406 HydrophobicContact CH2-CE2 4.17Å; W358-F406 AromaticContact CZ3-CD2 3.8Å; W358-F406 HydrophobicContact CZ3-CD2 3.8Å; W358-F406 AromaticContact CZ3-CE2 3.48Å; W358-F406 HydrophobicContact CZ3-CE2 3.48Å; W358-F406 VanDerWaalsContact CZ3-CE2 3.48Å; I362-F406 HydrophobicContact CD1-CD2 3.88Å; I362-F406 HydrophobicContact CD1-CE2 3.98Å; I362-F406 HydrophobicContact CG1-CD2 4.21Å; P402-F406 WeakPolarHBondContact O-CB 3.4Å; P402-F406 PolarHBondContact O-N 3.15Å; D403-F406 PolarHBondContact O-N 3Å; G404-F406 VanDerWaalsContact C-N 3.32Å; F406-L408 VanDerWaalsContact C-N 3.34Å; F406-L408 PolarHBondContact O-N 3.49Å; F406-R409 PolarHBondContact O-N 3.39Å; F406-L410 WeakPolarHBondContact O-CB 3.49Å; F406-L410 PolarHBondContact O-N 3.09Å
407	V	89.2	Confident	86.5	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.03	19%	0.193	C	C	.	.	H	α-helix	trans	-60.3	-44.3	176.6	172.5	0	0	0	0	111.1	I184 V186 I189 D403 G404 R409 L410 I411	I184-V407 HydrophobicContact CG2-CG2 4.1Å; V186-V407 HydrophobicContact CG2-CG2 4.35Å; I189-V407 HydrophobicContact CD1-CG1 4.29Å; I189-V407 HydrophobicContact CG2-CG1 4.04Å; D403-V407 WeakPolarHBondContact O-CG2 3.21Å; D403-V407 PolarHBondContact O-N 3.36Å; G404-V407 PolarHBondContact O-N 3.39Å; V407-R409 VanDerWaalsContact C-N 3.35Å; V407-R409 PolarHBondContact O-N 3.35Å; V407-L410 WeakPolarHBondContact O-CB 3.44Å; V407-L410 PolarHBondContact O-N 2.8Å; V407-I411 HydrophobicContact CG1-CD1 3.99Å; V407-I411 WeakPolarHBondContact O-CG1 3.46Å; V407-I411 PolarHBondContact O-N 3.1Å
408	L	90.4	Very high	86.6	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-63.5	-41.6	178.2	-174.7	66.7	0	0	0	111.9	F371 I372 L400 G404 V405 F406 L410 I411 T412 L423 L424	F371-L408 HydrophobicContact CE1-CD2 4.13Å; F371-L408 HydrophobicContact CE1-CG 4.24Å; I372-L408 HydrophobicContact CD1-CD2 3.58Å; L400-L408 HydrophobicContact CD2-CD2 4.48Å; G404-L408 WeakPolarHBondContact O-CB 3.3Å; G404-L408 PolarHBondContact O-N 3.06Å; V405-L408 PolarHBondContact O-N 3.02Å; F406-L408 VanDerWaalsContact C-N 3.34Å; F406-L408 PolarHBondContact O-N 3.49Å; L408-L410 VanDerWaalsContact C-N 3.3Å; L408-L410 PolarHBondContact O-N 3.4Å; L408-I411 PolarHBondContact O-N 2.85Å; L408-T412 WeakPolarHBondContact O-CG2 3.36Å; L408-T412 PolarHBondContact O-N 2.92Å; L408-T412 PolarHBondContact O-OG1 2.8Å; L408-L423 HydrophobicContact CD1-CD2 4.06Å; L408-L423 HydrophobicContact CD1-CG 4.41Å; L408-L424 HydrophobicContact CD1-CB 4.37Å; L408-L424 HydrophobicContact CD2-CB 3.93Å; L408-L424 HydrophobicContact CD2-CD1 3.62Å; L408-L424 HydrophobicContact CD2-CD2 4.3Å; L408-L424 HydrophobicContact CD2-CG 4.14Å
409	R	90.7	Very high	87.2	Confident	18 Å²	18	33.2 Å²	33.2	7%	0.068	17%	0.17	C	C	.	.	H	α-helix	trans	-63	-37.7	174.5	-175.6	177.8	-70	-130.2	4.7	111.8	P367 F371 V405 F406 V407 T412 L413	P367-R409 PolarHBondContact O-NH2 3.23Å; P367-R409 VanDerWaalsContact O-NH2 3.08Å; F371-R409 HydrophobicContact CE1-CB 4.29Å; F371-R409 HydrophobicContact CE2-CB 4.36Å; F371-R409 HydrophobicContact CE2-CG 4.19Å; F371-R409 HydrophobicContact CZ-CB 3.99Å; F371-R409 HydrophobicContact CZ-CG 4.31Å; V405-R409 WeakPolarHBondContact O-CB 3.28Å; V405-R409 PolarHBondContact O-N 3.3Å; F406-R409 PolarHBondContact O-N 3.39Å; V407-R409 VanDerWaalsContact C-N 3.35Å; V407-R409 PolarHBondContact O-N 3.35Å; R409-T412 PolarHBondContact O-N 2.75Å; R409-T412 PolarHBondContact O-OG1 3.25Å; R409-T412 VanDerWaalsContact O-OG1 3.08Å; R409-L413 HydrophobicContact CG-CD1 4.15Å; R409-L413 WeakPolarHBondContact O-CB 3.41Å; R409-L413 WeakPolarHBondContact O-CG 3.44Å; R409-L413 PolarHBondContact O-N 2.89Å
410	L	88.3	Confident	87.5	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-43.1	176.6	-162.6	63.4	0	0	0	111.6	D72 V186 V190 F406 V407 L408 L413 R414	D72-L410 HydrophobicContact CB-CD2 4.24Å; D72-L410 VanDerWaalsContact O-CD1 3.23Å; D72-L410 WeakPolarHBondContact O-CD1 3.41Å; V186-L410 HydrophobicContact CG1-CD2 3.35Å; V190-L410 HydrophobicContact CG2-CD2 3.87Å; V190-L410 HydrophobicContact CG2-CG 4.04Å; F406-L410 WeakPolarHBondContact O-CB 3.49Å; F406-L410 PolarHBondContact O-N 3.09Å; V407-L410 WeakPolarHBondContact O-CB 3.44Å; V407-L410 PolarHBondContact O-N 2.8Å; L408-L410 VanDerWaalsContact C-N 3.3Å; L408-L410 PolarHBondContact O-N 3.4Å; L410-L413 PolarHBondContact O-N 3.2Å; L410-R414 WeakPolarHBondContact O-CG 3.26Å; L410-R414 PolarHBondContact O-N 2.99Å
411	I	89.1	Confident	87.7	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-46.5	175.1	-66.4	161.9	0	0	0	110.3	I189 L211 V407 L408 L413 R414 S415 F419 L423	I189-I411 HydrophobicContact CG2-CD1 3.55Å; I189-I411 HydrophobicContact CG2-CG1 3.89Å; L211-I411 HydrophobicContact CD2-CD1 4.13Å; V407-I411 HydrophobicContact CG1-CD1 3.99Å; V407-I411 WeakPolarHBondContact O-CG1 3.46Å; V407-I411 PolarHBondContact O-N 3.1Å; L408-I411 PolarHBondContact O-N 2.85Å; I411-L413 VanDerWaalsContact C-N 3.28Å; I411-L413 PolarHBondContact O-N 3.41Å; I411-R414 PolarHBondContact O-N 3.35Å; I411-S415 WeakPolarHBondContact CG2-OG 3.47Å; I411-S415 WeakPolarHBondContact O-CB 3.29Å; I411-S415 PolarHBondContact O-N 2.87Å; I411-S415 PolarHBondContact O-OG 3.12Å; I411-F419 HydrophobicContact CG2-CD1 4.08Å; I411-F419 HydrophobicContact CG2-CE1 4.3Å; I411-L423 HydrophobicContact CD1-CD2 3.59Å; I411-L423 HydrophobicContact CG2-CD2 4.5Å
412	T	88.6	Confident	87.8	Confident	20 Å²	20	33.5 Å²	33.5	12%	0.123	18%	0.175	C	C	.	.	H	α-helix	trans	-70.6	-23.1	-177.4	65.6	0	0	0	0	113.5	F371 L408 R409	F371-T412 HydrophobicContact CZ-CG2 4.02Å; F371-T412 WeakPolarHBondContact CZ-OG1 3.27Å; L408-T412 WeakPolarHBondContact O-CG2 3.36Å; L408-T412 PolarHBondContact O-N 2.92Å; L408-T412 PolarHBondContact O-OG1 2.8Å; R409-T412 PolarHBondContact O-N 2.75Å; R409-T412 PolarHBondContact O-OG1 3.25Å; R409-T412 VanDerWaalsContact O-OG1 3.08Å
413	L	86	Confident	88	Confident	91 Å²	91	30.7 Å²	30.7	48%	0.476	16%	0.157	S	C	.	.	H	α-helix	trans	-76.3	-23.2	173	-74.2	170	0	0	0	113.3	W358 R409 L410 I411	W358-L413 HydrophobicContact CH2-CD1 3.65Å; W358-L413 HydrophobicContact CZ2-CD1 3.83Å; R409-L413 HydrophobicContact CG-CD1 4.15Å; R409-L413 WeakPolarHBondContact O-CB 3.41Å; R409-L413 WeakPolarHBondContact O-CG 3.44Å; R409-L413 PolarHBondContact O-N 2.89Å; L410-L413 PolarHBondContact O-N 3.2Å; I411-L413 VanDerWaalsContact C-N 3.28Å; I411-L413 PolarHBondContact O-N 3.41Å
414	R	85.3	Confident	88.1	Confident	83 Å²	83	30.6 Å²	30.6	31%	0.313	16%	0.156	S	C	.	.	H	α-helix	trans	-108.3	-39.8	-175	-62.6	-58	175.7	-172.4	-23.2	114.4	R71 E73 D74 V190 V194 L410 I411	R71-R414 WeakPolarHBondContact O-CD 3.43Å; R71-R414 WeakPolarHBondContact O-CG 3.33Å; R71-R414 PolarHBondContact O-NE 3.09Å; E73-R414 PolarHBondContact O-NH1 3.19Å; E73-R414 PolarHBondContact O-NH2 2.74Å; D74-R414 VanDerWaalsContact CA-NH2 3.33Å; V190-R414 HydrophobicContact CG1-CB 4.01Å; V190-R414 HydrophobicContact CG1-CG 4.01Å; V194-R414 HydrophobicContact CG2-CB 3.69Å; L410-R414 WeakPolarHBondContact O-CG 3.26Å; L410-R414 PolarHBondContact O-N 2.99Å; I411-R414 PolarHBondContact O-N 3.35Å
415	S	84.5	Confident	88	Confident	12 Å²	12	30.8 Å²	30.8	8%	0.084	16%	0.157	C	C	.	.	S	Bend	trans	-89	171.1	175.7	71.3	0	0	0	0	110.5	S193 I411	S193-S415 WeakPolarHBondContact O-CB 3.11Å; I411-S415 WeakPolarHBondContact CG2-OG 3.47Å; I411-S415 WeakPolarHBondContact O-CB 3.29Å; I411-S415 PolarHBondContact O-N 2.87Å; I411-S415 PolarHBondContact O-OG 3.12Å
416	N	83.4	Confident	87.7	Confident	123 Å²	123	31 Å²	31	66%	0.658	16%	0.158	S	C	*	.			trans	-61.3	138.7	171.7	-64.2	-29.5	0	0	0	109.8	I418 F419 G420	N416-I418 PolarHBondContact O-N 3.12Å; N416-F419 WeakPolarHBondContact O-CB 3.26Å; N416-F419 PolarHBondContact O-N 3.18Å; N416-G420 PolarHBondContact O-N 3.23Å
417	I	86.1	Confident	87.5	Confident	92 Å²	92	30.8 Å²	30.8	47%	0.472	16%	0.157	S	C	.	.	H	α-helix	trans	-51.8	-34.7	-178.9	-162.5	165.4	0	0	0	112.6	L378 F419 G420 T421	L378-I417 HydrophobicContact CD2-CD1 4.19Å; L378-I417 HydrophobicContact CD2-CG1 4.42Å; I417-F419 PolarHBondContact O-N 3.34Å; I417-G420 PolarHBondContact O-N 3.06Å; I417-T421 WeakPolarHBondContact O-CG2 3.34Å; I417-T421 PolarHBondContact O-N 3.43Å; I417-T421 PolarHBondContact O-OG1 3.45Å
418	I	86.3	Confident	87.3	Confident	102 Å²	102	31.4 Å²	31.4	52%	0.523	16%	0.159	S	C	.	.	H	α-helix	trans	-61.8	-41.2	177.2	-56.9	169.8	0	0	0	111.8	N416 G420 T421 D422	N416-I418 PolarHBondContact O-N 3.12Å; I418-G420 VanDerWaalsContact C-N 3.34Å; I418-T421 WeakPolarHBondContact CA-OG1 3.35Å; I418-T421 PolarHBondContact O-N 3.36Å; I418-T421 PolarHBondContact O-OG1 3.42Å; I418-D422 WeakPolarHBondContact O-CB 3.37Å; I418-D422 PolarHBondContact O-N 2.98Å
419	F	88.5	Confident	86.8	Confident	9 Å²	9	31.5 Å²	31.5	4%	0.039	16%	0.16	C	C	.	.	H	α-helix	trans	-66	-42	177.8	-174.7	-88.4	0	0	0	110.7	N198 K204 L208 L211 I411 N416 I417 D422 L423	N198-F419 HydrophobicContact CB-CD2 4.5Å; K204-F419 HydrophobicContact CD-CD2 4.42Å; K204-F419 HydrophobicContact CG-CD2 3.94Å; K204-F419 HydrophobicContact CG-CE2 4.05Å; L208-F419 HydrophobicContact CD2-CD1 4.49Å; L208-F419 HydrophobicContact CD2-CD2 4.2Å; L208-F419 HydrophobicContact CD2-CE1 4.08Å; L208-F419 HydrophobicContact CD2-CE2 3.77Å; L208-F419 HydrophobicContact CD2-CZ 3.7Å; L208-F419 HydrophobicContact CG-CD2 4.4Å; L208-F419 HydrophobicContact CG-CE2 3.82Å; L208-F419 HydrophobicContact CG-CZ 4.11Å; L211-F419 HydrophobicContact CD2-CE1 4.13Å; L211-F419 HydrophobicContact CD2-CZ 4.45Å; I411-F419 HydrophobicContact CG2-CD1 4.08Å; I411-F419 HydrophobicContact CG2-CE1 4.3Å; N416-F419 WeakPolarHBondContact O-CB 3.26Å; N416-F419 PolarHBondContact O-N 3.18Å; I417-F419 PolarHBondContact O-N 3.34Å; F419-D422 PolarHBondContact O-N 3.3Å; F419-L423 WeakPolarHBondContact O-CB 3.18Å; F419-L423 PolarHBondContact O-N 2.7Å
420	G	89	Confident	86.2	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-44.3	175.2	0	0	0	0	0	113.6	N416 I417 I418 L424	N416-G420 PolarHBondContact O-N 3.23Å; I417-G420 PolarHBondContact O-N 3.06Å; I418-G420 VanDerWaalsContact C-N 3.34Å; G420-L424 PolarHBondContact O-N 2.91Å
421	T	88.8	Confident	85.7	Confident	8 Å²	8	32.4 Å²	32.4	5%	0.049	17%	0.167	C	C	.	.	H	α-helix	trans	-65	-43.7	176.5	50.8	0	0	0	0	111.8	H375 L378 I417 I418 L423 L424 V425	H375-T421 HydrophobicContact CB-CG2 4.13Å; L378-T421 HydrophobicContact CB-CG2 4.49Å; L378-T421 HydrophobicContact CD2-CG2 4.16Å; I417-T421 WeakPolarHBondContact O-CG2 3.34Å; I417-T421 PolarHBondContact O-N 3.43Å; I417-T421 PolarHBondContact O-OG1 3.45Å; I418-T421 WeakPolarHBondContact CA-OG1 3.35Å; I418-T421 PolarHBondContact O-N 3.36Å; I418-T421 PolarHBondContact O-OG1 3.42Å; T421-L423 VanDerWaalsContact C-N 3.33Å; T421-L423 PolarHBondContact O-N 3.16Å; T421-L424 WeakPolarHBondContact O-CB 3.37Å; T421-L424 PolarHBondContact O-N 3.23Å; T421-V425 VanDerWaalsContact O-CG2 3.3Å; T421-V425 WeakPolarHBondContact O-CG2 3.38Å; T421-V425 PolarHBondContact O-N 3Å
422	D	87.4	Confident	85	Confident	56 Å²	56	35.4 Å²	35.4	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-64.2	-39.2	-179.9	-68.7	-15.1	0	0	0	111.8	K204 L208 I418 F419 V425 S426	K204-D422 WeakPolarHBondContact CE-OD2 3.43Å; K204-D422 IonicContact NZ-OD2 2.85Å; K204-D422 PolarHBondContact NZ-OD2 3.4Å; L208-D422 HydrophobicContact CD1-CB 3.83Å; L208-D422 HydrophobicContact CD2-CB 4.39Å; I418-D422 WeakPolarHBondContact O-CB 3.37Å; I418-D422 PolarHBondContact O-N 2.98Å; F419-D422 PolarHBondContact O-N 3.3Å; D422-V425 PolarHBondContact O-N 2.84Å; D422-S426 WeakPolarHBondContact O-CB 3.49Å; D422-S426 PolarHBondContact O-N 3.17Å
423	L	89.4	Confident	84	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.1	-42.9	174	-176.6	65.7	0	0	0	111.8	L208 L211 I215 L408 I411 F419 T421 V425 S426 L427	L208-L423 HydrophobicContact CD2-CB 3.68Å; L208-L423 HydrophobicContact CD2-CD1 4.04Å; L208-L423 HydrophobicContact CD2-CG 4.44Å; L211-L423 HydrophobicContact CB-CD1 4.12Å; L211-L423 HydrophobicContact CD2-CD1 3.93Å; L211-L423 HydrophobicContact CD2-CD2 3.42Å; L211-L423 VanDerWaalsContact CD2-CD2 3.42Å; L211-L423 HydrophobicContact CD2-CG 4.3Å; L211-L423 HydrophobicContact CG-CD1 3.83Å; L211-L423 HydrophobicContact CG-CD2 3.95Å; I215-L423 HydrophobicContact CD1-CD2 4.05Å; L408-L423 HydrophobicContact CD1-CD2 4.06Å; L408-L423 HydrophobicContact CD1-CG 4.41Å; I411-L423 HydrophobicContact CD1-CD2 3.59Å; I411-L423 HydrophobicContact CG2-CD2 4.5Å; F419-L423 WeakPolarHBondContact O-CB 3.18Å; F419-L423 PolarHBondContact O-N 2.7Å; T421-L423 VanDerWaalsContact C-N 3.33Å; T421-L423 PolarHBondContact O-N 3.16Å; L423-V425 VanDerWaalsContact C-N 3.34Å; L423-S426 WeakPolarHBondContact O-CB 3.21Å; L423-S426 PolarHBondContact O-N 3.36Å; L423-L427 HydrophobicContact CG-CD1 4.36Å; L423-L427 WeakPolarHBondContact O-CG 2.96Å; L423-L427 PolarHBondContact O-N 3.19Å
424	L	90.2	Very high	83.1	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-45	175.6	174.4	59	0	0	0	111.3	I372 H375 L376 F395 L408 G420 T421 S426 L427 W428	I372-L424 HydrophobicContact CD1-CD1 3.81Å; I372-L424 HydrophobicContact CD1-CD2 4.16Å; I372-L424 HydrophobicContact CG2-CD1 4.2Å; I372-L424 HydrophobicContact CG2-CD2 4.26Å; H375-L424 HydrophobicContact CB-CD2 3.37Å; L376-L424 HydrophobicContact CD2-CD2 4.24Å; L376-L424 HydrophobicContact CD2-CG 4.21Å; L376-L424 HydrophobicContact CG-CD2 4.1Å; F395-L424 HydrophobicContact CE1-CD1 3.73Å; F395-L424 HydrophobicContact CZ-CD1 4.07Å; L408-L424 HydrophobicContact CD1-CB 4.37Å; L408-L424 HydrophobicContact CD2-CB 3.93Å; L408-L424 HydrophobicContact CD2-CD1 3.62Å; L408-L424 HydrophobicContact CD2-CD2 4.3Å; L408-L424 HydrophobicContact CD2-CG 4.14Å; G420-L424 PolarHBondContact O-N 2.91Å; T421-L424 WeakPolarHBondContact O-CB 3.37Å; T421-L424 PolarHBondContact O-N 3.23Å; L424-S426 VanDerWaalsContact C-N 3.33Å; L424-S426 PolarHBondContact O-N 3.42Å; L424-L427 PolarHBondContact O-N 3.48Å; L424-W428 WeakPolarHBondContact O-CB 3.45Å; L424-W428 PolarHBondContact O-N 3.37Å
425	V	85.5	Confident	81.9	Confident	10 Å²	10	30.4 Å²	30.4	6%	0.061	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-40.9	178.3	172.9	0	0	0	0	111.1	S379 M381 T421 D422 L423 W428 C429 L459	S379-V425 VanDerWaalsContact CB-CG2 3.48Å; M381-V425 HydrophobicContact CE-CB 4.43Å; M381-V425 HydrophobicContact CE-CG1 3.73Å; M381-V425 HydrophobicContact CE-CG2 4.17Å; M381-V425 HydrophobicContact CG-CG1 4.31Å; M381-V425 HydrophobicContact SD-CG1 3.74Å; T421-V425 VanDerWaalsContact O-CG2 3.3Å; T421-V425 WeakPolarHBondContact O-CG2 3.38Å; T421-V425 PolarHBondContact O-N 3Å; D422-V425 PolarHBondContact O-N 2.84Å; L423-V425 VanDerWaalsContact C-N 3.34Å; V425-W428 PolarHBondContact O-N 2.93Å; V425-C429 WeakPolarHBondContact O-CB 3.43Å; V425-C429 PolarHBondContact O-N 3.29Å; V425-C429 PolarHBondContact O-SG 3.5Å; V425-L459 HydrophobicContact CG1-CD1 3.8Å; V425-L459 HydrophobicContact CG1-CG 4.26Å
426	S	83.9	Confident	80.9	Confident	11 Å²	11	34.5 Å²	34.5	8%	0.077	18%	0.179	C	C	.	.	H	α-helix	trans	-59.7	-45.3	174.1	-177.5	0	0	0	0	111.8	T212 D422 L423 L424 S430	T212-S426 WeakPolarHBondContact CG2-OG 3.22Å; T212-S426 WeakPolarHBondContact OG1-CB 3.47Å; T212-S426 PolarHBondContact OG1-OG 3.19Å; D422-S426 WeakPolarHBondContact O-CB 3.49Å; D422-S426 PolarHBondContact O-N 3.17Å; L423-S426 WeakPolarHBondContact O-CB 3.21Å; L423-S426 PolarHBondContact O-N 3.36Å; L424-S426 VanDerWaalsContact C-N 3.33Å; L424-S426 PolarHBondContact O-N 3.42Å; S426-S430 PolarHBondContact O-N 2.92Å
427	L	86.7	Confident	79.4	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-65.6	-40.3	176	-71.2	169.3	0	0	0	112.4	T212 I215 Q216 F395 L400 L423 L424 S430 F431	T212-L427 HydrophobicContact CG2-CD2 4.12Å; I215-L427 HydrophobicContact CB-CD2 4.26Å; I215-L427 HydrophobicContact CD1-CD1 4.32Å; I215-L427 HydrophobicContact CG2-CD1 4.22Å; I215-L427 HydrophobicContact CG2-CD2 3.9Å; Q216-L427 HydrophobicContact CG-CD2 4.18Å; F395-L427 HydrophobicContact CZ-CB 4.23Å; L400-L427 HydrophobicContact CD1-CD1 4.5Å; L423-L427 HydrophobicContact CG-CD1 4.36Å; L423-L427 WeakPolarHBondContact O-CG 2.96Å; L423-L427 PolarHBondContact O-N 3.19Å; L424-L427 PolarHBondContact O-N 3.48Å; L427-S430 PolarHBondContact O-N 3.23Å; L427-F431 PolarHBondContact O-N 3.36Å
428	W	84.7	Confident	78	Confident	18 Å²	18	30.9 Å²	30.9	7%	0.068	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-51.4	176.1	-177.9	-94.1	0	0	0	111.4	L376 M381 F383 D391 V392 F395 L424 V425 S430 F431 Y432	L376-W428 HydrophobicContact CD1-CD2 4.02Å; L376-W428 HydrophobicContact CD1-CE3 3.76Å; L376-W428 HydrophobicContact CD1-CH2 3.95Å; L376-W428 HydrophobicContact CD1-CZ2 4.14Å; L376-W428 HydrophobicContact CD1-CZ3 3.73Å; L376-W428 HydrophobicContact CD2-CB 4.28Å; L376-W428 HydrophobicContact CD2-CD2 4.06Å; L376-W428 HydrophobicContact CD2-CE3 4.41Å; L376-W428 HydrophobicContact CD2-CG 4.04Å; M381-W428 HydrophobicContact CE-CG 4.47Å; F383-W428 HydrophobicContact CE2-CH2 4.46Å; F383-W428 HydrophobicContact CE2-CZ2 4.14Å; D391-W428 HydrophobicContact CB-CH2 4.28Å; V392-W428 HydrophobicContact CB-CH2 4.38Å; V392-W428 HydrophobicContact CG2-CH2 3.67Å; V392-W428 HydrophobicContact CG2-CZ3 4.11Å; F395-W428 HydrophobicContact CB-CE3 3.96Å; F395-W428 HydrophobicContact CB-CH2 4.41Å; F395-W428 HydrophobicContact CB-CZ3 3.44Å; F395-W428 VanDerWaalsContact CB-CZ3 3.44Å; F395-W428 AromaticContact CD1-CE3 3.6Å; F395-W428 HydrophobicContact CD1-CE3 3.6Å; F395-W428 AromaticContact CD1-CZ3 3.71Å; F395-W428 HydrophobicContact CD1-CZ3 3.71Å; F395-W428 AromaticContact CD2-CE3 3.75Å; F395-W428 HydrophobicContact CD2-CE3 3.75Å; F395-W428 HydrophobicContact CD2-CZ3 4.15Å; F395-W428 AromaticContact CE1-CE3 3.95Å; F395-W428 HydrophobicContact CE1-CE3 3.95Å; F395-W428 HydrophobicContact CE1-CZ3 4.49Å; F395-W428 HydrophobicContact CE2-CE3 4.08Å; F395-W428 AromaticContact CG-CE3 3.49Å; F395-W428 HydrophobicContact CG-CE3 3.49Å; F395-W428 VanDerWaalsContact CG-CE3 3.49Å; F395-W428 AromaticContact CG-CZ3 3.51Å; F395-W428 HydrophobicContact CG-CZ3 3.51Å; F395-W428 HydrophobicContact CZ-CB 4.49Å; F395-W428 HydrophobicContact CZ-CE3 4.17Å; L424-W428 WeakPolarHBondContact O-CB 3.45Å; L424-W428 PolarHBondContact O-N 3.37Å; V425-W428 PolarHBondContact O-N 2.93Å; W428-S430 VanDerWaalsContact C-N 3.27Å; W428-S430 PolarHBondContact O-N 3.35Å; W428-F431 WeakPolarHBondContact O-CB 2.95Å; W428-F431 PolarHBondContact O-N 3.42Å; W428-Y432 AromaticContact CD1-CD2 3.84Å; W428-Y432 AromaticContact CD1-CE2 3.94Å; W428-Y432 HydrophobicContact CD2-CD2 4.09Å; W428-Y432 AromaticContact CD2-CE2 3.66Å; W428-Y432 HydrophobicContact CD2-CE2 3.66Å; W428-Y432 AromaticContact CE2-CD2 3.79Å; W428-Y432 AromaticContact CE2-CE2 3.07Å; W428-Y432 AromaticContact CE2-CZ 3.85Å; W428-Y432 HydrophobicContact CE3-CE2 4.22Å; W428-Y432 HydrophobicContact CG-CD2 4.2Å; W428-Y432 HydrophobicContact CG-CE2 4.23Å; W428-Y432 AromaticContact CH2-CE2 3.78Å; W428-Y432 HydrophobicContact CH2-CE2 3.78Å; W428-Y432 HydrophobicContact CZ2-CD2 4.3Å; W428-Y432 AromaticContact CZ2-CE2 3.18Å; W428-Y432 HydrophobicContact CZ2-CE2 3.18Å; W428-Y432 AromaticContact CZ2-CZ 3.54Å; W428-Y432 WeakPolarHBondContact CZ2-OH 3.34Å; W428-Y432 HydrophobicContact CZ3-CE2 4.27Å; W428-Y432 AromaticContact NE1-CD2 3.57Å; W428-Y432 AromaticContact NE1-CE2 3.24Å; W428-Y432 AromaticContact NE1-CZ 4Å; W428-Y432 WeakPolarHBondContact O-CD2 3.25Å; W428-Y432 PolarHBondContact O-N 3.03Å
429	C	80.4	Confident	76.5	Confident	4 Å²	4	33.2 Å²	33.2	3%	0.027	16%	0.164	C	C	.	.	H	α-helix	trans	-56.4	-43.7	176.8	-71.9	0	0	0	0	111.5	V425 F431 Y432 G433	V425-C429 WeakPolarHBondContact O-CB 3.43Å; V425-C429 PolarHBondContact O-N 3.29Å; V425-C429 PolarHBondContact O-SG 3.5Å; C429-F431 VanDerWaalsContact C-N 3.33Å; C429-F431 PolarHBondContact O-N 3.3Å; C429-Y432 PolarHBondContact O-N 3.12Å; C429-G433 PolarHBondContact O-N 2.98Å
430	S	77.6	Confident	74.7	Confident	22 Å²	22	38.4 Å²	38.4	15%	0.154	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-32.6	177.4	-172.3	0	0	0	0	113.3	Q216 S426 L427 W428 I434	Q216-S430 PolarHBondContact NE2-OG 2.85Å; S426-S430 PolarHBondContact O-N 2.92Å; L427-S430 PolarHBondContact O-N 3.23Å; W428-S430 VanDerWaalsContact C-N 3.27Å; W428-S430 PolarHBondContact O-N 3.35Å; S430-I434 WeakPolarHBondContact O-CD1 3.24Å; S430-I434 WeakPolarHBondContact O-CG1 3.4Å; S430-I434 PolarHBondContact O-N 2.99Å
431	F	79.5	Confident	72.7	Confident	17 Å²	17	42 Å²	42	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-65.4	-47.7	174.5	170.9	-104.5	0	0	0	111.3	R394 F395 Y399 L427 W428 C429 G433 I434 E435	R394-F431 HydrophobicContact CG-CZ 4.27Å; F395-F431 HydrophobicContact CB-CD1 4.34Å; F395-F431 HydrophobicContact CB-CE1 4.28Å; F395-F431 HydrophobicContact CD2-CB 3.68Å; F395-F431 AromaticContact CD2-CD1 3.67Å; F395-F431 HydrophobicContact CD2-CD1 3.67Å; F395-F431 HydrophobicContact CD2-CD2 4.27Å; F395-F431 HydrophobicContact CD2-CE1 4.37Å; F395-F431 AromaticContact CD2-CG 3.59Å; F395-F431 HydrophobicContact CD2-CG 3.59Å; F395-F431 HydrophobicContact CE2-CB 3.71Å; F395-F431 HydrophobicContact CE2-CG 4.16Å; F395-F431 HydrophobicContact CG-CD1 4.48Å; Y399-F431 VanDerWaalsContact CB-CD2 3.45Å; Y399-F431 HydrophobicContact CD1-CB 4.04Å; Y399-F431 HydrophobicContact CD1-CD2 4.07Å; Y399-F431 HydrophobicContact CD1-CG 4.33Å; Y399-F431 AromaticContact CD2-CD2 3.57Å; Y399-F431 HydrophobicContact CD2-CD2 3.57Å; Y399-F431 HydrophobicContact CD2-CE2 4.31Å; Y399-F431 HydrophobicContact CD2-CG 4.48Å; Y399-F431 HydrophobicContact CE1-CB 4.07Å; Y399-F431 HydrophobicContact CE2-CD2 4.26Å; Y399-F431 HydrophobicContact CG-CB 4.24Å; Y399-F431 AromaticContact CG-CD2 3.43Å; Y399-F431 HydrophobicContact CG-CD2 3.43Å; Y399-F431 VanDerWaalsContact CG-CD2 3.43Å; Y399-F431 HydrophobicContact CG-CE2 4.13Å; Y399-F431 HydrophobicContact CG-CG 4.14Å; L427-F431 PolarHBondContact O-N 3.36Å; W428-F431 WeakPolarHBondContact O-CB 2.95Å; W428-F431 PolarHBondContact O-N 3.42Å; C429-F431 VanDerWaalsContact C-N 3.33Å; C429-F431 PolarHBondContact O-N 3.3Å; F431-G433 VanDerWaalsContact C-N 3.33Å; F431-G433 PolarHBondContact O-N 3.1Å; F431-I434 WeakPolarHBondContact O-CB 3.27Å; F431-I434 PolarHBondContact O-N 3.06Å; F431-I434 VanDerWaalsContact O-N 3.08Å; F431-E435 PolarHBondContact O-N 2.94Å
432	Y	72.5	Confident	70.4	Confident	63 Å²	63	44.8 Å²	44.8	25%	0.247	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-40.4	176.1	-85.3	-94	0	0	0	112.1	D391 W428 C429 I434 E435 Q436	D391-Y432 WeakPolarHBondContact CB-OH 3.18Å; D391-Y432 PolarHBondContact OD2-OH 3.35Å; W428-Y432 AromaticContact CD1-CD2 3.84Å; W428-Y432 AromaticContact CD1-CE2 3.94Å; W428-Y432 HydrophobicContact CD2-CD2 4.09Å; W428-Y432 AromaticContact CD2-CE2 3.66Å; W428-Y432 HydrophobicContact CD2-CE2 3.66Å; W428-Y432 AromaticContact CE2-CD2 3.79Å; W428-Y432 AromaticContact CE2-CE2 3.07Å; W428-Y432 AromaticContact CE2-CZ 3.85Å; W428-Y432 HydrophobicContact CE3-CE2 4.22Å; W428-Y432 HydrophobicContact CG-CD2 4.2Å; W428-Y432 HydrophobicContact CG-CE2 4.23Å; W428-Y432 AromaticContact CH2-CE2 3.78Å; W428-Y432 HydrophobicContact CH2-CE2 3.78Å; W428-Y432 HydrophobicContact CZ2-CD2 4.3Å; W428-Y432 AromaticContact CZ2-CE2 3.18Å; W428-Y432 HydrophobicContact CZ2-CE2 3.18Å; W428-Y432 AromaticContact CZ2-CZ 3.54Å; W428-Y432 WeakPolarHBondContact CZ2-OH 3.34Å; W428-Y432 HydrophobicContact CZ3-CE2 4.27Å; W428-Y432 AromaticContact NE1-CD2 3.57Å; W428-Y432 AromaticContact NE1-CE2 3.24Å; W428-Y432 AromaticContact NE1-CZ 4Å; W428-Y432 WeakPolarHBondContact O-CD2 3.25Å; W428-Y432 PolarHBondContact O-N 3.03Å; C429-Y432 PolarHBondContact O-N 3.12Å; Y432-I434 PolarHBondContact O-N 3.14Å; Y432-E435 PolarHBondContact O-N 2.99Å; Y432-E435 VanDerWaalsContact O-N 3.16Å; Y432-Q436 WeakPolarHBondContact O-CB 3.44Å; Y432-Q436 PolarHBondContact O-N 2.9Å
433	G	69.5	Low	68.4	Low	17 Å²	17	49.2 Å²	49.2	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-27.6	173.8	0	0	0	0	0	113.5	C429 F431 R437	C429-G433 PolarHBondContact O-N 2.98Å; F431-G433 VanDerWaalsContact C-N 3.33Å; F431-G433 PolarHBondContact O-N 3.1Å; G433-R437 WeakPolarHBondContact O-CG 3.38Å; G433-R437 PolarHBondContact O-NE 2.93Å
434	I	65.4	Low	66.1	Low	56 Å²	56	54.9 Å²	54.9	29%	0.287	29%	0.289	S	S	.	.	H	α-helix	trans	-76.5	-43.9	170.4	-68.3	160.7	0	0	0	110.2	Y399 S430 F431 Y432 Q436 R437 V438	Y399-I434 HydrophobicContact CE2-CD1 4.02Å; S430-I434 WeakPolarHBondContact O-CD1 3.24Å; S430-I434 WeakPolarHBondContact O-CG1 3.4Å; S430-I434 PolarHBondContact O-N 2.99Å; F431-I434 WeakPolarHBondContact O-CB 3.27Å; F431-I434 PolarHBondContact O-N 3.06Å; F431-I434 VanDerWaalsContact O-N 3.08Å; Y432-I434 PolarHBondContact O-N 3.14Å; I434-Q436 PolarHBondContact O-N 2.96Å; I434-R437 PolarHBondContact O-N 3.17Å; I434-V438 HydrophobicContact CG2-CG2 4.44Å; I434-V438 WeakPolarHBondContact O-CG2 3.45Å; I434-V438 PolarHBondContact O-N 3.43Å
435	E	61.5	Low	63.4	Low	17 Å²	17	59.9 Å²	59.9	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-40.6	-178.3	-162.4	-172	157.5	0	0	111.9	R394 F431 Y432 V438 K439	R394-E435 IonicContact CZ-OE1 3.5Å; R394-E435 IonicContact NH1-OE1 3.11Å; R394-E435 PolarHBondContact NH1-OE1 3.27Å; R394-E435 IonicContact NH1-OE2 2.7Å; R394-E435 IonicContact NH2-OE1 4Å; F431-E435 PolarHBondContact O-N 2.94Å; Y432-E435 PolarHBondContact O-N 2.99Å; Y432-E435 VanDerWaalsContact O-N 3.16Å; E435-V438 PolarHBondContact O-N 3.38Å; E435-K439 WeakPolarHBondContact O-CG 3.44Å; E435-K439 PolarHBondContact O-N 3.44Å; E435-K439 WeakPolarHBondContact OE1-CE 3.44Å; E435-K439 IonicContact OE1-NZ 3.77Å; E435-K439 PolarHBondContact OE1-NZ 3.28Å
436	Q	62.2	Low	61.4	Low	98 Å²	98	63.2 Å²	63.2	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-44.4	175.7	-173.3	173.4	-9.9	0	0	111.1	Y432 I434 V438 K439 E440	Y432-Q436 WeakPolarHBondContact O-CB 3.44Å; Y432-Q436 PolarHBondContact O-N 2.9Å; I434-Q436 PolarHBondContact O-N 2.96Å; Q436-V438 VanDerWaalsContact C-N 3.33Å; Q436-V438 PolarHBondContact O-N 3.33Å; Q436-K439 PolarHBondContact O-N 3.37Å; Q436-K439 VanDerWaalsContact O-N 3.14Å; Q436-E440 HydrophobicContact CG-CG 4.44Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.41Å; Q436-E440 PolarHBondContact NE2-OE1 2.75Å; Q436-E440 WeakPolarHBondContact O-CG 3.36Å; Q436-E440 PolarHBondContact O-N 3.02Å
437	R	52.4	Low	59.2	Low	67 Å²	67	67.3 Å²	67.3	25%	0.253	37%	0.373	S	S	.	.	H	α-helix	trans	-60.9	-39.6	174.4	-76.6	-176.3	-75.2	165.6	-8.8	113	G433 I434 K439 E440 N441	G433-R437 WeakPolarHBondContact O-CG 3.38Å; G433-R437 PolarHBondContact O-NE 2.93Å; I434-R437 PolarHBondContact O-N 3.17Å; R437-K439 VanDerWaalsContact C-N 3.33Å; R437-E440 PolarHBondContact O-N 3.36Å; R437-N441 WeakPolarHBondContact O-CB 3.17Å; R437-N441 PolarHBondContact O-N 3.43Å
438	V	56.8	Low	56.9	Low	72 Å²	72	71 Å²	71	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-66	-37.4	175.8	172.7	0	0	0	0	111.3	I434 E435 Q436 G442	I434-V438 HydrophobicContact CG2-CG2 4.44Å; I434-V438 WeakPolarHBondContact O-CG2 3.45Å; I434-V438 PolarHBondContact O-N 3.43Å; E435-V438 PolarHBondContact O-N 3.38Å; Q436-V438 VanDerWaalsContact C-N 3.33Å; Q436-V438 PolarHBondContact O-N 3.33Å; V438-G442 PolarHBondContact O-N 3.17Å
439	K	55.3	Low	54.9	Low	151 Å²	151	77.3 Å²	77.3	66%	0.657	42%	0.42	S	S	*	.	H	α-helix	trans	-69.5	-38.4	175.9	-74.7	177.1	-175.8	165.5	0	112.7	E435 Q436 R437	E435-K439 WeakPolarHBondContact O-CG 3.44Å; E435-K439 PolarHBondContact O-N 3.44Å; E435-K439 WeakPolarHBondContact OE1-CE 3.44Å; E435-K439 IonicContact OE1-NZ 3.77Å; E435-K439 PolarHBondContact OE1-NZ 3.28Å; Q436-K439 PolarHBondContact O-N 3.37Å; Q436-K439 VanDerWaalsContact O-N 3.14Å; R437-K439 VanDerWaalsContact C-N 3.33Å
440	E	49.8	Very low	52.9	Low	118 Å²	118	86.3 Å²	86.3	55%	0.551	46%	0.459	S	S	*	.	H	α-helix	trans	-76.7	-40.5	-177.7	-72.8	172.8	-176.5	0	0	112.6	Q436 R437	Q436-E440 HydrophobicContact CG-CG 4.44Å; Q436-E440 WeakPolarHBondContact CG-OE1 3.41Å; Q436-E440 PolarHBondContact NE2-OE1 2.75Å; Q436-E440 WeakPolarHBondContact O-CG 3.36Å; Q436-E440 PolarHBondContact O-N 3.02Å; R437-E440 PolarHBondContact O-N 3.36Å
441	N	47.8	Very low	50.9	Low	75 Å²	75	94.4 Å²	94.4	40%	0.401	49%	0.492	S	S	.	.	H	α-helix	trans	-104	-12.7	-168.7	-68.4	-10.2	0	0	0	115	R437 M443 E448	R437-N441 WeakPolarHBondContact O-CB 3.17Å; R437-N441 PolarHBondContact O-N 3.43Å; N441-M443 PolarHBondContact O-N 3.26Å; N441-E448 PolarHBondContact ND2-OE1 3.16Å; N441-E448 PolarHBondContact ND2-OE2 2.91Å
442	G	41.1	Very low	49	Very low	67 Å²	67	98.2 Å²	98.2	69%	0.691	51%	0.512	S	S	*	.	S	Bend	trans	64.6	-22.7	176.8	0	0	0	0	0	116.4	V438	V438-G442 PolarHBondContact O-N 3.17Å
443	M	43.8	Very low	47.7	Very low	148 Å²	148	101.7 Å²	101.7	73%	0.729	53%	0.53	S	S	*	.	S	Bend	trans	-145.2	141.2	175.2	-79	176.7	69.4	0	0	108.9	N441 D445	N441-M443 PolarHBondContact O-N 3.26Å; M443-D445 PolarHBondContact O-N 2.69Å
444	L	41.5	Very low	46.6	Very low	120 Å²	120	101.8 Å²	101.8	63%	0.628	53%	0.528	S	S	*	.			trans	-84.1	101.3	177.2	-82.7	143.2	0	0	0	109.4
445	D	34.5	Very low	45.6	Very low	105 Å²	105	100.2 Å²	100.2	56%	0.561	52%	0.521	S	S	*	.			trans	-77.8	140.6	171.9	-79.2	-25.2	0	0	0	112	M443 S447 E448	M443-D445 PolarHBondContact O-N 2.69Å; D445-S447 PolarHBondContact O-N 2.83Å; D445-E448 PolarHBondContact O-N 3.27Å
446	A	42.6	Very low	45	Very low	81 Å²	81	100.9 Å²	100.9	67%	0.669	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-68.3	-17.8	-174.1	0	0	0	0	0	114.1
447	S	37.5	Very low	44.4	Very low	97 Å²	97	99.7 Å²	99.7	68%	0.678	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-78.4	-23.2	-178.6	52.4	0	0	0	0	113.6	D445 Q449	D445-S447 PolarHBondContact O-N 2.83Å; S447-Q449 VanDerWaalsContact C-N 3.31Å; S447-Q449 PolarHBondContact O-N 3.4Å
448	E	38.1	Very low	44.3	Very low	77 Å²	77	99.3 Å²	99.3	36%	0.36	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-81.1	-7.7	179.7	-66.7	-168.5	141.4	0	0	113.7	N441 D445 K450 F451	N441-E448 PolarHBondContact ND2-OE1 3.16Å; N441-E448 PolarHBondContact ND2-OE2 2.91Å; D445-E448 PolarHBondContact O-N 3.27Å; E448-K450 PolarHBondContact O-N 3.13Å; E448-F451 PolarHBondContact O-N 3.4Å
449	Q	42.7	Very low	43.8	Very low	152 Å²	152	98.7 Å²	98.7	71%	0.71	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-66.8	-15.6	178.4	-75.4	-179.3	-4	0	0	113.9	S447	S447-Q449 VanDerWaalsContact C-N 3.31Å; S447-Q449 PolarHBondContact O-N 3.4Å
450	K	39.6	Very low	43.6	Very low	192 Å²	192	92.4 Å²	92.4	84%	0.835	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-88.1	-15.7	179.2	-85	-175	171.8	-173	0	114.8	E448	E448-K450 PolarHBondContact O-N 3.13Å
451	F	35.5	Very low	43.9	Very low	192 Å²	192	92.5 Å²	92.5	84%	0.842	48%	0.483	S	S	*	.	S	Bend	trans	-103.1	14.5	-161.9	-139.1	-92.7	0	0	0	116.3	E448	E448-F451 PolarHBondContact O-N 3.4Å
452	I	38.8	Very low	44.1	Very low	98 Å²	98	90.2 Å²	90.2	50%	0.503	47%	0.472	S	S	.	.			trans	-126.5	85.1	179.6	-54.7	-173.8	0	0	0	109.9
453	Q	45.6	Very low	44.5	Very low	135 Å²	135	91.8 Å²	91.8	63%	0.631	46%	0.458	S	S	*	.			trans	-101.8	-1.7	-175.2	-109.9	173.1	-12.7	0	0	115.3	K209	K209-Q453 WeakPolarHBondContact CE-O 3.47Å; K209-Q453 PolarHBondContact NZ-O 3.29Å
454	T	45.8	Very low	45	Very low	20 Å²	20	87.6 Å²	87.6	12%	0.123	44%	0.438	C	S	.	.			trans	-143.9	96.1	174.7	45.7	0	0	0	0	114.4	I456 E457 E496	T454-I456 PolarHBondContact O-N 2.86Å; T454-E457 PolarHBondContact O-N 2.96Å; T454-E496 WeakPolarHBondContact CG2-OE1 3.43Å
455	P	45.9	Very low	45.7	Very low	22 Å²	22	88.9 Å²	88.9	14%	0.143	43%	0.434	C	S	.	.	H	α-helix	trans	-52.6	-22	164.2	-24	32.7	0	0	0	113.4	L459	P455-L459 WeakPolarHBondContact O-CB 3.38Å; P455-L459 PolarHBondContact O-N 2.69Å
456	I	47.7	Very low	46.4	Very low	32 Å²	32	84.2 Å²	84.2	16%	0.164	41%	0.41	C	S	.	.	H	α-helix	trans	-68.9	-39.5	-177.9	-59.7	166.5	0	0	0	111.7	L205 K209 T454 H458 L459 L460	L205-I456 HydrophobicContact CD1-CD1 3.85Å; L205-I456 HydrophobicContact CD1-CG1 3.89Å; L205-I456 HydrophobicContact CD2-CD1 3.89Å; L205-I456 HydrophobicContact CD2-CG2 4.38Å; L205-I456 HydrophobicContact CG-CD1 3.71Å; L205-I456 HydrophobicContact CG-CG1 4.32Å; K209-I456 HydrophobicContact CD-CD1 4.33Å; T454-I456 PolarHBondContact O-N 2.86Å; I456-H458 VanDerWaalsContact C-N 3.31Å; I456-H458 PolarHBondContact O-N 2.9Å; I456-L459 PolarHBondContact O-N 3.36Å; I456-L460 HydrophobicContact CG2-CD1 3.9Å; I456-L460 WeakPolarHBondContact O-CB 3.21Å; I456-L460 WeakPolarHBondContact O-CG 3.42Å; I456-L460 PolarHBondContact O-N 3.24Å
457	E	50.7	Low	46.8	Very low	73 Å²	73	83.4 Å²	83.4	34%	0.341	39%	0.394	S	S	.	.	H	α-helix	trans	-66.9	-38.8	179.9	-150.2	-155	147	0	0	110.6	T454 L460 R461 L489	T454-E457 PolarHBondContact O-N 2.96Å; E457-L460 PolarHBondContact O-N 3.38Å; E457-R461 WeakPolarHBondContact O-CG 2.99Å; E457-R461 PolarHBondContact O-N 3.47Å; E457-R461 IonicContact OE1-CZ 2.97Å; E457-R461 IonicContact OE1-NE 3.03Å; E457-R461 IonicContact OE1-NH2 3.91Å; E457-R461 PolarHBondContact OE1-NH2 2.81Å; E457-R461 IonicContact OE2-NH2 2.76Å; E457-R461 PolarHBondContact OE2-NH2 3.08Å; E457-L489 HydrophobicContact CG-CD2 3.7Å
458	H	49.5	Very low	47.6	Very low	58 Å²	58	83.2 Å²	83.2	27%	0.269	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-41.2	173	-171.4	-78.5	0	0	0	112	I456 L460 R461 C462	I456-H458 VanDerWaalsContact C-N 3.31Å; I456-H458 PolarHBondContact O-N 2.9Å; H458-L460 VanDerWaalsContact C-N 3.34Å; H458-R461 PolarHBondContact O-N 3.41Å; H458-C462 PolarHBondContact CE1-SG 3.01Å; H458-C462 WeakPolarHBondContact O-CB 3.33Å; H458-C462 PolarHBondContact O-N 3.03Å; H458-C462 PolarHBondContact O-SG 3.31Å
459	L	46.6	Very low	48.4	Very low	60 Å²	60	83.1 Å²	83.1	31%	0.314	41%	0.405	S	S	.	.	H	α-helix	trans	-66	-37.7	177.9	-156.3	137.9	0	0	0	111.5	V425 P455 I456 C462 R463	V425-L459 HydrophobicContact CG1-CD1 3.8Å; V425-L459 HydrophobicContact CG1-CG 4.26Å; P455-L459 WeakPolarHBondContact O-CB 3.38Å; P455-L459 PolarHBondContact O-N 2.69Å; I456-L459 PolarHBondContact O-N 3.36Å; L459-C462 PolarHBondContact O-N 3.21Å; L459-R463 WeakPolarHBondContact O-CB 3.41Å; L459-R463 PolarHBondContact O-N 3.09Å
460	L	51.3	Low	48.8	Very low	19 Å²	19	83.6 Å²	83.6	10%	0.099	41%	0.405	C	S	.	.	H	α-helix	trans	-64.9	-43.6	171.1	-81.4	161.7	0	0	0	112.1	I456 E457 H458 R463 L464 L485 L489	I456-L460 HydrophobicContact CG2-CD1 3.9Å; I456-L460 WeakPolarHBondContact O-CB 3.21Å; I456-L460 WeakPolarHBondContact O-CG 3.42Å; I456-L460 PolarHBondContact O-N 3.24Å; E457-L460 PolarHBondContact O-N 3.38Å; H458-L460 VanDerWaalsContact C-N 3.34Å; L460-R463 PolarHBondContact O-N 3.18Å; L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 WeakPolarHBondContact O-CG 3.06Å; L460-L464 PolarHBondContact O-N 3.19Å; L460-L485 HydrophobicContact CD2-CB 4.48Å; L460-L485 HydrophobicContact CD2-CD1 4.07Å; L460-L485 HydrophobicContact CD2-CD2 3.36Å; L460-L485 HydrophobicContact CD2-CG 4.16Å; L460-L489 HydrophobicContact CD1-CD2 3.85Å; L460-L489 HydrophobicContact CD1-CG 4.04Å
461	R	54.4	Low	48.9	Very low	119 Å²	119	78.1 Å²	78.1	45%	0.449	40%	0.403	S	S	.	.	H	α-helix	trans	-62.5	-41.4	173.6	-76.7	-174.3	-138.2	174.4	6.2	112.1	E457 H458 R463 L464 R465	E457-R461 WeakPolarHBondContact O-CG 2.99Å; E457-R461 PolarHBondContact O-N 3.47Å; E457-R461 IonicContact OE1-CZ 2.97Å; E457-R461 IonicContact OE1-NE 3.03Å; E457-R461 IonicContact OE1-NH2 3.91Å; E457-R461 PolarHBondContact OE1-NH2 2.81Å; E457-R461 IonicContact OE2-NH2 2.76Å; E457-R461 PolarHBondContact OE2-NH2 3.08Å; H458-R461 PolarHBondContact O-N 3.41Å; R461-R463 VanDerWaalsContact C-N 3.34Å; R461-L464 PolarHBondContact O-N 2.91Å; R461-R465 WeakPolarHBondContact O-CB 3.47Å; R461-R465 WeakPolarHBondContact O-CG 3.42Å; R461-R465 PolarHBondContact O-N 3.17Å
462	C	53.2	Low	49.1	Very low	27 Å²	27	71.7 Å²	71.7	18%	0.182	39%	0.391	C	S	.	.	H	α-helix	trans	-62.2	-41.2	174.2	-77.5	0	0	0	0	111.6	M381 H458 L459 R465 S466	M381-C462 HydrophobicContact SD-CB 4.36Å; H458-C462 PolarHBondContact CE1-SG 3.01Å; H458-C462 WeakPolarHBondContact O-CB 3.33Å; H458-C462 PolarHBondContact O-N 3.03Å; H458-C462 PolarHBondContact O-SG 3.31Å; L459-C462 PolarHBondContact O-N 3.21Å; C462-R465 PolarHBondContact O-N 3.27Å; C462-S466 PolarHBondContact O-N 3.4Å
463	R	49.3	Very low	49.5	Very low	100 Å²	100	77 Å²	77	38%	0.377	41%	0.411	S	S	.	.	H	α-helix	trans	-67.3	-40	176.5	-163.2	170.1	-167	-173.5	1.9	112.6	E380 L459 L460 R461 S466 L467	E380-R463 IonicContact OE1-CZ 3.57Å; E380-R463 IonicContact OE1-NH2 2.7Å; E380-R463 PolarHBondContact OE1-NH2 3.24Å; E380-R463 IonicContact OE2-CZ 3.87Å; E380-R463 IonicContact OE2-NE 2.78Å; E380-R463 PolarHBondContact OE2-NE 3.39Å; E380-R463 IonicContact OE2-NH2 3.52Å; E380-R463 PolarHBondContact OE2-NH2 2.89Å; L459-R463 WeakPolarHBondContact O-CB 3.41Å; L459-R463 PolarHBondContact O-N 3.09Å; L460-R463 PolarHBondContact O-N 3.18Å; R461-R463 VanDerWaalsContact C-N 3.34Å; R463-S466 PolarHBondContact O-N 3.27Å; R463-S466 PolarHBondContact O-OG 3.27Å; R463-L467 HydrophobicContact CG-CD1 4.4Å; R463-L467 WeakPolarHBondContact O-CB 3.4Å; R463-L467 VanDerWaalsContact O-CG 3.29Å; R463-L467 WeakPolarHBondContact O-CG 3.29Å; R463-L467 PolarHBondContact O-N 2.89Å
464	L	55.1	Low	49.7	Very low	60 Å²	60	74.2 Å²	74.2	31%	0.314	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-42.2	173.1	-79.7	159.8	0	0	0	111.4	L460 R461 S468 A482	L460-L464 WeakPolarHBondContact O-CB 3.41Å; L460-L464 WeakPolarHBondContact O-CG 3.06Å; L460-L464 PolarHBondContact O-N 3.19Å; R461-L464 PolarHBondContact O-N 2.91Å; L464-S468 WeakPolarHBondContact O-CB 3.23Å; L464-S468 PolarHBondContact O-N 2.51Å; L464-A482 HydrophobicContact CD2-CB 3.82Å
465	R	55	Low	50	Low	148 Å²	148	79.9 Å²	79.9	56%	0.558	43%	0.428	S	S	*	.	H	α-helix	trans	-64.6	-38.6	174.6	-74.9	178.6	-177.1	175.3	2.2	112.4	R461 C462 S468 A469	R461-R465 WeakPolarHBondContact O-CB 3.47Å; R461-R465 WeakPolarHBondContact O-CG 3.42Å; R461-R465 PolarHBondContact O-N 3.17Å; C462-R465 PolarHBondContact O-N 3.27Å; R465-S468 PolarHBondContact O-N 2.82Å; R465-A469 PolarHBondContact O-N 3.01Å
466	S	50.4	Low	50.5	Low	7 Å²	7	87.2 Å²	87.2	5%	0.049	46%	0.457	C	S	.	.	H	α-helix	trans	-68.9	-41	179.1	78.4	0	0	0	0	112.7	P382 C462 R463 S468 A469 K470	P382-S466 VanDerWaalsContact CD-CB 3.49Å; C462-S466 PolarHBondContact O-N 3.4Å; R463-S466 PolarHBondContact O-N 3.27Å; R463-S466 PolarHBondContact O-OG 3.27Å; S466-S468 VanDerWaalsContact C-N 3.3Å; S466-S468 PolarHBondContact O-N 2.89Å; S466-A469 PolarHBondContact O-N 3.45Å; S466-K470 PolarHBondContact O-N 3.36Å
467	L	50.3	Low	50.9	Low	63 Å²	63	91.8 Å²	91.8	33%	0.33	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-35.5	173.9	-70.3	170.1	0	0	0	111.5	R463 A481	R463-L467 HydrophobicContact CG-CD1 4.4Å; R463-L467 WeakPolarHBondContact O-CB 3.4Å; R463-L467 VanDerWaalsContact O-CG 3.29Å; R463-L467 WeakPolarHBondContact O-CG 3.29Å; R463-L467 PolarHBondContact O-N 2.89Å; L467-A481 HydrophobicContact CD1-CB 4.15Å
468	S	53.3	Low	50.9	Low	94 Å²	94	89.9 Å²	89.9	66%	0.657	48%	0.475	S	S	*	.	H	α-helix	trans	-70.8	-32.7	175.7	-179.7	0	0	0	0	113.4	L464 R465 S466	L464-S468 WeakPolarHBondContact O-CB 3.23Å; L464-S468 PolarHBondContact O-N 2.51Å; R465-S468 PolarHBondContact O-N 2.82Å; S466-S468 VanDerWaalsContact C-N 3.3Å; S466-S468 PolarHBondContact O-N 2.89Å
469	A	54.9	Low	51.2	Low	75 Å²	75	92.6 Å²	92.6	62%	0.62	49%	0.486	S	S	*	.	H	α-helix	trans	-75.1	-25.4	179.7	0	0	0	0	0	113.9	R465 S466 G471	R465-A469 PolarHBondContact O-N 3.01Å; S466-A469 PolarHBondContact O-N 3.45Å; A469-G471 PolarHBondContact O-N 3.12Å
470	K	52.8	Low	51.7	Low	161 Å²	161	92.9 Å²	92.9	70%	0.7	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	33.7	176.7	-77.8	-177.9	175.2	174.9	0	113.5	S466 G472	S466-K470 PolarHBondContact O-N 3.36Å; K470-G472 PolarHBondContact O-N 2.74Å
471	G	41.5	Very low	51.7	Low	78 Å²	78	93.5 Å²	93.5	80%	0.804	50%	0.498	S	S	*	.			trans	-62.4	35.8	-173.7	0	0	0	0	0	118	A469	A469-G471 PolarHBondContact O-N 3.12Å
472	G	39.9	Very low	51.6	Low	57 Å²	57	89.1 Å²	89.1	59%	0.588	49%	0.487	S	S	*	.	S	Bend	trans	-126	100.4	170.4	0	0	0	0	0	111.1	K470	K470-G472 PolarHBondContact O-N 2.74Å
473	K	46.6	Very low	51.8	Low	210 Å²	210	94.1 Å²	94.1	91%	0.913	51%	0.508	S	S	*	.	S	Bend	trans	110	-16.1	159.1	-62	179.8	175.1	178.2	0	120.4
474	T	50.4	Low	52.1	Low	76 Å²	76	96.5 Å²	96.5	47%	0.466	52%	0.521	S	S	.	.			trans	-138.9	58.9	176.1	51.6	0	0	0	0	114.5	K476 E477 A478	T474-K476 PolarHBondContact O-N 3.08Å; T474-K476 VanDerWaalsContact O-N 3.11Å; T474-E477 WeakPolarHBondContact CB-OE2 3.11Å; T474-E477 HydrophobicContact CG2-CG 4.26Å; T474-E477 WeakPolarHBondContact CG2-OE2 3.26Å; T474-E477 PolarHBondContact O-N 3.28Å; T474-E477 PolarHBondContact OG1-OE2 2.79Å; T474-A478 PolarHBondContact O-N 2.05Å
475	E	52.2	Low	51.9	Low	139 Å²	139	95.1 Å²	95.1	65%	0.65	51%	0.514	S	S	*	.	H	α-helix	trans	-52.9	-32.1	174.6	-163.4	-169.1	148.2	0	0	113.4	K479	E475-K479 WeakPolarHBondContact O-CB 3.49Å; E475-K479 WeakPolarHBondContact O-CG 3.24Å; E475-K479 PolarHBondContact O-N 3.5Å; E475-K479 VanDerWaalsContact O-N 3.11Å; E475-K479 WeakPolarHBondContact OE1-CE 3.5Å; E475-K479 IonicContact OE1-NZ 2.64Å; E475-K479 PolarHBondContact OE1-NZ 3.16Å
476	K	56.4	Low	51.9	Low	175 Å²	175	92.7 Å²	92.7	76%	0.761	51%	0.511	S	S	*	.	H	α-helix	trans	-65.6	-38.8	174.3	-81.2	-177.6	173.9	179.6	0	113	T474 K479 T480	T474-K476 PolarHBondContact O-N 3.08Å; T474-K476 VanDerWaalsContact O-N 3.11Å; K476-K479 PolarHBondContact O-N 3.45Å; K476-T480 WeakPolarHBondContact O-CB 3.22Å; K476-T480 PolarHBondContact O-N 3.41Å; K476-T480 PolarHBondContact O-OG1 3.47Å
477	E	54.5	Low	52	Low	128 Å²	128	95.4 Å²	95.4	60%	0.598	53%	0.529	S	S	*	.	H	α-helix	trans	-70.9	-38.3	-178.9	-67.7	177.9	162.6	0	0	111.4	T474 T480 A481	T474-E477 WeakPolarHBondContact CB-OE2 3.11Å; T474-E477 HydrophobicContact CG2-CG 4.26Å; T474-E477 WeakPolarHBondContact CG2-OE2 3.26Å; T474-E477 PolarHBondContact O-N 3.28Å; T474-E477 PolarHBondContact OG1-OE2 2.79Å; E477-T480 PolarHBondContact O-N 3.05Å; E477-A481 VanDerWaalsContact O-CB 3.29Å; E477-A481 WeakPolarHBondContact O-CB 3.37Å; E477-A481 PolarHBondContact O-N 3.23Å
478	A	51.3	Low	52	Low	33 Å²	33	96.6 Å²	96.6	27%	0.273	54%	0.535	S	S	.	.	H	α-helix	trans	-64.3	-42	173.7	0	0	0	0	0	111.8	T474 A482	T474-A478 PolarHBondContact O-N 2.05Å; A478-A482 WeakPolarHBondContact O-CB 3.31Å; A478-A482 PolarHBondContact O-N 2.76Å
479	K	55.5	Low	51.8	Low	116 Å²	116	94 Å²	94	50%	0.504	51%	0.513	S	S	.	.	H	α-helix	trans	-62.9	-47.6	174.5	-78.6	174.7	170.8	166.5	0	111.9	E475 K476 A481 A482 E483	E475-K479 WeakPolarHBondContact O-CB 3.49Å; E475-K479 WeakPolarHBondContact O-CG 3.24Å; E475-K479 PolarHBondContact O-N 3.5Å; E475-K479 VanDerWaalsContact O-N 3.11Å; E475-K479 WeakPolarHBondContact OE1-CE 3.5Å; E475-K479 IonicContact OE1-NZ 2.64Å; E475-K479 PolarHBondContact OE1-NZ 3.16Å; K476-K479 PolarHBondContact O-N 3.45Å; K479-A481 PolarHBondContact O-N 2.85Å; K479-A482 PolarHBondContact O-N 2.81Å; K479-E483 WeakPolarHBondContact O-CB 3.46Å; K479-E483 WeakPolarHBondContact O-CG 3.45Å; K479-E483 PolarHBondContact O-N 3.32Å
480	T	58	Low	51.8	Low	66 Å²	66	95.4 Å²	95.4	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-66.3	-34.5	178.7	-55	0	0	0	0	112.9	K476 E477 K484	K476-T480 WeakPolarHBondContact O-CB 3.22Å; K476-T480 PolarHBondContact O-N 3.41Å; K476-T480 PolarHBondContact O-OG1 3.47Å; E477-T480 PolarHBondContact O-N 3.05Å; T480-K484 WeakPolarHBondContact O-CG 3.32Å; T480-K484 PolarHBondContact O-N 2.73Å; T480-K484 VanDerWaalsContact O-N 3.15Å
481	A	51.4	Low	51.7	Low	32 Å²	32	92.7 Å²	92.7	26%	0.264	50%	0.5	S	S	.	.	H	α-helix	trans	-69.3	-40.2	175.1	0	0	0	0	0	112	L467 E477 K479 K484 L485	L467-A481 HydrophobicContact CD1-CB 4.15Å; E477-A481 VanDerWaalsContact O-CB 3.29Å; E477-A481 WeakPolarHBondContact O-CB 3.37Å; E477-A481 PolarHBondContact O-N 3.23Å; K479-A481 PolarHBondContact O-N 2.85Å; A481-K484 PolarHBondContact O-N 2.99Å; A481-L485 WeakPolarHBondContact O-CB 3.24Å; A481-L485 WeakPolarHBondContact O-CD1 3.39Å; A481-L485 WeakPolarHBondContact O-CG 3.45Å; A481-L485 PolarHBondContact O-N 2.94Å
482	A	52.9	Low	52.1	Low	26 Å²	26	91.5 Å²	91.5	22%	0.215	48%	0.475	C	S	.	.	H	α-helix	trans	-65.8	-43.3	175	0	0	0	0	0	112.1	L464 A478 K479 K484 L485 L486	L464-A482 HydrophobicContact CD2-CB 3.82Å; A478-A482 WeakPolarHBondContact O-CB 3.31Å; A478-A482 PolarHBondContact O-N 2.76Å; K479-A482 PolarHBondContact O-N 2.81Å; A482-K484 VanDerWaalsContact C-N 3.29Å; A482-K484 PolarHBondContact O-N 2.82Å; A482-L485 PolarHBondContact O-N 3.32Å; A482-L485 VanDerWaalsContact O-N 3.14Å; A482-L486 PolarHBondContact O-N 3.27Å
483	E	56.8	Low	52.6	Low	133 Å²	133	96.1 Å²	96.1	62%	0.621	48%	0.475	S	S	*	.	H	α-helix	trans	-61.2	-33.9	175.5	-78.3	174.2	169.7	0	0	112.8	K479 P487	K479-E483 WeakPolarHBondContact O-CB 3.46Å; K479-E483 WeakPolarHBondContact O-CG 3.45Å; K479-E483 PolarHBondContact O-N 3.32Å; E483-P487 WeakPolarHBondContact O-CD 3.19Å
484	K	54.4	Low	53	Low	150 Å²	150	91.4 Å²	91.4	65%	0.652	46%	0.456	S	S	*	.	H	α-helix	trans	-75.9	-26.1	175.3	-76.8	-178.5	179.1	-178.2	0	113.8	T480 A481 A482	T480-K484 WeakPolarHBondContact O-CG 3.32Å; T480-K484 PolarHBondContact O-N 2.73Å; T480-K484 VanDerWaalsContact O-N 3.15Å; A481-K484 PolarHBondContact O-N 2.99Å; A482-K484 VanDerWaalsContact C-N 3.29Å; A482-K484 PolarHBondContact O-N 2.82Å
485	L	52.1	Low	53	Low	31 Å²	31	94.5 Å²	94.5	16%	0.162	46%	0.463	C	S	.	.	H	α-helix	trans	-91.3	-29.9	-174.8	-80.6	167.6	0	0	0	113.3	L460 A481 A482 I488 L489	L460-L485 HydrophobicContact CD2-CB 4.48Å; L460-L485 HydrophobicContact CD2-CD1 4.07Å; L460-L485 HydrophobicContact CD2-CD2 3.36Å; L460-L485 HydrophobicContact CD2-CG 4.16Å; A481-L485 WeakPolarHBondContact O-CB 3.24Å; A481-L485 WeakPolarHBondContact O-CD1 3.39Å; A481-L485 WeakPolarHBondContact O-CG 3.45Å; A481-L485 PolarHBondContact O-N 2.94Å; A482-L485 PolarHBondContact O-N 3.32Å; A482-L485 VanDerWaalsContact O-N 3.14Å; L485-I488 HydrophobicContact CD2-CD1 4.39Å; L485-I488 WeakPolarHBondContact O-CB 3.31Å; L485-I488 PolarHBondContact O-N 3.3Å; L485-L489 PolarHBondContact O-N 3.19Å; L485-L489 VanDerWaalsContact O-N 3.12Å
486	L	54.4	Low	52.8	Low	96 Å²	96	90.9 Å²	90.9	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-52.8	-51.6	175.4	-92.2	157	0	0	0	114.6	A482 I488 L489 E490	A482-L486 PolarHBondContact O-N 3.27Å; L486-I488 PolarHBondContact O-N 3.09Å; L486-L489 WeakPolarHBondContact O-CB 3.24Å; L486-L489 PolarHBondContact O-N 2.91Å; L486-L489 VanDerWaalsContact O-N 3.08Å; L486-E490 PolarHBondContact O-N 3.04Å
487	P	52	Low	52.4	Low	65 Å²	65	87 Å²	87	42%	0.422	43%	0.43	S	S	.	.	H	α-helix	trans	-66.3	-25.8	-179.8	22.8	-31.9	0	0	0	113	E483 N491	E483-P487 WeakPolarHBondContact O-CD 3.19Å; P487-N491 WeakPolarHBondContact O-CB 3.34Å; P487-N491 PolarHBondContact O-N 3.14Å; P487-N491 PolarHBondContact O-ND2 3.13Å
488	I	50.1	Low	52	Low	88 Å²	88	87.1 Å²	87.1	45%	0.451	43%	0.432	S	S	.	.	H	α-helix	trans	-70.6	-40.4	174.6	-59.1	174.1	0	0	0	110	L485 L486 N491 I492	L485-I488 HydrophobicContact CD2-CD1 4.39Å; L485-I488 WeakPolarHBondContact O-CB 3.31Å; L485-I488 PolarHBondContact O-N 3.3Å; L486-I488 PolarHBondContact O-N 3.09Å; I488-N491 PolarHBondContact O-N 2.83Å; I488-I492 HydrophobicContact CG2-CD1 4.07Å; I488-I492 WeakPolarHBondContact O-CD1 3.4Å; I488-I492 VanDerWaalsContact O-CG1 3.25Å; I488-I492 WeakPolarHBondContact O-CG1 3.39Å; I488-I492 PolarHBondContact O-N 3.46Å; I488-I492 VanDerWaalsContact O-N 3.09Å
489	L	50	Low	51.7	Low	39 Å²	39	90 Å²	90	20%	0.204	44%	0.443	C	S	.	.	H	α-helix	trans	-64.5	-42.1	173.6	-80.9	156.3	0	0	0	111.8	E457 L460 L485 L486 I492 R493	E457-L489 HydrophobicContact CG-CD2 3.7Å; L460-L489 HydrophobicContact CD1-CD2 3.85Å; L460-L489 HydrophobicContact CD1-CG 4.04Å; L485-L489 PolarHBondContact O-N 3.19Å; L485-L489 VanDerWaalsContact O-N 3.12Å; L486-L489 WeakPolarHBondContact O-CB 3.24Å; L486-L489 PolarHBondContact O-N 2.91Å; L486-L489 VanDerWaalsContact O-N 3.08Å; L489-I492 PolarHBondContact O-N 3.42Å; L489-R493 WeakPolarHBondContact O-CB 3.32Å; L489-R493 PolarHBondContact O-N 2.88Å
490	E	54.9	Low	51.2	Low	104 Å²	104	87.7 Å²	87.7	49%	0.486	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.9	-131.8	104.7	-142.2	0	0	111.6	L486 I492 R493 Q494	L486-E490 PolarHBondContact O-N 3.04Å; E490-I492 PolarHBondContact O-N 3.49Å; E490-R493 PolarHBondContact O-N 3.09Å; E490-Q494 WeakPolarHBondContact O-CG 2.96Å; E490-Q494 PolarHBondContact O-N 3.36Å
491	N	51.3	Low	50.8	Low	105 Å²	105	89.1 Å²	89.1	56%	0.561	45%	0.448	S	S	*	.	H	α-helix	trans	-64.8	-37.5	178.5	-79	-17.2	0	0	0	112.8	P487 I488 K495	P487-N491 WeakPolarHBondContact O-CB 3.34Å; P487-N491 PolarHBondContact O-N 3.14Å; P487-N491 PolarHBondContact O-ND2 3.13Å; I488-N491 PolarHBondContact O-N 2.83Å; N491-K495 WeakPolarHBondContact O-CB 3.12Å; N491-K495 PolarHBondContact O-N 3.07Å; N491-K495 VanDerWaalsContact O-N 3.12Å
492	I	48.9	Very low	50.5	Low	53 Å²	53	92.9 Å²	92.9	27%	0.272	46%	0.46	S	S	.	.	H	α-helix	trans	-66.7	-44.1	176.1	-69.1	165.9	0	0	0	109.9	I488 L489 E490 K495 E496	I488-I492 HydrophobicContact CG2-CD1 4.07Å; I488-I492 WeakPolarHBondContact O-CD1 3.4Å; I488-I492 VanDerWaalsContact O-CG1 3.25Å; I488-I492 WeakPolarHBondContact O-CG1 3.39Å; I488-I492 PolarHBondContact O-N 3.46Å; I488-I492 VanDerWaalsContact O-N 3.09Å; L489-I492 PolarHBondContact O-N 3.42Å; E490-I492 PolarHBondContact O-N 3.49Å; I492-K495 PolarHBondContact O-N 2.91Å; I492-E496 WeakPolarHBondContact O-CG 3.21Å; I492-E496 PolarHBondContact O-N 2.81Å
493	R	50.3	Low	50.1	Low	154 Å²	154	98.7 Å²	98.7	58%	0.581	48%	0.482	S	S	*	.	H	α-helix	trans	-62.5	-45.5	177.5	-178.1	179.7	169.1	171.5	0.2	112.3	L489 E490 K495 E496 E497	L489-R493 WeakPolarHBondContact O-CB 3.32Å; L489-R493 PolarHBondContact O-N 2.88Å; E490-R493 PolarHBondContact O-N 3.09Å; R493-K495 VanDerWaalsContact C-N 3.26Å; R493-K495 PolarHBondContact O-N 2.89Å; R493-E496 PolarHBondContact O-N 3.07Å; R493-E497 IonicContact CZ-OE1 3.31Å; R493-E497 IonicContact NE-OE1 3.16Å; R493-E497 PolarHBondContact NE-OE1 3.05Å; R493-E497 IonicContact NH2-OE1 3.65Å; R493-E497 WeakPolarHBondContact O-CG 3.44Å; R493-E497 PolarHBondContact O-N 2.81Å
494	Q	54.6	Low	49.4	Very low	110 Å²	110	99 Å²	99	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-61.4	-36.1	176.4	-75.5	-177.5	-9.4	0	0	112.2	E490 E497 M498	E490-Q494 WeakPolarHBondContact O-CG 2.96Å; E490-Q494 PolarHBondContact O-N 3.36Å; Q494-E497 PolarHBondContact O-N 2.84Å; Q494-M498 WeakPolarHBondContact O-CG 3.26Å; Q494-M498 PolarHBondContact O-N 3.1Å
495	K	51	Low	48.9	Very low	142 Å²	142	95.5 Å²	95.5	62%	0.617	48%	0.483	S	S	*	.	H	α-helix	trans	-69	-39.4	176.9	-166	169.6	-176.5	171.4	0	112.1	N491 I492 R493 M498 D499	N491-K495 WeakPolarHBondContact O-CB 3.12Å; N491-K495 PolarHBondContact O-N 3.07Å; N491-K495 VanDerWaalsContact O-N 3.12Å; I492-K495 PolarHBondContact O-N 2.91Å; R493-K495 VanDerWaalsContact C-N 3.26Å; R493-K495 PolarHBondContact O-N 2.89Å; K495-M498 PolarHBondContact O-N 2.87Å; K495-D499 VanDerWaalsContact O-CG 3.32Å; K495-D499 PolarHBondContact O-N 2.02Å
496	E	48.2	Very low	48.7	Very low	63 Å²	63	101.4 Å²	101.4	29%	0.294	51%	0.507	S	S	.	.	H	α-helix	trans	-68.3	-37.7	174.6	-71.4	178.1	165.7	0	0	112.1	T454 I492 R493 D499 T500	T454-E496 WeakPolarHBondContact CG2-OE1 3.43Å; I492-E496 WeakPolarHBondContact O-CG 3.21Å; I492-E496 PolarHBondContact O-N 2.81Å; R493-E496 PolarHBondContact O-N 3.07Å; E496-D499 PolarHBondContact O-N 2.53Å; E496-T500 WeakPolarHBondContact O-CG2 3.38Å; E496-T500 PolarHBondContact O-N 3.16Å; E496-T500 VanDerWaalsContact O-N 3.12Å; E496-T500 PolarHBondContact O-OG1 2.67Å
497	E	48.1	Very low	48.1	Very low	92 Å²	92	101.7 Å²	101.7	43%	0.43	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-34.8	173.4	-73	173.5	-175.2	0	0	111.9	R493 Q494 T500 V501	R493-E497 IonicContact CZ-OE1 3.31Å; R493-E497 IonicContact NE-OE1 3.16Å; R493-E497 PolarHBondContact NE-OE1 3.05Å; R493-E497 IonicContact NH2-OE1 3.65Å; R493-E497 WeakPolarHBondContact O-CG 3.44Å; R493-E497 PolarHBondContact O-N 2.81Å; Q494-E497 PolarHBondContact O-N 2.84Å; E497-T500 WeakPolarHBondContact CA-OG1 3.23Å; E497-T500 PolarHBondContact O-OG1 3.04Å; E497-T500 VanDerWaalsContact O-OG1 3.07Å; E497-V501 WeakPolarHBondContact O-CG2 2.93Å; E497-V501 PolarHBondContact O-N 3.12Å
498	M	46.7	Very low	47.5	Very low	131 Å²	131	105.4 Å²	105.4	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-70.2	-44	172.9	-77.9	-177.7	57.4	0	0	113.3	Q494 K495 T500 V501 E502	Q494-M498 WeakPolarHBondContact O-CG 3.26Å; Q494-M498 PolarHBondContact O-N 3.1Å; K495-M498 PolarHBondContact O-N 2.87Å; M498-T500 VanDerWaalsContact C-N 3.27Å; M498-T500 PolarHBondContact O-N 3.37Å; M498-V501 PolarHBondContact O-N 2.79Å; M498-E502 PolarHBondContact O-N 2.8Å; M498-E502 VanDerWaalsContact O-N 3.09Å
499	D	44.2	Very low	47	Very low	94 Å²	94	110.1 Å²	110.1	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-66	-31	-178.6	-71.6	-20.2	0	0	0	111.6	K495 E496 E503	K495-D499 VanDerWaalsContact O-CG 3.32Å; K495-D499 PolarHBondContact O-N 2.02Å; E496-D499 PolarHBondContact O-N 2.53Å; D499-E503 PolarHBondContact O-N 3.18Å
500	T	44.4	Very low	46.5	Very low	68 Å²	68	115.2 Å²	115.2	42%	0.417	58%	0.582	S	S	.	*	H	α-helix	trans	-76.8	-38.9	176.7	43.3	0	0	0	0	113.2	E496 E497 M498 E502 E503 E504	E496-T500 WeakPolarHBondContact O-CG2 3.38Å; E496-T500 PolarHBondContact O-N 3.16Å; E496-T500 VanDerWaalsContact O-N 3.12Å; E496-T500 PolarHBondContact O-OG1 2.67Å; E497-T500 WeakPolarHBondContact CA-OG1 3.23Å; E497-T500 PolarHBondContact O-OG1 3.04Å; E497-T500 VanDerWaalsContact O-OG1 3.07Å; M498-T500 VanDerWaalsContact C-N 3.27Å; M498-T500 PolarHBondContact O-N 3.37Å; T500-E502 VanDerWaalsContact C-N 3.28Å; T500-E502 PolarHBondContact O-N 3.39Å; T500-E503 PolarHBondContact O-N 2.62Å; T500-E504 PolarHBondContact O-N 3.4Å; T500-E504 VanDerWaalsContact O-N 3.09Å
501	V	49.3	Very low	45.6	Very low	96 Å²	96	113.4 Å²	113.4	58%	0.582	59%	0.591	S	S	*	*	H	α-helix	trans	-67.4	-30.6	174.6	173.4	0	0	0	0	111.4	E497 M498 A505	E497-V501 WeakPolarHBondContact O-CG2 2.93Å; E497-V501 PolarHBondContact O-N 3.12Å; M498-V501 PolarHBondContact O-N 2.79Å; V501-A505 VanDerWaalsContact O-CB 3.28Å; V501-A505 WeakPolarHBondContact O-CB 3.38Å; V501-A505 PolarHBondContact O-N 2.93Å; V501-A505 VanDerWaalsContact O-N 3.08Å
502	E	46.2	Very low	44.7	Very low	111 Å²	111	115.4 Å²	115.4	52%	0.519	61%	0.607	S	S	.	*	H	α-helix	trans	-77.7	-23.2	177.9	-147.5	-177.8	155.5	0	0	113.8	M498 T500 K506	M498-E502 PolarHBondContact O-N 2.8Å; M498-E502 VanDerWaalsContact O-N 3.09Å; T500-E502 VanDerWaalsContact C-N 3.28Å; T500-E502 PolarHBondContact O-N 3.39Å; E502-K506 IonicContact OE1-NZ 3.82Å
503	E	43.6	Very low	44	Very low	148 Å²	148	116.9 Å²	116.9	69%	0.692	63%	0.627	S	S	*	*	H	α-helix	trans	-81.3	-36.6	171	-100.1	-172.2	152.8	0	0	112.6	D499 T500 K506 T507	D499-E503 PolarHBondContact O-N 3.18Å; T500-E503 PolarHBondContact O-N 2.62Å; E503-K506 PolarHBondContact O-N 3.01Å; E503-T507 PolarHBondContact O-OG1 3.23Å; E503-T507 VanDerWaalsContact O-OG1 3.13Å
504	E	43.1	Very low	43.3	Very low	139 Å²	139	116.2 Å²	116.2	65%	0.65	64%	0.641	S	S	*	*	H	α-helix	trans	-76.1	-27.8	177.7	-71.1	-174.2	166.6	0	0	113	T500 K506 T507	T500-E504 PolarHBondContact O-N 3.4Å; T500-E504 VanDerWaalsContact O-N 3.09Å; E504-K506 VanDerWaalsContact C-N 3.25Å; E504-K506 PolarHBondContact O-N 3.07Å; E504-T507 PolarHBondContact O-OG1 2.86Å
505	A	44.5	Very low	42.3	Very low	77 Å²	77	116.4 Å²	116.4	64%	0.636	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-14.4	174.3	0	0	0	0	0	114.1	V501	V501-A505 VanDerWaalsContact O-CB 3.28Å; V501-A505 WeakPolarHBondContact O-CB 3.38Å; V501-A505 PolarHBondContact O-N 2.93Å; V501-A505 VanDerWaalsContact O-N 3.08Å
506	K	46.1	Very low	41.3	Very low	155 Å²	155	118 Å²	118	67%	0.674	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-4	-179.3	-74.8	172.2	-174.7	152.7	0	114.2	E502 E503 E504	E502-K506 IonicContact OE1-NZ 3.82Å; E503-K506 PolarHBondContact O-N 3.01Å; E504-K506 VanDerWaalsContact C-N 3.25Å; E504-K506 PolarHBondContact O-N 3.07Å
507	T	43.3	Very low	40.4	Very low	101 Å²	101	122.1 Å²	122.1	62%	0.62	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.3	-8.4	-169.3	33.1	0	0	0	0	116.7	E503 E504	E503-T507 PolarHBondContact O-OG1 3.23Å; E503-T507 VanDerWaalsContact O-OG1 3.13Å; E504-T507 PolarHBondContact O-OG1 2.86Å
508	N	38.1	Very low	39.5	Very low	144 Å²	144	125.1 Å²	125.1	77%	0.77	70%	0.699	S	S	*	*			trans	-124.9	71.1	-174.9	-72.1	-26.7	0	0	0	113.9
509	H	39.3	Very low	38.7	Very low	187 Å²	187	125.9 Å²	125.9	87%	0.866	71%	0.706	S	S	*	*			trans	-118.4	65	164.9	-101.8	-53.2	0	0	0	110.4
510	T	40.9	Very low	37.9	Very low	145 Å²	145	129.4 Å²	129.4	89%	0.89	73%	0.725	S	S	*	*	S	Bend	trans	-164.7	101.7	161.7	18.8	0	0	0	0	111.8
511	G	36.3	Very low	37.4	Very low	66 Å²	66	129.4 Å²	129.4	68%	0.68	74%	0.738	S	S	*	*			trans	54.1	110.2	139.6	0	0	0	0	0	122.9
512	T	32.3	Very low	36.5	Very low	147 Å²	147	136.1 Å²	136.1	90%	0.902	76%	0.755	S	S	*	*				28.3	132.8	121.8	49	0	0	0	0	118.7
513	A	34.3	Very low	35.9	Very low	84 Å²	84	135.9 Å²	135.9	69%	0.694	77%	0.772	S	S	*	*			cis	-171.8	152.8	37.9	0	0	0	0	0	113.5
514	T	35.4	Very low	35.4	Very low	141 Å²	141	139.6 Å²	139.6	87%	0.865	78%	0.779	S	S	*	*			trans	66.7	147.2	145.6	48.7	0	0	0	0	123.8
515	P	32.1	Very low	35	Very low	114 Å²	114	142 Å²	142	74%	0.74	79%	0.788	S	S	*	*			trans	-113.7	136.4	-155.2	35.8	-19.8	0	0	0	114.2
516	Q	31.8	Very low	34.6	Very low	174 Å²	174	145.1 Å²	145.1	81%	0.813	79%	0.794	S	S	*	*			trans	-165.6	132.7	155.4	-116.8	174.4	-48.9	0	0	112.4
517	E	28.2	Very low	34.4	Very low	150 Å²	150	140.8 Å²	140.8	70%	0.701	78%	0.783	S	S	*	*			trans	43	106.1	150.8	-74.9	170.1	133.8	0	0	119.5
518	N	28.8	Very low	34.1	Very low	155 Å²	155	140.3 Å²	140.3	83%	0.829	78%	0.78	S	S	*	*				167.7	160.7	117.4	-82.9	-28	0	0	0	111.2
519	D	31	Very low	34.2	Very low	148 Å²	148	137.9 Å²	137.9	79%	0.791	77%	0.77	S	S	*	*			trans	84.8	87.5	165.4	-77.7	-7.3	0	0	0	119.7	G521	D519-G521 PolarHBondContact O-N 3.38Å
520	D	27.7	Very low	34.1	Very low	167 Å²	167	136.8 Å²	136.8	89%	0.893	76%	0.759	S	S	*	*				18.3	95.4	109.8	-66.4	-18.5	0	0	0	115.9
521	G	33	Very low	34.3	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	75%	0.746	S	S	*	*			trans	173.5	-17.9	169.8	0	0	0	0	0	117.7	D519	D519-G521 PolarHBondContact O-N 3.38Å
522	Y	31.2	Very low	34.5	Very low	238 Å²	238	137.9 Å²	137.9	93%	0.933	74%	0.735	S	S	*	*	S	Bend	trans	-96.6	0.7	-166.7	-124.4	-95.7	0	0	0	116.3
523	A	33.4	Very low	35.1	Very low	105 Å²	105	136.6 Å²	136.6	87%	0.868	72%	0.718	S	S	*	*	S	Bend	trans	-98	2.6	-172.6	0	0	0	0	0	116
524	R	32.3	Very low	35.8	Very low	226 Å²	226	137.7 Å²	137.7	85%	0.853	71%	0.709	S	S	*	*	S	Bend	trans	-103.8	-6	-171.3	-142.2	172.8	-163.2	167.7	4.6	116.3
525	K	34.4	Very low	36.3	Very low	191 Å²	191	138.1 Å²	138.1	83%	0.83	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-0.4	-175.1	-85.5	-178.2	174.3	178.9	0	116.4
526	N	36.1	Very low	37.1	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	13.2	-175.1	-82	-7.2	0	0	0	116.1
527	S	41.8	Very low	38.1	Very low	64 Å²	64	131.9 Å²	131.9	45%	0.448	67%	0.669	S	S	.	*	S	Bend	trans	-101.9	-22	-174.1	89	0	0	0	0	116	K531	S527-K531 WeakPolarHBondContact O-CB 3.28Å; S527-K531 WeakPolarHBondContact O-CD 3.28Å; S527-K531 WeakPolarHBondContact O-CG 3.35Å; S527-K531 PolarHBondContact O-N 2.83Å
528	T	37.2	Very low	39.5	Very low	91 Å²	91	128.2 Å²	128.2	56%	0.558	66%	0.664	S	S	*	*	H	α-helix	trans	-92.2	-34.8	-174.3	-31.4	0	0	0	0	112.6	M532	T528-M532 PolarHBondContact O-N 3.02Å
529	V	39.9	Very low	40.7	Very low	93 Å²	93	128 Å²	128	56%	0.564	66%	0.656	S	S	*	*	H	α-helix	trans	-72.1	-43.6	175.5	179.3	0	0	0	0	110.5	K531 M532 E533	V529-K531 VanDerWaalsContact C-N 3.34Å; V529-K531 PolarHBondContact O-N 3.08Å; V529-M532 PolarHBondContact O-N 2.99Å; V529-E533 WeakPolarHBondContact O-CG 3.37Å; V529-E533 PolarHBondContact O-N 2.92Å
530	R	39.1	Very low	41.5	Very low	165 Å²	165	128.7 Å²	128.7	62%	0.623	65%	0.654	S	S	*	*	H	α-helix	trans	-62.8	-36.3	175.8	-165.2	175.6	177.2	161.3	4.7	113.1	M532 E533 E534	R530-M532 VanDerWaalsContact C-N 3.35Å; R530-E533 PolarHBondContact O-N 2.88Å; R530-E534 IonicContact NE-OE1 2.7Å; R530-E534 WeakPolarHBondContact O-CB 3.29Å; R530-E534 VanDerWaalsContact O-CG 3.29Å; R530-E534 WeakPolarHBondContact O-CG 3.44Å; R530-E534 PolarHBondContact O-N 2.93Å
531	K	43.9	Very low	42.5	Very low	142 Å²	142	129.5 Å²	129.5	62%	0.617	67%	0.665	S	S	*	*	H	α-helix	trans	-69.8	-28.3	173.1	-77.5	177.2	-177.9	178.2	0	113.3	S527 V529 Y535	S527-K531 WeakPolarHBondContact O-CB 3.28Å; S527-K531 WeakPolarHBondContact O-CD 3.28Å; S527-K531 WeakPolarHBondContact O-CG 3.35Å; S527-K531 PolarHBondContact O-N 2.83Å; V529-K531 VanDerWaalsContact C-N 3.34Å; V529-K531 PolarHBondContact O-N 3.08Å; K531-Y535 WeakPolarHBondContact O-CB 3.46Å; K531-Y535 PolarHBondContact O-N 2.8Å
532	M	39.8	Very low	43	Very low	91 Å²	91	132.6 Å²	132.6	45%	0.448	66%	0.663	S	S	.	*	H	α-helix	trans	-77.9	-36.2	172.4	-83.1	-171.8	173.5	0	0	112	T528 V529 R530 Y535 I536	T528-M532 PolarHBondContact O-N 3.02Å; V529-M532 PolarHBondContact O-N 2.99Å; R530-M532 VanDerWaalsContact C-N 3.35Å; M532-Y535 PolarHBondContact O-N 3.37Å; M532-I536 WeakPolarHBondContact O-CB 3.36Å; M532-I536 WeakPolarHBondContact O-CD1 3.35Å; M532-I536 WeakPolarHBondContact O-CG1 3.42Å; M532-I536 PolarHBondContact O-N 2.86Å
533	E	45.5	Very low	43.6	Very low	120 Å²	120	127.1 Å²	127.1	56%	0.561	65%	0.649	S	S	*	*	H	α-helix	trans	-66.4	-41	172.7	-71.5	173.4	163.9	0	0	111.8	V529 R530 Y535 I536 A537	V529-E533 WeakPolarHBondContact O-CG 3.37Å; V529-E533 PolarHBondContact O-N 2.92Å; R530-E533 PolarHBondContact O-N 2.88Å; E533-Y535 PolarHBondContact O-N 2.84Å; E533-I536 PolarHBondContact O-N 3.03Å; E533-A537 VanDerWaalsContact O-CB 3.29Å; E533-A537 WeakPolarHBondContact O-CB 3.36Å; E533-A537 PolarHBondContact O-N 3Å
534	E	48.5	Very low	44.2	Very low	108 Å²	108	128.3 Å²	128.3	51%	0.505	64%	0.637	S	S	.	*	H	α-helix	trans	-65.4	-35	173.7	-75.6	169	-175.2	0	0	112.3	R530 A538	R530-E534 IonicContact NE-OE1 2.7Å; R530-E534 WeakPolarHBondContact O-CB 3.29Å; R530-E534 VanDerWaalsContact O-CG 3.29Å; R530-E534 WeakPolarHBondContact O-CG 3.44Å; R530-E534 PolarHBondContact O-N 2.93Å; E534-A538 WeakPolarHBondContact O-CB 3.15Å; E534-A538 PolarHBondContact O-N 2.86Å
535	Y	47.5	Very low	44.9	Very low	149 Å²	149	122.5 Å²	122.5	58%	0.584	62%	0.624	S	S	*	*	H	α-helix	trans	-72.4	-33.5	175.3	-172.5	-95.4	0	0	0	113.1	K531 M532 E533 K539	K531-Y535 WeakPolarHBondContact O-CB 3.46Å; K531-Y535 PolarHBondContact O-N 2.8Å; M532-Y535 PolarHBondContact O-N 3.37Å; E533-Y535 PolarHBondContact O-N 2.84Å; Y535-K539 HydrophobicContact CE1-CD 4.46Å
536	I	47.6	Very low	45.5	Very low	101 Å²	101	118.3 Å²	118.3	52%	0.518	61%	0.611	S	S	.	*	H	α-helix	trans	-73.9	-41.3	175.3	-69.1	165.5	0	0	0	110.4	M532 E533 K539 Q540	M532-I536 WeakPolarHBondContact O-CB 3.36Å; M532-I536 WeakPolarHBondContact O-CD1 3.35Å; M532-I536 WeakPolarHBondContact O-CG1 3.42Å; M532-I536 PolarHBondContact O-N 2.86Å; E533-I536 PolarHBondContact O-N 3.03Å; I536-K539 PolarHBondContact O-N 2.89Å; I536-Q540 WeakPolarHBondContact O-CG 3.43Å
537	A	53.7	Low	46.2	Very low	56 Å²	56	116.7 Å²	116.7	46%	0.463	60%	0.602	S	S	.	*	H	α-helix	trans	-66.8	-37.1	175.5	0	0	0	0	0	112.5	E533 K539 Q540	E533-A537 VanDerWaalsContact O-CB 3.29Å; E533-A537 WeakPolarHBondContact O-CB 3.36Å; E533-A537 PolarHBondContact O-N 3Å; A537-K539 PolarHBondContact O-N 2.98Å; A537-Q540 PolarHBondContact O-N 3.1Å
538	A	57.8	Low	46.5	Very low	74 Å²	74	120.5 Å²	120.5	61%	0.612	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-11.9	178.8	0	0	0	0	0	114.7	E534	E534-A538 WeakPolarHBondContact O-CB 3.15Å; E534-A538 PolarHBondContact O-N 2.86Å
539	K	53.7	Low	47.2	Very low	151 Å²	151	122.8 Å²	122.8	66%	0.657	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	1.8	174.6	-90.1	-164.9	174.3	-173.3	0	114	Y535 I536 A537	Y535-K539 HydrophobicContact CE1-CD 4.46Å; I536-K539 PolarHBondContact O-N 2.89Å; A537-K539 PolarHBondContact O-N 2.98Å
540	Q	47.4	Very low	47.8	Very low	161 Å²	161	125.3 Å²	125.3	75%	0.752	62%	0.622	S	S	*	*			trans	-97.5	-2.7	176.5	-78.9	-176.8	-27.1	0	0	113.8	I536 A537	I536-Q540 WeakPolarHBondContact O-CG 3.43Å; A537-Q540 PolarHBondContact O-N 3.1Å
541	V	49	Very low	48.6	Very low	185 Å²	185	121.6 Å²	121.6	100%	1.121	62%	0.622	S	S	*	*			trans	-100.2	0	163.5	-176.7	0	0	0	0	107.9

Retrieved 541 of 541 residues in 410.6 ms (Link to these results)

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