A0A096NYL0_PAPAN Loading...

Synaptic vesicle glycoprotein 2A

Plays a role in the control of regulated secretion in neural and endocrine cells, enhancing selectively low-frequency neurotransmission. Positively regulates vesicle fusion by maintaining the readily releasable pool of secretory vesicles.

AlphaFold DB , UniProt , Accession A0A096NYL0, Species PAPAN (Papio anubis, Olive baboon), Gene SV2A, Length 742 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	45.9	Very low	49.2	Very low	221 Å²	221	138.7 Å²	138.7	100%	1.089	68%	0.676	S	S	*	*				0	-32.8	0	-157.5	176	-72.8	0	0	112
2	E	39.8	Very low	50.5	Low	169 Å²	169	136.5 Å²	136.5	79%	0.79	67%	0.667	S	S	*	*			trans	-70.5	-30.6	-176.2	-63	172.8	109.4	0	0	115.4	G4 F5 R6	E2-G4 PolarHBondContact O-N 3.44Å; E2-F5 VanDerWaalsContact O-CB 3.32Å; E2-F5 WeakPolarHBondContact O-CB 3.41Å; E2-F5 PolarHBondContact O-N 3.3Å; E2-R6 PolarHBondContact O-N 3.34Å
3	E	39	Very low	51.5	Low	158 Å²	158	139.2 Å²	139.2	74%	0.738	67%	0.666	S	S	*	*	H	α-helix	trans	-59.1	-46.1	-175.9	-66.3	173.4	128	0	0	112.8	F5 R6 D7	E3-F5 PolarHBondContact O-N 3.47Å; E3-R6 WeakPolarHBondContact O-CA 3.49Å; E3-R6 VanDerWaalsContact O-CB 3.28Å; E3-R6 WeakPolarHBondContact O-CB 3.49Å; E3-R6 PolarHBondContact O-N 3.42Å; E3-D7 PolarHBondContact O-N 3.17Å
4	G	46.2	Very low	52.8	Low	46 Å²	46	131.6 Å²	131.6	47%	0.474	64%	0.643	S	S	.	*	H	α-helix	trans	-64.5	-20.6	176.8	0	0	0	0	0	114.5	E2 R8	E2-G4 PolarHBondContact O-N 3.44Å; G4-R8 PolarHBondContact O-N 2.93Å
5	F	45.4	Very low	53.4	Low	160 Å²	160	126.1 Å²	126.1	70%	0.702	63%	0.627	S	S	*	*	H	α-helix	trans	-75.7	-37	169.5	-111.9	-84.7	0	0	0	111.5	E2 E3 A9	E2-F5 VanDerWaalsContact O-CB 3.32Å; E2-F5 WeakPolarHBondContact O-CB 3.41Å; E2-F5 PolarHBondContact O-N 3.3Å; E3-F5 PolarHBondContact O-N 3.47Å; F5-A9 WeakPolarHBondContact O-CB 3.41Å; F5-A9 PolarHBondContact O-N 3.09Å
6	R	43.9	Very low	53.9	Low	206 Å²	206	128.2 Å²	128.2	78%	0.777	63%	0.631	S	S	*	*	H	α-helix	trans	-67.3	-42	178.8	-153.6	172	-175.4	173.4	0.2	111.4	E2 E3 A9 A10	E2-R6 PolarHBondContact O-N 3.34Å; E3-R6 WeakPolarHBondContact O-CA 3.49Å; E3-R6 VanDerWaalsContact O-CB 3.28Å; E3-R6 WeakPolarHBondContact O-CB 3.49Å; E3-R6 PolarHBondContact O-N 3.42Å; R6-A9 PolarHBondContact O-N 3.04Å; R6-A10 PolarHBondContact O-N 2.87Å
7	D	53.3	Low	55	Low	117 Å²	117	126.2 Å²	126.2	63%	0.626	62%	0.624	S	S	*	*	H	α-helix	trans	-67	-42.4	175.4	-74.3	-22.1	0	0	0	112.6	E3 A9 A10 F11	E3-D7 PolarHBondContact O-N 3.17Å; D7-A9 VanDerWaalsContact C-N 3.29Å; D7-A9 PolarHBondContact O-N 3.27Å; D7-A10 PolarHBondContact O-N 2.89Å; D7-A10 VanDerWaalsContact O-N 3.13Å; D7-F11 WeakPolarHBondContact O-CB 3.21Å; D7-F11 PolarHBondContact O-N 2.86Å
8	R	51.5	Low	55.8	Low	187 Å²	187	125.7 Å²	125.7	71%	0.706	62%	0.622	S	S	*	*	H	α-helix	trans	-57.7	-42.5	171.3	-86.6	-175	165.4	-167.9	-3.7	111.7	G4 A10 F11 I12	G4-R8 PolarHBondContact O-N 2.93Å; R8-A10 VanDerWaalsContact C-N 3.3Å; R8-A10 PolarHBondContact O-N 3.2Å; R8-F11 PolarHBondContact O-N 2.86Å; R8-I12 WeakPolarHBondContact O-CB 3.38Å; R8-I12 WeakPolarHBondContact O-CD1 3.35Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 3.28Å; R8-I12 PolarHBondContact O-N 2.8Å
9	A	57.5	Low	56.3	Low	42 Å²	42	122.2 Å²	122.2	35%	0.347	62%	0.616	S	S	.	*	H	α-helix	trans	-70.4	-21.6	178	0	0	0	0	0	114.2	F5 R6 D7 R13	F5-A9 WeakPolarHBondContact O-CB 3.41Å; F5-A9 PolarHBondContact O-N 3.09Å; R6-A9 PolarHBondContact O-N 3.04Å; D7-A9 VanDerWaalsContact C-N 3.29Å; D7-A9 PolarHBondContact O-N 3.27Å; A9-R13 PolarHBondContact O-NE 3.3Å
10	A	56.9	Low	56.9	Low	57 Å²	57	123.4 Å²	123.4	47%	0.471	62%	0.617	S	S	.	*	H	α-helix	trans	-80.1	-47.7	171	0	0	0	0	0	111.3	R6 D7 R8 I12 R13 G14	R6-A10 PolarHBondContact O-N 2.87Å; D7-A10 PolarHBondContact O-N 2.89Å; D7-A10 VanDerWaalsContact O-N 3.13Å; R8-A10 VanDerWaalsContact C-N 3.3Å; R8-A10 PolarHBondContact O-N 3.2Å; A10-I12 PolarHBondContact O-N 3.28Å; A10-R13 WeakPolarHBondContact O-CA 3.44Å; A10-R13 WeakPolarHBondContact O-CB 3.46Å; A10-R13 PolarHBondContact O-N 3.22Å; A10-G14 PolarHBondContact O-N 2.7Å
11	F	61.7	Low	57.5	Low	163 Å²	163	121.3 Å²	121.3	72%	0.715	61%	0.605	S	S	*	*	H	α-helix	trans	-58.5	-45.6	177.7	-177.1	-96.9	0	0	0	112.3	D7 R8 R13 G14 A15	D7-F11 WeakPolarHBondContact O-CB 3.21Å; D7-F11 PolarHBondContact O-N 2.86Å; R8-F11 PolarHBondContact O-N 2.86Å; F11-R13 VanDerWaalsContact C-N 3.25Å; F11-R13 PolarHBondContact O-N 3.42Å; F11-G14 PolarHBondContact O-N 3.4Å; F11-A15 WeakPolarHBondContact O-CB 3.32Å; F11-A15 PolarHBondContact O-N 3.37Å
12	I	64.8	Low	58.6	Low	112 Å²	112	115.2 Å²	115.2	57%	0.574	58%	0.58	S	S	*	*	H	α-helix	trans	-62.4	-32.9	176.4	-68.9	166.2	0	0	0	111.5	R8 A10 K16	R8-I12 WeakPolarHBondContact O-CB 3.38Å; R8-I12 WeakPolarHBondContact O-CD1 3.35Å; R8-I12 VanDerWaalsContact O-CG1 3.24Å; R8-I12 WeakPolarHBondContact O-CG1 3.28Å; R8-I12 PolarHBondContact O-N 2.8Å; A10-I12 PolarHBondContact O-N 3.28Å; I12-K16 WeakPolarHBondContact O-CB 3.34Å; I12-K16 PolarHBondContact O-N 3.38Å
13	R	63.4	Low	59.8	Low	171 Å²	171	115 Å²	115	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-68.4	-51.5	173.9	-112.1	176.7	-80.2	-154.9	-6.4	111.4	A9 A10 F11 A15 K16 D17	A9-R13 PolarHBondContact O-NE 3.3Å; A10-R13 WeakPolarHBondContact O-CA 3.44Å; A10-R13 WeakPolarHBondContact O-CB 3.46Å; A10-R13 PolarHBondContact O-N 3.22Å; F11-R13 VanDerWaalsContact C-N 3.25Å; F11-R13 PolarHBondContact O-N 3.42Å; R13-A15 VanDerWaalsContact C-N 3.34Å; R13-A15 PolarHBondContact O-N 2.74Å; R13-K16 WeakPolarHBondContact O-CB 3.45Å; R13-K16 PolarHBondContact O-N 2.94Å; R13-D17 PolarHBondContact O-N 3.46Å
14	G	69.3	Low	61.2	Low	34 Å²	34	112.9 Å²	112.9	35%	0.351	57%	0.565	S	S	.	*	H	α-helix	trans	-55.9	-45.6	177.3	0	0	0	0	0	112.9	A10 F11 K16 D17 I18	A10-G14 PolarHBondContact O-N 2.7Å; F11-G14 PolarHBondContact O-N 3.4Å; G14-K16 VanDerWaalsContact C-N 3.31Å; G14-K16 PolarHBondContact O-N 2.92Å; G14-D17 PolarHBondContact O-N 3.38Å; G14-I18 VanDerWaalsContact O-CG1 3.27Å; G14-I18 WeakPolarHBondContact O-CG1 3.31Å; G14-I18 PolarHBondContact O-N 3.48Å
15	A	62.8	Low	62	Low	49 Å²	49	116.4 Å²	116.4	41%	0.405	57%	0.569	S	S	.	*	H	α-helix	trans	-60.8	-38.1	175.5	0	0	0	0	0	112.8	F11 R13 A19	F11-A15 WeakPolarHBondContact O-CB 3.32Å; F11-A15 PolarHBondContact O-N 3.37Å; R13-A15 VanDerWaalsContact C-N 3.34Å; R13-A15 PolarHBondContact O-N 2.74Å; A15-A19 WeakPolarHBondContact O-CB 3.41Å; A15-A19 PolarHBondContact O-N 3.46Å
16	K	61.2	Low	62.6	Low	159 Å²	159	111.2 Å²	111.2	69%	0.691	56%	0.555	S	S	*	*	H	α-helix	trans	-70.7	-37	179.2	-165.6	171.9	-172.5	174.4	0	112.5	I12 R13 G14 K20	I12-K16 WeakPolarHBondContact O-CB 3.34Å; I12-K16 PolarHBondContact O-N 3.38Å; R13-K16 WeakPolarHBondContact O-CB 3.45Å; R13-K16 PolarHBondContact O-N 2.94Å; G14-K16 VanDerWaalsContact C-N 3.31Å; G14-K16 PolarHBondContact O-N 2.92Å; K16-K20 WeakPolarHBondContact O-CB 3.45Å; K16-K20 PolarHBondContact O-N 2.84Å
17	D	71.9	Confident	63.5	Low	95 Å²	95	103.9 Å²	103.9	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-73.9	-37.7	175.8	-70.3	-41.5	0	0	0	112	R13 G14 K20 E21	R13-D17 PolarHBondContact O-N 3.46Å; G14-D17 PolarHBondContact O-N 3.38Å; D17-K20 WeakPolarHBondContact O-CB 3.29Å; D17-K20 PolarHBondContact O-N 3.33Å; D17-E21 PolarHBondContact O-N 2.84Å
18	I	69.9	Low	64.1	Low	116 Å²	116	105.6 Å²	105.6	60%	0.595	54%	0.541	S	S	*	.	H	α-helix	trans	-59	-48.2	169.9	-69.1	164.7	0	0	0	110.5	G14 K20 E21 V22	G14-I18 VanDerWaalsContact O-CG1 3.27Å; G14-I18 WeakPolarHBondContact O-CG1 3.31Å; G14-I18 PolarHBondContact O-N 3.48Å; I18-K20 VanDerWaalsContact C-N 3.27Å; I18-K20 PolarHBondContact O-N 2.92Å; I18-E21 PolarHBondContact O-N 3.3Å; I18-V22 HydrophobicContact CG2-CG2 4.35Å; I18-V22 WeakPolarHBondContact O-CB 3.35Å; I18-V22 WeakPolarHBondContact O-CG2 3.11Å; I18-V22 PolarHBondContact O-N 3.27Å
19	A	64.4	Low	64.8	Low	60 Å²	60	104.9 Å²	104.9	50%	0.496	54%	0.543	S	S	.	.	H	α-helix	trans	-60.9	-35.6	177.5	0	0	0	0	0	112.7	A15 K23	A15-A19 WeakPolarHBondContact O-CB 3.41Å; A15-A19 PolarHBondContact O-N 3.46Å; A19-K23 WeakPolarHBondContact O-CB 3.49Å; A19-K23 PolarHBondContact O-N 3.15Å
20	K	70.1	Confident	64.8	Low	146 Å²	146	107.3 Å²	107.3	64%	0.635	55%	0.553	S	S	*	*	H	α-helix	trans	-67.1	-43.4	176.4	-172.1	179.7	178.8	-174.7	0	112	K16 D17 I18 K23 K24	K16-K20 WeakPolarHBondContact O-CB 3.45Å; K16-K20 PolarHBondContact O-N 2.84Å; D17-K20 WeakPolarHBondContact O-CB 3.29Å; D17-K20 PolarHBondContact O-N 3.33Å; I18-K20 VanDerWaalsContact C-N 3.27Å; I18-K20 PolarHBondContact O-N 2.92Å; K20-K23 PolarHBondContact O-N 3.35Å; K20-K24 WeakPolarHBondContact O-CB 3.36Å; K20-K24 PolarHBondContact O-N 3.44Å
21	E	67.6	Low	65.2	Low	80 Å²	80	108.6 Å²	108.6	37%	0.374	56%	0.555	S	S	.	*	H	α-helix	trans	-74.3	-34.9	179.1	-159.2	58.8	-147.1	0	0	111.9	D17 I18 K24 H25	D17-E21 PolarHBondContact O-N 2.84Å; I18-E21 PolarHBondContact O-N 3.3Å; E21-K24 WeakPolarHBondContact O-CB 3.45Å; E21-K24 PolarHBondContact O-N 3.41Å; E21-K24 WeakPolarHBondContact OE1-CE 3.29Å; E21-K24 IonicContact OE1-NZ 3.79Å; E21-K24 PolarHBondContact OE1-NZ 2.84Å; E21-K24 WeakPolarHBondContact OE2-CD 3.22Å; E21-K24 IonicContact OE2-NZ 2.8Å; E21-K24 PolarHBondContact OE2-NZ 3.32Å; E21-H25 PolarHBondContact O-CD2 2.88Å; E21-H25 PolarHBondContact O-N 2.79Å; E21-H25 IonicContact OE1-CD2 3.56Å
22	V	69.8	Low	65	Low	92 Å²	92	108.7 Å²	108.7	56%	0.558	56%	0.555	S	S	*	*	H	α-helix	trans	-59.7	-45.3	168.4	169.1	0	0	0	0	111	I18 K24 H25 A26	I18-V22 HydrophobicContact CG2-CG2 4.35Å; I18-V22 WeakPolarHBondContact O-CB 3.35Å; I18-V22 WeakPolarHBondContact O-CG2 3.11Å; I18-V22 PolarHBondContact O-N 3.27Å; V22-K24 VanDerWaalsContact C-N 3.28Å; V22-K24 PolarHBondContact O-N 3.07Å; V22-H25 PolarHBondContact O-N 3.24Å; V22-A26 WeakPolarHBondContact O-CB 3.43Å; V22-A26 PolarHBondContact O-N 2.96Å
23	K	64.4	Low	64.6	Low	165 Å²	165	104.9 Å²	104.9	72%	0.717	54%	0.543	S	S	*	.	H	α-helix	trans	-62.1	-35.3	176	-171.3	171.1	-177.2	174.4	0	112.3	A19 K20 A27	A19-K23 WeakPolarHBondContact O-CB 3.49Å; A19-K23 PolarHBondContact O-N 3.15Å; K20-K23 PolarHBondContact O-N 3.35Å; K23-A27 WeakPolarHBondContact O-CB 3.47Å; K23-A27 PolarHBondContact O-N 2.61Å
24	K	69.9	Low	64.1	Low	113 Å²	113	102 Å²	102	49%	0.491	54%	0.54	S	S	.	.	H	α-helix	trans	-71.4	-37.8	175.9	179.6	168.2	157.2	-124.4	0	112.7	K20 E21 V22 K28	K20-K24 WeakPolarHBondContact O-CB 3.36Å; K20-K24 PolarHBondContact O-N 3.44Å; E21-K24 WeakPolarHBondContact O-CB 3.45Å; E21-K24 PolarHBondContact O-N 3.41Å; E21-K24 WeakPolarHBondContact OE1-CE 3.29Å; E21-K24 IonicContact OE1-NZ 3.79Å; E21-K24 PolarHBondContact OE1-NZ 2.84Å; E21-K24 WeakPolarHBondContact OE2-CD 3.22Å; E21-K24 IonicContact OE2-NZ 2.8Å; E21-K24 PolarHBondContact OE2-NZ 3.32Å; V22-K24 VanDerWaalsContact C-N 3.28Å; V22-K24 PolarHBondContact O-N 3.07Å; K24-K28 PolarHBondContact O-N 3.15Å
25	H	63.2	Low	63.5	Low	120 Å²	120	104.6 Å²	104.6	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-68.6	-38.6	170.6	-90.8	-97.4	0	0	0	112.7	E21 V22 K28 K29	E21-H25 PolarHBondContact O-CD2 2.88Å; E21-H25 PolarHBondContact O-N 2.79Å; E21-H25 IonicContact OE1-CD2 3.56Å; V22-H25 PolarHBondContact O-N 3.24Å; H25-K28 PolarHBondContact O-N 3.17Å; H25-K29 PolarHBondContact O-N 3.19Å
26	A	57.9	Low	63	Low	51 Å²	51	110.1 Å²	110.1	42%	0.421	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-47.6	173	0	0	0	0	0	111.1	V22 K28 K29 V30	V22-A26 WeakPolarHBondContact O-CB 3.43Å; V22-A26 PolarHBondContact O-N 2.96Å; A26-K28 PolarHBondContact O-N 2.81Å; A26-K29 PolarHBondContact O-N 3.28Å; A26-K29 VanDerWaalsContact O-N 3.09Å; A26-V30 WeakPolarHBondContact O-CG2 3.24Å; A26-V30 PolarHBondContact O-N 3.22Å
27	A	61.6	Low	62.8	Low	52 Å²	52	107 Å²	107	43%	0.43	55%	0.551	S	S	.	*	H	α-helix	trans	-57.4	-45.4	174.8	0	0	0	0	0	112.2	K23 K29 V30 V31	K23-A27 WeakPolarHBondContact O-CB 3.47Å; K23-A27 PolarHBondContact O-N 2.61Å; A27-K29 VanDerWaalsContact C-N 3.33Å; A27-K29 PolarHBondContact O-N 3.3Å; A27-V30 PolarHBondContact O-N 3.22Å; A27-V31 WeakPolarHBondContact O-CG2 3.36Å; A27-V31 PolarHBondContact O-N 3.12Å
28	K	66.1	Low	61.8	Low	153 Å²	153	109 Å²	109	67%	0.665	56%	0.557	S	S	*	*	H	α-helix	trans	-61.6	-35.5	174.2	-83.8	-169.3	170	-172	0	113.5	K24 H25 A26 K32	K24-K28 PolarHBondContact O-N 3.15Å; H25-K28 PolarHBondContact O-N 3.17Å; A26-K28 PolarHBondContact O-N 2.81Å; K28-K32 WeakPolarHBondContact O-CB 3.32Å; K28-K32 PolarHBondContact O-N 3.39Å; K28-K32 VanDerWaalsContact O-N 3.14Å
29	K	65.9	Low	61	Low	172 Å²	172	108.9 Å²	108.9	75%	0.748	56%	0.557	S	S	*	*	H	α-helix	trans	-69.1	-37.9	173.3	-83.1	-170.6	172.4	-173.4	0	112.6	H25 A26 A27 G33	H25-K29 PolarHBondContact O-N 3.19Å; A26-K29 PolarHBondContact O-N 3.28Å; A26-K29 VanDerWaalsContact O-N 3.09Å; A27-K29 VanDerWaalsContact C-N 3.33Å; A27-K29 PolarHBondContact O-N 3.3Å; K29-G33 PolarHBondContact O-N 2.94Å
30	V	58.6	Low	60.5	Low	93 Å²	93	110.9 Å²	110.9	56%	0.564	56%	0.556	S	S	*	*	H	α-helix	trans	-68.8	-46.4	177.9	171.6	0	0	0	0	111.1	A26 A27 G33 L34	A26-V30 WeakPolarHBondContact O-CG2 3.24Å; A26-V30 PolarHBondContact O-N 3.22Å; A27-V30 PolarHBondContact O-N 3.22Å; V30-G33 WeakPolarHBondContact O-CA 3.36Å; V30-G33 PolarHBondContact O-N 2.82Å; V30-L34 HydrophobicContact CG1-CD1 4.24Å; V30-L34 PolarHBondContact O-N 2.84Å
31	V	64.4	Low	59.3	Low	85 Å²	85	112.5 Å²	112.5	52%	0.515	56%	0.56	S	S	.	*	H	α-helix	trans	-57.8	-52.4	175.3	172.6	0	0	0	0	110.4	A27 G33 L34 D35	A27-V31 WeakPolarHBondContact O-CG2 3.36Å; A27-V31 PolarHBondContact O-N 3.12Å; V31-G33 PolarHBondContact O-N 2.73Å; V31-L34 WeakPolarHBondContact O-CA 3.2Å; V31-L34 WeakPolarHBondContact O-CB 3.44Å; V31-L34 PolarHBondContact O-N 2.82Å; V31-D35 PolarHBondContact O-N 2.97Å
32	K	57.6	Low	58.3	Low	164 Å²	164	111.9 Å²	111.9	71%	0.713	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-13.7	177.6	-162.8	169.3	-175.3	177.1	0	114	K28 D35	K28-K32 WeakPolarHBondContact O-CB 3.32Å; K28-K32 PolarHBondContact O-N 3.39Å; K28-K32 VanDerWaalsContact O-N 3.14Å; K32-D35 WeakPolarHBondContact CA-OD2 3.37Å
33	G	55.9	Low	56.9	Low	32 Å²	32	117.4 Å²	117.4	33%	0.33	58%	0.575	S	S	.	*	H	α-helix	trans	-81.6	-44.8	168.2	0	0	0	0	0	112.2	K29 V30 V31 R36 V37	K29-G33 PolarHBondContact O-N 2.94Å; V30-G33 WeakPolarHBondContact O-CA 3.36Å; V30-G33 PolarHBondContact O-N 2.82Å; V31-G33 PolarHBondContact O-N 2.73Å; G33-R36 PolarHBondContact O-N 3.2Å; G33-V37 WeakPolarHBondContact O-CG2 3.29Å; G33-V37 PolarHBondContact O-N 3.43Å
34	L	53.8	Low	55.9	Low	112 Å²	112	119 Å²	119	59%	0.586	58%	0.577	S	S	*	*	H	α-helix	trans	-59.9	-50	174	-105.9	74.7	0	0	0	111.6	V30 V31 R36 V37 Q38	V30-L34 HydrophobicContact CG1-CD1 4.24Å; V30-L34 PolarHBondContact O-N 2.84Å; V31-L34 WeakPolarHBondContact O-CA 3.2Å; V31-L34 WeakPolarHBondContact O-CB 3.44Å; V31-L34 PolarHBondContact O-N 2.82Å; L34-R36 PolarHBondContact O-N 3.28Å; L34-V37 PolarHBondContact O-N 3.49Å; L34-Q38 WeakPolarHBondContact O-CB 3.37Å; L34-Q38 PolarHBondContact O-N 3.22Å
35	D	56.3	Low	54.4	Low	88 Å²	88	116.6 Å²	116.6	47%	0.471	57%	0.574	S	S	.	*	H	α-helix	trans	-51.7	-46.7	179.4	-55.5	-30.3	0	0	0	110.4	V31 K32 Q38 D39	V31-D35 PolarHBondContact O-N 2.97Å; K32-D35 WeakPolarHBondContact CA-OD2 3.37Å; D35-Q38 PolarHBondContact O-N 3.17Å; D35-D39 PolarHBondContact O-N 2.75Å
36	R	52.5	Low	53.3	Low	164 Å²	164	119.3 Å²	119.3	62%	0.619	58%	0.581	S	S	*	*	H	α-helix	trans	-68.7	-39.2	179.5	178.9	178.5	165	168	-1.4	113.2	G33 L34 Q38 D39 E40	G33-R36 PolarHBondContact O-N 3.2Å; L34-R36 PolarHBondContact O-N 3.28Å; R36-Q38 VanDerWaalsContact C-N 3.27Å; R36-D39 PolarHBondContact O-N 3.01Å; R36-E40 IonicContact CZ-OE1 3.43Å; R36-E40 VanDerWaalsContact CZ-OE1 3.28Å; R36-E40 IonicContact NE-OE1 3.38Å; R36-E40 PolarHBondContact NE-OE1 3.11Å; R36-E40 IonicContact NH2-OE1 2.68Å; R36-E40 PolarHBondContact NH2-OE1 3.1Å; R36-E40 WeakPolarHBondContact O-CB 3.34Å; R36-E40 WeakPolarHBondContact O-CG 3.43Å; R36-E40 PolarHBondContact O-N 3.17Å
37	V	56.8	Low	52.4	Low	94 Å²	94	119.4 Å²	119.4	57%	0.57	58%	0.578	S	S	*	*	H	α-helix	trans	-66.1	-34.9	175	168.9	0	0	0	0	110.4	G33 L34 E40 Y41	G33-V37 WeakPolarHBondContact O-CG2 3.29Å; G33-V37 PolarHBondContact O-N 3.43Å; L34-V37 PolarHBondContact O-N 3.49Å; V37-E40 PolarHBondContact O-N 3.49Å; V37-Y41 WeakPolarHBondContact O-CB 3.03Å; V37-Y41 PolarHBondContact O-N 3.42Å
38	Q	51.8	Low	51.1	Low	136 Å²	136	124.6 Å²	124.6	64%	0.636	59%	0.587	S	S	*	*	H	α-helix	trans	-72.5	-36.8	177.2	-166.9	161.9	-21.8	0	0	112.4	L34 D35 R36 S42	L34-Q38 WeakPolarHBondContact O-CB 3.37Å; L34-Q38 PolarHBondContact O-N 3.22Å; D35-Q38 PolarHBondContact O-N 3.17Å; R36-Q38 VanDerWaalsContact C-N 3.27Å; Q38-S42 VanDerWaalsContact O-CB 3.3Å; Q38-S42 WeakPolarHBondContact O-CB 3.06Å; Q38-S42 PolarHBondContact O-N 3.17Å; Q38-S42 PolarHBondContact O-OG 3.24Å
39	D	52.4	Low	49.7	Very low	114 Å²	114	124.7 Å²	124.7	61%	0.61	59%	0.587	S	S	*	*	H	α-helix	trans	-61.6	-47.2	167.4	-82.7	-17.9	0	0	0	112.1	D35 R36 Y41 S42 R43	D35-D39 PolarHBondContact O-N 2.75Å; R36-D39 PolarHBondContact O-N 3.01Å; D39-Y41 VanDerWaalsContact C-N 3.33Å; D39-Y41 PolarHBondContact O-N 3.16Å; D39-S42 PolarHBondContact O-N 3.44Å; D39-R43 PolarHBondContact O-N 2.83Å
40	E	53.8	Low	48.4	Very low	102 Å²	102	123.9 Å²	123.9	48%	0.477	59%	0.586	S	S	.	*	H	α-helix	trans	-63.7	-37.4	178.5	-76	175.9	-166.8	0	0	111.6	R36 V37 R44	R36-E40 IonicContact CZ-OE1 3.43Å; R36-E40 VanDerWaalsContact CZ-OE1 3.28Å; R36-E40 IonicContact NE-OE1 3.38Å; R36-E40 PolarHBondContact NE-OE1 3.11Å; R36-E40 IonicContact NH2-OE1 2.68Å; R36-E40 PolarHBondContact NH2-OE1 3.1Å; R36-E40 WeakPolarHBondContact O-CB 3.34Å; R36-E40 WeakPolarHBondContact O-CG 3.43Å; R36-E40 PolarHBondContact O-N 3.17Å; V37-E40 PolarHBondContact O-N 3.49Å; E40-R44 WeakPolarHBondContact O-CB 3.42Å; E40-R44 PolarHBondContact O-N 3.36Å
41	Y	44.5	Very low	47.3	Very low	181 Å²	181	127.4 Å²	127.4	71%	0.71	60%	0.597	S	S	*	*	H	α-helix	trans	-69.9	-41.2	174.3	-158.2	-88.2	0	0	0	112.3	V37 D39 R44 S45	V37-Y41 WeakPolarHBondContact O-CB 3.03Å; V37-Y41 PolarHBondContact O-N 3.42Å; D39-Y41 VanDerWaalsContact C-N 3.33Å; D39-Y41 PolarHBondContact O-N 3.16Å; Y41-R44 PolarHBondContact O-N 2.9Å; Y41-S45 PolarHBondContact O-N 3.24Å
42	S	47.4	Very low	45.8	Very low	66 Å²	66	129.6 Å²	129.6	46%	0.462	60%	0.601	S	S	.	*	H	α-helix	trans	-64.9	-43.4	-179.8	-57.7	0	0	0	0	111.6	Q38 D39 R44 S45 Y46	Q38-S42 VanDerWaalsContact O-CB 3.3Å; Q38-S42 WeakPolarHBondContact O-CB 3.06Å; Q38-S42 PolarHBondContact O-N 3.17Å; Q38-S42 PolarHBondContact O-OG 3.24Å; D39-S42 PolarHBondContact O-N 3.44Å; S42-R44 VanDerWaalsContact C-N 3.33Å; S42-R44 PolarHBondContact O-N 2.86Å; S42-S45 PolarHBondContact O-N 3.26Å; S42-Y46 PolarHBondContact O-N 3.39Å; S42-Y46 VanDerWaalsContact O-N 3.16Å
43	R	40.6	Very low	44.5	Very low	208 Å²	208	129 Å²	129	79%	0.785	61%	0.606	S	S	*	*	H	α-helix	trans	-58.9	-43.1	172.2	-89.7	-178.5	156	168.4	-5.8	112.7	D39 S45 Y46 S47	D39-R43 PolarHBondContact O-N 2.83Å; R43-S45 VanDerWaalsContact C-N 3.28Å; R43-S45 PolarHBondContact O-N 2.99Å; R43-Y46 PolarHBondContact O-N 3.4Å; R43-S47 PolarHBondContact O-N 2.91Å; R43-S47 VanDerWaalsContact O-N 3.1Å
44	R	42.4	Very low	43.2	Very low	199 Å²	199	135.2 Å²	135.2	75%	0.751	63%	0.631	S	S	*	*	H	α-helix	trans	-73.1	-20.1	-178.3	-157.6	175.6	-167.1	177.6	3.1	113.6	E40 Y41 S42 S47	E40-R44 WeakPolarHBondContact O-CB 3.42Å; E40-R44 PolarHBondContact O-N 3.36Å; Y41-R44 PolarHBondContact O-N 2.9Å; S42-R44 VanDerWaalsContact C-N 3.33Å; S42-R44 PolarHBondContact O-N 2.86Å; R44-S47 PolarHBondContact O-OG 3.38Å
45	S	39.4	Very low	42	Very low	63 Å²	63	137.4 Å²	137.4	44%	0.441	64%	0.644	S	S	.	*	H	α-helix	trans	-77.4	-34.8	168.1	-168	0	0	0	0	111.9	Y41 S42 R43	Y41-S45 PolarHBondContact O-N 3.24Å; S42-S45 PolarHBondContact O-N 3.26Å; R43-S45 VanDerWaalsContact C-N 3.28Å; R43-S45 PolarHBondContact O-N 2.99Å
46	Y	39.1	Very low	40.8	Very low	176 Å²	176	141.4 Å²	141.4	69%	0.69	67%	0.665	S	S	*	*	H	α-helix	trans	-70.2	-46.3	179.3	-130.8	-82.8	0	0	0	111.5	S42 R43 R48 F49	S42-Y46 PolarHBondContact O-N 3.39Å; S42-Y46 VanDerWaalsContact O-N 3.16Å; R43-Y46 PolarHBondContact O-N 3.4Å; Y46-R48 PolarHBondContact O-N 2.79Å; Y46-R48 VanDerWaalsContact O-N 3.11Å; Y46-F49 PolarHBondContact O-N 3.05Å; Y46-F49 VanDerWaalsContact O-N 3.07Å
47	S	39.4	Very low	39.7	Very low	53 Å²	53	140.3 Å²	140.3	37%	0.371	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.2	-14.1	179.9	66.2	0	0	0	0	114.7	R43 R44	R43-S47 PolarHBondContact O-N 2.91Å; R43-S47 VanDerWaalsContact O-N 3.1Å; R44-S47 PolarHBondContact O-OG 3.38Å
48	R	34.8	Very low	38.3	Very low	162 Å²	162	144.6 Å²	144.6	61%	0.611	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-29.2	173.8	171.9	168.1	-80.3	-172.2	-13.8	112.4	Y46 E50 E51	Y46-R48 PolarHBondContact O-N 2.79Å; Y46-R48 VanDerWaalsContact O-N 3.11Å; R48-E50 PolarHBondContact O-N 3.44Å; R48-E51 PolarHBondContact O-N 3.1Å
49	F	36.4	Very low	37.8	Very low	155 Å²	155	143.2 Å²	143.2	68%	0.68	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-4.8	177.2	-85	-76.5	0	0	0	113.4	Y46	Y46-F49 PolarHBondContact O-N 3.05Å; Y46-F49 VanDerWaalsContact O-N 3.07Å
50	E	38	Very low	36.5	Very low	155 Å²	155	142.4 Å²	142.4	72%	0.724	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	3.9	174.1	-64.7	178.7	142.2	0	0	112.3	R48	R48-E50 PolarHBondContact O-N 3.44Å
51	E	36.3	Very low	35.7	Very low	167 Å²	167	143 Å²	143	78%	0.78	71%	0.707	S	S	*	*	S	Bend	trans	-123.8	7.2	-176.3	-68.5	-177.1	156.6	0	0	113.8	R48	R48-E51 PolarHBondContact O-N 3.1Å
52	E	31.9	Very low	34.7	Very low	131 Å²	131	139.5 Å²	139.5	61%	0.612	71%	0.709	S	S	*	*	S	Bend	trans	-122.4	9.1	-174.5	-72	-179.4	175.5	0	0	114.5
53	D	30	Very low	33.7	Very low	151 Å²	151	143.4 Å²	143.4	81%	0.807	73%	0.725	S	S	*	*	S	Bend	trans	-122.7	33.8	-169.1	-103.1	-13	0	0	0	114.6
54	D	30.1	Very low	32.9	Very low	162 Å²	162	137.8 Å²	137.8	87%	0.866	72%	0.718	S	S	*	*			trans	-143.1	151.3	169	-99.6	-44.1	0	0	0	111.4
55	D	28.8	Very low	32.1	Very low	158 Å²	158	137.8 Å²	137.8	85%	0.845	72%	0.719	S	S	*	*			trans	75.4	97.8	-177.9	-66.7	-25.2	0	0	0	119.7
56	D	29.5	Very low	31.5	Very low	172 Å²	172	143.9 Å²	143.9	92%	0.92	73%	0.734	S	S	*	*			trans	-166.7	162	133.9	-117.7	-21.9	0	0	0	113.6
57	D	31.2	Very low	30.8	Very low	141 Å²	141	146.5 Å²	146.5	75%	0.754	74%	0.742	S	S	*	*			trans	-71.2	164.2	-150.6	-110.7	-30.9	0	0	0	123.5
58	F	26.5	Very low	30.1	Very low	185 Å²	185	146.7 Å²	146.7	81%	0.811	75%	0.753	S	S	*	*			trans	-23.5	177.5	160.7	-87.9	-92.3	0	0	0	121.7
59	P	42.2	Very low	29.7	Very low	107 Å²	107	148.3 Å²	148.3	70%	0.695	77%	0.767	S	S	*	*			cis	-139.8	146	-6.9	33.5	-12.2	0	0	0	118.9
60	A	23.6	Very low	29.2	Very low	97 Å²	97	144.2 Å²	144.2	80%	0.802	77%	0.769	S	S	*	*			trans	56.8	171	140.3	0	0	0	0	0	122
61	P	38.3	Very low	28.7	Very low	113 Å²	113	143.1 Å²	143.1	73%	0.734	77%	0.773	S	S	*	*			cis	-128.2	-175.3	-18.2	41.6	-26.5	0	0	0	115.2
62	S	23.2	Very low	28.2	Very low	108 Å²	108	142.8 Å²	142.8	76%	0.755	77%	0.771	S	S	*	*			trans	92.8	151.8	148.4	73.4	0	0	0	0	122.4
63	D	25.1	Very low	28.1	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	78%	0.78	S	S	*	*			trans	59.8	86.7	167.1	-67.5	6.2	0	0	0	122
64	S	23.9	Very low	28	Very low	89 Å²	89	144.6 Å²	144.6	62%	0.622	78%	0.78	S	S	*	*				35	129.4	109.5	-178.7	0	0	0	0	119.3
65	Y	26.8	Very low	28	Very low	199 Å²	199	145.7 Å²	145.7	78%	0.78	78%	0.779	S	S	*	*				-171.8	110.4	112.9	-111.2	-83.2	0	0	0	113.6
66	Y	26	Very low	28.1	Very low	192 Å²	192	146.3 Å²	146.3	75%	0.753	78%	0.777	S	S	*	*			trans	60.4	133.2	143.6	-91.1	-106	0	0	0	124.5
67	R	24.9	Very low	28	Very low	230 Å²	230	141 Å²	141	87%	0.868	76%	0.763	S	S	*	*			trans	82.4	131.5	136.8	-159.7	-179.4	-160.5	155.8	4.1	118.3
68	G	25.2	Very low	27.9	Very low	57 Å²	57	138 Å²	138	59%	0.588	77%	0.765	S	S	*	*			cis	156.7	155.4	-7.7	0	0	0	0	0	113.1
69	E	26.1	Very low	28	Very low	197 Å²	197	134.2 Å²	134.2	92%	0.921	77%	0.769	S	S	*	*			trans	66.3	143.4	-179.8	-54.6	170.7	124.8	0	0	113.4
70	G	25.2	Very low	27.6	Very low	69 Å²	69	134.9 Å²	134.9	71%	0.711	78%	0.776	S	S	*	*			cis	159.5	124	-1.8	0	0	0	0	0	106.3
71	T	28	Very low	28.2	Very low	131 Å²	131	135 Å²	135	80%	0.804	77%	0.77	S	S	*	*				-163.3	143.4	77.3	44.5	0	0	0	0	108.7
72	Q	25.7	Very low	27.8	Very low	161 Å²	161	136.5 Å²	136.5	75%	0.752	77%	0.772	S	S	*	*				77.1	150.2	72.3	-130.5	175.2	-9.6	0	0	114.9
73	D	29.1	Very low	28.6	Very low	148 Å²	148	135.8 Å²	135.8	79%	0.791	77%	0.773	S	S	*	*			trans	83	117.4	-166.5	-51.2	-10.7	0	0	0	112.8
74	E	28.6	Very low	29	Very low	172 Å²	172	134.6 Å²	134.6	80%	0.804	77%	0.771	S	S	*	*			cis	66.7	129	28.8	-57.7	-178.4	-172.3	0	0	113.4
75	E	30.4	Very low	29.4	Very low	184 Å²	184	139.2 Å²	139.2	86%	0.86	78%	0.783	S	S	*	*			cis	-134.4	-174.3	-3	-47.8	175.4	95.9	0	0	108.2
76	E	30.3	Very low	29.6	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	78%	0.776	S	S	*	*			cis	-162.9	160.2	-4.6	-143.4	-67.5	91.6	0	0	108.3
77	G	28.7	Very low	29.8	Very low	59 Å²	59	131.3 Å²	131.3	61%	0.608	78%	0.776	S	S	*	*			trans	88.6	139.3	155	0	0	0	0	0	117.8
78	G	27.7	Very low	30.7	Very low	79 Å²	79	128.1 Å²	128.1	81%	0.814	78%	0.776	S	S	*	*			cis	-174.3	175.6	-1.5	0	0	0	0	0	112.9
79	A	29.6	Very low	31.2	Very low	106 Å²	106	133 Å²	133	88%	0.876	78%	0.784	S	S	*	*			trans	-69.4	166.8	-176.8	0	0	0	0	0	113.2
80	S	32.7	Very low	31.6	Very low	121 Å²	121	131.2 Å²	131.2	85%	0.846	78%	0.781	S	S	*	*				-157.1	168.5	56.3	58.9	0	0	0	0	115.9
81	S	35.9	Very low	32.1	Very low	98 Å²	98	135.3 Å²	135.3	69%	0.685	79%	0.786	S	S	*	*			trans	-104	-168.1	-179.5	61.9	0	0	0	0	114.1
82	D	30.6	Very low	32.6	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	79%	0.791	S	S	*	*			trans	88.9	122.3	168	-55.4	7.7	0	0	0	114.7
83	A	39.4	Very low	33	Very low	92 Å²	92	137.8 Å²	137.8	76%	0.76	79%	0.792	S	S	*	*			cis	88.6	95.8	12.3	0	0	0	0	0	118
84	T	34.8	Very low	33.3	Very low	124 Å²	124	140.8 Å²	140.8	76%	0.761	79%	0.794	S	S	*	*			trans	-164.7	131.3	154	21	0	0	0	0	106.3
85	E	31.2	Very low	33.6	Very low	187 Å²	187	141 Å²	141	87%	0.874	79%	0.794	S	S	*	*				62.6	123.3	83.3	-167.1	178.9	-141.1	0	0	112.4
86	G	31.1	Very low	33.7	Very low	62 Å²	62	135.1 Å²	135.1	64%	0.639	78%	0.783	S	S	*	*			cis	146.7	129.5	-3.7	0	0	0	0	0	110.9
87	H	29.8	Very low	33.7	Very low	163 Å²	163	135.4 Å²	135.4	76%	0.755	79%	0.785	S	S	*	*			trans	-169.1	141.8	169.5	-124.3	-90.9	0	0	0	112.7	E89	H87-E89 IonicContact CE1-OE1 3.91Å; H87-E89 PolarHBondContact CE1-OE1 2.82Å; H87-E89 IonicContact ND1-OE1 2.77Å
88	D	43.9	Very low	33.8	Very low	163 Å²	163	143 Å²	143	87%	0.872	80%	0.797	S	S	*	*			trans	-120.7	128.6	168.8	-63.7	-60.6	0	0	0	109.1
89	E	36.5	Very low	34	Very low	160 Å²	160	147.7 Å²	147.7	75%	0.748	80%	0.797	S	S	*	*			trans	-158.3	139.3	169.4	-61.2	-177.9	178.1	0	0	106.3	H87	H87-E89 IonicContact CE1-OE1 3.91Å; H87-E89 PolarHBondContact CE1-OE1 2.82Å; H87-E89 IonicContact ND1-OE1 2.77Å
90	D	34.1	Very low	33.9	Very low	159 Å²	159	145.5 Å²	145.5	85%	0.85	79%	0.785	S	S	*	*			cis	-157.4	163.5	-14.7	-119.6	-26.9	0	0	0	108.2
91	D	36.6	Very low	33.9	Very low	155 Å²	155	146.8 Å²	146.8	83%	0.829	78%	0.781	S	S	*	*			trans	-81	126.5	177	-89.1	-46	0	0	0	112.7
92	E	37.2	Very low	33.6	Very low	191 Å²	191	148.1 Å²	148.1	89%	0.893	79%	0.787	S	S	*	*			trans	-121	97.5	161.6	-77.8	-157.4	151.7	0	0	112.4	Y94	E92-Y94 PolarHBondContact O-N 3.34Å
93	I	35.7	Very low	33.5	Very low	152 Å²	152	152 Å²	152	78%	0.779	79%	0.791	S	S	*	*			trans	-78.7	112	165.6	-64.3	172.7	0	0	0	108.4	E95	I93-E95 PolarHBondContact O-N 3Å
94	Y	35.6	Very low	33	Very low	212 Å²	212	152.6 Å²	152.6	83%	0.831	80%	0.796	S	S	*	*			trans	-84.3	100.6	178.6	-163	-96.4	0	0	0	112.1	E92 G96	E92-Y94 PolarHBondContact O-N 3.34Å; Y94-G96 PolarHBondContact O-N 3.34Å
95	E	33.8	Very low	32.6	Very low	175 Å²	175	155.3 Å²	155.3	82%	0.818	80%	0.8	S	S	*	*			trans	-70.1	115.1	169.2	-67.5	-164.4	150.1	0	0	110.7	I93 E97	I93-E95 PolarHBondContact O-N 3Å; E95-E97 PolarHBondContact O-N 3.48Å
96	G	32.6	Very low	32.4	Very low	61 Å²	61	152.2 Å²	152.2	63%	0.629	80%	0.799	S	S	*	*			trans	-74.1	119.4	175.4	0	0	0	0	0	112.2	Y94 Y98	Y94-G96 PolarHBondContact O-N 3.34Å; G96-Y98 PolarHBondContact O-N 3.36Å
97	E	30.6	Very low	32.1	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	81%	0.806	S	S	*	*			trans	-57.6	118.2	176.6	-73.4	-164.8	132.3	0	0	112.1	E95 Q99	E95-E97 PolarHBondContact O-N 3.48Å; E97-Q99 PolarHBondContact O-N 3.16Å
98	Y	29.6	Very low	31.8	Very low	220 Å²	220	150 Å²	150	86%	0.863	80%	0.804	S	S	*	*			trans	-77.9	81.7	-175	-152	-80.1	0	0	0	111.4	G96 G100	G96-Y98 PolarHBondContact O-N 3.36Å; Y98-G100 PolarHBondContact O-N 2.87Å; Y98-G100 VanDerWaalsContact O-N 3.09Å
99	Q	32.3	Very low	31	Very low	176 Å²	176	152.1 Å²	152.1	82%	0.822	81%	0.806	S	S	*	*			trans	-60	114.9	178.1	-70.8	-166.3	-1.2	0	0	111.3	E97	E97-Q99 PolarHBondContact O-N 3.16Å
100	G	29.1	Very low	30.4	Very low	61 Å²	61	148.4 Å²	148.4	63%	0.629	81%	0.81	S	S	*	*			trans	-68.2	137.2	-170.5	0	0	0	0	0	114.2	Y98 P102	Y98-G100 PolarHBondContact O-N 2.87Å; Y98-G100 VanDerWaalsContact O-N 3.09Å; G100-P102 WeakPolarHBondContact O-CD 3.48Å
101	I	32.4	Very low	30.1	Very low	148 Å²	148	148 Å²	148	76%	0.759	80%	0.803	S	S	*	*			trans	-55.9	123	176.4	-57.4	166.9	0	0	0	110.3	R103	I101-R103 PolarHBondContact O-N 2.66Å
102	P	29.2	Very low	29.5	Very low	125 Å²	125	150 Å²	150	81%	0.812	80%	0.799	S	S	*	*			trans	-65.2	107	175.1	-21.8	33.9	0	0	0	111.5	G100	G100-P102 WeakPolarHBondContact O-CD 3.48Å
103	R	27.3	Very low	29	Very low	228 Å²	228	149 Å²	149	86%	0.86	80%	0.797	S	S	*	*			trans	-74.1	128.8	167.6	-81.5	-173.4	172.7	171.8	0.1	110	I101 E105	I101-R103 PolarHBondContact O-N 2.66Å; R103-E105 PolarHBondContact O-N 2.96Å
104	A	30	Very low	28.5	Very low	105 Å²	105	145.8 Å²	145.8	87%	0.868	79%	0.793	S	S	*	*			trans	-77.7	103.6	171.1	0	0	0	0	0	110.3
105	E	26.5	Very low	28	Very low	180 Å²	180	143.7 Å²	143.7	84%	0.841	80%	0.796	S	S	*	*			trans	-121.1	163.2	165.6	-77.5	-160.3	168.2	0	0	112.1	R103	R103-E105 PolarHBondContact O-N 2.96Å
106	S	26.6	Very low	27.6	Very low	123 Å²	123	139.5 Å²	139.5	86%	0.86	80%	0.8	S	S	*	*			trans	-109.8	117.6	-153.3	58.5	0	0	0	0	115.4
107	G	25.5	Very low	27.2	Very low	76 Å²	76	141.2 Å²	141.2	78%	0.784	81%	0.808	S	S	*	*			trans	96.4	160.7	130.9	0	0	0	0	0	120.4
108	S	23.9	Very low	27.6	Very low	102 Å²	102	138.3 Å²	138.3	71%	0.713	81%	0.805	S	S	*	*			trans	75.9	100.1	163.4	-170.3	0	0	0	0	120.6
109	K	25.3	Very low	27.4	Very low	207 Å²	207	136.4 Å²	136.4	90%	0.9	81%	0.808	S	S	*	*			trans	52.2	124.3	132.7	-56.4	173.4	179.7	177.4	0	120
110	G	25.1	Very low	27.1	Very low	82 Å²	82	132.8 Å²	132.8	85%	0.845	81%	0.809	S	S	*	*			trans	-175.6	94.1	165.8	0	0	0	0	0	115.8
111	E	26.4	Very low	26.8	Very low	151 Å²	151	133.4 Å²	133.4	71%	0.706	82%	0.815	S	S	*	*			trans	-46.6	148.8	-179.7	-71.4	-178.9	89.9	0	0	121.3
112	R	25.2	Very low	26.7	Very low	196 Å²	196	133.9 Å²	133.9	74%	0.74	83%	0.825	S	S	*	*			trans	81.1	117.2	133.6	-78.5	178.2	-144.4	-150.8	11.5	124.3
113	M	25.6	Very low	26.4	Very low	171 Å²	171	139.7 Å²	139.7	84%	0.842	83%	0.831	S	S	*	*				70.5	115.9	119	-74.8	175.9	151.7	0	0	123.4
114	A	26.1	Very low	26.3	Very low	84 Å²	84	132.6 Å²	132.6	69%	0.694	83%	0.828	S	S	*	*				125.5	133.3	104	0	0	0	0	0	119.6
115	D	24.2	Very low	26.1	Very low	168 Å²	168	131.5 Å²	131.5	90%	0.898	83%	0.827	S	S	*	*			trans	55.8	130.4	146.7	-55.7	-14.4	0	0	0	122.8
116	G	26.1	Very low	26.2	Very low	88 Å²	88	131.3 Å²	131.3	91%	0.907	83%	0.831	S	S	*	*			trans	161.5	60.7	173.2	0	0	0	0	0	116.1
117	A	23.9	Very low	26.4	Very low	96 Å²	96	131.1 Å²	131.1	79%	0.793	83%	0.83	S	S	*	*			trans	-122.5	172.7	176.5	0	0	0	0	0	110.9
118	P	38.5	Very low	26.7	Very low	118 Å²	118	133.4 Å²	133.4	77%	0.766	82%	0.824	S	S	*	*			cis	-131.9	-180	-7.3	42.2	-27.4	0	0	0	114.1
119	L	26.1	Very low	27	Very low	179 Å²	179	131.7 Å²	131.7	94%	0.937	82%	0.822	S	S	*	*			trans	-153.1	156.3	139.8	-112.3	169.6	0	0	0	109.6
120	A	26.1	Very low	27.3	Very low	101 Å²	101	131.5 Å²	131.5	84%	0.835	83%	0.825	S	S	*	*			trans	-138.7	148.6	-154.6	0	0	0	0	0	116.3
121	G	24	Very low	27.7	Very low	74 Å²	74	129.7 Å²	129.7	76%	0.763	81%	0.806	S	S	*	*			trans	134.9	130.9	178.3	0	0	0	0	0	109.6
122	V	28.5	Very low	28.2	Very low	157 Å²	157	127.7 Å²	127.7	95%	0.952	81%	0.806	S	S	*	*			cis	-123.1	163.4	10.3	174.9	0	0	0	0	110.7
123	R	24.1	Very low	28.9	Very low	248 Å²	248	124.3 Å²	124.3	94%	0.936	81%	0.81	S	S	*	*			trans	-120.8	125.8	-164.8	178.7	-169.6	-170.6	-174.2	4.6	112.1
124	G	25.2	Very low	29.9	Very low	79 Å²	79	118.7 Å²	118.7	81%	0.814	80%	0.796	S	S	*	*			trans	169.6	133.7	163.9	0	0	0	0	0	115.2
125	G	26.1	Very low	30.9	Very low	82 Å²	82	116.7 Å²	116.7	85%	0.845	78%	0.783	S	S	*	*			trans	104.6	25.3	156	0	0	0	0	0	120.1
126	L	27.2	Very low	32	Very low	175 Å²	175	115.5 Å²	115.5	92%	0.916	77%	0.766	S	S	*	*			trans	-101.2	108.4	170.1	-90.7	166.5	0	0	0	112.2
127	S	30.4	Very low	33.6	Very low	119 Å²	119	113 Å²	113	83%	0.832	74%	0.74	S	S	*	*			trans	-153.8	46.9	165.4	70	0	0	0	0	112.2
128	D	32	Very low	35.4	Very low	125 Å²	125	114.6 Å²	114.6	67%	0.668	73%	0.731	S	S	*	*			trans	-105.6	119.9	177.6	-118.7	16.5	0	0	0	109.5	R136	D128-R136 IonicContact OD2-CZ 3.31Å; D128-R136 IonicContact OD2-NH2 2.88Å; D128-R136 PolarHBondContact OD2-NH2 3.47Å
129	G	30.5	Very low	36.7	Very low	66 Å²	66	111.5 Å²	111.5	68%	0.68	72%	0.716	S	S	*	*			trans	-71.9	152.6	178.4	0	0	0	0	0	113	G131	G129-G131 PolarHBondContact O-N 3.45Å; G129-G131 VanDerWaalsContact O-N 3.12Å
130	E	32.8	Very low	39	Very low	202 Å²	202	108.7 Å²	108.7	94%	0.944	70%	0.698	S	S	*	*			trans	-71.8	103.5	-178.3	-66.1	174	105.2	0	0	111.9
131	G	33.1	Very low	41	Very low	45 Å²	45	110.5 Å²	110.5	46%	0.464	68%	0.683	S	S	.	*			trans	-93.9	153.8	163.1	0	0	0	0	0	111.7	G129	G129-G131 PolarHBondContact O-N 3.45Å; G129-G131 VanDerWaalsContact O-N 3.12Å
132	P	35.9	Very low	43.2	Very low	109 Å²	109	112.3 Å²	112.3	71%	0.708	67%	0.667	S	S	*	*			trans	-62.4	141.9	-177.3	25.5	-34.4	0	0	0	112.2	G134 G135	P132-G134 VanDerWaalsContact C-N 3.32Å; P132-G134 PolarHBondContact O-N 2.87Å; P132-G134 VanDerWaalsContact O-N 3.1Å; P132-G135 PolarHBondContact O-N 2.82Å
133	P	39.8	Very low	45.5	Very low	125 Å²	125	111.4 Å²	111.4	81%	0.812	65%	0.65	S	S	*	*	H	α-helix	trans	-63.7	-26.1	-159.3	20.2	-32.8	0	0	0	115.8	G135	P133-G135 PolarHBondContact O-N 3.23Å
134	G	48	Very low	47.9	Very low	53 Å²	53	103.1 Å²	103.1	55%	0.546	62%	0.622	S	S	.	*	H	α-helix	trans	-63.9	-36.3	178.1	0	0	0	0	0	114	P132 R136 G137 E138	P132-G134 VanDerWaalsContact C-N 3.32Å; P132-G134 PolarHBondContact O-N 2.87Å; P132-G134 VanDerWaalsContact O-N 3.1Å; G134-R136 PolarHBondContact O-N 3.33Å; G134-G137 PolarHBondContact O-N 3.49Å; G134-E138 PolarHBondContact O-N 3.16Å
135	G	46.2	Very low	50.2	Low	41 Å²	41	103.2 Å²	103.2	42%	0.423	60%	0.598	S	S	.	*	H	α-helix	trans	-68.8	-29.2	-171.7	0	0	0	0	0	114.5	P132 P133 A139	P132-G135 PolarHBondContact O-N 2.82Å; P133-G135 PolarHBondContact O-N 3.23Å; G135-A139 WeakPolarHBondContact O-CB 3.48Å; G135-A139 PolarHBondContact O-N 2.93Å; G135-A139 VanDerWaalsContact O-N 3.08Å
136	R	47.8	Very low	52.6	Low	143 Å²	143	102 Å²	102	54%	0.54	57%	0.57	S	S	.	*	H	α-helix	trans	-68	-41.1	177.1	-84.1	-177.9	164.1	160	-5.4	111.8	D128 G134 E138 A139 Q140	D128-R136 IonicContact OD2-CZ 3.31Å; D128-R136 IonicContact OD2-NH2 2.88Å; D128-R136 PolarHBondContact OD2-NH2 3.47Å; G134-R136 PolarHBondContact O-N 3.33Å; R136-E138 PolarHBondContact O-N 2.97Å; R136-A139 PolarHBondContact O-N 3.12Å; R136-Q140 WeakPolarHBondContact O-CB 3.43Å; R136-Q140 PolarHBondContact O-N 2.89Å
137	G	59.1	Low	55.1	Low	36 Å²	36	98.2 Å²	98.2	37%	0.371	55%	0.548	S	S	.	.	H	α-helix	trans	-69.7	-29.3	178.9	0	0	0	0	0	114	G134 R141	G134-G137 PolarHBondContact O-N 3.49Å; G137-R141 WeakPolarHBondContact O-CB 3.43Å; G137-R141 WeakPolarHBondContact O-CG 3.19Å; G137-R141 PolarHBondContact O-N 3.29Å; G137-R141 PolarHBondContact O-NE 3.41Å
138	E	61.8	Low	57.4	Low	129 Å²	129	93.8 Å²	93.8	60%	0.603	52%	0.515	S	S	*	.	H	α-helix	trans	-74.2	-46.6	171.5	-70.1	178.8	162	0	0	111.8	G134 R136 Q140 R141 R142	G134-E138 PolarHBondContact O-N 3.16Å; R136-E138 PolarHBondContact O-N 2.97Å; E138-Q140 VanDerWaalsContact C-N 3.26Å; E138-Q140 PolarHBondContact O-N 3.01Å; E138-R141 PolarHBondContact O-N 3.46Å; E138-R142 WeakPolarHBondContact O-CB 3.36Å; E138-R142 PolarHBondContact O-N 3.5Å
139	A	66.2	Low	59.6	Low	54 Å²	54	88.2 Å²	88.2	45%	0.446	49%	0.486	S	S	.	.	H	α-helix	trans	-61.6	-33.1	178.1	0	0	0	0	0	113.1	G135 R136 K143	G135-A139 WeakPolarHBondContact O-CB 3.48Å; G135-A139 PolarHBondContact O-N 2.93Å; G135-A139 VanDerWaalsContact O-N 3.08Å; R136-A139 PolarHBondContact O-N 3.12Å; A139-K143 PolarHBondContact O-N 3.34Å
140	Q	73.4	Confident	62.1	Low	119 Å²	119	90.9 Å²	90.9	56%	0.556	48%	0.481	S	S	*	.	H	α-helix	trans	-75.6	-49.9	177.1	178.9	159.8	-22.5	0	0	112.7	R136 E138 R142 K143 E144	R136-Q140 WeakPolarHBondContact O-CB 3.43Å; R136-Q140 PolarHBondContact O-N 2.89Å; E138-Q140 VanDerWaalsContact C-N 3.26Å; E138-Q140 PolarHBondContact O-N 3.01Å; Q140-R142 PolarHBondContact O-N 2.85Å; Q140-R142 VanDerWaalsContact O-N 3.12Å; Q140-K143 WeakPolarHBondContact O-CA 3.38Å; Q140-K143 WeakPolarHBondContact O-CB 3.15Å; Q140-K143 PolarHBondContact O-N 3.41Å; Q140-E144 WeakPolarHBondContact CG-OE1 3.31Å; Q140-E144 PolarHBondContact NE2-OE1 2.82Å; Q140-E144 PolarHBondContact O-N 2.92Å
141	R	68.6	Low	64.5	Low	139 Å²	139	84 Å²	84	53%	0.525	45%	0.448	S	S	.	.	H	α-helix	trans	-56.3	-30.9	174.3	-73.4	178.8	-66.1	171.8	2.1	112.7	G137 E138 E144 R145	G137-R141 WeakPolarHBondContact O-CB 3.43Å; G137-R141 WeakPolarHBondContact O-CG 3.19Å; G137-R141 PolarHBondContact O-N 3.29Å; G137-R141 PolarHBondContact O-NE 3.41Å; E138-R141 PolarHBondContact O-N 3.46Å; R141-E144 WeakPolarHBondContact CA-OE2 3.44Å; R141-R145 WeakPolarHBondContact O-CG 3.17Å; R141-R145 PolarHBondContact O-N 3.44Å; R141-R145 VanDerWaalsContact O-N 3.1Å
142	R	70.6	Confident	66.9	Low	113 Å²	113	82 Å²	82	43%	0.426	43%	0.427	S	S	.	.	H	α-helix	trans	-67.4	-43.6	172.4	179.9	172.6	168.7	155.2	-0.1	113	E138 Q140 E144 R145 E146 E442	E138-R142 WeakPolarHBondContact O-CB 3.36Å; E138-R142 PolarHBondContact O-N 3.5Å; Q140-R142 PolarHBondContact O-N 2.85Å; Q140-R142 VanDerWaalsContact O-N 3.12Å; R142-E144 VanDerWaalsContact C-N 3.33Å; R142-R145 PolarHBondContact O-N 3.19Å; R142-E146 IonicContact CZ-OE1 2.85Å; R142-E146 IonicContact NE-OE1 3.64Å; R142-E146 PolarHBondContact NE-OE1 3Å; R142-E146 IonicContact NH2-OE1 3.65Å; R142-E146 PolarHBondContact NH2-OE1 3.45Å; R142-E146 VanDerWaalsContact NH2-OE1 3.16Å; R142-E146 WeakPolarHBondContact O-CB 3.44Å; R142-E146 WeakPolarHBondContact O-CG 3.41Å; R142-E146 PolarHBondContact O-N 2.96Å; R142-E442 IonicContact CZ-OE1 3.58Å; R142-E442 IonicContact NH1-OE1 3.35Å; R142-E442 PolarHBondContact NH1-OE1 3.09Å
143	K	76.2	Confident	69.1	Low	137 Å²	137	77.4 Å²	77.4	60%	0.596	40%	0.396	S	S	*	.	H	α-helix	trans	-62.4	-41.2	173.8	-73.2	179.6	178.8	-177.6	0	111.8	A139 Q140 R145 E146 E147	A139-K143 PolarHBondContact O-N 3.34Å; Q140-K143 WeakPolarHBondContact O-CA 3.38Å; Q140-K143 WeakPolarHBondContact O-CB 3.15Å; Q140-K143 PolarHBondContact O-N 3.41Å; K143-R145 VanDerWaalsContact C-N 3.33Å; K143-R145 PolarHBondContact O-N 3.1Å; K143-E146 CarbonylContact O-C 3.43Å; K143-E146 PolarHBondContact O-N 3.44Å; K143-E146 VanDerWaalsContact O-N 3.12Å; K143-E147 PolarHBondContact O-N 3.24Å
144	E	75.1	Confident	71.2	Confident	75 Å²	75	74.2 Å²	74.2	35%	0.35	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-39.7	178.4	-70	156.4	-178.2	0	0	111.4	Q140 R141 R142 L148	Q140-E144 WeakPolarHBondContact CG-OE1 3.31Å; Q140-E144 PolarHBondContact NE2-OE1 2.82Å; Q140-E144 PolarHBondContact O-N 2.92Å; R141-E144 WeakPolarHBondContact CA-OE2 3.44Å; R142-E144 VanDerWaalsContact C-N 3.33Å; E144-L148 WeakPolarHBondContact O-CB 3.32Å; E144-L148 PolarHBondContact O-N 3.35Å
145	R	73	Confident	73	Confident	81 Å²	81	71.9 Å²	71.9	31%	0.306	36%	0.355	S	S	.	.	H	α-helix	trans	-63.7	-44.6	168.8	-75.5	174.4	168.1	-131.6	0.4	113.1	R141 R142 K143 E147 L148 A149 I400 D680	R141-R145 WeakPolarHBondContact O-CG 3.17Å; R141-R145 PolarHBondContact O-N 3.44Å; R141-R145 VanDerWaalsContact O-N 3.1Å; R142-R145 PolarHBondContact O-N 3.19Å; K143-R145 VanDerWaalsContact C-N 3.33Å; K143-R145 PolarHBondContact O-N 3.1Å; R145-E147 VanDerWaalsContact C-N 3.33Å; R145-E147 PolarHBondContact O-N 3.12Å; R145-L148 PolarHBondContact O-N 3.3Å; R145-A149 WeakPolarHBondContact O-CB 3.4Å; R145-A149 PolarHBondContact O-N 3.16Å; R145-I400 HydrophobicContact CG-CD1 3.45Å; R145-I400 VanDerWaalsContact CG-CD1 3.45Å; R145-D680 IonicContact CZ-OD2 2.69Å; R145-D680 VanDerWaalsContact CZ-OD2 3.25Å; R145-D680 VanDerWaalsContact NH1-CG 3.28Å; R145-D680 IonicContact NH1-OD1 2.75Å; R145-D680 PolarHBondContact NH1-OD1 3.19Å; R145-D680 IonicContact NH1-OD2 2.71Å; R145-D680 PolarHBondContact NH1-OD2 2.98Å; R145-D680 IonicContact NH2-OD2 3.62Å; R145-D680 PolarHBondContact NH2-OD2 3.39Å
146	E	76.9	Confident	74.8	Confident	57 Å²	57	70.2 Å²	70.2	27%	0.266	34%	0.337	S	S	.	.	H	α-helix	trans	-67	-31.3	179.2	-73.6	173.9	-173.3	0	0	112.4	R142 K143 Q150 Q742	R142-E146 IonicContact CZ-OE1 2.85Å; R142-E146 IonicContact NE-OE1 3.64Å; R142-E146 PolarHBondContact NE-OE1 3Å; R142-E146 IonicContact NH2-OE1 3.65Å; R142-E146 PolarHBondContact NH2-OE1 3.45Å; R142-E146 VanDerWaalsContact NH2-OE1 3.16Å; R142-E146 WeakPolarHBondContact O-CB 3.44Å; R142-E146 WeakPolarHBondContact O-CG 3.41Å; R142-E146 PolarHBondContact O-N 2.96Å; K143-E146 CarbonylContact O-C 3.43Å; K143-E146 PolarHBondContact O-N 3.44Å; K143-E146 VanDerWaalsContact O-N 3.12Å; E146-Q150 WeakPolarHBondContact O-CG 3.49Å; E146-Q150 PolarHBondContact O-N 2.68Å; E146-Q150 PolarHBondContact O-NE2 3.1Å; E146-Q742 PolarHBondContact OE1-NE2 2.82Å
147	E	79.4	Confident	76.6	Confident	94 Å²	94	69 Å²	69	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-70	-48.6	169.6	-78.8	-175.7	-152.7	0	0	112.1	K143 R145 A149 Q150 Q151 K398	K143-E147 PolarHBondContact O-N 3.24Å; R145-E147 VanDerWaalsContact C-N 3.33Å; R145-E147 PolarHBondContact O-N 3.12Å; E147-A149 VanDerWaalsContact C-N 3.31Å; E147-A149 PolarHBondContact O-N 2.76Å; E147-Q150 WeakPolarHBondContact O-CB 3.49Å; E147-Q150 PolarHBondContact O-N 3.25Å; E147-Q150 VanDerWaalsContact O-N 3.08Å; E147-Q151 PolarHBondContact O-N 3.38Å; E147-K398 IonicContact OE2-NZ 2.8Å; E147-K398 PolarHBondContact OE2-NZ 3.01Å
148	L	79.1	Confident	77.8	Confident	26 Å²	26	70 Å²	70	14%	0.136	33%	0.327	C	S	.	.	H	α-helix	trans	-59.6	-41.9	178.8	176.3	51.6	0	0	0	111.6	E144 R145 Q150 Q151 Y152 I397 K398 I400	E144-L148 WeakPolarHBondContact O-CB 3.32Å; E144-L148 PolarHBondContact O-N 3.35Å; R145-L148 PolarHBondContact O-N 3.3Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 3.44Å; L148-Q151 PolarHBondContact O-N 3.4Å; L148-Y152 WeakPolarHBondContact O-CB 3.38Å; L148-Y152 PolarHBondContact O-N 3.33Å; L148-I397 HydrophobicContact CD1-CG2 3.87Å; L148-K398 WeakPolarHBondContact CD1-O 3.44Å; L148-I400 HydrophobicContact CD2-CD1 4.32Å; L148-I400 HydrophobicContact CD2-CG1 4.44Å
149	A	78.6	Confident	78.8	Confident	8 Å²	8	63.8 Å²	63.8	7%	0.066	30%	0.298	C	S	.	.	H	α-helix	trans	-58.4	-39.6	174.2	0	0	0	0	0	112.7	R145 E147 E153 V740 L741	R145-A149 WeakPolarHBondContact O-CB 3.4Å; R145-A149 PolarHBondContact O-N 3.16Å; E147-A149 VanDerWaalsContact C-N 3.31Å; E147-A149 PolarHBondContact O-N 2.76Å; A149-E153 PolarHBondContact O-N 3.42Å; A149-E153 VanDerWaalsContact O-N 3.12Å; A149-V740 HydrophobicContact CB-CG1 4.11Å; A149-V740 WeakPolarHBondContact O-CG1 3.45Å; A149-L741 WeakPolarHBondContact CB-O 3.23Å
150	Q	82	Confident	79.6	Confident	122 Å²	122	61.9 Å²	61.9	57%	0.57	28%	0.284	S	S	*	.	H	α-helix	trans	-72.1	-42.9	176.7	-72.9	170	66.2	0	0	112.3	E146 E147 L148 Y152 E153 A154	E146-Q150 WeakPolarHBondContact O-CG 3.49Å; E146-Q150 PolarHBondContact O-N 2.68Å; E146-Q150 PolarHBondContact O-NE2 3.1Å; E147-Q150 WeakPolarHBondContact O-CB 3.49Å; E147-Q150 PolarHBondContact O-N 3.25Å; E147-Q150 VanDerWaalsContact O-N 3.08Å; L148-Q150 VanDerWaalsContact C-N 3.29Å; L148-Q150 PolarHBondContact O-N 3.44Å; Q150-Y152 VanDerWaalsContact C-N 3.33Å; Q150-Y152 PolarHBondContact O-N 2.83Å; Q150-E153 PolarHBondContact O-N 3.12Å; Q150-A154 PolarHBondContact O-N 3.31Å; Q150-A154 VanDerWaalsContact O-N 3.1Å
151	Q	83.3	Confident	80.2	Confident	57 Å²	57	58.7 Å²	58.7	27%	0.266	27%	0.269	S	S	.	.	H	α-helix	trans	-58.3	-47.7	174.1	-171.9	179.4	2.8	0	0	110.1	E147 L148 E153 A154 I155 H396	E147-Q151 PolarHBondContact O-N 3.38Å; L148-Q151 PolarHBondContact O-N 3.4Å; Q151-E153 PolarHBondContact O-N 3.39Å; Q151-A154 WeakPolarHBondContact O-CB 3.41Å; Q151-A154 PolarHBondContact O-N 2.82Å; Q151-I155 HydrophobicContact CG-CD1 4.17Å; Q151-I155 VanDerWaalsContact O-CG1 3.28Å; Q151-I155 WeakPolarHBondContact O-CG1 3.08Å; Q151-I155 PolarHBondContact O-N 3.23Å; Q151-H396 PolarHBondContact NE2-O 2.88Å; Q151-H396 VanDerWaalsContact NE2-O 3.1Å
152	Y	83.2	Confident	81.1	Confident	5 Å²	5	52.8 Å²	52.8	2%	0.02	25%	0.251	C	S	.	.	H	α-helix	trans	-61.3	-40.9	179.2	-175	-95.3	0	0	0	113.7	L148 Q150 A154 I155 L156 E282 P358 R359 L362 L374	L148-Y152 WeakPolarHBondContact O-CB 3.38Å; L148-Y152 PolarHBondContact O-N 3.33Å; Q150-Y152 VanDerWaalsContact C-N 3.33Å; Q150-Y152 PolarHBondContact O-N 2.83Å; Y152-A154 VanDerWaalsContact C-N 3.34Å; Y152-A154 PolarHBondContact O-N 2.99Å; Y152-I155 PolarHBondContact O-N 3.32Å; Y152-L156 HydrophobicContact CD1-CD1 4.09Å; Y152-L156 HydrophobicContact CD1-CG 4.3Å; Y152-L156 HydrophobicContact CE1-CD1 3.46Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.46Å; Y152-L156 HydrophobicContact CE1-CD2 4.44Å; Y152-L156 HydrophobicContact CE1-CG 3.8Å; Y152-L156 PolarHBondContact O-N 2.93Å; Y152-E282 PolarHBondContact OH-O 2.68Å; Y152-P358 HydrophobicContact CE2-CG 4.47Å; Y152-P358 WeakPolarHBondContact OH-CG 3.27Å; Y152-R359 HydrophobicContact CD1-CG 4.26Å; Y152-R359 HydrophobicContact CD2-CG 4.43Å; Y152-R359 HydrophobicContact CE1-CG 3.7Å; Y152-R359 HydrophobicContact CE2-CG 3.92Å; Y152-L362 HydrophobicContact CD2-CD1 3.77Å; Y152-L362 HydrophobicContact CE2-CD1 4.14Å; Y152-L374 HydrophobicContact CE2-CD1 4.47Å; Y152-L374 HydrophobicContact CE2-CD2 4.16Å
153	E	83.5	Confident	82	Confident	11 Å²	11	55.2 Å²	55.2	5%	0.051	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-34.9	175.2	174.2	63.2	-153.6	0	0	112.2	A149 Q150 Q151 L156 R157 Q286 V740	A149-E153 PolarHBondContact O-N 3.42Å; A149-E153 VanDerWaalsContact O-N 3.12Å; Q150-E153 PolarHBondContact O-N 3.12Å; Q151-E153 PolarHBondContact O-N 3.39Å; E153-L156 PolarHBondContact O-N 3.32Å; E153-R157 WeakPolarHBondContact O-CG 3.26Å; E153-R157 PolarHBondContact O-N 2.98Å; E153-R157 VanDerWaalsContact O-N 3.16Å; E153-R157 IonicContact OE1-CZ 3.52Å; E153-R157 VanDerWaalsContact OE1-CZ 3.31Å; E153-R157 IonicContact OE1-NE 3.22Å; E153-R157 PolarHBondContact OE1-NE 3.24Å; E153-R157 IonicContact OE1-NH2 2.88Å; E153-R157 PolarHBondContact OE1-NH2 2.83Å; E153-Q286 VanDerWaalsContact CD-CB 3.47Å; E153-Q286 HydrophobicContact CG-CB 4.47Å; E153-Q286 WeakPolarHBondContact OE1-CB 3.47Å; E153-Q286 PolarHBondContact OE1-N 2.86Å; E153-Q286 VanDerWaalsContact OE1-N 3.1Å; E153-Q286 WeakPolarHBondContact OE2-CB 3.33Å; E153-Q286 PolarHBondContact OE2-N 3.3Å; E153-Q286 VanDerWaalsContact OE2-N 3.12Å; E153-V740 HydrophobicContact CB-CG1 4.01Å; E153-V740 HydrophobicContact CG-CG1 4.48Å; E153-V740 HydrophobicContact CG-CG2 4.45Å
154	A	83.5	Confident	82.7	Confident	59 Å²	59	49.2 Å²	49.2	49%	0.488	23%	0.234	S	C	.	.	H	α-helix	trans	-64.6	-43.8	172.4	0	0	0	0	0	111.7	Q150 Q151 Y152 L156 R157 E158	Q150-A154 PolarHBondContact O-N 3.31Å; Q150-A154 VanDerWaalsContact O-N 3.1Å; Q151-A154 WeakPolarHBondContact O-CB 3.41Å; Q151-A154 PolarHBondContact O-N 2.82Å; Y152-A154 VanDerWaalsContact C-N 3.34Å; Y152-A154 PolarHBondContact O-N 2.99Å; A154-L156 PolarHBondContact O-N 3.3Å; A154-R157 WeakPolarHBondContact O-CB 3.42Å; A154-R157 PolarHBondContact O-N 2.71Å; A154-R157 VanDerWaalsContact O-N 3.15Å; A154-E158 PolarHBondContact O-N 3.07Å; A154-E158 VanDerWaalsContact O-N 3.11Å
155	I	85.1	Confident	83.6	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-43.5	176.3	-59.6	166.2	0	0	0	111.1	Q151 Y152 R157 E158 C159 L374 F392 V394 I397	Q151-I155 HydrophobicContact CG-CD1 4.17Å; Q151-I155 VanDerWaalsContact O-CG1 3.28Å; Q151-I155 WeakPolarHBondContact O-CG1 3.08Å; Q151-I155 PolarHBondContact O-N 3.23Å; Y152-I155 PolarHBondContact O-N 3.32Å; I155-R157 VanDerWaalsContact C-N 3.29Å; I155-R157 PolarHBondContact O-N 2.68Å; I155-E158 PolarHBondContact O-N 3.22Å; I155-C159 PolarHBondContact O-N 2.6Å; I155-C159 PolarHBondContact O-SG 3.2Å; I155-L374 HydrophobicContact CG2-CD1 4.22Å; I155-L374 HydrophobicContact CG2-CD2 4.23Å; I155-F392 HydrophobicContact CG2-CE2 3.76Å; I155-F392 HydrophobicContact CG2-CZ 3.63Å; I155-V394 HydrophobicContact CD1-CG1 3.85Å; I155-V394 HydrophobicContact CG1-CG1 4.05Å; I155-V394 HydrophobicContact CG1-CG2 3.86Å; I155-V394 HydrophobicContact CG2-CG2 4.39Å; I155-I397 HydrophobicContact CD1-CD1 3.95Å; I155-I397 HydrophobicContact CD1-CG1 3.96Å
156	L	85.1	Confident	84.5	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	22%	0.224	C	C	.	.	H	α-helix	trans	-63.8	-32.2	176.5	-79.1	-174.5	0	0	0	113.1	Y152 E153 A154 G160 A285 L374	Y152-L156 HydrophobicContact CD1-CD1 4.09Å; Y152-L156 HydrophobicContact CD1-CG 4.3Å; Y152-L156 HydrophobicContact CE1-CD1 3.46Å; Y152-L156 VanDerWaalsContact CE1-CD1 3.46Å; Y152-L156 HydrophobicContact CE1-CD2 4.44Å; Y152-L156 HydrophobicContact CE1-CG 3.8Å; Y152-L156 PolarHBondContact O-N 2.93Å; E153-L156 PolarHBondContact O-N 3.32Å; A154-L156 PolarHBondContact O-N 3.3Å; L156-G160 PolarHBondContact O-N 3.06Å; L156-A285 HydrophobicContact CB-CB 4.41Å; L156-L374 HydrophobicContact CD2-CD2 4.44Å
157	R	85	Confident	85.3	Confident	116 Å²	116	47.9 Å²	47.9	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-69.7	-36.7	174.8	-70.6	169.5	-171	-147.6	0.2	112.2	E153 A154 I155 G160 E287	E153-R157 WeakPolarHBondContact O-CG 3.26Å; E153-R157 PolarHBondContact O-N 2.98Å; E153-R157 VanDerWaalsContact O-N 3.16Å; E153-R157 IonicContact OE1-CZ 3.52Å; E153-R157 VanDerWaalsContact OE1-CZ 3.31Å; E153-R157 IonicContact OE1-NE 3.22Å; E153-R157 PolarHBondContact OE1-NE 3.24Å; E153-R157 IonicContact OE1-NH2 2.88Å; E153-R157 PolarHBondContact OE1-NH2 2.83Å; A154-R157 WeakPolarHBondContact O-CB 3.42Å; A154-R157 PolarHBondContact O-N 2.71Å; A154-R157 VanDerWaalsContact O-N 3.15Å; I155-R157 VanDerWaalsContact C-N 3.29Å; I155-R157 PolarHBondContact O-N 2.68Å; R157-G160 PolarHBondContact O-N 3.19Å; R157-E287 IonicContact NH1-OE1 2.77Å
158	E	83.8	Confident	86	Confident	57 Å²	57	43.4 Å²	43.4	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-66.4	-48.6	173.4	-174.1	178.8	169.5	0	0	111.7	A154 I155 G160 M382 S393 V394	A154-E158 PolarHBondContact O-N 3.07Å; A154-E158 VanDerWaalsContact O-N 3.11Å; I155-E158 PolarHBondContact O-N 3.22Å; E158-G160 PolarHBondContact O-N 3.38Å; E158-M382 WeakPolarHBondContact O-CE 3.49Å; E158-S393 VanDerWaalsContact OE1-CB 3.29Å; E158-S393 WeakPolarHBondContact OE1-CB 3.35Å; E158-S393 PolarHBondContact OE1-N 3.05Å; E158-S393 PolarHBondContact OE1-OG 2.8Å; E158-S393 PolarHBondContact OE2-OG 3.02Å; E158-S393 VanDerWaalsContact OE2-OG 3.06Å; E158-V394 WeakPolarHBondContact OE2-CG2 3.39Å
159	C	83.3	Confident	86.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.6	-39	170.6	-62.3	0	0	0	0	111.7	I155 V377 H378	I155-C159 PolarHBondContact O-N 2.6Å; I155-C159 PolarHBondContact O-SG 3.2Å; C159-V377 HydrophobicContact CB-CG1 4.3Å; C159-H378 HydrophobicContact CB-CB 4.35Å
160	G	82.7	Confident	87.5	Confident	14 Å²	14	47.9 Å²	47.9	14%	0.144	23%	0.227	C	C	.	.			trans	63.7	176.9	179	0	0	0	0	0	113.7	L156 R157 E158 Q165 N381	L156-G160 PolarHBondContact O-N 3.06Å; R157-G160 PolarHBondContact O-N 3.19Å; E158-G160 PolarHBondContact O-N 3.38Å; G160-Q165 PolarHBondContact O-NE2 2.89Å; G160-N381 PolarHBondContact O-ND2 3.22Å
161	H	85.8	Confident	88.1	Confident	52 Å²	52	42.6 Å²	42.6	24%	0.241	20%	0.204	C	C	.	.	S	Bend	trans	-85.4	140.7	173	-160.6	92.6	0	0	0	110.9	Q165 W166 H292 K385	H161-Q165 VanDerWaalsContact CE1-CB 3.42Å; H161-Q165 WeakPolarHBondContact CE1-CB 3.45Å; H161-W166 AromaticContact CD2-NE1 3.78Å; H161-W166 AromaticContact NE2-CD1 2.81Å; H161-W166 AromaticContact NE2-CD2 3.5Å; H161-W166 AromaticContact NE2-CE2 2.97Å; H161-W166 AromaticContact NE2-CG 3.42Å; H161-W166 AromaticContact NE2-CZ2 3.72Å; H161-W166 AromaticContact NE2-NE1 2.48Å; H161-W166 PolarHBondContact NE2-NE1 3.33Å; H161-H292 AromaticContact CE1-CD2 3.17Å; H161-H292 PolarHBondContact CE1-CD2 3.01Å; H161-H292 AromaticContact CE1-CE1 3.4Å; H161-H292 PolarHBondContact CE1-CE1 3.12Å; H161-H292 VanDerWaalsContact CE1-CE1 3.4Å; H161-H292 AromaticContact CE1-CG 3.54Å; H161-H292 AromaticContact CE1-ND1 3.65Å; H161-H292 AromaticContact CE1-NE2 3.09Å; H161-H292 PolarHBondContact CE1-NE2 3.42Å; H161-H292 AromaticContact ND1-NE2 3.79Å; H161-H292 AromaticContact NE2-CE1 3.7Å; H161-H292 AromaticContact NE2-NE2 3.87Å; H161-K385 WeakPolarHBondContact O-CE 3.43Å; H161-K385 PolarHBondContact O-NZ 3.19Å
162	G	87.8	Confident	88.7	Confident	14 Å²	14	39.9 Å²	39.9	14%	0.144	19%	0.191	C	C	.	.	S	Bend	trans	-170.2	-150.7	-179.3	0	0	0	0	0	113.5	F164 W166 N381	G162-F164 VanDerWaalsContact C-N 3.29Å; G162-F164 PolarHBondContact O-N 3.28Å; G162-W166 PolarHBondContact O-N 3.49Å; G162-N381 WeakPolarHBondContact CA-OD1 3.48Å
163	R	89.7	Confident	89.2	Confident	164 Å²	164	39.7 Å²	39.7	62%	0.619	19%	0.19	S	C	*	.	H	α-helix	trans	-62.3	-34.1	-177.6	-81.4	-177.1	-165.6	158.4	3.7	112.7	W166 T167 T380 N381 A384	R163-W166 PolarHBondContact O-N 3.1Å; R163-T167 PolarHBondContact O-N 3.03Å; R163-T167 PolarHBondContact O-OG1 3.34Å; R163-T380 HydrophobicContact CB-CG2 4.45Å; R163-N381 PolarHBondContact N-OD1 3.39Å; R163-A384 HydrophobicContact CB-CB 3.93Å; R163-A384 HydrophobicContact CG-CB 3.58Å
164	F	91.9	Very high	89.8	Confident	11 Å²	11	41.8 Å²	41.8	5%	0.048	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-52.9	-177.7	-176.3	-85.3	0	0	0	111.6	G162 W166 T167 L168 F283 P355 V377 T380 N381	G162-F164 VanDerWaalsContact C-N 3.29Å; G162-F164 PolarHBondContact O-N 3.28Å; F164-W166 VanDerWaalsContact C-N 3.28Å; F164-W166 PolarHBondContact O-N 3.03Å; F164-T167 PolarHBondContact O-N 2.93Å; F164-L168 HydrophobicContact CE1-CB 4.43Å; F164-L168 HydrophobicContact CE1-CD2 4.05Å; F164-L168 WeakPolarHBondContact O-CB 3.19Å; F164-L168 PolarHBondContact O-N 3.41Å; F164-F283 HydrophobicContact CD1-CD1 4.42Å; F164-F283 AromaticContact CE1-CD1 3.61Å; F164-F283 HydrophobicContact CE1-CD1 3.61Å; F164-F283 AromaticContact CE1-CE1 3.75Å; F164-F283 HydrophobicContact CE1-CE1 3.75Å; F164-F283 HydrophobicContact CE1-CG 4.18Å; F164-F283 HydrophobicContact CE1-CZ 4.44Å; F164-F283 HydrophobicContact CZ-CD1 4.32Å; F164-F283 AromaticContact CZ-CE1 3.98Å; F164-F283 HydrophobicContact CZ-CE1 3.98Å; F164-F283 HydrophobicContact CZ-CZ 4.48Å; F164-P355 HydrophobicContact CE2-CG 3.97Å; F164-P355 HydrophobicContact CZ-CG 3.64Å; F164-V377 HydrophobicContact CB-CG1 4.28Å; F164-V377 HydrophobicContact CD1-CB 4.34Å; F164-V377 HydrophobicContact CD1-CG1 3.94Å; F164-V377 HydrophobicContact CD1-CG2 3.68Å; F164-V377 HydrophobicContact CD2-CG2 4.07Å; F164-V377 HydrophobicContact CE1-CG2 3.62Å; F164-V377 HydrophobicContact CE2-CG2 3.99Å; F164-V377 HydrophobicContact CG-CB 4.33Å; F164-V377 HydrophobicContact CG-CG1 4.13Å; F164-V377 HydrophobicContact CG-CG2 3.92Å; F164-V377 HydrophobicContact CZ-CG2 3.78Å; F164-T380 HydrophobicContact CB-CG2 3.99Å; F164-N381 WeakPolarHBondContact CB-OD1 3.48Å; F164-N381 PolarHBondContact N-OD1 2.95Å
165	Q	92.2	Very high	90.3	Very high	5 Å²	5	39 Å²	39	2%	0.023	18%	0.178	C	C	.	.	H	α-helix	trans	-64.2	-32.3	-179.7	-65.8	89.5	-9.3	0	0	112.6	G160 H161 Y169 N381	G160-Q165 PolarHBondContact O-NE2 2.89Å; H161-Q165 VanDerWaalsContact CE1-CB 3.42Å; H161-Q165 WeakPolarHBondContact CE1-CB 3.45Å; Q165-Y169 WeakPolarHBondContact O-CB 3.42Å; Q165-Y169 PolarHBondContact O-N 2.57Å; Q165-N381 PolarHBondContact NE2-ND2 3.2Å; Q165-N381 PolarHBondContact OE1-ND2 3.47Å
166	W	92.4	Very high	90.8	Very high	110 Å²	110	39 Å²	39	42%	0.417	18%	0.178	S	C	.	.	H	α-helix	trans	-70.5	-39.8	174.1	-80.5	109.9	0	0	0	112.7	H161 G162 R163 F164 Y169 F170	H161-W166 AromaticContact CD2-NE1 3.78Å; H161-W166 AromaticContact NE2-CD1 2.81Å; H161-W166 AromaticContact NE2-CD2 3.5Å; H161-W166 AromaticContact NE2-CE2 2.97Å; H161-W166 AromaticContact NE2-CG 3.42Å; H161-W166 AromaticContact NE2-CZ2 3.72Å; H161-W166 AromaticContact NE2-NE1 2.48Å; H161-W166 PolarHBondContact NE2-NE1 3.33Å; G162-W166 PolarHBondContact O-N 3.49Å; R163-W166 PolarHBondContact O-N 3.1Å; F164-W166 VanDerWaalsContact C-N 3.28Å; F164-W166 PolarHBondContact O-N 3.03Å; W166-Y169 AromaticContact CE3-CD1 3.73Å; W166-Y169 HydrophobicContact CE3-CD1 3.73Å; W166-Y169 HydrophobicContact CE3-CE1 4.15Å; W166-Y169 HydrophobicContact CE3-CG 4.29Å; W166-Y169 AromaticContact CZ3-CD1 3.82Å; W166-Y169 HydrophobicContact CZ3-CD1 3.82Å; W166-Y169 AromaticContact CZ3-CE1 3.77Å; W166-Y169 HydrophobicContact CZ3-CE1 3.77Å; W166-Y169 HydrophobicContact CZ3-CG 4.44Å; W166-Y169 WeakPolarHBondContact O-CB 3.49Å; W166-Y169 PolarHBondContact O-N 3.21Å; W166-F170 HydrophobicContact CE3-CE2 4.22Å; W166-F170 WeakPolarHBondContact O-CD2 3.48Å; W166-F170 PolarHBondContact O-N 3.47Å; W166-F170 VanDerWaalsContact O-N 3.13Å
167	T	93.8	Very high	91.3	Very high	71 Å²	71	39.8 Å²	39.8	44%	0.436	18%	0.182	S	C	.	.	H	α-helix	trans	-60	-51.7	171.5	-62.4	0	0	0	0	110.3	R163 F164 Y169 F170 V171	R163-T167 PolarHBondContact O-N 3.03Å; R163-T167 PolarHBondContact O-OG1 3.34Å; F164-T167 PolarHBondContact O-N 2.93Å; T167-Y169 VanDerWaalsContact C-N 3.31Å; T167-Y169 PolarHBondContact O-N 3.23Å; T167-F170 PolarHBondContact O-N 3.06Å; T167-F170 VanDerWaalsContact O-N 3.08Å; T167-V171 HydrophobicContact CG2-CG2 4.37Å; T167-V171 WeakPolarHBondContact O-CG2 3.46Å; T167-V171 PolarHBondContact O-N 3.01Å
168	L	93.7	Very high	91.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.4	-42.8	178.8	-174.9	63.5	0	0	0	112.1	F164 F170 V171 L172 Y279 F280 F283 Q354	F164-L168 HydrophobicContact CE1-CB 4.43Å; F164-L168 HydrophobicContact CE1-CD2 4.05Å; F164-L168 WeakPolarHBondContact O-CB 3.19Å; F164-L168 PolarHBondContact O-N 3.41Å; L168-F170 PolarHBondContact O-N 3.29Å; L168-V171 PolarHBondContact O-N 3.34Å; L168-L172 HydrophobicContact CD1-CD1 3.82Å; L168-L172 HydrophobicContact CD1-CG 4.1Å; L168-L172 HydrophobicContact CD2-CD1 4.46Å; L168-L172 HydrophobicContact CG-CD1 3.79Å; L168-L172 HydrophobicContact CG-CG 4.39Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.49Å; L168-L172 PolarHBondContact O-N 3.42Å; L168-Y279 HydrophobicContact CD1-CD1 4.45Å; L168-Y279 HydrophobicContact CD1-CE1 3.66Å; L168-F280 HydrophobicContact CD2-CD2 3.94Å; L168-F280 HydrophobicContact CD2-CE2 4.45Å; L168-F280 HydrophobicContact CG-CD2 4.08Å; L168-F280 HydrophobicContact CG-CE2 4.46Å; L168-F283 HydrophobicContact CD2-CB 3.91Å; L168-F283 HydrophobicContact CD2-CD2 3.46Å; L168-F283 VanDerWaalsContact CD2-CD2 3.46Å; L168-F283 HydrophobicContact CD2-CE2 4.06Å; L168-F283 HydrophobicContact CD2-CG 3.74Å; L168-Q354 HydrophobicContact CD1-CB 4.46Å; L168-Q354 HydrophobicContact CD1-CG 4.17Å
169	Y	94.4	Very high	92.2	Very high	11 Å²	11	31.7 Å²	31.7	4%	0.043	15%	0.15	C	C	.	.	H	α-helix	trans	-56.1	-44.5	173.7	169.9	-95.9	0	0	0	112.8	Q165 W166 T167 G173 F280 W295 L296 F299	Q165-Y169 WeakPolarHBondContact O-CB 3.42Å; Q165-Y169 PolarHBondContact O-N 2.57Å; W166-Y169 AromaticContact CE3-CD1 3.73Å; W166-Y169 HydrophobicContact CE3-CD1 3.73Å; W166-Y169 HydrophobicContact CE3-CE1 4.15Å; W166-Y169 HydrophobicContact CE3-CG 4.29Å; W166-Y169 AromaticContact CZ3-CD1 3.82Å; W166-Y169 HydrophobicContact CZ3-CD1 3.82Å; W166-Y169 AromaticContact CZ3-CE1 3.77Å; W166-Y169 HydrophobicContact CZ3-CE1 3.77Å; W166-Y169 HydrophobicContact CZ3-CG 4.44Å; W166-Y169 WeakPolarHBondContact O-CB 3.49Å; W166-Y169 PolarHBondContact O-N 3.21Å; T167-Y169 VanDerWaalsContact C-N 3.31Å; T167-Y169 PolarHBondContact O-N 3.23Å; Y169-G173 WeakPolarHBondContact O-CA 3.38Å; Y169-G173 PolarHBondContact O-N 2.65Å; Y169-F280 AromaticContact CD2-CE1 3.91Å; Y169-F280 HydrophobicContact CD2-CE1 3.91Å; Y169-F280 AromaticContact CD2-CZ 3.81Å; Y169-F280 HydrophobicContact CD2-CZ 3.81Å; Y169-F280 HydrophobicContact CG-CZ 4.24Å; Y169-W295 HydrophobicContact CE2-CB 3.86Å; Y169-W295 PolarHBondContact OH-O 2.89Å; Y169-L296 HydrophobicContact CD2-CB 4.46Å; Y169-L296 HydrophobicContact CD2-CD1 3.62Å; Y169-L296 HydrophobicContact CE2-CB 4.24Å; Y169-L296 HydrophobicContact CE2-CD1 3.97Å; Y169-L296 HydrophobicContact CG-CD1 4.33Å; Y169-L296 WeakPolarHBondContact O-CD1 3.44Å; Y169-F299 HydrophobicContact CD1-CE2 4.12Å; Y169-F299 HydrophobicContact CD1-CZ 4.46Å; Y169-F299 AromaticContact CE1-CE2 3.53Å; Y169-F299 HydrophobicContact CE1-CE2 3.53Å; Y169-F299 AromaticContact CE1-CZ 3.9Å; Y169-F299 HydrophobicContact CE1-CZ 3.9Å; Y169-F299 HydrophobicContact CE2-CE2 4.09Å; Y169-F299 AromaticContact CZ-CE2 3.51Å
170	F	94.9	Very high	92.6	Very high	116 Å²	116	31.7 Å²	31.7	51%	0.509	15%	0.15	S	C	.	.	H	α-helix	trans	-70.7	-39.6	176.6	-75.6	-66.1	0	0	0	112.7	W166 T167 L168 G173 L174 F299	W166-F170 HydrophobicContact CE3-CE2 4.22Å; W166-F170 WeakPolarHBondContact O-CD2 3.48Å; W166-F170 PolarHBondContact O-N 3.47Å; W166-F170 VanDerWaalsContact O-N 3.13Å; T167-F170 PolarHBondContact O-N 3.06Å; T167-F170 VanDerWaalsContact O-N 3.08Å; L168-F170 PolarHBondContact O-N 3.29Å; F170-G173 PolarHBondContact O-N 3.17Å; F170-L174 WeakPolarHBondContact O-CG 3.12Å; F170-L174 PolarHBondContact O-N 3.44Å; F170-F299 HydrophobicContact CD1-CE1 4.38Å; F170-F299 AromaticContact CD1-CZ 3.73Å; F170-F299 HydrophobicContact CD1-CZ 3.73Å; F170-F299 HydrophobicContact CE1-CZ 4.07Å
171	V	95.1	Very high	93.1	Very high	12 Å²	12	31 Å²	31	7%	0.073	14%	0.143	C	C	.	.	H	α-helix	trans	-62.3	-45.6	177.4	175.4	0	0	0	0	111.2	T167 L168 L174 A175 A350 L351 Q354	T167-V171 HydrophobicContact CG2-CG2 4.37Å; T167-V171 WeakPolarHBondContact O-CG2 3.46Å; T167-V171 PolarHBondContact O-N 3.01Å; L168-V171 PolarHBondContact O-N 3.34Å; V171-L174 PolarHBondContact O-N 2.76Å; V171-A175 PolarHBondContact O-N 2.93Å; V171-A350 HydrophobicContact CB-CB 4.46Å; V171-A350 HydrophobicContact CG1-CB 3.9Å; V171-A350 HydrophobicContact CG2-CB 4.03Å; V171-L351 HydrophobicContact CG1-CB 4.42Å; V171-L351 HydrophobicContact CG1-CD2 3.66Å; V171-L351 HydrophobicContact CG1-CG 3.71Å; V171-Q354 HydrophobicContact CB-CG 4.36Å; V171-Q354 HydrophobicContact CG1-CG 4Å; V171-Q354 HydrophobicContact CG2-CG 4.24Å
172	L	95.5	Very high	93.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-74.9	-28.2	177.8	-66	177.4	0	0	0	113	L168 L174 A175 L176 L235 V276 Y279 F280 L296 L351	L168-L172 HydrophobicContact CD1-CD1 3.82Å; L168-L172 HydrophobicContact CD1-CG 4.1Å; L168-L172 HydrophobicContact CD2-CD1 4.46Å; L168-L172 HydrophobicContact CG-CD1 3.79Å; L168-L172 HydrophobicContact CG-CG 4.39Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.49Å; L168-L172 PolarHBondContact O-N 3.42Å; L172-L174 VanDerWaalsContact C-N 3.34Å; L172-A175 WeakPolarHBondContact O-CB 3.28Å; L172-A175 PolarHBondContact O-N 3.39Å; L172-L176 PolarHBondContact O-N 2.8Å; L172-L235 HydrophobicContact CD2-CD2 3.67Å; L172-V276 HydrophobicContact CB-CG1 3.86Å; L172-V276 HydrophobicContact CD2-CG1 4.32Å; L172-V276 HydrophobicContact CD2-CG2 4.11Å; L172-V276 HydrophobicContact CG-CG1 4.46Å; L172-Y279 HydrophobicContact CD1-CD1 3.58Å; L172-Y279 HydrophobicContact CD1-CE1 4.01Å; L172-Y279 HydrophobicContact CD2-CD1 3.57Å; L172-Y279 HydrophobicContact CD2-CE1 3.79Å; L172-Y279 HydrophobicContact CG-CD1 4.15Å; L172-Y279 HydrophobicContact CG-CE1 4.31Å; L172-F280 HydrophobicContact CD1-CB 3.71Å; L172-F280 HydrophobicContact CD1-CD2 4.1Å; L172-F280 HydrophobicContact CD1-CG 4.16Å; L172-L296 HydrophobicContact CB-CD1 4.26Å; L172-L351 HydrophobicContact CD2-CD2 3.95Å
173	G	95.3	Very high	93.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-57.4	-44.1	166.2	0	0	0	0	0	112.5	Y169 F170 A175 L176 M177 F299	Y169-G173 WeakPolarHBondContact O-CA 3.38Å; Y169-G173 PolarHBondContact O-N 2.65Å; F170-G173 PolarHBondContact O-N 3.17Å; G173-A175 VanDerWaalsContact C-N 3.3Å; G173-A175 PolarHBondContact O-N 3.37Å; G173-L176 PolarHBondContact O-N 2.89Å; G173-M177 VanDerWaalsContact O-CB 3.29Å; G173-M177 WeakPolarHBondContact O-CB 3.34Å; G173-M177 PolarHBondContact O-N 3.08Å; G173-F299 VanDerWaalsContact O-CB 3.24Å; G173-F299 WeakPolarHBondContact O-CB 3.48Å
174	L	94.6	Very high	93.3	Very high	56 Å²	56	23.2 Å²	23.2	29%	0.293	11%	0.11	S	C	.	.	H	α-helix	trans	-63.6	-34.6	175.4	-67.9	172.5	0	0	0	112.7	F170 V171 L172 M177 A178 A347	F170-L174 WeakPolarHBondContact O-CG 3.12Å; F170-L174 PolarHBondContact O-N 3.44Å; V171-L174 PolarHBondContact O-N 2.76Å; L172-L174 VanDerWaalsContact C-N 3.34Å; L174-M177 HydrophobicContact CD2-SD 4.27Å; L174-M177 PolarHBondContact O-N 3.37Å; L174-A178 PolarHBondContact O-N 3.4Å; L174-A347 HydrophobicContact CB-CB 3.95Å
175	A	95.4	Very high	93.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.1	-44.7	174.8	0	0	0	0	0	112.5	V171 L172 G173 A178 D179 L235 L239 V276 A347	V171-A175 PolarHBondContact O-N 2.93Å; L172-A175 WeakPolarHBondContact O-CB 3.28Å; L172-A175 PolarHBondContact O-N 3.39Å; G173-A175 VanDerWaalsContact C-N 3.3Å; G173-A175 PolarHBondContact O-N 3.37Å; A175-A178 WeakPolarHBondContact O-CB 3.23Å; A175-A178 PolarHBondContact O-N 3.38Å; A175-D179 PolarHBondContact O-N 3.32Å; A175-L235 HydrophobicContact CB-CD2 4.42Å; A175-L239 HydrophobicContact CB-CD1 3.92Å; A175-V276 HydrophobicContact CB-CG2 3.94Å; A175-A347 HydrophobicContact CB-CB 4.36Å
176	L	94.6	Very high	92.8	Very high	3 Å²	3	23.1 Å²	23.1	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-71.7	-30.3	175.6	-75.4	166	0	0	0	113.1	L172 G173 A178 D179 G180 I273 V276 F277 L296 F299	L172-L176 PolarHBondContact O-N 2.8Å; G173-L176 PolarHBondContact O-N 2.89Å; L176-A178 VanDerWaalsContact C-N 3.29Å; L176-D179 PolarHBondContact O-N 3.04Å; L176-G180 PolarHBondContact O-N 2.55Å; L176-I273 HydrophobicContact CD2-CB 4.48Å; L176-I273 HydrophobicContact CD2-CG1 3.92Å; L176-V276 HydrophobicContact CD1-CB 4.47Å; L176-V276 HydrophobicContact CD1-CG1 3.53Å; L176-V276 HydrophobicContact CD2-CG1 4.42Å; L176-V276 HydrophobicContact CG-CB 4.32Å; L176-V276 HydrophobicContact CG-CG1 3.79Å; L176-V276 HydrophobicContact CG-CG2 4.47Å; L176-F277 HydrophobicContact CD1-CD2 4.44Å; L176-F277 HydrophobicContact CD1-CE2 3.94Å; L176-F277 HydrophobicContact CD2-CE2 4.11Å; L176-L296 HydrophobicContact CD1-CD2 3.68Å; L176-L296 HydrophobicContact CD1-CG 3.66Å; L176-F299 HydrophobicContact CB-CB 4.35Å
177	M	94.9	Very high	92.2	Very high	24 Å²	24	20.2 Å²	20.2	12%	0.118	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-41.3	169.6	-176.5	-173.7	172.4	0	0	110.5	G173 L174 G180 V181 F299 I302 G303 Y306 P343	G173-M177 VanDerWaalsContact O-CB 3.29Å; G173-M177 WeakPolarHBondContact O-CB 3.34Å; G173-M177 PolarHBondContact O-N 3.08Å; L174-M177 HydrophobicContact CD2-SD 4.27Å; L174-M177 PolarHBondContact O-N 3.37Å; M177-G180 PolarHBondContact O-N 2.97Å; M177-V181 VanDerWaalsContact O-CG2 3.27Å; M177-V181 WeakPolarHBondContact O-CG2 3.48Å; M177-V181 PolarHBondContact O-N 3.07Å; M177-F299 WeakPolarHBondContact CA-O 3.33Å; M177-I302 HydrophobicContact CE-CG2 4.49Å; M177-I302 HydrophobicContact SD-CG2 4.39Å; M177-G303 WeakPolarHBondContact O-CA 3.44Å; M177-Y306 HydrophobicContact CE-CD1 4.01Å; M177-Y306 HydrophobicContact CE-CD2 3.74Å; M177-Y306 HydrophobicContact CE-CE2 4.42Å; M177-Y306 HydrophobicContact CE-CG 3.5Å; M177-Y306 VanDerWaalsContact CE-CG 3.5Å; M177-P343 HydrophobicContact CE-CG 4.16Å; M177-P343 HydrophobicContact SD-CB 4.44Å
178	A	94.1	Very high	91.5	Very high	2 Å²	2	17 Å²	17	2%	0.017	10%	0.095	C	C	.	.	H	α-helix	trans	-65	-39.3	175.8	0	0	0	0	0	113.1	L174 A175 L176 V181 E182 L239 P343	L174-A178 PolarHBondContact O-N 3.4Å; A175-A178 WeakPolarHBondContact O-CB 3.23Å; A175-A178 PolarHBondContact O-N 3.38Å; L176-A178 VanDerWaalsContact C-N 3.29Å; A178-V181 PolarHBondContact O-N 2.93Å; A178-E182 PolarHBondContact O-N 3.37Å; A178-E182 VanDerWaalsContact O-N 3.08Å; A178-L239 HydrophobicContact CB-CD2 4.43Å; A178-P343 HydrophobicContact CB-CB 4.32Å
179	D	93.4	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-48	173	-177.6	90.5	0	0	0	112	A175 L176 V181 E182 V183 M215 I269 S272 W300	A175-D179 PolarHBondContact O-N 3.32Å; L176-D179 PolarHBondContact O-N 3.04Å; D179-V181 VanDerWaalsContact C-N 3.31Å; D179-V181 PolarHBondContact O-N 3.12Å; D179-E182 PolarHBondContact O-N 3.48Å; D179-V183 WeakPolarHBondContact O-CG2 3.46Å; D179-V183 PolarHBondContact O-N 3.14Å; D179-V183 VanDerWaalsContact O-N 3.13Å; D179-M215 WeakPolarHBondContact OD1-CE 3.44Å; D179-I269 HydrophobicContact CB-CD1 4.22Å; D179-I269 HydrophobicContact CB-CG1 3.85Å; D179-I269 WeakPolarHBondContact OD1-CG1 3.37Å; D179-S272 WeakPolarHBondContact CB-OG 3.49Å; D179-S272 PolarHBondContact OD1-OG 2.99Å; D179-W300 VanDerWaalsContact OD2-CD1 3.31Å; D179-W300 PolarHBondContact OD2-NE1 3.15Å
180	G	91.9	Very high	90.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-56	-46.2	174.8	0	0	0	0	0	111.8	L176 M177 V183 F184	L176-G180 PolarHBondContact O-N 2.55Å; M177-G180 PolarHBondContact O-N 2.97Å; G180-V183 PolarHBondContact O-N 2.99Å; G180-F184 WeakPolarHBondContact O-CD2 3.28Å; G180-F184 PolarHBondContact O-N 2.92Å
181	V	93.3	Very high	89.4	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-57.9	-51.9	177.7	170.3	0	0	0	0	112	M177 A178 D179 V183 F184 V185 G303 Y306 A307 C340 P343	M177-V181 VanDerWaalsContact O-CG2 3.27Å; M177-V181 WeakPolarHBondContact O-CG2 3.48Å; M177-V181 PolarHBondContact O-N 3.07Å; A178-V181 PolarHBondContact O-N 2.93Å; D179-V181 VanDerWaalsContact C-N 3.31Å; D179-V181 PolarHBondContact O-N 3.12Å; V181-V183 VanDerWaalsContact C-N 3.32Å; V181-V183 PolarHBondContact O-N 2.79Å; V181-F184 PolarHBondContact O-N 3.39Å; V181-V185 HydrophobicContact CG1-CG2 3.83Å; V181-V185 WeakPolarHBondContact O-CB 3.42Å; V181-V185 WeakPolarHBondContact O-CG2 3.33Å; V181-V185 PolarHBondContact O-N 3.38Å; V181-G303 VanDerWaalsContact CG2-O 3.28Å; V181-G303 WeakPolarHBondContact CG2-O 3.48Å; V181-Y306 HydrophobicContact CG2-CD1 3.65Å; V181-Y306 HydrophobicContact CG2-CE1 4.34Å; V181-A307 HydrophobicContact CG1-CB 4.49Å; V181-A307 HydrophobicContact CG2-CB 4.49Å; V181-C340 HydrophobicContact CG1-CB 3.45Å; V181-C340 VanDerWaalsContact CG1-CB 3.45Å; V181-C340 WeakPolarHBondContact CG1-O 3.43Å; V181-P343 HydrophobicContact CG2-CG 4.46Å
182	E	91.4	Very high	88.5	Confident	6 Å²	6	15.5 Å²	15.5	3%	0.028	10%	0.096	C	C	.	.	H	α-helix	trans	-64.2	-36.2	-175.8	-172.8	67.5	175.2	0	0	112.2	A178 D179 S265 I269	A178-E182 PolarHBondContact O-N 3.37Å; A178-E182 VanDerWaalsContact O-N 3.08Å; D179-E182 PolarHBondContact O-N 3.48Å; E182-S265 VanDerWaalsContact OE1-CB 3.22Å; E182-S265 WeakPolarHBondContact OE1-CB 3.44Å; E182-S265 PolarHBondContact OE1-OG 3.11Å; E182-I269 HydrophobicContact CG-CG2 4.38Å
183	V	89	Confident	87.6	Confident	14 Å²	14	15.5 Å²	15.5	9%	0.085	10%	0.096	C	C	.	.	H	α-helix	trans	-64.4	-47.5	174	175.1	0	0	0	0	111.6	D179 G180 V181 M215 W300	D179-V183 WeakPolarHBondContact O-CG2 3.46Å; D179-V183 PolarHBondContact O-N 3.14Å; D179-V183 VanDerWaalsContact O-N 3.13Å; G180-V183 PolarHBondContact O-N 2.99Å; V181-V183 VanDerWaalsContact C-N 3.32Å; V181-V183 PolarHBondContact O-N 2.79Å; V183-M215 HydrophobicContact CG2-CE 3.43Å; V183-M215 VanDerWaalsContact CG2-CE 3.43Å; V183-M215 HydrophobicContact CG2-SD 3.75Å; V183-W300 HydrophobicContact CB-CZ2 4.35Å; V183-W300 HydrophobicContact CG1-CZ2 4.17Å
184	F	88.1	Confident	86.6	Confident	45 Å²	45	17.7 Å²	17.7	20%	0.197	11%	0.106	C	C	.	.	H	α-helix	trans	-75.9	-29.2	-177	-77.7	-68.5	0	0	0	113.5	G180 V181 V186 G187 F188 W300 M301 A307 T605	G180-F184 WeakPolarHBondContact O-CD2 3.28Å; G180-F184 PolarHBondContact O-N 2.92Å; V181-F184 PolarHBondContact O-N 3.39Å; F184-V186 VanDerWaalsContact C-N 3.25Å; F184-V186 PolarHBondContact O-N 3.5Å; F184-G187 PolarHBondContact O-N 2.75Å; F184-F188 HydrophobicContact CB-CE2 4.16Å; F184-F188 WeakPolarHBondContact O-CD2 3.32Å; F184-F188 PolarHBondContact O-N 3.47Å; F184-W300 HydrophobicContact CE2-CE3 4.25Å; F184-W300 AromaticContact CE2-CH2 3.57Å; F184-W300 HydrophobicContact CE2-CH2 3.57Å; F184-W300 HydrophobicContact CE2-CZ2 4.13Å; F184-W300 AromaticContact CE2-CZ3 3.65Å; F184-W300 HydrophobicContact CE2-CZ3 3.65Å; F184-W300 AromaticContact CZ-CH2 3.77Å; F184-W300 HydrophobicContact CZ-CH2 3.77Å; F184-W300 AromaticContact CZ-CZ3 3.86Å; F184-W300 HydrophobicContact CZ-CZ3 3.86Å; F184-M301 HydrophobicContact CZ-CE 4.4Å; F184-A307 HydrophobicContact CB-CB 4.07Å; F184-T605 HydrophobicContact CD1-CG2 4.23Å; F184-T605 HydrophobicContact CE1-CG2 3.72Å; F184-T605 HydrophobicContact CE2-CG2 4.48Å; F184-T605 HydrophobicContact CZ-CG2 3.87Å
185	V	88.4	Confident	85.5	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-52.8	-39.4	179.3	155.4	0	0	0	0	112.8	V181 G187 F188 V189 R262 F336 V337 C340	V181-V185 HydrophobicContact CG1-CG2 3.83Å; V181-V185 WeakPolarHBondContact O-CB 3.42Å; V181-V185 WeakPolarHBondContact O-CG2 3.33Å; V181-V185 PolarHBondContact O-N 3.38Å; V185-G187 VanDerWaalsContact C-N 3.33Å; V185-G187 PolarHBondContact O-N 2.96Å; V185-F188 PolarHBondContact O-N 2.88Å; V185-V189 HydrophobicContact CG1-CG2 3.98Å; V185-V189 WeakPolarHBondContact O-CB 3.47Å; V185-V189 WeakPolarHBondContact O-CG2 3.25Å; V185-V189 PolarHBondContact O-N 3.24Å; V185-R262 VanDerWaalsContact CG1-NH1 3.35Å; V185-F336 HydrophobicContact CB-CE1 4.4Å; V185-F336 HydrophobicContact CG1-CE1 4.24Å; V185-F336 HydrophobicContact CG2-CE1 4.06Å; V185-F336 HydrophobicContact CG2-CZ 3.84Å; V185-V337 HydrophobicContact CG1-CG2 4.33Å; V185-C340 HydrophobicContact CG2-CB 3.52Å; V185-C340 WeakPolarHBondContact CG2-SG 3.36Å
186	V	84.2	Confident	84.4	Confident	14 Å²	14	20.5 Å²	20.5	9%	0.085	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-43.4	-177.1	-175.9	0	0	0	0	111.2	F184 F188 V189 L190 L207 V211	F184-V186 VanDerWaalsContact C-N 3.25Å; F184-V186 PolarHBondContact O-N 3.5Å; V186-F188 VanDerWaalsContact C-N 3.34Å; V186-F188 PolarHBondContact O-N 2.8Å; V186-V189 PolarHBondContact O-N 3.37Å; V186-L190 WeakPolarHBondContact O-CB 3.47Å; V186-L190 PolarHBondContact O-N 3.1Å; V186-L207 WeakPolarHBondContact CG1-O 3.36Å; V186-V211 HydrophobicContact CG2-CB 4.26Å; V186-V211 HydrophobicContact CG2-CG2 3.74Å
187	G	79.4	Confident	83.4	Confident	49 Å²	49	22 Å²	22	51%	0.505	13%	0.125	S	C	.	.	H	α-helix	trans	-65.2	-34.4	178	0	0	0	0	0	113.5	F184 V185 P191	F184-G187 PolarHBondContact O-N 2.75Å; V185-G187 VanDerWaalsContact C-N 3.33Å; V185-G187 PolarHBondContact O-N 2.96Å; G187-P191 WeakPolarHBondContact O-CD 3.49Å
188	F	81.1	Confident	82.3	Confident	5 Å²	5	24.9 Å²	24.9	2%	0.022	15%	0.148	C	C	.	.	H	α-helix	trans	-76.5	-35.9	176.9	-67.9	-64.7	0	0	0	113.1	F184 V185 V186 A307 A308 A311 F336 Y598	F184-F188 HydrophobicContact CB-CE2 4.16Å; F184-F188 WeakPolarHBondContact O-CD2 3.32Å; F184-F188 PolarHBondContact O-N 3.47Å; V185-F188 PolarHBondContact O-N 2.88Å; V186-F188 VanDerWaalsContact C-N 3.34Å; V186-F188 PolarHBondContact O-N 2.8Å; F188-A307 HydrophobicContact CD2-CB 4.27Å; F188-A307 HydrophobicContact CE2-CB 4.23Å; F188-A308 HydrophobicContact CE1-CB 4.16Å; F188-A308 HydrophobicContact CE2-CB 3.98Å; F188-A308 HydrophobicContact CZ-CB 3.47Å; F188-A308 VanDerWaalsContact CZ-CB 3.47Å; F188-A311 HydrophobicContact CB-CB 3.85Å; F188-A311 HydrophobicContact CD1-CB 3.68Å; F188-A311 HydrophobicContact CD2-CB 4.4Å; F188-A311 HydrophobicContact CE1-CB 4.41Å; F188-A311 HydrophobicContact CG-CB 3.71Å; F188-F336 HydrophobicContact CB-CE1 3.66Å; F188-F336 HydrophobicContact CB-CZ 3.81Å; F188-F336 HydrophobicContact CD2-CZ 4.29Å; F188-F336 HydrophobicContact CG-CZ 4.32Å; F188-Y598 HydrophobicContact CB-CE1 4.48Å; F188-Y598 AromaticContact CD1-CD1 3.54Å; F188-Y598 HydrophobicContact CD1-CD1 3.54Å; F188-Y598 AromaticContact CD1-CE1 3.93Å; F188-Y598 HydrophobicContact CD1-CE1 3.93Å; F188-Y598 HydrophobicContact CD1-CG 4.3Å; F188-Y598 HydrophobicContact CE1-CD1 4.06Å; F188-Y598 WeakPolarHBondContact O-CE1 3.32Å; F188-Y598 PolarHBondContact O-OH 3.45Å
189	V	83.2	Confident	81.1	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.006	15%	0.15	C	C	.	.	H	α-helix	trans	-71.8	-39.5	177.7	167.4	0	0	0	0	112.4	V185 V186 S192 A193 F258 W333 F336 V337	V185-V189 HydrophobicContact CG1-CG2 3.98Å; V185-V189 WeakPolarHBondContact O-CB 3.47Å; V185-V189 WeakPolarHBondContact O-CG2 3.25Å; V185-V189 PolarHBondContact O-N 3.24Å; V186-V189 PolarHBondContact O-N 3.37Å; V189-S192 WeakPolarHBondContact O-CB 3.05Å; V189-S192 PolarHBondContact O-N 3.44Å; V189-A193 HydrophobicContact CG1-CB 3.88Å; V189-A193 PolarHBondContact O-N 3.3Å; V189-F258 HydrophobicContact CG1-CZ 4.38Å; V189-W333 HydrophobicContact CB-CE3 4.49Å; V189-W333 HydrophobicContact CG1-CD2 4.32Å; V189-W333 HydrophobicContact CG1-CE3 3.56Å; V189-W333 HydrophobicContact CG1-CZ3 3.71Å; V189-W333 HydrophobicContact CG2-CE3 4.17Å; V189-F336 HydrophobicContact CG2-CD1 3.89Å; V189-F336 HydrophobicContact CG2-CE1 3.93Å; V189-V337 HydrophobicContact CG2-CG2 3.66Å
190	L	78.8	Confident	80.2	Confident	46 Å²	46	28.2 Å²	28.2	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-49.7	-47.3	-168.3	-176.1	65.5	0	0	0	114.6	V186 S192 A193 E194 K204 L207	V186-L190 WeakPolarHBondContact O-CB 3.47Å; V186-L190 PolarHBondContact O-N 3.1Å; L190-S192 VanDerWaalsContact C-N 3.26Å; L190-S192 PolarHBondContact O-N 3.02Å; L190-A193 PolarHBondContact O-N 2.89Å; L190-E194 VanDerWaalsContact O-CB 3.29Å; L190-E194 WeakPolarHBondContact O-CB 3.43Å; L190-E194 PolarHBondContact O-N 3.4Å; L190-K204 HydrophobicContact CD1-CB 4.01Å; L190-K204 HydrophobicContact CD1-CG 4.39Å; L190-L207 HydrophobicContact CD1-CB 4.44Å; L190-L207 HydrophobicContact CD1-CD2 3.97Å; L190-L207 HydrophobicContact CD1-CG 4.46Å
191	P	75.4	Confident	79.2	Confident	35 Å²	35	34 Å²	34	23%	0.227	20%	0.2	C	C	.	.	H	α-helix	trans	-70.2	-19.2	-179.6	-17.6	32.7	0	0	0	114.4	G187 Y598	G187-P191 WeakPolarHBondContact O-CD 3.49Å; P191-Y598 HydrophobicContact CG-CE1 4.37Å
192	S	76.1	Confident	78.4	Confident	24 Å²	24	38.5 Å²	38.5	17%	0.168	23%	0.232	C	C	.	.	H	α-helix	trans	-87.2	-44.3	174.5	-65.6	0	0	0	0	111.1	V189 L190 E194 K195 D196	V189-S192 WeakPolarHBondContact O-CB 3.05Å; V189-S192 PolarHBondContact O-N 3.44Å; L190-S192 VanDerWaalsContact C-N 3.26Å; L190-S192 PolarHBondContact O-N 3.02Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 2.96Å; S192-K195 PolarHBondContact O-N 3.36Å; S192-D196 WeakPolarHBondContact O-CB 3.42Å; S192-D196 PolarHBondContact O-N 3.31Å
193	A	77.9	Confident	77.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-65.7	-32.3	176.8	0	0	0	0	0	112.6	V189 L190 K195 D196 M197 L207 W333	V189-A193 HydrophobicContact CG1-CB 3.88Å; V189-A193 PolarHBondContact O-N 3.3Å; L190-A193 PolarHBondContact O-N 2.89Å; A193-K195 VanDerWaalsContact C-N 3.3Å; A193-K195 PolarHBondContact O-N 3.45Å; A193-D196 PolarHBondContact O-N 3Å; A193-M197 WeakPolarHBondContact O-CB 3.38Å; A193-M197 PolarHBondContact O-N 2.66Å; A193-L207 HydrophobicContact CB-CD2 4.36Å; A193-W333 HydrophobicContact CB-CH2 4.48Å; A193-W333 HydrophobicContact CB-CZ2 4.33Å
194	E	73.9	Confident	77.4	Confident	46 Å²	46	41.4 Å²	41.4	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-52.4	-46.7	170.2	168.8	172	-168.5	0	0	112	L190 S192 C198 L199 K204	L190-E194 VanDerWaalsContact O-CB 3.29Å; L190-E194 WeakPolarHBondContact O-CB 3.43Å; L190-E194 PolarHBondContact O-N 3.4Å; S192-E194 VanDerWaalsContact C-N 3.31Å; S192-E194 PolarHBondContact O-N 2.96Å; E194-C198 PolarHBondContact O-N 2.9Å; E194-L199 PolarHBondContact O-N 2.96Å; E194-K204 HydrophobicContact CG-CD 4.13Å; E194-K204 WeakPolarHBondContact OE1-CE 3.34Å; E194-K204 IonicContact OE1-NZ 2.75Å; E194-K204 PolarHBondContact OE1-NZ 2.94Å
195	K	70.6	Confident	77	Confident	68 Å²	68	41.1 Å²	41.1	30%	0.296	26%	0.255	S	S	.	.	H	α-helix	trans	-78.3	-40.3	-178.2	-63.9	-177.3	-179.4	-176.3	0	112.9	S192 A193 L585 D586 T590	S192-K195 PolarHBondContact O-N 3.36Å; A193-K195 VanDerWaalsContact C-N 3.3Å; A193-K195 PolarHBondContact O-N 3.45Å; K195-L585 HydrophobicContact CB-CD2 3.99Å; K195-L585 HydrophobicContact CD-CD2 4.44Å; K195-D586 PolarHBondContact NZ-O 3.08Å; K195-T590 PolarHBondContact NZ-OG1 3.44Å
196	D	72.8	Confident	77	Confident	48 Å²	48	45 Å²	45	26%	0.257	28%	0.275	S	S	.	.	H	α-helix	trans	-66	-46.7	179.5	-172.4	11.4	0	0	0	111.4	S192 A193 H331 W333 R334	S192-D196 WeakPolarHBondContact O-CB 3.42Å; S192-D196 PolarHBondContact O-N 3.31Å; A193-D196 PolarHBondContact O-N 3Å; D196-H331 IonicContact OD1-CD2 3.62Å; D196-H331 PolarHBondContact OD1-CD2 2.98Å; D196-H331 IonicContact OD1-NE2 3.01Å; D196-H331 IonicContact OD2-CD2 3.34Å; D196-W333 VanDerWaalsContact OD2-CE2 3.26Å; D196-W333 VanDerWaalsContact OD2-CZ2 3.22Å; D196-W333 WeakPolarHBondContact OD2-CZ2 3.08Å; D196-W333 PolarHBondContact OD2-NE1 3Å; D196-R334 IonicContact OD2-NE 3.48Å; D196-R334 IonicContact OD2-NH2 3.56Å
197	M	73.3	Confident	77	Confident	33 Å²	33	44.5 Å²	44.5	16%	0.163	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	10.6	-173	-60.8	-176	177.5	0	0	114.8	A193 L199 Y255 F258 W333 R334	A193-M197 WeakPolarHBondContact O-CB 3.38Å; A193-M197 PolarHBondContact O-N 2.66Å; M197-L199 VanDerWaalsContact C-N 3.31Å; M197-L199 HydrophobicContact CB-CD2 3.63Å; M197-L199 HydrophobicContact CB-CG 3.89Å; M197-L199 PolarHBondContact O-N 3.31Å; M197-Y255 HydrophobicContact SD-CD2 3.89Å; M197-Y255 HydrophobicContact SD-CG 4.37Å; M197-F258 HydrophobicContact CE-CB 4.49Å; M197-F258 HydrophobicContact CE-CD1 4.43Å; M197-F258 HydrophobicContact CE-CG 4.4Å; M197-W333 HydrophobicContact CE-CH2 4.08Å; M197-W333 HydrophobicContact CE-CZ2 4.09Å; M197-R334 VanDerWaalsContact CE-NH2 3.29Å
198	C	71.6	Confident	77.1	Confident	86 Å²	86	43.2 Å²	43.2	58%	0.581	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	41.5	178.3	-53.1	0	0	0	0	113.8	E194 C583	E194-C198 PolarHBondContact O-N 2.9Å; C198-C583 WeakPolarHBondContact SG-CB 3.48Å
199	L	70.2	Confident	77.5	Confident	12 Å²	12	45 Å²	45	6%	0.063	27%	0.267	C	S	.	.			trans	-72.3	134	-166.5	-58.7	179.9	0	0	0	113	E194 M197 N203 K204 Y255	E194-L199 PolarHBondContact O-N 2.96Å; M197-L199 VanDerWaalsContact C-N 3.31Å; M197-L199 HydrophobicContact CB-CD2 3.63Å; M197-L199 HydrophobicContact CB-CG 3.89Å; M197-L199 PolarHBondContact O-N 3.31Å; L199-N203 HydrophobicContact CB-CB 4.25Å; L199-N203 HydrophobicContact CD2-CB 4.25Å; L199-K204 HydrophobicContact CB-CG 4.01Å; L199-K204 WeakPolarHBondContact O-CE 3.37Å; L199-Y255 HydrophobicContact CD1-CD2 4.36Å; L199-Y255 HydrophobicContact CD1-CE2 4.02Å; L199-Y255 HydrophobicContact CD2-CD1 4.43Å; L199-Y255 HydrophobicContact CD2-CD2 3.57Å; L199-Y255 HydrophobicContact CD2-CE2 3.68Å; L199-Y255 HydrophobicContact CD2-CG 3.98Å
200	S	74.3	Confident	77.9	Confident	59 Å²	59	46.1 Å²	46.1	41%	0.413	27%	0.273	S	S	.	.			trans	-69.1	157.7	164.7	65.6	0	0	0	0	111.4	S202 N203 K204	S200-S202 VanDerWaalsContact C-N 3.26Å; S200-S202 PolarHBondContact O-N 3.45Å; S200-N203 WeakPolarHBondContact O-CA 3.44Å; S200-N203 WeakPolarHBondContact O-CB 3.38Å; S200-N203 PolarHBondContact O-N 3.47Å; S200-K204 WeakPolarHBondContact O-CG 3.48Å; S200-K204 PolarHBondContact O-N 3.21Å
201	D	71.6	Confident	78.5	Confident	122 Å²	122	44.1 Å²	44.1	65%	0.652	26%	0.263	S	S	*	.	H	α-helix	trans	-61.8	-32.8	-176.2	-57	-63.3	0	0	0	113.4	K204 G205	D201-K204 WeakPolarHBondContact O-CB 3.35Å; D201-K204 PolarHBondContact O-N 3.49Å; D201-K204 WeakPolarHBondContact OD1-CE 3.34Å; D201-K204 IonicContact OD1-NZ 3.47Å; D201-K204 PolarHBondContact OD1-NZ 3.28Å; D201-G205 PolarHBondContact O-N 3.46Å
202	S	75.6	Confident	79.3	Confident	95 Å²	95	44 Å²	44	66%	0.664	26%	0.258	S	S	*	.	H	α-helix	trans	-61.8	-42.4	171.4	-173.8	0	0	0	0	112.1	S200 G205 M206	S200-S202 VanDerWaalsContact C-N 3.26Å; S200-S202 PolarHBondContact O-N 3.45Å; S202-G205 PolarHBondContact O-N 2.98Å; S202-M206 PolarHBondContact O-N 3Å
203	N	81.1	Confident	80.1	Confident	49 Å²	49	46.6 Å²	46.6	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-68.4	-34.9	176.4	-74.5	-2.8	0	0	0	112.1	L199 S200 M206 L207 Y255	L199-N203 HydrophobicContact CB-CB 4.25Å; L199-N203 HydrophobicContact CD2-CB 4.25Å; S200-N203 WeakPolarHBondContact O-CA 3.44Å; S200-N203 WeakPolarHBondContact O-CB 3.38Å; S200-N203 PolarHBondContact O-N 3.47Å; N203-M206 PolarHBondContact O-N 2.93Å; N203-L207 PolarHBondContact O-N 2.89Å; N203-L207 VanDerWaalsContact O-N 3.08Å; N203-Y255 VanDerWaalsContact CA-OH 3.28Å; N203-Y255 WeakPolarHBondContact CA-OH 3.42Å; N203-Y255 HydrophobicContact CB-CE1 4.01Å; N203-Y255 VanDerWaalsContact CB-OH 3.3Å; N203-Y255 WeakPolarHBondContact CB-OH 3.33Å; N203-Y255 PolarHBondContact O-OH 3.2Å
204	K	77.4	Confident	80.9	Confident	33 Å²	33	46.6 Å²	46.6	14%	0.143	27%	0.269	C	S	.	.	H	α-helix	trans	-60.7	-48.3	172.9	-63.5	170.6	-145.6	176.3	0	110.7	L190 E194 L199 S200 D201 L207 G208	L190-K204 HydrophobicContact CD1-CB 4.01Å; L190-K204 HydrophobicContact CD1-CG 4.39Å; E194-K204 HydrophobicContact CG-CD 4.13Å; E194-K204 WeakPolarHBondContact OE1-CE 3.34Å; E194-K204 IonicContact OE1-NZ 2.75Å; E194-K204 PolarHBondContact OE1-NZ 2.94Å; L199-K204 HydrophobicContact CB-CG 4.01Å; L199-K204 WeakPolarHBondContact O-CE 3.37Å; S200-K204 WeakPolarHBondContact O-CG 3.48Å; S200-K204 PolarHBondContact O-N 3.21Å; D201-K204 WeakPolarHBondContact O-CB 3.35Å; D201-K204 PolarHBondContact O-N 3.49Å; D201-K204 WeakPolarHBondContact OD1-CE 3.34Å; D201-K204 IonicContact OD1-NZ 3.47Å; D201-K204 PolarHBondContact OD1-NZ 3.28Å; K204-L207 PolarHBondContact O-N 3.38Å; K204-G208 PolarHBondContact O-N 3.03Å
205	G	81.2	Confident	81.9	Confident	39 Å²	39	44.4 Å²	44.4	40%	0.402	26%	0.259	S	S	.	.	H	α-helix	trans	-60.1	-44.7	176.2	0	0	0	0	0	113.1	D201 S202 L207 G208 L209	D201-G205 PolarHBondContact O-N 3.46Å; S202-G205 PolarHBondContact O-N 2.98Å; G205-L207 VanDerWaalsContact C-N 3.35Å; G205-L207 PolarHBondContact O-N 2.96Å; G205-G208 PolarHBondContact O-N 3.06Å; G205-G208 VanDerWaalsContact O-N 3.13Å; G205-L209 WeakPolarHBondContact O-CG 3.46Å; G205-L209 PolarHBondContact O-N 3.1Å
206	M	86.7	Confident	83.1	Confident	82 Å²	82	43.4 Å²	43.4	40%	0.404	26%	0.256	S	S	.	.	H	α-helix	trans	-61.3	-39.6	177.6	-179.4	163.6	52.6	0	0	112.8	S202 N203 G208 L209 I210 Y255 L259	S202-M206 PolarHBondContact O-N 3Å; N203-M206 PolarHBondContact O-N 2.93Å; M206-G208 VanDerWaalsContact C-N 3.31Å; M206-G208 PolarHBondContact O-N 3.04Å; M206-L209 PolarHBondContact O-N 3.19Å; M206-I210 WeakPolarHBondContact O-CB 3.3Å; M206-I210 PolarHBondContact O-N 2.96Å; M206-Y255 HydrophobicContact CE-CE1 4.14Å; M206-L259 HydrophobicContact CE-CD1 3.84Å; M206-L259 HydrophobicContact CG-CD1 4.37Å; M206-L259 HydrophobicContact CG-CD2 4.5Å; M206-L259 HydrophobicContact SD-CD1 4.28Å
207	L	85.1	Confident	84.2	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-34.7	175.3	178	59.3	0	0	0	112.3	V186 L190 A193 N203 K204 G205 F258 L259	V186-L207 WeakPolarHBondContact CG1-O 3.36Å; L190-L207 HydrophobicContact CD1-CB 4.44Å; L190-L207 HydrophobicContact CD1-CD2 3.97Å; L190-L207 HydrophobicContact CD1-CG 4.46Å; A193-L207 HydrophobicContact CB-CD2 4.36Å; N203-L207 PolarHBondContact O-N 2.89Å; N203-L207 VanDerWaalsContact O-N 3.08Å; K204-L207 PolarHBondContact O-N 3.38Å; G205-L207 VanDerWaalsContact C-N 3.35Å; G205-L207 PolarHBondContact O-N 2.96Å; L207-F258 HydrophobicContact CD1-CD1 4.13Å; L207-F258 HydrophobicContact CD1-CE1 3.6Å; L207-F258 HydrophobicContact CD2-CE1 3.99Å; L207-F258 HydrophobicContact CG-CE1 4.49Å; L207-L259 HydrophobicContact CB-CD2 4.07Å; L207-L259 HydrophobicContact CD1-CD2 3.83Å
208	G	82.1	Confident	85.2	Confident	21 Å²	21	42.5 Å²	42.5	22%	0.216	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-42.6	172.6	0	0	0	0	0	113.2	K204 G205 M206 Y212	K204-G208 PolarHBondContact O-N 3.03Å; G205-G208 PolarHBondContact O-N 3.06Å; G205-G208 VanDerWaalsContact O-N 3.13Å; M206-G208 VanDerWaalsContact C-N 3.31Å; M206-G208 PolarHBondContact O-N 3.04Å; G208-Y212 WeakPolarHBondContact O-CD2 3.36Å
209	L	88.9	Confident	86.3	Confident	43 Å²	43	38.4 Å²	38.4	23%	0.225	23%	0.227	C	C	.	.	H	α-helix	trans	-85.8	-26.1	-172.5	-64	175.3	0	0	0	114.4	G205 M206 V211 Y212 L213 V698 I701	G205-L209 WeakPolarHBondContact O-CG 3.46Å; G205-L209 PolarHBondContact O-N 3.1Å; M206-L209 PolarHBondContact O-N 3.19Å; L209-V211 VanDerWaalsContact C-N 3.29Å; L209-V211 PolarHBondContact O-N 3.44Å; L209-Y212 PolarHBondContact O-N 3.35Å; L209-L213 PolarHBondContact O-N 3.36Å; L209-V698 HydrophobicContact CD2-CB 4.49Å; L209-V698 HydrophobicContact CD2-CG1 4.28Å; L209-V698 HydrophobicContact CD2-CG2 4.36Å; L209-I701 HydrophobicContact CD2-CB 4.18Å; L209-I701 HydrophobicContact CD2-CD1 4.34Å; L209-I701 HydrophobicContact CD2-CG2 3.93Å
210	I	92.1	Very high	87.4	Confident	25 Å²	25	40.9 Å²	40.9	13%	0.128	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-33.6	-173.4	-162.3	67.3	0	0	0	113.2	M206 L213 G214 L259 R262 L263	M206-I210 WeakPolarHBondContact O-CB 3.3Å; M206-I210 PolarHBondContact O-N 2.96Å; I210-L213 HydrophobicContact CD1-CD2 4.26Å; I210-L213 PolarHBondContact O-N 2.96Å; I210-G214 PolarHBondContact O-N 3.22Å; I210-L259 HydrophobicContact CB-CD2 4.39Å; I210-L259 HydrophobicContact CG2-CD2 3.87Å; I210-R262 HydrophobicContact CG2-CB 4.25Å; I210-L263 HydrophobicContact CD1-CB 4.41Å; I210-L263 HydrophobicContact CD1-CD1 3.95Å; I210-L263 HydrophobicContact CG1-CB 3.94Å; I210-L263 HydrophobicContact CG1-CD1 4.07Å
211	V	91.2	Very high	88.3	Confident	4 Å²	4	42 Å²	42	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-71.6	-40.2	178.1	177.8	0	0	0	0	110.9	V186 L209 L213 G214 M215 R262	V186-V211 HydrophobicContact CG2-CB 4.26Å; V186-V211 HydrophobicContact CG2-CG2 3.74Å; L209-V211 VanDerWaalsContact C-N 3.29Å; L209-V211 PolarHBondContact O-N 3.44Å; V211-L213 VanDerWaalsContact C-N 3.32Å; V211-L213 PolarHBondContact O-N 3.5Å; V211-G214 PolarHBondContact O-N 2.91Å; V211-M215 WeakPolarHBondContact O-CG 3.34Å; V211-M215 PolarHBondContact O-N 3.19Å; V211-R262 HydrophobicContact CG2-CB 3.98Å
212	Y	91.9	Very high	89.4	Confident	32 Å²	32	37.7 Å²	37.7	13%	0.125	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-37.1	173.5	-72.4	-85.2	0	0	0	112.2	G208 L209 M215 M216 Y462 K694 A697 I701	G208-Y212 WeakPolarHBondContact O-CD2 3.36Å; L209-Y212 PolarHBondContact O-N 3.35Å; Y212-M215 PolarHBondContact O-N 3.32Å; Y212-M216 PolarHBondContact O-N 3.43Å; Y212-Y462 AromaticContact CE1-CD1 3.77Å; Y212-Y462 HydrophobicContact CE1-CD1 3.77Å; Y212-Y462 AromaticContact CE1-CE1 3.77Å; Y212-Y462 HydrophobicContact CE1-CE1 3.77Å; Y212-K694 HydrophobicContact CD1-CD 4.08Å; Y212-A697 HydrophobicContact CD1-CB 4.11Å; Y212-A697 HydrophobicContact CE1-CB 4.28Å; Y212-I701 HydrophobicContact CD2-CD1 4.48Å; Y212-I701 HydrophobicContact CE2-CD1 4.17Å
213	L	93.6	Very high	90.1	Very high	78 Å²	78	33.2 Å²	33.2	41%	0.408	18%	0.181	S	C	.	.	H	α-helix	trans	-63.9	-41	172.6	-170.5	73.1	0	0	0	111.5	L209 I210 V211 M216 V217 L263	L209-L213 PolarHBondContact O-N 3.36Å; I210-L213 HydrophobicContact CD1-CD2 4.26Å; I210-L213 PolarHBondContact O-N 2.96Å; V211-L213 VanDerWaalsContact C-N 3.32Å; V211-L213 PolarHBondContact O-N 3.5Å; L213-M216 HydrophobicContact CD1-CE 3.71Å; L213-M216 WeakPolarHBondContact O-CB 3.19Å; L213-M216 PolarHBondContact O-N 3.43Å; L213-V217 PolarHBondContact O-N 2.84Å; L213-L263 HydrophobicContact CD2-CD1 4.45Å
214	G	94.8	Very high	90.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60.5	-49.4	171.8	0	0	0	0	0	112.1	I210 V211 M216 V217 G218 G266 V267	I210-G214 PolarHBondContact O-N 3.22Å; V211-G214 PolarHBondContact O-N 2.91Å; G214-M216 VanDerWaalsContact C-N 3.29Å; G214-M216 PolarHBondContact O-N 2.88Å; G214-V217 PolarHBondContact O-N 2.65Å; G214-G218 PolarHBondContact O-N 2.9Å; G214-G266 CarbonylContact C-O 3.44Å; G214-V267 WeakPolarHBondContact O-CA 3.26Å; G214-V267 WeakPolarHBondContact O-CG2 3.42Å
215	M	94.7	Very high	91.2	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-37.7	177.6	-69.8	-175.4	111.8	0	0	112.5	D179 V183 V211 Y212 G218 A219 G266 I269 K694	D179-M215 WeakPolarHBondContact OD1-CE 3.44Å; V183-M215 HydrophobicContact CG2-CE 3.43Å; V183-M215 VanDerWaalsContact CG2-CE 3.43Å; V183-M215 HydrophobicContact CG2-SD 3.75Å; V211-M215 WeakPolarHBondContact O-CG 3.34Å; V211-M215 PolarHBondContact O-N 3.19Å; Y212-M215 PolarHBondContact O-N 3.32Å; M215-G218 PolarHBondContact O-N 3.32Å; M215-A219 WeakPolarHBondContact O-CB 3.32Å; M215-A219 PolarHBondContact O-N 2.96Å; M215-G266 WeakPolarHBondContact CA-O 3.47Å; M215-G266 PolarHBondContact N-O 3.3Å; M215-I269 HydrophobicContact CE-CG2 4Å; M215-I269 HydrophobicContact CG-CG2 4.14Å; M215-K694 HydrophobicContact CB-CD 4.03Å; M215-K694 HydrophobicContact CB-CG 3.85Å; M215-K694 HydrophobicContact SD-CD 3.88Å; M215-K694 PolarHBondContact SD-NZ 2.91Å
216	M	94.9	Very high	91.7	Very high	47 Å²	47	29.6 Å²	29.6	23%	0.232	15%	0.154	C	C	.	.	H	α-helix	trans	-59.3	-47.9	175.9	179.2	-172.2	77.5	0	0	111.5	Y212 L213 G214 F220 A691 K694 L695	Y212-M216 PolarHBondContact O-N 3.43Å; L213-M216 HydrophobicContact CD1-CE 3.71Å; L213-M216 WeakPolarHBondContact O-CB 3.19Å; L213-M216 PolarHBondContact O-N 3.43Å; G214-M216 VanDerWaalsContact C-N 3.29Å; G214-M216 PolarHBondContact O-N 2.88Å; M216-F220 PolarHBondContact O-N 3.28Å; M216-A691 HydrophobicContact CG-CB 4.25Å; M216-A691 WeakPolarHBondContact CG-O 3.16Å; M216-A691 VanDerWaalsContact O-CB 3.29Å; M216-A691 WeakPolarHBondContact O-CB 3.41Å; M216-K694 HydrophobicContact CB-CB 3.98Å; M216-L695 HydrophobicContact SD-CB 3.87Å; M216-L695 HydrophobicContact SD-CD1 4.09Å; M216-L695 HydrophobicContact SD-CG 4.46Å
217	V	95.3	Very high	91.7	Very high	62 Å²	62	26 Å²	26	38%	0.376	14%	0.137	S	C	.	.	H	α-helix	trans	-69.1	-43.8	178.6	174.3	0	0	0	0	110.7	L213 G214 A219 F220 L221 V267	L213-V217 PolarHBondContact O-N 2.84Å; G214-V217 PolarHBondContact O-N 2.65Å; V217-A219 PolarHBondContact O-N 2.89Å; V217-F220 PolarHBondContact O-N 2.89Å; V217-L221 HydrophobicContact CG1-CD1 3.7Å; V217-L221 HydrophobicContact CG1-CG 4.29Å; V217-L221 WeakPolarHBondContact O-CG 3.47Å; V217-L221 PolarHBondContact O-N 3.48Å; V217-V267 HydrophobicContact CB-CG2 4.24Å; V217-V267 HydrophobicContact CG1-CG2 4.27Å
218	G	95	Very high	91.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-43.4	177.6	0	0	0	0	0	113.7	G214 M215 F220 L221 W222 V267	G214-G218 PolarHBondContact O-N 2.9Å; M215-G218 PolarHBondContact O-N 3.32Å; G218-F220 VanDerWaalsContact C-N 3.34Å; G218-F220 PolarHBondContact O-N 3.25Å; G218-L221 PolarHBondContact O-N 3Å; G218-W222 WeakPolarHBondContact O-CB 3.41Å; G218-W222 PolarHBondContact O-N 3.45Å; G218-V267 WeakPolarHBondContact CA-O 3.46Å
219	A	94.1	Very high	91.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.8	-41.4	179.4	0	0	0	0	0	112.3	M215 V217 G223 G270 G687 N690 A691	M215-A219 WeakPolarHBondContact O-CB 3.32Å; M215-A219 PolarHBondContact O-N 2.96Å; V217-A219 PolarHBondContact O-N 2.89Å; A219-G223 WeakPolarHBondContact O-CA 3.29Å; A219-G223 PolarHBondContact O-N 3.38Å; A219-G223 VanDerWaalsContact O-N 3.13Å; A219-G270 WeakPolarHBondContact CA-O 3.23Å; A219-G270 WeakPolarHBondContact CB-O 3.35Å; A219-G687 CarbonylContact C-O 3.55Å; A219-G687 WeakPolarHBondContact CB-O 2.97Å; A219-G687 CarbonylContact O-C 3.09Å; A219-G687 WeakPolarHBondContact O-CA 3.45Å; A219-N690 HydrophobicContact CB-CB 4.08Å; A219-A691 HydrophobicContact CB-CB 4.2Å
220	F	93.1	Very high	91.8	Very high	63 Å²	63	29.2 Å²	29.2	28%	0.276	14%	0.144	S	C	.	.	H	α-helix	trans	-70.1	-47.9	176.4	-172.1	-100.1	0	0	0	112	M216 V217 G218 G224 W432 F435 F688 A691	M216-F220 PolarHBondContact O-N 3.28Å; V217-F220 PolarHBondContact O-N 2.89Å; G218-F220 VanDerWaalsContact C-N 3.34Å; G218-F220 PolarHBondContact O-N 3.25Å; F220-G224 PolarHBondContact O-N 3.15Å; F220-W432 HydrophobicContact CZ-CE3 4.4Å; F220-W432 HydrophobicContact CZ-CZ3 4.19Å; F220-F435 AromaticContact CE2-CD2 3.9Å; F220-F435 HydrophobicContact CE2-CD2 3.9Å; F220-F435 HydrophobicContact CE2-CE2 4.07Å; F220-F435 HydrophobicContact CE2-CG 4.22Å; F220-F435 HydrophobicContact CZ-CD2 4.5Å; F220-F435 HydrophobicContact CZ-CG 4.37Å; F220-F688 HydrophobicContact CD2-CB 4.31Å; F220-F688 HydrophobicContact CD2-CD2 4.16Å; F220-F688 HydrophobicContact CE2-CD2 4.2Å; F220-A691 HydrophobicContact CB-CB 4.17Å
221	L	93.8	Very high	91.8	Very high	83 Å²	83	28 Å²	28	44%	0.435	14%	0.138	S	C	.	.	H	α-helix	trans	-63.4	-58.3	-178.4	-70.7	175.6	0	0	0	112.3	V217 G218 L225 V267	V217-L221 HydrophobicContact CG1-CD1 3.7Å; V217-L221 HydrophobicContact CG1-CG 4.29Å; V217-L221 WeakPolarHBondContact O-CG 3.47Å; V217-L221 PolarHBondContact O-N 3.48Å; G218-L221 PolarHBondContact O-N 3Å; L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 VanDerWaalsContact O-CG 3.25Å; L221-L225 WeakPolarHBondContact O-CG 3.33Å; L221-L225 PolarHBondContact O-N 3.48Å; L221-V267 HydrophobicContact CD1-CG1 4.5Å
222	W	94.6	Very high	91.9	Very high	32 Å²	32	30.7 Å²	30.7	12%	0.121	15%	0.148	C	C	.	.	H	α-helix	trans	-71.6	-34	-176	-63.3	119.6	0	0	0	112.6	G218 L225 A226 I237 V241 V267 I275	G218-W222 WeakPolarHBondContact O-CB 3.41Å; G218-W222 PolarHBondContact O-N 3.45Å; W222-L225 HydrophobicContact CE3-CD1 4.13Å; W222-L225 HydrophobicContact CZ3-CD1 4.24Å; W222-L225 PolarHBondContact O-N 2.98Å; W222-A226 VanDerWaalsContact O-CB 3.31Å; W222-A226 WeakPolarHBondContact O-CB 3.28Å; W222-A226 PolarHBondContact O-N 3.11Å; W222-I237 HydrophobicContact CH2-CB 4.2Å; W222-I237 HydrophobicContact CH2-CG2 3.44Å; W222-I237 VanDerWaalsContact CH2-CG2 3.44Å; W222-I237 HydrophobicContact CZ2-CG2 4.41Å; W222-I237 HydrophobicContact CZ3-CB 4.09Å; W222-I237 HydrophobicContact CZ3-CG2 3.76Å; W222-V241 HydrophobicContact CZ2-CG2 4.22Å; W222-V267 PolarHBondContact NE1-O 3.1Å; W222-I275 HydrophobicContact CB-CD1 4Å
223	G	90.9	Very high	91.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-45.8	176.3	0	0	0	0	0	112	A219 T683 T684	A219-G223 WeakPolarHBondContact O-CA 3.29Å; A219-G223 PolarHBondContact O-N 3.38Å; A219-G223 VanDerWaalsContact O-N 3.13Å; G223-T683 CarbonylContact C-O 3.46Å; G223-T683 WeakPolarHBondContact CA-O 3.26Å; G223-T683 CarbonylContact O-C 3.55Å; G223-T683 WeakPolarHBondContact O-CB 3.33Å; G223-T684 PolarHBondContact O-N 3.16Å
224	G	90.1	Very high	92	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-65	-45.4	173.6	0	0	0	0	0	113.4	F220 A226 V431	F220-G224 PolarHBondContact O-N 3.15Å; G224-A226 VanDerWaalsContact C-N 3.31Å; G224-A226 PolarHBondContact O-N 3.12Å; G224-V431 WeakPolarHBondContact O-CG2 3.5Å
225	L	91.3	Very high	91.9	Very high	44 Å²	44	29.7 Å²	29.7	23%	0.23	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-32.5	-178.7	-74	173	0	0	0	113.6	L221 W222 D227 R228 L229 C234 V431	L221-L225 WeakPolarHBondContact O-CB 3.27Å; L221-L225 VanDerWaalsContact O-CG 3.25Å; L221-L225 WeakPolarHBondContact O-CG 3.33Å; L221-L225 PolarHBondContact O-N 3.48Å; W222-L225 HydrophobicContact CE3-CD1 4.13Å; W222-L225 HydrophobicContact CZ3-CD1 4.24Å; W222-L225 PolarHBondContact O-N 2.98Å; L225-D227 VanDerWaalsContact C-N 3.34Å; L225-D227 PolarHBondContact O-N 3.45Å; L225-R228 PolarHBondContact O-N 3.23Å; L225-R228 VanDerWaalsContact O-N 3.07Å; L225-L229 HydrophobicContact CB-CD1 4.33Å; L225-L229 HydrophobicContact CD2-CD1 4.01Å; L225-L229 PolarHBondContact O-N 3.36Å; L225-C234 VanDerWaalsContact C-SG 3.56Å; L225-V431 HydrophobicContact CD2-CG2 4.5Å
226	A	91.3	Very high	92	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.1	-25.8	-176.1	0	0	0	0	0	114.6	W222 G224 R228 G230 C234 I275 T683	W222-A226 VanDerWaalsContact O-CB 3.31Å; W222-A226 WeakPolarHBondContact O-CB 3.28Å; W222-A226 PolarHBondContact O-N 3.11Å; G224-A226 VanDerWaalsContact C-N 3.31Å; G224-A226 PolarHBondContact O-N 3.12Å; A226-R228 PolarHBondContact O-N 3.32Å; A226-G230 CarbonylContact O-C 3.56Å; A226-C234 HydrophobicContact CB-CB 3.84Å; A226-I275 HydrophobicContact CB-CD1 3.85Å; A226-I275 HydrophobicContact CB-CG1 3.62Å; A226-I275 HydrophobicContact CB-CG2 4.42Å; A226-T683 HydrophobicContact CB-CG2 3.77Å
227	D	87.8	Confident	92	Very high	8 Å²	8	31.3 Å²	31.3	4%	0.043	15%	0.151	C	C	.	.	H	α-helix	trans	-69.2	-22.9	172.4	-69.3	-23.4	0	0	0	111.4	L225 K681 T683 T684	L225-D227 VanDerWaalsContact C-N 3.34Å; L225-D227 PolarHBondContact O-N 3.45Å; D227-K681 VanDerWaalsContact OD2-C 3.31Å; D227-K681 WeakPolarHBondContact OD2-CA 3.39Å; D227-T683 WeakPolarHBondContact OD1-CA 3.19Å; D227-T683 WeakPolarHBondContact OD1-CB 3.24Å; D227-T683 PolarHBondContact OD1-N 2.98Å; D227-T683 PolarHBondContact OD1-OG1 3.03Å; D227-T683 PolarHBondContact OD2-N 3.42Å; D227-T684 VanDerWaalsContact OD2-CB 3.26Å; D227-T684 WeakPolarHBondContact OD2-CB 3.46Å; D227-T684 PolarHBondContact OD2-N 3.37Å; D227-T684 PolarHBondContact OD2-OG1 3.37Å
228	R	84.4	Confident	92	Very high	62 Å²	62	28.3 Å²	28.3	23%	0.234	13%	0.133	C	C	.	.	H	α-helix	trans	-109.6	-40	-174.2	-67.8	-70.5	178.9	161.3	-4.3	115.3	L225 A226 F360 D404 L427 Q430 N434	L225-R228 PolarHBondContact O-N 3.23Å; L225-R228 VanDerWaalsContact O-N 3.07Å; A226-R228 PolarHBondContact O-N 3.32Å; R228-F360 WeakPolarHBondContact O-CE2 3.24Å; R228-F360 WeakPolarHBondContact O-CZ 3.41Å; R228-D404 IonicContact NH1-OD2 2.8Å; R228-L427 HydrophobicContact CB-CD2 4.17Å; R228-Q430 VanDerWaalsContact NH1-CD 3.3Å; R228-N434 PolarHBondContact NH2-OD1 2.83Å; R228-N434 VanDerWaalsContact NH2-OD1 3.16Å
229	L	85.8	Confident	92	Very high	72 Å²	72	28.3 Å²	28.3	38%	0.377	13%	0.133	S	C	.	.	H	α-helix	trans	-93.4	-3.7	-177.5	-65.3	-179.8	0	0	0	114	L225 L427	L225-L229 HydrophobicContact CB-CD1 4.33Å; L225-L229 HydrophobicContact CD2-CD1 4.01Å; L225-L229 PolarHBondContact O-N 3.36Å; L229-L427 HydrophobicContact CD2-CD1 4.08Å; L229-L427 HydrophobicContact CD2-CD2 4.28Å
230	G	87.7	Confident	92	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.			trans	99.4	146.1	-174.6	0	0	0	0	0	112.1	A226 C234 F360	A226-G230 CarbonylContact O-C 3.56Å; G230-C234 WeakPolarHBondContact O-CB 3.4Å; G230-C234 PolarHBondContact O-N 3.3Å; G230-C234 VanDerWaalsContact O-N 3.1Å; G230-F360 VanDerWaalsContact CA-CE1 3.47Å
231	R	92.3	Very high	92.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-73.9	-49.2	-173.5	-70.4	69.2	153.4	146.8	-10.8	110.4	L235 I275 Y279 E282 E356 E363	R231-L235 WeakPolarHBondContact O-CB 3.4Å; R231-L235 PolarHBondContact O-N 3.28Å; R231-L235 VanDerWaalsContact O-N 3.08Å; R231-I275 HydrophobicContact CB-CG2 4.26Å; R231-I275 WeakPolarHBondContact O-CG2 3.29Å; R231-Y279 HydrophobicContact CB-CD2 3.74Å; R231-Y279 HydrophobicContact CB-CG 4.08Å; R231-E282 IonicContact CZ-OE1 2.66Å; R231-E282 IonicContact CZ-OE2 3.81Å; R231-E282 IonicContact NE-OE1 2.61Å; R231-E282 PolarHBondContact NE-OE1 3.12Å; R231-E282 IonicContact NE-OE2 2.79Å; R231-E282 PolarHBondContact NE-OE2 3.46Å; R231-E282 IonicContact NH2-OE1 2.82Å; R231-E282 PolarHBondContact NH2-OE1 2.91Å; R231-E282 IonicContact NH2-OE2 3.95Å; R231-E356 PolarHBondContact N-OE1 3.19Å; R231-E356 PolarHBondContact N-OE2 3.33Å; R231-E363 IonicContact CZ-OE2 4Å; R231-E363 IonicContact NH1-OE2 3.22Å; R231-E363 IonicContact NH2-OE2 3.61Å; R231-E363 PolarHBondContact NH2-OE2 3.43Å
232	R	93.3	Very high	92.2	Very high	60 Å²	60	25.6 Å²	25.6	23%	0.226	13%	0.126	C	C	.	.	H	α-helix	trans	-63.9	-43.6	175.8	158.4	-178.6	174.4	-109	21.3	111.2	L235 L236 Y279 L351 T352 Q354 E356	R232-L235 PolarHBondContact O-N 2.97Å; R232-L236 HydrophobicContact CG-CD1 3.9Å; R232-L236 WeakPolarHBondContact O-CG 3.47Å; R232-L236 PolarHBondContact O-N 2.61Å; R232-Y279 HydrophobicContact CB-CE2 4.14Å; R232-L351 PolarHBondContact NE-O 3.05Å; R232-L351 VanDerWaalsContact NE-O 3.07Å; R232-T352 PolarHBondContact NH2-O 3.36Å; R232-Q354 WeakPolarHBondContact CD-O 3.4Å; R232-Q354 PolarHBondContact NE-O 3.48Å; R232-Q354 PolarHBondContact NH2-O 2.9Å; R232-E356 WeakPolarHBondContact CA-OE2 3.26Å; R232-E356 WeakPolarHBondContact CB-OE2 3.33Å; R232-E356 PolarHBondContact N-OE1 3.18Å; R232-E356 PolarHBondContact N-OE2 3.44Å
233	Q	92	Very high	92.2	Very high	88 Å²	88	24.9 Å²	24.9	41%	0.411	13%	0.126	S	C	.	.	H	α-helix	trans	-63.7	-44.9	-178.5	-172.6	63.7	5.6	0	0	112.2	L235 L236 I237 E356	Q233-L235 PolarHBondContact O-N 2.85Å; Q233-L236 PolarHBondContact O-N 3.32Å; Q233-I237 HydrophobicContact CG-CD1 4.23Å; Q233-I237 WeakPolarHBondContact O-CG1 3.45Å; Q233-I237 PolarHBondContact O-N 3.42Å; Q233-E356 PolarHBondContact N-OE2 3.08Å
234	C	93.8	Very high	92.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-64.4	-38.3	174.1	-84.1	0	0	0	0	113	L225 A226 G230 I237 S238 I275	L225-C234 VanDerWaalsContact C-SG 3.56Å; A226-C234 HydrophobicContact CB-CB 3.84Å; G230-C234 WeakPolarHBondContact O-CB 3.4Å; G230-C234 PolarHBondContact O-N 3.3Å; G230-C234 VanDerWaalsContact O-N 3.1Å; C234-I237 PolarHBondContact O-N 3.12Å; C234-S238 WeakPolarHBondContact O-CB 3.22Å; C234-S238 PolarHBondContact O-N 3.49Å; C234-I275 HydrophobicContact CB-CD1 3.87Å
235	L	94.8	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-41.4	176.9	-172.1	58.4	0	0	0	112.4	L172 A175 R231 R232 Q233 S238 L239 I275 V276 L351	L172-L235 HydrophobicContact CD2-CD2 3.67Å; A175-L235 HydrophobicContact CB-CD2 4.42Å; R231-L235 WeakPolarHBondContact O-CB 3.4Å; R231-L235 PolarHBondContact O-N 3.28Å; R231-L235 VanDerWaalsContact O-N 3.08Å; R232-L235 PolarHBondContact O-N 2.97Å; Q233-L235 PolarHBondContact O-N 2.85Å; L235-S238 PolarHBondContact O-N 3.1Å; L235-L239 HydrophobicContact CD1-CD1 4.04Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 3.95Å; L235-L239 WeakPolarHBondContact O-CB 3.39Å; L235-L239 WeakPolarHBondContact O-CG 3.36Å; L235-L239 PolarHBondContact O-N 2.6Å; L235-I275 HydrophobicContact CB-CG2 3.9Å; L235-V276 HydrophobicContact CD1-CG2 3.81Å; L235-V276 HydrophobicContact CD2-CG2 3.65Å; L235-V276 HydrophobicContact CG-CG2 4.41Å; L235-L351 HydrophobicContact CD2-CD1 3.7Å; L235-L351 HydrophobicContact CD2-CD2 3.88Å; L235-L351 HydrophobicContact CD2-CG 4.47Å; L235-L351 HydrophobicContact CG-CD1 3.78Å
236	L	95.6	Very high	92.7	Very high	21 Å²	21	28.9 Å²	28.9	11%	0.11	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-44.3	175.7	-81	167.9	0	0	0	112	R232 Q233 S240 I348 L351 T352	R232-L236 HydrophobicContact CG-CD1 3.9Å; R232-L236 WeakPolarHBondContact O-CG 3.47Å; R232-L236 PolarHBondContact O-N 2.61Å; Q233-L236 PolarHBondContact O-N 3.32Å; L236-S240 VanDerWaalsContact O-CB 3.28Å; L236-S240 WeakPolarHBondContact O-CB 3.44Å; L236-S240 PolarHBondContact O-N 3.28Å; L236-S240 PolarHBondContact O-OG 2.74Å; L236-I348 HydrophobicContact CD2-CG2 4.11Å; L236-L351 HydrophobicContact CD2-CB 3.57Å; L236-L351 HydrophobicContact CD2-CD1 4.47Å; L236-L351 HydrophobicContact CG-CB 4.08Å; L236-T352 HydrophobicContact CD2-CG2 4.49Å
237	I	94.8	Very high	92.7	Very high	61 Å²	61	33.4 Å²	33.4	31%	0.313	17%	0.167	S	C	.	.	H	α-helix	trans	-69.7	-45.8	179.1	-57.4	163.2	0	0	0	110.4	W222 Q233 C234 L239 S240 V241	W222-I237 HydrophobicContact CH2-CB 4.2Å; W222-I237 HydrophobicContact CH2-CG2 3.44Å; W222-I237 VanDerWaalsContact CH2-CG2 3.44Å; W222-I237 HydrophobicContact CZ2-CG2 4.41Å; W222-I237 HydrophobicContact CZ3-CB 4.09Å; W222-I237 HydrophobicContact CZ3-CG2 3.76Å; Q233-I237 HydrophobicContact CG-CD1 4.23Å; Q233-I237 WeakPolarHBondContact O-CG1 3.45Å; Q233-I237 PolarHBondContact O-N 3.42Å; C234-I237 PolarHBondContact O-N 3.12Å; I237-L239 PolarHBondContact O-N 3.37Å; I237-S240 PolarHBondContact O-N 2.65Å; I237-V241 HydrophobicContact CG2-CG2 4.44Å; I237-V241 WeakPolarHBondContact O-CG2 3.21Å; I237-V241 PolarHBondContact O-N 2.74Å
238	S	95.1	Very high	93	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-51.6	-52.7	175.3	156.5	0	0	0	0	112.2	C234 L235 V241 N242 G268	C234-S238 WeakPolarHBondContact O-CB 3.22Å; C234-S238 PolarHBondContact O-N 3.49Å; L235-S238 PolarHBondContact O-N 3.1Å; S238-V241 PolarHBondContact O-N 2.89Å; S238-N242 PolarHBondContact O-N 3.37Å; S238-N242 VanDerWaalsContact O-N 3.12Å; S238-G268 WeakPolarHBondContact CB-O 3.25Å; S238-G268 CarbonylContact O-C 3.57Å; S238-G268 WeakPolarHBondContact O-CA 3.41Å; S238-G268 PolarHBondContact OG-O 2.8Å
239	L	94.9	Very high	93.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.3	-35.5	178.8	-69.4	169.1	0	0	0	112.4	A175 A178 L235 I237 N242 S243 I269 A347 I348 L351	A175-L239 HydrophobicContact CB-CD1 3.92Å; A178-L239 HydrophobicContact CB-CD2 4.43Å; L235-L239 HydrophobicContact CD1-CD1 4.04Å; L235-L239 HydrophobicContact CD1-CG 4.2Å; L235-L239 HydrophobicContact CG-CD1 3.95Å; L235-L239 WeakPolarHBondContact O-CB 3.39Å; L235-L239 WeakPolarHBondContact O-CG 3.36Å; L235-L239 PolarHBondContact O-N 2.6Å; I237-L239 PolarHBondContact O-N 3.37Å; L239-N242 PolarHBondContact O-N 3.41Å; L239-S243 WeakPolarHBondContact O-CB 3.43Å; L239-S243 PolarHBondContact O-N 3.39Å; L239-I269 HydrophobicContact CD2-CD1 3.74Å; L239-A347 HydrophobicContact CD1-CB 4.09Å; L239-I348 HydrophobicContact CB-CD1 4.14Å; L239-I348 HydrophobicContact CB-CG1 3.66Å; L239-L351 HydrophobicContact CD1-CD1 3.44Å; L239-L351 VanDerWaalsContact CD1-CD1 3.44Å
240	S	95.4	Very high	93.5	Very high	46 Å²	46	31.8 Å²	31.8	32%	0.322	16%	0.158	S	C	.	.	H	α-helix	trans	-64.7	-43	176.8	-61.6	0	0	0	0	111.9	L236 I237 S243 V244	L236-S240 VanDerWaalsContact O-CB 3.28Å; L236-S240 WeakPolarHBondContact O-CB 3.44Å; L236-S240 PolarHBondContact O-N 3.28Å; L236-S240 PolarHBondContact O-OG 2.74Å; I237-S240 PolarHBondContact O-N 2.65Å; S240-S243 PolarHBondContact O-N 3.05Å; S240-V244 WeakPolarHBondContact O-CB 3.46Å; S240-V244 VanDerWaalsContact O-CG2 3.29Å; S240-V244 WeakPolarHBondContact O-CG2 3.4Å; S240-V244 PolarHBondContact O-N 3.2Å
241	V	95.4	Very high	93.5	Very high	39 Å²	39	35.8 Å²	35.8	24%	0.236	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-48.5	173.5	169.6	0	0	0	0	110.3	W222 I237 S238 V244 F245	W222-V241 HydrophobicContact CZ2-CG2 4.22Å; I237-V241 HydrophobicContact CG2-CG2 4.44Å; I237-V241 WeakPolarHBondContact O-CG2 3.21Å; I237-V241 PolarHBondContact O-N 2.74Å; S238-V241 PolarHBondContact O-N 2.89Å; V241-V244 PolarHBondContact O-N 3.19Å; V241-F245 HydrophobicContact CG1-CD2 3.87Å; V241-F245 HydrophobicContact CG1-CE2 4.07Å; V241-F245 VanDerWaalsContact O-CD2 3.25Å; V241-F245 WeakPolarHBondContact O-CD2 3.19Å; V241-F245 PolarHBondContact O-N 2.81Å; V241-F245 VanDerWaalsContact O-N 3.12Å
242	N	94.9	Very high	93.3	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-53.5	175	179.5	81.7	0	0	0	111.7	S238 L239 V244 F245 A246 S265 I269	S238-N242 PolarHBondContact O-N 3.37Å; S238-N242 VanDerWaalsContact O-N 3.12Å; L239-N242 PolarHBondContact O-N 3.41Å; N242-V244 VanDerWaalsContact C-N 3.31Å; N242-V244 PolarHBondContact O-N 3.13Å; N242-F245 PolarHBondContact O-N 3.42Å; N242-A246 WeakPolarHBondContact O-CB 3.4Å; N242-A246 PolarHBondContact O-N 3.44Å; N242-S265 PolarHBondContact OD1-O 2.9Å; N242-S265 PolarHBondContact OD1-OG 3.31Å; N242-I269 HydrophobicContact CB-CB 4.22Å; N242-I269 HydrophobicContact CB-CD1 4.19Å; N242-I269 WeakPolarHBondContact OD1-CB 3.49Å
243	S	94.1	Very high	92.9	Very high	16 Å²	16	37.5 Å²	37.5	11%	0.112	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-40.1	-176.7	-173.4	0	0	0	0	112.9	L239 S240 F247 S344 V345	L239-S243 WeakPolarHBondContact O-CB 3.43Å; L239-S243 PolarHBondContact O-N 3.39Å; S240-S243 PolarHBondContact O-N 3.05Å; S243-F247 VanDerWaalsContact O-CB 3.26Å; S243-F247 WeakPolarHBondContact O-CB 3.16Å; S243-F247 PolarHBondContact O-N 3.42Å; S243-F247 VanDerWaalsContact O-N 3.1Å; S243-S344 WeakPolarHBondContact CB-OG 3.16Å; S243-S344 PolarHBondContact OG-OG 2.81Å; S243-V345 WeakPolarHBondContact OG-CG2 3.5Å
244	V	95.2	Very high	92.5	Very high	71 Å²	71	35.3 Å²	35.3	43%	0.43	19%	0.189	S	C	.	.	H	α-helix	trans	-70.1	-46.8	-179.6	169.9	0	0	0	0	111.1	S240 V241 N242 F247 F248	S240-V244 WeakPolarHBondContact O-CB 3.46Å; S240-V244 VanDerWaalsContact O-CG2 3.29Å; S240-V244 WeakPolarHBondContact O-CG2 3.4Å; S240-V244 PolarHBondContact O-N 3.2Å; V241-V244 PolarHBondContact O-N 3.19Å; N242-V244 VanDerWaalsContact C-N 3.31Å; N242-V244 PolarHBondContact O-N 3.13Å; V244-F247 PolarHBondContact O-N 2.58Å; V244-F248 HydrophobicContact CG1-CD2 3.74Å; V244-F248 HydrophobicContact CG1-CE2 3.58Å; V244-F248 WeakPolarHBondContact O-CD2 3.22Å; V244-F248 PolarHBondContact O-N 3.17Å
245	F	95.2	Very high	92.2	Very high	58 Å²	58	37.2 Å²	37.2	25%	0.254	20%	0.197	S	C	.	.	H	α-helix	trans	-75.9	-31.7	-179.2	-71.5	-64.1	0	0	0	113.4	V241 N242 S249 L264	V241-F245 HydrophobicContact CG1-CD2 3.87Å; V241-F245 HydrophobicContact CG1-CE2 4.07Å; V241-F245 VanDerWaalsContact O-CD2 3.25Å; V241-F245 WeakPolarHBondContact O-CD2 3.19Å; V241-F245 PolarHBondContact O-N 2.81Å; V241-F245 VanDerWaalsContact O-N 3.12Å; N242-F245 PolarHBondContact O-N 3.42Å; F245-S249 WeakPolarHBondContact O-CB 3.31Å; F245-S249 PolarHBondContact O-N 3.14Å; F245-L264 HydrophobicContact CB-CB 4.26Å; F245-L264 HydrophobicContact CD1-CB 4.09Å; F245-L264 HydrophobicContact CD1-CD1 4.05Å; F245-L264 HydrophobicContact CD2-CB 3.58Å; F245-L264 HydrophobicContact CD2-CD1 4.35Å; F245-L264 HydrophobicContact CE1-CB 4.38Å; F245-L264 HydrophobicContact CE1-CD1 3.6Å; F245-L264 HydrophobicContact CE2-CB 3.91Å; F245-L264 HydrophobicContact CE2-CD1 3.94Å; F245-L264 HydrophobicContact CG-CB 3.69Å; F245-L264 HydrophobicContact CG-CD1 4.42Å; F245-L264 HydrophobicContact CZ-CB 4.31Å; F245-L264 HydrophobicContact CZ-CD1 3.55Å
246	A	92.1	Very high	92	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-50	168.8	0	0	0	0	0	111	N242 S249 S250 A341	N242-A246 WeakPolarHBondContact O-CB 3.4Å; N242-A246 PolarHBondContact O-N 3.44Å; A246-S249 PolarHBondContact O-N 3.05Å; A246-S249 PolarHBondContact O-OG 3.46Å; A246-S250 PolarHBondContact O-N 3.19Å; A246-A341 HydrophobicContact CB-CB 4.26Å
247	F	92.6	Very high	91.7	Very high	95 Å²	95	42.3 Å²	42.3	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-55.7	-54.7	175.9	177.8	-93.5	0	0	0	111.5	S243 V244 S249 S250 F251 L338	S243-F247 VanDerWaalsContact O-CB 3.26Å; S243-F247 WeakPolarHBondContact O-CB 3.16Å; S243-F247 PolarHBondContact O-N 3.42Å; S243-F247 VanDerWaalsContact O-N 3.1Å; V244-F247 PolarHBondContact O-N 2.58Å; F247-S249 VanDerWaalsContact C-N 3.28Å; F247-S249 PolarHBondContact O-N 3.03Å; F247-S250 WeakPolarHBondContact O-CB 3.36Å; F247-S250 PolarHBondContact O-N 3.09Å; F247-S250 VanDerWaalsContact O-N 3.15Å; F247-S250 PolarHBondContact O-OG 2.88Å; F247-F251 HydrophobicContact CD1-CD2 4.48Å; F247-F251 HydrophobicContact CD1-CE2 4.09Å; F247-F251 HydrophobicContact CD2-CE2 4.27Å; F247-F251 HydrophobicContact CE1-CD2 4.26Å; F247-F251 AromaticContact CE1-CE2 3.64Å; F247-F251 HydrophobicContact CE1-CE2 3.64Å; F247-F251 HydrophobicContact CE1-CZ 4.49Å; F247-F251 AromaticContact CE2-CE2 3.86Å; F247-F251 HydrophobicContact CE2-CE2 3.86Å; F247-F251 HydrophobicContact CE2-CZ 4.33Å; F247-F251 HydrophobicContact CG-CE2 4.38Å; F247-F251 AromaticContact CZ-CE2 3.52Å; F247-F251 HydrophobicContact CZ-CE2 3.52Å; F247-F251 HydrophobicContact CZ-CZ 4.01Å; F247-F251 WeakPolarHBondContact O-CD2 3.39Å; F247-L338 HydrophobicContact CD2-CD1 3.57Å; F247-L338 HydrophobicContact CE2-CD1 3.71Å
248	F	92.8	Very high	91.6	Very high	108 Å²	108	39.5 Å²	39.5	47%	0.474	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-36.2	178.2	-76.6	-55	0	0	0	112.8	V244 S250 F251 V252	V244-F248 HydrophobicContact CG1-CD2 3.74Å; V244-F248 HydrophobicContact CG1-CE2 3.58Å; V244-F248 WeakPolarHBondContact O-CD2 3.22Å; V244-F248 PolarHBondContact O-N 3.17Å; F248-S250 PolarHBondContact O-N 3.27Å; F248-S250 VanDerWaalsContact O-N 3.13Å; F248-F251 PolarHBondContact O-N 2.93Å; F248-F251 VanDerWaalsContact O-N 3.11Å; F248-V252 WeakPolarHBondContact O-CG2 3.43Å; F248-V252 PolarHBondContact O-N 3.07Å
249	S	91.3	Very high	91.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-24.2	178.8	81.2	0	0	0	0	113.8	F245 A246 F247 F258 R262	F245-S249 WeakPolarHBondContact O-CB 3.31Å; F245-S249 PolarHBondContact O-N 3.14Å; A246-S249 PolarHBondContact O-N 3.05Å; A246-S249 PolarHBondContact O-OG 3.46Å; F247-S249 VanDerWaalsContact C-N 3.28Å; F247-S249 PolarHBondContact O-N 3.03Å; S249-F258 VanDerWaalsContact O-CD2 3.26Å; S249-F258 WeakPolarHBondContact O-CD2 3.46Å; S249-F258 WeakPolarHBondContact O-CE2 3.36Å; S249-R262 PolarHBondContact OG-NE 3.14Å; S249-R262 VanDerWaalsContact OG-NE 3.13Å; S249-R262 PolarHBondContact OG-NH2 2.91Å
250	S	89.9	Confident	91.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-39.4	175.8	69.6	0	0	0	0	112.5	A246 F247 F248 F330 R334	A246-S250 PolarHBondContact O-N 3.19Å; F247-S250 WeakPolarHBondContact O-CB 3.36Å; F247-S250 PolarHBondContact O-N 3.09Å; F247-S250 VanDerWaalsContact O-N 3.15Å; F247-S250 PolarHBondContact O-OG 2.88Å; F248-S250 PolarHBondContact O-N 3.27Å; F248-S250 VanDerWaalsContact O-N 3.13Å; S250-F330 WeakPolarHBondContact O-CE2 3.45Å; S250-R334 WeakPolarHBondContact CB-O 3.45Å; S250-R334 WeakPolarHBondContact O-CD 3.28Å; S250-R334 WeakPolarHBondContact O-CG 3.5Å; S250-R334 PolarHBondContact O-NH1 2.94Å
251	F	88.4	Confident	91.4	Very high	84 Å²	84	44.1 Å²	44.1	37%	0.368	24%	0.24	S	C	.	.	H	α-helix	trans	-83.1	-20.8	-175.3	-62.9	-82.3	0	0	0	114.1	F247 F248 Q253 Y328 F330 L338	F247-F251 HydrophobicContact CD1-CD2 4.48Å; F247-F251 HydrophobicContact CD1-CE2 4.09Å; F247-F251 HydrophobicContact CD2-CE2 4.27Å; F247-F251 HydrophobicContact CE1-CD2 4.26Å; F247-F251 AromaticContact CE1-CE2 3.64Å; F247-F251 HydrophobicContact CE1-CE2 3.64Å; F247-F251 HydrophobicContact CE1-CZ 4.49Å; F247-F251 AromaticContact CE2-CE2 3.86Å; F247-F251 HydrophobicContact CE2-CE2 3.86Å; F247-F251 HydrophobicContact CE2-CZ 4.33Å; F247-F251 HydrophobicContact CG-CE2 4.38Å; F247-F251 AromaticContact CZ-CE2 3.52Å; F247-F251 HydrophobicContact CZ-CE2 3.52Å; F247-F251 HydrophobicContact CZ-CZ 4.01Å; F247-F251 WeakPolarHBondContact O-CD2 3.39Å; F248-F251 PolarHBondContact O-N 2.93Å; F248-F251 VanDerWaalsContact O-N 3.11Å; F251-Q253 PolarHBondContact O-N 3.38Å; F251-Y328 WeakPolarHBondContact CA-OH 3.46Å; F251-Y328 PolarHBondContact O-OH 3.35Å; F251-F330 HydrophobicContact CD1-CE2 4.12Å; F251-F330 HydrophobicContact CE1-CE2 4.39Å; F251-L338 HydrophobicContact CE2-CD1 4.02Å; F251-L338 HydrophobicContact CZ-CD1 4.23Å
252	V	88.7	Confident	91.2	Very high	30 Å²	30	42.3 Å²	42.3	18%	0.182	23%	0.23	C	C	.	.			trans	-78	119.1	-173.1	170	0	0	0	0	112	F248 T257 F258 R334	F248-V252 WeakPolarHBondContact O-CG2 3.43Å; F248-V252 PolarHBondContact O-N 3.07Å; V252-T257 HydrophobicContact CG1-CG2 3.7Å; V252-T257 HydrophobicContact CG2-CG2 4.25Å; V252-F258 HydrophobicContact CG1-CB 4.08Å; V252-R334 PolarHBondContact O-NH1 2.91Å; V252-R334 PolarHBondContact O-NH2 2.98Å
253	Q	83.3	Confident	91.2	Very high	67 Å²	67	44.4 Å²	44.4	31%	0.313	24%	0.24	S	C	.	.			trans	-90.6	-28.7	178.9	-80	156.1	-11.8	0	0	114.3	F251 Y255 Y328 Q329	F251-Q253 PolarHBondContact O-N 3.38Å; Q253-Y255 PolarHBondContact O-N 3.16Å; Q253-Y328 VanDerWaalsContact CD-CE2 3.5Å; Q253-Y328 HydrophobicContact CG-CE2 4.46Å; Q253-Y328 VanDerWaalsContact NE2-CE2 3.26Å; Q253-Y328 VanDerWaalsContact NE2-CG 3.29Å; Q253-Q329 PolarHBondContact NE2-O 2.97Å
254	G	85.3	Confident	91.3	Very high	41 Å²	41	45.7 Å²	45.7	42%	0.423	25%	0.246	S	C	.	.	S	Bend	trans	-71.5	118.4	176.6	0	0	0	0	0	112	G256 T257 F258	G254-G256 VanDerWaalsContact C-N 3.33Å; G254-G256 PolarHBondContact O-N 2.84Å; G254-T257 PolarHBondContact O-N 3.32Å; G254-T257 VanDerWaalsContact O-N 3.08Å; G254-F258 PolarHBondContact O-N 2.93Å
255	Y	87.1	Confident	91.3	Very high	41 Å²	41	42.3 Å²	42.3	16%	0.161	23%	0.225	C	C	.	.	H	α-helix	trans	-51.3	-44.7	-177.6	172.1	-110.5	0	0	0	113.9	M197 L199 N203 M206 Q253 T257 F258 L259	M197-Y255 HydrophobicContact SD-CD2 3.89Å; M197-Y255 HydrophobicContact SD-CG 4.37Å; L199-Y255 HydrophobicContact CD1-CD2 4.36Å; L199-Y255 HydrophobicContact CD1-CE2 4.02Å; L199-Y255 HydrophobicContact CD2-CD1 4.43Å; L199-Y255 HydrophobicContact CD2-CD2 3.57Å; L199-Y255 HydrophobicContact CD2-CE2 3.68Å; L199-Y255 HydrophobicContact CD2-CG 3.98Å; N203-Y255 VanDerWaalsContact CA-OH 3.28Å; N203-Y255 WeakPolarHBondContact CA-OH 3.42Å; N203-Y255 HydrophobicContact CB-CE1 4.01Å; N203-Y255 VanDerWaalsContact CB-OH 3.3Å; N203-Y255 WeakPolarHBondContact CB-OH 3.33Å; N203-Y255 PolarHBondContact O-OH 3.2Å; M206-Y255 HydrophobicContact CE-CE1 4.14Å; Q253-Y255 PolarHBondContact O-N 3.16Å; Y255-T257 PolarHBondContact O-N 3.37Å; Y255-F258 WeakPolarHBondContact O-CB 3.4Å; Y255-F258 PolarHBondContact O-N 3.2Å; Y255-L259 HydrophobicContact CD1-CD1 4.2Å; Y255-L259 HydrophobicContact CD2-CG 4.45Å; Y255-L259 HydrophobicContact CE1-CD1 3.6Å; Y255-L259 HydrophobicContact CE1-CG 4.35Å; Y255-L259 HydrophobicContact CE2-CD1 4.14Å; Y255-L259 HydrophobicContact CE2-CD2 4.13Å; Y255-L259 HydrophobicContact CE2-CG 4.03Å; Y255-L259 WeakPolarHBondContact O-CG 3.35Å; Y255-L259 PolarHBondContact O-N 3.44Å
256	G	89.1	Confident	91.2	Very high	49 Å²	49	39.6 Å²	39.6	51%	0.505	21%	0.213	S	C	.	.	H	α-helix	trans	-63.3	-41.2	177.8	0	0	0	0	0	113.5	G254 L259 F260	G254-G256 VanDerWaalsContact C-N 3.33Å; G254-G256 PolarHBondContact O-N 2.84Å; G256-L259 PolarHBondContact O-N 2.86Å; G256-F260 PolarHBondContact O-N 3.33Å
257	T	90.9	Very high	91.4	Very high	79 Å²	79	40.8 Å²	40.8	49%	0.485	22%	0.22	S	C	.	.	H	α-helix	trans	-70.7	-33.7	175.8	-47.5	0	0	0	0	111.2	V252 G254 Y255 F260 C261	V252-T257 HydrophobicContact CG1-CG2 3.7Å; V252-T257 HydrophobicContact CG2-CG2 4.25Å; G254-T257 PolarHBondContact O-N 3.32Å; G254-T257 VanDerWaalsContact O-N 3.08Å; Y255-T257 PolarHBondContact O-N 3.37Å; T257-F260 PolarHBondContact O-N 3.18Å; T257-C261 PolarHBondContact O-N 2.64Å; T257-C261 PolarHBondContact O-SG 3.43Å; T257-C261 VanDerWaalsContact O-SG 3.38Å
258	F	91.2	Very high	91.5	Very high	1 Å²	1	36.2 Å²	36.2	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-45	174.4	176	-110.2	0	0	0	111.5	V189 M197 L207 S249 V252 G254 Y255 F260 C261 R262 W333	V189-F258 HydrophobicContact CG1-CZ 4.38Å; M197-F258 HydrophobicContact CE-CB 4.49Å; M197-F258 HydrophobicContact CE-CD1 4.43Å; M197-F258 HydrophobicContact CE-CG 4.4Å; L207-F258 HydrophobicContact CD1-CD1 4.13Å; L207-F258 HydrophobicContact CD1-CE1 3.6Å; L207-F258 HydrophobicContact CD2-CE1 3.99Å; L207-F258 HydrophobicContact CG-CE1 4.49Å; S249-F258 VanDerWaalsContact O-CD2 3.26Å; S249-F258 WeakPolarHBondContact O-CD2 3.46Å; S249-F258 WeakPolarHBondContact O-CE2 3.36Å; V252-F258 HydrophobicContact CG1-CB 4.08Å; G254-F258 PolarHBondContact O-N 2.93Å; Y255-F258 WeakPolarHBondContact O-CB 3.4Å; Y255-F258 PolarHBondContact O-N 3.2Å; F258-F260 VanDerWaalsContact C-N 3.33Å; F258-F260 PolarHBondContact O-N 2.77Å; F258-C261 PolarHBondContact O-N 2.9Å; F258-R262 HydrophobicContact CE2-CG 4.47Å; F258-R262 HydrophobicContact CZ-CG 4.38Å; F258-R262 WeakPolarHBondContact O-CG 3Å; F258-R262 PolarHBondContact O-N 3.01Å; F258-W333 HydrophobicContact CE1-CH2 4.42Å; F258-W333 AromaticContact CE2-CH2 3.97Å; F258-W333 HydrophobicContact CE2-CH2 3.97Å; F258-W333 AromaticContact CE2-CZ3 3.84Å; F258-W333 HydrophobicContact CE2-CZ3 3.84Å; F258-W333 AromaticContact CZ-CH2 3.9Å; F258-W333 HydrophobicContact CZ-CH2 3.9Å; F258-W333 AromaticContact CZ-CZ3 3.71Å; F258-W333 HydrophobicContact CZ-CZ3 3.71Å
259	L	91.9	Very high	91.5	Very high	17 Å²	17	31.1 Å²	31.1	9%	0.089	18%	0.178	C	C	.	.	H	α-helix	trans	-58.2	-43.1	170.4	-70.8	173.2	0	0	0	112.1	M206 L207 I210 Y255 G256 R262 L263	M206-L259 HydrophobicContact CE-CD1 3.84Å; M206-L259 HydrophobicContact CG-CD1 4.37Å; M206-L259 HydrophobicContact CG-CD2 4.5Å; M206-L259 HydrophobicContact SD-CD1 4.28Å; L207-L259 HydrophobicContact CB-CD2 4.07Å; L207-L259 HydrophobicContact CD1-CD2 3.83Å; I210-L259 HydrophobicContact CB-CD2 4.39Å; I210-L259 HydrophobicContact CG2-CD2 3.87Å; Y255-L259 HydrophobicContact CD1-CD1 4.2Å; Y255-L259 HydrophobicContact CD2-CG 4.45Å; Y255-L259 HydrophobicContact CE1-CD1 3.6Å; Y255-L259 HydrophobicContact CE1-CG 4.35Å; Y255-L259 HydrophobicContact CE2-CD1 4.14Å; Y255-L259 HydrophobicContact CE2-CD2 4.13Å; Y255-L259 HydrophobicContact CE2-CG 4.03Å; Y255-L259 WeakPolarHBondContact O-CG 3.35Å; Y255-L259 PolarHBondContact O-N 3.44Å; G256-L259 PolarHBondContact O-N 2.86Å; L259-R262 CarbonylContact O-C 3.42Å; L259-R262 PolarHBondContact O-N 2.85Å; L259-R262 VanDerWaalsContact O-N 3.16Å; L259-L263 PolarHBondContact O-N 3.34Å
260	F	94.5	Very high	91.5	Very high	117 Å²	117	31.1 Å²	31.1	51%	0.513	18%	0.178	S	C	.	.	H	α-helix	trans	-63.3	-45.4	179.3	179.6	-103.5	0	0	0	112.2	G256 T257 F258 R262 L263 L264	G256-F260 PolarHBondContact O-N 3.33Å; T257-F260 PolarHBondContact O-N 3.18Å; F258-F260 VanDerWaalsContact C-N 3.33Å; F258-F260 PolarHBondContact O-N 2.77Å; F260-R262 VanDerWaalsContact C-N 3.28Å; F260-R262 PolarHBondContact O-N 2.8Å; F260-L263 PolarHBondContact O-N 3.47Å; F260-L264 HydrophobicContact CD1-CD1 4.22Å; F260-L264 HydrophobicContact CE1-CD1 3.58Å; F260-L264 HydrophobicContact CE2-CD1 4.23Å; F260-L264 HydrophobicContact CZ-CD1 3.59Å; F260-L264 HydrophobicContact CZ-CG 4.36Å; F260-L264 PolarHBondContact O-N 3.3Å; F260-L264 VanDerWaalsContact O-N 3.13Å
261	C	94.7	Very high	91.4	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.061	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-40	171.8	-65.5	0	0	0	0	111.5	T257 F258 L264 S265	T257-C261 PolarHBondContact O-N 2.64Å; T257-C261 PolarHBondContact O-SG 3.43Å; T257-C261 VanDerWaalsContact O-SG 3.38Å; F258-C261 PolarHBondContact O-N 2.9Å; C261-L264 PolarHBondContact O-N 3.07Å; C261-S265 WeakPolarHBondContact O-CB 3.44Å; C261-S265 PolarHBondContact O-N 3.23Å
262	R	92.7	Very high	91.6	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.008	16%	0.161	C	C	.	.	H	α-helix	trans	-69.6	-34.9	178	-73.8	-68.9	158.7	114.7	10.7	114.3	V185 I210 V211 S249 F258 L259 F260 S265 G266	V185-R262 VanDerWaalsContact CG1-NH1 3.35Å; I210-R262 HydrophobicContact CG2-CB 4.25Å; V211-R262 HydrophobicContact CG2-CB 3.98Å; S249-R262 PolarHBondContact OG-NE 3.14Å; S249-R262 VanDerWaalsContact OG-NE 3.13Å; S249-R262 PolarHBondContact OG-NH2 2.91Å; F258-R262 HydrophobicContact CE2-CG 4.47Å; F258-R262 HydrophobicContact CZ-CG 4.38Å; F258-R262 WeakPolarHBondContact O-CG 3Å; F258-R262 PolarHBondContact O-N 3.01Å; L259-R262 CarbonylContact O-C 3.42Å; L259-R262 PolarHBondContact O-N 2.85Å; L259-R262 VanDerWaalsContact O-N 3.16Å; F260-R262 VanDerWaalsContact C-N 3.28Å; F260-R262 PolarHBondContact O-N 2.8Å; R262-S265 PolarHBondContact O-N 2.98Å; R262-G266 PolarHBondContact O-N 3.24Å
263	L	95	Very high	91.8	Very high	48 Å²	48	26.5 Å²	26.5	25%	0.251	16%	0.156	S	C	.	.	H	α-helix	trans	-59.6	-48.8	171.3	-177.9	64.1	0	0	0	110.4	I210 L213 L259 F260 G266 V267	I210-L263 HydrophobicContact CD1-CB 4.41Å; I210-L263 HydrophobicContact CD1-CD1 3.95Å; I210-L263 HydrophobicContact CG1-CB 3.94Å; I210-L263 HydrophobicContact CG1-CD1 4.07Å; L213-L263 HydrophobicContact CD2-CD1 4.45Å; L259-L263 PolarHBondContact O-N 3.34Å; F260-L263 PolarHBondContact O-N 3.47Å; L263-G266 PolarHBondContact O-N 2.91Å; L263-V267 WeakPolarHBondContact O-CG2 3.26Å; L263-V267 PolarHBondContact O-N 3.28Å
264	L	95.6	Very high	92.3	Very high	43 Å²	43	23.3 Å²	23.3	23%	0.225	14%	0.141	C	C	.	.	H	α-helix	trans	-71	-33.1	-179.5	-64.4	-178.3	0	0	0	113.3	F245 F260 C261 V267 G268	F245-L264 HydrophobicContact CB-CB 4.26Å; F245-L264 HydrophobicContact CD1-CB 4.09Å; F245-L264 HydrophobicContact CD1-CD1 4.05Å; F245-L264 HydrophobicContact CD2-CB 3.58Å; F245-L264 HydrophobicContact CD2-CD1 4.35Å; F245-L264 HydrophobicContact CE1-CB 4.38Å; F245-L264 HydrophobicContact CE1-CD1 3.6Å; F245-L264 HydrophobicContact CE2-CB 3.91Å; F245-L264 HydrophobicContact CE2-CD1 3.94Å; F245-L264 HydrophobicContact CG-CB 3.69Å; F245-L264 HydrophobicContact CG-CD1 4.42Å; F245-L264 HydrophobicContact CZ-CB 4.31Å; F245-L264 HydrophobicContact CZ-CD1 3.55Å; F260-L264 HydrophobicContact CD1-CD1 4.22Å; F260-L264 HydrophobicContact CE1-CD1 3.58Å; F260-L264 HydrophobicContact CE2-CD1 4.23Å; F260-L264 HydrophobicContact CZ-CD1 3.59Å; F260-L264 HydrophobicContact CZ-CG 4.36Å; F260-L264 PolarHBondContact O-N 3.3Å; F260-L264 VanDerWaalsContact O-N 3.13Å; C261-L264 PolarHBondContact O-N 3.07Å; L264-V267 PolarHBondContact O-N 2.9Å; L264-G268 PolarHBondContact O-N 3.08Å
265	S	94.5	Very high	92.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.1	-50.9	168.7	-153.9	0	0	0	0	110.4	E182 N242 C261 R262 V267 G268 I269	E182-S265 VanDerWaalsContact OE1-CB 3.22Å; E182-S265 WeakPolarHBondContact OE1-CB 3.44Å; E182-S265 PolarHBondContact OE1-OG 3.11Å; N242-S265 PolarHBondContact OD1-O 2.9Å; N242-S265 PolarHBondContact OD1-OG 3.31Å; C261-S265 WeakPolarHBondContact O-CB 3.44Å; C261-S265 PolarHBondContact O-N 3.23Å; R262-S265 PolarHBondContact O-N 2.98Å; S265-V267 PolarHBondContact O-N 2.98Å; S265-G268 WeakPolarHBondContact O-CA 3.41Å; S265-G268 PolarHBondContact O-N 3.03Å; S265-I269 PolarHBondContact O-N 3.34Å
266	G	94.1	Very high	93.1	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.2	-41.3	173.7	0	0	0	0	0	113.9	G214 M215 R262 L263 I269 G270	G214-G266 CarbonylContact C-O 3.44Å; M215-G266 WeakPolarHBondContact CA-O 3.47Å; M215-G266 PolarHBondContact N-O 3.3Å; R262-G266 PolarHBondContact O-N 3.24Å; L263-G266 PolarHBondContact O-N 2.91Å; G266-I269 PolarHBondContact O-N 3.08Å; G266-G270 PolarHBondContact O-N 3.13Å
267	V	96.1	Very high	93.3	Very high	25 Å²	25	17.2 Å²	17.2	15%	0.152	9%	0.09	C	C	.	.	H	α-helix	trans	-64.1	-40.1	174	171.6	0	0	0	0	111.3	G214 V217 G218 L221 W222 L263 L264 S265	G214-V267 WeakPolarHBondContact O-CA 3.26Å; G214-V267 WeakPolarHBondContact O-CG2 3.42Å; V217-V267 HydrophobicContact CB-CG2 4.24Å; V217-V267 HydrophobicContact CG1-CG2 4.27Å; G218-V267 WeakPolarHBondContact CA-O 3.46Å; L221-V267 HydrophobicContact CD1-CG1 4.5Å; W222-V267 PolarHBondContact NE1-O 3.1Å; L263-V267 WeakPolarHBondContact O-CG2 3.26Å; L263-V267 PolarHBondContact O-N 3.28Å; L264-V267 PolarHBondContact O-N 2.9Å; S265-V267 PolarHBondContact O-N 2.98Å
268	G	94.4	Very high	93.4	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-58.4	-54	172.8	0	0	0	0	0	111.6	S238 L264 S265	S238-G268 WeakPolarHBondContact CB-O 3.25Å; S238-G268 CarbonylContact O-C 3.57Å; S238-G268 WeakPolarHBondContact O-CA 3.41Å; S238-G268 PolarHBondContact OG-O 2.8Å; L264-G268 PolarHBondContact O-N 3.08Å; S265-G268 WeakPolarHBondContact O-CA 3.41Å; S265-G268 PolarHBondContact O-N 3.03Å
269	I	92.8	Very high	93.5	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-79.7	-27.1	-168.2	-151.8	58.6	0	0	0	114.8	D179 E182 M215 L239 N242 S265 G266 G271 S272	D179-I269 HydrophobicContact CB-CD1 4.22Å; D179-I269 HydrophobicContact CB-CG1 3.85Å; D179-I269 WeakPolarHBondContact OD1-CG1 3.37Å; E182-I269 HydrophobicContact CG-CG2 4.38Å; M215-I269 HydrophobicContact CE-CG2 4Å; M215-I269 HydrophobicContact CG-CG2 4.14Å; L239-I269 HydrophobicContact CD2-CD1 3.74Å; N242-I269 HydrophobicContact CB-CB 4.22Å; N242-I269 HydrophobicContact CB-CD1 4.19Å; N242-I269 WeakPolarHBondContact OD1-CB 3.49Å; S265-I269 PolarHBondContact O-N 3.34Å; G266-I269 PolarHBondContact O-N 3.08Å; I269-G271 PolarHBondContact O-N 3.34Å; I269-S272 WeakPolarHBondContact O-CB 3.47Å; I269-S272 PolarHBondContact O-N 3.46Å; I269-S272 PolarHBondContact O-OG 3.48Å
270	G	91.2	Very high	93.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.1	-177.1	0	0	0	0	0	115.3	A219 G266 N690	A219-G270 WeakPolarHBondContact CA-O 3.23Å; A219-G270 WeakPolarHBondContact CB-O 3.35Å; G266-G270 PolarHBondContact O-N 3.13Å; G270-N690 PolarHBondContact O-ND2 3.44Å
271	G	87.8	Confident	93.4	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-18.9	173.2	0	0	0	0	0	115.5	I269 I273 P274 I275	I269-G271 PolarHBondContact O-N 3.34Å; G271-I273 PolarHBondContact O-N 3.11Å; G271-P274 VanDerWaalsContact O-CD 3.31Å; G271-P274 WeakPolarHBondContact O-CD 3.47Å; G271-P274 WeakPolarHBondContact O-CG 3.45Å; G271-I275 WeakPolarHBondContact O-CD1 3.38Å; G271-I275 WeakPolarHBondContact O-CG1 3.43Å; G271-I275 PolarHBondContact O-N 2.7Å
272	S	92.6	Very high	93.2	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-61.6	-50.9	-167.3	65	0	0	0	0	112.9	D179 I269 I275 V276	D179-S272 WeakPolarHBondContact CB-OG 3.49Å; D179-S272 PolarHBondContact OD1-OG 2.99Å; I269-S272 WeakPolarHBondContact O-CB 3.47Å; I269-S272 PolarHBondContact O-N 3.46Å; I269-S272 PolarHBondContact O-OG 3.48Å; S272-I275 PolarHBondContact O-N 2.89Å; S272-V276 VanDerWaalsContact O-CB 3.29Å; S272-V276 WeakPolarHBondContact O-CB 3.16Å; S272-V276 WeakPolarHBondContact O-CG2 3.07Å; S272-V276 PolarHBondContact O-N 3.47Å
273	I	92.6	Very high	93.1	Very high	17 Å²	17	6.7 Å²	6.7	9%	0.087	4%	0.036	C	C	.	.	H	α-helix	trans	-54	-62.5	-178.3	-59.6	173.1	0	0	0	112.4	L176 G271 I275 V276 F277 F686	L176-I273 HydrophobicContact CD2-CB 4.48Å; L176-I273 HydrophobicContact CD2-CG1 3.92Å; G271-I273 PolarHBondContact O-N 3.11Å; I273-I275 VanDerWaalsContact C-N 3.25Å; I273-I275 PolarHBondContact O-N 3.13Å; I273-V276 PolarHBondContact O-N 3.04Å; I273-F277 HydrophobicContact CG2-CD2 3.97Å; I273-F277 HydrophobicContact CG2-CE2 3.99Å; I273-F277 VanDerWaalsContact O-CD2 3.3Å; I273-F277 WeakPolarHBondContact O-CD2 3.38Å; I273-F277 PolarHBondContact O-N 3.3Å; I273-F277 VanDerWaalsContact O-N 3.08Å; I273-F686 HydrophobicContact CG2-CE2 4.19Å; I273-F686 HydrophobicContact CG2-CZ 3.97Å
274	P	93.6	Very high	92.7	Very high	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-60.7	-35.4	-175.1	24.2	-35.6	0	0	0	112.6	G271 S278 T683 F686	G271-P274 VanDerWaalsContact O-CD 3.31Å; G271-P274 WeakPolarHBondContact O-CD 3.47Å; G271-P274 WeakPolarHBondContact O-CG 3.45Å; P274-S278 VanDerWaalsContact O-CB 3.28Å; P274-S278 WeakPolarHBondContact O-CB 3.36Å; P274-S278 PolarHBondContact O-N 2.72Å; P274-S278 VanDerWaalsContact O-N 3.15Å; P274-S278 PolarHBondContact O-OG 2.68Å; P274-T683 HydrophobicContact CB-CG2 4.23Å; P274-F686 HydrophobicContact CB-CB 3.73Å; P274-F686 HydrophobicContact CB-CD1 4.06Å; P274-F686 HydrophobicContact CB-CD2 3.97Å; P274-F686 HydrophobicContact CB-CG 3.65Å
275	I	94.6	Very high	92.1	Very high	0 Å²	0	4 Å²	4	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-70.1	-51.1	178.8	-59.8	171.8	0	0	0	111	W222 A226 R231 C234 L235 G271 S272 I273 F277 S278 Y279 T683	W222-I275 HydrophobicContact CB-CD1 4Å; A226-I275 HydrophobicContact CB-CD1 3.85Å; A226-I275 HydrophobicContact CB-CG1 3.62Å; A226-I275 HydrophobicContact CB-CG2 4.42Å; R231-I275 HydrophobicContact CB-CG2 4.26Å; R231-I275 WeakPolarHBondContact O-CG2 3.29Å; C234-I275 HydrophobicContact CB-CD1 3.87Å; L235-I275 HydrophobicContact CB-CG2 3.9Å; G271-I275 WeakPolarHBondContact O-CD1 3.38Å; G271-I275 WeakPolarHBondContact O-CG1 3.43Å; G271-I275 PolarHBondContact O-N 2.7Å; S272-I275 PolarHBondContact O-N 2.89Å; I273-I275 VanDerWaalsContact C-N 3.25Å; I273-I275 PolarHBondContact O-N 3.13Å; I275-F277 VanDerWaalsContact C-N 3.34Å; I275-F277 PolarHBondContact O-N 3.49Å; I275-S278 PolarHBondContact O-N 3.15Å; I275-Y279 WeakPolarHBondContact O-CB 3.32Å; I275-Y279 PolarHBondContact O-N 3.04Å; I275-T683 HydrophobicContact CB-CG2 4.34Å; I275-T683 HydrophobicContact CG1-CG2 3.78Å
276	V	95.4	Very high	91.2	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-57.5	-47.1	-178.5	164.4	0	0	0	0	111.3	L172 A175 L176 L235 S272 I273 F280 L296	L172-V276 HydrophobicContact CB-CG1 3.86Å; L172-V276 HydrophobicContact CD2-CG1 4.32Å; L172-V276 HydrophobicContact CD2-CG2 4.11Å; L172-V276 HydrophobicContact CG-CG1 4.46Å; A175-V276 HydrophobicContact CB-CG2 3.94Å; L176-V276 HydrophobicContact CD1-CB 4.47Å; L176-V276 HydrophobicContact CD1-CG1 3.53Å; L176-V276 HydrophobicContact CD2-CG1 4.42Å; L176-V276 HydrophobicContact CG-CB 4.32Å; L176-V276 HydrophobicContact CG-CG1 3.79Å; L176-V276 HydrophobicContact CG-CG2 4.47Å; L235-V276 HydrophobicContact CD1-CG2 3.81Å; L235-V276 HydrophobicContact CD2-CG2 3.65Å; L235-V276 HydrophobicContact CG-CG2 4.41Å; S272-V276 VanDerWaalsContact O-CB 3.29Å; S272-V276 WeakPolarHBondContact O-CB 3.16Å; S272-V276 WeakPolarHBondContact O-CG2 3.07Å; S272-V276 PolarHBondContact O-N 3.47Å; I273-V276 PolarHBondContact O-N 3.04Å; V276-F280 WeakPolarHBondContact O-CB 3.49Å; V276-F280 PolarHBondContact O-N 3.22Å; V276-L296 HydrophobicContact CG1-CD2 3.62Å
277	F	93.6	Very high	90.3	Very high	4 Å²	4	11.9 Å²	11.9	2%	0.018	6%	0.063	C	C	.	.	H	α-helix	trans	-66.5	-43.1	-179.9	-86.4	-103.9	0	0	0	112.2	L176 I273 I275 S281 L293 C297 D670 V674 F686	L176-F277 HydrophobicContact CD1-CD2 4.44Å; L176-F277 HydrophobicContact CD1-CE2 3.94Å; L176-F277 HydrophobicContact CD2-CE2 4.11Å; I273-F277 HydrophobicContact CG2-CD2 3.97Å; I273-F277 HydrophobicContact CG2-CE2 3.99Å; I273-F277 VanDerWaalsContact O-CD2 3.3Å; I273-F277 WeakPolarHBondContact O-CD2 3.38Å; I273-F277 PolarHBondContact O-N 3.3Å; I273-F277 VanDerWaalsContact O-N 3.08Å; I275-F277 VanDerWaalsContact C-N 3.34Å; I275-F277 PolarHBondContact O-N 3.49Å; F277-S281 VanDerWaalsContact O-CB 3.31Å; F277-S281 WeakPolarHBondContact O-CB 3.47Å; F277-S281 PolarHBondContact O-N 3.06Å; F277-L293 HydrophobicContact CD1-CD2 3.93Å; F277-C297 VanDerWaalsContact CZ-SG 3.54Å; F277-D670 HydrophobicContact CD1-CB 4.03Å; F277-D670 HydrophobicContact CE1-CB 3.51Å; F277-D670 HydrophobicContact CZ-CB 3.88Å; F277-V674 HydrophobicContact CB-CG2 3.74Å; F277-V674 HydrophobicContact CD1-CG2 4.28Å; F277-V674 HydrophobicContact CG-CG2 4.49Å; F277-F686 HydrophobicContact CB-CD1 4.45Å; F277-F686 HydrophobicContact CB-CE1 3.63Å; F277-F686 HydrophobicContact CB-CZ 4.4Å; F277-F686 HydrophobicContact CD1-CE1 4.49Å; F277-F686 HydrophobicContact CG-CE1 4.05Å; F277-F686 HydrophobicContact CG-CZ 4.39Å
278	S	92.4	Very high	89.5	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.3	-49.2	177.8	-56.8	0	0	0	0	110.9	P274 I275 F280 S281 E282	P274-S278 VanDerWaalsContact O-CB 3.28Å; P274-S278 WeakPolarHBondContact O-CB 3.36Å; P274-S278 PolarHBondContact O-N 2.72Å; P274-S278 VanDerWaalsContact O-N 3.15Å; P274-S278 PolarHBondContact O-OG 2.68Å; I275-S278 PolarHBondContact O-N 3.15Å; S278-F280 PolarHBondContact O-N 3.38Å; S278-S281 WeakPolarHBondContact O-CB 3.17Å; S278-S281 PolarHBondContact O-N 2.9Å; S278-S281 PolarHBondContact O-OG 3.21Å; S278-E282 WeakPolarHBondContact O-CG 3.42Å; S278-E282 PolarHBondContact O-N 3.37Å
279	Y	94.2	Very high	89	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-59	-47.1	177.7	-178.1	-128.1	0	0	0	112.6	L168 L172 R231 R232 I275 S281 E282 F283 P355	L168-Y279 HydrophobicContact CD1-CD1 4.45Å; L168-Y279 HydrophobicContact CD1-CE1 3.66Å; L172-Y279 HydrophobicContact CD1-CD1 3.58Å; L172-Y279 HydrophobicContact CD1-CE1 4.01Å; L172-Y279 HydrophobicContact CD2-CD1 3.57Å; L172-Y279 HydrophobicContact CD2-CE1 3.79Å; L172-Y279 HydrophobicContact CG-CD1 4.15Å; L172-Y279 HydrophobicContact CG-CE1 4.31Å; R231-Y279 HydrophobicContact CB-CD2 3.74Å; R231-Y279 HydrophobicContact CB-CG 4.08Å; R232-Y279 HydrophobicContact CB-CE2 4.14Å; I275-Y279 WeakPolarHBondContact O-CB 3.32Å; I275-Y279 PolarHBondContact O-N 3.04Å; Y279-S281 VanDerWaalsContact C-N 3.32Å; Y279-S281 PolarHBondContact O-N 3.4Å; Y279-E282 PolarHBondContact O-N 2.9Å; Y279-F283 HydrophobicContact CD2-CE2 4.01Å; Y279-F283 AromaticContact CE2-CE2 3.65Å; Y279-F283 HydrophobicContact CE2-CE2 3.65Å; Y279-F283 HydrophobicContact CE2-CZ 4.39Å; Y279-F283 WeakPolarHBondContact O-CD2 3.4Å; Y279-P355 PolarHBondContact OH-O 2.82Å
280	F	93.7	Very high	88.4	Confident	0 Å²	0	16 Å²	16	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.9	-35.8	177.6	-166.2	-138.1	0	0	0	112.2	L168 Y169 L172 V276 S278 E282 F283 L284 H292 L293 L296	L168-F280 HydrophobicContact CD2-CD2 3.94Å; L168-F280 HydrophobicContact CD2-CE2 4.45Å; L168-F280 HydrophobicContact CG-CD2 4.08Å; L168-F280 HydrophobicContact CG-CE2 4.46Å; Y169-F280 AromaticContact CD2-CE1 3.91Å; Y169-F280 HydrophobicContact CD2-CE1 3.91Å; Y169-F280 AromaticContact CD2-CZ 3.81Å; Y169-F280 HydrophobicContact CD2-CZ 3.81Å; Y169-F280 HydrophobicContact CG-CZ 4.24Å; L172-F280 HydrophobicContact CD1-CB 3.71Å; L172-F280 HydrophobicContact CD1-CD2 4.1Å; L172-F280 HydrophobicContact CD1-CG 4.16Å; V276-F280 WeakPolarHBondContact O-CB 3.49Å; V276-F280 PolarHBondContact O-N 3.22Å; S278-F280 PolarHBondContact O-N 3.38Å; F280-E282 PolarHBondContact O-N 2.63Å; F280-F283 PolarHBondContact O-N 3.14Å; F280-L284 HydrophobicContact CD1-CD1 3.61Å; F280-L284 HydrophobicContact CD2-CD1 4.35Å; F280-L284 HydrophobicContact CE1-CD1 3.62Å; F280-L284 HydrophobicContact CE1-CG 4.47Å; F280-L284 HydrophobicContact CE2-CD1 4.33Å; F280-L284 HydrophobicContact CE2-CG 4.41Å; F280-L284 HydrophobicContact CG-CD1 3.99Å; F280-L284 HydrophobicContact CZ-CD1 3.97Å; F280-L284 HydrophobicContact CZ-CD2 4.31Å; F280-L284 HydrophobicContact CZ-CG 4.35Å; F280-L284 WeakPolarHBondContact O-CD1 3.5Å; F280-L284 WeakPolarHBondContact O-CG 3.5Å; F280-H292 HydrophobicContact CE1-CB 4.02Å; F280-H292 HydrophobicContact CZ-CB 4.29Å; F280-L293 HydrophobicContact CB-CD2 4.24Å; F280-L293 HydrophobicContact CD1-CD2 3.85Å; F280-L293 HydrophobicContact CD1-CG 4.46Å; F280-L296 HydrophobicContact CB-CD2 4.32Å; F280-L296 HydrophobicContact CD1-CB 4.47Å; F280-L296 HydrophobicContact CD1-CD1 4.35Å; F280-L296 HydrophobicContact CD1-CD2 3.81Å; F280-L296 HydrophobicContact CD1-CG 4.44Å; F280-L296 HydrophobicContact CE1-CB 4.48Å; F280-L296 HydrophobicContact CE1-CD1 4.34Å; F280-L296 HydrophobicContact CE1-CD2 4.5Å; F280-L296 HydrophobicContact CG-CD2 4.33Å
281	S	90.8	Very high	88.2	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.007	9%	0.093	C	C	.	.	H	α-helix	trans	-63	-27.1	178.2	80.1	0	0	0	0	113.9	F277 S278 Y279 F283 L284 V674	F277-S281 VanDerWaalsContact O-CB 3.31Å; F277-S281 WeakPolarHBondContact O-CB 3.47Å; F277-S281 PolarHBondContact O-N 3.06Å; S278-S281 WeakPolarHBondContact O-CB 3.17Å; S278-S281 PolarHBondContact O-N 2.9Å; S278-S281 PolarHBondContact O-OG 3.21Å; Y279-S281 VanDerWaalsContact C-N 3.32Å; Y279-S281 PolarHBondContact O-N 3.4Å; S281-F283 VanDerWaalsContact C-N 3.35Å; S281-L284 PolarHBondContact O-N 2.82Å; S281-V674 WeakPolarHBondContact OG-CG1 3.37Å
282	E	89.9	Confident	88.2	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-78.3	-18.9	-176.9	-69.7	173.9	159.5	0	0	112.8	Y152 R231 S278 Y279 F280 S357 R359 S679 R682	Y152-E282 PolarHBondContact OH-O 2.68Å; R231-E282 IonicContact CZ-OE1 2.66Å; R231-E282 IonicContact CZ-OE2 3.81Å; R231-E282 IonicContact NE-OE1 2.61Å; R231-E282 PolarHBondContact NE-OE1 3.12Å; R231-E282 IonicContact NE-OE2 2.79Å; R231-E282 PolarHBondContact NE-OE2 3.46Å; R231-E282 IonicContact NH2-OE1 2.82Å; R231-E282 PolarHBondContact NH2-OE1 2.91Å; R231-E282 IonicContact NH2-OE2 3.95Å; S278-E282 WeakPolarHBondContact O-CG 3.42Å; S278-E282 PolarHBondContact O-N 3.37Å; Y279-E282 PolarHBondContact O-N 2.9Å; F280-E282 PolarHBondContact O-N 2.63Å; E282-S357 VanDerWaalsContact OE2-CB 3.23Å; E282-S357 WeakPolarHBondContact OE2-CB 3.44Å; E282-S357 PolarHBondContact OE2-OG 3.32Å; E282-R359 HydrophobicContact CB-CB 4.43Å; E282-R359 HydrophobicContact CB-CG 4.37Å; E282-R359 HydrophobicContact CG-CB 4.23Å; E282-R359 HydrophobicContact CG-CG 4.28Å; E282-S679 WeakPolarHBondContact OE1-CB 3.39Å; E282-R682 IonicContact OE1-NH1 3.9Å
283	F	89.9	Confident	88.1	Confident	1 Å²	1	19.7 Å²	19.7	0%	0.004	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	2.3	172.9	-67.2	-87.3	0	0	0	113.9	F164 L168 Y279 F280 S281 P355 P358 V373 V377	F164-F283 HydrophobicContact CD1-CD1 4.42Å; F164-F283 AromaticContact CE1-CD1 3.61Å; F164-F283 HydrophobicContact CE1-CD1 3.61Å; F164-F283 AromaticContact CE1-CE1 3.75Å; F164-F283 HydrophobicContact CE1-CE1 3.75Å; F164-F283 HydrophobicContact CE1-CG 4.18Å; F164-F283 HydrophobicContact CE1-CZ 4.44Å; F164-F283 HydrophobicContact CZ-CD1 4.32Å; F164-F283 AromaticContact CZ-CE1 3.98Å; F164-F283 HydrophobicContact CZ-CE1 3.98Å; F164-F283 HydrophobicContact CZ-CZ 4.48Å; L168-F283 HydrophobicContact CD2-CB 3.91Å; L168-F283 HydrophobicContact CD2-CD2 3.46Å; L168-F283 VanDerWaalsContact CD2-CD2 3.46Å; L168-F283 HydrophobicContact CD2-CE2 4.06Å; L168-F283 HydrophobicContact CD2-CG 3.74Å; Y279-F283 HydrophobicContact CD2-CE2 4.01Å; Y279-F283 AromaticContact CE2-CE2 3.65Å; Y279-F283 HydrophobicContact CE2-CE2 3.65Å; Y279-F283 HydrophobicContact CE2-CZ 4.39Å; Y279-F283 WeakPolarHBondContact O-CD2 3.4Å; F280-F283 PolarHBondContact O-N 3.14Å; S281-F283 VanDerWaalsContact C-N 3.35Å; F283-P355 HydrophobicContact CZ-CG 4.38Å; F283-P358 HydrophobicContact CE1-CG 4.04Å; F283-P358 HydrophobicContact CZ-CG 4.37Å; F283-V373 HydrophobicContact CE1-CG1 3.98Å; F283-V373 HydrophobicContact CZ-CG1 4.33Å; F283-V377 HydrophobicContact CD1-CG2 4.02Å; F283-V377 HydrophobicContact CE1-CG2 3.98Å
284	L	88.1	Confident	88	Confident	3 Å²	3	18.9 Å²	18.9	2%	0.016	9%	0.092	C	C	.	.	S	Bend	trans	-108.2	117.3	-175.3	-80	169.9	0	0	0	112.2	F280 S281 R289 H292 L293	F280-L284 HydrophobicContact CD1-CD1 3.61Å; F280-L284 HydrophobicContact CD2-CD1 4.35Å; F280-L284 HydrophobicContact CE1-CD1 3.62Å; F280-L284 HydrophobicContact CE1-CG 4.47Å; F280-L284 HydrophobicContact CE2-CD1 4.33Å; F280-L284 HydrophobicContact CE2-CG 4.41Å; F280-L284 HydrophobicContact CG-CD1 3.99Å; F280-L284 HydrophobicContact CZ-CD1 3.97Å; F280-L284 HydrophobicContact CZ-CD2 4.31Å; F280-L284 HydrophobicContact CZ-CG 4.35Å; F280-L284 WeakPolarHBondContact O-CD1 3.5Å; F280-L284 WeakPolarHBondContact O-CG 3.5Å; S281-L284 PolarHBondContact O-N 2.82Å; L284-R289 HydrophobicContact CB-CB 4.12Å; L284-R289 HydrophobicContact CB-CG 4.11Å; L284-R289 HydrophobicContact CD1-CG 4.35Å; L284-H292 HydrophobicContact CD1-CB 3.93Å; L284-H292 HydrophobicContact CD2-CB 3.81Å; L284-L293 HydrophobicContact CD1-CG 4.15Å
285	A	82.8	Confident	87.9	Confident	31 Å²	31	21.5 Å²	21.5	26%	0.256	10%	0.102	S	C	.	.			trans	-59.6	144.3	170	0	0	0	0	0	111.7	L156 E287 K288 R289	L156-A285 HydrophobicContact CB-CB 4.41Å; A285-E287 VanDerWaalsContact C-N 3.25Å; A285-E287 PolarHBondContact O-N 3.31Å; A285-K288 PolarHBondContact O-N 3.15Å; A285-R289 PolarHBondContact O-N 2.79Å
286	Q	75.6	Confident	87.8	Confident	26 Å²	26	21.5 Å²	21.5	12%	0.121	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.8	-40.2	-172	-178.8	-173.6	40.2	0	0	115.7	E153 K288 G738 Q739 V740	E153-Q286 VanDerWaalsContact CD-CB 3.47Å; E153-Q286 HydrophobicContact CG-CB 4.47Å; E153-Q286 WeakPolarHBondContact OE1-CB 3.47Å; E153-Q286 PolarHBondContact OE1-N 2.86Å; E153-Q286 VanDerWaalsContact OE1-N 3.1Å; E153-Q286 WeakPolarHBondContact OE2-CB 3.33Å; E153-Q286 PolarHBondContact OE2-N 3.3Å; E153-Q286 VanDerWaalsContact OE2-N 3.12Å; Q286-K288 PolarHBondContact O-N 2.94Å; Q286-G738 PolarHBondContact NE2-O 3.41Å; Q286-Q739 PolarHBondContact NE2-O 3.48Å; Q286-V740 VanDerWaalsContact NE2-N 3.18Å
287	E	74.8	Confident	87.5	Confident	139 Å²	139	21.9 Å²	21.9	65%	0.65	10%	0.104	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-32	-170	-63.6	-177.2	175.4	0	0	114.3	R157 A285	R157-E287 IonicContact NH1-OE1 2.77Å; A285-E287 VanDerWaalsContact C-N 3.25Å; A285-E287 PolarHBondContact O-N 3.31Å
288	K	78.3	Confident	87.4	Confident	108 Å²	108	23.4 Å²	23.4	47%	0.47	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.3	2.1	-175	-59.3	-169.9	176.4	-170.3	0	114	A285 Q286 G290 H292	A285-K288 PolarHBondContact O-N 3.15Å; Q286-K288 PolarHBondContact O-N 2.94Å; K288-G290 VanDerWaalsContact C-N 3.27Å; K288-G290 PolarHBondContact O-N 3.48Å; K288-H292 PolarHBondContact O-CD2 3.41Å; K288-H292 VanDerWaalsContact O-CD2 3.31Å; K288-H292 PolarHBondContact O-N 3.39Å
289	R	84.9	Confident	87.5	Confident	3 Å²	3	24.4 Å²	24.4	1%	0.011	12%	0.116	C	C	.	.	H	α-helix	trans	-58.4	-38.3	-176.6	-178.9	175.1	63.1	-129.7	3.8	112.6	L284 A285 L293 E675 Q739	L284-R289 HydrophobicContact CB-CB 4.12Å; L284-R289 HydrophobicContact CB-CG 4.11Å; L284-R289 HydrophobicContact CD1-CG 4.35Å; A285-R289 PolarHBondContact O-N 2.79Å; R289-L293 HydrophobicContact CG-CD1 3.65Å; R289-L293 HydrophobicContact CG-CG 4.42Å; R289-L293 WeakPolarHBondContact O-CB 3.39Å; R289-L293 WeakPolarHBondContact O-CD1 3.38Å; R289-L293 VanDerWaalsContact O-CG 3.3Å; R289-L293 WeakPolarHBondContact O-CG 3.32Å; R289-L293 PolarHBondContact O-N 3.1Å; R289-E675 IonicContact CZ-OE1 2.76Å; R289-E675 VanDerWaalsContact CZ-OE1 3.22Å; R289-E675 IonicContact NE-OE1 2.67Å; R289-E675 PolarHBondContact NE-OE1 3.46Å; R289-E675 IonicContact NH2-OE1 2.69Å; R289-E675 PolarHBondContact NH2-OE1 3.22Å; R289-Q739 PolarHBondContact NH2-O 3.38Å
290	G	80.8	Confident	87.4	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-67.8	-54.1	-179	0	0	0	0	0	112.7	K288 H292 S294 D620	K288-G290 VanDerWaalsContact C-N 3.27Å; K288-G290 PolarHBondContact O-N 3.48Å; G290-H292 PolarHBondContact O-N 3.04Å; G290-S294 WeakPolarHBondContact O-CB 3.32Å; G290-S294 PolarHBondContact O-N 3.32Å; G290-D620 WeakPolarHBondContact CA-OD1 3.35Å
291	E	85.1	Confident	87.3	Confident	66 Å²	66	25.9 Å²	25.9	31%	0.308	12%	0.122	S	C	.	.	H	α-helix	trans	-54	-51.8	173.5	171.1	167.3	-157.6	0	0	111.5	L293 S294 W295 D620	E291-L293 PolarHBondContact O-N 3.08Å; E291-S294 PolarHBondContact O-N 3.3Å; E291-W295 VanDerWaalsContact CG-CD1 3.4Å; E291-W295 PolarHBondContact O-N 2.88Å; E291-W295 PolarHBondContact OE1-NE1 3.38Å; E291-D620 WeakPolarHBondContact CB-OD2 3.36Å; E291-D620 PolarHBondContact N-OD2 3.26Å
292	H	89.7	Confident	87.3	Confident	12 Å²	12	28.8 Å²	28.8	6%	0.056	14%	0.137	C	C	.	.	H	α-helix	trans	-67.4	-38.3	-174.9	-76.2	-53.8	0	0	0	114	H161 F280 L284 K288 G290 L296	H161-H292 AromaticContact CE1-CD2 3.17Å; H161-H292 PolarHBondContact CE1-CD2 3.01Å; H161-H292 AromaticContact CE1-CE1 3.4Å; H161-H292 PolarHBondContact CE1-CE1 3.12Å; H161-H292 VanDerWaalsContact CE1-CE1 3.4Å; H161-H292 AromaticContact CE1-CG 3.54Å; H161-H292 AromaticContact CE1-ND1 3.65Å; H161-H292 AromaticContact CE1-NE2 3.09Å; H161-H292 PolarHBondContact CE1-NE2 3.42Å; H161-H292 AromaticContact ND1-NE2 3.79Å; H161-H292 AromaticContact NE2-CE1 3.7Å; H161-H292 AromaticContact NE2-NE2 3.87Å; F280-H292 HydrophobicContact CE1-CB 4.02Å; F280-H292 HydrophobicContact CZ-CB 4.29Å; L284-H292 HydrophobicContact CD1-CB 3.93Å; L284-H292 HydrophobicContact CD2-CB 3.81Å; K288-H292 PolarHBondContact O-CD2 3.41Å; K288-H292 VanDerWaalsContact O-CD2 3.31Å; K288-H292 PolarHBondContact O-N 3.39Å; G290-H292 PolarHBondContact O-N 3.04Å; H292-L296 PolarHBondContact O-N 3.21Å; H292-L296 VanDerWaalsContact O-N 3.13Å
293	L	90.5	Very high	87.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.5	-36.8	173.2	-71.9	164.6	0	0	0	111.7	F277 F280 L284 R289 E291 L296 C297 V671 V674	F277-L293 HydrophobicContact CD1-CD2 3.93Å; F280-L293 HydrophobicContact CB-CD2 4.24Å; F280-L293 HydrophobicContact CD1-CD2 3.85Å; F280-L293 HydrophobicContact CD1-CG 4.46Å; L284-L293 HydrophobicContact CD1-CG 4.15Å; R289-L293 HydrophobicContact CG-CD1 3.65Å; R289-L293 HydrophobicContact CG-CG 4.42Å; R289-L293 WeakPolarHBondContact O-CB 3.39Å; R289-L293 WeakPolarHBondContact O-CD1 3.38Å; R289-L293 VanDerWaalsContact O-CG 3.3Å; R289-L293 WeakPolarHBondContact O-CG 3.32Å; R289-L293 PolarHBondContact O-N 3.1Å; E291-L293 PolarHBondContact O-N 3.08Å; L293-L296 VanDerWaalsContact O-CB 3.24Å; L293-L296 WeakPolarHBondContact O-CB 3.16Å; L293-L296 PolarHBondContact O-N 3.25Å; L293-L296 VanDerWaalsContact O-N 3.11Å; L293-C297 PolarHBondContact O-N 3.27Å; L293-C297 PolarHBondContact O-SG 3.49Å; L293-C297 VanDerWaalsContact O-SG 3.38Å; L293-V671 HydrophobicContact CB-CG2 3.53Å; L293-V671 HydrophobicContact CD1-CG1 4.05Å; L293-V671 HydrophobicContact CD1-CG2 4.16Å; L293-V671 HydrophobicContact CG-CG2 4.49Å; L293-V674 HydrophobicContact CD1-CG1 4.36Å
294	S	89	Confident	87.5	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.1	-37.4	176.9	-164.6	0	0	0	0	112.8	G290 E291 L296 C297 S615 A616	G290-S294 WeakPolarHBondContact O-CB 3.32Å; G290-S294 PolarHBondContact O-N 3.32Å; E291-S294 PolarHBondContact O-N 3.3Å; S294-L296 VanDerWaalsContact C-N 3.26Å; S294-L296 PolarHBondContact O-N 2.88Å; S294-C297 WeakPolarHBondContact O-CB 3.5Å; S294-C297 PolarHBondContact O-N 2.94Å; S294-S615 PolarHBondContact OG-OG 3.04Å; S294-A616 WeakPolarHBondContact OG-CA 3.42Å; S294-A616 PolarHBondContact OG-N 3.37Å
295	W	91.6	Very high	87.6	Confident	55 Å²	55	30 Å²	30	21%	0.208	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-34.4	168.4	-81.5	117.1	0	0	0	112.2	Y169 E291 C297 M298 I613 A616 L617	Y169-W295 HydrophobicContact CE2-CB 3.86Å; Y169-W295 PolarHBondContact OH-O 2.89Å; E291-W295 VanDerWaalsContact CG-CD1 3.4Å; E291-W295 PolarHBondContact O-N 2.88Å; E291-W295 PolarHBondContact OE1-NE1 3.38Å; W295-C297 VanDerWaalsContact C-N 3.34Å; W295-C297 PolarHBondContact O-N 2.8Å; W295-M298 HydrophobicContact CE3-CE 3.99Å; W295-M298 HydrophobicContact CE3-SD 4.21Å; W295-M298 HydrophobicContact CZ3-CE 4.15Å; W295-M298 HydrophobicContact CZ3-SD 4.05Å; W295-M298 WeakPolarHBondContact O-CB 3.42Å; W295-M298 PolarHBondContact O-N 3.33Å; W295-M298 VanDerWaalsContact O-N 3.13Å; W295-I613 HydrophobicContact CH2-CG2 4.23Å; W295-I613 HydrophobicContact CZ3-CG1 4.23Å; W295-A616 HydrophobicContact CD2-CB 3.84Å; W295-A616 HydrophobicContact CE3-CB 4.4Å; W295-A616 HydrophobicContact CG-CB 3.95Å; W295-A616 HydrophobicContact CZ2-CB 4.39Å; W295-L617 HydrophobicContact CZ2-CD2 4.06Å; W295-L617 HydrophobicContact CZ2-CG 4.31Å
296	L	92.4	Very high	88	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-65.3	-36	179.6	-162.9	76.9	0	0	0	112	Y169 L172 L176 V276 F280 H292 L293 S294 M298 F299	Y169-L296 HydrophobicContact CD2-CB 4.46Å; Y169-L296 HydrophobicContact CD2-CD1 3.62Å; Y169-L296 HydrophobicContact CE2-CB 4.24Å; Y169-L296 HydrophobicContact CE2-CD1 3.97Å; Y169-L296 HydrophobicContact CG-CD1 4.33Å; Y169-L296 WeakPolarHBondContact O-CD1 3.44Å; L172-L296 HydrophobicContact CB-CD1 4.26Å; L176-L296 HydrophobicContact CD1-CD2 3.68Å; L176-L296 HydrophobicContact CD1-CG 3.66Å; V276-L296 HydrophobicContact CG1-CD2 3.62Å; F280-L296 HydrophobicContact CB-CD2 4.32Å; F280-L296 HydrophobicContact CD1-CB 4.47Å; F280-L296 HydrophobicContact CD1-CD1 4.35Å; F280-L296 HydrophobicContact CD1-CD2 3.81Å; F280-L296 HydrophobicContact CD1-CG 4.44Å; F280-L296 HydrophobicContact CE1-CB 4.48Å; F280-L296 HydrophobicContact CE1-CD1 4.34Å; F280-L296 HydrophobicContact CE1-CD2 4.5Å; F280-L296 HydrophobicContact CG-CD2 4.33Å; H292-L296 PolarHBondContact O-N 3.21Å; H292-L296 VanDerWaalsContact O-N 3.13Å; L293-L296 VanDerWaalsContact O-CB 3.24Å; L293-L296 WeakPolarHBondContact O-CB 3.16Å; L293-L296 PolarHBondContact O-N 3.25Å; L293-L296 VanDerWaalsContact O-N 3.11Å; S294-L296 VanDerWaalsContact C-N 3.26Å; S294-L296 PolarHBondContact O-N 2.88Å; L296-M298 PolarHBondContact O-N 2.82Å; L296-F299 HydrophobicContact CD1-CD2 4.34Å; L296-F299 PolarHBondContact O-N 3.39Å; L296-F299 VanDerWaalsContact O-N 3.14Å
297	C	89.9	Confident	88.8	Confident	8 Å²	8	30 Å²	30	5%	0.054	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-27.3	172.6	-54.9	0	0	0	0	113.2	F277 L293 S294 W295 F299 W300 N667	F277-C297 VanDerWaalsContact CZ-SG 3.54Å; L293-C297 PolarHBondContact O-N 3.27Å; L293-C297 PolarHBondContact O-SG 3.49Å; L293-C297 VanDerWaalsContact O-SG 3.38Å; S294-C297 WeakPolarHBondContact O-CB 3.5Å; S294-C297 PolarHBondContact O-N 2.94Å; W295-C297 VanDerWaalsContact C-N 3.34Å; W295-C297 PolarHBondContact O-N 2.8Å; C297-F299 PolarHBondContact O-N 3.16Å; C297-W300 WeakPolarHBondContact O-CB 3.22Å; C297-W300 PolarHBondContact O-N 2.87Å; C297-N667 HydrophobicContact CB-CB 4.32Å; C297-N667 VanDerWaalsContact CB-CG 3.45Å; C297-N667 WeakPolarHBondContact CB-OD1 3.46Å; C297-N667 VanDerWaalsContact SG-CG 3.5Å; C297-N667 PolarHBondContact SG-OD1 3.08Å
298	M	91.6	Very high	89.3	Confident	37 Å²	37	23.5 Å²	23.5	18%	0.182	11%	0.107	C	C	.	.	H	α-helix	trans	-60.9	-32	-179.9	-169.4	174.9	60.1	0	0	112.9	W295 L296 W300 M301 I302 L609 I613	W295-M298 HydrophobicContact CE3-CE 3.99Å; W295-M298 HydrophobicContact CE3-SD 4.21Å; W295-M298 HydrophobicContact CZ3-CE 4.15Å; W295-M298 HydrophobicContact CZ3-SD 4.05Å; W295-M298 WeakPolarHBondContact O-CB 3.42Å; W295-M298 PolarHBondContact O-N 3.33Å; W295-M298 VanDerWaalsContact O-N 3.13Å; L296-M298 PolarHBondContact O-N 2.82Å; M298-W300 VanDerWaalsContact C-N 3.31Å; M298-W300 PolarHBondContact O-N 3.38Å; M298-M301 PolarHBondContact O-N 3.43Å; M298-I302 HydrophobicContact CE-CD1 4.36Å; M298-I302 HydrophobicContact CG-CD1 4.14Å; M298-I302 WeakPolarHBondContact O-CG1 3.29Å; M298-I302 PolarHBondContact O-N 3.13Å; M298-L609 HydrophobicContact CG-CD2 3.91Å; M298-I613 HydrophobicContact SD-CG1 4.38Å
299	F	93.8	Very high	89.7	Confident	21 Å²	21	20 Å²	20	9%	0.092	10%	0.099	C	C	.	.	H	α-helix	trans	-65.7	-31.5	-179.8	-76.8	-79.2	0	0	0	113.8	Y169 F170 G173 L176 M177 L296 C297 M301 I302 G303	Y169-F299 HydrophobicContact CD1-CE2 4.12Å; Y169-F299 HydrophobicContact CD1-CZ 4.46Å; Y169-F299 AromaticContact CE1-CE2 3.53Å; Y169-F299 HydrophobicContact CE1-CE2 3.53Å; Y169-F299 AromaticContact CE1-CZ 3.9Å; Y169-F299 HydrophobicContact CE1-CZ 3.9Å; Y169-F299 HydrophobicContact CE2-CE2 4.09Å; Y169-F299 AromaticContact CZ-CE2 3.51Å; F170-F299 HydrophobicContact CD1-CE1 4.38Å; F170-F299 AromaticContact CD1-CZ 3.73Å; F170-F299 HydrophobicContact CD1-CZ 3.73Å; F170-F299 HydrophobicContact CE1-CZ 4.07Å; G173-F299 VanDerWaalsContact O-CB 3.24Å; G173-F299 WeakPolarHBondContact O-CB 3.48Å; L176-F299 HydrophobicContact CB-CB 4.35Å; M177-F299 WeakPolarHBondContact CA-O 3.33Å; L296-F299 HydrophobicContact CD1-CD2 4.34Å; L296-F299 PolarHBondContact O-N 3.39Å; L296-F299 VanDerWaalsContact O-N 3.14Å; C297-F299 PolarHBondContact O-N 3.16Å; F299-M301 VanDerWaalsContact C-N 3.31Å; F299-M301 PolarHBondContact O-N 3Å; F299-I302 HydrophobicContact CD1-CD1 4.23Å; F299-I302 WeakPolarHBondContact O-CB 3.21Å; F299-I302 PolarHBondContact O-N 2.94Å; F299-G303 PolarHBondContact O-N 2.91Å
300	W	92.9	Very high	89.8	Confident	29 Å²	29	22.2 Å²	22.2	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-43.9	175.5	-168.8	83.6	0	0	0	111.2	D179 V183 F184 C297 M298 G303 G304	D179-W300 VanDerWaalsContact OD2-CD1 3.31Å; D179-W300 PolarHBondContact OD2-NE1 3.15Å; V183-W300 HydrophobicContact CB-CZ2 4.35Å; V183-W300 HydrophobicContact CG1-CZ2 4.17Å; F184-W300 HydrophobicContact CE2-CE3 4.25Å; F184-W300 AromaticContact CE2-CH2 3.57Å; F184-W300 HydrophobicContact CE2-CH2 3.57Å; F184-W300 HydrophobicContact CE2-CZ2 4.13Å; F184-W300 AromaticContact CE2-CZ3 3.65Å; F184-W300 HydrophobicContact CE2-CZ3 3.65Å; F184-W300 AromaticContact CZ-CH2 3.77Å; F184-W300 HydrophobicContact CZ-CH2 3.77Å; F184-W300 AromaticContact CZ-CZ3 3.86Å; F184-W300 HydrophobicContact CZ-CZ3 3.86Å; C297-W300 WeakPolarHBondContact O-CB 3.22Å; C297-W300 PolarHBondContact O-N 2.87Å; M298-W300 VanDerWaalsContact C-N 3.31Å; M298-W300 PolarHBondContact O-N 3.38Å; W300-G303 WeakPolarHBondContact O-CA 3.4Å; W300-G303 PolarHBondContact O-N 3.33Å; W300-G303 VanDerWaalsContact O-N 3.17Å; W300-G304 PolarHBondContact O-N 2.97Å; W300-G304 VanDerWaalsContact O-N 3.15Å
301	M	90.7	Very high	89.9	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.005	11%	0.11	C	C	.	.	H	α-helix	trans	-69.8	-33.7	174.2	-68.6	-52.8	-41.8	0	0	113.3	F184 M298 F299 G303 G304 V305 T605 V608 L609 N612	F184-M301 HydrophobicContact CZ-CE 4.4Å; M298-M301 PolarHBondContact O-N 3.43Å; F299-M301 VanDerWaalsContact C-N 3.31Å; F299-M301 PolarHBondContact O-N 3Å; M301-G303 PolarHBondContact O-N 2.98Å; M301-G304 PolarHBondContact O-N 3.06Å; M301-V305 WeakPolarHBondContact O-CG2 3.31Å; M301-V305 PolarHBondContact O-N 3.37Å; M301-T605 HydrophobicContact CE-CG2 4.08Å; M301-T605 WeakPolarHBondContact CE-O 3.43Å; M301-V608 HydrophobicContact CE-CB 3.79Å; M301-V608 HydrophobicContact CE-CG1 4.02Å; M301-V608 HydrophobicContact CE-CG2 4.3Å; M301-V608 HydrophobicContact CG-CB 4.44Å; M301-V608 HydrophobicContact CG-CG1 3.83Å; M301-V608 HydrophobicContact SD-CB 4.04Å; M301-V608 HydrophobicContact SD-CG1 3.56Å; M301-V608 VanDerWaalsContact SD-CG1 3.56Å; M301-L609 HydrophobicContact CB-CD2 3.58Å; M301-L609 HydrophobicContact CB-CG 4.21Å; M301-N612 VanDerWaalsContact CG-ND2 3.29Å; M301-N612 WeakPolarHBondContact CG-ND2 3.26Å
302	I	92.3	Very high	89.6	Confident	62 Å²	62	25.3 Å²	25.3	32%	0.318	12%	0.119	S	C	.	.	H	α-helix	trans	-62.2	-34.6	170.7	-67.3	167.1	0	0	0	110.4	M177 M298 F299 V305 Y306	M177-I302 HydrophobicContact CE-CG2 4.49Å; M177-I302 HydrophobicContact SD-CG2 4.39Å; M298-I302 HydrophobicContact CE-CD1 4.36Å; M298-I302 HydrophobicContact CG-CD1 4.14Å; M298-I302 WeakPolarHBondContact O-CG1 3.29Å; M298-I302 PolarHBondContact O-N 3.13Å; F299-I302 HydrophobicContact CD1-CD1 4.23Å; F299-I302 WeakPolarHBondContact O-CB 3.21Å; F299-I302 PolarHBondContact O-N 2.94Å; I302-V305 PolarHBondContact O-N 3.3Å; I302-Y306 VanDerWaalsContact O-CB 3.32Å; I302-Y306 WeakPolarHBondContact O-CB 3.49Å; I302-Y306 PolarHBondContact O-N 3.49Å
303	G	92.9	Very high	89.1	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-47.8	170	0	0	0	0	0	112.7	M177 V181 F299 W300 M301 V305 Y306 A307	M177-G303 WeakPolarHBondContact O-CA 3.44Å; V181-G303 VanDerWaalsContact CG2-O 3.28Å; V181-G303 WeakPolarHBondContact CG2-O 3.48Å; F299-G303 PolarHBondContact O-N 2.91Å; W300-G303 WeakPolarHBondContact O-CA 3.4Å; W300-G303 PolarHBondContact O-N 3.33Å; W300-G303 VanDerWaalsContact O-N 3.17Å; M301-G303 PolarHBondContact O-N 2.98Å; G303-V305 PolarHBondContact O-N 3.42Å; G303-Y306 PolarHBondContact O-N 2.89Å; G303-A307 WeakPolarHBondContact O-CB 3.43Å; G303-A307 PolarHBondContact O-N 3.18Å
304	G	89.7	Confident	88.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.4	-43.4	174.2	0	0	0	0	0	113.9	W300 M301 A307 A308	W300-G304 PolarHBondContact O-N 2.97Å; W300-G304 VanDerWaalsContact O-N 3.15Å; M301-G304 PolarHBondContact O-N 3.06Å; G304-A307 PolarHBondContact O-N 3.22Å; G304-A308 WeakPolarHBondContact O-CB 3.16Å; G304-A308 PolarHBondContact O-N 3.45Å
305	V	90.4	Very high	88	Confident	33 Å²	33	28.3 Å²	28.3	20%	0.2	14%	0.14	C	C	.	.	H	α-helix	trans	-65.5	-38.2	176	171.3	0	0	0	0	111.6	M301 I302 G303 A309 F602 L609	M301-V305 WeakPolarHBondContact O-CG2 3.31Å; M301-V305 PolarHBondContact O-N 3.37Å; I302-V305 PolarHBondContact O-N 3.3Å; G303-V305 PolarHBondContact O-N 3.42Å; V305-A309 VanDerWaalsContact O-CB 3.28Å; V305-A309 WeakPolarHBondContact O-CB 3.2Å; V305-A309 PolarHBondContact O-N 3.49Å; V305-F602 HydrophobicContact CG1-CE2 4.14Å; V305-L609 HydrophobicContact CG2-CD1 4.11Å
306	Y	92.1	Very high	86.8	Confident	55 Å²	55	28.3 Å²	28.3	22%	0.216	15%	0.147	C	C	.	.	H	α-helix	trans	-64.8	-46.8	173.4	173.4	-92.2	0	0	0	111.8	M177 V181 I302 G303 A308 A309 M310 V339 P343	M177-Y306 HydrophobicContact CE-CD1 4.01Å; M177-Y306 HydrophobicContact CE-CD2 3.74Å; M177-Y306 HydrophobicContact CE-CE2 4.42Å; M177-Y306 HydrophobicContact CE-CG 3.5Å; M177-Y306 VanDerWaalsContact CE-CG 3.5Å; V181-Y306 HydrophobicContact CG2-CD1 3.65Å; V181-Y306 HydrophobicContact CG2-CE1 4.34Å; I302-Y306 VanDerWaalsContact O-CB 3.32Å; I302-Y306 WeakPolarHBondContact O-CB 3.49Å; I302-Y306 PolarHBondContact O-N 3.49Å; G303-Y306 PolarHBondContact O-N 2.89Å; Y306-A308 VanDerWaalsContact C-N 3.34Å; Y306-A308 PolarHBondContact O-N 3.32Å; Y306-A309 PolarHBondContact O-N 2.88Å; Y306-M310 HydrophobicContact CD1-CG 4.19Å; Y306-M310 HydrophobicContact CD2-CG 4.17Å; Y306-M310 HydrophobicContact CE1-CG 3.86Å; Y306-M310 HydrophobicContact CE2-CG 3.83Å; Y306-M310 HydrophobicContact CE2-SD 4.17Å; Y306-M310 HydrophobicContact CG-CG 4.35Å; Y306-M310 WeakPolarHBondContact O-CB 3.33Å; Y306-M310 WeakPolarHBondContact O-CG 3.38Å; Y306-M310 PolarHBondContact O-N 3.02Å; Y306-V339 WeakPolarHBondContact OH-CG1 3.45Å; Y306-V339 PolarHBondContact OH-O 2.9Å; Y306-P343 HydrophobicContact CD1-CG 4.25Å; Y306-P343 HydrophobicContact CE1-CG 3.74Å
307	A	90.6	Very high	85.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.9	-45.2	176.1	0	0	0	0	0	111.3	V181 F184 F188 G303 G304 M310 A311 F336	V181-A307 HydrophobicContact CG1-CB 4.49Å; V181-A307 HydrophobicContact CG2-CB 4.49Å; F184-A307 HydrophobicContact CB-CB 4.07Å; F188-A307 HydrophobicContact CD2-CB 4.27Å; F188-A307 HydrophobicContact CE2-CB 4.23Å; G303-A307 WeakPolarHBondContact O-CB 3.43Å; G303-A307 PolarHBondContact O-N 3.18Å; G304-A307 PolarHBondContact O-N 3.22Å; A307-M310 PolarHBondContact O-N 2.71Å; A307-A311 VanDerWaalsContact O-CB 3.27Å; A307-A311 WeakPolarHBondContact O-CB 3.33Å; A307-A311 PolarHBondContact O-N 3.15Å; A307-F336 VanDerWaalsContact O-CE2 3.22Å; A307-F336 WeakPolarHBondContact O-CE2 3.44Å
308	A	85.9	Confident	83.7	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.025	20%	0.195	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.9	0	0	0	0	0	112.8	F188 G304 Y306 A311 W312 F602	F188-A308 HydrophobicContact CE1-CB 4.16Å; F188-A308 HydrophobicContact CE2-CB 3.98Å; F188-A308 HydrophobicContact CZ-CB 3.47Å; F188-A308 VanDerWaalsContact CZ-CB 3.47Å; G304-A308 WeakPolarHBondContact O-CB 3.16Å; G304-A308 PolarHBondContact O-N 3.45Å; Y306-A308 VanDerWaalsContact C-N 3.34Å; Y306-A308 PolarHBondContact O-N 3.32Å; A308-A311 PolarHBondContact O-N 3.25Å; A308-W312 WeakPolarHBondContact O-CB 3.36Å; A308-W312 PolarHBondContact O-N 2.92Å; A308-F602 HydrophobicContact CB-CB 4.12Å; A308-F602 HydrophobicContact CB-CD2 3.86Å
309	A	86.1	Confident	81.9	Confident	35 Å²	35	41.4 Å²	41.4	29%	0.289	22%	0.222	S	C	.	.	H	α-helix	trans	-67.5	-38.9	178.3	0	0	0	0	0	112.8	V305 Y306 A313	V305-A309 VanDerWaalsContact O-CB 3.28Å; V305-A309 WeakPolarHBondContact O-CB 3.2Å; V305-A309 PolarHBondContact O-N 3.49Å; Y306-A309 PolarHBondContact O-N 2.88Å; A309-A313 VanDerWaalsContact O-CB 3.29Å; A309-A313 WeakPolarHBondContact O-CB 3.28Å; A309-A313 PolarHBondContact O-N 3.04Å
310	M	86.9	Confident	80.1	Confident	50 Å²	50	46.9 Å²	46.9	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-72.3	-36.4	175.8	-66.4	-58.7	95.4	0	0	111.8	Y306 A307 A313 I314 F336 V339	Y306-M310 HydrophobicContact CD1-CG 4.19Å; Y306-M310 HydrophobicContact CD2-CG 4.17Å; Y306-M310 HydrophobicContact CE1-CG 3.86Å; Y306-M310 HydrophobicContact CE2-CG 3.83Å; Y306-M310 HydrophobicContact CE2-SD 4.17Å; Y306-M310 HydrophobicContact CG-CG 4.35Å; Y306-M310 WeakPolarHBondContact O-CB 3.33Å; Y306-M310 WeakPolarHBondContact O-CG 3.38Å; Y306-M310 PolarHBondContact O-N 3.02Å; A307-M310 PolarHBondContact O-N 2.71Å; M310-A313 PolarHBondContact O-N 2.84Å; M310-I314 HydrophobicContact CB-CD1 4.3Å; M310-I314 VanDerWaalsContact O-CB 3.31Å; M310-I314 WeakPolarHBondContact O-CB 3.33Å; M310-I314 VanDerWaalsContact O-CG1 3.29Å; M310-I314 WeakPolarHBondContact O-CG1 3.39Å; M310-I314 PolarHBondContact O-N 3.41Å; M310-F336 HydrophobicContact CB-CD2 3.96Å; M310-F336 HydrophobicContact CB-CE2 3.93Å; M310-V339 HydrophobicContact CB-CG1 4.48Å; M310-V339 HydrophobicContact CG-CG1 4.03Å; M310-V339 HydrophobicContact SD-CG1 3.94Å
311	A	83.2	Confident	78.7	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.8	-48.2	171.8	0	0	0	0	0	110.8	F188 A307 A308 A313 I314 I315 P316 F336	F188-A311 HydrophobicContact CB-CB 3.85Å; F188-A311 HydrophobicContact CD1-CB 3.68Å; F188-A311 HydrophobicContact CD2-CB 4.4Å; F188-A311 HydrophobicContact CE1-CB 4.41Å; F188-A311 HydrophobicContact CG-CB 3.71Å; A307-A311 VanDerWaalsContact O-CB 3.27Å; A307-A311 WeakPolarHBondContact O-CB 3.33Å; A307-A311 PolarHBondContact O-N 3.15Å; A308-A311 PolarHBondContact O-N 3.25Å; A311-A313 PolarHBondContact O-N 2.97Å; A311-I314 PolarHBondContact O-N 3.5Å; A311-I315 HydrophobicContact CB-CD1 3.86Å; A311-I315 VanDerWaalsContact O-CB 3.29Å; A311-I315 WeakPolarHBondContact O-CB 3.38Å; A311-I315 WeakPolarHBondContact O-CG1 3.31Å; A311-I315 PolarHBondContact O-N 3.33Å; A311-P316 WeakPolarHBondContact O-CD 3.35Å; A311-F336 HydrophobicContact CB-CD2 4.2Å; A311-F336 HydrophobicContact CB-CE1 4.44Å; A311-F336 HydrophobicContact CB-CE2 3.74Å; A311-F336 HydrophobicContact CB-CZ 3.88Å; A311-F336 VanDerWaalsContact N-CE2 3.3Å
312	W	79.3	Confident	77.3	Confident	130 Å²	130	54.7 Å²	54.7	49%	0.492	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-36.8	176	-178.7	85.4	0	0	0	113.3	A308 P316 Y595	A308-W312 WeakPolarHBondContact O-CB 3.36Å; A308-W312 PolarHBondContact O-N 2.92Å; W312-P316 WeakPolarHBondContact O-CD 3.36Å; W312-P316 WeakPolarHBondContact O-CG 3.46Å; W312-Y595 AromaticContact CD1-CE2 3.75Å; W312-Y595 AromaticContact NE1-CE2 3.2Å; W312-Y595 AromaticContact NE1-CZ 3.33Å; W312-Y595 VanDerWaalsContact NE1-CZ 3.33Å; W312-Y595 PolarHBondContact NE1-OH 2.98Å
313	A	80.1	Confident	75.6	Confident	39 Å²	39	58.3 Å²	58.3	32%	0.322	30%	0.299	S	S	.	.	H	α-helix	trans	-79.3	-25.9	-179.7	0	0	0	0	0	114.5	A309 M310 A311 H317	A309-A313 VanDerWaalsContact O-CB 3.29Å; A309-A313 WeakPolarHBondContact O-CB 3.28Å; A309-A313 PolarHBondContact O-N 3.04Å; M310-A313 PolarHBondContact O-N 2.84Å; A311-A313 PolarHBondContact O-N 2.97Å; A313-H317 PolarHBondContact O-CD2 3.46Å
314	I	81.9	Confident	73.6	Confident	14 Å²	14	65.8 Å²	65.8	7%	0.072	34%	0.336	C	S	.	.	H	α-helix	trans	-108.9	-47	-170.9	-60.1	168.1	0	0	0	112.2	M310 A311 H317 S332 V335 F336 V339	M310-I314 HydrophobicContact CB-CD1 4.3Å; M310-I314 VanDerWaalsContact O-CB 3.31Å; M310-I314 WeakPolarHBondContact O-CB 3.33Å; M310-I314 VanDerWaalsContact O-CG1 3.29Å; M310-I314 WeakPolarHBondContact O-CG1 3.39Å; M310-I314 PolarHBondContact O-N 3.41Å; A311-I314 PolarHBondContact O-N 3.5Å; I314-H317 PolarHBondContact O-N 3.18Å; I314-S332 WeakPolarHBondContact CG2-O 3.32Å; I314-V335 HydrophobicContact CG2-CB 4Å; I314-V335 HydrophobicContact CG2-CG1 4.01Å; I314-F336 HydrophobicContact CB-CB 4.36Å; I314-F336 HydrophobicContact CD1-CB 4.4Å; I314-F336 HydrophobicContact CG2-CB 4.17Å; I314-V339 HydrophobicContact CD1-CB 4.04Å; I314-V339 HydrophobicContact CD1-CG1 4.18Å; I314-V339 HydrophobicContact CD1-CG2 3.89Å
315	I	74.1	Confident	72	Confident	22 Å²	22	68.8 Å²	68.8	11%	0.113	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-46.8	-170.9	-58	177	0	0	0	113.3	A311 H317 F336 Y598	A311-I315 HydrophobicContact CB-CD1 3.86Å; A311-I315 VanDerWaalsContact O-CB 3.29Å; A311-I315 WeakPolarHBondContact O-CB 3.38Å; A311-I315 WeakPolarHBondContact O-CG1 3.31Å; A311-I315 PolarHBondContact O-N 3.33Å; I315-H317 VanDerWaalsContact C-N 3.29Å; I315-H317 PolarHBondContact O-N 3.5Å; I315-F336 HydrophobicContact CD1-CD1 4.19Å; I315-F336 HydrophobicContact CD1-CG 4.39Å; I315-F336 HydrophobicContact CG1-CB 4.31Å; I315-F336 HydrophobicContact CG1-CG 4.45Å; I315-Y598 HydrophobicContact CB-CE2 4.45Å; I315-Y598 HydrophobicContact CD1-CE2 4.26Å; I315-Y598 HydrophobicContact CG2-CE2 4.08Å
316	P	65.4	Low	70.3	Confident	55 Å²	55	73 Å²	73	36%	0.357	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.5	-178.3	31.5	-35.2	0	0	0	114	A311 W312 Y318	A311-P316 WeakPolarHBondContact O-CD 3.35Å; W312-P316 WeakPolarHBondContact O-CD 3.36Å; W312-P316 WeakPolarHBondContact O-CG 3.46Å; P316-Y318 WeakPolarHBondContact O-CD2 3.34Å
317	H	65.2	Low	68.6	Low	109 Å²	109	74.7 Å²	74.7	51%	0.505	42%	0.423	S	S	.	.			trans	-96.9	98.2	-176.8	-75	-71.8	0	0	0	111.5	A313 I314 I315 G319	A313-H317 PolarHBondContact O-CD2 3.46Å; I314-H317 PolarHBondContact O-N 3.18Å; I315-H317 VanDerWaalsContact C-N 3.29Å; I315-H317 PolarHBondContact O-N 3.5Å; H317-G319 PolarHBondContact O-N 3.42Å
318	Y	53.4	Low	67.5	Low	140 Å²	140	78 Å²	78	55%	0.549	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-61.2	-5.5	-174.3	-77.6	-90.8	0	0	0	116.8	P316 W320 S321 V587	P316-Y318 WeakPolarHBondContact O-CD2 3.34Å; Y318-W320 PolarHBondContact O-N 2.82Å; Y318-S321 PolarHBondContact O-OG 2.84Å; Y318-V587 HydrophobicContact CE1-CG1 3.98Å; Y318-V587 HydrophobicContact CE1-CG2 4.42Å; Y318-V587 HydrophobicContact CE2-CG1 4.44Å; Y318-V587 VanDerWaalsContact OH-CG1 3.28Å; Y318-V587 WeakPolarHBondContact OH-CG1 3.28Å; Y318-V587 VanDerWaalsContact OH-CG2 3.27Å; Y318-V587 WeakPolarHBondContact OH-CG2 3.15Å
319	G	52.3	Low	66.7	Low	72 Å²	72	81.4 Å²	81.4	74%	0.742	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-73.4	-2.9	-177.8	0	0	0	0	0	116	H317	H317-G319 PolarHBondContact O-N 3.42Å
320	W	56.8	Low	66.2	Low	135 Å²	135	81 Å²	81	51%	0.511	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-108.3	-0.2	-172.5	-65.8	88.1	0	0	0	114.7	Y318 F322 V335	Y318-W320 PolarHBondContact O-N 2.82Å; W320-F322 WeakPolarHBondContact O-CD2 3.19Å; W320-V335 HydrophobicContact CB-CG2 4.31Å; W320-V335 HydrophobicContact CE3-CG1 3.95Å; W320-V335 HydrophobicContact CZ3-CG1 4.44Å
321	S	62.5	Low	65.8	Low	53 Å²	53	80.7 Å²	80.7	37%	0.371	44%	0.441	S	S	.	.			trans	-85.1	123.4	179.1	58.3	0	0	0	0	112	Y318 F330	Y318-S321 PolarHBondContact O-OG 2.84Å; S321-F330 VanDerWaalsContact CA-O 3.24Å; S321-F330 WeakPolarHBondContact CA-O 3.29Å
322	F	62.4	Low	65.6	Low	142 Å²	142	81.1 Å²	81.1	62%	0.623	44%	0.444	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	138.1	176.8	-65.3	-86.4	0	0	0	110.6	W320 F330	W320-F322 WeakPolarHBondContact O-CD2 3.19Å; F322-F330 PolarHBondContact N-O 2.99Å; F322-F330 WeakPolarHBondContact O-CA 3.35Å; F322-F330 WeakPolarHBondContact O-CB 3.38Å; F322-F330 PolarHBondContact O-N 3.42Å
323	Q	57	Low	65.8	Low	137 Å²	137	75.3 Å²	75.3	64%	0.64	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.7	175.3	-69.9	174.4	-27.5	0	0	108.7	Q329	Q323-Q329 HydrophobicContact CG-CB 4.42Å; Q323-Q329 HydrophobicContact CG-CG 4.15Å
324	M	50.2	Low	66.1	Low	158 Å²	158	73.6 Å²	73.6	78%	0.778	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	78.5	-176.8	-168	69.8	171.8	0	0	108.8	Y328	M324-Y328 HydrophobicContact CB-CD1 4.26Å; M324-Y328 PolarHBondContact N-O 3.18Å
325	G	56.4	Low	66.4	Low	63 Å²	63	73.6 Å²	73.6	65%	0.649	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	-169.7	-168.5	0	0	0	0	0	113
326	S	54	Low	67.1	Low	122 Å²	122	72.6 Å²	72.6	85%	0.853	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-24.9	-176.6	50.1	0	0	0	0	114.4
327	A	56.6	Low	68.2	Low	90 Å²	90	70.1 Å²	70.1	74%	0.744	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-30	-173.8	0	0	0	0	0	114.2
328	Y	68.4	Low	69.5	Low	70 Å²	70	66.9 Å²	66.9	28%	0.275	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	102.4	-172.7	-164.6	-85.6	0	0	0	112.1	F251 Q253 M324 F330	F251-Y328 WeakPolarHBondContact CA-OH 3.46Å; F251-Y328 PolarHBondContact O-OH 3.35Å; Q253-Y328 VanDerWaalsContact CD-CE2 3.5Å; Q253-Y328 HydrophobicContact CG-CE2 4.46Å; Q253-Y328 VanDerWaalsContact NE2-CE2 3.26Å; Q253-Y328 VanDerWaalsContact NE2-CG 3.29Å; M324-Y328 HydrophobicContact CB-CD1 4.26Å; M324-Y328 PolarHBondContact N-O 3.18Å; Y328-F330 HydrophobicContact CE1-CB 4.06Å; Y328-F330 AromaticContact CE1-CD2 4Å; Y328-F330 HydrophobicContact CE1-CD2 4Å; Y328-F330 HydrophobicContact CE1-CG 4.44Å
329	Q	68.4	Low	71.3	Confident	74 Å²	74	61.3 Å²	61.3	35%	0.346	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.1	172.2	-52.7	-156.6	34.2	0	0	111.2	Q253 Q323	Q253-Q329 PolarHBondContact NE2-O 2.97Å; Q323-Q329 HydrophobicContact CG-CB 4.42Å; Q323-Q329 HydrophobicContact CG-CG 4.15Å
330	F	76.5	Confident	73.1	Confident	27 Å²	27	58.1 Å²	58.1	12%	0.118	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	89.7	-179.3	-161.3	-102.2	0	0	0	109.9	S250 F251 S321 F322 Y328 R334 V335	S250-F330 WeakPolarHBondContact O-CE2 3.45Å; F251-F330 HydrophobicContact CD1-CE2 4.12Å; F251-F330 HydrophobicContact CE1-CE2 4.39Å; S321-F330 VanDerWaalsContact CA-O 3.24Å; S321-F330 WeakPolarHBondContact CA-O 3.29Å; F322-F330 PolarHBondContact N-O 2.99Å; F322-F330 WeakPolarHBondContact O-CA 3.35Å; F322-F330 WeakPolarHBondContact O-CB 3.38Å; F322-F330 PolarHBondContact O-N 3.42Å; Y328-F330 HydrophobicContact CE1-CB 4.06Å; Y328-F330 AromaticContact CE1-CD2 4Å; Y328-F330 HydrophobicContact CE1-CD2 4Å; Y328-F330 HydrophobicContact CE1-CG 4.44Å; F330-R334 HydrophobicContact CD1-CB 4.43Å; F330-R334 HydrophobicContact CD2-CB 4.04Å; F330-R334 HydrophobicContact CE1-CB 4.09Å; F330-R334 HydrophobicContact CE2-CB 3.65Å; F330-R334 HydrophobicContact CE2-CG 4.45Å; F330-R334 HydrophobicContact CG-CB 4.42Å; F330-R334 HydrophobicContact CZ-CB 3.67Å; F330-V335 HydrophobicContact CD1-CG2 4.09Å; F330-V335 HydrophobicContact CE1-CG2 3.62Å
331	H	77.4	Confident	74.8	Confident	42 Å²	42	52 Å²	52	19%	0.194	30%	0.297	C	S	.	.			trans	-78	156.2	-178.5	-63.3	-72.7	0	0	0	112.9	D196 W333 R334	D196-H331 IonicContact OD1-CD2 3.62Å; D196-H331 PolarHBondContact OD1-CD2 2.98Å; D196-H331 IonicContact OD1-NE2 3.01Å; D196-H331 IonicContact OD2-CD2 3.34Å; H331-W333 PolarHBondContact O-N 3Å; H331-R334 WeakPolarHBondContact O-CB 3.45Å; H331-R334 PolarHBondContact O-N 3.29Å
332	S	80.1	Confident	76.2	Confident	10 Å²	10	53.8 Å²	53.8	7%	0.07	30%	0.299	C	S	.	.	H	α-helix	trans	-54.5	-27.6	-174.5	-48.4	0	0	0	0	114.8	I314 R334 V335 F336	I314-S332 WeakPolarHBondContact CG2-O 3.32Å; S332-R334 PolarHBondContact O-N 3.46Å; S332-V335 WeakPolarHBondContact O-CB 3.47Å; S332-V335 PolarHBondContact O-N 3.23Å; S332-F336 PolarHBondContact O-N 2.88Å
333	W	82.6	Confident	77.7	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-64.9	-24.8	175.9	74.8	-100.1	0	0	0	113.1	V189 A193 D196 M197 F258 H331 F336 V337	V189-W333 HydrophobicContact CB-CE3 4.49Å; V189-W333 HydrophobicContact CG1-CD2 4.32Å; V189-W333 HydrophobicContact CG1-CE3 3.56Å; V189-W333 HydrophobicContact CG1-CZ3 3.71Å; V189-W333 HydrophobicContact CG2-CE3 4.17Å; A193-W333 HydrophobicContact CB-CH2 4.48Å; A193-W333 HydrophobicContact CB-CZ2 4.33Å; D196-W333 VanDerWaalsContact OD2-CE2 3.26Å; D196-W333 VanDerWaalsContact OD2-CZ2 3.22Å; D196-W333 WeakPolarHBondContact OD2-CZ2 3.08Å; D196-W333 PolarHBondContact OD2-NE1 3Å; M197-W333 HydrophobicContact CE-CH2 4.08Å; M197-W333 HydrophobicContact CE-CZ2 4.09Å; F258-W333 HydrophobicContact CE1-CH2 4.42Å; F258-W333 AromaticContact CE2-CH2 3.97Å; F258-W333 HydrophobicContact CE2-CH2 3.97Å; F258-W333 AromaticContact CE2-CZ3 3.84Å; F258-W333 HydrophobicContact CE2-CZ3 3.84Å; F258-W333 AromaticContact CZ-CH2 3.9Å; F258-W333 HydrophobicContact CZ-CH2 3.9Å; F258-W333 AromaticContact CZ-CZ3 3.71Å; F258-W333 HydrophobicContact CZ-CZ3 3.71Å; H331-W333 PolarHBondContact O-N 3Å; W333-F336 WeakPolarHBondContact O-CB 3.43Å; W333-V337 HydrophobicContact CE3-CG2 4.19Å; W333-V337 HydrophobicContact CZ3-CG2 4.35Å; W333-V337 WeakPolarHBondContact O-CG2 3.27Å; W333-V337 PolarHBondContact O-N 3.17Å; W333-V337 VanDerWaalsContact O-N 3.13Å
334	R	87.1	Confident	79.4	Confident	3 Å²	3	40.9 Å²	40.9	1%	0.011	24%	0.241	C	C	.	.	H	α-helix	trans	-76.5	-35	174.6	-61	173.6	175	-81.5	-1.7	111.8	D196 M197 S250 V252 F330 H331 S332 F336 V337 L338	D196-R334 IonicContact OD2-NE 3.48Å; D196-R334 IonicContact OD2-NH2 3.56Å; M197-R334 VanDerWaalsContact CE-NH2 3.29Å; S250-R334 WeakPolarHBondContact CB-O 3.45Å; S250-R334 WeakPolarHBondContact O-CD 3.28Å; S250-R334 WeakPolarHBondContact O-CG 3.5Å; S250-R334 PolarHBondContact O-NH1 2.94Å; V252-R334 PolarHBondContact O-NH1 2.91Å; V252-R334 PolarHBondContact O-NH2 2.98Å; F330-R334 HydrophobicContact CD1-CB 4.43Å; F330-R334 HydrophobicContact CD2-CB 4.04Å; F330-R334 HydrophobicContact CE1-CB 4.09Å; F330-R334 HydrophobicContact CE2-CB 3.65Å; F330-R334 HydrophobicContact CE2-CG 4.45Å; F330-R334 HydrophobicContact CG-CB 4.42Å; F330-R334 HydrophobicContact CZ-CB 3.67Å; H331-R334 WeakPolarHBondContact O-CB 3.45Å; H331-R334 PolarHBondContact O-N 3.29Å; S332-R334 PolarHBondContact O-N 3.46Å; R334-F336 VanDerWaalsContact C-N 3.35Å; R334-V337 PolarHBondContact O-N 2.9Å; R334-L338 PolarHBondContact O-N 3.1Å
335	V	86.8	Confident	81.5	Confident	15 Å²	15	37 Å²	37	9%	0.091	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-43.6	169.1	-179.2	0	0	0	0	110.2	I314 W320 F330 S332 V337 L338 V339	I314-V335 HydrophobicContact CG2-CB 4Å; I314-V335 HydrophobicContact CG2-CG1 4.01Å; W320-V335 HydrophobicContact CB-CG2 4.31Å; W320-V335 HydrophobicContact CE3-CG1 3.95Å; W320-V335 HydrophobicContact CZ3-CG1 4.44Å; F330-V335 HydrophobicContact CD1-CG2 4.09Å; F330-V335 HydrophobicContact CE1-CG2 3.62Å; S332-V335 WeakPolarHBondContact O-CB 3.47Å; S332-V335 PolarHBondContact O-N 3.23Å; V335-V337 PolarHBondContact O-N 2.73Å; V335-L338 WeakPolarHBondContact O-CB 3.49Å; V335-L338 PolarHBondContact O-N 2.9Å; V335-V339 HydrophobicContact CG1-CG2 4.46Å; V335-V339 WeakPolarHBondContact O-CG2 3.48Å; V335-V339 PolarHBondContact O-N 2.96Å
336	F	88.9	Confident	83.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.7	-48	174.7	165.7	-112.3	0	0	0	112.1	V185 F188 V189 A307 M310 A311 I314 I315 S332 W333 R334 L338 V339 C340	V185-F336 HydrophobicContact CB-CE1 4.4Å; V185-F336 HydrophobicContact CG1-CE1 4.24Å; V185-F336 HydrophobicContact CG2-CE1 4.06Å; V185-F336 HydrophobicContact CG2-CZ 3.84Å; F188-F336 HydrophobicContact CB-CE1 3.66Å; F188-F336 HydrophobicContact CB-CZ 3.81Å; F188-F336 HydrophobicContact CD2-CZ 4.29Å; F188-F336 HydrophobicContact CG-CZ 4.32Å; V189-F336 HydrophobicContact CG2-CD1 3.89Å; V189-F336 HydrophobicContact CG2-CE1 3.93Å; A307-F336 VanDerWaalsContact O-CE2 3.22Å; A307-F336 WeakPolarHBondContact O-CE2 3.44Å; M310-F336 HydrophobicContact CB-CD2 3.96Å; M310-F336 HydrophobicContact CB-CE2 3.93Å; A311-F336 HydrophobicContact CB-CD2 4.2Å; A311-F336 HydrophobicContact CB-CE1 4.44Å; A311-F336 HydrophobicContact CB-CE2 3.74Å; A311-F336 HydrophobicContact CB-CZ 3.88Å; A311-F336 VanDerWaalsContact N-CE2 3.3Å; I314-F336 HydrophobicContact CB-CB 4.36Å; I314-F336 HydrophobicContact CD1-CB 4.4Å; I314-F336 HydrophobicContact CG2-CB 4.17Å; I315-F336 HydrophobicContact CD1-CD1 4.19Å; I315-F336 HydrophobicContact CD1-CG 4.39Å; I315-F336 HydrophobicContact CG1-CB 4.31Å; I315-F336 HydrophobicContact CG1-CG 4.45Å; S332-F336 PolarHBondContact O-N 2.88Å; W333-F336 WeakPolarHBondContact O-CB 3.43Å; R334-F336 VanDerWaalsContact C-N 3.35Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 2.87Å; F336-V339 PolarHBondContact O-N 3.06Å; F336-C340 WeakPolarHBondContact CE2-SG 3.45Å; F336-C340 WeakPolarHBondContact O-CB 3.43Å; F336-C340 PolarHBondContact O-N 3.02Å; F336-C340 PolarHBondContact O-SG 3.03Å
337	V	90.2	Very high	85.2	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	18%	0.184	C	C	.	.	H	α-helix	trans	-55.7	-45.2	173.8	165.4	0	0	0	0	112.4	V185 V189 W333 R334 V335 C340 A341	V185-V337 HydrophobicContact CG1-CG2 4.33Å; V189-V337 HydrophobicContact CG2-CG2 3.66Å; W333-V337 HydrophobicContact CE3-CG2 4.19Å; W333-V337 HydrophobicContact CZ3-CG2 4.35Å; W333-V337 WeakPolarHBondContact O-CG2 3.27Å; W333-V337 PolarHBondContact O-N 3.17Å; W333-V337 VanDerWaalsContact O-N 3.13Å; R334-V337 PolarHBondContact O-N 2.9Å; V335-V337 PolarHBondContact O-N 2.73Å; V337-C340 PolarHBondContact O-N 2.92Å; V337-A341 PolarHBondContact O-N 2.84Å
338	L	90.9	Very high	87	Confident	41 Å²	41	32.2 Å²	32.2	22%	0.215	16%	0.157	C	C	.	.	H	α-helix	trans	-61.9	-46.1	179.3	-168.8	90.4	0	0	0	111.7	F247 F251 R334 V335 F336 C340 A341	F247-L338 HydrophobicContact CD2-CD1 3.57Å; F247-L338 HydrophobicContact CE2-CD1 3.71Å; F251-L338 HydrophobicContact CE2-CD1 4.02Å; F251-L338 HydrophobicContact CZ-CD1 4.23Å; R334-L338 PolarHBondContact O-N 3.1Å; V335-L338 WeakPolarHBondContact O-CB 3.49Å; V335-L338 PolarHBondContact O-N 2.9Å; F336-L338 VanDerWaalsContact C-N 3.33Å; F336-L338 PolarHBondContact O-N 2.87Å; L338-C340 VanDerWaalsContact C-N 3.28Å; L338-C340 PolarHBondContact O-N 2.89Å; L338-A341 WeakPolarHBondContact O-CB 3.47Å; L338-A341 PolarHBondContact O-N 3.14Å; L338-A341 VanDerWaalsContact O-N 3.13Å
339	V	91.8	Very high	88.3	Confident	23 Å²	23	30.8 Å²	30.8	14%	0.139	16%	0.163	C	C	.	.	H	α-helix	trans	-62.9	-36.9	178	170.3	0	0	0	0	111.3	Y306 M310 I314 V335 F336 A341 F342	Y306-V339 WeakPolarHBondContact OH-CG1 3.45Å; Y306-V339 PolarHBondContact OH-O 2.9Å; M310-V339 HydrophobicContact CB-CG1 4.48Å; M310-V339 HydrophobicContact CG-CG1 4.03Å; M310-V339 HydrophobicContact SD-CG1 3.94Å; I314-V339 HydrophobicContact CD1-CB 4.04Å; I314-V339 HydrophobicContact CD1-CG1 4.18Å; I314-V339 HydrophobicContact CD1-CG2 3.89Å; V335-V339 HydrophobicContact CG1-CG2 4.46Å; V335-V339 WeakPolarHBondContact O-CG2 3.48Å; V335-V339 PolarHBondContact O-N 2.96Å; F336-V339 PolarHBondContact O-N 3.06Å; V339-A341 PolarHBondContact O-N 3.06Å; V339-F342 HydrophobicContact CB-CD2 4.4Å; V339-F342 HydrophobicContact CB-CE2 4.25Å; V339-F342 HydrophobicContact CG1-CD2 4.18Å; V339-F342 HydrophobicContact CG1-CE2 4.33Å; V339-F342 HydrophobicContact CG2-CE2 3.96Å; V339-F342 HydrophobicContact CG2-CZ 4.48Å; V339-F342 WeakPolarHBondContact O-CB 3.09Å; V339-F342 WeakPolarHBondContact O-CD2 3.48Å; V339-F342 WeakPolarHBondContact O-CG 3.37Å; V339-F342 PolarHBondContact O-N 3.19Å; V339-F342 VanDerWaalsContact O-N 3.08Å
340	C	90.3	Very high	89.5	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.034	16%	0.157	C	C	.	.	H	α-helix	trans	-66.4	-16.7	175.7	-78.4	0	0	0	0	114.8	V181 V185 F336 V337 L338 F342 P343	V181-C340 HydrophobicContact CG1-CB 3.45Å; V181-C340 VanDerWaalsContact CG1-CB 3.45Å; V181-C340 WeakPolarHBondContact CG1-O 3.43Å; V185-C340 HydrophobicContact CG2-CB 3.52Å; V185-C340 WeakPolarHBondContact CG2-SG 3.36Å; F336-C340 WeakPolarHBondContact CE2-SG 3.45Å; F336-C340 WeakPolarHBondContact O-CB 3.43Å; F336-C340 PolarHBondContact O-N 3.02Å; F336-C340 PolarHBondContact O-SG 3.03Å; V337-C340 PolarHBondContact O-N 2.92Å; L338-C340 VanDerWaalsContact C-N 3.28Å; L338-C340 PolarHBondContact O-N 2.89Å; C340-F342 VanDerWaalsContact C-N 3.34Å; C340-P343 WeakPolarHBondContact O-CD 3.42Å
341	A	91.6	Very high	90.4	Very high	6 Å²	6	27.1 Å²	27.1	5%	0.05	15%	0.151	C	C	.	.	H	α-helix	trans	-74.3	-23.1	170.6	0	0	0	0	0	112.9	A246 V337 L338 V339 S344 V345	A246-A341 HydrophobicContact CB-CB 4.26Å; V337-A341 PolarHBondContact O-N 2.84Å; L338-A341 WeakPolarHBondContact O-CB 3.47Å; L338-A341 PolarHBondContact O-N 3.14Å; L338-A341 VanDerWaalsContact O-N 3.13Å; V339-A341 PolarHBondContact O-N 3.06Å; A341-S344 WeakPolarHBondContact O-CB 3.43Å; A341-S344 PolarHBondContact O-N 3.28Å; A341-S344 PolarHBondContact O-OG 3.17Å; A341-V345 PolarHBondContact O-N 3.46Å
342	F	92.6	Very high	91.1	Very high	92 Å²	92	28.9 Å²	28.9	40%	0.404	17%	0.165	S	C	.	.	H	α-helix	trans	-58.1	-42.3	-172	-62.5	-24	0	0	0	115	V339 C340 S344 V345 F346	V339-F342 HydrophobicContact CB-CD2 4.4Å; V339-F342 HydrophobicContact CB-CE2 4.25Å; V339-F342 HydrophobicContact CG1-CD2 4.18Å; V339-F342 HydrophobicContact CG1-CE2 4.33Å; V339-F342 HydrophobicContact CG2-CE2 3.96Å; V339-F342 HydrophobicContact CG2-CZ 4.48Å; V339-F342 WeakPolarHBondContact O-CB 3.09Å; V339-F342 WeakPolarHBondContact O-CD2 3.48Å; V339-F342 WeakPolarHBondContact O-CG 3.37Å; V339-F342 PolarHBondContact O-N 3.19Å; V339-F342 VanDerWaalsContact O-N 3.08Å; C340-F342 VanDerWaalsContact C-N 3.34Å; F342-S344 PolarHBondContact O-N 2.97Å; F342-V345 PolarHBondContact O-N 3.42Å; F342-V345 VanDerWaalsContact O-N 3.11Å; F342-F346 HydrophobicContact CB-CD2 4.37Å; F342-F346 HydrophobicContact CB-CE2 4.18Å; F342-F346 WeakPolarHBondContact O-CD2 3.45Å; F342-F346 PolarHBondContact O-N 3.27Å
343	P	93.2	Very high	91.6	Very high	7 Å²	7	32.9 Å²	32.9	5%	0.045	19%	0.189	C	C	.	.	H	α-helix	trans	-56.6	-34.9	174.9	-27.1	37.1	0	0	0	113.4	M177 A178 V181 Y306 C340 A347	M177-P343 HydrophobicContact CE-CG 4.16Å; M177-P343 HydrophobicContact SD-CB 4.44Å; A178-P343 HydrophobicContact CB-CB 4.32Å; V181-P343 HydrophobicContact CG2-CG 4.46Å; Y306-P343 HydrophobicContact CD1-CG 4.25Å; Y306-P343 HydrophobicContact CE1-CG 3.74Å; C340-P343 WeakPolarHBondContact O-CD 3.42Å; P343-A347 VanDerWaalsContact O-CB 3.32Å; P343-A347 WeakPolarHBondContact O-CB 3.47Å; P343-A347 PolarHBondContact O-N 3.4Å
344	S	92.9	Very high	92.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-69.2	-39.5	176	73.6	0	0	0	0	112.4	S243 A341 F342 A347 I348	S243-S344 WeakPolarHBondContact CB-OG 3.16Å; S243-S344 PolarHBondContact OG-OG 2.81Å; A341-S344 WeakPolarHBondContact O-CB 3.43Å; A341-S344 PolarHBondContact O-N 3.28Å; A341-S344 PolarHBondContact O-OG 3.17Å; F342-S344 PolarHBondContact O-N 2.97Å; S344-A347 PolarHBondContact O-N 3.13Å; S344-I348 WeakPolarHBondContact O-CD1 3.47Å; S344-I348 VanDerWaalsContact O-CG1 3.22Å; S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 2.84Å
345	V	94.3	Very high	92.3	Very high	76 Å²	76	33.8 Å²	33.8	46%	0.461	20%	0.195	S	C	.	.	H	α-helix	trans	-62.9	-44.8	174.7	-178.6	0	0	0	0	111.1	S243 A341 F342 I348 G349	S243-V345 WeakPolarHBondContact OG-CG2 3.5Å; A341-V345 PolarHBondContact O-N 3.46Å; F342-V345 PolarHBondContact O-N 3.42Å; F342-V345 VanDerWaalsContact O-N 3.11Å; V345-I348 PolarHBondContact O-N 3.32Å; V345-G349 PolarHBondContact O-N 2.97Å
346	F	94.4	Very high	92.6	Very high	140 Å²	140	33.9 Å²	33.9	61%	0.614	19%	0.194	S	C	*	.	H	α-helix	trans	-64.8	-39.3	175.5	-72.4	-62.6	0	0	0	112.3	F342 G349 A350	F342-F346 HydrophobicContact CB-CD2 4.37Å; F342-F346 HydrophobicContact CB-CE2 4.18Å; F342-F346 WeakPolarHBondContact O-CD2 3.45Å; F342-F346 PolarHBondContact O-N 3.27Å; F346-G349 PolarHBondContact O-N 2.48Å; F346-A350 VanDerWaalsContact O-CB 3.28Å; F346-A350 WeakPolarHBondContact O-CB 3.41Å; F346-A350 PolarHBondContact O-N 3.17Å
347	A	94.4	Very high	92.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-45.6	175.2	0	0	0	0	0	112.2	L174 A175 L239 P343 S344 A350 L351	L174-A347 HydrophobicContact CB-CB 3.95Å; A175-A347 HydrophobicContact CB-CB 4.36Å; L239-A347 HydrophobicContact CD1-CB 4.09Å; P343-A347 VanDerWaalsContact O-CB 3.32Å; P343-A347 WeakPolarHBondContact O-CB 3.47Å; P343-A347 PolarHBondContact O-N 3.4Å; S344-A347 PolarHBondContact O-N 3.13Å; A347-A350 PolarHBondContact O-N 2.86Å; A347-L351 WeakPolarHBondContact O-CB 3.46Å; A347-L351 WeakPolarHBondContact O-CD1 3.41Å; A347-L351 VanDerWaalsContact O-CG 3.27Å; A347-L351 WeakPolarHBondContact O-CG 3.49Å; A347-L351 PolarHBondContact O-N 3.31Å
348	I	95.3	Very high	92.5	Very high	34 Å²	34	33.7 Å²	33.7	17%	0.174	19%	0.193	C	C	.	.	H	α-helix	trans	-57.6	-53	175.6	-66.9	158.1	0	0	0	110.2	L236 L239 S344 V345 A350 L351 T352	L236-I348 HydrophobicContact CD2-CG2 4.11Å; L239-I348 HydrophobicContact CB-CD1 4.14Å; L239-I348 HydrophobicContact CB-CG1 3.66Å; S344-I348 WeakPolarHBondContact O-CD1 3.47Å; S344-I348 VanDerWaalsContact O-CG1 3.22Å; S344-I348 WeakPolarHBondContact O-CG1 3.49Å; S344-I348 PolarHBondContact O-N 2.84Å; V345-I348 PolarHBondContact O-N 3.32Å; I348-A350 VanDerWaalsContact C-N 3.31Å; I348-A350 PolarHBondContact O-N 2.88Å; I348-L351 PolarHBondContact O-N 3.4Å; I348-T352 WeakPolarHBondContact O-CG2 3.42Å; I348-T352 PolarHBondContact O-N 3.39Å
349	G	95.1	Very high	92.2	Very high	40 Å²	40	32.6 Å²	32.6	41%	0.412	19%	0.186	S	C	.	.	H	α-helix	trans	-56.7	-44.9	179.5	0	0	0	0	0	112.2	V345 F346 T352	V345-G349 PolarHBondContact O-N 2.97Å; F346-G349 PolarHBondContact O-N 2.48Å; G349-T352 PolarHBondContact O-N 3.09Å; G349-T352 PolarHBondContact O-OG1 3.26Å
350	A	93.9	Very high	91.9	Very high	25 Å²	25	32.3 Å²	32.3	21%	0.207	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-39.5	178.4	0	0	0	0	0	113.2	V171 F346 A347 I348 T352 T353	V171-A350 HydrophobicContact CB-CB 4.46Å; V171-A350 HydrophobicContact CG1-CB 3.9Å; V171-A350 HydrophobicContact CG2-CB 4.03Å; F346-A350 VanDerWaalsContact O-CB 3.28Å; F346-A350 WeakPolarHBondContact O-CB 3.41Å; F346-A350 PolarHBondContact O-N 3.17Å; A347-A350 PolarHBondContact O-N 2.86Å; I348-A350 VanDerWaalsContact C-N 3.31Å; I348-A350 PolarHBondContact O-N 2.88Å; A350-T352 VanDerWaalsContact C-N 3.26Å; A350-T352 PolarHBondContact O-N 3.13Å; A350-T353 WeakPolarHBondContact O-CB 3.38Å; A350-T353 PolarHBondContact O-N 3.04Å; A350-T353 VanDerWaalsContact O-N 3.12Å; A350-T353 PolarHBondContact O-OG1 2.95Å
351	L	93.8	Very high	91.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-24.4	177.6	-79.3	165.7	0	0	0	113.8	V171 L172 R232 L235 L236 L239 A347 I348 T353 Q354	V171-L351 HydrophobicContact CG1-CB 4.42Å; V171-L351 HydrophobicContact CG1-CD2 3.66Å; V171-L351 HydrophobicContact CG1-CG 3.71Å; L172-L351 HydrophobicContact CD2-CD2 3.95Å; R232-L351 PolarHBondContact NE-O 3.05Å; R232-L351 VanDerWaalsContact NE-O 3.07Å; L235-L351 HydrophobicContact CD2-CD1 3.7Å; L235-L351 HydrophobicContact CD2-CD2 3.88Å; L235-L351 HydrophobicContact CD2-CG 4.47Å; L235-L351 HydrophobicContact CG-CD1 3.78Å; L236-L351 HydrophobicContact CD2-CB 3.57Å; L236-L351 HydrophobicContact CD2-CD1 4.47Å; L236-L351 HydrophobicContact CG-CB 4.08Å; L239-L351 HydrophobicContact CD1-CD1 3.44Å; L239-L351 VanDerWaalsContact CD1-CD1 3.44Å; A347-L351 WeakPolarHBondContact O-CB 3.46Å; A347-L351 WeakPolarHBondContact O-CD1 3.41Å; A347-L351 VanDerWaalsContact O-CG 3.27Å; A347-L351 WeakPolarHBondContact O-CG 3.49Å; A347-L351 PolarHBondContact O-N 3.31Å; I348-L351 PolarHBondContact O-N 3.4Å; L351-T353 PolarHBondContact O-N 3.45Å; L351-Q354 PolarHBondContact O-N 3.5Å
352	T	92.6	Very high	91.1	Very high	78 Å²	78	33.4 Å²	33.4	48%	0.479	19%	0.187	S	C	.	.	H	α-helix	trans	-58.1	-32.5	172.2	68.8	0	0	0	0	112.2	R232 L236 I348 G349 A350	R232-T352 PolarHBondContact NH2-O 3.36Å; L236-T352 HydrophobicContact CD2-CG2 4.49Å; I348-T352 WeakPolarHBondContact O-CG2 3.42Å; I348-T352 PolarHBondContact O-N 3.39Å; G349-T352 PolarHBondContact O-N 3.09Å; G349-T352 PolarHBondContact O-OG1 3.26Å; A350-T352 VanDerWaalsContact C-N 3.26Å; A350-T352 PolarHBondContact O-N 3.13Å
353	T	90.8	Very high	90.3	Very high	95 Å²	95	31.3 Å²	31.3	58%	0.583	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-14.5	-175.6	71.4	0	0	0	0	114.9	A350 L351	A350-T353 WeakPolarHBondContact O-CB 3.38Å; A350-T353 PolarHBondContact O-N 3.04Å; A350-T353 VanDerWaalsContact O-N 3.12Å; A350-T353 PolarHBondContact O-OG1 2.95Å; L351-T353 PolarHBondContact O-N 3.45Å
354	Q	92.7	Very high	89.5	Confident	14 Å²	14	34.2 Å²	34.2	7%	0.065	19%	0.193	C	C	.	.	S	Bend	trans	-90	151.4	-176.5	-56.1	-56.7	-78.3	0	0	110.8	L168 V171 R232 L351	L168-Q354 HydrophobicContact CD1-CB 4.46Å; L168-Q354 HydrophobicContact CD1-CG 4.17Å; V171-Q354 HydrophobicContact CB-CG 4.36Å; V171-Q354 HydrophobicContact CG1-CG 4Å; V171-Q354 HydrophobicContact CG2-CG 4.24Å; R232-Q354 WeakPolarHBondContact CD-O 3.4Å; R232-Q354 PolarHBondContact NE-O 3.48Å; R232-Q354 PolarHBondContact NH2-O 2.9Å; L351-Q354 PolarHBondContact O-N 3.5Å
355	P	93	Very high	88.7	Confident	15 Å²	15	35.9 Å²	35.9	10%	0.097	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-75.5	163.2	171.9	31.3	-34.5	0	0	0	112.1	F164 Y279 F283 V373	F164-P355 HydrophobicContact CE2-CG 3.97Å; F164-P355 HydrophobicContact CZ-CG 3.64Å; Y279-P355 PolarHBondContact OH-O 2.82Å; F283-P355 HydrophobicContact CZ-CG 4.38Å; P355-V373 HydrophobicContact CB-CB 4.43Å; P355-V373 HydrophobicContact CB-CG1 3.86Å; P355-V373 HydrophobicContact CB-CG2 3.7Å; P355-V373 HydrophobicContact CG-CG1 3.87Å
356	E	91.9	Very high	88.1	Confident	16 Å²	16	36.5 Å²	36.5	8%	0.075	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-73.1	164	167.5	-172.5	55.4	-94.6	0	0	110.6	R231 R232 Q233 F360 F361	R231-E356 PolarHBondContact N-OE1 3.19Å; R231-E356 PolarHBondContact N-OE2 3.33Å; R232-E356 WeakPolarHBondContact CA-OE2 3.26Å; R232-E356 WeakPolarHBondContact CB-OE2 3.33Å; R232-E356 PolarHBondContact N-OE1 3.18Å; R232-E356 PolarHBondContact N-OE2 3.44Å; Q233-E356 PolarHBondContact N-OE2 3.08Å; E356-F360 HydrophobicContact CG-CD1 3.7Å; E356-F360 HydrophobicContact CG-CE1 4.13Å; E356-F361 HydrophobicContact CB-CE1 4.49Å; E356-F361 HydrophobicContact CB-CE2 3.91Å; E356-F361 HydrophobicContact CB-CZ 3.69Å; E356-F361 HydrophobicContact CG-CE1 4.44Å; E356-F361 HydrophobicContact CG-CE2 4.48Å; E356-F361 HydrophobicContact CG-CZ 4.1Å
357	S	90.3	Very high	87.4	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-64.4	129	-176.5	179.1	0	0	0	0	112.8	E282 R359 F360 F361	E282-S357 VanDerWaalsContact OE2-CB 3.23Å; E282-S357 WeakPolarHBondContact OE2-CB 3.44Å; E282-S357 PolarHBondContact OE2-OG 3.32Å; S357-R359 PolarHBondContact O-N 3.34Å; S357-R359 PolarHBondContact OG-N 2.77Å; S357-F360 WeakPolarHBondContact O-CB 3.46Å; S357-F360 PolarHBondContact O-N 3.13Å; S357-F361 PolarHBondContact O-N 3.31Å
358	P	87.5	Confident	86.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-23.9	174.8	28	-33.8	0	0	0	112.4	Y152 F283 F361 L362 V373 L374	Y152-P358 HydrophobicContact CE2-CG 4.47Å; Y152-P358 WeakPolarHBondContact OH-CG 3.27Å; F283-P358 HydrophobicContact CE1-CG 4.04Å; F283-P358 HydrophobicContact CZ-CG 4.37Å; P358-F361 PolarHBondContact O-N 3.03Å; P358-L362 WeakPolarHBondContact O-CG 3.26Å; P358-L362 PolarHBondContact O-N 3.47Å; P358-V373 HydrophobicContact CB-CB 4.33Å; P358-V373 HydrophobicContact CB-CG1 4.13Å; P358-V373 HydrophobicContact CG-CG1 4.11Å; P358-L374 HydrophobicContact CB-CD1 4.28Å; P358-L374 HydrophobicContact CB-CD2 4.12Å; P358-L374 HydrophobicContact CB-CG 3.83Å; P358-L374 HydrophobicContact CG-CD2 3.98Å; P358-L374 HydrophobicContact CG-CG 4.23Å
359	R	83.6	Confident	86.5	Confident	17 Å²	17	40.8 Å²	40.8	6%	0.064	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-45.2	170.6	-84.8	-143.3	174	-167.8	-3.2	112	Y152 E282 S357 F361 L362 E363 S679 L741 Q742	Y152-R359 HydrophobicContact CD1-CG 4.26Å; Y152-R359 HydrophobicContact CD2-CG 4.43Å; Y152-R359 HydrophobicContact CE1-CG 3.7Å; Y152-R359 HydrophobicContact CE2-CG 3.92Å; E282-R359 HydrophobicContact CB-CB 4.43Å; E282-R359 HydrophobicContact CB-CG 4.37Å; E282-R359 HydrophobicContact CG-CB 4.23Å; E282-R359 HydrophobicContact CG-CG 4.28Å; S357-R359 PolarHBondContact O-N 3.34Å; S357-R359 PolarHBondContact OG-N 2.77Å; R359-F361 VanDerWaalsContact C-N 3.26Å; R359-F361 PolarHBondContact O-N 3Å; R359-L362 PolarHBondContact O-N 2.73Å; R359-L362 VanDerWaalsContact O-N 3.16Å; R359-E363 WeakPolarHBondContact O-CB 3.29Å; R359-E363 WeakPolarHBondContact O-CG 3.44Å; R359-E363 PolarHBondContact O-N 3.36Å; R359-S679 WeakPolarHBondContact CD-OG 3.24Å; R359-S679 PolarHBondContact NH1-OG 2.89Å; R359-L741 PolarHBondContact NH1-O 3.13Å; R359-L741 PolarHBondContact NH2-O 3.08Å; R359-Q742 PolarHBondContact NH1-O 3.3Å
360	F	85	Confident	86.1	Confident	17 Å²	17	38.9 Å²	38.9	8%	0.075	21%	0.213	C	C	.	.	H	α-helix	trans	-59.1	-38.7	176.1	172.2	-111.5	0	0	0	111.8	R228 G230 E356 S357 E363 N364	R228-F360 WeakPolarHBondContact O-CE2 3.24Å; R228-F360 WeakPolarHBondContact O-CZ 3.41Å; G230-F360 VanDerWaalsContact CA-CE1 3.47Å; E356-F360 HydrophobicContact CG-CD1 3.7Å; E356-F360 HydrophobicContact CG-CE1 4.13Å; S357-F360 WeakPolarHBondContact O-CB 3.46Å; S357-F360 PolarHBondContact O-N 3.13Å; F360-E363 PolarHBondContact O-N 3.13Å; F360-N364 WeakPolarHBondContact CD2-ND2 3.3Å; F360-N364 WeakPolarHBondContact CE1-ND2 3.44Å; F360-N364 WeakPolarHBondContact CE2-ND2 3.3Å; F360-N364 WeakPolarHBondContact CZ-ND2 3.38Å; F360-N364 WeakPolarHBondContact O-CB 3.4Å; F360-N364 VanDerWaalsContact O-CG 3.25Å; F360-N364 PolarHBondContact O-N 3.25Å; F360-N364 PolarHBondContact O-ND2 3.48Å
361	F	85.2	Confident	85.8	Confident	25 Å²	25	41.7 Å²	41.7	11%	0.11	22%	0.218	C	C	.	.	H	α-helix	trans	-67.2	-40.6	174.5	-68.9	-43.6	0	0	0	113.2	E356 S357 P358 R359 N364 G365 K366 E369 A370 V373	E356-F361 HydrophobicContact CB-CE1 4.49Å; E356-F361 HydrophobicContact CB-CE2 3.91Å; E356-F361 HydrophobicContact CB-CZ 3.69Å; E356-F361 HydrophobicContact CG-CE1 4.44Å; E356-F361 HydrophobicContact CG-CE2 4.48Å; E356-F361 HydrophobicContact CG-CZ 4.1Å; S357-F361 PolarHBondContact O-N 3.31Å; P358-F361 PolarHBondContact O-N 3.03Å; R359-F361 VanDerWaalsContact C-N 3.26Å; R359-F361 PolarHBondContact O-N 3Å; F361-N364 CarbonylContact O-C 3.57Å; F361-N364 PolarHBondContact O-N 2.94Å; F361-G365 PolarHBondContact O-N 3.47Å; F361-K366 HydrophobicContact CB-CB 4.15Å; F361-K366 HydrophobicContact CD1-CB 4.16Å; F361-K366 HydrophobicContact CD1-CD 3.95Å; F361-K366 HydrophobicContact CE1-CD 4.38Å; F361-K366 PolarHBondContact O-N 3.45Å; F361-E369 HydrophobicContact CB-CB 4.41Å; F361-E369 HydrophobicContact CD1-CB 3.96Å; F361-E369 HydrophobicContact CD2-CB 3.85Å; F361-E369 HydrophobicContact CE1-CB 4.08Å; F361-E369 WeakPolarHBondContact CE1-OE2 3.41Å; F361-E369 HydrophobicContact CE2-CB 3.97Å; F361-E369 HydrophobicContact CG-CB 3.84Å; F361-E369 HydrophobicContact CZ-CB 4.07Å; F361-A370 HydrophobicContact CB-CB 3.72Å; F361-V373 HydrophobicContact CD2-CG2 4.44Å; F361-V373 HydrophobicContact CE2-CG2 4.06Å
362	L	81.1	Confident	85.6	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.052	24%	0.243	C	C	.	.	H	α-helix	trans	-66	-38.5	173.9	-68	171.9	0	0	0	112.7	Y152 P358 R359 N364 G365 A370 I397 T399	Y152-L362 HydrophobicContact CD2-CD1 3.77Å; Y152-L362 HydrophobicContact CE2-CD1 4.14Å; P358-L362 WeakPolarHBondContact O-CG 3.26Å; P358-L362 PolarHBondContact O-N 3.47Å; R359-L362 PolarHBondContact O-N 2.73Å; R359-L362 VanDerWaalsContact O-N 3.16Å; L362-N364 VanDerWaalsContact C-N 3.31Å; L362-G365 PolarHBondContact O-N 3.48Å; L362-A370 HydrophobicContact CD2-CB 3.72Å; L362-A370 HydrophobicContact CG-CB 3.73Å; L362-I397 HydrophobicContact CD1-CD1 4.39Å; L362-I397 HydrophobicContact CD1-CG2 4.05Å; L362-I397 HydrophobicContact CD2-CB 4.05Å; L362-I397 HydrophobicContact CD2-CD1 4.04Å; L362-I397 HydrophobicContact CD2-CG2 3.72Å; L362-T399 HydrophobicContact CD2-CG2 4.16Å
363	E	75.1	Confident	85.5	Confident	47 Å²	47	43.7 Å²	43.7	22%	0.22	22%	0.224	C	C	.	.	H	α-helix	trans	-64.2	-35	174.7	-73	172.6	159.7	0	0	111.9	R231 R359 F360 S679 D680	R231-E363 IonicContact CZ-OE2 4Å; R231-E363 IonicContact NH1-OE2 3.22Å; R231-E363 IonicContact NH2-OE2 3.61Å; R231-E363 PolarHBondContact NH2-OE2 3.43Å; R359-E363 WeakPolarHBondContact O-CB 3.29Å; R359-E363 WeakPolarHBondContact O-CG 3.44Å; R359-E363 PolarHBondContact O-N 3.36Å; F360-E363 PolarHBondContact O-N 3.13Å; E363-S679 VanDerWaalsContact OE1-C 3.26Å; E363-S679 WeakPolarHBondContact OE1-CB 3.22Å; E363-S679 PolarHBondContact OE1-OG 3.05Å; E363-D680 PolarHBondContact OE1-N 3.49Å; E363-D680 VanDerWaalsContact OE1-N 3.14Å
364	N	76.9	Confident	85.4	Confident	69 Å²	69	39.3 Å²	39.3	37%	0.369	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	11.1	176.4	-66.1	-18.6	0	0	0	114.2	F360 F361 L362 K366	F360-N364 WeakPolarHBondContact CD2-ND2 3.3Å; F360-N364 WeakPolarHBondContact CE1-ND2 3.44Å; F360-N364 WeakPolarHBondContact CE2-ND2 3.3Å; F360-N364 WeakPolarHBondContact CZ-ND2 3.38Å; F360-N364 WeakPolarHBondContact O-CB 3.4Å; F360-N364 VanDerWaalsContact O-CG 3.25Å; F360-N364 PolarHBondContact O-N 3.25Å; F360-N364 PolarHBondContact O-ND2 3.48Å; F361-N364 CarbonylContact O-C 3.57Å; F361-N364 PolarHBondContact O-N 2.94Å; L362-N364 VanDerWaalsContact C-N 3.31Å; N364-K366 HydrophobicContact CB-CD 4.36Å; N364-K366 PolarHBondContact O-N 3.09Å
365	G	75	Confident	85.3	Confident	36 Å²	36	42.5 Å²	42.5	37%	0.371	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.8	13.4	-179.6	0	0	0	0	0	115.7	F361 L362 H367	F361-G365 PolarHBondContact O-N 3.47Å; L362-G365 PolarHBondContact O-N 3.48Å; G365-H367 VanDerWaalsContact C-ND1 3.29Å; G365-H367 PolarHBondContact O-CE1 2.63Å; G365-H367 PolarHBondContact O-N 3.2Å; G365-H367 PolarHBondContact O-ND1 2.69Å
366	K	81.9	Confident	85.1	Confident	89 Å²	89	46.2 Å²	46.2	39%	0.387	23%	0.227	S	C	.	.			trans	-88.5	81.9	179.1	-76.9	164.6	153.9	-86.5	0	111.2	F361 N364 E369 A370	F361-K366 HydrophobicContact CB-CB 4.15Å; F361-K366 HydrophobicContact CD1-CB 4.16Å; F361-K366 HydrophobicContact CD1-CD 3.95Å; F361-K366 HydrophobicContact CE1-CD 4.38Å; F361-K366 PolarHBondContact O-N 3.45Å; N364-K366 HydrophobicContact CB-CD 4.36Å; N364-K366 PolarHBondContact O-N 3.09Å; K366-E369 HydrophobicContact CB-CB 4.22Å; K366-E369 IonicContact NZ-OE1 3.75Å; K366-E369 PolarHBondContact NZ-OE1 2.96Å; K366-E369 IonicContact NZ-OE2 2.85Å; K366-E369 PolarHBondContact NZ-OE2 3.12Å; K366-A370 PolarHBondContact O-N 3.14Å; K366-A370 VanDerWaalsContact O-N 3.15Å
367	H	81.1	Confident	85	Confident	69 Å²	69	45.5 Å²	45.5	32%	0.319	22%	0.224	S	C	.	.	H	α-helix	trans	-67.9	-46.6	-168	-60.2	30.1	0	0	0	111.9	G365 A370 W371 T399	G365-H367 VanDerWaalsContact C-ND1 3.29Å; G365-H367 PolarHBondContact O-CE1 2.63Å; G365-H367 PolarHBondContact O-N 3.2Å; G365-H367 PolarHBondContact O-ND1 2.69Å; H367-A370 WeakPolarHBondContact O-CB 3.45Å; H367-A370 PolarHBondContact O-N 3.35Å; H367-W371 WeakPolarHBondContact O-CB 3.38Å; H367-W371 PolarHBondContact O-N 2.96Å; H367-T399 WeakPolarHBondContact CE1-CG2 3.43Å; H367-T399 PolarHBondContact CE1-OG1 2.71Å; H367-T399 WeakPolarHBondContact NE2-CG2 3.29Å; H367-T399 PolarHBondContact NE2-OG1 3.39Å
368	D	83.9	Confident	84.9	Confident	126 Å²	126	45.7 Å²	45.7	67%	0.674	22%	0.224	S	C	*	.	H	α-helix	trans	-67.9	-39.9	-177	-53.2	-46.4	0	0	0	112.2	W371 M372	D368-W371 PolarHBondContact O-N 2.75Å; D368-M372 HydrophobicContact CB-CE 4.49Å; D368-M372 WeakPolarHBondContact O-CB 3.4Å; D368-M372 VanDerWaalsContact O-CG 3.29Å; D368-M372 WeakPolarHBondContact O-CG 3.48Å; D368-M372 PolarHBondContact O-N 2.85Å
369	E	86.9	Confident	84.9	Confident	68 Å²	68	48.7 Å²	48.7	32%	0.318	24%	0.24	S	C	.	.	H	α-helix	trans	-63.4	-41.4	174.7	-72.8	166	-126.3	0	0	111.4	F361 K366 M372 V373	F361-E369 HydrophobicContact CB-CB 4.41Å; F361-E369 HydrophobicContact CD1-CB 3.96Å; F361-E369 HydrophobicContact CD2-CB 3.85Å; F361-E369 HydrophobicContact CE1-CB 4.08Å; F361-E369 WeakPolarHBondContact CE1-OE2 3.41Å; F361-E369 HydrophobicContact CE2-CB 3.97Å; F361-E369 HydrophobicContact CG-CB 3.84Å; F361-E369 HydrophobicContact CZ-CB 4.07Å; K366-E369 HydrophobicContact CB-CB 4.22Å; K366-E369 IonicContact NZ-OE1 3.75Å; K366-E369 PolarHBondContact NZ-OE1 2.96Å; K366-E369 IonicContact NZ-OE2 2.85Å; K366-E369 PolarHBondContact NZ-OE2 3.12Å; E369-M372 HydrophobicContact CG-CE 4.31Å; E369-V373 WeakPolarHBondContact O-CG2 3.44Å; E369-V373 PolarHBondContact O-N 3.02Å
370	A	86.6	Confident	85.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-46.2	173.1	0	0	0	0	0	112.2	F361 L362 K366 H367 V373 L374	F361-A370 HydrophobicContact CB-CB 3.72Å; L362-A370 HydrophobicContact CD2-CB 3.72Å; L362-A370 HydrophobicContact CG-CB 3.73Å; K366-A370 PolarHBondContact O-N 3.14Å; K366-A370 VanDerWaalsContact O-N 3.15Å; H367-A370 WeakPolarHBondContact O-CB 3.45Å; H367-A370 PolarHBondContact O-N 3.35Å; A370-V373 PolarHBondContact O-N 3.44Å; A370-L374 WeakPolarHBondContact O-CG 3.06Å; A370-L374 PolarHBondContact O-N 3.46Å
371	W	87.5	Confident	85.3	Confident	84 Å²	84	49.7 Å²	49.7	32%	0.318	25%	0.25	S	C	.	.	H	α-helix	trans	-66.1	-44.5	-178	-173.8	91.4	0	0	0	112.3	H367 D368 V373 L374 K375 F392 V394	H367-W371 WeakPolarHBondContact O-CB 3.38Å; H367-W371 PolarHBondContact O-N 2.96Å; D368-W371 PolarHBondContact O-N 2.75Å; W371-V373 VanDerWaalsContact C-N 3.32Å; W371-V373 PolarHBondContact O-N 3.04Å; W371-L374 PolarHBondContact O-N 3.17Å; W371-K375 HydrophobicContact CE3-CD 4.48Å; W371-K375 HydrophobicContact CH2-CD 3.56Å; W371-K375 HydrophobicContact CZ2-CD 4.19Å; W371-K375 HydrophobicContact CZ3-CD 3.72Å; W371-K375 WeakPolarHBondContact O-CB 3.32Å; W371-K375 PolarHBondContact O-N 3.26Å; W371-F392 AromaticContact CD1-CE1 3.83Å; W371-F392 HydrophobicContact CZ2-CD1 4.33Å; W371-F392 AromaticContact NE1-CD1 3.73Å; W371-F392 AromaticContact NE1-CE1 3.55Å; W371-V394 PolarHBondContact NE1-O 3.18Å
372	M	88.8	Confident	85.4	Confident	109 Å²	109	49.2 Å²	49.2	54%	0.537	25%	0.248	S	C	.	.	H	α-helix	trans	-58.4	-42.2	175.6	-76.9	-171.5	-71.9	0	0	111.9	D368 E369 Q376	D368-M372 HydrophobicContact CB-CE 4.49Å; D368-M372 WeakPolarHBondContact O-CB 3.4Å; D368-M372 VanDerWaalsContact O-CG 3.29Å; D368-M372 WeakPolarHBondContact O-CG 3.48Å; D368-M372 PolarHBondContact O-N 2.85Å; E369-M372 HydrophobicContact CG-CE 4.31Å; M372-Q376 WeakPolarHBondContact O-CB 3.36Å; M372-Q376 PolarHBondContact O-N 3.41Å
373	V	90.6	Very high	85.6	Confident	12 Å²	12	58.4 Å²	58.4	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-67.7	-45.2	176.5	172.8	0	0	0	0	111.4	F283 P355 P358 F361 E369 A370 W371 K375 Q376 V377	F283-V373 HydrophobicContact CE1-CG1 3.98Å; F283-V373 HydrophobicContact CZ-CG1 4.33Å; P355-V373 HydrophobicContact CB-CB 4.43Å; P355-V373 HydrophobicContact CB-CG1 3.86Å; P355-V373 HydrophobicContact CB-CG2 3.7Å; P355-V373 HydrophobicContact CG-CG1 3.87Å; P358-V373 HydrophobicContact CB-CB 4.33Å; P358-V373 HydrophobicContact CB-CG1 4.13Å; P358-V373 HydrophobicContact CG-CG1 4.11Å; F361-V373 HydrophobicContact CD2-CG2 4.44Å; F361-V373 HydrophobicContact CE2-CG2 4.06Å; E369-V373 WeakPolarHBondContact O-CG2 3.44Å; E369-V373 PolarHBondContact O-N 3.02Å; A370-V373 PolarHBondContact O-N 3.44Å; W371-V373 VanDerWaalsContact C-N 3.32Å; W371-V373 PolarHBondContact O-N 3.04Å; V373-K375 VanDerWaalsContact C-N 3.34Å; V373-K375 PolarHBondContact O-N 2.93Å; V373-Q376 WeakPolarHBondContact O-CB 3.31Å; V373-Q376 PolarHBondContact O-N 3.37Å; V373-V377 WeakPolarHBondContact O-CG2 3.39Å; V373-V377 PolarHBondContact O-N 2.81Å
374	L	89.6	Confident	85.9	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-61.5	-42.6	178.1	-72.3	164.2	0	0	0	111.8	Y152 I155 L156 P358 A370 W371 V377 H378 F392 I397	Y152-L374 HydrophobicContact CE2-CD1 4.47Å; Y152-L374 HydrophobicContact CE2-CD2 4.16Å; I155-L374 HydrophobicContact CG2-CD1 4.22Å; I155-L374 HydrophobicContact CG2-CD2 4.23Å; L156-L374 HydrophobicContact CD2-CD2 4.44Å; P358-L374 HydrophobicContact CB-CD1 4.28Å; P358-L374 HydrophobicContact CB-CD2 4.12Å; P358-L374 HydrophobicContact CB-CG 3.83Å; P358-L374 HydrophobicContact CG-CD2 3.98Å; P358-L374 HydrophobicContact CG-CG 4.23Å; A370-L374 WeakPolarHBondContact O-CG 3.06Å; A370-L374 PolarHBondContact O-N 3.46Å; W371-L374 PolarHBondContact O-N 3.17Å; L374-V377 PolarHBondContact O-N 2.95Å; L374-H378 WeakPolarHBondContact O-CB 3.39Å; L374-H378 PolarHBondContact O-N 3.49Å; L374-F392 HydrophobicContact CB-CE1 4.42Å; L374-F392 HydrophobicContact CB-CZ 3.86Å; L374-I397 HydrophobicContact CD1-CD1 3.8Å
375	K	89	Confident	86.2	Confident	81 Å²	81	58.9 Å²	58.9	35%	0.352	29%	0.285	S	S	.	.	H	α-helix	trans	-61.3	-44.8	171.9	179.7	172.5	176.2	179.2	0	112.1	W371 V373 V377 H378 D379 F392	W371-K375 HydrophobicContact CE3-CD 4.48Å; W371-K375 HydrophobicContact CH2-CD 3.56Å; W371-K375 HydrophobicContact CZ2-CD 4.19Å; W371-K375 HydrophobicContact CZ3-CD 3.72Å; W371-K375 WeakPolarHBondContact O-CB 3.32Å; W371-K375 PolarHBondContact O-N 3.26Å; V373-K375 VanDerWaalsContact C-N 3.34Å; V373-K375 PolarHBondContact O-N 2.93Å; K375-V377 VanDerWaalsContact C-N 3.28Å; K375-V377 PolarHBondContact O-N 3.2Å; K375-H378 PolarHBondContact O-N 2.93Å; K375-D379 WeakPolarHBondContact CE-OD2 3.41Å; K375-D379 WeakPolarHBondContact CG-OD2 3.41Å; K375-D379 WeakPolarHBondContact O-CB 3.02Å; K375-D379 VanDerWaalsContact O-CG 3.24Å; K375-D379 PolarHBondContact O-N 3.11Å; K375-F392 HydrophobicContact CB-CD1 4.39Å
376	Q	89.8	Confident	86.3	Confident	94 Å²	94	59.7 Å²	59.7	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-57.5	-40.9	176.1	-172.4	-172.2	14	0	0	111.9	M372 V373 T380	M372-Q376 WeakPolarHBondContact O-CB 3.36Å; M372-Q376 PolarHBondContact O-N 3.41Å; V373-Q376 WeakPolarHBondContact O-CB 3.31Å; V373-Q376 PolarHBondContact O-N 3.37Å; Q376-T380 WeakPolarHBondContact O-CB 3.42Å; Q376-T380 PolarHBondContact O-N 2.9Å; Q376-T380 VanDerWaalsContact O-N 3.1Å; Q376-T380 PolarHBondContact O-OG1 2.95Å
377	V	89.9	Confident	86.2	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.006	29%	0.294	C	S	.	.	H	α-helix	trans	-65.7	-49.7	175.8	176.5	0	0	0	0	110.9	C159 F164 F283 V373 L374 K375 N381	C159-V377 HydrophobicContact CB-CG1 4.3Å; F164-V377 HydrophobicContact CB-CG1 4.28Å; F164-V377 HydrophobicContact CD1-CB 4.34Å; F164-V377 HydrophobicContact CD1-CG1 3.94Å; F164-V377 HydrophobicContact CD1-CG2 3.68Å; F164-V377 HydrophobicContact CD2-CG2 4.07Å; F164-V377 HydrophobicContact CE1-CG2 3.62Å; F164-V377 HydrophobicContact CE2-CG2 3.99Å; F164-V377 HydrophobicContact CG-CB 4.33Å; F164-V377 HydrophobicContact CG-CG1 4.13Å; F164-V377 HydrophobicContact CG-CG2 3.92Å; F164-V377 HydrophobicContact CZ-CG2 3.78Å; F283-V377 HydrophobicContact CD1-CG2 4.02Å; F283-V377 HydrophobicContact CE1-CG2 3.98Å; V373-V377 WeakPolarHBondContact O-CG2 3.39Å; V373-V377 PolarHBondContact O-N 2.81Å; L374-V377 PolarHBondContact O-N 2.95Å; K375-V377 VanDerWaalsContact C-N 3.28Å; K375-V377 PolarHBondContact O-N 3.2Å; V377-N381 WeakPolarHBondContact O-CB 3.38Å; V377-N381 VanDerWaalsContact O-CG 3.25Å; V377-N381 PolarHBondContact O-N 3.02Å; V377-N381 PolarHBondContact O-ND2 3.01Å
378	H	88.8	Confident	85.8	Confident	3 Å²	3	60.7 Å²	60.7	1%	0.014	31%	0.308	C	S	.	.	H	α-helix	trans	-55.5	-56.4	177	171.4	-87.6	0	0	0	111.4	C159 L374 K375 T380 N381 M382 R390 F392	C159-H378 HydrophobicContact CB-CB 4.35Å; L374-H378 WeakPolarHBondContact O-CB 3.39Å; L374-H378 PolarHBondContact O-N 3.49Å; K375-H378 PolarHBondContact O-N 2.93Å; H378-T380 VanDerWaalsContact C-N 3.35Å; H378-T380 PolarHBondContact O-N 3.45Å; H378-N381 CarbonylContact O-C 3.53Å; H378-N381 WeakPolarHBondContact O-CA 3.22Å; H378-N381 PolarHBondContact O-N 2.7Å; H378-M382 WeakPolarHBondContact NE2-CG 3.48Å; H378-M382 WeakPolarHBondContact O-CG 3.47Å; H378-M382 PolarHBondContact O-N 3.39Å; H378-R390 PolarHBondContact CE1-O 2.91Å; H378-F392 HydrophobicContact CB-CD2 3.97Å; H378-F392 HydrophobicContact CB-CE2 4.5Å; H378-F392 AromaticContact CG-CD2 3.9Å
379	D	87.3	Confident	84.6	Confident	64 Å²	64	60.5 Å²	60.5	34%	0.342	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-39.4	-173.6	-64.5	-3.2	0	0	0	111	K375 N381 R383	K375-D379 WeakPolarHBondContact CE-OD2 3.41Å; K375-D379 WeakPolarHBondContact CG-OD2 3.41Å; K375-D379 WeakPolarHBondContact O-CB 3.02Å; K375-D379 VanDerWaalsContact O-CG 3.24Å; K375-D379 PolarHBondContact O-N 3.11Å; D379-N381 VanDerWaalsContact C-N 3.28Å; D379-N381 PolarHBondContact O-N 3.39Å; D379-R383 WeakPolarHBondContact O-CB 3.35Å; D379-R383 PolarHBondContact O-N 2.85Å
380	T	87.6	Confident	83.7	Confident	55 Å²	55	64 Å²	64	34%	0.337	31%	0.313	S	S	.	.	H	α-helix	trans	-59.8	-39.3	172.4	-61.4	0	0	0	0	111.7	R163 F164 Q376 H378 A384	R163-T380 HydrophobicContact CB-CG2 4.45Å; F164-T380 HydrophobicContact CB-CG2 3.99Å; Q376-T380 WeakPolarHBondContact O-CB 3.42Å; Q376-T380 PolarHBondContact O-N 2.9Å; Q376-T380 VanDerWaalsContact O-N 3.1Å; Q376-T380 PolarHBondContact O-OG1 2.95Å; H378-T380 VanDerWaalsContact C-N 3.35Å; H378-T380 PolarHBondContact O-N 3.45Å; T380-A384 WeakPolarHBondContact O-CB 3.21Å; T380-A384 PolarHBondContact O-N 3.34Å
381	N	89.3	Confident	82.8	Confident	0 Å²	0	70 Å²	70	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-79.9	-36.5	-177.4	-76	-16.3	0	0	0	113.4	G160 G162 R163 F164 Q165 V377 H378 D379 A384 K385	G160-N381 PolarHBondContact O-ND2 3.22Å; G162-N381 WeakPolarHBondContact CA-OD1 3.48Å; R163-N381 PolarHBondContact N-OD1 3.39Å; F164-N381 WeakPolarHBondContact CB-OD1 3.48Å; F164-N381 PolarHBondContact N-OD1 2.95Å; Q165-N381 PolarHBondContact NE2-ND2 3.2Å; Q165-N381 PolarHBondContact OE1-ND2 3.47Å; V377-N381 WeakPolarHBondContact O-CB 3.38Å; V377-N381 VanDerWaalsContact O-CG 3.25Å; V377-N381 PolarHBondContact O-N 3.02Å; V377-N381 PolarHBondContact O-ND2 3.01Å; H378-N381 CarbonylContact O-C 3.53Å; H378-N381 WeakPolarHBondContact O-CA 3.22Å; H378-N381 PolarHBondContact O-N 2.7Å; D379-N381 VanDerWaalsContact C-N 3.28Å; D379-N381 PolarHBondContact O-N 3.39Å; N381-A384 PolarHBondContact O-N 3.43Å; N381-K385 WeakPolarHBondContact O-CD 3.48Å; N381-K385 VanDerWaalsContact O-CG 3.29Å; N381-K385 WeakPolarHBondContact O-CG 3.16Å; N381-K385 PolarHBondContact O-N 2.82Å
382	M	85.7	Confident	82.2	Confident	14 Å²	14	66.7 Å²	66.7	7%	0.069	34%	0.337	C	S	.	.	H	α-helix	trans	-76.9	-40.5	178	-61.7	-50.8	178	0	0	111.8	E158 H378 A384 K385 G386 H387 R390	E158-M382 WeakPolarHBondContact O-CE 3.49Å; H378-M382 WeakPolarHBondContact NE2-CG 3.48Å; H378-M382 WeakPolarHBondContact O-CG 3.47Å; H378-M382 PolarHBondContact O-N 3.39Å; M382-A384 PolarHBondContact O-N 3.13Å; M382-K385 PolarHBondContact O-N 3.13Å; M382-K385 HydrophobicContact SD-CD 4.05Å; M382-G386 PolarHBondContact O-N 3.4Å; M382-G386 VanDerWaalsContact O-N 3.1Å; M382-H387 WeakPolarHBondContact CB-O 3.47Å; M382-H387 PolarHBondContact O-N 2.9Å; M382-R390 HydrophobicContact CG-CB 4.47Å
383	R	85.5	Confident	81.1	Confident	203 Å²	203	65.5 Å²	65.5	77%	0.766	34%	0.339	S	S	*	.	H	α-helix	trans	-60.7	-31	170	-165.5	176.9	-167.2	173.1	6.2	112.2	D379	D379-R383 WeakPolarHBondContact O-CB 3.35Å; D379-R383 PolarHBondContact O-N 2.85Å
384	A	82.3	Confident	80.2	Confident	27 Å²	27	65.8 Å²	65.8	22%	0.223	34%	0.341	C	S	.	.	H	α-helix	trans	-74.1	-25.3	173	0	0	0	0	0	114.6	R163 T380 N381 M382	R163-A384 HydrophobicContact CB-CB 3.93Å; R163-A384 HydrophobicContact CG-CB 3.58Å; T380-A384 WeakPolarHBondContact O-CB 3.21Å; T380-A384 PolarHBondContact O-N 3.34Å; N381-A384 PolarHBondContact O-N 3.43Å; M382-A384 PolarHBondContact O-N 3.13Å
385	K	82.8	Confident	78.8	Confident	99 Å²	99	72.1 Å²	72.1	43%	0.43	38%	0.38	S	S	.	.	H	α-helix	trans	-88.5	-9.6	177	-72.3	164	-174.4	164.5	0	113.4	H161 N381 M382	H161-K385 WeakPolarHBondContact O-CE 3.43Å; H161-K385 PolarHBondContact O-NZ 3.19Å; N381-K385 WeakPolarHBondContact O-CD 3.48Å; N381-K385 VanDerWaalsContact O-CG 3.29Å; N381-K385 WeakPolarHBondContact O-CG 3.16Å; N381-K385 PolarHBondContact O-N 2.82Å; M382-K385 PolarHBondContact O-N 3.13Å; M382-K385 HydrophobicContact SD-CD 4.05Å
386	G	78.3	Confident	77.4	Confident	53 Å²	53	74.6 Å²	74.6	55%	0.546	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	18.7	-175.9	0	0	0	0	0	114.5	M382 P388	M382-G386 PolarHBondContact O-N 3.4Å; M382-G386 VanDerWaalsContact O-N 3.1Å; G386-P388 WeakPolarHBondContact O-CD 3.31Å
387	H	79.6	Confident	76.4	Confident	86 Å²	86	70.6 Å²	70.6	40%	0.398	37%	0.374	S	S	.	.			trans	-121.7	55.3	180	-73.3	-63.1	0	0	0	112.9	M382 E389 R390	M382-H387 WeakPolarHBondContact CB-O 3.47Å; M382-H387 PolarHBondContact O-N 2.9Å; H387-E389 WeakPolarHBondContact CA-OE1 3.25Å; H387-E389 VanDerWaalsContact CA-OE2 3.26Å; H387-E389 WeakPolarHBondContact CA-OE2 3.41Å; H387-E389 WeakPolarHBondContact CB-OE1 3.39Å; H387-E389 IonicContact CE1-OE1 2.8Å; H387-E389 IonicContact CG-OE1 3.7Å; H387-E389 IonicContact ND1-OE1 3.22Å; H387-E389 PolarHBondContact ND1-OE1 3.02Å; H387-E389 PolarHBondContact O-N 3.09Å; H387-E389 VanDerWaalsContact O-N 3.16Å; H387-R390 HydrophobicContact CB-CG 4.38Å; H387-R390 PolarHBondContact O-N 2.99Å
388	P	71.4	Confident	75.1	Confident	93 Å²	93	76.2 Å²	76.2	60%	0.604	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-17.1	-180	30.4	-38.1	0	0	0	114.2	G386 R390	G386-P388 WeakPolarHBondContact O-CD 3.31Å; P388-R390 VanDerWaalsContact C-N 3.3Å; P388-R390 PolarHBondContact O-N 3.41Å
389	E	59.2	Low	73.6	Confident	122 Å²	122	78.5 Å²	78.5	57%	0.57	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.7	-179.1	70.8	-71.2	163.9	0	0	115	H387 V391	H387-E389 WeakPolarHBondContact CA-OE1 3.25Å; H387-E389 VanDerWaalsContact CA-OE2 3.26Å; H387-E389 WeakPolarHBondContact CA-OE2 3.41Å; H387-E389 WeakPolarHBondContact CB-OE1 3.39Å; H387-E389 IonicContact CE1-OE1 2.8Å; H387-E389 IonicContact CG-OE1 3.7Å; H387-E389 IonicContact ND1-OE1 3.22Å; H387-E389 PolarHBondContact ND1-OE1 3.02Å; H387-E389 PolarHBondContact O-N 3.09Å; H387-E389 VanDerWaalsContact O-N 3.16Å; E389-V391 PolarHBondContact O-N 3.43Å
390	R	67.7	Low	72.2	Confident	142 Å²	142	78 Å²	78	54%	0.536	41%	0.41	S	S	.	.			trans	-73.6	123.8	175.3	-69.8	-173.7	177.1	-139.3	-3.4	110	H378 M382 H387 P388	H378-R390 PolarHBondContact CE1-O 2.91Å; M382-R390 HydrophobicContact CG-CB 4.47Å; H387-R390 HydrophobicContact CB-CG 4.38Å; H387-R390 PolarHBondContact O-N 2.99Å; P388-R390 VanDerWaalsContact C-N 3.3Å; P388-R390 PolarHBondContact O-N 3.41Å
391	V	68.1	Low	70.3	Confident	127 Å²	127	84.8 Å²	84.8	77%	0.77	44%	0.437	S	S	*	.			trans	-88	133.9	172.4	-176.2	0	0	0	0	109.1	E389 S393	E389-V391 PolarHBondContact O-N 3.43Å; V391-S393 PolarHBondContact O-N 3.29Å
392	F	75	Confident	68.5	Low	14 Å²	14	89.1 Å²	89.1	6%	0.061	46%	0.457	C	S	.	.			trans	-63.9	113.2	170.8	-176.7	-117.7	0	0	0	109.6	I155 W371 L374 K375 H378 V394	I155-F392 HydrophobicContact CG2-CE2 3.76Å; I155-F392 HydrophobicContact CG2-CZ 3.63Å; W371-F392 AromaticContact CD1-CE1 3.83Å; W371-F392 HydrophobicContact CZ2-CD1 4.33Å; W371-F392 AromaticContact NE1-CD1 3.73Å; W371-F392 AromaticContact NE1-CE1 3.55Å; L374-F392 HydrophobicContact CB-CE1 4.42Å; L374-F392 HydrophobicContact CB-CZ 3.86Å; K375-F392 HydrophobicContact CB-CD1 4.39Å; H378-F392 HydrophobicContact CB-CD2 3.97Å; H378-F392 HydrophobicContact CB-CE2 4.5Å; H378-F392 AromaticContact CG-CD2 3.9Å; F392-V394 VanDerWaalsContact C-N 3.3Å; F392-V394 HydrophobicContact CD1-CB 4.39Å; F392-V394 HydrophobicContact CE1-CB 3.87Å; F392-V394 HydrophobicContact CE2-CB 4.42Å; F392-V394 HydrophobicContact CE2-CG2 4.27Å; F392-V394 HydrophobicContact CZ-CB 3.88Å; F392-V394 HydrophobicContact CZ-CG2 4.17Å; F392-V394 PolarHBondContact O-N 3.22Å
393	S	65.3	Low	66.7	Low	83 Å²	83	97.1 Å²	97.1	58%	0.58	50%	0.495	S	S	*	.			trans	-80.4	-8.3	-165.4	69.3	0	0	0	0	114.9	E158 V391	E158-S393 VanDerWaalsContact OE1-CB 3.29Å; E158-S393 WeakPolarHBondContact OE1-CB 3.35Å; E158-S393 PolarHBondContact OE1-N 3.05Å; E158-S393 PolarHBondContact OE1-OG 2.8Å; E158-S393 PolarHBondContact OE2-OG 3.02Å; E158-S393 VanDerWaalsContact OE2-OG 3.06Å; V391-S393 PolarHBondContact O-N 3.29Å
394	V	71.3	Confident	64.9	Low	19 Å²	19	90 Å²	90	12%	0.115	47%	0.472	C	S	.	.			trans	-90.7	109.7	-169.3	-178.8	0	0	0	0	109.9	I155 E158 W371 F392 I397	I155-V394 HydrophobicContact CD1-CG1 3.85Å; I155-V394 HydrophobicContact CG1-CG1 4.05Å; I155-V394 HydrophobicContact CG1-CG2 3.86Å; I155-V394 HydrophobicContact CG2-CG2 4.39Å; E158-V394 WeakPolarHBondContact OE2-CG2 3.39Å; W371-V394 PolarHBondContact NE1-O 3.18Å; F392-V394 VanDerWaalsContact C-N 3.3Å; F392-V394 HydrophobicContact CD1-CB 4.39Å; F392-V394 HydrophobicContact CE1-CB 3.87Å; F392-V394 HydrophobicContact CE2-CB 4.42Å; F392-V394 HydrophobicContact CE2-CG2 4.27Å; F392-V394 HydrophobicContact CZ-CB 3.88Å; F392-V394 HydrophobicContact CZ-CG2 4.17Å; F392-V394 PolarHBondContact O-N 3.22Å; V394-I397 HydrophobicContact CG1-CG1 4.07Å
395	T	61	Low	63.3	Low	134 Å²	134	95.9 Å²	95.9	82%	0.822	50%	0.495	S	S	*	.			trans	-96.3	-30.5	-178.6	52.4	0	0	0	0	114.2
396	H	59.4	Low	61.6	Low	134 Å²	134	98 Å²	98	62%	0.62	51%	0.51	S	S	*	.			trans	-141	134.7	-179.3	-158.8	-62.3	0	0	0	111.3	Q151	Q151-H396 PolarHBondContact NE2-O 2.88Å; Q151-H396 VanDerWaalsContact NE2-O 3.1Å
397	I	69.3	Low	60.3	Low	10 Å²	10	99 Å²	99	5%	0.051	50%	0.502	C	S	.	.			trans	-109	132.6	175.6	-54.5	175.3	0	0	0	107.2	L148 I155 L362 L374 V394	L148-I397 HydrophobicContact CD1-CG2 3.87Å; I155-I397 HydrophobicContact CD1-CD1 3.95Å; I155-I397 HydrophobicContact CD1-CG1 3.96Å; L362-I397 HydrophobicContact CD1-CD1 4.39Å; L362-I397 HydrophobicContact CD1-CG2 4.05Å; L362-I397 HydrophobicContact CD2-CB 4.05Å; L362-I397 HydrophobicContact CD2-CD1 4.04Å; L362-I397 HydrophobicContact CD2-CG2 3.72Å; L374-I397 HydrophobicContact CD1-CD1 3.8Å; V394-I397 HydrophobicContact CG1-CG1 4.07Å
398	K	62.1	Low	59.1	Low	119 Å²	119	101.6 Å²	101.6	52%	0.517	51%	0.514	S	S	.	.			trans	-64.9	145.3	172.7	-73	-171.2	-178.3	-174.8	0	109.4	E147 L148	E147-K398 IonicContact OE2-NZ 2.8Å; E147-K398 PolarHBondContact OE2-NZ 3.01Å; L148-K398 WeakPolarHBondContact CD1-O 3.44Å
399	T	58.4	Low	58.2	Low	50 Å²	50	103.2 Å²	103.2	31%	0.307	52%	0.517	S	S	.	.			trans	-135.6	166.8	178.8	51.4	0	0	0	0	111.2	L362 H367	L362-T399 HydrophobicContact CD2-CG2 4.16Å; H367-T399 WeakPolarHBondContact CE1-CG2 3.43Å; H367-T399 PolarHBondContact CE1-OG1 2.71Å; H367-T399 WeakPolarHBondContact NE2-CG2 3.29Å; H367-T399 PolarHBondContact NE2-OG1 3.39Å
400	I	57.3	Low	57.8	Low	55 Å²	55	104.6 Å²	104.6	28%	0.282	52%	0.523	S	S	.	.			trans	-109.1	118	-179.4	-59.1	167.5	0	0	0	106.1	R145 L148 Q402	R145-I400 HydrophobicContact CG-CD1 3.45Å; R145-I400 VanDerWaalsContact CG-CD1 3.45Å; L148-I400 HydrophobicContact CD2-CD1 4.32Å; L148-I400 HydrophobicContact CD2-CG1 4.44Å; I400-Q402 PolarHBondContact O-N 3.44Å
401	H	47	Very low	57	Low	197 Å²	197	98.2 Å²	98.2	91%	0.912	50%	0.5	S	S	*	.			trans	-60.3	131.7	169.4	-95.7	-60.1	0	0	0	109.5
402	Q	52.4	Low	56.5	Low	91 Å²	91	96 Å²	96	43%	0.425	48%	0.484	S	S	.	.			trans	-123.5	137	178.7	-167.8	163.3	-70	0	0	110.3	I400 D404	I400-Q402 PolarHBondContact O-N 3.44Å; Q402-D404 PolarHBondContact NE2-OD2 3.44Å; Q402-D404 PolarHBondContact O-N 3.25Å
403	E	46.6	Very low	55.6	Low	182 Å²	182	101.4 Å²	101.4	85%	0.85	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	15.5	-164.9	-57	168.8	131.1	0	0	114.5	E405	E403-E405 VanDerWaalsContact C-N 3.33Å; E403-E405 PolarHBondContact O-N 2.86Å
404	D	48	Very low	55.6	Low	54 Å²	54	98.7 Å²	98.7	29%	0.289	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-12.4	-170.1	-82.5	-57.3	0	0	0	114.2	R228 Q402 L406 I407 Q430	R228-D404 IonicContact NH1-OD2 2.8Å; Q402-D404 PolarHBondContact NE2-OD2 3.44Å; Q402-D404 PolarHBondContact O-N 3.25Å; D404-L406 PolarHBondContact O-N 3.43Å; D404-L406 VanDerWaalsContact O-N 3.15Å; D404-I407 WeakPolarHBondContact O-CB 3.24Å; D404-I407 PolarHBondContact O-N 2.86Å; D404-Q430 PolarHBondContact OD1-NE2 3.5Å
405	E	49.8	Very low	56	Low	150 Å²	150	101.9 Å²	101.9	70%	0.701	52%	0.523	S	S	*	.	H	α-helix	trans	-52.5	-37.3	179.2	-69.6	-172.7	140.8	0	0	113.3	E403 I407 E408 I409	E403-E405 VanDerWaalsContact C-N 3.33Å; E403-E405 PolarHBondContact O-N 2.86Å; E405-I407 PolarHBondContact O-N 3.31Å; E405-E408 PolarHBondContact O-N 3.35Å; E405-I409 WeakPolarHBondContact O-CG1 3.36Å; E405-I409 PolarHBondContact O-N 3.49Å
406	L	46.9	Very low	56.9	Low	143 Å²	143	103.6 Å²	103.6	75%	0.749	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-28.1	178.9	-107.2	77.3	0	0	0	113.2	D404	D404-L406 PolarHBondContact O-N 3.43Å; D404-L406 VanDerWaalsContact O-N 3.15Å
407	I	51.4	Low	57.9	Low	73 Å²	73	104.8 Å²	104.8	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-80.2	-36.1	-178.4	-55.5	-177.8	0	0	0	110.3	D404 E405 Q410 S411	D404-I407 WeakPolarHBondContact O-CB 3.24Å; D404-I407 PolarHBondContact O-N 2.86Å; E405-I407 PolarHBondContact O-N 3.31Å; I407-Q410 PolarHBondContact O-N 3.36Å; I407-S411 PolarHBondContact O-N 3.37Å
408	E	53.4	Low	58.3	Low	141 Å²	141	109.8 Å²	109.8	66%	0.659	54%	0.538	S	S	*	.	H	α-helix	trans	-67	-46.1	-177.5	-164.5	154.3	-127.7	0	0	111.1	E405 Q410 S411	E405-E408 PolarHBondContact O-N 3.35Å; E408-Q410 VanDerWaalsContact C-N 3.31Å; E408-Q410 PolarHBondContact O-N 2.77Å; E408-S411 WeakPolarHBondContact O-CB 3.41Å; E408-S411 PolarHBondContact O-N 2.87Å; E408-S411 PolarHBondContact O-OG 3.37Å
409	I	52.1	Low	59	Low	128 Å²	128	108.6 Å²	108.6	66%	0.656	53%	0.53	S	S	*	.	H	α-helix	trans	-56.2	-40.4	176.9	-63.4	166.2	0	0	0	112.2	E405 S411	E405-I409 WeakPolarHBondContact O-CG1 3.36Å; E405-I409 PolarHBondContact O-N 3.49Å; I409-S411 VanDerWaalsContact C-N 3.26Å; I409-S411 PolarHBondContact O-N 3.15Å
410	Q	50.5	Low	60	Low	150 Å²	150	114.9 Å²	114.9	70%	0.701	55%	0.548	S	S	*	.	H	α-helix	trans	-75.1	-15.4	179.1	-162.4	171.1	17.5	0	0	112.8	I407 E408	I407-Q410 PolarHBondContact O-N 3.36Å; E408-Q410 VanDerWaalsContact C-N 3.31Å; E408-Q410 PolarHBondContact O-N 2.77Å
411	S	52.6	Low	61	Low	9 Å²	9	113.8 Å²	113.8	6%	0.063	55%	0.551	C	S	.	*	H	α-helix	trans	-82.7	-16.7	-172.9	82.6	0	0	0	0	115	I407 E408 I409 R419 R423	I407-S411 PolarHBondContact O-N 3.37Å; E408-S411 WeakPolarHBondContact O-CB 3.41Å; E408-S411 PolarHBondContact O-N 2.87Å; E408-S411 PolarHBondContact O-OG 3.37Å; I409-S411 VanDerWaalsContact C-N 3.26Å; I409-S411 PolarHBondContact O-N 3.15Å; S411-R419 VanDerWaalsContact O-CD 3.28Å; S411-R419 WeakPolarHBondContact O-CD 3.22Å; S411-R419 WeakPolarHBondContact O-CG 3.49Å; S411-R423 PolarHBondContact OG-NE 3.19Å; S411-R423 PolarHBondContact OG-NH2 3.39Å
412	D	55.9	Low	62.6	Low	81 Å²	81	108 Å²	108	43%	0.433	53%	0.529	S	S	.	.	S	Bend	trans	-100	-7.8	-175.4	-85.8	-29.5	0	0	0	115.7	G414 R419 R423	D412-G414 PolarHBondContact O-N 3.19Å; D412-R419 PolarHBondContact O-NE 3.07Å; D412-R419 PolarHBondContact O-NH2 3.42Å; D412-R419 IonicContact OD1-CZ 3.44Å; D412-R419 IonicContact OD1-NH1 3.57Å; D412-R419 PolarHBondContact OD1-NH1 3.13Å; D412-R423 IonicContact OD1-NH2 3.28Å; D412-R423 PolarHBondContact OD1-NH2 3.17Å
413	T	57.5	Low	63.9	Low	127 Å²	127	108.7 Å²	108.7	78%	0.779	53%	0.528	S	S	*	.	S	Bend	trans	-90.3	10.4	-175.4	51.4	0	0	0	0	115
414	G	64.8	Low	65.6	Low	26 Å²	26	102.1 Å²	102.1	27%	0.268	50%	0.504	S	S	.	.	S	Bend	trans	-114.8	171.9	-179	0	0	0	0	0	115.8	D412 R419	D412-G414 PolarHBondContact O-N 3.19Å; G414-R419 WeakPolarHBondContact O-CG 3.34Å; G414-R419 PolarHBondContact O-NE 2.88Å
415	T	80.5	Confident	67.2	Low	85 Å²	85	106.2 Å²	106.2	52%	0.521	53%	0.525	S	S	.	.			trans	-69.7	157.6	167.9	64.2	0	0	0	0	111.2	Y417 Q418 R419	T415-Y417 VanDerWaalsContact C-N 3.34Å; T415-Y417 PolarHBondContact O-N 3.42Å; T415-Q418 CarbonylContact O-C 3.57Å; T415-Q418 WeakPolarHBondContact O-CA 3.34Å; T415-Q418 WeakPolarHBondContact O-CB 3.46Å; T415-Q418 PolarHBondContact O-N 3.18Å; T415-Q418 VanDerWaalsContact OG1-CD 3.24Å; T415-Q418 WeakPolarHBondContact OG1-CG 3.46Å; T415-Q418 PolarHBondContact OG1-OE1 3.45Å; T415-R419 WeakPolarHBondContact O-CG 3.4Å; T415-R419 PolarHBondContact O-N 3.04Å
416	W	79.3	Confident	68.8	Low	170 Å²	170	100.7 Å²	100.7	64%	0.644	50%	0.503	S	S	*	.	H	α-helix	trans	-59	-38.7	-168.2	81.8	-98.1	0	0	0	114.5	Q418 R419 W420	W416-Q418 VanDerWaalsContact C-N 3.33Å; W416-Q418 PolarHBondContact O-N 3.26Å; W416-R419 PolarHBondContact O-N 3.39Å; W416-W420 WeakPolarHBondContact O-CB 3.31Å; W416-W420 PolarHBondContact O-N 3.11Å
417	Y	79.6	Confident	70.5	Confident	160 Å²	160	96 Å²	96	63%	0.627	48%	0.479	S	S	*	.	H	α-helix	trans	-62.8	-38.3	173	-63.9	-74.3	0	0	0	112.5	T415 G421	T415-Y417 VanDerWaalsContact C-N 3.34Å; T415-Y417 PolarHBondContact O-N 3.42Å; Y417-G421 PolarHBondContact O-N 3.27Å
418	Q	77.1	Confident	72.1	Confident	115 Å²	115	94.4 Å²	94.4	54%	0.537	48%	0.481	S	S	.	.	H	α-helix	trans	-70.6	-42.4	176.6	-67.4	167.2	-43.6	0	0	111	T415 W416 W420 G421 V422	T415-Q418 CarbonylContact O-C 3.57Å; T415-Q418 WeakPolarHBondContact O-CA 3.34Å; T415-Q418 WeakPolarHBondContact O-CB 3.46Å; T415-Q418 PolarHBondContact O-N 3.18Å; T415-Q418 VanDerWaalsContact OG1-CD 3.24Å; T415-Q418 WeakPolarHBondContact OG1-CG 3.46Å; T415-Q418 PolarHBondContact OG1-OE1 3.45Å; W416-Q418 VanDerWaalsContact C-N 3.33Å; W416-Q418 PolarHBondContact O-N 3.26Å; Q418-W420 VanDerWaalsContact C-N 3.34Å; Q418-W420 PolarHBondContact O-N 3.46Å; Q418-G421 PolarHBondContact O-N 3.27Å; Q418-V422 WeakPolarHBondContact O-CB 3.33Å; Q418-V422 VanDerWaalsContact O-CG2 3.31Å; Q418-V422 WeakPolarHBondContact O-CG2 3.45Å; Q418-V422 PolarHBondContact O-N 3.24Å
419	R	76.9	Confident	73.5	Confident	94 Å²	94	89.9 Å²	89.9	36%	0.355	47%	0.472	S	S	.	.	H	α-helix	trans	-58.9	-46	173.9	-57.7	-165.2	-166.3	-172.8	7.2	111.1	S411 D412 G414 T415 W416 R423	S411-R419 VanDerWaalsContact O-CD 3.28Å; S411-R419 WeakPolarHBondContact O-CD 3.22Å; S411-R419 WeakPolarHBondContact O-CG 3.49Å; D412-R419 PolarHBondContact O-NE 3.07Å; D412-R419 PolarHBondContact O-NH2 3.42Å; D412-R419 IonicContact OD1-CZ 3.44Å; D412-R419 IonicContact OD1-NH1 3.57Å; D412-R419 PolarHBondContact OD1-NH1 3.13Å; G414-R419 WeakPolarHBondContact O-CG 3.34Å; G414-R419 PolarHBondContact O-NE 2.88Å; T415-R419 WeakPolarHBondContact O-CG 3.4Å; T415-R419 PolarHBondContact O-N 3.04Å; W416-R419 PolarHBondContact O-N 3.39Å; R419-R423 WeakPolarHBondContact O-CB 3.32Å; R419-R423 WeakPolarHBondContact O-CG 3.42Å; R419-R423 PolarHBondContact O-N 3.14Å
420	W	80.6	Confident	74.9	Confident	182 Å²	182	85.6 Å²	85.6	69%	0.689	45%	0.449	S	S	*	.	H	α-helix	trans	-63.8	-44.8	176.8	-174.4	86.3	0	0	0	111.9	W416 Q418 R423 A424	W416-W420 WeakPolarHBondContact O-CB 3.31Å; W416-W420 PolarHBondContact O-N 3.11Å; Q418-W420 VanDerWaalsContact C-N 3.34Å; Q418-W420 PolarHBondContact O-N 3.46Å; W420-R423 PolarHBondContact O-N 3.04Å; W420-A424 WeakPolarHBondContact O-CB 3.46Å; W420-A424 PolarHBondContact O-N 2.91Å
421	G	78.6	Confident	76.7	Confident	32 Å²	32	79.3 Å²	79.3	33%	0.33	42%	0.421	S	S	.	.	H	α-helix	trans	-62.3	-43.8	177.3	0	0	0	0	0	113.3	Y417 Q418 L425	Y417-G421 PolarHBondContact O-N 3.27Å; Q418-G421 PolarHBondContact O-N 3.27Å; G421-L425 VanDerWaalsContact O-CB 3.29Å; G421-L425 WeakPolarHBondContact O-CB 3.13Å; G421-L425 PolarHBondContact O-N 3.48Å
422	V	80.5	Confident	78.3	Confident	74 Å²	74	85.3 Å²	85.3	45%	0.448	44%	0.442	S	S	.	.	H	α-helix	trans	-65.5	-46.7	175.9	170.8	0	0	0	0	110.9	Q418 A424 L425 S426	Q418-V422 WeakPolarHBondContact O-CB 3.33Å; Q418-V422 VanDerWaalsContact O-CG2 3.31Å; Q418-V422 WeakPolarHBondContact O-CG2 3.45Å; Q418-V422 PolarHBondContact O-N 3.24Å; V422-A424 PolarHBondContact O-N 2.92Å; V422-L425 PolarHBondContact O-N 2.85Å; V422-S426 WeakPolarHBondContact O-CB 3.48Å; V422-S426 PolarHBondContact O-N 3.03Å; V422-S426 PolarHBondContact O-OG 3.49Å
423	R	79	Confident	79.8	Confident	107 Å²	107	83.2 Å²	83.2	40%	0.404	44%	0.44	S	S	.	.	H	α-helix	trans	-64.5	-38	177.4	-71.7	-179.4	-179.1	174.2	6	112.3	S411 D412 R419 W420 S426 L427	S411-R423 PolarHBondContact OG-NE 3.19Å; S411-R423 PolarHBondContact OG-NH2 3.39Å; D412-R423 IonicContact OD1-NH2 3.28Å; D412-R423 PolarHBondContact OD1-NH2 3.17Å; R419-R423 WeakPolarHBondContact O-CB 3.32Å; R419-R423 WeakPolarHBondContact O-CG 3.42Å; R419-R423 PolarHBondContact O-N 3.14Å; W420-R423 PolarHBondContact O-N 3.04Å; R423-S426 PolarHBondContact O-OG 2.93Å; R423-L427 VanDerWaalsContact O-CB 3.24Å; R423-L427 WeakPolarHBondContact O-CB 3.28Å; R423-L427 WeakPolarHBondContact O-CD1 3.49Å; R423-L427 WeakPolarHBondContact O-CG 3.22Å; R423-L427 PolarHBondContact O-N 3.2Å
424	A	81.6	Confident	81.2	Confident	44 Å²	44	77.9 Å²	77.9	36%	0.364	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-39.4	174.7	0	0	0	0	0	112.2	W420 V422 G428	W420-A424 WeakPolarHBondContact O-CB 3.46Å; W420-A424 PolarHBondContact O-N 2.91Å; V422-A424 PolarHBondContact O-N 2.92Å; A424-G428 PolarHBondContact O-N 3.29Å
425	L	82.9	Confident	82.4	Confident	139 Å²	139	77.9 Å²	77.9	73%	0.728	40%	0.399	S	S	*	.	H	α-helix	trans	-69.8	-41.8	177	-167.3	75	0	0	0	112	G421 V422 G428 G429	G421-L425 VanDerWaalsContact O-CB 3.29Å; G421-L425 WeakPolarHBondContact O-CB 3.13Å; G421-L425 PolarHBondContact O-N 3.48Å; V422-L425 PolarHBondContact O-N 2.85Å; L425-G428 PolarHBondContact O-N 3.33Å; L425-G429 PolarHBondContact O-N 3.23Å
426	S	82.2	Confident	82.8	Confident	34 Å²	34	78.3 Å²	78.3	24%	0.238	40%	0.397	C	S	.	.	H	α-helix	trans	-69.3	-45.1	178.4	66.2	0	0	0	0	111.8	V422 R423 G428 G429 Q430	V422-S426 WeakPolarHBondContact O-CB 3.48Å; V422-S426 PolarHBondContact O-N 3.03Å; V422-S426 PolarHBondContact O-OG 3.49Å; R423-S426 PolarHBondContact O-OG 2.93Å; S426-G428 VanDerWaalsContact C-N 3.34Å; S426-G428 PolarHBondContact O-N 3.3Å; S426-G429 PolarHBondContact O-N 3.36Å; S426-Q430 WeakPolarHBondContact O-CB 3.38Å; S426-Q430 WeakPolarHBondContact O-CG 3.49Å; S426-Q430 PolarHBondContact O-N 3.44Å
427	L	83.4	Confident	83.1	Confident	44 Å²	44	72 Å²	72	23%	0.23	38%	0.38	C	S	.	.	H	α-helix	trans	-59.9	-43.2	172.5	-72.7	168.7	0	0	0	111.4	R228 L229 R423 G429 Q430 V431	R228-L427 HydrophobicContact CB-CD2 4.17Å; L229-L427 HydrophobicContact CD2-CD1 4.08Å; L229-L427 HydrophobicContact CD2-CD2 4.28Å; R423-L427 VanDerWaalsContact O-CB 3.24Å; R423-L427 WeakPolarHBondContact O-CB 3.28Å; R423-L427 WeakPolarHBondContact O-CD1 3.49Å; R423-L427 WeakPolarHBondContact O-CG 3.22Å; R423-L427 PolarHBondContact O-N 3.2Å; L427-G429 PolarHBondContact O-N 3.38Å; L427-Q430 PolarHBondContact O-N 3.43Å; L427-V431 WeakPolarHBondContact O-CB 3.15Å; L427-V431 VanDerWaalsContact O-CG2 3.31Å; L427-V431 WeakPolarHBondContact O-CG2 3.43Å; L427-V431 PolarHBondContact O-N 3.38Å
428	G	84.2	Confident	83.5	Confident	41 Å²	41	64.6 Å²	64.6	42%	0.423	35%	0.351	S	S	.	.	H	α-helix	trans	-60.5	-43.6	174.9	0	0	0	0	0	112.8	A424 L425 S426 W432	A424-G428 PolarHBondContact O-N 3.29Å; L425-G428 PolarHBondContact O-N 3.33Å; S426-G428 VanDerWaalsContact C-N 3.34Å; S426-G428 PolarHBondContact O-N 3.3Å; G428-W432 WeakPolarHBondContact O-CB 3.16Å; G428-W432 PolarHBondContact O-N 3.21Å
429	G	83.8	Confident	84.1	Confident	45 Å²	45	62 Å²	62	46%	0.464	34%	0.338	S	S	.	.	H	α-helix	trans	-64.7	-41.4	174.7	0	0	0	0	0	113.4	L425 S426 L427 W432 G433	L425-G429 PolarHBondContact O-N 3.23Å; S426-G429 PolarHBondContact O-N 3.36Å; L427-G429 PolarHBondContact O-N 3.38Å; G429-W432 PolarHBondContact O-N 3.04Å; G429-G433 PolarHBondContact O-N 2.81Å
430	Q	82.2	Confident	84.5	Confident	39 Å²	39	58.6 Å²	58.6	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-45	175.8	-77.4	178.1	-10.7	0	0	111.9	R228 D404 S426 L427 W432 G433 N434	R228-Q430 VanDerWaalsContact NH1-CD 3.3Å; D404-Q430 PolarHBondContact OD1-NE2 3.5Å; S426-Q430 WeakPolarHBondContact O-CB 3.38Å; S426-Q430 WeakPolarHBondContact O-CG 3.49Å; S426-Q430 PolarHBondContact O-N 3.44Å; L427-Q430 PolarHBondContact O-N 3.43Å; Q430-W432 VanDerWaalsContact C-N 3.35Å; Q430-W432 PolarHBondContact O-N 2.68Å; Q430-G433 PolarHBondContact O-N 3.38Å; Q430-N434 PolarHBondContact O-N 3.27Å; Q430-N434 PolarHBondContact O-OD1 3.41Å
431	V	87.1	Confident	84.7	Confident	17 Å²	17	56.2 Å²	56.2	10%	0.103	34%	0.34	C	S	.	.	H	α-helix	trans	-62.1	-42.3	174.9	168.4	0	0	0	0	111.1	G224 L225 L427 G433 N434 F435	G224-V431 WeakPolarHBondContact O-CG2 3.5Å; L225-V431 HydrophobicContact CD2-CG2 4.5Å; L427-V431 WeakPolarHBondContact O-CB 3.15Å; L427-V431 VanDerWaalsContact O-CG2 3.31Å; L427-V431 WeakPolarHBondContact O-CG2 3.43Å; L427-V431 PolarHBondContact O-N 3.38Å; V431-G433 VanDerWaalsContact C-N 3.35Å; V431-N434 PolarHBondContact O-N 2.91Å; V431-F435 WeakPolarHBondContact O-CB 3.33Å; V431-F435 PolarHBondContact O-N 2.96Å
432	W	87.6	Confident	84.9	Confident	136 Å²	136	60.2 Å²	60.2	52%	0.515	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-37.2	175.3	-169.5	-109.5	0	0	0	112.4	F220 G428 G429 Q430 F435 L436	F220-W432 HydrophobicContact CZ-CE3 4.4Å; F220-W432 HydrophobicContact CZ-CZ3 4.19Å; G428-W432 WeakPolarHBondContact O-CB 3.16Å; G428-W432 PolarHBondContact O-N 3.21Å; G429-W432 PolarHBondContact O-N 3.04Å; Q430-W432 VanDerWaalsContact C-N 3.35Å; Q430-W432 PolarHBondContact O-N 2.68Å; W432-F435 HydrophobicContact CD2-CD1 4.26Å; W432-F435 AromaticContact CE3-CD1 3.75Å; W432-F435 HydrophobicContact CE3-CD1 3.75Å; W432-F435 HydrophobicContact CE3-CE1 4.29Å; W432-F435 HydrophobicContact CH2-CD1 4.05Å; W432-F435 AromaticContact CH2-CE1 3.79Å; W432-F435 HydrophobicContact CH2-CE1 3.79Å; W432-F435 HydrophobicContact CZ2-CE1 4.44Å; W432-F435 AromaticContact CZ3-CD1 3.64Å; W432-F435 HydrophobicContact CZ3-CD1 3.64Å; W432-F435 AromaticContact CZ3-CE1 3.7Å; W432-F435 HydrophobicContact CZ3-CE1 3.7Å; W432-F435 PolarHBondContact O-N 3.37Å; W432-L436 WeakPolarHBondContact O-CB 3.49Å; W432-L436 WeakPolarHBondContact O-CG 3.35Å; W432-L436 PolarHBondContact O-N 2.72Å
433	G	85.6	Confident	85.2	Confident	37 Å²	37	58.5 Å²	58.5	38%	0.381	34%	0.336	S	S	.	.	H	α-helix	trans	-62.6	-47.8	172.3	0	0	0	0	0	112.8	G429 Q430 V431 F435 L436 S437	G429-G433 PolarHBondContact O-N 2.81Å; Q430-G433 PolarHBondContact O-N 3.38Å; V431-G433 VanDerWaalsContact C-N 3.35Å; G433-F435 VanDerWaalsContact C-N 3.34Å; G433-F435 PolarHBondContact O-N 3.08Å; G433-L436 PolarHBondContact O-N 3.45Å; G433-S437 WeakPolarHBondContact O-CB 3.19Å; G433-S437 PolarHBondContact O-N 3.45Å
434	N	87	Confident	85.6	Confident	15 Å²	15	60.4 Å²	60.4	8%	0.08	34%	0.343	C	S	.	.	H	α-helix	trans	-56.1	-48.7	173	-81.3	28.2	0	0	0	110.5	R228 Q430 V431 S437 C438 D680 T684	R228-N434 PolarHBondContact NH2-OD1 2.83Å; R228-N434 VanDerWaalsContact NH2-OD1 3.16Å; Q430-N434 PolarHBondContact O-N 3.27Å; Q430-N434 PolarHBondContact O-OD1 3.41Å; V431-N434 PolarHBondContact O-N 2.91Å; N434-S437 WeakPolarHBondContact O-CB 3.39Å; N434-S437 PolarHBondContact O-N 2.94Å; N434-S437 PolarHBondContact O-OG 3.13Å; N434-C438 PolarHBondContact O-N 3.4Å; N434-C438 PolarHBondContact O-SG 3.05Å; N434-C438 VanDerWaalsContact O-SG 3.38Å; N434-D680 PolarHBondContact ND2-O 3.22Å; N434-T684 HydrophobicContact CB-CG2 4.18Å
435	F	89.6	Confident	86.1	Confident	26 Å²	26	66.1 Å²	66.1	11%	0.114	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-47.7	177.6	168.9	-108.8	0	0	0	113.2	F220 V431 W432 G433 S437 C438 F439 T684 F688	F220-F435 AromaticContact CE2-CD2 3.9Å; F220-F435 HydrophobicContact CE2-CD2 3.9Å; F220-F435 HydrophobicContact CE2-CE2 4.07Å; F220-F435 HydrophobicContact CE2-CG 4.22Å; F220-F435 HydrophobicContact CZ-CD2 4.5Å; F220-F435 HydrophobicContact CZ-CG 4.37Å; V431-F435 WeakPolarHBondContact O-CB 3.33Å; V431-F435 PolarHBondContact O-N 2.96Å; W432-F435 HydrophobicContact CD2-CD1 4.26Å; W432-F435 AromaticContact CE3-CD1 3.75Å; W432-F435 HydrophobicContact CE3-CD1 3.75Å; W432-F435 HydrophobicContact CE3-CE1 4.29Å; W432-F435 HydrophobicContact CH2-CD1 4.05Å; W432-F435 AromaticContact CH2-CE1 3.79Å; W432-F435 HydrophobicContact CH2-CE1 3.79Å; W432-F435 HydrophobicContact CZ2-CE1 4.44Å; W432-F435 AromaticContact CZ3-CD1 3.64Å; W432-F435 HydrophobicContact CZ3-CD1 3.64Å; W432-F435 AromaticContact CZ3-CE1 3.7Å; W432-F435 HydrophobicContact CZ3-CE1 3.7Å; W432-F435 PolarHBondContact O-N 3.37Å; G433-F435 VanDerWaalsContact C-N 3.34Å; G433-F435 PolarHBondContact O-N 3.08Å; F435-S437 VanDerWaalsContact C-N 3.27Å; F435-S437 PolarHBondContact O-N 3.29Å; F435-C438 WeakPolarHBondContact O-CB 3.33Å; F435-C438 PolarHBondContact O-N 3.47Å; F435-F439 HydrophobicContact CD2-CE2 4.38Å; F435-F439 HydrophobicContact CE2-CD2 4.49Å; F435-F439 AromaticContact CE2-CE2 3.67Å; F435-F439 HydrophobicContact CE2-CE2 3.67Å; F435-F439 HydrophobicContact CZ-CD2 4.49Å; F435-F439 AromaticContact CZ-CE2 3.79Å; F435-F439 HydrophobicContact CZ-CE2 3.79Å; F435-T684 HydrophobicContact CB-CG2 4.01Å; F435-F688 HydrophobicContact CD2-CB 4.34Å; F435-F688 HydrophobicContact CD2-CD2 4.3Å; F435-F688 HydrophobicContact CD2-CG 4.17Å; F435-F688 HydrophobicContact CE2-CB 4.28Å; F435-F688 AromaticContact CE2-CD1 3.99Å; F435-F688 HydrophobicContact CE2-CD1 3.99Å; F435-F688 AromaticContact CE2-CD2 3.48Å; F435-F688 HydrophobicContact CE2-CD2 3.48Å; F435-F688 VanDerWaalsContact CE2-CD2 3.48Å; F435-F688 HydrophobicContact CE2-CE1 4.18Å; F435-F688 AromaticContact CE2-CE2 3.69Å; F435-F688 HydrophobicContact CE2-CE2 3.69Å; F435-F688 AromaticContact CE2-CG 3.63Å; F435-F688 HydrophobicContact CE2-CG 3.63Å; F435-F688 HydrophobicContact CE2-CZ 4.03Å; F435-F688 HydrophobicContact CZ-CD2 4.24Å; F435-F688 HydrophobicContact CZ-CE2 4.07Å; F435-F688 HydrophobicContact CZ-CZ 4.41Å
436	L	89.8	Confident	86.4	Confident	93 Å²	93	61.2 Å²	61.2	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-62.4	-34.9	176.3	-73	177.3	0	0	0	112	W432 G433 C438 F439 G440	W432-L436 WeakPolarHBondContact O-CB 3.49Å; W432-L436 WeakPolarHBondContact O-CG 3.35Å; W432-L436 PolarHBondContact O-N 2.72Å; G433-L436 PolarHBondContact O-N 3.45Å; L436-C438 VanDerWaalsContact C-N 3.25Å; L436-C438 PolarHBondContact O-N 2.88Å; L436-F439 WeakPolarHBondContact O-CA 3.5Å; L436-F439 PolarHBondContact O-N 3.04Å; L436-G440 PolarHBondContact O-N 3.33Å
437	S	85.9	Confident	86.9	Confident	39 Å²	39	59.7 Å²	59.7	27%	0.273	32%	0.319	S	S	.	.	H	α-helix	trans	-64.8	-26.6	177.9	82.1	0	0	0	0	113.3	G433 N434 F435 F439 G440 K681	G433-S437 WeakPolarHBondContact O-CB 3.19Å; G433-S437 PolarHBondContact O-N 3.45Å; N434-S437 WeakPolarHBondContact O-CB 3.39Å; N434-S437 PolarHBondContact O-N 2.94Å; N434-S437 PolarHBondContact O-OG 3.13Å; F435-S437 VanDerWaalsContact C-N 3.27Å; F435-S437 PolarHBondContact O-N 3.29Å; S437-F439 PolarHBondContact O-N 2.98Å; S437-G440 PolarHBondContact O-N 3.04Å; S437-K681 VanDerWaalsContact OG-CD 3.23Å; S437-K681 WeakPolarHBondContact OG-CD 3.2Å; S437-K681 WeakPolarHBondContact OG-CE 3.43Å
438	C	87.3	Confident	87.3	Confident	4 Å²	4	61.9 Å²	61.9	3%	0.027	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.1	171.4	-56.8	0	0	0	0	113.1	N434 F435 L436 T447	N434-C438 PolarHBondContact O-N 3.4Å; N434-C438 PolarHBondContact O-SG 3.05Å; N434-C438 VanDerWaalsContact O-SG 3.38Å; F435-C438 WeakPolarHBondContact O-CB 3.33Å; F435-C438 PolarHBondContact O-N 3.47Å; L436-C438 VanDerWaalsContact C-N 3.25Å; L436-C438 PolarHBondContact O-N 2.88Å; C438-T447 WeakPolarHBondContact O-CB 3.28Å; C438-T447 PolarHBondContact O-OG1 3.41Å
439	F	89.9	Confident	87.8	Confident	60 Å²	60	61.5 Å²	61.5	26%	0.263	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	6.9	171.5	-66.3	-86.8	0	0	0	113.2	F435 L436 S437 R444 T447 L448 M451 F688	F435-F439 HydrophobicContact CD2-CE2 4.38Å; F435-F439 HydrophobicContact CE2-CD2 4.49Å; F435-F439 AromaticContact CE2-CE2 3.67Å; F435-F439 HydrophobicContact CE2-CE2 3.67Å; F435-F439 HydrophobicContact CZ-CD2 4.49Å; F435-F439 AromaticContact CZ-CE2 3.79Å; F435-F439 HydrophobicContact CZ-CE2 3.79Å; L436-F439 WeakPolarHBondContact O-CA 3.5Å; L436-F439 PolarHBondContact O-N 3.04Å; S437-F439 PolarHBondContact O-N 2.98Å; F439-R444 WeakPolarHBondContact O-CB 3.44Å; F439-T447 HydrophobicContact CD1-CG2 4.42Å; F439-T447 HydrophobicContact CE1-CG2 3.96Å; F439-T447 HydrophobicContact CE2-CG2 4.36Å; F439-T447 HydrophobicContact CZ-CG2 3.93Å; F439-L448 HydrophobicContact CE1-CD2 4.34Å; F439-M451 HydrophobicContact CE1-SD 3.82Å; F439-M451 HydrophobicContact CZ-SD 3.81Å; F439-F688 HydrophobicContact CE2-CE1 4.11Å; F439-F688 HydrophobicContact CE2-CZ 4.43Å; F439-F688 AromaticContact CZ-CE1 3.7Å; F439-F688 HydrophobicContact CZ-CE1 3.7Å; F439-F688 AromaticContact CZ-CZ 3.99Å; F439-F688 HydrophobicContact CZ-CZ 3.99Å
440	G	86.5	Confident	88.2	Confident	22 Å²	22	59.3 Å²	59.3	23%	0.227	30%	0.296	C	S	.	.	S	Bend	trans	-61.7	159.4	170.3	0	0	0	0	0	112.6	L436 S437 E442 Y443 R444	L436-G440 PolarHBondContact O-N 3.33Å; S437-G440 PolarHBondContact O-N 3.04Å; G440-E442 VanDerWaalsContact C-N 3.26Å; G440-E442 PolarHBondContact O-N 3.29Å; G440-E442 VanDerWaalsContact O-N 3.1Å; G440-Y443 PolarHBondContact O-N 3.09Å; G440-R444 VanDerWaalsContact O-CB 3.27Å; G440-R444 WeakPolarHBondContact O-CB 3.49Å; G440-R444 PolarHBondContact O-N 3.38Å
441	P	84.3	Confident	88.9	Confident	133 Å²	133	59.4 Å²	59.4	86%	0.864	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.3	-165.8	22.1	-33.7	0	0	0	114.5
442	E	82.9	Confident	89.2	Confident	115 Å²	115	59.5 Å²	59.5	54%	0.537	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-52.3	176.7	-60.9	-172.4	116.6	0	0	112.3	R142 G440	R142-E442 IonicContact CZ-OE1 3.58Å; R142-E442 IonicContact NH1-OE1 3.35Å; R142-E442 PolarHBondContact NH1-OE1 3.09Å; G440-E442 VanDerWaalsContact C-N 3.26Å; G440-E442 PolarHBondContact O-N 3.29Å; G440-E442 VanDerWaalsContact O-N 3.1Å
443	Y	85.7	Confident	89.6	Confident	38 Å²	38	53.1 Å²	53.1	15%	0.149	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-19.6	-170.5	-62.7	-82.5	0	0	0	114	G440 R445 I446 T447 Y677	G440-Y443 PolarHBondContact O-N 3.09Å; Y443-R445 PolarHBondContact O-N 3.42Å; Y443-I446 WeakPolarHBondContact O-CA 3.47Å; Y443-I446 WeakPolarHBondContact O-CB 3.27Å; Y443-I446 PolarHBondContact O-N 3.34Å; Y443-T447 PolarHBondContact O-N 2.95Å; Y443-T447 PolarHBondContact O-OG1 3.11Å; Y443-Y677 HydrophobicContact CD1-CD1 4.3Å; Y443-Y677 HydrophobicContact CD1-CE1 4.47Å
444	R	89.1	Confident	90	Very high	147 Å²	147	51.5 Å²	51.5	56%	0.555	26%	0.26	S	S	*	.	H	α-helix	trans	-48.2	-40.7	-173.6	-175.3	175.1	176.1	-173.7	0.4	114.4	F439 G440 L448	F439-R444 WeakPolarHBondContact O-CB 3.44Å; G440-R444 VanDerWaalsContact O-CB 3.27Å; G440-R444 WeakPolarHBondContact O-CB 3.49Å; G440-R444 PolarHBondContact O-N 3.38Å; R444-L448 HydrophobicContact CG-CD1 3.95Å; R444-L448 WeakPolarHBondContact O-CB 3.41Å; R444-L448 VanDerWaalsContact O-CG 3.25Å; R444-L448 WeakPolarHBondContact O-CG 3.47Å; R444-L448 PolarHBondContact O-N 2.86Å
445	R	90.3	Very high	90.5	Very high	165 Å²	165	54.1 Å²	54.1	62%	0.623	27%	0.27	S	S	*	.	H	α-helix	trans	-67.3	-42.1	178.1	176.5	176.3	164	177	-7	112	Y443 M449	Y443-R445 PolarHBondContact O-N 3.42Å; R445-M449 HydrophobicContact CG-CE 4.12Å; R445-M449 HydrophobicContact CG-SD 4.12Å; R445-M449 WeakPolarHBondContact O-CB 3.37Å; R445-M449 VanDerWaalsContact O-CG 3.31Å; R445-M449 WeakPolarHBondContact O-CG 3.3Å; R445-M449 PolarHBondContact O-N 3.21Å; R445-M449 VanDerWaalsContact O-N 3.13Å
446	I	90.2	Very high	90.7	Very high	35 Å²	35	53.7 Å²	53.7	18%	0.179	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-50.6	177.8	-61	174.9	0	0	0	108.8	Y443 L448 M449 M450 L676 L733	Y443-I446 WeakPolarHBondContact O-CA 3.47Å; Y443-I446 WeakPolarHBondContact O-CB 3.27Å; Y443-I446 PolarHBondContact O-N 3.34Å; I446-L448 PolarHBondContact O-N 3.19Å; I446-M449 PolarHBondContact O-N 2.95Å; I446-M449 VanDerWaalsContact O-N 3.13Å; I446-M450 HydrophobicContact CG2-CG 4.18Å; I446-M450 WeakPolarHBondContact O-CB 3.45Å; I446-M450 WeakPolarHBondContact O-CG 3.45Å; I446-M450 PolarHBondContact O-N 3.46Å; I446-L676 HydrophobicContact CG2-CB 4.26Å; I446-L676 HydrophobicContact CG2-CD1 3.85Å; I446-L676 HydrophobicContact CG2-CD2 4.03Å; I446-L676 HydrophobicContact CG2-CG 4.28Å; I446-L733 HydrophobicContact CG2-CD2 4.23Å
447	T	92.4	Very high	90.9	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-56.4	-47.7	178.8	-52.8	0	0	0	0	112.2	C438 F439 Y443 M449 M450 M451 Y677	C438-T447 WeakPolarHBondContact O-CB 3.28Å; C438-T447 PolarHBondContact O-OG1 3.41Å; F439-T447 HydrophobicContact CD1-CG2 4.42Å; F439-T447 HydrophobicContact CE1-CG2 3.96Å; F439-T447 HydrophobicContact CE2-CG2 4.36Å; F439-T447 HydrophobicContact CZ-CG2 3.93Å; Y443-T447 PolarHBondContact O-N 2.95Å; Y443-T447 PolarHBondContact O-OG1 3.11Å; T447-M449 PolarHBondContact O-N 3.43Å; T447-M450 PolarHBondContact O-N 2.63Å; T447-M451 HydrophobicContact CG2-SD 4.29Å; T447-M451 WeakPolarHBondContact O-CB 3.49Å; T447-M451 WeakPolarHBondContact O-CG 3.4Å; T447-M451 PolarHBondContact O-N 2.94Å; T447-Y677 VanDerWaalsContact CA-OH 3.28Å; T447-Y677 WeakPolarHBondContact CA-OH 3.26Å; T447-Y677 WeakPolarHBondContact CB-OH 3.38Å; T447-Y677 PolarHBondContact OG1-OH 3.36Å
448	L	92.9	Very high	91.2	Very high	91 Å²	91	47.8 Å²	47.8	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-65.3	-34.7	177.6	-71.1	171.1	0	0	0	113.4	F439 R444 I446 M451 G452	F439-L448 HydrophobicContact CE1-CD2 4.34Å; R444-L448 HydrophobicContact CG-CD1 3.95Å; R444-L448 WeakPolarHBondContact O-CB 3.41Å; R444-L448 VanDerWaalsContact O-CG 3.25Å; R444-L448 WeakPolarHBondContact O-CG 3.47Å; R444-L448 PolarHBondContact O-N 2.86Å; I446-L448 PolarHBondContact O-N 3.19Å; L448-M451 HydrophobicContact CD2-SD 4.14Å; L448-G452 PolarHBondContact O-N 3.28Å
449	M	93	Very high	91.6	Very high	32 Å²	32	48.8 Å²	48.8	16%	0.158	24%	0.24	C	C	.	.	H	α-helix	trans	-69.9	-45	174.3	-74.5	177.1	172	0	0	111.4	R445 I446 T447 M451 G452 V453 K732 L733	R445-M449 HydrophobicContact CG-CE 4.12Å; R445-M449 HydrophobicContact CG-SD 4.12Å; R445-M449 WeakPolarHBondContact O-CB 3.37Å; R445-M449 VanDerWaalsContact O-CG 3.31Å; R445-M449 WeakPolarHBondContact O-CG 3.3Å; R445-M449 PolarHBondContact O-N 3.21Å; R445-M449 VanDerWaalsContact O-N 3.13Å; I446-M449 PolarHBondContact O-N 2.95Å; I446-M449 VanDerWaalsContact O-N 3.13Å; T447-M449 PolarHBondContact O-N 3.43Å; M449-M451 PolarHBondContact O-N 3.17Å; M449-G452 PolarHBondContact O-N 3.49Å; M449-G452 VanDerWaalsContact O-N 3.17Å; M449-V453 WeakPolarHBondContact O-CG2 3.32Å; M449-V453 PolarHBondContact O-N 2.92Å; M449-K732 HydrophobicContact CE-CB 3.96Å; M449-K732 HydrophobicContact CE-CD 4.39Å; M449-K732 HydrophobicContact SD-CB 4.01Å; M449-L733 HydrophobicContact CB-CD2 3.62Å; M449-L733 HydrophobicContact CB-CG 4.27Å; M449-L733 HydrophobicContact SD-CD2 4.45Å
450	M	93.6	Very high	91.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.6	-44	175.8	-71	-62.2	-74.4	0	0	111.7	I446 T447 G452 V453 W454 L669 L672 T673 L676 L689 L733	I446-M450 HydrophobicContact CG2-CG 4.18Å; I446-M450 WeakPolarHBondContact O-CB 3.45Å; I446-M450 WeakPolarHBondContact O-CG 3.45Å; I446-M450 PolarHBondContact O-N 3.46Å; T447-M450 PolarHBondContact O-N 2.63Å; M450-G452 VanDerWaalsContact C-N 3.28Å; M450-G452 PolarHBondContact O-N 3.33Å; M450-V453 PolarHBondContact O-N 3.06Å; M450-W454 WeakPolarHBondContact O-CB 3.13Å; M450-W454 VanDerWaalsContact O-CD1 3.32Å; M450-W454 PolarHBondContact O-N 3.21Å; M450-L669 HydrophobicContact CE-CD1 3.86Å; M450-L672 HydrophobicContact SD-CD2 4.45Å; M450-T673 HydrophobicContact CE-CG2 4.37Å; M450-T673 WeakPolarHBondContact CE-OG1 3.15Å; M450-L676 HydrophobicContact CE-CD1 3.93Å; M450-L676 HydrophobicContact CG-CD1 3.84Å; M450-L676 HydrophobicContact SD-CD1 3.49Å; M450-L676 WeakPolarHBondContact SD-CD1 3.47Å; M450-L689 HydrophobicContact CB-CD1 3.91Å; M450-L689 HydrophobicContact CB-CD2 3.95Å; M450-L733 HydrophobicContact CG-CD1 4.45Å; M450-L733 HydrophobicContact CG-CD2 4.11Å; M450-L733 HydrophobicContact SD-CD1 3.43Å; M450-L733 WeakPolarHBondContact SD-CD1 3.38Å; M450-L733 HydrophobicContact SD-CD2 4.1Å; M450-L733 HydrophobicContact SD-CG 4.43Å
451	M	95.3	Very high	92	Very high	40 Å²	40	45.7 Å²	45.7	20%	0.197	22%	0.219	C	C	.	.	H	α-helix	trans	-54.5	-44.2	173.8	-75.1	172.4	72.6	0	0	111.8	F439 T447 L448 M449 F455 F688 L689 L692	F439-M451 HydrophobicContact CE1-SD 3.82Å; F439-M451 HydrophobicContact CZ-SD 3.81Å; T447-M451 HydrophobicContact CG2-SD 4.29Å; T447-M451 WeakPolarHBondContact O-CB 3.49Å; T447-M451 WeakPolarHBondContact O-CG 3.4Å; T447-M451 PolarHBondContact O-N 2.94Å; L448-M451 HydrophobicContact CD2-SD 4.14Å; M449-M451 PolarHBondContact O-N 3.17Å; M451-F455 WeakPolarHBondContact O-CB 3.47Å; M451-F455 PolarHBondContact O-N 2.84Å; M451-F688 HydrophobicContact CE-CE1 4.06Å; M451-F688 HydrophobicContact CE-CZ 3.83Å; M451-F688 HydrophobicContact CG-CE1 3.96Å; M451-F688 HydrophobicContact SD-CE1 3.76Å; M451-F688 HydrophobicContact SD-CZ 4.14Å; M451-L689 HydrophobicContact CB-CD2 4.3Å; M451-L689 HydrophobicContact CG-CD2 3.69Å; M451-L692 HydrophobicContact CB-CD2 3.56Å; M451-L692 HydrophobicContact CE-CD2 4.01Å; M451-L692 HydrophobicContact CG-CD2 3.71Å
452	G	94.8	Very high	92.3	Very high	20 Å²	20	40.4 Å²	40.4	21%	0.206	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-41.4	177.7	0	0	0	0	0	113.4	L448 M449 M450 T456	L448-G452 PolarHBondContact O-N 3.28Å; M449-G452 PolarHBondContact O-N 3.49Å; M449-G452 VanDerWaalsContact O-N 3.17Å; M450-G452 VanDerWaalsContact C-N 3.28Å; M450-G452 PolarHBondContact O-N 3.33Å; G452-T456 WeakPolarHBondContact O-CB 3.45Å; G452-T456 WeakPolarHBondContact O-CG2 3.41Å; G452-T456 PolarHBondContact O-N 2.86Å; G452-T456 PolarHBondContact O-OG1 3.4Å
453	V	95.1	Very high	92.6	Very high	2 Å²	2	35 Å²	35	1%	0.012	16%	0.157	C	C	.	.	H	α-helix	trans	-67.5	-50.6	176.8	179.7	0	0	0	0	111.1	M449 M450 F455 T456 M457 L628 L669 L729 A730	M449-V453 WeakPolarHBondContact O-CG2 3.32Å; M449-V453 PolarHBondContact O-N 2.92Å; M450-V453 PolarHBondContact O-N 3.06Å; V453-F455 PolarHBondContact O-N 3.27Å; V453-T456 PolarHBondContact O-N 2.95Å; V453-T456 PolarHBondContact O-OG1 3.37Å; V453-M457 VanDerWaalsContact O-CB 3.27Å; V453-M457 WeakPolarHBondContact O-CB 3.47Å; V453-M457 PolarHBondContact O-N 3.32Å; V453-L628 HydrophobicContact CG1-CD1 4.5Å; V453-L628 HydrophobicContact CG1-CD2 4.38Å; V453-L669 HydrophobicContact CB-CD1 4.39Å; V453-L669 HydrophobicContact CG1-CD1 3.7Å; V453-L669 HydrophobicContact CG1-CD2 4.27Å; V453-L729 HydrophobicContact CG2-CB 3.82Å; V453-A730 HydrophobicContact CG2-CB 4.25Å
454	W	95.3	Very high	92.7	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.011	15%	0.15	C	C	.	.	H	α-helix	trans	-57.7	-44.5	177.4	-87.1	98.9	0	0	0	112.4	M450 S458 W666 L669 D670 T673 F686 L689 C693	M450-W454 WeakPolarHBondContact O-CB 3.13Å; M450-W454 VanDerWaalsContact O-CD1 3.32Å; M450-W454 PolarHBondContact O-N 3.21Å; W454-S458 WeakPolarHBondContact O-CB 3.43Å; W454-S458 PolarHBondContact O-N 3.05Å; W454-S458 VanDerWaalsContact O-N 3.11Å; W454-W666 AromaticContact CE3-CZ3 3.88Å; W454-W666 HydrophobicContact CE3-CZ3 3.88Å; W454-W666 HydrophobicContact CZ3-CE3 4.33Å; W454-W666 AromaticContact CZ3-CZ3 3.64Å; W454-W666 HydrophobicContact CZ3-CZ3 3.64Å; W454-L669 HydrophobicContact CD2-CD2 3.62Å; W454-L669 HydrophobicContact CD2-CG 4.04Å; W454-L669 HydrophobicContact CE3-CD2 3.92Å; W454-L669 HydrophobicContact CG-CD1 4.47Å; W454-L669 HydrophobicContact CG-CD2 3.9Å; W454-L669 HydrophobicContact CG-CG 4.36Å; W454-L669 HydrophobicContact CZ2-CD2 4.33Å; W454-L669 HydrophobicContact CZ2-CG 4.02Å; W454-L669 HydrophobicContact CZ3-CD2 4.43Å; W454-D670 VanDerWaalsContact CH2-OD1 3.27Å; W454-D670 WeakPolarHBondContact CH2-OD1 3.46Å; W454-T673 HydrophobicContact CZ2-CG2 4.47Å; W454-T673 WeakPolarHBondContact CZ2-OG1 3.4Å; W454-T673 PolarHBondContact NE1-OG1 2.83Å; W454-F686 HydrophobicContact CH2-CD2 4.41Å; W454-F686 AromaticContact CH2-CE2 3.64Å; W454-F686 HydrophobicContact CH2-CE2 3.64Å; W454-F686 HydrophobicContact CH2-CZ 4.47Å; W454-F686 HydrophobicContact CZ2-CD2 4.06Å; W454-F686 AromaticContact CZ2-CE2 3.55Å; W454-F686 HydrophobicContact CZ2-CE2 3.55Å; W454-F686 HydrophobicContact CZ2-CZ 4.37Å; W454-L689 HydrophobicContact CD2-CB 4.31Å; W454-L689 HydrophobicContact CG-CB 4.12Å; W454-L689 HydrophobicContact CG-CD2 4.42Å; W454-C693 HydrophobicContact CE3-CB 3.52Å; W454-C693 HydrophobicContact CZ3-CB 3.9Å
455	F	95.9	Very high	92.5	Very high	69 Å²	69	28.3 Å²	28.3	30%	0.303	14%	0.137	S	C	.	.	H	α-helix	trans	-64	-54.2	177.2	-176.1	-82.7	0	0	0	111.8	M451 V453 M457 S458 F459 L692 A696 L699	M451-F455 WeakPolarHBondContact O-CB 3.47Å; M451-F455 PolarHBondContact O-N 2.84Å; V453-F455 PolarHBondContact O-N 3.27Å; F455-M457 PolarHBondContact O-N 2.97Å; F455-S458 PolarHBondContact O-N 2.96Å; F455-F459 WeakPolarHBondContact O-CB 3.44Å; F455-F459 PolarHBondContact O-N 3.32Å; F455-L692 HydrophobicContact CB-CD2 4.45Å; F455-L692 HydrophobicContact CB-CG 4.46Å; F455-L692 HydrophobicContact CD2-CD1 4.03Å; F455-L692 HydrophobicContact CD2-CG 4.38Å; F455-A696 HydrophobicContact CB-CB 4.41Å; F455-A696 HydrophobicContact CD2-CB 3.55Å; F455-A696 HydrophobicContact CE2-CB 3.83Å; F455-A696 HydrophobicContact CG-CB 3.94Å; F455-A696 HydrophobicContact CZ-CB 4.42Å; F455-A696 WeakPolarHBondContact O-CB 3.36Å; F455-L699 HydrophobicContact CE2-CD1 4.09Å; F455-L699 HydrophobicContact CZ-CD1 4.17Å
456	T	94.8	Very high	92.2	Very high	18 Å²	18	22.9 Å²	22.9	11%	0.11	12%	0.122	C	C	.	.	H	α-helix	trans	-63.2	-40.7	-175.5	48.2	0	0	0	0	112.6	G452 V453 S460 A722 G726	G452-T456 WeakPolarHBondContact O-CB 3.45Å; G452-T456 WeakPolarHBondContact O-CG2 3.41Å; G452-T456 PolarHBondContact O-N 2.86Å; G452-T456 PolarHBondContact O-OG1 3.4Å; V453-T456 PolarHBondContact O-N 2.95Å; V453-T456 PolarHBondContact O-OG1 3.37Å; T456-S460 PolarHBondContact O-N 3.47Å; T456-S460 PolarHBondContact O-OG 3.39Å; T456-A722 WeakPolarHBondContact CB-O 3.49Å; T456-A722 HydrophobicContact CG2-CB 4.27Å; T456-G726 VanDerWaalsContact OG1-CA 3.28Å; T456-G726 WeakPolarHBondContact OG1-CA 3.36Å
457	M	93.4	Very high	92	Very high	7 Å²	7	21.2 Å²	21.2	3%	0.034	11%	0.113	C	C	.	.	H	α-helix	trans	-72.8	-40	-178.9	-161.2	165.6	99.2	0	0	112.3	V453 F455 Y461 L628 S665 W666 L669 L723	V453-M457 VanDerWaalsContact O-CB 3.27Å; V453-M457 WeakPolarHBondContact O-CB 3.47Å; V453-M457 PolarHBondContact O-N 3.32Å; F455-M457 PolarHBondContact O-N 2.97Å; M457-Y461 WeakPolarHBondContact O-CB 3.19Å; M457-Y461 PolarHBondContact O-N 3.47Å; M457-L628 HydrophobicContact SD-CD1 4.18Å; M457-S665 VanDerWaalsContact CE-C 3.48Å; M457-S665 WeakPolarHBondContact SD-CB 3.43Å; M457-W666 VanDerWaalsContact CE-CA 3.49Å; M457-W666 HydrophobicContact CE-CB 4.16Å; M457-W666 HydrophobicContact CE-CD2 3.31Å; M457-W666 HydrophobicContact CE-CE3 3.47Å; M457-W666 VanDerWaalsContact CE-CE3 3.47Å; M457-W666 HydrophobicContact CE-CG 3.64Å; M457-W666 HydrophobicContact CE-CH2 4.27Å; M457-W666 HydrophobicContact CE-CZ2 4.17Å; M457-W666 HydrophobicContact CE-CZ3 3.94Å; M457-W666 HydrophobicContact CG-CZ2 4.35Å; M457-L669 HydrophobicContact CE-CB 4.1Å; M457-L669 HydrophobicContact CE-CD2 3.63Å; M457-L669 HydrophobicContact SD-CD2 4.33Å; M457-L723 HydrophobicContact CG-CD2 4.23Å
458	S	93.9	Very high	91.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-49.7	174.1	-176.9	0	0	0	0	112.3	W454 F455 S460 Y461 Y462 C693 A697	W454-S458 WeakPolarHBondContact O-CB 3.43Å; W454-S458 PolarHBondContact O-N 3.05Å; W454-S458 VanDerWaalsContact O-N 3.11Å; F455-S458 PolarHBondContact O-N 2.96Å; S458-S460 VanDerWaalsContact C-N 3.33Å; S458-S460 PolarHBondContact O-N 3.46Å; S458-Y461 PolarHBondContact O-N 2.99Å; S458-Y462 PolarHBondContact O-N 3.47Å; S458-Y462 WeakPolarHBondContact OG-CD2 3.39Å; S458-C693 WeakPolarHBondContact CB-O 3.23Å; S458-C693 VanDerWaalsContact CB-SG 3.52Å; S458-C693 PolarHBondContact OG-O 3.19Å; S458-C693 PolarHBondContact OG-SG 2.85Å; S458-C693 VanDerWaalsContact OG-SG 3.4Å; S458-A697 PolarHBondContact OG-N 3.46Å
459	F	94.8	Very high	90.8	Very high	26 Å²	26	19.2 Å²	19.2	11%	0.114	11%	0.105	C	C	.	.	H	α-helix	trans	-53.2	-48.7	179.1	176.8	-98.2	0	0	0	111.9	F455 G463 A696 G700 I703 F704 F718 A722	F455-F459 WeakPolarHBondContact O-CB 3.44Å; F455-F459 PolarHBondContact O-N 3.32Å; F459-G463 WeakPolarHBondContact O-CA 3.41Å; F459-G463 PolarHBondContact O-N 2.88Å; F459-A696 HydrophobicContact CB-CB 4.41Å; F459-G700 VanDerWaalsContact CD2-CA 3.47Å; F459-I703 HydrophobicContact CE2-CD1 4.14Å; F459-F704 HydrophobicContact CD1-CZ 4.15Å; F459-F704 AromaticContact CE1-CE1 3.66Å; F459-F704 HydrophobicContact CE1-CE1 3.66Å; F459-F704 AromaticContact CE1-CZ 3.64Å; F459-F704 HydrophobicContact CE1-CZ 3.64Å; F459-F704 HydrophobicContact CE2-CE1 4.41Å; F459-F704 AromaticContact CZ-CE1 3.59Å; F459-F704 HydrophobicContact CZ-CE1 3.59Å; F459-F704 HydrophobicContact CZ-CZ 4.02Å; F459-F718 HydrophobicContact CE1-CB 4.25Å; F459-A722 HydrophobicContact CD1-CB 4.17Å
460	S	93.8	Very high	90.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-68.7	-46.3	177	-62.8	0	0	0	0	113.1	T456 S458 L464 A719 A722	T456-S460 PolarHBondContact O-N 3.47Å; T456-S460 PolarHBondContact O-OG 3.39Å; S458-S460 VanDerWaalsContact C-N 3.33Å; S458-S460 PolarHBondContact O-N 3.46Å; S460-L464 VanDerWaalsContact O-CB 3.27Å; S460-L464 WeakPolarHBondContact O-CB 3.15Å; S460-L464 WeakPolarHBondContact O-CG 3.39Å; S460-L464 PolarHBondContact O-N 3.44Å; S460-A719 VanDerWaalsContact OG-CA 3.28Å; S460-A719 WeakPolarHBondContact OG-CA 3.43Å; S460-A719 PolarHBondContact OG-O 2.94Å; S460-A722 WeakPolarHBondContact OG-CB 3.49Å
461	Y	91.6	Very high	89.7	Confident	17 Å²	17	20.4 Å²	20.4	7%	0.067	11%	0.112	C	C	.	.	H	α-helix	trans	-70.9	-55.9	-172.1	-179.6	-100.6	0	0	0	112.8	M457 S458 T465 F658 W666	M457-Y461 WeakPolarHBondContact O-CB 3.19Å; M457-Y461 PolarHBondContact O-N 3.47Å; S458-Y461 PolarHBondContact O-N 2.99Å; Y461-T465 WeakPolarHBondContact O-CB 3.29Å; Y461-T465 PolarHBondContact O-N 2.92Å; Y461-T465 PolarHBondContact O-OG1 2.85Å; Y461-F658 HydrophobicContact CD2-CE1 4.01Å; Y461-F658 HydrophobicContact CD2-CZ 4.24Å; Y461-W666 AromaticContact CD1-CE2 3.79Å; Y461-W666 AromaticContact CD1-CZ2 3.87Å; Y461-W666 HydrophobicContact CD1-CZ2 3.87Å; Y461-W666 AromaticContact CD1-NE1 3.26Å; Y461-W666 VanDerWaalsContact CD1-NE1 3.26Å; Y461-W666 AromaticContact CD2-NE1 3.44Å; Y461-W666 AromaticContact CE1-NE1 3.6Å; Y461-W666 AromaticContact CE2-NE1 3.77Å; Y461-W666 AromaticContact CG-CE2 3.91Å; Y461-W666 HydrophobicContact CG-CZ2 4.04Å; Y461-W666 AromaticContact CG-NE1 3.17Å; Y461-W666 AromaticContact CZ-NE1 3.84Å
462	Y	89.7	Confident	89	Confident	22 Å²	22	18.8 Å²	18.8	9%	0.086	11%	0.105	C	C	.	.	H	α-helix	trans	-69.7	-37.9	-179.2	-69.8	-85.8	0	0	0	111.1	Y212 S458 T465 V466 W666 K694 A697	Y212-Y462 AromaticContact CE1-CD1 3.77Å; Y212-Y462 HydrophobicContact CE1-CD1 3.77Å; Y212-Y462 AromaticContact CE1-CE1 3.77Å; Y212-Y462 HydrophobicContact CE1-CE1 3.77Å; S458-Y462 PolarHBondContact O-N 3.47Å; S458-Y462 WeakPolarHBondContact OG-CD2 3.39Å; Y462-T465 PolarHBondContact O-N 3.28Å; Y462-V466 PolarHBondContact O-N 2.93Å; Y462-W666 HydrophobicContact CD2-CZ2 4.27Å; Y462-W666 AromaticContact CE2-CH2 3.93Å; Y462-W666 HydrophobicContact CE2-CH2 3.93Å; Y462-W666 AromaticContact CE2-CZ2 3.82Å; Y462-W666 HydrophobicContact CE2-CZ2 3.82Å; Y462-K694 PolarHBondContact OH-NZ 2.92Å; Y462-A697 HydrophobicContact CD1-CB 4.37Å; Y462-A697 HydrophobicContact CD2-CB 3.77Å; Y462-A697 HydrophobicContact CE2-CB 4.49Å; Y462-A697 HydrophobicContact CG-CB 3.69Å
463	G	89.9	Confident	88.2	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.2	-53.2	174.6	0	0	0	0	0	112.3	F459 W467	F459-G463 WeakPolarHBondContact O-CA 3.41Å; F459-G463 PolarHBondContact O-N 2.88Å; G463-W467 VanDerWaalsContact O-CB 3.27Å; G463-W467 WeakPolarHBondContact O-CB 3.29Å; G463-W467 PolarHBondContact O-N 3.14Å; G463-W467 VanDerWaalsContact O-N 3.08Å
464	L	88.1	Confident	87.6	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.8	-42.9	177.3	-74	-177.5	0	0	0	111.6	S460 V466 W467 F468 L642 F658 F704 A719	S460-L464 VanDerWaalsContact O-CB 3.27Å; S460-L464 WeakPolarHBondContact O-CB 3.15Å; S460-L464 WeakPolarHBondContact O-CG 3.39Å; S460-L464 PolarHBondContact O-N 3.44Å; L464-V466 PolarHBondContact O-N 2.93Å; L464-W467 HydrophobicContact CD2-CD2 4.46Å; L464-W467 HydrophobicContact CD2-CE3 3.89Å; L464-W467 HydrophobicContact CD2-CZ3 4.27Å; L464-W467 PolarHBondContact O-N 3.42Å; L464-W467 VanDerWaalsContact O-N 3.09Å; L464-F468 HydrophobicContact CB-CD2 4.12Å; L464-F468 HydrophobicContact CB-CE2 3.99Å; L464-F468 WeakPolarHBondContact O-CD2 3.28Å; L464-F468 PolarHBondContact O-N 3.16Å; L464-L642 HydrophobicContact CD1-CD1 4.38Å; L464-F658 HydrophobicContact CB-CE1 3.98Å; L464-F658 HydrophobicContact CB-CZ 4.33Å; L464-F658 HydrophobicContact CD1-CD2 4.44Å; L464-F658 HydrophobicContact CD1-CE1 4.04Å; L464-F658 HydrophobicContact CD1-CE2 3.95Å; L464-F658 HydrophobicContact CD1-CZ 3.73Å; L464-F704 HydrophobicContact CD2-CD2 4.05Å; L464-F704 HydrophobicContact CD2-CE2 4Å; L464-F704 HydrophobicContact CG-CD2 4.32Å; L464-F704 HydrophobicContact CG-CE2 3.99Å; L464-A719 HydrophobicContact CD1-CB 3.64Å; L464-A719 HydrophobicContact CD2-CB 4.11Å; L464-A719 HydrophobicContact CG-CB 3.8Å
465	T	84.4	Confident	86.9	Confident	46 Å²	46	29.6 Å²	29.6	28%	0.282	14%	0.144	S	C	.	.	H	α-helix	trans	-58.7	-33.3	-176.1	-61.1	0	0	0	0	113.1	Y461 Y462 P469	Y461-T465 WeakPolarHBondContact O-CB 3.29Å; Y461-T465 PolarHBondContact O-N 2.92Å; Y461-T465 PolarHBondContact O-OG1 2.85Å; Y462-T465 PolarHBondContact O-N 3.28Å; T465-P469 WeakPolarHBondContact O-CD 3.46Å
466	V	83.2	Confident	86.2	Confident	50 Å²	50	29.5 Å²	29.5	30%	0.303	15%	0.145	S	C	.	.	H	α-helix	trans	-83.1	-39.6	172.8	178.9	0	0	0	0	112	Y462 L464 F468 P469 I701	Y462-V466 PolarHBondContact O-N 2.93Å; L464-V466 PolarHBondContact O-N 2.93Å; V466-F468 VanDerWaalsContact C-N 3.26Å; V466-F468 PolarHBondContact O-N 3.37Å; V466-P469 WeakPolarHBondContact O-CD 3.49Å; V466-I701 HydrophobicContact CB-CG1 4.23Å; V466-I701 HydrophobicContact CB-CG2 4.35Å; V466-I701 HydrophobicContact CG1-CG2 4.07Å; V466-I701 HydrophobicContact CG2-CD1 3.99Å; V466-I701 HydrophobicContact CG2-CG1 3.86Å; V466-I701 HydrophobicContact CG2-CG2 4.46Å
467	W	87.1	Confident	85.4	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-30.3	177.2	175.7	85.4	0	0	0	113.8	G463 L464 D470 M471 M651 F704 P715 I716	G463-W467 VanDerWaalsContact O-CB 3.27Å; G463-W467 WeakPolarHBondContact O-CB 3.29Å; G463-W467 PolarHBondContact O-N 3.14Å; G463-W467 VanDerWaalsContact O-N 3.08Å; L464-W467 HydrophobicContact CD2-CD2 4.46Å; L464-W467 HydrophobicContact CD2-CE3 3.89Å; L464-W467 HydrophobicContact CD2-CZ3 4.27Å; L464-W467 PolarHBondContact O-N 3.42Å; L464-W467 VanDerWaalsContact O-N 3.09Å; W467-D470 PolarHBondContact O-N 2.97Å; W467-M471 HydrophobicContact CD2-CB 4.39Å; W467-M471 HydrophobicContact CH2-CG 4.32Å; W467-M471 HydrophobicContact CZ2-CB 4.41Å; W467-M471 HydrophobicContact CZ2-CE 3.75Å; W467-M471 HydrophobicContact CZ2-CG 4.17Å; W467-M471 VanDerWaalsContact O-CB 3.23Å; W467-M471 WeakPolarHBondContact O-CB 3.37Å; W467-M471 PolarHBondContact O-N 3.5Å; W467-M651 HydrophobicContact CH2-CE 4.14Å; W467-M651 HydrophobicContact CZ3-CE 3.92Å; W467-F704 HydrophobicContact CB-CB 4.07Å; W467-F704 VanDerWaalsContact CD1-O 3.31Å; W467-F704 HydrophobicContact CG-CB 4.32Å; W467-P715 HydrophobicContact CD2-CB 4.39Å; W467-P715 HydrophobicContact CZ2-CB 4.32Å; W467-P715 HydrophobicContact CZ2-CG 4.38Å; W467-I716 HydrophobicContact CH2-CD1 4.3Å; W467-I716 HydrophobicContact CH2-CG1 4.23Å
468	F	82.3	Confident	84.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-58.2	179.4	-90.3	-71.9	0	0	0	113	L464 V466 D470 M471 I472 L642 M651 L655 F658	L464-F468 HydrophobicContact CB-CD2 4.12Å; L464-F468 HydrophobicContact CB-CE2 3.99Å; L464-F468 WeakPolarHBondContact O-CD2 3.28Å; L464-F468 PolarHBondContact O-N 3.16Å; V466-F468 VanDerWaalsContact C-N 3.26Å; V466-F468 PolarHBondContact O-N 3.37Å; F468-D470 VanDerWaalsContact C-N 3.34Å; F468-D470 PolarHBondContact O-N 3.25Å; F468-M471 PolarHBondContact O-N 2.96Å; F468-I472 WeakPolarHBondContact O-CG1 3.37Å; F468-I472 PolarHBondContact O-N 2.72Å; F468-L642 HydrophobicContact CE1-CD1 4.2Å; F468-L642 HydrophobicContact CE1-CD2 3.4Å; F468-L642 HydrophobicContact CE1-CG 4.45Å; F468-L642 HydrophobicContact CE2-CD1 4.37Å; F468-L642 HydrophobicContact CZ-CD1 3.62Å; F468-L642 HydrophobicContact CZ-CD2 3.47Å; F468-L642 VanDerWaalsContact CZ-CD2 3.47Å; F468-L642 HydrophobicContact CZ-CG 4.19Å; F468-M651 HydrophobicContact CD1-CE 3.91Å; F468-M651 HydrophobicContact CE1-CE 4.05Å; F468-L655 HydrophobicContact CB-CD1 4.12Å; F468-L655 HydrophobicContact CB-CD2 4.21Å; F468-L655 HydrophobicContact CD1-CB 3.75Å; F468-L655 HydrophobicContact CD1-CD1 4.45Å; F468-L655 HydrophobicContact CD2-CB 4.24Å; F468-L655 HydrophobicContact CD2-CD1 3.49Å; F468-L655 VanDerWaalsContact CD2-CD1 3.49Å; F468-L655 HydrophobicContact CD2-CG 4.37Å; F468-L655 HydrophobicContact CE1-CB 3.71Å; F468-L655 HydrophobicContact CE2-CB 4.25Å; F468-L655 HydrophobicContact CE2-CD1 3.86Å; F468-L655 HydrophobicContact CG-CB 4.01Å; F468-L655 HydrophobicContact CG-CD1 3.83Å; F468-L655 HydrophobicContact CG-CD2 4.46Å; F468-L655 HydrophobicContact CG-CG 4.3Å; F468-L655 HydrophobicContact CZ-CB 3.97Å; F468-L655 HydrophobicContact CZ-CD1 4.45Å; F468-F658 AromaticContact CE2-CD1 3.91Å; F468-F658 HydrophobicContact CE2-CD1 3.91Å; F468-F658 HydrophobicContact CE2-CG 4.43Å
469	P	77.1	Confident	84.2	Confident	51 Å²	51	38 Å²	38	33%	0.331	20%	0.2	S	C	.	.	H	α-helix	trans	-54	-43.3	171.9	-29.3	35	0	0	0	114.2	T465 V466 I472 R473	T465-P469 WeakPolarHBondContact O-CD 3.46Å; V466-P469 WeakPolarHBondContact O-CD 3.49Å; P469-I472 PolarHBondContact O-N 3.16Å; P469-R473 WeakPolarHBondContact O-CB 3.39Å; P469-R473 PolarHBondContact O-N 3.46Å
470	D	79.3	Confident	83.5	Confident	52 Å²	52	41.1 Å²	41.1	28%	0.278	21%	0.212	S	C	.	.	H	α-helix	trans	-66.2	-39.8	-179.3	-73.5	-20	0	0	0	112	W467 F468 R473 H474 V708	W467-D470 PolarHBondContact O-N 2.97Å; F468-D470 VanDerWaalsContact C-N 3.34Å; F468-D470 PolarHBondContact O-N 3.25Å; D470-R473 PolarHBondContact O-N 3.44Å; D470-H474 WeakPolarHBondContact O-CB 3.27Å; D470-H474 PolarHBondContact O-N 3.01Å; D470-V708 HydrophobicContact CB-CG1 4.36Å; D470-V708 HydrophobicContact CB-CG2 3.94Å
471	M	83.6	Confident	82.8	Confident	5 Å²	5	43.9 Å²	43.9	3%	0.025	24%	0.235	C	C	.	.	H	α-helix	trans	-67.7	-36.8	174.1	-176.9	55.2	58	0	0	112	W467 F468 H474 L475 M651 V708 K712	W467-M471 HydrophobicContact CD2-CB 4.39Å; W467-M471 HydrophobicContact CH2-CG 4.32Å; W467-M471 HydrophobicContact CZ2-CB 4.41Å; W467-M471 HydrophobicContact CZ2-CE 3.75Å; W467-M471 HydrophobicContact CZ2-CG 4.17Å; W467-M471 VanDerWaalsContact O-CB 3.23Å; W467-M471 WeakPolarHBondContact O-CB 3.37Å; W467-M471 PolarHBondContact O-N 3.5Å; F468-M471 PolarHBondContact O-N 2.96Å; M471-H474 PolarHBondContact O-N 2.91Å; M471-L475 HydrophobicContact CG-CD1 4.4Å; M471-L475 VanDerWaalsContact O-CG 3.28Å; M471-L475 WeakPolarHBondContact O-CG 3.19Å; M471-L475 PolarHBondContact O-N 2.93Å; M471-L475 HydrophobicContact SD-CG 4.43Å; M471-M651 HydrophobicContact CG-CE 3.97Å; M471-V708 HydrophobicContact CE-CG1 4.43Å; M471-K712 HydrophobicContact CE-CG 4.41Å; M471-K712 HydrophobicContact SD-CG 4.31Å
472	I	80.6	Confident	82.4	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.036	26%	0.262	C	S	.	.	H	α-helix	trans	-64.5	-48.2	172.8	-70.2	163.1	0	0	0	110.3	F468 P469 H474 L475 Q476 E648 M651 I652	F468-I472 WeakPolarHBondContact O-CG1 3.37Å; F468-I472 PolarHBondContact O-N 2.72Å; P469-I472 PolarHBondContact O-N 3.16Å; I472-H474 VanDerWaalsContact C-N 3.28Å; I472-H474 PolarHBondContact O-N 3.03Å; I472-L475 PolarHBondContact O-N 3.41Å; I472-L475 VanDerWaalsContact O-N 3.13Å; I472-Q476 HydrophobicContact CG2-CG 4.41Å; I472-Q476 WeakPolarHBondContact O-CG 3.48Å; I472-Q476 PolarHBondContact O-N 3.21Å; I472-E648 HydrophobicContact CG2-CG 4.07Å; I472-M651 HydrophobicContact CD1-CB 4.34Å; I472-M651 HydrophobicContact CG1-CB 4.01Å; I472-I652 HydrophobicContact CD1-CG1 3.72Å
473	R	78	Confident	82.1	Confident	145 Å²	145	54.1 Å²	54.1	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-38.1	176.4	-174.1	175.7	179.5	171	-1.1	111.8	P469 D470 A477	P469-R473 WeakPolarHBondContact O-CB 3.39Å; P469-R473 PolarHBondContact O-N 3.46Å; D470-R473 PolarHBondContact O-N 3.44Å; R473-A477 WeakPolarHBondContact O-CB 3.5Å; R473-A477 PolarHBondContact O-N 3Å
474	H	82.9	Confident	82	Confident	68 Å²	68	56 Å²	56	32%	0.315	30%	0.299	S	S	.	.	H	α-helix	trans	-65.3	-45.6	173.1	178.7	-86.2	0	0	0	112.2	D470 M471 I472 A477 V478 V708 G709	D470-H474 WeakPolarHBondContact O-CB 3.27Å; D470-H474 PolarHBondContact O-N 3.01Å; M471-H474 PolarHBondContact O-N 2.91Å; I472-H474 VanDerWaalsContact C-N 3.28Å; I472-H474 PolarHBondContact O-N 3.03Å; H474-A477 PolarHBondContact O-N 3.4Å; H474-V478 WeakPolarHBondContact O-CG2 3.45Å; H474-V478 PolarHBondContact O-N 3.41Å; H474-V708 HydrophobicContact CB-CG1 3.92Å; H474-G709 VanDerWaalsContact NE2-CA 3.33Å; H474-G709 WeakPolarHBondContact NE2-CA 3.2Å
475	L	81.4	Confident	82.1	Confident	38 Å²	38	62.1 Å²	62.1	20%	0.199	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-42.2	176.5	-71.6	168.7	0	0	0	111.9	M471 I472 A477 V478 D479 M651	M471-L475 HydrophobicContact CG-CD1 4.4Å; M471-L475 VanDerWaalsContact O-CG 3.28Å; M471-L475 WeakPolarHBondContact O-CG 3.19Å; M471-L475 PolarHBondContact O-N 2.93Å; M471-L475 HydrophobicContact SD-CG 4.43Å; I472-L475 PolarHBondContact O-N 3.41Å; I472-L475 VanDerWaalsContact O-N 3.13Å; L475-A477 VanDerWaalsContact C-N 3.34Å; L475-A477 PolarHBondContact O-N 3.45Å; L475-V478 PolarHBondContact O-N 3.3Å; L475-D479 PolarHBondContact O-N 3.48Å; L475-M651 HydrophobicContact CD1-CG 4.07Å
476	Q	80.2	Confident	82.3	Confident	68 Å²	68	63.7 Å²	63.7	32%	0.318	34%	0.335	S	S	.	.	H	α-helix	trans	-60.1	-42	172.7	-71.5	172.5	-12.4	0	0	111.7	I472 D479 Y480 E648	I472-Q476 HydrophobicContact CG2-CG 4.41Å; I472-Q476 WeakPolarHBondContact O-CG 3.48Å; I472-Q476 PolarHBondContact O-N 3.21Å; Q476-D479 PolarHBondContact O-N 3.2Å; Q476-Y480 VanDerWaalsContact O-CB 3.27Å; Q476-Y480 WeakPolarHBondContact O-CB 3.3Å; Q476-Y480 PolarHBondContact O-N 3.33Å; Q476-E648 PolarHBondContact NE2-OE1 2.94Å
477	A	77.6	Confident	82.7	Confident	57 Å²	57	64.1 Å²	64.1	47%	0.471	33%	0.333	S	S	.	.	H	α-helix	trans	-66.3	-37	177.3	0	0	0	0	0	112.8	R473 H474 L475 A481	R473-A477 WeakPolarHBondContact O-CB 3.5Å; R473-A477 PolarHBondContact O-N 3Å; H474-A477 PolarHBondContact O-N 3.4Å; L475-A477 VanDerWaalsContact C-N 3.34Å; L475-A477 PolarHBondContact O-N 3.45Å; A477-A481 VanDerWaalsContact O-CB 3.31Å; A477-A481 WeakPolarHBondContact O-CB 3.33Å; A477-A481 PolarHBondContact O-N 2.8Å
478	V	82.5	Confident	82.9	Confident	78 Å²	78	69 Å²	69	47%	0.473	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-43.3	174.6	171	0	0	0	0	111.7	H474 L475 A481 S482	H474-V478 WeakPolarHBondContact O-CG2 3.45Å; H474-V478 PolarHBondContact O-N 3.41Å; L475-V478 PolarHBondContact O-N 3.3Å; V478-A481 PolarHBondContact O-N 2.88Å; V478-S482 WeakPolarHBondContact O-CB 3.47Å; V478-S482 PolarHBondContact O-N 2.85Å
479	D	80.4	Confident	83.2	Confident	68 Å²	68	71.7 Å²	71.7	36%	0.364	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-46.6	174.6	-178.4	17.4	0	0	0	110.9	L475 Q476 A481 S482 R483	L475-D479 PolarHBondContact O-N 3.48Å; Q476-D479 PolarHBondContact O-N 3.2Å; D479-A481 PolarHBondContact O-N 3.42Å; D479-S482 WeakPolarHBondContact O-CB 3.39Å; D479-S482 PolarHBondContact O-N 3.25Å; D479-S482 VanDerWaalsContact O-N 3.08Å; D479-S482 PolarHBondContact O-OG 2.86Å; D479-R483 VanDerWaalsContact CG-NH2 3.3Å; D479-R483 WeakPolarHBondContact O-CG 3.45Å; D479-R483 PolarHBondContact O-N 2.98Å; D479-R483 IonicContact OD1-CZ 3.46Å; D479-R483 IonicContact OD1-NE 2.75Å; D479-R483 PolarHBondContact OD1-NE 3.18Å; D479-R483 IonicContact OD1-NH2 2.84Å; D479-R483 PolarHBondContact OD1-NH2 3.24Å; D479-R483 VanDerWaalsContact OD1-NH2 3.13Å; D479-R483 IonicContact OD2-CZ 3.72Å; D479-R483 IonicContact OD2-NE 3.47Å; D479-R483 IonicContact OD2-NH2 3.16Å; D479-R483 PolarHBondContact OD2-NH2 2.99Å
480	Y	78.9	Confident	83.7	Confident	91 Å²	91	72 Å²	72	36%	0.357	39%	0.389	S	S	.	.	H	α-helix	trans	-55.3	-49.8	173.5	-173.7	-88.6	0	0	0	111.5	Q476 S482 R483 N503	Q476-Y480 VanDerWaalsContact O-CB 3.27Å; Q476-Y480 WeakPolarHBondContact O-CB 3.3Å; Q476-Y480 PolarHBondContact O-N 3.33Å; Y480-S482 VanDerWaalsContact C-N 3.29Å; Y480-S482 PolarHBondContact O-N 3.24Å; Y480-R483 PolarHBondContact O-N 3.25Å; Y480-N503 WeakPolarHBondContact CD1-OD1 3.47Å; Y480-N503 HydrophobicContact CE1-CB 3.87Å; Y480-N503 WeakPolarHBondContact CE1-OD1 3.38Å; Y480-N503 HydrophobicContact CE2-CB 4.32Å; Y480-N503 PolarHBondContact O-ND2 3.25Å
481	A	79.4	Confident	84.3	Confident	59 Å²	59	77.5 Å²	77.5	49%	0.488	41%	0.406	S	S	.	.	H	α-helix	trans	-61	-34.8	176.4	0	0	0	0	0	112.8	A477 V478 D479 R483 T484	A477-A481 VanDerWaalsContact O-CB 3.31Å; A477-A481 WeakPolarHBondContact O-CB 3.33Å; A477-A481 PolarHBondContact O-N 2.8Å; V478-A481 PolarHBondContact O-N 2.88Å; D479-A481 PolarHBondContact O-N 3.42Å; A481-R483 PolarHBondContact O-N 2.75Å; A481-T484 WeakPolarHBondContact O-CB 3.45Å; A481-T484 PolarHBondContact O-N 3.12Å; A481-T484 PolarHBondContact O-OG1 3.17Å
482	S	83.3	Confident	84.7	Confident	89 Å²	89	78.4 Å²	78.4	62%	0.622	41%	0.412	S	S	*	.	H	α-helix	trans	-66.5	-23.5	176.3	82.9	0	0	0	0	113.5	V478 D479 Y480	V478-S482 WeakPolarHBondContact O-CB 3.47Å; V478-S482 PolarHBondContact O-N 2.85Å; D479-S482 WeakPolarHBondContact O-CB 3.39Å; D479-S482 PolarHBondContact O-N 3.25Å; D479-S482 VanDerWaalsContact O-N 3.08Å; D479-S482 PolarHBondContact O-OG 2.86Å; Y480-S482 VanDerWaalsContact C-N 3.29Å; Y480-S482 PolarHBondContact O-N 3.24Å
483	R	84.9	Confident	85.3	Confident	164 Å²	164	82 Å²	82	62%	0.619	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	7.7	178.6	-61.2	172.5	-167.9	-151.7	8.4	113.7	D479 Y480 A481 K485 N503	D479-R483 VanDerWaalsContact CG-NH2 3.3Å; D479-R483 WeakPolarHBondContact O-CG 3.45Å; D479-R483 PolarHBondContact O-N 2.98Å; D479-R483 IonicContact OD1-CZ 3.46Å; D479-R483 IonicContact OD1-NE 2.75Å; D479-R483 PolarHBondContact OD1-NE 3.18Å; D479-R483 IonicContact OD1-NH2 2.84Å; D479-R483 PolarHBondContact OD1-NH2 3.24Å; D479-R483 VanDerWaalsContact OD1-NH2 3.13Å; D479-R483 IonicContact OD2-CZ 3.72Å; D479-R483 IonicContact OD2-NE 3.47Å; D479-R483 IonicContact OD2-NH2 3.16Å; D479-R483 PolarHBondContact OD2-NH2 2.99Å; Y480-R483 PolarHBondContact O-N 3.25Å; A481-R483 PolarHBondContact O-N 2.75Å; R483-K485 PolarHBondContact O-N 3.47Å; R483-N503 VanDerWaalsContact C-ND2 3.31Å; R483-N503 PolarHBondContact O-ND2 3.5Å
484	T	86.6	Confident	85.9	Confident	41 Å²	41	81 Å²	81	25%	0.252	43%	0.429	S	S	.	.			trans	-63.7	127.9	-179.3	-51.4	0	0	0	0	110.8	A481 N503 I505	A481-T484 WeakPolarHBondContact O-CB 3.45Å; A481-T484 PolarHBondContact O-N 3.12Å; A481-T484 PolarHBondContact O-OG1 3.17Å; T484-N503 WeakPolarHBondContact CA-ND2 3.36Å; T484-N503 PolarHBondContact N-ND2 3.36Å; T484-N503 PolarHBondContact OG1-OD1 2.96Å; T484-I505 HydrophobicContact CG2-CD1 3.8Å; T484-I505 HydrophobicContact CG2-CG1 3.72Å
485	K	89.3	Confident	86.3	Confident	127 Å²	127	80.6 Å²	80.6	55%	0.552	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	127.1	175.1	-64.6	-179	-178.1	176.9	0	110	R483 F487 N503 Q504 I505	R483-K485 PolarHBondContact O-N 3.47Å; K485-F487 HydrophobicContact CB-CD2 4.28Å; K485-F487 HydrophobicContact CB-CE2 3.59Å; K485-F487 HydrophobicContact CB-CZ 4.07Å; K485-F487 HydrophobicContact CD-CE2 4.35Å; K485-F487 HydrophobicContact CD-CZ 4.16Å; K485-N503 PolarHBondContact N-O 3.04Å; K485-Q504 CarbonylContact O-C 3.5Å; K485-Q504 VanDerWaalsContact O-CA 3.3Å; K485-Q504 WeakPolarHBondContact O-CA 3.26Å; K485-I505 PolarHBondContact O-N 3Å
486	V	90.5	Very high	86.9	Confident	79 Å²	79	82.3 Å²	82.3	48%	0.479	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.9	175.2	-173.9	0	0	0	0	109.3	I505 R507	V486-I505 CarbonylContact C-O 3.55Å; V486-I505 WeakPolarHBondContact CA-O 2.89Å; V486-I505 HydrophobicContact CG2-CB 4.44Å; V486-R507 HydrophobicContact CG1-CG 4.44Å
487	F	91.2	Very high	87.3	Confident	59 Å²	59	80.4 Å²	80.4	26%	0.259	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	99.6	-177.7	-68.1	-82.4	0	0	0	109.9	K485 E490 Q504 I505 H506 R507	K485-F487 HydrophobicContact CB-CD2 4.28Å; K485-F487 HydrophobicContact CB-CE2 3.59Å; K485-F487 HydrophobicContact CB-CZ 4.07Å; K485-F487 HydrophobicContact CD-CE2 4.35Å; K485-F487 HydrophobicContact CD-CZ 4.16Å; F487-E490 VanDerWaalsContact CB-CD 3.48Å; F487-E490 HydrophobicContact CB-CG 3.99Å; F487-E490 WeakPolarHBondContact CB-OE2 3.46Å; F487-E490 VanDerWaalsContact CD1-OE1 3.23Å; F487-E490 WeakPolarHBondContact CD1-OE1 3.29Å; F487-Q504 HydrophobicContact CD2-CB 4.31Å; F487-Q504 HydrophobicContact CE2-CB 4.13Å; F487-Q504 HydrophobicContact CE2-CG 4.14Å; F487-I505 PolarHBondContact N-O 3.43Å; F487-H506 AromaticContact CD2-CE1 3.66Å; F487-H506 AromaticContact CD2-ND1 3.87Å; F487-H506 AromaticContact CG-ND1 3.97Å; F487-H506 WeakPolarHBondContact O-CA 3.47Å; F487-R507 PolarHBondContact O-N 3.35Å
488	P	91.4	Very high	87.9	Confident	102 Å²	102	83.4 Å²	83.4	66%	0.662	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	131.1	-177.1	34.2	-31.7	0	0	0	112.4	E490	P488-E490 VanDerWaalsContact C-N 3.33Å; P488-E490 PolarHBondContact O-N 3Å
489	G	87.4	Confident	88.2	Confident	57 Å²	57	84.9 Å²	84.9	59%	0.588	44%	0.443	S	S	*	.	S	Bend	trans	66.8	28	169	0	0	0	0	0	115.1	R491 R507	G489-R491 PolarHBondContact O-N 3.32Å; G489-R507 PolarHBondContact N-O 3.48Å
490	E	89.2	Confident	88.4	Confident	57 Å²	57	84.4 Å²	84.4	27%	0.266	44%	0.442	S	S	.	.			trans	-63.7	132.2	175.7	-65.2	-172	128.9	0	0	110.9	F487 P488 V492 H506 G509 Q510 Y511	F487-E490 VanDerWaalsContact CB-CD 3.48Å; F487-E490 HydrophobicContact CB-CG 3.99Å; F487-E490 WeakPolarHBondContact CB-OE2 3.46Å; F487-E490 VanDerWaalsContact CD1-OE1 3.23Å; F487-E490 WeakPolarHBondContact CD1-OE1 3.29Å; P488-E490 VanDerWaalsContact C-N 3.33Å; P488-E490 PolarHBondContact O-N 3Å; E490-V492 HydrophobicContact CB-CG2 4.41Å; E490-H506 IonicContact OE2-CE1 2.8Å; E490-H506 IonicContact OE2-CG 3.88Å; E490-H506 IonicContact OE2-ND1 2.77Å; E490-H506 PolarHBondContact OE2-ND1 3.07Å; E490-G509 CarbonylContact O-C 3.48Å; E490-G509 VanDerWaalsContact O-CA 3.24Å; E490-G509 WeakPolarHBondContact O-CA 3.47Å; E490-Q510 PolarHBondContact O-N 3.22Å; E490-Y511 PolarHBondContact OE2-OH 3.28Å
491	R	91.4	Very high	88.9	Confident	169 Å²	169	80.3 Å²	80.3	64%	0.638	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	119.3	165.8	-178.5	167.3	169.9	163.5	-1.9	108.6	G489 E493 Q510	G489-R491 PolarHBondContact O-N 3.32Å; R491-E493 HydrophobicContact CG-CG 4.34Å; R491-E493 IonicContact CZ-OE1 3.12Å; R491-E493 IonicContact NE-OE1 2.73Å; R491-E493 PolarHBondContact NE-OE1 3.01Å; R491-E493 IonicContact NH2-OE1 2.67Å; R491-E493 PolarHBondContact NH2-OE1 3.08Å; R491-Q510 CarbonylContact C-O 3.59Å; R491-Q510 WeakPolarHBondContact CA-O 3.32Å; R491-Q510 HydrophobicContact CB-CB 4.44Å; R491-Q510 HydrophobicContact CG-CB 4.23Å
492	V	91	Very high	89.2	Confident	23 Å²	23	80.9 Å²	80.9	14%	0.139	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.4	-176.2	-169.9	0	0	0	0	107.7	E490 V495 F497 Q510 Y511 F512	E490-V492 HydrophobicContact CB-CG2 4.41Å; V492-V495 HydrophobicContact CG1-CB 3.67Å; V492-V495 HydrophobicContact CG1-CG1 4.42Å; V492-V495 HydrophobicContact CG1-CG2 3.46Å; V492-V495 VanDerWaalsContact CG1-CG2 3.46Å; V492-F497 HydrophobicContact CG1-CE2 4.18Å; V492-F497 HydrophobicContact CG1-CZ 4.04Å; V492-Q510 PolarHBondContact N-O 2.89Å; V492-Y511 HydrophobicContact CB-CD1 3.83Å; V492-Y511 HydrophobicContact CB-CE1 4.12Å; V492-Y511 HydrophobicContact CG2-CD1 4Å; V492-Y511 HydrophobicContact CG2-CE1 3.75Å; V492-Y511 WeakPolarHBondContact O-CA 3.19Å; V492-F512 PolarHBondContact O-N 3.43Å
493	E	92.8	Very high	89.4	Confident	83 Å²	83	77.5 Å²	77.5	39%	0.388	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	132.5	-176.8	-51.1	-172.6	152.2	0	0	109.6	R491 V495 F512	R491-E493 HydrophobicContact CG-CG 4.34Å; R491-E493 IonicContact CZ-OE1 3.12Å; R491-E493 IonicContact NE-OE1 2.73Å; R491-E493 PolarHBondContact NE-OE1 3.01Å; R491-E493 IonicContact NH2-OE1 2.67Å; R491-E493 PolarHBondContact NH2-OE1 3.08Å; E493-V495 PolarHBondContact O-N 3.26Å; E493-F512 WeakPolarHBondContact CA-O 3.39Å; E493-F512 HydrophobicContact CG-CB 4.21Å
494	H	91.4	Very high	89.7	Confident	123 Å²	123	71 Å²	71	57%	0.569	37%	0.371	S	S	*	.	S	Bend	trans	58.2	22.5	176.2	-52.3	-64.2	0	0	0	116.1	F512 D514	H494-F512 PolarHBondContact N-O 2.78Å; H494-D514 PolarHBondContact N-OD1 3.38Å; H494-D514 VanDerWaalsContact N-OD1 3.16Å
495	V	92.3	Very high	89.9	Confident	60 Å²	60	71 Å²	71	36%	0.364	37%	0.369	S	S	.	.			trans	-87.4	138.2	179.2	176.3	0	0	0	0	111.1	V492 E493 F497 D514 K515	V492-V495 HydrophobicContact CG1-CB 3.67Å; V492-V495 HydrophobicContact CG1-CG1 4.42Å; V492-V495 HydrophobicContact CG1-CG2 3.46Å; V492-V495 VanDerWaalsContact CG1-CG2 3.46Å; E493-V495 PolarHBondContact O-N 3.26Å; V495-F497 HydrophobicContact CB-CE2 4.21Å; V495-F497 HydrophobicContact CG1-CD2 4.14Å; V495-F497 HydrophobicContact CG1-CE1 4.46Å; V495-F497 HydrophobicContact CG1-CE2 3.94Å; V495-F497 HydrophobicContact CG1-CG 4.49Å; V495-F497 HydrophobicContact CG1-CZ 4.12Å; V495-D514 PolarHBondContact N-OD1 2.96Å; V495-D514 CarbonylContact O-C 3.46Å; V495-D514 WeakPolarHBondContact O-CA 3.4Å; V495-K515 PolarHBondContact O-N 3.35Å
496	T	92.2	Very high	90.1	Very high	74 Å²	74	65.4 Å²	65.4	45%	0.454	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	106.1	167.7	-58.1	0	0	0	0	110	K515 I517	T496-K515 CarbonylContact C-O 3.55Å; T496-K515 WeakPolarHBondContact CA-O 3.05Å; T496-K515 HydrophobicContact CG2-CB 4.16Å; T496-I517 HydrophobicContact CG2-CD1 4.05Å; T496-I517 HydrophobicContact CG2-CG1 4.36Å
497	F	90.5	Very high	90.3	Very high	28 Å²	28	67.4 Å²	67.4	12%	0.123	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	124.8	169.1	-62.6	-90.3	0	0	0	109.4	V492 V495 F499 D514 K515 F516 I517 L519	V492-F497 HydrophobicContact CG1-CE2 4.18Å; V492-F497 HydrophobicContact CG1-CZ 4.04Å; V495-F497 HydrophobicContact CB-CE2 4.21Å; V495-F497 HydrophobicContact CG1-CD2 4.14Å; V495-F497 HydrophobicContact CG1-CE1 4.46Å; V495-F497 HydrophobicContact CG1-CE2 3.94Å; V495-F497 HydrophobicContact CG1-CG 4.49Å; V495-F497 HydrophobicContact CG1-CZ 4.12Å; F497-F499 AromaticContact CD1-CE1 4Å; F497-F499 HydrophobicContact CD1-CE1 4Å; F497-F499 AromaticContact CD1-CZ 3.83Å; F497-F499 HydrophobicContact CD1-CZ 3.83Å; F497-F499 HydrophobicContact CE1-CZ 4.31Å; F497-D514 HydrophobicContact CE2-CB 4.44Å; F497-K515 PolarHBondContact N-O 3.45Å; F497-F516 HydrophobicContact CB-CD1 4.05Å; F497-F516 HydrophobicContact CB-CE1 4.44Å; F497-F516 AromaticContact CD2-CD1 3.78Å; F497-F516 HydrophobicContact CD2-CD1 3.78Å; F497-F516 AromaticContact CD2-CE1 3.43Å; F497-F516 HydrophobicContact CD2-CE1 3.43Å; F497-F516 VanDerWaalsContact CD2-CE1 3.43Å; F497-F516 HydrophobicContact CD2-CE2 4.31Å; F497-F516 HydrophobicContact CD2-CG 4.35Å; F497-F516 AromaticContact CD2-CZ 3.72Å; F497-F516 HydrophobicContact CD2-CZ 3.72Å; F497-F516 AromaticContact CE2-CE1 3.73Å; F497-F516 HydrophobicContact CE2-CE1 3.73Å; F497-F516 HydrophobicContact CE2-CE2 4.48Å; F497-F516 AromaticContact CE2-CZ 3.7Å; F497-F516 HydrophobicContact CE2-CZ 3.7Å; F497-F516 HydrophobicContact CG-CD1 4.04Å; F497-F516 AromaticContact CG-CE1 3.94Å; F497-F516 HydrophobicContact CG-CE1 3.94Å; F497-F516 HydrophobicContact CZ-CE1 4.43Å; F497-I517 PolarHBondContact O-N 3.3Å; F497-L519 HydrophobicContact CB-CD2 3.5Å; F497-L519 VanDerWaalsContact CB-CD2 3.5Å; F497-L519 WeakPolarHBondContact O-CD2 3.29Å
498	N	89.6	Confident	90.3	Very high	120 Å²	120	66.3 Å²	66.3	64%	0.642	35%	0.349	S	S	*	.			trans	-135.3	15.4	179.7	66.2	-2.4	0	0	0	112.8
499	F	88.2	Confident	90.3	Very high	110 Å²	110	61.6 Å²	61.6	48%	0.482	32%	0.319	S	S	.	.	S	Bend	trans	-127.9	156.6	-176	59.4	-89.5	0	0	0	110.8	F497 L501 L519	F497-F499 AromaticContact CD1-CE1 4Å; F497-F499 HydrophobicContact CD1-CE1 4Å; F497-F499 AromaticContact CD1-CZ 3.83Å; F497-F499 HydrophobicContact CD1-CZ 3.83Å; F497-F499 HydrophobicContact CE1-CZ 4.31Å; F499-L501 HydrophobicContact CD2-CD2 4.06Å; F499-L501 HydrophobicContact CE2-CD2 3.47Å; F499-L501 VanDerWaalsContact CE2-CD2 3.47Å; F499-L501 HydrophobicContact CZ-CD2 4.25Å; F499-L501 PolarHBondContact O-N 2.97Å; F499-L519 WeakPolarHBondContact O-CB 3.27Å
500	T	85.9	Confident	90.6	Very high	57 Å²	57	63.2 Å²	63.2	35%	0.35	31%	0.311	S	S	.	.			trans	-74	125.7	-175.9	52.9	0	0	0	0	111.8	E502 R520	T500-E502 PolarHBondContact OG1-OE1 2.98Å; T500-R520 CarbonylContact C-O 3.44Å; T500-R520 WeakPolarHBondContact CA-O 3.41Å; T500-R520 HydrophobicContact CG2-CB 3.79Å; T500-R520 HydrophobicContact CG2-CG 4.11Å
501	L	87.6	Confident	90.9	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	120.4	172.5	-60.9	178.7	0	0	0	108.6	F499 R520 L521 K522 V524	F499-L501 HydrophobicContact CD2-CD2 4.06Å; F499-L501 HydrophobicContact CE2-CD2 3.47Å; F499-L501 VanDerWaalsContact CE2-CD2 3.47Å; F499-L501 HydrophobicContact CZ-CD2 4.25Å; F499-L501 PolarHBondContact O-N 2.97Å; L501-R520 PolarHBondContact N-O 3.26Å; L501-L521 HydrophobicContact CB-CD2 3.86Å; L501-L521 HydrophobicContact CD1-CD2 3.85Å; L501-L521 HydrophobicContact CG-CD2 4.21Å; L501-L521 WeakPolarHBondContact O-CA 3.18Å; L501-K522 PolarHBondContact O-N 3.03Å; L501-V524 HydrophobicContact CB-CG2 3.87Å; L501-V524 WeakPolarHBondContact O-CG2 3.28Å
502	E	86.6	Confident	91.1	Very high	71 Å²	71	55.9 Å²	55.9	33%	0.332	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	128.8	-175	-51.5	-164.6	-168.5	0	0	110.7	T500 Q504 K522	T500-E502 PolarHBondContact OG1-OE1 2.98Å; E502-Q504 VanDerWaalsContact O-CG 3.24Å; E502-Q504 WeakPolarHBondContact O-CG 3.46Å; E502-Q504 PolarHBondContact O-NE2 2.95Å; E502-K522 WeakPolarHBondContact CA-O 3.34Å; E502-K522 HydrophobicContact CB-CB 4.41Å; E502-K522 HydrophobicContact CG-CB 4.11Å; E502-K522 HydrophobicContact CG-CD 4.25Å; E502-K522 HydrophobicContact CG-CG 4.3Å; E502-K522 WeakPolarHBondContact OE1-CE 3.33Å; E502-K522 IonicContact OE1-NZ 2.76Å; E502-K522 PolarHBondContact OE1-NZ 2.84Å; E502-K522 IonicContact OE2-NZ 3.69Å; E502-K522 PolarHBondContact OE2-NZ 3.44Å; E502-K522 VanDerWaalsContact OE2-NZ 3.09Å
503	N	86.9	Confident	91.2	Very high	18 Å²	18	57.3 Å²	57.3	10%	0.096	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	60.8	57.1	175.3	-154.4	31.3	0	0	0	115.1	Y480 R483 T484 K485 K522 S523	Y480-N503 WeakPolarHBondContact CD1-OD1 3.47Å; Y480-N503 HydrophobicContact CE1-CB 3.87Å; Y480-N503 WeakPolarHBondContact CE1-OD1 3.38Å; Y480-N503 HydrophobicContact CE2-CB 4.32Å; Y480-N503 PolarHBondContact O-ND2 3.25Å; R483-N503 VanDerWaalsContact C-ND2 3.31Å; R483-N503 PolarHBondContact O-ND2 3.5Å; T484-N503 WeakPolarHBondContact CA-ND2 3.36Å; T484-N503 PolarHBondContact N-ND2 3.36Å; T484-N503 PolarHBondContact OG1-OD1 2.96Å; K485-N503 PolarHBondContact N-O 3.04Å; N503-K522 PolarHBondContact N-O 3.4Å; N503-S523 WeakPolarHBondContact CA-O 3.41Å
504	Q	90.9	Very high	91.3	Very high	27 Å²	27	53.4 Å²	53.4	13%	0.126	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	141.5	-170.7	-48.1	-174	22	0	0	111.9	K485 F487 E502 S523 V524 S525	K485-Q504 CarbonylContact O-C 3.5Å; K485-Q504 VanDerWaalsContact O-CA 3.3Å; K485-Q504 WeakPolarHBondContact O-CA 3.26Å; F487-Q504 HydrophobicContact CD2-CB 4.31Å; F487-Q504 HydrophobicContact CE2-CB 4.13Å; F487-Q504 HydrophobicContact CE2-CG 4.14Å; E502-Q504 VanDerWaalsContact O-CG 3.24Å; E502-Q504 WeakPolarHBondContact O-CG 3.46Å; E502-Q504 PolarHBondContact O-NE2 2.95Å; Q504-S523 PolarHBondContact N-O 3.38Å; Q504-V524 CarbonylContact O-C 3.6Å; Q504-V524 VanDerWaalsContact O-CA 3.25Å; Q504-V524 WeakPolarHBondContact O-CA 3.38Å; Q504-S525 PolarHBondContact O-N 3.24Å
505	I	92.2	Very high	91.4	Very high	41 Å²	41	51.8 Å²	51.8	21%	0.21	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	110	173.2	-56.5	174.9	0	0	0	108.4	T484 K485 V486 F487 R507 S525 E527	T484-I505 HydrophobicContact CG2-CD1 3.8Å; T484-I505 HydrophobicContact CG2-CG1 3.72Å; K485-I505 PolarHBondContact O-N 3Å; V486-I505 CarbonylContact C-O 3.55Å; V486-I505 WeakPolarHBondContact CA-O 2.89Å; V486-I505 HydrophobicContact CG2-CB 4.44Å; F487-I505 PolarHBondContact N-O 3.43Å; I505-R507 HydrophobicContact CG2-CG 3.88Å; I505-S525 CarbonylContact C-O 3.54Å; I505-S525 VanDerWaalsContact CA-O 3.28Å; I505-S525 WeakPolarHBondContact CA-O 3.45Å; I505-E527 HydrophobicContact CG2-CG 4.24Å
506	H	93.4	Very high	91.4	Very high	10 Å²	10	49 Å²	49	5%	0.046	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.9	175.2	-53.6	-94.1	0	0	0	108.5	F487 E490 Y511 S525 F526 E527	F487-H506 AromaticContact CD2-CE1 3.66Å; F487-H506 AromaticContact CD2-ND1 3.87Å; F487-H506 AromaticContact CG-ND1 3.97Å; F487-H506 WeakPolarHBondContact O-CA 3.47Å; E490-H506 IonicContact OE2-CE1 2.8Å; E490-H506 IonicContact OE2-CG 3.88Å; E490-H506 IonicContact OE2-ND1 2.77Å; E490-H506 PolarHBondContact OE2-ND1 3.07Å; H506-Y511 WeakPolarHBondContact CB-OH 3.41Å; H506-Y511 PolarHBondContact ND1-OH 2.69Å; H506-S525 PolarHBondContact N-O 3.16Å; H506-F526 HydrophobicContact CB-CD1 3.66Å; H506-F526 HydrophobicContact CB-CE1 3.94Å; H506-F526 AromaticContact CD2-CD1 3.88Å; H506-F526 AromaticContact CD2-CE1 3.43Å; H506-F526 VanDerWaalsContact CD2-CE1 3.43Å; H506-F526 WeakPolarHBondContact CD2-CE1 3.41Å; H506-F526 AromaticContact CD2-CZ 3.82Å; H506-F526 AromaticContact CG-CD1 3.94Å; H506-F526 AromaticContact CG-CE1 3.69Å; H506-E527 PolarHBondContact O-N 2.95Å
507	R	93.3	Very high	91.4	Very high	121 Å²	121	48.2 Å²	48.2	46%	0.457	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	121.9	-173.1	-67.4	-166.3	155.9	170.9	-6.1	111.7	V486 F487 G489 I505 G509 E527	V486-R507 HydrophobicContact CG1-CG 4.44Å; F487-R507 PolarHBondContact O-N 3.35Å; G489-R507 PolarHBondContact N-O 3.48Å; I505-R507 HydrophobicContact CG2-CG 3.88Å; R507-G509 PolarHBondContact O-N 3.07Å; R507-E527 WeakPolarHBondContact CA-O 3.47Å; R507-E527 HydrophobicContact CG-CB 4.35Å; R507-E527 IonicContact CZ-OE2 3.17Å; R507-E527 IonicContact NE-OE2 2.76Å; R507-E527 PolarHBondContact NE-OE2 2.69Å; R507-E527 IonicContact NH2-OE2 2.71Å; R507-E527 PolarHBondContact NH2-OE2 2.96Å
508	G	92.3	Very high	91.1	Very high	36 Å²	36	49.5 Å²	49.5	37%	0.371	26%	0.259	S	S	.	.	S	Bend	trans	63	30.6	-177.8	0	0	0	0	0	113	E527 D528	G508-E527 PolarHBondContact N-O 3.12Å; G508-D528 WeakPolarHBondContact CA-O 3.47Å
509	G	91.9	Very high	91	Very high	2 Å²	2	43.9 Å²	43.9	2%	0.021	23%	0.229	C	C	.	.			trans	-72.5	150.2	-179.8	0	0	0	0	0	112.3	E490 R507 S529 L530	E490-G509 CarbonylContact O-C 3.48Å; E490-G509 VanDerWaalsContact O-CA 3.24Å; E490-G509 WeakPolarHBondContact O-CA 3.47Å; R507-G509 PolarHBondContact O-N 3.07Å; G509-S529 PolarHBondContact N-OG 2.64Å; G509-S529 CarbonylContact O-C 3.56Å; G509-S529 VanDerWaalsContact O-CA 3.25Å; G509-S529 WeakPolarHBondContact O-CA 3.49Å; G509-S529 WeakPolarHBondContact O-CB 3.23Å; G509-L530 PolarHBondContact O-N 2.88Å
510	Q	94.1	Very high	90.8	Very high	91 Å²	91	43.1 Å²	43.1	43%	0.425	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	114.2	173.3	-66.6	-177.4	-13	0	0	108.5	E490 R491 V492	E490-Q510 PolarHBondContact O-N 3.22Å; R491-Q510 CarbonylContact C-O 3.59Å; R491-Q510 WeakPolarHBondContact CA-O 3.32Å; R491-Q510 HydrophobicContact CB-CB 4.44Å; R491-Q510 HydrophobicContact CG-CB 4.23Å; V492-Q510 PolarHBondContact N-O 2.89Å
511	Y	94.5	Very high	90.8	Very high	6 Å²	6	40.5 Å²	40.5	2%	0.024	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	119.2	-178.9	-59.9	-82.1	0	0	0	108.4	E490 V492 H506 D514 F516 F526 L530 F531 E532 C534	E490-Y511 PolarHBondContact OE2-OH 3.28Å; V492-Y511 HydrophobicContact CB-CD1 3.83Å; V492-Y511 HydrophobicContact CB-CE1 4.12Å; V492-Y511 HydrophobicContact CG2-CD1 4Å; V492-Y511 HydrophobicContact CG2-CE1 3.75Å; V492-Y511 WeakPolarHBondContact O-CA 3.19Å; H506-Y511 WeakPolarHBondContact CB-OH 3.41Å; H506-Y511 PolarHBondContact ND1-OH 2.69Å; Y511-D514 VanDerWaalsContact CA-OD2 3.25Å; Y511-D514 WeakPolarHBondContact CA-OD2 3.43Å; Y511-D514 VanDerWaalsContact CB-OD2 3.3Å; Y511-D514 WeakPolarHBondContact CB-OD2 3.31Å; Y511-F516 HydrophobicContact CD1-CZ 4.19Å; Y511-F526 HydrophobicContact CE2-CD1 4.04Å; Y511-F526 HydrophobicContact CE2-CE1 4.1Å; Y511-F526 AromaticContact CZ-CE1 3.94Å; Y511-L530 PolarHBondContact N-O 3.23Å; Y511-F531 HydrophobicContact CD1-CE1 4.44Å; Y511-F531 AromaticContact CD2-CD1 3.7Å; Y511-F531 HydrophobicContact CD2-CD1 3.7Å; Y511-F531 HydrophobicContact CD2-CD2 4.47Å; Y511-F531 AromaticContact CD2-CE1 3.34Å; Y511-F531 HydrophobicContact CD2-CE1 3.34Å; Y511-F531 HydrophobicContact CD2-CE2 4.17Å; Y511-F531 HydrophobicContact CD2-CG 4.26Å; Y511-F531 AromaticContact CD2-CZ 3.6Å; Y511-F531 HydrophobicContact CD2-CZ 3.6Å; Y511-F531 AromaticContact CE2-CE1 3.92Å; Y511-F531 HydrophobicContact CE2-CE1 3.92Å; Y511-F531 HydrophobicContact CE2-CE2 4.5Å; Y511-F531 AromaticContact CE2-CZ 3.82Å; Y511-F531 HydrophobicContact CE2-CZ 3.82Å; Y511-F531 AromaticContact CG-CD1 3.83Å; Y511-F531 HydrophobicContact CG-CD1 3.83Å; Y511-F531 AromaticContact CG-CE1 3.66Å; Y511-F531 HydrophobicContact CG-CE1 3.66Å; Y511-F531 HydrophobicContact CG-CZ 4.37Å; Y511-F531 WeakPolarHBondContact O-CA 3.41Å; Y511-E532 PolarHBondContact O-N 3.4Å; Y511-C534 PolarHBondContact O-SG 2.97Å; Y511-C534 VanDerWaalsContact O-SG 3.42Å
512	F	95.2	Very high	90.6	Very high	67 Å²	67	41.3 Å²	41.3	29%	0.294	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	118	-174.2	-176.1	-92.8	0	0	0	111.6	V492 E493 H494 D514 E532	V492-F512 PolarHBondContact O-N 3.43Å; E493-F512 WeakPolarHBondContact CA-O 3.39Å; E493-F512 HydrophobicContact CG-CB 4.21Å; H494-F512 PolarHBondContact N-O 2.78Å; F512-D514 PolarHBondContact N-OD2 3.09Å; F512-D514 PolarHBondContact O-N 3.24Å; F512-D514 VanDerWaalsContact O-N 3.16Å; F512-E532 WeakPolarHBondContact CA-O 3.46Å; F512-E532 HydrophobicContact CD2-CB 4.01Å; F512-E532 HydrophobicContact CD2-CG 3.94Å; F512-E532 HydrophobicContact CE2-CG 3.95Å
513	N	94.3	Very high	90.4	Very high	53 Å²	53	39.5 Å²	39.5	28%	0.283	21%	0.205	S	C	.	.	S	Bend	trans	56.1	29.9	-179.7	-154.9	-59.1	0	0	0	112.4	E532 E533	N513-E532 PolarHBondContact N-O 2.98Å; N513-E533 HydrophobicContact CB-CB 4.34Å; N513-E533 PolarHBondContact ND2-OE2 2.9Å
514	D	93.3	Very high	90.6	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.			trans	-84.2	150.4	178.4	-69.8	-40.7	0	0	0	112.2	H494 V495 F497 Y511 F512 F516 C534 Y535	H494-D514 PolarHBondContact N-OD1 3.38Å; H494-D514 VanDerWaalsContact N-OD1 3.16Å; V495-D514 PolarHBondContact N-OD1 2.96Å; V495-D514 CarbonylContact O-C 3.46Å; V495-D514 WeakPolarHBondContact O-CA 3.4Å; F497-D514 HydrophobicContact CE2-CB 4.44Å; Y511-D514 VanDerWaalsContact CA-OD2 3.25Å; Y511-D514 WeakPolarHBondContact CA-OD2 3.43Å; Y511-D514 VanDerWaalsContact CB-OD2 3.3Å; Y511-D514 WeakPolarHBondContact CB-OD2 3.31Å; F512-D514 PolarHBondContact N-OD2 3.09Å; F512-D514 PolarHBondContact O-N 3.24Å; F512-D514 VanDerWaalsContact O-N 3.16Å; D514-F516 HydrophobicContact CB-CE2 3.84Å; D514-F516 HydrophobicContact CB-CZ 4.39Å; D514-C534 CarbonylContact O-C 3.46Å; D514-C534 VanDerWaalsContact O-CA 3.23Å; D514-C534 WeakPolarHBondContact O-CA 3.39Å; D514-Y535 PolarHBondContact O-N 2.87Å
515	K	93.5	Very high	90.6	Very high	90 Å²	90	38 Å²	38	39%	0.391	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	125	-177.5	-56.3	-170.1	179.7	-176.4	0	111.4	V495 T496 F497 I517 Y535	V495-K515 PolarHBondContact O-N 3.35Å; T496-K515 CarbonylContact C-O 3.55Å; T496-K515 WeakPolarHBondContact CA-O 3.05Å; T496-K515 HydrophobicContact CG2-CB 4.16Å; F497-K515 PolarHBondContact N-O 3.45Å; K515-I517 HydrophobicContact CB-CD1 4.04Å; K515-I517 HydrophobicContact CB-CG1 4.05Å; K515-I517 HydrophobicContact CD-CD1 4.41Å; K515-Y535 CarbonylContact C-O 3.47Å; K515-Y535 WeakPolarHBondContact CA-O 3.43Å
516	F	93.5	Very high	90.6	Very high	2 Å²	2	36.1 Å²	36.1	1%	0.009	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	87.8	-178.1	-65.4	-94.7	0	0	0	108.2	F497 Y511 D514 L519 F531 C534 Y535 F536 E537 V539	F497-F516 HydrophobicContact CB-CD1 4.05Å; F497-F516 HydrophobicContact CB-CE1 4.44Å; F497-F516 AromaticContact CD2-CD1 3.78Å; F497-F516 HydrophobicContact CD2-CD1 3.78Å; F497-F516 AromaticContact CD2-CE1 3.43Å; F497-F516 HydrophobicContact CD2-CE1 3.43Å; F497-F516 VanDerWaalsContact CD2-CE1 3.43Å; F497-F516 HydrophobicContact CD2-CE2 4.31Å; F497-F516 HydrophobicContact CD2-CG 4.35Å; F497-F516 AromaticContact CD2-CZ 3.72Å; F497-F516 HydrophobicContact CD2-CZ 3.72Å; F497-F516 AromaticContact CE2-CE1 3.73Å; F497-F516 HydrophobicContact CE2-CE1 3.73Å; F497-F516 HydrophobicContact CE2-CE2 4.48Å; F497-F516 AromaticContact CE2-CZ 3.7Å; F497-F516 HydrophobicContact CE2-CZ 3.7Å; F497-F516 HydrophobicContact CG-CD1 4.04Å; F497-F516 AromaticContact CG-CE1 3.94Å; F497-F516 HydrophobicContact CG-CE1 3.94Å; F497-F516 HydrophobicContact CZ-CE1 4.43Å; Y511-F516 HydrophobicContact CD1-CZ 4.19Å; D514-F516 HydrophobicContact CB-CE2 3.84Å; D514-F516 HydrophobicContact CB-CZ 4.39Å; F516-L519 HydrophobicContact CB-CD2 3.85Å; F516-L519 HydrophobicContact CD1-CD2 3.97Å; F516-L519 HydrophobicContact CG-CD2 4.39Å; F516-F531 HydrophobicContact CE2-CD1 4.42Å; F516-F531 HydrophobicContact CE2-CE1 4.3Å; F516-F531 HydrophobicContact CZ-CE1 4.06Å; F516-C534 HydrophobicContact CE2-CB 4.48Å; F516-Y535 PolarHBondContact N-O 3.25Å; F516-F536 HydrophobicContact CB-CD1 3.54Å; F516-F536 HydrophobicContact CB-CE1 3.86Å; F516-F536 HydrophobicContact CB-CG 4.09Å; F516-F536 HydrophobicContact CD1-CE1 4.04Å; F516-F536 HydrophobicContact CD2-CD1 4.01Å; F516-F536 HydrophobicContact CD2-CD2 4.38Å; F516-F536 AromaticContact CD2-CE1 3.62Å; F516-F536 HydrophobicContact CD2-CE1 3.62Å; F516-F536 HydrophobicContact CD2-CE2 4.02Å; F516-F536 HydrophobicContact CD2-CG 4.37Å; F516-F536 AromaticContact CD2-CZ 3.61Å; F516-F536 HydrophobicContact CD2-CZ 3.61Å; F516-F536 HydrophobicContact CE2-CE1 4.16Å; F516-F536 HydrophobicContact CE2-CE2 4.35Å; F516-F536 AromaticContact CE2-CZ 3.83Å; F516-F536 HydrophobicContact CE2-CZ 3.83Å; F516-F536 AromaticContact CG-CD1 3.8Å; F516-F536 HydrophobicContact CG-CD1 3.8Å; F516-F536 AromaticContact CG-CE1 3.56Å; F516-F536 HydrophobicContact CG-CE1 3.56Å; F516-F536 HydrophobicContact CG-CG 4.48Å; F516-F536 HydrophobicContact CG-CZ 4.07Å; F516-F536 HydrophobicContact CZ-CZ 4.43Å; F516-E537 PolarHBondContact O-N 3.49Å; F516-V539 HydrophobicContact CB-CG2 4.26Å; F516-V539 VanDerWaalsContact O-CG2 3.24Å; F516-V539 WeakPolarHBondContact O-CG2 3.21Å
517	I	92	Very high	90.7	Very high	56 Å²	56	36.7 Å²	36.7	29%	0.287	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.9	-166.8	-53	-178.5	0	0	0	111.1	T496 F497 K515 L519 E537	T496-I517 HydrophobicContact CG2-CD1 4.05Å; T496-I517 HydrophobicContact CG2-CG1 4.36Å; F497-I517 PolarHBondContact O-N 3.3Å; K515-I517 HydrophobicContact CB-CD1 4.04Å; K515-I517 HydrophobicContact CB-CG1 4.05Å; K515-I517 HydrophobicContact CD-CD1 4.41Å; I517-L519 PolarHBondContact O-N 3.42Å; I517-L519 VanDerWaalsContact O-N 3.08Å; I517-E537 CarbonylContact C-O 3.44Å; I517-E537 WeakPolarHBondContact CA-O 3.21Å; I517-E537 HydrophobicContact CG1-CB 4.29Å; I517-E537 HydrophobicContact CG2-CB 4.29Å; I517-E537 HydrophobicContact CG2-CG 4.28Å
518	G	85	Confident	90.7	Very high	55 Å²	55	35.8 Å²	35.8	57%	0.567	20%	0.196	S	C	*	.	S	Bend	trans	65.1	13.5	170.3	0	0	0	0	0	115.3	E537	G518-E537 PolarHBondContact N-O 2.96Å
519	L	87.6	Confident	90.9	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.179	C	C	.	.			trans	-96.9	168.7	-172.3	67.8	84.5	0	0	0	113.3	F497 F499 F516 I517 L521 V539 T540	F497-L519 HydrophobicContact CB-CD2 3.5Å; F497-L519 VanDerWaalsContact CB-CD2 3.5Å; F497-L519 WeakPolarHBondContact O-CD2 3.29Å; F499-L519 WeakPolarHBondContact O-CB 3.27Å; F516-L519 HydrophobicContact CB-CD2 3.85Å; F516-L519 HydrophobicContact CD1-CD2 3.97Å; F516-L519 HydrophobicContact CG-CD2 4.39Å; I517-L519 PolarHBondContact O-N 3.42Å; I517-L519 VanDerWaalsContact O-N 3.08Å; L519-L521 HydrophobicContact CD1-CD2 3.5Å; L519-L521 HydrophobicContact CD1-CG 3.8Å; L519-V539 HydrophobicContact CD1-CG1 3.96Å; L519-V539 HydrophobicContact CD1-CG2 4.31Å; L519-V539 HydrophobicContact CG-CG2 4.23Å; L519-V539 WeakPolarHBondContact O-CA 3.28Å; L519-T540 PolarHBondContact O-N 2.79Å
520	R	83.9	Confident	91	Very high	94 Å²	94	36.5 Å²	36.5	36%	0.355	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.2	175.7	-50.2	-170	-84	-126	0.6	110.9	T500 L501 T540 T588	T500-R520 CarbonylContact C-O 3.44Å; T500-R520 WeakPolarHBondContact CA-O 3.41Å; T500-R520 HydrophobicContact CG2-CB 3.79Å; T500-R520 HydrophobicContact CG2-CG 4.11Å; L501-R520 PolarHBondContact N-O 3.26Å; R520-T540 VanDerWaalsContact CA-O 3.29Å; R520-T540 WeakPolarHBondContact CA-O 3.47Å; R520-T540 WeakPolarHBondContact CG-OG1 3.31Å; R520-T588 VanDerWaalsContact CZ-OG1 3.24Å; R520-T588 PolarHBondContact NH1-OG1 2.91Å; R520-T588 PolarHBondContact NH2-OG1 3.17Å
521	L	85.3	Confident	91.1	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	124	173.5	-54.7	177.3	0	0	0	107.7	L501 L519 V524 V539 T540 S541 S542 T544 F546	L501-L521 HydrophobicContact CB-CD2 3.86Å; L501-L521 HydrophobicContact CD1-CD2 3.85Å; L501-L521 HydrophobicContact CG-CD2 4.21Å; L501-L521 WeakPolarHBondContact O-CA 3.18Å; L519-L521 HydrophobicContact CD1-CD2 3.5Å; L519-L521 HydrophobicContact CD1-CG 3.8Å; L521-V524 HydrophobicContact CB-CB 4.35Å; L521-V524 HydrophobicContact CB-CG2 4.32Å; L521-V524 HydrophobicContact CD2-CG2 4.49Å; L521-V539 HydrophobicContact CD1-CG1 4.1Å; L521-V539 HydrophobicContact CG-CG1 4.16Å; L521-T540 PolarHBondContact N-O 2.8Å; L521-S541 CarbonylContact O-C 3.55Å; L521-S541 WeakPolarHBondContact O-CA 3.28Å; L521-S542 PolarHBondContact O-N 3.01Å; L521-T544 HydrophobicContact CB-CG2 3.83Å; L521-T544 WeakPolarHBondContact CB-OG1 3.28Å; L521-T544 HydrophobicContact CD1-CG2 3.77Å; L521-T544 HydrophobicContact CG-CG2 4.43Å; L521-T544 PolarHBondContact O-OG1 3.22Å; L521-F546 HydrophobicContact CD1-CZ 4.35Å
522	K	82.8	Confident	91.1	Very high	23 Å²	23	35 Å²	35	10%	0.1	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	116.6	175.7	-58.3	-171.4	-159.2	141.8	0	110.8	L501 E502 N503 V524 S542	L501-K522 PolarHBondContact O-N 3.03Å; E502-K522 WeakPolarHBondContact CA-O 3.34Å; E502-K522 HydrophobicContact CB-CB 4.41Å; E502-K522 HydrophobicContact CG-CB 4.11Å; E502-K522 HydrophobicContact CG-CD 4.25Å; E502-K522 HydrophobicContact CG-CG 4.3Å; E502-K522 WeakPolarHBondContact OE1-CE 3.33Å; E502-K522 IonicContact OE1-NZ 2.76Å; E502-K522 PolarHBondContact OE1-NZ 2.84Å; E502-K522 IonicContact OE2-NZ 3.69Å; E502-K522 PolarHBondContact OE2-NZ 3.44Å; E502-K522 VanDerWaalsContact OE2-NZ 3.09Å; N503-K522 PolarHBondContact N-O 3.4Å; K522-V524 PolarHBondContact O-N 3.17Å; K522-S542 WeakPolarHBondContact CA-O 3.39Å
523	S	83.4	Confident	91	Very high	33 Å²	33	36 Å²	36	23%	0.231	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	50.6	47.6	-175	-59.7	0	0	0	0	111.4	N503 Q504 S542 N543	N503-S523 WeakPolarHBondContact CA-O 3.41Å; Q504-S523 PolarHBondContact N-O 3.38Å; S523-S542 PolarHBondContact N-O 3.36Å; S523-N543 WeakPolarHBondContact CA-O 3.4Å; S523-N543 PolarHBondContact OG-ND2 2.88Å
524	V	89.4	Confident	91	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.006	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.7	176	-178.4	0	0	0	0	108.9	L501 Q504 L521 K522 F526 T544 F545	L501-V524 HydrophobicContact CB-CG2 3.87Å; L501-V524 WeakPolarHBondContact O-CG2 3.28Å; Q504-V524 CarbonylContact O-C 3.6Å; Q504-V524 VanDerWaalsContact O-CA 3.25Å; Q504-V524 WeakPolarHBondContact O-CA 3.38Å; L521-V524 HydrophobicContact CB-CB 4.35Å; L521-V524 HydrophobicContact CB-CG2 4.32Å; L521-V524 HydrophobicContact CD2-CG2 4.49Å; K522-V524 PolarHBondContact O-N 3.17Å; V524-F526 HydrophobicContact CG1-CD2 4.12Å; V524-F526 HydrophobicContact CG1-CE2 3.52Å; V524-F526 HydrophobicContact CG1-CZ 3.91Å; V524-T544 HydrophobicContact CB-CG2 4.43Å; V524-T544 VanDerWaalsContact O-CA 3.23Å; V524-T544 WeakPolarHBondContact O-CA 3.33Å; V524-T544 WeakPolarHBondContact O-CG2 3.37Å; V524-F545 PolarHBondContact O-N 3.35Å; V524-F545 VanDerWaalsContact O-N 3.16Å
525	S	91.3	Very high	91	Very high	12 Å²	12	37.1 Å²	37.1	8%	0.084	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	127.7	174.4	-165.3	0	0	0	0	110.1	Q504 I505 H506 F545	Q504-S525 PolarHBondContact O-N 3.24Å; I505-S525 CarbonylContact C-O 3.54Å; I505-S525 VanDerWaalsContact CA-O 3.28Å; I505-S525 WeakPolarHBondContact CA-O 3.45Å; H506-S525 PolarHBondContact N-O 3.16Å; S525-F545 WeakPolarHBondContact CA-O 3.43Å
526	F	93.8	Very high	91	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.2	166.8	-63.4	-90.6	0	0	0	107.5	H506 Y511 V524 F531 F545 F546 R547	H506-F526 HydrophobicContact CB-CD1 3.66Å; H506-F526 HydrophobicContact CB-CE1 3.94Å; H506-F526 AromaticContact CD2-CD1 3.88Å; H506-F526 AromaticContact CD2-CE1 3.43Å; H506-F526 VanDerWaalsContact CD2-CE1 3.43Å; H506-F526 WeakPolarHBondContact CD2-CE1 3.41Å; H506-F526 AromaticContact CD2-CZ 3.82Å; H506-F526 AromaticContact CG-CD1 3.94Å; H506-F526 AromaticContact CG-CE1 3.69Å; Y511-F526 HydrophobicContact CE2-CD1 4.04Å; Y511-F526 HydrophobicContact CE2-CE1 4.1Å; Y511-F526 AromaticContact CZ-CE1 3.94Å; V524-F526 HydrophobicContact CG1-CD2 4.12Å; V524-F526 HydrophobicContact CG1-CE2 3.52Å; V524-F526 HydrophobicContact CG1-CZ 3.91Å; F526-F531 HydrophobicContact CB-CE2 4.38Å; F526-F531 HydrophobicContact CB-CZ 4.39Å; F526-F531 HydrophobicContact CD1-CE2 4.37Å; F526-F531 AromaticContact CD1-CZ 3.64Å; F526-F531 HydrophobicContact CD1-CZ 3.64Å; F526-F531 HydrophobicContact CD2-CZ 4.48Å; F526-F531 AromaticContact CE1-CZ 3.98Å; F526-F531 HydrophobicContact CE1-CZ 3.98Å; F526-F531 HydrophobicContact CG-CE2 4.4Å; F526-F531 AromaticContact CG-CZ 3.92Å; F526-F531 HydrophobicContact CG-CZ 3.92Å; F526-F545 PolarHBondContact N-O 3.34Å; F526-F546 HydrophobicContact CB-CD1 3.7Å; F526-F546 HydrophobicContact CB-CE1 4.1Å; F526-F546 AromaticContact CD2-CD1 3.65Å; F526-F546 HydrophobicContact CD2-CD1 3.65Å; F526-F546 AromaticContact CD2-CE1 3.2Å; F526-F546 HydrophobicContact CD2-CE1 3.2Å; F526-F546 AromaticContact CD2-CZ 3.77Å; F526-F546 HydrophobicContact CD2-CZ 3.77Å; F526-F546 AromaticContact CE2-CE1 3.73Å; F526-F546 HydrophobicContact CE2-CE1 3.73Å; F526-F546 AromaticContact CE2-CZ 4Å; F526-F546 HydrophobicContact CE2-CZ 4Å; F526-F546 AromaticContact CG-CD1 3.91Å; F526-F546 HydrophobicContact CG-CD1 3.91Å; F526-F546 AromaticContact CG-CE1 3.77Å; F526-F546 HydrophobicContact CG-CE1 3.77Å; F526-R547 PolarHBondContact O-N 3.47Å
527	E	94.4	Very high	90.9	Very high	23 Å²	23	35.5 Å²	35.5	11%	0.107	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.8	-179.1	-50.2	-168	126.8	0	0	109.1	I505 H506 R507 G508 S529 R547	I505-E527 HydrophobicContact CG2-CG 4.24Å; H506-E527 PolarHBondContact O-N 2.95Å; R507-E527 WeakPolarHBondContact CA-O 3.47Å; R507-E527 HydrophobicContact CG-CB 4.35Å; R507-E527 IonicContact CZ-OE2 3.17Å; R507-E527 IonicContact NE-OE2 2.76Å; R507-E527 PolarHBondContact NE-OE2 2.69Å; R507-E527 IonicContact NH2-OE2 2.71Å; R507-E527 PolarHBondContact NH2-OE2 2.96Å; G508-E527 PolarHBondContact N-O 3.12Å; E527-S529 PolarHBondContact O-N 2.77Å; E527-S529 PolarHBondContact O-OG 3.06Å; E527-R547 CarbonylContact C-O 3.6Å; E527-R547 WeakPolarHBondContact CA-O 3.44Å; E527-R547 HydrophobicContact CG-CB 4.23Å; E527-R547 WeakPolarHBondContact OE1-CD 3.45Å; E527-R547 IonicContact OE1-CZ 2.67Å; E527-R547 IonicContact OE1-NE 3.25Å; E527-R547 IonicContact OE1-NH1 3.13Å; E527-R547 PolarHBondContact OE1-NH1 2.97Å
528	D	94.4	Very high	90.7	Very high	101 Å²	101	36.1 Å²	36.1	54%	0.54	19%	0.189	S	C	.	.	S	Bend	trans	53.7	26.1	177.4	-54.4	-51	0	0	0	114.9	G508 R547 N548	G508-D528 WeakPolarHBondContact CA-O 3.47Å; D528-R547 PolarHBondContact N-O 2.91Å; D528-N548 WeakPolarHBondContact OD1-CB 3.26Å; D528-N548 PolarHBondContact OD1-ND2 3Å
529	S	94.8	Very high	90.7	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.014	16%	0.162	C	C	.	.			trans	-102.1	145.9	-168.4	-57.9	0	0	0	0	113.7	G509 E527 C549 T550	G509-S529 PolarHBondContact N-OG 2.64Å; G509-S529 CarbonylContact O-C 3.56Å; G509-S529 VanDerWaalsContact O-CA 3.25Å; G509-S529 WeakPolarHBondContact O-CA 3.49Å; G509-S529 WeakPolarHBondContact O-CB 3.23Å; E527-S529 PolarHBondContact O-N 2.77Å; E527-S529 PolarHBondContact O-OG 3.06Å; S529-C549 CarbonylContact O-C 3.5Å; S529-C549 WeakPolarHBondContact O-CA 3.42Å; S529-C549 WeakPolarHBondContact O-CB 3.39Å; S529-T550 PolarHBondContact O-N 3.33Å
530	L	94.9	Very high	90.5	Very high	51 Å²	51	35.2 Å²	35.2	27%	0.267	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	132.6	177.8	177.1	64.9	0	0	0	110.7	G509 Y511 T550 I552	G509-L530 PolarHBondContact O-N 2.88Å; Y511-L530 PolarHBondContact N-O 3.23Å; L530-T550 CarbonylContact C-O 3.57Å; L530-T550 WeakPolarHBondContact CA-O 3.34Å; L530-T550 HydrophobicContact CD1-CG2 4.05Å; L530-I552 HydrophobicContact CD1-CD1 3.97Å; L530-I552 HydrophobicContact CD1-CG1 4.28Å
531	F	95.2	Very high	90.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118	171.7	-65.4	-93.7	0	0	0	108.8	Y511 F516 F526 C534 F536 F546 T550 F551 I552 T554	Y511-F531 HydrophobicContact CD1-CE1 4.44Å; Y511-F531 AromaticContact CD2-CD1 3.7Å; Y511-F531 HydrophobicContact CD2-CD1 3.7Å; Y511-F531 HydrophobicContact CD2-CD2 4.47Å; Y511-F531 AromaticContact CD2-CE1 3.34Å; Y511-F531 HydrophobicContact CD2-CE1 3.34Å; Y511-F531 HydrophobicContact CD2-CE2 4.17Å; Y511-F531 HydrophobicContact CD2-CG 4.26Å; Y511-F531 AromaticContact CD2-CZ 3.6Å; Y511-F531 HydrophobicContact CD2-CZ 3.6Å; Y511-F531 AromaticContact CE2-CE1 3.92Å; Y511-F531 HydrophobicContact CE2-CE1 3.92Å; Y511-F531 HydrophobicContact CE2-CE2 4.5Å; Y511-F531 AromaticContact CE2-CZ 3.82Å; Y511-F531 HydrophobicContact CE2-CZ 3.82Å; Y511-F531 AromaticContact CG-CD1 3.83Å; Y511-F531 HydrophobicContact CG-CD1 3.83Å; Y511-F531 AromaticContact CG-CE1 3.66Å; Y511-F531 HydrophobicContact CG-CE1 3.66Å; Y511-F531 HydrophobicContact CG-CZ 4.37Å; Y511-F531 WeakPolarHBondContact O-CA 3.41Å; F516-F531 HydrophobicContact CE2-CD1 4.42Å; F516-F531 HydrophobicContact CE2-CE1 4.3Å; F516-F531 HydrophobicContact CZ-CE1 4.06Å; F526-F531 HydrophobicContact CB-CE2 4.38Å; F526-F531 HydrophobicContact CB-CZ 4.39Å; F526-F531 HydrophobicContact CD1-CE2 4.37Å; F526-F531 AromaticContact CD1-CZ 3.64Å; F526-F531 HydrophobicContact CD1-CZ 3.64Å; F526-F531 HydrophobicContact CD2-CZ 4.48Å; F526-F531 AromaticContact CE1-CZ 3.98Å; F526-F531 HydrophobicContact CE1-CZ 3.98Å; F526-F531 HydrophobicContact CG-CE2 4.4Å; F526-F531 AromaticContact CG-CZ 3.92Å; F526-F531 HydrophobicContact CG-CZ 3.92Å; F531-C534 HydrophobicContact CB-CB 4.38Å; F531-C534 HydrophobicContact CD1-CB 4.47Å; F531-F536 HydrophobicContact CD1-CE2 4.38Å; F531-F536 HydrophobicContact CD1-CZ 4.01Å; F531-F536 AromaticContact CE1-CZ 4Å; F531-F536 HydrophobicContact CE1-CZ 4Å; F531-F546 HydrophobicContact CE2-CD1 4.04Å; F531-F546 HydrophobicContact CE2-CE1 4.1Å; F531-F546 HydrophobicContact CZ-CD1 4.29Å; F531-F546 AromaticContact CZ-CE1 3.9Å; F531-F546 HydrophobicContact CZ-CE1 3.9Å; F531-T550 PolarHBondContact N-O 3.33Å; F531-F551 HydrophobicContact CB-CD1 3.58Å; F531-F551 HydrophobicContact CB-CE1 3.72Å; F531-F551 HydrophobicContact CB-CG 4.27Å; F531-F551 HydrophobicContact CD1-CE1 4.17Å; F531-F551 HydrophobicContact CD2-CD1 4.03Å; F531-F551 AromaticContact CD2-CE1 3.45Å; F531-F551 HydrophobicContact CD2-CE1 3.45Å; F531-F551 VanDerWaalsContact CD2-CE1 3.45Å; F531-F551 HydrophobicContact CD2-CE2 4.02Å; F531-F551 AromaticContact CD2-CZ 3.43Å; F531-F551 HydrophobicContact CD2-CZ 3.43Å; F531-F551 VanDerWaalsContact CD2-CZ 3.43Å; F531-F551 HydrophobicContact CE2-CE1 4.05Å; F531-F551 HydrophobicContact CE2-CE2 4.4Å; F531-F551 AromaticContact CE2-CZ 3.7Å; F531-F551 HydrophobicContact CE2-CZ 3.7Å; F531-F551 AromaticContact CG-CD1 3.93Å; F531-F551 HydrophobicContact CG-CD1 3.93Å; F531-F551 AromaticContact CG-CE1 3.51Å; F531-F551 HydrophobicContact CG-CE1 3.51Å; F531-F551 HydrophobicContact CG-CZ 4.02Å; F531-F551 HydrophobicContact CZ-CZ 4.47Å; F531-F551 CarbonylContact O-C 3.59Å; F531-F551 WeakPolarHBondContact O-CA 3.44Å; F531-I552 PolarHBondContact O-N 3.44Å; F531-T554 HydrophobicContact CB-CG2 4.14Å
532	E	94.4	Very high	89.8	Confident	66 Å²	66	32.7 Å²	32.7	31%	0.308	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.5	-177	-177.4	163.3	-142.5	0	0	110.1	Y511 F512 N513 C534 I552	Y511-E532 PolarHBondContact O-N 3.4Å; F512-E532 WeakPolarHBondContact CA-O 3.46Å; F512-E532 HydrophobicContact CD2-CB 4.01Å; F512-E532 HydrophobicContact CD2-CG 3.94Å; F512-E532 HydrophobicContact CE2-CG 3.95Å; N513-E532 PolarHBondContact N-O 2.98Å; E532-C534 PolarHBondContact O-N 3.45Å; E532-I552 WeakPolarHBondContact CA-O 3.29Å; E532-I552 HydrophobicContact CB-CB 4.48Å; E532-I552 HydrophobicContact CG-CB 4.29Å
533	E	93.9	Very high	89.5	Confident	89 Å²	89	36.8 Å²	36.8	42%	0.416	19%	0.192	S	C	.	.	S	Bend	trans	57.5	14.7	-173.9	-55.2	-169.6	159.6	0	0	115.3	N513 I552 N553	N513-E533 HydrophobicContact CB-CB 4.34Å; N513-E533 PolarHBondContact ND2-OE2 2.9Å; E533-I552 PolarHBondContact N-O 2.88Å; E533-N553 HydrophobicContact CG-CB 4.48Å
534	C	93.6	Very high	89.6	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.182	C	C	.	.			trans	-70.7	145.9	-179.2	-59.7	0	0	0	0	113.8	Y511 D514 F516 F531 E532 F536 T554 V555	Y511-C534 PolarHBondContact O-SG 2.97Å; Y511-C534 VanDerWaalsContact O-SG 3.42Å; D514-C534 CarbonylContact O-C 3.46Å; D514-C534 VanDerWaalsContact O-CA 3.23Å; D514-C534 WeakPolarHBondContact O-CA 3.39Å; F516-C534 HydrophobicContact CE2-CB 4.48Å; F531-C534 HydrophobicContact CB-CB 4.38Å; F531-C534 HydrophobicContact CD1-CB 4.47Å; E532-C534 PolarHBondContact O-N 3.45Å; C534-F536 HydrophobicContact CB-CE2 3.96Å; C534-T554 HydrophobicContact CB-CG2 3.88Å; C534-T554 WeakPolarHBondContact O-CA 3.44Å; C534-T554 VanDerWaalsContact O-CB 3.29Å; C534-T554 WeakPolarHBondContact O-CB 3.33Å; C534-V555 PolarHBondContact O-N 3.34Å; C534-V555 VanDerWaalsContact O-N 3.14Å
535	Y	93.8	Very high	89.7	Confident	74 Å²	74	38.2 Å²	38.2	29%	0.29	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.3	-179.2	-169.1	-98.1	0	0	0	111.1	D514 K515 F516 E537 V555	D514-Y535 PolarHBondContact O-N 2.87Å; K515-Y535 CarbonylContact C-O 3.47Å; K515-Y535 WeakPolarHBondContact CA-O 3.43Å; F516-Y535 PolarHBondContact N-O 3.25Å; Y535-E537 HydrophobicContact CD1-CB 4.14Å; Y535-E537 HydrophobicContact CE1-CB 3.71Å; Y535-E537 HydrophobicContact CE1-CG 4.36Å; Y535-V555 HydrophobicContact CD2-CB 3.74Å; Y535-V555 HydrophobicContact CD2-CG1 4.22Å; Y535-V555 HydrophobicContact CD2-CG2 4.33Å; Y535-V555 HydrophobicContact CE2-CB 3.9Å; Y535-V555 HydrophobicContact CE2-CG1 3.85Å
536	F	93.3	Very high	89.8	Confident	1 Å²	1	37.6 Å²	37.6	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.8	178.4	-68.3	-101.2	0	0	0	109.9	F516 F531 C534 V539 F551 V555 F556 Y557 T559 L561	F516-F536 HydrophobicContact CB-CD1 3.54Å; F516-F536 HydrophobicContact CB-CE1 3.86Å; F516-F536 HydrophobicContact CB-CG 4.09Å; F516-F536 HydrophobicContact CD1-CE1 4.04Å; F516-F536 HydrophobicContact CD2-CD1 4.01Å; F516-F536 HydrophobicContact CD2-CD2 4.38Å; F516-F536 AromaticContact CD2-CE1 3.62Å; F516-F536 HydrophobicContact CD2-CE1 3.62Å; F516-F536 HydrophobicContact CD2-CE2 4.02Å; F516-F536 HydrophobicContact CD2-CG 4.37Å; F516-F536 AromaticContact CD2-CZ 3.61Å; F516-F536 HydrophobicContact CD2-CZ 3.61Å; F516-F536 HydrophobicContact CE2-CE1 4.16Å; F516-F536 HydrophobicContact CE2-CE2 4.35Å; F516-F536 AromaticContact CE2-CZ 3.83Å; F516-F536 HydrophobicContact CE2-CZ 3.83Å; F516-F536 AromaticContact CG-CD1 3.8Å; F516-F536 HydrophobicContact CG-CD1 3.8Å; F516-F536 AromaticContact CG-CE1 3.56Å; F516-F536 HydrophobicContact CG-CE1 3.56Å; F516-F536 HydrophobicContact CG-CG 4.48Å; F516-F536 HydrophobicContact CG-CZ 4.07Å; F516-F536 HydrophobicContact CZ-CZ 4.43Å; F531-F536 HydrophobicContact CD1-CE2 4.38Å; F531-F536 HydrophobicContact CD1-CZ 4.01Å; F531-F536 AromaticContact CE1-CZ 4Å; F531-F536 HydrophobicContact CE1-CZ 4Å; C534-F536 HydrophobicContact CB-CE2 3.96Å; F536-V539 HydrophobicContact CB-CG2 4.3Å; F536-V539 HydrophobicContact CD1-CG2 4.25Å; F536-F551 HydrophobicContact CE2-CE1 4.1Å; F536-F551 HydrophobicContact CZ-CE1 4.25Å; F536-V555 PolarHBondContact N-O 3.04Å; F536-F556 HydrophobicContact CB-CD1 3.69Å; F536-F556 HydrophobicContact CB-CE1 4.23Å; F536-F556 HydrophobicContact CD1-CE1 4.35Å; F536-F556 AromaticContact CD2-CD1 3.8Å; F536-F556 HydrophobicContact CD2-CD1 3.8Å; F536-F556 AromaticContact CD2-CE1 3.49Å; F536-F556 HydrophobicContact CD2-CE1 3.49Å; F536-F556 VanDerWaalsContact CD2-CE1 3.49Å; F536-F556 HydrophobicContact CD2-CZ 4.24Å; F536-F556 AromaticContact CE2-CE1 3.86Å; F536-F556 HydrophobicContact CE2-CE1 3.86Å; F536-F556 HydrophobicContact CE2-CZ 4.37Å; F536-F556 AromaticContact CG-CD1 3.77Å; F536-F556 HydrophobicContact CG-CD1 3.77Å; F536-F556 AromaticContact CG-CE1 3.78Å; F536-F556 HydrophobicContact CG-CE1 3.78Å; F536-F556 HydrophobicContact CZ-CE1 4.45Å; F536-Y557 PolarHBondContact O-N 2.98Å; F536-T559 HydrophobicContact CB-CG2 4.16Å; F536-L561 HydrophobicContact CD1-CD1 4.24Å
537	E	92	Very high	89.7	Confident	57 Å²	57	42.8 Å²	42.8	27%	0.266	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	129	-175.7	177.5	164.8	-137.2	0	0	111.6	F516 I517 G518 Y535 V539 Y557	F516-E537 PolarHBondContact O-N 3.49Å; I517-E537 CarbonylContact C-O 3.44Å; I517-E537 WeakPolarHBondContact CA-O 3.21Å; I517-E537 HydrophobicContact CG1-CB 4.29Å; I517-E537 HydrophobicContact CG2-CB 4.29Å; I517-E537 HydrophobicContact CG2-CG 4.28Å; G518-E537 PolarHBondContact N-O 2.96Å; Y535-E537 HydrophobicContact CD1-CB 4.14Å; Y535-E537 HydrophobicContact CE1-CB 3.71Å; Y535-E537 HydrophobicContact CE1-CG 4.36Å; E537-V539 PolarHBondContact O-N 2.81Å; E537-Y557 WeakPolarHBondContact CA-O 3.39Å; E537-Y557 HydrophobicContact CG-CD1 4.24Å
538	D	87.4	Confident	89.8	Confident	68 Å²	68	46.1 Å²	46.1	36%	0.364	23%	0.228	S	C	.	.	S	Bend	trans	60.7	8.4	177.1	-113.6	-61.2	0	0	0	116.2	Y557 N558 K580	D538-Y557 PolarHBondContact N-O 3.28Å; D538-N558 CarbonylContact C-O 3.59Å; D538-N558 VanDerWaalsContact CA-O 3.32Å; D538-N558 WeakPolarHBondContact CA-O 3.44Å; D538-N558 VanDerWaalsContact CG-ND2 3.25Å; D538-N558 PolarHBondContact OD1-ND2 2.94Å; D538-N558 PolarHBondContact OD2-ND2 3.21Å; D538-K580 VanDerWaalsContact C-NZ 3.33Å; D538-K580 PolarHBondContact O-NZ 2.64Å; D538-K580 IonicContact OD1-NZ 3.56Å; D538-K580 PolarHBondContact OD1-NZ 2.93Å
539	V	85.6	Confident	89.8	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.203	C	C	.	.			trans	-61.8	133.7	-175.7	-176.6	0	0	0	0	112.6	F516 L519 L521 F536 E537 T559 D560	F516-V539 HydrophobicContact CB-CG2 4.26Å; F516-V539 VanDerWaalsContact O-CG2 3.24Å; F516-V539 WeakPolarHBondContact O-CG2 3.21Å; L519-V539 HydrophobicContact CD1-CG1 3.96Å; L519-V539 HydrophobicContact CD1-CG2 4.31Å; L519-V539 HydrophobicContact CG-CG2 4.23Å; L519-V539 WeakPolarHBondContact O-CA 3.28Å; L521-V539 HydrophobicContact CD1-CG1 4.1Å; L521-V539 HydrophobicContact CG-CG1 4.16Å; F536-V539 HydrophobicContact CB-CG2 4.3Å; F536-V539 HydrophobicContact CD1-CG2 4.25Å; E537-V539 PolarHBondContact O-N 2.81Å; V539-T559 HydrophobicContact CB-CG2 4.06Å; V539-T559 HydrophobicContact CG2-CG2 4.5Å; V539-T559 WeakPolarHBondContact O-CA 3.27Å; V539-D560 PolarHBondContact O-N 3.12Å
540	T	82.8	Confident	89.8	Confident	39 Å²	39	43.4 Å²	43.4	24%	0.239	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	137.6	169	66.3	0	0	0	0	110.7	L519 R520 L521 D560 K580	L519-T540 PolarHBondContact O-N 2.79Å; R520-T540 VanDerWaalsContact CA-O 3.29Å; R520-T540 WeakPolarHBondContact CA-O 3.47Å; R520-T540 WeakPolarHBondContact CG-OG1 3.31Å; L521-T540 PolarHBondContact N-O 2.8Å; T540-D560 WeakPolarHBondContact CA-OD1 3.07Å; T540-K580 HydrophobicContact CG2-CD 4.27Å
541	S	79.6	Confident	89.8	Confident	4 Å²	4	41 Å²	41	3%	0.028	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	104.6	-163.5	61.1	0	0	0	0	113.6	L521 D560 L561 K565	L521-S541 CarbonylContact O-C 3.55Å; L521-S541 WeakPolarHBondContact O-CA 3.28Å; S541-D560 WeakPolarHBondContact CB-OD1 3.27Å; S541-D560 PolarHBondContact N-OD1 2.82Å; S541-D560 PolarHBondContact N-OD2 2.9Å; S541-D560 VanDerWaalsContact OG-CG 3.25Å; S541-D560 PolarHBondContact OG-OD1 3.41Å; S541-D560 PolarHBondContact OG-OD2 3.21Å; S541-L561 VanDerWaalsContact OG-CD2 3.25Å; S541-L561 WeakPolarHBondContact OG-CD2 3.25Å; S541-K565 PolarHBondContact O-NZ 2.95Å; S541-K565 PolarHBondContact OG-NZ 3.41Å
542	S	76.1	Confident	89.7	Confident	39 Å²	39	43 Å²	43	27%	0.273	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	131.1	178.2	-65.6	0	0	0	0	110.9	L521 K522 S523 T544	L521-S542 PolarHBondContact O-N 3.01Å; K522-S542 WeakPolarHBondContact CA-O 3.39Å; S523-S542 PolarHBondContact N-O 3.36Å; S542-T544 PolarHBondContact O-N 2.81Å; S542-T544 VanDerWaalsContact O-N 3.09Å; S542-T544 PolarHBondContact O-OG1 3.18Å
543	N	76.1	Confident	89.7	Confident	108 Å²	108	43.1 Å²	43.1	58%	0.578	22%	0.216	S	C	*	.	S	Bend	trans	48.3	38.5	179.3	-168.6	42.3	0	0	0	113.6	S523	S523-N543 WeakPolarHBondContact CA-O 3.4Å; S523-N543 PolarHBondContact OG-ND2 2.88Å
544	T	85.8	Confident	89.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.012	20%	0.196	C	C	.	.			trans	-114	136.4	-170	-66.6	0	0	0	0	110.4	L521 V524 S542 F546	L521-T544 HydrophobicContact CB-CG2 3.83Å; L521-T544 WeakPolarHBondContact CB-OG1 3.28Å; L521-T544 HydrophobicContact CD1-CG2 3.77Å; L521-T544 HydrophobicContact CG-CG2 4.43Å; L521-T544 PolarHBondContact O-OG1 3.22Å; V524-T544 HydrophobicContact CB-CG2 4.43Å; V524-T544 VanDerWaalsContact O-CA 3.23Å; V524-T544 WeakPolarHBondContact O-CA 3.33Å; V524-T544 WeakPolarHBondContact O-CG2 3.37Å; S542-T544 PolarHBondContact O-N 2.81Å; S542-T544 VanDerWaalsContact O-N 3.09Å; S542-T544 PolarHBondContact O-OG1 3.18Å; T544-F546 HydrophobicContact CG2-CE2 4.23Å
545	F	89.9	Confident	89.7	Confident	62 Å²	62	40.5 Å²	40.5	27%	0.272	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	145.7	-174.7	-60.7	-82.5	0	0	0	112.5	V524 S525 F526 R547 V567	V524-F545 PolarHBondContact O-N 3.35Å; V524-F545 VanDerWaalsContact O-N 3.16Å; S525-F545 WeakPolarHBondContact CA-O 3.43Å; F526-F545 PolarHBondContact N-O 3.34Å; F545-R547 HydrophobicContact CB-CG 4.49Å; F545-V567 HydrophobicContact CD1-CG2 4.47Å
546	F	93.3	Very high	89.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.9	170.7	-62.7	-91.9	0	0	0	107.7	L521 F526 F531 T544 C549 F551 L561 K565 F566 V567 S569	L521-F546 HydrophobicContact CD1-CZ 4.35Å; F526-F546 HydrophobicContact CB-CD1 3.7Å; F526-F546 HydrophobicContact CB-CE1 4.1Å; F526-F546 AromaticContact CD2-CD1 3.65Å; F526-F546 HydrophobicContact CD2-CD1 3.65Å; F526-F546 AromaticContact CD2-CE1 3.2Å; F526-F546 HydrophobicContact CD2-CE1 3.2Å; F526-F546 AromaticContact CD2-CZ 3.77Å; F526-F546 HydrophobicContact CD2-CZ 3.77Å; F526-F546 AromaticContact CE2-CE1 3.73Å; F526-F546 HydrophobicContact CE2-CE1 3.73Å; F526-F546 AromaticContact CE2-CZ 4Å; F526-F546 HydrophobicContact CE2-CZ 4Å; F526-F546 AromaticContact CG-CD1 3.91Å; F526-F546 HydrophobicContact CG-CD1 3.91Å; F526-F546 AromaticContact CG-CE1 3.77Å; F526-F546 HydrophobicContact CG-CE1 3.77Å; F531-F546 HydrophobicContact CE2-CD1 4.04Å; F531-F546 HydrophobicContact CE2-CE1 4.1Å; F531-F546 HydrophobicContact CZ-CD1 4.29Å; F531-F546 AromaticContact CZ-CE1 3.9Å; F531-F546 HydrophobicContact CZ-CE1 3.9Å; T544-F546 HydrophobicContact CG2-CE2 4.23Å; F546-C549 HydrophobicContact CB-CB 4.3Å; F546-F551 HydrophobicContact CB-CE2 4.31Å; F546-F551 HydrophobicContact CD1-CE2 4.11Å; F546-F551 AromaticContact CD1-CZ 3.55Å; F546-F551 HydrophobicContact CD1-CZ 3.55Å; F546-F551 AromaticContact CE1-CZ 3.88Å; F546-F551 HydrophobicContact CE1-CZ 3.88Å; F546-F551 HydrophobicContact CG-CE2 4.33Å; F546-F551 HydrophobicContact CG-CZ 4.07Å; F546-L561 HydrophobicContact CE2-CD1 4.4Å; F546-L561 HydrophobicContact CE2-CD2 3.76Å; F546-K565 PolarHBondContact N-O 3.33Å; F546-F566 HydrophobicContact CB-CD1 3.88Å; F546-F566 HydrophobicContact CB-CE1 4.34Å; F546-F566 HydrophobicContact CD2-CD1 4.21Å; F546-F566 AromaticContact CD2-CE1 3.99Å; F546-F566 HydrophobicContact CD2-CE1 3.99Å; F546-F566 HydrophobicContact CG-CD1 4.17Å; F546-F566 HydrophobicContact CG-CE1 4.13Å; F546-F566 CarbonylContact O-C 3.52Å; F546-V567 PolarHBondContact O-N 3.33Å; F546-S569 PolarHBondContact O-OG 2.71Å; F546-S569 VanDerWaalsContact O-OG 3.1Å
547	R	93.5	Very high	89.5	Confident	110 Å²	110	40.9 Å²	40.9	42%	0.415	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.6	-170.5	-69	173.5	171.6	177.7	-0.6	110.2	F526 E527 D528 F545 C549 V567	F526-R547 PolarHBondContact O-N 3.47Å; E527-R547 CarbonylContact C-O 3.6Å; E527-R547 WeakPolarHBondContact CA-O 3.44Å; E527-R547 HydrophobicContact CG-CB 4.23Å; E527-R547 WeakPolarHBondContact OE1-CD 3.45Å; E527-R547 IonicContact OE1-CZ 2.67Å; E527-R547 IonicContact OE1-NE 3.25Å; E527-R547 IonicContact OE1-NH1 3.13Å; E527-R547 PolarHBondContact OE1-NH1 2.97Å; D528-R547 PolarHBondContact N-O 2.91Å; F545-R547 HydrophobicContact CB-CG 4.49Å; R547-C549 PolarHBondContact O-N 2.95Å; R547-C549 VanDerWaalsContact O-N 3.09Å; R547-V567 WeakPolarHBondContact CA-O 3.22Å; R547-V567 HydrophobicContact CG-CB 4.3Å
548	N	94.7	Very high	89.3	Confident	93 Å²	93	40.3 Å²	40.3	50%	0.497	21%	0.206	S	C	.	.	S	Bend	trans	53	28.4	-177.9	-164.4	41.1	0	0	0	113	D528 V567 S569	D528-N548 WeakPolarHBondContact OD1-CB 3.26Å; D528-N548 PolarHBondContact OD1-ND2 3Å; N548-V567 PolarHBondContact N-O 3.29Å; N548-S569 PolarHBondContact N-OG 2.69Å
549	C	94.3	Very high	89.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.			trans	-82.2	154.3	179.7	-70.1	0	0	0	0	110.7	S529 F546 R547 F551 S569 R570	S529-C549 CarbonylContact O-C 3.5Å; S529-C549 WeakPolarHBondContact O-CA 3.42Å; S529-C549 WeakPolarHBondContact O-CB 3.39Å; F546-C549 HydrophobicContact CB-CB 4.3Å; R547-C549 PolarHBondContact O-N 2.95Å; R547-C549 VanDerWaalsContact O-N 3.09Å; C549-F551 HydrophobicContact CB-CD2 4.31Å; C549-F551 HydrophobicContact CB-CE2 3.71Å; C549-S569 PolarHBondContact N-OG 3.29Å; C549-S569 CarbonylContact O-C 3.59Å; C549-S569 WeakPolarHBondContact O-CA 3.48Å; C549-S569 WeakPolarHBondContact O-CB 3.21Å; C549-R570 PolarHBondContact O-N 3.37Å
550	T	94.9	Very high	88.9	Confident	46 Å²	46	37.1 Å²	37.1	28%	0.282	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.2	171.7	-60.7	0	0	0	0	109.6	S529 L530 F531 I552 R570	S529-T550 PolarHBondContact O-N 3.33Å; L530-T550 CarbonylContact C-O 3.57Å; L530-T550 WeakPolarHBondContact CA-O 3.34Å; L530-T550 HydrophobicContact CD1-CG2 4.05Å; F531-T550 PolarHBondContact N-O 3.33Å; T550-I552 HydrophobicContact CG2-CD1 4.24Å; T550-I552 HydrophobicContact CG2-CG1 3.97Å; T550-R570 WeakPolarHBondContact CA-O 3.4Å; T550-R570 HydrophobicContact CG2-CB 4.42Å
551	F	95.1	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	126.1	178.8	-72.7	-93.6	0	0	0	109	F531 F536 F546 C549 T554 F556 F566 R570 L571 V572	F531-F551 HydrophobicContact CB-CD1 3.58Å; F531-F551 HydrophobicContact CB-CE1 3.72Å; F531-F551 HydrophobicContact CB-CG 4.27Å; F531-F551 HydrophobicContact CD1-CE1 4.17Å; F531-F551 HydrophobicContact CD2-CD1 4.03Å; F531-F551 AromaticContact CD2-CE1 3.45Å; F531-F551 HydrophobicContact CD2-CE1 3.45Å; F531-F551 VanDerWaalsContact CD2-CE1 3.45Å; F531-F551 HydrophobicContact CD2-CE2 4.02Å; F531-F551 AromaticContact CD2-CZ 3.43Å; F531-F551 HydrophobicContact CD2-CZ 3.43Å; F531-F551 VanDerWaalsContact CD2-CZ 3.43Å; F531-F551 HydrophobicContact CE2-CE1 4.05Å; F531-F551 HydrophobicContact CE2-CE2 4.4Å; F531-F551 AromaticContact CE2-CZ 3.7Å; F531-F551 HydrophobicContact CE2-CZ 3.7Å; F531-F551 AromaticContact CG-CD1 3.93Å; F531-F551 HydrophobicContact CG-CD1 3.93Å; F531-F551 AromaticContact CG-CE1 3.51Å; F531-F551 HydrophobicContact CG-CE1 3.51Å; F531-F551 HydrophobicContact CG-CZ 4.02Å; F531-F551 HydrophobicContact CZ-CZ 4.47Å; F531-F551 CarbonylContact O-C 3.59Å; F531-F551 WeakPolarHBondContact O-CA 3.44Å; F536-F551 HydrophobicContact CE2-CE1 4.1Å; F536-F551 HydrophobicContact CZ-CE1 4.25Å; F546-F551 HydrophobicContact CB-CE2 4.31Å; F546-F551 HydrophobicContact CD1-CE2 4.11Å; F546-F551 AromaticContact CD1-CZ 3.55Å; F546-F551 HydrophobicContact CD1-CZ 3.55Å; F546-F551 AromaticContact CE1-CZ 3.88Å; F546-F551 HydrophobicContact CE1-CZ 3.88Å; F546-F551 HydrophobicContact CG-CE2 4.33Å; F546-F551 HydrophobicContact CG-CZ 4.07Å; C549-F551 HydrophobicContact CB-CD2 4.31Å; C549-F551 HydrophobicContact CB-CE2 3.71Å; F551-T554 HydrophobicContact CB-CG2 4.29Å; F551-T554 HydrophobicContact CD1-CG2 3.96Å; F551-F556 HydrophobicContact CD1-CE2 4.46Å; F551-F556 AromaticContact CD1-CZ 3.73Å; F551-F556 HydrophobicContact CD1-CZ 3.73Å; F551-F556 HydrophobicContact CE1-CE1 4.33Å; F551-F556 AromaticContact CE1-CZ 3.77Å; F551-F556 HydrophobicContact CE1-CZ 3.77Å; F551-F556 HydrophobicContact CG-CZ 4.45Å; F551-F566 HydrophobicContact CD2-CD1 4.35Å; F551-F566 HydrophobicContact CD2-CE1 4.22Å; F551-F566 HydrophobicContact CE1-CE1 4.4Å; F551-F566 AromaticContact CE2-CD1 3.8Å; F551-F566 HydrophobicContact CE2-CD1 3.8Å; F551-F566 AromaticContact CE2-CE1 3.62Å; F551-F566 HydrophobicContact CE2-CE1 3.62Å; F551-F566 HydrophobicContact CZ-CD1 4.34Å; F551-F566 AromaticContact CZ-CE1 3.73Å; F551-F566 HydrophobicContact CZ-CE1 3.73Å; F551-R570 PolarHBondContact N-O 3.09Å; F551-L571 HydrophobicContact CB-CD2 3.83Å; F551-L571 HydrophobicContact CB-CG 4.49Å; F551-L571 HydrophobicContact CD2-CD2 4.3Å; F551-L571 HydrophobicContact CG-CD2 4.08Å; F551-V572 WeakPolarHBondContact O-CB 3.29Å; F551-V572 PolarHBondContact O-N 3.18Å
552	I	94.7	Very high	89.2	Confident	44 Å²	44	38 Å²	38	23%	0.226	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	123.8	-177.8	-52.3	-177.1	0	0	0	108.9	L530 F531 E532 E533 T550 T554 V572	L530-I552 HydrophobicContact CD1-CD1 3.97Å; L530-I552 HydrophobicContact CD1-CG1 4.28Å; F531-I552 PolarHBondContact O-N 3.44Å; E532-I552 WeakPolarHBondContact CA-O 3.29Å; E532-I552 HydrophobicContact CB-CB 4.48Å; E532-I552 HydrophobicContact CG-CB 4.29Å; E533-I552 PolarHBondContact N-O 2.88Å; T550-I552 HydrophobicContact CG2-CD1 4.24Å; T550-I552 HydrophobicContact CG2-CG1 3.97Å; I552-T554 WeakPolarHBondContact O-CG2 3.3Å; I552-T554 PolarHBondContact O-N 3.31Å; I552-T554 VanDerWaalsContact O-N 3.13Å; I552-V572 WeakPolarHBondContact CA-O 3.39Å; I552-V572 HydrophobicContact CG1-CB 4.49Å
553	N	94.4	Very high	89.4	Confident	68 Å²	68	44.1 Å²	44.1	36%	0.364	21%	0.214	S	C	.	.	S	Bend	trans	56.6	23.4	179.9	-59.8	-26.2	0	0	0	114.6	E533 V572 N573	E533-N553 HydrophobicContact CG-CB 4.48Å; N553-V572 PolarHBondContact N-O 3.21Å; N553-N573 WeakPolarHBondContact OD1-CB 3.35Å; N553-N573 PolarHBondContact OD1-ND2 2.94Å
554	T	93.4	Very high	89.7	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.216	C	C	.	.			trans	-89.3	141.5	-173.9	65.8	0	0	0	0	113	F531 C534 F551 I552 S574 T575	F531-T554 HydrophobicContact CB-CG2 4.14Å; C534-T554 HydrophobicContact CB-CG2 3.88Å; C534-T554 WeakPolarHBondContact O-CA 3.44Å; C534-T554 VanDerWaalsContact O-CB 3.29Å; C534-T554 WeakPolarHBondContact O-CB 3.33Å; F551-T554 HydrophobicContact CB-CG2 4.29Å; F551-T554 HydrophobicContact CD1-CG2 3.96Å; I552-T554 WeakPolarHBondContact O-CG2 3.3Å; I552-T554 PolarHBondContact O-N 3.31Å; I552-T554 VanDerWaalsContact O-N 3.13Å; T554-S574 CarbonylContact O-C 3.55Å; T554-S574 WeakPolarHBondContact O-CA 3.27Å; T554-S574 WeakPolarHBondContact O-CB 3.34Å; T554-S574 PolarHBondContact OG1-OG 2.99Å; T554-T575 PolarHBondContact O-N 3.24Å
555	V	93.6	Very high	89.7	Confident	36 Å²	36	46.8 Å²	46.8	22%	0.218	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.2	178.8	-175.9	0	0	0	0	110.3	C534 Y535 F536 L577	C534-V555 PolarHBondContact O-N 3.34Å; C534-V555 VanDerWaalsContact O-N 3.14Å; Y535-V555 HydrophobicContact CD2-CB 3.74Å; Y535-V555 HydrophobicContact CD2-CG1 4.22Å; Y535-V555 HydrophobicContact CD2-CG2 4.33Å; Y535-V555 HydrophobicContact CE2-CB 3.9Å; Y535-V555 HydrophobicContact CE2-CG1 3.85Å; F536-V555 PolarHBondContact N-O 3.04Å; V555-L577 HydrophobicContact CG1-CD1 4.1Å
556	F	92.4	Very high	89.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.7	173.7	-59	-84.1	0	0	0	109.3	F536 F551 T559 L561 F566 L571 T575 F576 L577	F536-F556 HydrophobicContact CB-CD1 3.69Å; F536-F556 HydrophobicContact CB-CE1 4.23Å; F536-F556 HydrophobicContact CD1-CE1 4.35Å; F536-F556 AromaticContact CD2-CD1 3.8Å; F536-F556 HydrophobicContact CD2-CD1 3.8Å; F536-F556 AromaticContact CD2-CE1 3.49Å; F536-F556 HydrophobicContact CD2-CE1 3.49Å; F536-F556 VanDerWaalsContact CD2-CE1 3.49Å; F536-F556 HydrophobicContact CD2-CZ 4.24Å; F536-F556 AromaticContact CE2-CE1 3.86Å; F536-F556 HydrophobicContact CE2-CE1 3.86Å; F536-F556 HydrophobicContact CE2-CZ 4.37Å; F536-F556 AromaticContact CG-CD1 3.77Å; F536-F556 HydrophobicContact CG-CD1 3.77Å; F536-F556 AromaticContact CG-CE1 3.78Å; F536-F556 HydrophobicContact CG-CE1 3.78Å; F536-F556 HydrophobicContact CZ-CE1 4.45Å; F551-F556 HydrophobicContact CD1-CE2 4.46Å; F551-F556 AromaticContact CD1-CZ 3.73Å; F551-F556 HydrophobicContact CD1-CZ 3.73Å; F551-F556 HydrophobicContact CE1-CE1 4.33Å; F551-F556 AromaticContact CE1-CZ 3.77Å; F551-F556 HydrophobicContact CE1-CZ 3.77Å; F551-F556 HydrophobicContact CG-CZ 4.45Å; F556-T559 HydrophobicContact CB-CG2 4.37Å; F556-L561 HydrophobicContact CD1-CD1 3.82Å; F556-L561 HydrophobicContact CE1-CD1 3.85Å; F556-F566 HydrophobicContact CE1-CZ 4.03Å; F556-F566 HydrophobicContact CE2-CZ 4.41Å; F556-F566 HydrophobicContact CZ-CE1 4.11Å; F556-F566 AromaticContact CZ-CZ 3.82Å; F556-F566 HydrophobicContact CZ-CZ 3.82Å; F556-L571 HydrophobicContact CE2-CD2 3.86Å; F556-L571 HydrophobicContact CZ-CD2 4.4Å; F556-T575 PolarHBondContact N-O 3.19Å; F556-F576 HydrophobicContact CB-CD1 3.59Å; F556-F576 HydrophobicContact CB-CE1 3.87Å; F556-F576 HydrophobicContact CB-CG 4.31Å; F556-F576 HydrophobicContact CD1-CE1 4.32Å; F556-F576 AromaticContact CD2-CD1 3.83Å; F556-F576 HydrophobicContact CD2-CD1 3.83Å; F556-F576 HydrophobicContact CD2-CD2 4.42Å; F556-F576 AromaticContact CD2-CE1 3.41Å; F556-F576 HydrophobicContact CD2-CE1 3.41Å; F556-F576 VanDerWaalsContact CD2-CE1 3.41Å; F556-F576 HydrophobicContact CD2-CE2 4.08Å; F556-F576 HydrophobicContact CD2-CG 4.31Å; F556-F576 AromaticContact CD2-CZ 3.55Å; F556-F576 HydrophobicContact CD2-CZ 3.55Å; F556-F576 AromaticContact CE2-CE1 3.98Å; F556-F576 HydrophobicContact CE2-CE1 3.98Å; F556-F576 HydrophobicContact CE2-CE2 4.36Å; F556-F576 AromaticContact CE2-CZ 3.74Å; F556-F576 HydrophobicContact CE2-CZ 3.74Å; F556-F576 AromaticContact CG-CD1 3.88Å; F556-F576 HydrophobicContact CG-CD1 3.88Å; F556-F576 AromaticContact CG-CE1 3.61Å; F556-F576 HydrophobicContact CG-CE1 3.61Å; F556-F576 HydrophobicContact CG-CZ 4.22Å; F556-F576 CarbonylContact O-C 3.59Å; F556-F576 WeakPolarHBondContact O-CA 3.27Å; F556-L577 PolarHBondContact O-N 2.91Å
557	Y	90.7	Very high	89.4	Confident	82 Å²	82	47.6 Å²	47.6	32%	0.322	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.2	-177.6	-175.9	-89.4	0	0	0	111.2	F536 E537 D538 T559 L577 H578	F536-Y557 PolarHBondContact O-N 2.98Å; E537-Y557 WeakPolarHBondContact CA-O 3.39Å; E537-Y557 HydrophobicContact CG-CD1 4.24Å; D538-Y557 PolarHBondContact N-O 3.28Å; Y557-T559 VanDerWaalsContact C-N 3.32Å; Y557-T559 WeakPolarHBondContact O-CG2 3.47Å; Y557-T559 PolarHBondContact O-N 3.35Å; Y557-L577 WeakPolarHBondContact CA-O 3.36Å; Y557-L577 HydrophobicContact CD2-CB 3.78Å; Y557-L577 HydrophobicContact CD2-CD1 4.24Å; Y557-L577 HydrophobicContact CE2-CB 4.48Å; Y557-H578 AromaticContact CE2-CD2 3.89Å
558	N	86.4	Confident	89.3	Confident	46 Å²	46	49 Å²	49	25%	0.246	24%	0.241	C	C	.	.	S	Bend	trans	54.4	43.5	179.9	-161.2	19.6	0	0	0	113.4	D538 L577 H578 K580	D538-N558 CarbonylContact C-O 3.59Å; D538-N558 VanDerWaalsContact CA-O 3.32Å; D538-N558 WeakPolarHBondContact CA-O 3.44Å; D538-N558 VanDerWaalsContact CG-ND2 3.25Å; D538-N558 PolarHBondContact OD1-ND2 2.94Å; D538-N558 PolarHBondContact OD2-ND2 3.21Å; N558-L577 PolarHBondContact N-O 3.01Å; N558-H578 VanDerWaalsContact CA-O 3.31Å; N558-H578 WeakPolarHBondContact CA-O 3.26Å; N558-K580 WeakPolarHBondContact O-CD 3.46Å; N558-K580 VanDerWaalsContact O-CE 3.25Å; N558-K580 WeakPolarHBondContact O-CE 3.38Å; N558-K580 PolarHBondContact O-NZ 3.44Å; N558-K580 VanDerWaalsContact OD1-CE 3.28Å; N558-K580 WeakPolarHBondContact OD1-CE 3.36Å; N558-K580 WeakPolarHBondContact OD1-CG 3.31Å
559	T	85.3	Confident	89.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.225	C	C	.	.			trans	-110.9	163	-178	76.3	0	0	0	0	112.9	F536 V539 F556 Y557 L561 K580	F536-T559 HydrophobicContact CB-CG2 4.16Å; V539-T559 HydrophobicContact CB-CG2 4.06Å; V539-T559 HydrophobicContact CG2-CG2 4.5Å; V539-T559 WeakPolarHBondContact O-CA 3.27Å; F556-T559 HydrophobicContact CB-CG2 4.37Å; Y557-T559 VanDerWaalsContact C-N 3.32Å; Y557-T559 WeakPolarHBondContact O-CG2 3.47Å; Y557-T559 PolarHBondContact O-N 3.35Å; T559-L561 PolarHBondContact OG1-N 2.88Å; T559-K580 PolarHBondContact O-N 2.67Å
560	D	80.4	Confident	89	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	26%	0.258	C	S	.	.			trans	-98.3	21.8	170.1	75.8	-27.4	0	0	0	112.8	V539 T540 S541 F562 K565 K580 P584	V539-D560 PolarHBondContact O-N 3.12Å; T540-D560 WeakPolarHBondContact CA-OD1 3.07Å; S541-D560 WeakPolarHBondContact CB-OD1 3.27Å; S541-D560 PolarHBondContact N-OD1 2.82Å; S541-D560 PolarHBondContact N-OD2 2.9Å; S541-D560 VanDerWaalsContact OG-CG 3.25Å; S541-D560 PolarHBondContact OG-OD1 3.41Å; S541-D560 PolarHBondContact OG-OD2 3.21Å; D560-F562 HydrophobicContact CB-CE2 4.45Å; D560-F562 VanDerWaalsContact O-CD2 3.26Å; D560-F562 WeakPolarHBondContact O-CD2 3.26Å; D560-F562 PolarHBondContact O-N 2.69Å; D560-F562 VanDerWaalsContact O-N 3.11Å; D560-K565 VanDerWaalsContact CG-NZ 3.28Å; D560-K565 WeakPolarHBondContact O-CE 3.24Å; D560-K565 PolarHBondContact O-NZ 3.45Å; D560-K565 IonicContact OD1-NZ 3.36Å; D560-K565 IonicContact OD2-NZ 3.43Å; D560-K565 PolarHBondContact OD2-NZ 3.19Å; D560-K580 HydrophobicContact CB-CB 4.46Å; D560-P584 HydrophobicContact CB-CG 4.02Å; D560-P584 WeakPolarHBondContact OD2-CG 3.28Å
561	L	84.8	Confident	88.9	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	26%	0.263	C	S	.	.			trans	-86	77	-176.2	-68.3	176.2	0	0	0	111.2	F536 S541 F546 F556 T559 K565 F566 F576	F536-L561 HydrophobicContact CD1-CD1 4.24Å; S541-L561 VanDerWaalsContact OG-CD2 3.25Å; S541-L561 WeakPolarHBondContact OG-CD2 3.25Å; F546-L561 HydrophobicContact CE2-CD1 4.4Å; F546-L561 HydrophobicContact CE2-CD2 3.76Å; F556-L561 HydrophobicContact CD1-CD1 3.82Å; F556-L561 HydrophobicContact CE1-CD1 3.85Å; T559-L561 PolarHBondContact OG1-N 2.88Å; L561-K565 HydrophobicContact CD2-CD 4.02Å; L561-F566 HydrophobicContact CB-CE2 4.08Å; L561-F566 HydrophobicContact CB-CZ 4.11Å; L561-F576 VanDerWaalsContact O-CE1 3.28Å; L561-F576 WeakPolarHBondContact O-CE1 3.49Å
562	F	82.6	Confident	88.7	Confident	59 Å²	59	59.1 Å²	59.1	26%	0.259	28%	0.283	S	S	.	.			trans	-76.2	157.9	174.7	-58.5	-76.5	0	0	0	112.9	D560 Y564 K565 F566 N579 K580	D560-F562 HydrophobicContact CB-CE2 4.45Å; D560-F562 VanDerWaalsContact O-CD2 3.26Å; D560-F562 WeakPolarHBondContact O-CD2 3.26Å; D560-F562 PolarHBondContact O-N 2.69Å; D560-F562 VanDerWaalsContact O-N 3.11Å; F562-Y564 HydrophobicContact CB-CD1 3.62Å; F562-Y564 HydrophobicContact CB-CE1 3.61Å; F562-Y564 AromaticContact CD2-CE1 3.89Å; F562-Y564 HydrophobicContact CD2-CE1 3.89Å; F562-Y564 HydrophobicContact CG-CE1 4.1Å; F562-Y564 PolarHBondContact O-N 3.13Å; F562-K565 WeakPolarHBondContact O-CB 3.34Å; F562-K565 PolarHBondContact O-N 3.3Å; F562-F566 WeakPolarHBondContact O-CD2 3.11Å; F562-N579 HydrophobicContact CE1-CB 4.49Å; F562-K580 WeakPolarHBondContact CZ-O 3.25Å
563	E	80.2	Confident	88.6	Confident	169 Å²	169	63 Å²	63	79%	0.79	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-47.7	-38.6	-178.6	-169.9	174.3	-166.8	0	0	114.1	K565 F566	E563-K565 PolarHBondContact O-N 3.31Å; E563-K565 VanDerWaalsContact O-N 3.09Å; E563-F566 WeakPolarHBondContact O-CB 3.35Å; E563-F566 PolarHBondContact O-N 2.66Å
564	Y	82.4	Confident	88.3	Confident	157 Å²	157	61 Å²	61	62%	0.616	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-63.6	-16.9	179.7	78.9	-96.3	0	0	0	114.6	F562 F566	F562-Y564 HydrophobicContact CB-CD1 3.62Å; F562-Y564 HydrophobicContact CB-CE1 3.61Å; F562-Y564 AromaticContact CD2-CE1 3.89Å; F562-Y564 HydrophobicContact CD2-CE1 3.89Å; F562-Y564 HydrophobicContact CG-CE1 4.1Å; F562-Y564 PolarHBondContact O-N 3.13Å; Y564-F566 VanDerWaalsContact C-N 3.35Å
565	K	85.8	Confident	88.2	Confident	9 Å²	9	64.1 Å²	64.1	4%	0.039	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-82.1	-12.9	174.2	-64	179.9	178.2	173.5	0	112.4	S541 F546 D560 L561 F562 E563 V567	S541-K565 PolarHBondContact O-NZ 2.95Å; S541-K565 PolarHBondContact OG-NZ 3.41Å; F546-K565 PolarHBondContact N-O 3.33Å; D560-K565 VanDerWaalsContact CG-NZ 3.28Å; D560-K565 WeakPolarHBondContact O-CE 3.24Å; D560-K565 PolarHBondContact O-NZ 3.45Å; D560-K565 IonicContact OD1-NZ 3.36Å; D560-K565 IonicContact OD2-NZ 3.43Å; D560-K565 PolarHBondContact OD2-NZ 3.19Å; L561-K565 HydrophobicContact CD2-CD 4.02Å; F562-K565 WeakPolarHBondContact O-CB 3.34Å; F562-K565 PolarHBondContact O-N 3.3Å; E563-K565 PolarHBondContact O-N 3.31Å; E563-K565 VanDerWaalsContact O-N 3.09Å; K565-V567 PolarHBondContact O-N 3.35Å
566	F	89.7	Confident	88	Confident	16 Å²	16	65.9 Å²	65.9	7%	0.07	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	64.8	-176.5	-65.9	-81	0	0	0	112.4	F546 F551 F556 L561 F562 E563 Y564 N568 S569 F576	F546-F566 HydrophobicContact CB-CD1 3.88Å; F546-F566 HydrophobicContact CB-CE1 4.34Å; F546-F566 HydrophobicContact CD2-CD1 4.21Å; F546-F566 AromaticContact CD2-CE1 3.99Å; F546-F566 HydrophobicContact CD2-CE1 3.99Å; F546-F566 HydrophobicContact CG-CD1 4.17Å; F546-F566 HydrophobicContact CG-CE1 4.13Å; F546-F566 CarbonylContact O-C 3.52Å; F551-F566 HydrophobicContact CD2-CD1 4.35Å; F551-F566 HydrophobicContact CD2-CE1 4.22Å; F551-F566 HydrophobicContact CE1-CE1 4.4Å; F551-F566 AromaticContact CE2-CD1 3.8Å; F551-F566 HydrophobicContact CE2-CD1 3.8Å; F551-F566 AromaticContact CE2-CE1 3.62Å; F551-F566 HydrophobicContact CE2-CE1 3.62Å; F551-F566 HydrophobicContact CZ-CD1 4.34Å; F551-F566 AromaticContact CZ-CE1 3.73Å; F551-F566 HydrophobicContact CZ-CE1 3.73Å; F556-F566 HydrophobicContact CE1-CZ 4.03Å; F556-F566 HydrophobicContact CE2-CZ 4.41Å; F556-F566 HydrophobicContact CZ-CE1 4.11Å; F556-F566 AromaticContact CZ-CZ 3.82Å; F556-F566 HydrophobicContact CZ-CZ 3.82Å; L561-F566 HydrophobicContact CB-CE2 4.08Å; L561-F566 HydrophobicContact CB-CZ 4.11Å; F562-F566 WeakPolarHBondContact O-CD2 3.11Å; E563-F566 WeakPolarHBondContact O-CB 3.35Å; E563-F566 PolarHBondContact O-N 2.66Å; Y564-F566 VanDerWaalsContact C-N 3.35Å; F566-N568 PolarHBondContact O-N 3.47Å; F566-S569 PolarHBondContact O-N 2.87Å; F566-F576 HydrophobicContact CE2-CE1 4.11Å; F566-F576 AromaticContact CE2-CZ 3.94Å; F566-F576 HydrophobicContact CE2-CZ 3.94Å; F566-F576 HydrophobicContact CZ-CE1 4.38Å; F566-F576 HydrophobicContact CZ-CZ 4.2Å
567	V	88.9	Confident	87.7	Confident	63 Å²	63	69.8 Å²	69.8	38%	0.382	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	119.5	-177.6	-175.5	0	0	0	0	111.1	F545 F546 R547 N548 K565 S569	F545-V567 HydrophobicContact CD1-CG2 4.47Å; F546-V567 PolarHBondContact O-N 3.33Å; R547-V567 WeakPolarHBondContact CA-O 3.22Å; R547-V567 HydrophobicContact CG-CB 4.3Å; N548-V567 PolarHBondContact N-O 3.29Å; K565-V567 PolarHBondContact O-N 3.35Å; V567-S569 PolarHBondContact O-N 2.85Å; V567-S569 PolarHBondContact O-OG 3.08Å
568	N	90.1	Very high	87.2	Confident	138 Å²	138	72.8 Å²	72.8	74%	0.738	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	19.7	-178.6	-61.4	-17.1	0	0	0	114.9	F566	F566-N568 PolarHBondContact O-N 3.47Å
569	S	92.2	Very high	86.7	Confident	23 Å²	23	73.3 Å²	73.3	16%	0.161	36%	0.36	C	S	.	.			trans	-92	151.6	-174.6	-62.4	0	0	0	0	111.4	F546 N548 C549 F566 V567	F546-S569 PolarHBondContact O-OG 2.71Å; F546-S569 VanDerWaalsContact O-OG 3.1Å; N548-S569 PolarHBondContact N-OG 2.69Å; C549-S569 PolarHBondContact N-OG 3.29Å; C549-S569 CarbonylContact O-C 3.59Å; C549-S569 WeakPolarHBondContact O-CA 3.48Å; C549-S569 WeakPolarHBondContact O-CB 3.21Å; F566-S569 PolarHBondContact O-N 2.87Å; V567-S569 PolarHBondContact O-N 2.85Å; V567-S569 PolarHBondContact O-OG 3.08Å
570	R	92	Very high	85.8	Confident	185 Å²	185	75.5 Å²	75.5	70%	0.698	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.2	179.8	-65.5	-174.4	-179.7	-142.2	-0.2	110.9	C549 T550 F551	C549-R570 PolarHBondContact O-N 3.37Å; T550-R570 WeakPolarHBondContact CA-O 3.4Å; T550-R570 HydrophobicContact CG2-CB 4.42Å; F551-R570 PolarHBondContact N-O 3.09Å
571	L	91.5	Very high	84.9	Confident	72 Å²	72	84.1 Å²	84.1	38%	0.377	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	115.3	174	-72.3	148.4	0	0	0	108.7	F551 F556 F576	F551-L571 HydrophobicContact CB-CD2 3.83Å; F551-L571 HydrophobicContact CB-CG 4.49Å; F551-L571 HydrophobicContact CD2-CD2 4.3Å; F551-L571 HydrophobicContact CG-CD2 4.08Å; F556-L571 HydrophobicContact CE2-CD2 3.86Å; F556-L571 HydrophobicContact CZ-CD2 4.4Å; L571-F576 HydrophobicContact CD1-CE2 4.26Å; L571-F576 HydrophobicContact CD1-CZ 4.31Å; L571-F576 HydrophobicContact CD2-CE2 4.24Å; L571-F576 HydrophobicContact CD2-CZ 4.17Å
572	V	91.8	Very high	83.5	Confident	72 Å²	72	87 Å²	87	44%	0.436	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.9	-177.7	-176.7	0	0	0	0	108.6	F551 I552 N553 S574	F551-V572 WeakPolarHBondContact O-CB 3.29Å; F551-V572 PolarHBondContact O-N 3.18Å; I552-V572 WeakPolarHBondContact CA-O 3.39Å; I552-V572 HydrophobicContact CG1-CB 4.49Å; N553-V572 PolarHBondContact N-O 3.21Å; V572-S574 PolarHBondContact O-N 3.27Å; V572-S574 PolarHBondContact O-OG 3.4Å; V572-S574 VanDerWaalsContact O-OG 3.04Å
573	N	91.9	Very high	82	Confident	126 Å²	126	87.7 Å²	87.7	67%	0.674	45%	0.451	S	S	*	.	S	Bend	trans	48.7	34.2	-177.9	-164.3	41.3	0	0	0	113.6	N553	N553-N573 WeakPolarHBondContact OD1-CB 3.35Å; N553-N573 PolarHBondContact OD1-ND2 2.94Å
574	S	89.1	Confident	80.6	Confident	25 Å²	25	82 Å²	82	18%	0.175	43%	0.429	C	S	.	.			trans	-100.8	145.1	-176.7	-54.2	0	0	0	0	110.3	T554 V572	T554-S574 CarbonylContact O-C 3.55Å; T554-S574 WeakPolarHBondContact O-CA 3.27Å; T554-S574 WeakPolarHBondContact O-CB 3.34Å; T554-S574 PolarHBondContact OG1-OG 2.99Å; V572-S574 PolarHBondContact O-N 3.27Å; V572-S574 PolarHBondContact O-OG 3.4Å; V572-S574 VanDerWaalsContact O-OG 3.04Å
575	T	90.4	Very high	78.9	Confident	66 Å²	66	79.2 Å²	79.2	41%	0.405	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	143.5	-173.8	55.6	0	0	0	0	112.7	T554 F556	T554-T575 PolarHBondContact O-N 3.24Å; F556-T575 PolarHBondContact N-O 3.19Å
576	F	89.6	Confident	76.8	Confident	74 Å²	74	80.2 Å²	80.2	33%	0.325	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.2	176.5	-67.8	-91.2	0	0	0	109.5	F556 L561 F566 L571	F556-F576 HydrophobicContact CB-CD1 3.59Å; F556-F576 HydrophobicContact CB-CE1 3.87Å; F556-F576 HydrophobicContact CB-CG 4.31Å; F556-F576 HydrophobicContact CD1-CE1 4.32Å; F556-F576 AromaticContact CD2-CD1 3.83Å; F556-F576 HydrophobicContact CD2-CD1 3.83Å; F556-F576 HydrophobicContact CD2-CD2 4.42Å; F556-F576 AromaticContact CD2-CE1 3.41Å; F556-F576 HydrophobicContact CD2-CE1 3.41Å; F556-F576 VanDerWaalsContact CD2-CE1 3.41Å; F556-F576 HydrophobicContact CD2-CE2 4.08Å; F556-F576 HydrophobicContact CD2-CG 4.31Å; F556-F576 AromaticContact CD2-CZ 3.55Å; F556-F576 HydrophobicContact CD2-CZ 3.55Å; F556-F576 AromaticContact CE2-CE1 3.98Å; F556-F576 HydrophobicContact CE2-CE1 3.98Å; F556-F576 HydrophobicContact CE2-CE2 4.36Å; F556-F576 AromaticContact CE2-CZ 3.74Å; F556-F576 HydrophobicContact CE2-CZ 3.74Å; F556-F576 AromaticContact CG-CD1 3.88Å; F556-F576 HydrophobicContact CG-CD1 3.88Å; F556-F576 AromaticContact CG-CE1 3.61Å; F556-F576 HydrophobicContact CG-CE1 3.61Å; F556-F576 HydrophobicContact CG-CZ 4.22Å; F556-F576 CarbonylContact O-C 3.59Å; F556-F576 WeakPolarHBondContact O-CA 3.27Å; L561-F576 VanDerWaalsContact O-CE1 3.28Å; L561-F576 WeakPolarHBondContact O-CE1 3.49Å; F566-F576 HydrophobicContact CE2-CE1 4.11Å; F566-F576 AromaticContact CE2-CZ 3.94Å; F566-F576 HydrophobicContact CE2-CZ 3.94Å; F566-F576 HydrophobicContact CZ-CE1 4.38Å; F566-F576 HydrophobicContact CZ-CZ 4.2Å; L571-F576 HydrophobicContact CD1-CE2 4.26Å; L571-F576 HydrophobicContact CD1-CZ 4.31Å; L571-F576 HydrophobicContact CD2-CE2 4.24Å; L571-F576 HydrophobicContact CD2-CZ 4.17Å
577	L	85.9	Confident	74.7	Confident	82 Å²	82	81.7 Å²	81.7	43%	0.429	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	127.6	-172.9	-64.4	173.6	0	0	0	110	V555 F556 Y557 N558 N579	V555-L577 HydrophobicContact CG1-CD1 4.1Å; F556-L577 PolarHBondContact O-N 2.91Å; Y557-L577 WeakPolarHBondContact CA-O 3.36Å; Y557-L577 HydrophobicContact CD2-CB 3.78Å; Y557-L577 HydrophobicContact CD2-CD1 4.24Å; Y557-L577 HydrophobicContact CE2-CB 4.48Å; N558-L577 PolarHBondContact N-O 3.01Å; L577-N579 PolarHBondContact O-N 3.4Å
578	H	79.6	Confident	72.2	Confident	144 Å²	144	83 Å²	83	67%	0.667	45%	0.448	S	S	*	.	S	Bend	trans	49.5	51.7	179.9	-65.5	-74.3	0	0	0	114.2	Y557 N558 K580	Y557-H578 AromaticContact CE2-CD2 3.89Å; N558-H578 VanDerWaalsContact CA-O 3.31Å; N558-H578 WeakPolarHBondContact CA-O 3.26Å; H578-K580 PolarHBondContact O-N 3.07Å
579	N	75.8	Confident	69.8	Low	58 Å²	58	77.6 Å²	77.6	31%	0.31	43%	0.426	S	S	.	.			trans	-53.9	141	177.6	-73.9	-1.9	0	0	0	112.1	F562 L577 E581	F562-N579 HydrophobicContact CE1-CB 4.49Å; L577-N579 PolarHBondContact O-N 3.4Å; N579-E581 PolarHBondContact O-N 3.25Å
580	K	68	Low	67.4	Low	46 Å²	46	79.2 Å²	79.2	20%	0.2	43%	0.434	C	S	.	.			trans	-74.7	89.7	178.6	-76.2	176.1	163.8	132.6	0	110.6	D538 T540 N558 T559 D560 F562 H578	D538-K580 VanDerWaalsContact C-NZ 3.33Å; D538-K580 PolarHBondContact O-NZ 2.64Å; D538-K580 IonicContact OD1-NZ 3.56Å; D538-K580 PolarHBondContact OD1-NZ 2.93Å; T540-K580 HydrophobicContact CG2-CD 4.27Å; N558-K580 WeakPolarHBondContact O-CD 3.46Å; N558-K580 VanDerWaalsContact O-CE 3.25Å; N558-K580 WeakPolarHBondContact O-CE 3.38Å; N558-K580 PolarHBondContact O-NZ 3.44Å; N558-K580 VanDerWaalsContact OD1-CE 3.28Å; N558-K580 WeakPolarHBondContact OD1-CE 3.36Å; N558-K580 WeakPolarHBondContact OD1-CG 3.31Å; T559-K580 PolarHBondContact O-N 2.67Å; D560-K580 HydrophobicContact CB-CB 4.46Å; F562-K580 WeakPolarHBondContact CZ-O 3.25Å; H578-K580 PolarHBondContact O-N 3.07Å
581	E	60.1	Low	65	Low	181 Å²	181	72.2 Å²	72.2	85%	0.846	42%	0.42	S	S	*	.			trans	-68.1	147.6	175	-66.3	-174.3	-179.8	0	0	112.6	N579	N579-E581 PolarHBondContact O-N 3.25Å
582	G	55.3	Low	62.6	Low	62 Å²	62	76.7 Å²	76.7	64%	0.639	44%	0.439	S	S	*	.	S	Bend	trans	91.5	169.4	-170.4	0	0	0	0	0	113.1	P584	G582-P584 WeakPolarHBondContact O-CD 3.35Å
583	C	52.2	Low	60.5	Low	73 Å²	73	75.2 Å²	75.2	49%	0.493	44%	0.438	S	S	.	.			trans	-80.6	117.9	177	-170.7	0	0	0	0	109.8	C198 L585	C198-C583 WeakPolarHBondContact SG-CB 3.48Å; C583-L585 PolarHBondContact O-N 3.22Å; C583-L585 VanDerWaalsContact O-N 3.12Å
584	P	50.3	Low	58.6	Low	50 Å²	50	70.7 Å²	70.7	33%	0.325	42%	0.419	S	S	.	.			trans	-69.2	114.6	-177.1	26.3	-32.4	0	0	0	110.4	D560 G582 D586	D560-P584 HydrophobicContact CB-CG 4.02Å; D560-P584 WeakPolarHBondContact OD2-CG 3.28Å; G582-P584 WeakPolarHBondContact O-CD 3.35Å; P584-D586 PolarHBondContact O-N 3.45Å
585	L	47.1	Very low	57.3	Low	99 Å²	99	74.5 Å²	74.5	52%	0.518	43%	0.43	S	S	.	.			trans	-60.2	95.6	175.9	-80.7	167.1	0	0	0	111.3	K195 C583 V587	K195-L585 HydrophobicContact CB-CD2 3.99Å; K195-L585 HydrophobicContact CD-CD2 4.44Å; C583-L585 PolarHBondContact O-N 3.22Å; C583-L585 VanDerWaalsContact O-N 3.12Å; L585-V587 HydrophobicContact CB-CB 4.35Å; L585-V587 HydrophobicContact CB-CG2 3.78Å; L585-V587 HydrophobicContact CD2-CG2 4.13Å; L585-V587 HydrophobicContact CG-CG2 4.42Å; L585-V587 PolarHBondContact O-N 2.83Å
586	D	42.1	Very low	55.9	Low	30 Å²	30	76 Å²	76	16%	0.16	43%	0.434	C	S	.	.			trans	-69.2	87.3	162.7	-174.9	4.7	0	0	0	109.1	K195 P584 G589 T590	K195-D586 PolarHBondContact NZ-O 3.08Å; P584-D586 PolarHBondContact O-N 3.45Å; D586-G589 VanDerWaalsContact OD1-CA 3.3Å; D586-G589 WeakPolarHBondContact OD1-CA 3.41Å; D586-G589 PolarHBondContact OD1-N 2.96Å; D586-T590 PolarHBondContact O-OG1 3.33Å
587	V	44.3	Very low	54.8	Low	47 Å²	47	75.5 Å²	75.5	29%	0.285	44%	0.437	S	S	.	.			trans	-104.2	-11.6	-170.3	136.1	0	0	0	0	112.5	Y318 L585	Y318-V587 HydrophobicContact CE1-CG1 3.98Å; Y318-V587 HydrophobicContact CE1-CG2 4.42Å; Y318-V587 HydrophobicContact CE2-CG1 4.44Å; Y318-V587 VanDerWaalsContact OH-CG1 3.28Å; Y318-V587 WeakPolarHBondContact OH-CG1 3.28Å; Y318-V587 VanDerWaalsContact OH-CG2 3.27Å; Y318-V587 WeakPolarHBondContact OH-CG2 3.15Å; L585-V587 HydrophobicContact CB-CB 4.35Å; L585-V587 HydrophobicContact CB-CG2 3.78Å; L585-V587 HydrophobicContact CD2-CG2 4.13Å; L585-V587 HydrophobicContact CG-CG2 4.42Å; L585-V587 PolarHBondContact O-N 2.83Å
588	T	37.5	Very low	54	Low	89 Å²	89	72.4 Å²	72.4	55%	0.546	42%	0.419	S	S	.	.	S	Bend	trans	-121.2	-15.4	-179.6	48.8	0	0	0	0	114.2	R520	R520-T588 VanDerWaalsContact CZ-OG1 3.24Å; R520-T588 PolarHBondContact NH1-OG1 2.91Å; R520-T588 PolarHBondContact NH2-OG1 3.17Å
589	G	39.7	Very low	53.7	Low	26 Å²	26	69.7 Å²	69.7	27%	0.268	41%	0.406	S	S	.	.	S	Bend	trans	-83.2	-39.6	171.7	0	0	0	0	0	113.9	D586 G591	D586-G589 VanDerWaalsContact OD1-CA 3.3Å; D586-G589 WeakPolarHBondContact OD1-CA 3.41Å; D586-G589 PolarHBondContact OD1-N 2.96Å; G589-G591 VanDerWaalsContact C-N 3.34Å
590	T	42.3	Very low	53.5	Low	56 Å²	56	67.9 Å²	67.9	34%	0.344	40%	0.397	S	S	.	.	S	Bend	trans	-92.5	11.1	-179.2	53.6	0	0	0	0	113.8	K195 D586 E592 G593 A594	K195-T590 PolarHBondContact NZ-OG1 3.44Å; D586-T590 PolarHBondContact O-OG1 3.33Å; T590-E592 PolarHBondContact O-N 3.31Å; T590-G593 PolarHBondContact O-N 2.98Å; T590-A594 WeakPolarHBondContact O-CB 3.48Å; T590-A594 PolarHBondContact O-N 3.26Å
591	G	40.5	Very low	53.8	Low	39 Å²	39	67.6 Å²	67.6	40%	0.402	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-46.1	179.6	0	0	0	0	0	112.9	G589 Y595	G589-G591 VanDerWaalsContact C-N 3.34Å; G591-Y595 WeakPolarHBondContact O-CB 3.44Å; G591-Y595 PolarHBondContact O-N 3.28Å
592	E	40.7	Very low	54.7	Low	165 Å²	165	61.9 Å²	61.9	77%	0.771	37%	0.373	S	S	*	.	H	α-helix	trans	-68.6	-43.6	175.6	-62.2	-173.2	139.8	0	0	111.6	T590 Y595 M596	T590-E592 PolarHBondContact O-N 3.31Å; E592-Y595 PolarHBondContact O-N 3.21Å; E592-M596 WeakPolarHBondContact O-CB 3.48Å; E592-M596 VanDerWaalsContact O-CG 3.26Å; E592-M596 WeakPolarHBondContact O-CG 3.47Å; E592-M596 PolarHBondContact O-N 3.3Å
593	G	47.6	Very low	55.8	Low	41 Å²	41	61.7 Å²	61.7	42%	0.423	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-47.5	-179.4	0	0	0	0	0	113.7	T590 M596 V597	T590-G593 PolarHBondContact O-N 2.98Å; G593-M596 PolarHBondContact O-N 3.35Å; G593-V597 WeakPolarHBondContact O-CG2 3.4Å; G593-V597 PolarHBondContact O-N 2.91Å
594	A	52.4	Low	57	Low	32 Å²	32	58.9 Å²	58.9	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-66.2	-40	177.3	0	0	0	0	0	111.7	T590 V597 Y598	T590-A594 WeakPolarHBondContact O-CB 3.48Å; T590-A594 PolarHBondContact O-N 3.26Å; A594-V597 PolarHBondContact O-N 3Å; A594-Y598 VanDerWaalsContact O-CD2 3.26Å; A594-Y598 WeakPolarHBondContact O-CD2 3.49Å; A594-Y598 VanDerWaalsContact O-CG 3.29Å; A594-Y598 PolarHBondContact O-N 2.82Å
595	Y	61.2	Low	58.5	Low	104 Å²	104	56.9 Å²	56.9	41%	0.408	33%	0.328	S	S	.	.	H	α-helix	trans	-60.9	-43.8	174	-172.6	-81	0	0	0	111.6	W312 G591 E592 Y598 F599	W312-Y595 AromaticContact CD1-CE2 3.75Å; W312-Y595 AromaticContact NE1-CE2 3.2Å; W312-Y595 AromaticContact NE1-CZ 3.33Å; W312-Y595 VanDerWaalsContact NE1-CZ 3.33Å; W312-Y595 PolarHBondContact NE1-OH 2.98Å; G591-Y595 WeakPolarHBondContact O-CB 3.44Å; G591-Y595 PolarHBondContact O-N 3.28Å; E592-Y595 PolarHBondContact O-N 3.21Å; Y595-Y598 PolarHBondContact O-N 2.89Å; Y595-F599 VanDerWaalsContact O-CB 3.26Å; Y595-F599 WeakPolarHBondContact O-CB 3.4Å; Y595-F599 PolarHBondContact O-N 2.93Å
596	M	61.6	Low	60.3	Low	99 Å²	99	55.8 Å²	55.8	49%	0.488	32%	0.322	S	S	.	.	H	α-helix	trans	-66	-40.1	176.5	-72.1	-62	-177.2	0	0	112.4	E592 G593 F599 V600	E592-M596 WeakPolarHBondContact O-CB 3.48Å; E592-M596 VanDerWaalsContact O-CG 3.26Å; E592-M596 WeakPolarHBondContact O-CG 3.47Å; E592-M596 PolarHBondContact O-N 3.3Å; G593-M596 PolarHBondContact O-N 3.35Å; M596-F599 PolarHBondContact O-N 3.39Å; M596-F599 HydrophobicContact SD-CD1 4.42Å; M596-V600 WeakPolarHBondContact O-CB 3.22Å; M596-V600 VanDerWaalsContact O-CG2 3.3Å; M596-V600 WeakPolarHBondContact O-CG2 3.28Å; M596-V600 PolarHBondContact O-N 2.65Å
597	V	65.9	Low	62.4	Low	63 Å²	63	55.7 Å²	55.7	38%	0.382	33%	0.325	S	S	.	.	H	α-helix	trans	-58.3	-50.5	173.1	167.9	0	0	0	0	110.7	G593 A594 F599 V600 S601	G593-V597 WeakPolarHBondContact O-CG2 3.4Å; G593-V597 PolarHBondContact O-N 2.91Å; A594-V597 PolarHBondContact O-N 3Å; V597-F599 VanDerWaalsContact C-N 3.32Å; V597-F599 PolarHBondContact O-N 3.46Å; V597-V600 PolarHBondContact O-N 2.97Å; V597-S601 PolarHBondContact O-N 3.36Å; V597-S601 PolarHBondContact O-OG 3.11Å
598	Y	70.6	Confident	64.5	Low	16 Å²	16	53.9 Å²	53.9	6%	0.063	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-36.3	178.5	-62	-31.8	0	0	0	112.8	F188 P191 I315 A594 Y595 F602	F188-Y598 HydrophobicContact CB-CE1 4.48Å; F188-Y598 AromaticContact CD1-CD1 3.54Å; F188-Y598 HydrophobicContact CD1-CD1 3.54Å; F188-Y598 AromaticContact CD1-CE1 3.93Å; F188-Y598 HydrophobicContact CD1-CE1 3.93Å; F188-Y598 HydrophobicContact CD1-CG 4.3Å; F188-Y598 HydrophobicContact CE1-CD1 4.06Å; F188-Y598 WeakPolarHBondContact O-CE1 3.32Å; F188-Y598 PolarHBondContact O-OH 3.45Å; P191-Y598 HydrophobicContact CG-CE1 4.37Å; I315-Y598 HydrophobicContact CB-CE2 4.45Å; I315-Y598 HydrophobicContact CD1-CE2 4.26Å; I315-Y598 HydrophobicContact CG2-CE2 4.08Å; A594-Y598 VanDerWaalsContact O-CD2 3.26Å; A594-Y598 WeakPolarHBondContact O-CD2 3.49Å; A594-Y598 VanDerWaalsContact O-CG 3.29Å; A594-Y598 PolarHBondContact O-N 2.82Å; Y595-Y598 PolarHBondContact O-N 2.89Å; Y598-F602 WeakPolarHBondContact O-CB 3.32Å; Y598-F602 PolarHBondContact O-N 3.46Å
599	F	72.2	Confident	66.9	Low	87 Å²	87	51.1 Å²	51.1	38%	0.382	30%	0.296	S	S	.	.	H	α-helix	trans	-69.4	-38.8	175.5	-178	-114.2	0	0	0	112.9	Y595 M596 V597 F602 L603	Y595-F599 VanDerWaalsContact O-CB 3.26Å; Y595-F599 WeakPolarHBondContact O-CB 3.4Å; Y595-F599 PolarHBondContact O-N 2.93Å; M596-F599 PolarHBondContact O-N 3.39Å; M596-F599 HydrophobicContact SD-CD1 4.42Å; V597-F599 VanDerWaalsContact C-N 3.32Å; V597-F599 PolarHBondContact O-N 3.46Å; F599-F602 WeakPolarHBondContact O-CB 3.33Å; F599-F602 PolarHBondContact O-N 3.31Å; F599-L603 HydrophobicContact CD1-CD1 4Å; F599-L603 HydrophobicContact CE1-CD1 3.54Å; F599-L603 HydrophobicContact CE1-CG 4.22Å; F599-L603 HydrophobicContact CE2-CD1 4.48Å; F599-L603 HydrophobicContact CE2-CD2 4.47Å; F599-L603 HydrophobicContact CE2-CG 4.31Å; F599-L603 HydrophobicContact CZ-CD1 3.81Å; F599-L603 HydrophobicContact CZ-CD2 4.25Å; F599-L603 HydrophobicContact CZ-CG 4.1Å; F599-L603 WeakPolarHBondContact O-CG 3.37Å; F599-L603 PolarHBondContact O-N 2.95Å
600	V	72.2	Confident	69.4	Low	20 Å²	20	53.5 Å²	53.5	12%	0.121	31%	0.307	C	S	.	.	H	α-helix	trans	-67.2	-41.2	174.3	169.4	0	0	0	0	110.9	M596 V597 L603 G604 I652	M596-V600 WeakPolarHBondContact O-CB 3.22Å; M596-V600 VanDerWaalsContact O-CG2 3.3Å; M596-V600 WeakPolarHBondContact O-CG2 3.28Å; M596-V600 PolarHBondContact O-N 2.65Å; V597-V600 PolarHBondContact O-N 2.97Å; V600-L603 PolarHBondContact O-N 3.18Å; V600-G604 PolarHBondContact O-N 3.38Å; V600-I652 HydrophobicContact CG1-CD1 4.44Å; V600-I652 HydrophobicContact CG1-CG1 4.2Å; V600-I652 HydrophobicContact CG2-CD1 3.86Å
601	S	73.4	Confident	71.6	Confident	40 Å²	40	51.2 Å²	51.2	28%	0.28	29%	0.294	S	S	.	.	H	α-helix	trans	-60.8	-43.7	171.6	-61.9	0	0	0	0	112	V597 G604 T605	V597-S601 PolarHBondContact O-N 3.36Å; V597-S601 PolarHBondContact O-OG 3.11Å; S601-G604 PolarHBondContact O-N 3.49Å; S601-T605 PolarHBondContact O-N 2.99Å; S601-T605 PolarHBondContact O-OG1 2.82Å
602	F	79.6	Confident	73.9	Confident	62 Å²	62	49.4 Å²	49.4	27%	0.272	28%	0.275	S	S	.	.	H	α-helix	trans	-58.8	-51.1	174.2	175	-95.6	0	0	0	111.7	V305 A308 Y598 F599 G604 T605 L606	V305-F602 HydrophobicContact CG1-CE2 4.14Å; A308-F602 HydrophobicContact CB-CB 4.12Å; A308-F602 HydrophobicContact CB-CD2 3.86Å; Y598-F602 WeakPolarHBondContact O-CB 3.32Å; Y598-F602 PolarHBondContact O-N 3.46Å; F599-F602 WeakPolarHBondContact O-CB 3.33Å; F599-F602 PolarHBondContact O-N 3.31Å; F602-G604 VanDerWaalsContact C-N 3.3Å; F602-G604 PolarHBondContact O-N 2.91Å; F602-T605 PolarHBondContact O-N 3.02Å; F602-T605 PolarHBondContact O-OG1 2.98Å; F602-L606 HydrophobicContact CE1-CD2 4Å; F602-L606 HydrophobicContact CZ-CD2 4.44Å; F602-L606 WeakPolarHBondContact O-CB 3.18Å; F602-L606 PolarHBondContact O-N 3.34Å
603	L	77.6	Confident	76.4	Confident	57 Å²	57	44.8 Å²	44.8	30%	0.298	26%	0.255	S	S	.	.	H	α-helix	trans	-58.7	-40.3	177	-74	177.9	0	0	0	112.4	F599 V600 L606 A607	F599-L603 HydrophobicContact CD1-CD1 4Å; F599-L603 HydrophobicContact CE1-CD1 3.54Å; F599-L603 HydrophobicContact CE1-CG 4.22Å; F599-L603 HydrophobicContact CE2-CD1 4.48Å; F599-L603 HydrophobicContact CE2-CD2 4.47Å; F599-L603 HydrophobicContact CE2-CG 4.31Å; F599-L603 HydrophobicContact CZ-CD1 3.81Å; F599-L603 HydrophobicContact CZ-CD2 4.25Å; F599-L603 HydrophobicContact CZ-CG 4.1Å; F599-L603 WeakPolarHBondContact O-CG 3.37Å; F599-L603 PolarHBondContact O-N 2.95Å; V600-L603 PolarHBondContact O-N 3.18Å; L603-L606 PolarHBondContact O-N 3.01Å; L603-A607 WeakPolarHBondContact O-CB 3.32Å; L603-A607 PolarHBondContact O-N 3.34Å
604	G	77.9	Confident	78.4	Confident	15 Å²	15	46.7 Å²	46.7	16%	0.155	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-50.5	173.6	0	0	0	0	0	112	V600 S601 F602 L606 A607 V608	V600-G604 PolarHBondContact O-N 3.38Å; S601-G604 PolarHBondContact O-N 3.49Å; F602-G604 VanDerWaalsContact C-N 3.3Å; F602-G604 PolarHBondContact O-N 2.91Å; G604-L606 VanDerWaalsContact C-N 3.34Å; G604-L606 PolarHBondContact O-N 2.67Å; G604-A607 PolarHBondContact O-N 3.18Å; G604-V608 WeakPolarHBondContact O-CG2 3.39Å
605	T	81.6	Confident	80.2	Confident	8 Å²	8	45.2 Å²	45.2	5%	0.049	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-36.8	176.5	59.8	0	0	0	0	113	F184 M301 S601 F602 V608	F184-T605 HydrophobicContact CD1-CG2 4.23Å; F184-T605 HydrophobicContact CE1-CG2 3.72Å; F184-T605 HydrophobicContact CE2-CG2 4.48Å; F184-T605 HydrophobicContact CZ-CG2 3.87Å; M301-T605 HydrophobicContact CE-CG2 4.08Å; M301-T605 WeakPolarHBondContact CE-O 3.43Å; S601-T605 PolarHBondContact O-N 2.99Å; S601-T605 PolarHBondContact O-OG1 2.82Å; F602-T605 PolarHBondContact O-N 3.02Å; F602-T605 PolarHBondContact O-OG1 2.98Å; T605-V608 PolarHBondContact O-N 2.99Å
606	L	85.6	Confident	81.5	Confident	76 Å²	76	40.4 Å²	40.4	40%	0.398	23%	0.228	S	C	.	.	H	α-helix	trans	-66.4	-37.5	178.7	-176.9	62.5	0	0	0	112.1	F602 L603 G604 V608 L609 P610	F602-L606 HydrophobicContact CE1-CD2 4Å; F602-L606 HydrophobicContact CZ-CD2 4.44Å; F602-L606 WeakPolarHBondContact O-CB 3.18Å; F602-L606 PolarHBondContact O-N 3.34Å; L603-L606 PolarHBondContact O-N 3.01Å; G604-L606 VanDerWaalsContact C-N 3.34Å; G604-L606 PolarHBondContact O-N 2.67Å; L606-V608 PolarHBondContact O-N 3.03Å; L606-L609 HydrophobicContact CD1-CD1 4.35Å; L606-L609 PolarHBondContact O-N 3.34Å; L606-P610 VanDerWaalsContact O-CD 3.29Å; L606-P610 WeakPolarHBondContact O-CD 3.3Å
607	A	85.7	Confident	82.8	Confident	28 Å²	28	39.6 Å²	39.6	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-67	-18.6	178	0	0	0	0	0	114.1	L603 G604 C656	L603-A607 WeakPolarHBondContact O-CB 3.32Å; L603-A607 PolarHBondContact O-N 3.34Å; G604-A607 PolarHBondContact O-N 3.18Å; A607-C656 HydrophobicContact CB-CB 3.51Å
608	V	88.7	Confident	83.9	Confident	8 Å²	8	39.6 Å²	39.6	5%	0.048	22%	0.222	C	C	.	.	H	α-helix	trans	-81.1	-28.9	178.2	179.6	0	0	0	0	112.2	M301 G604 T605 L606 G611 N612 I663	M301-V608 HydrophobicContact CE-CB 3.79Å; M301-V608 HydrophobicContact CE-CG1 4.02Å; M301-V608 HydrophobicContact CE-CG2 4.3Å; M301-V608 HydrophobicContact CG-CB 4.44Å; M301-V608 HydrophobicContact CG-CG1 3.83Å; M301-V608 HydrophobicContact SD-CB 4.04Å; M301-V608 HydrophobicContact SD-CG1 3.56Å; M301-V608 VanDerWaalsContact SD-CG1 3.56Å; G604-V608 WeakPolarHBondContact O-CG2 3.39Å; T605-V608 PolarHBondContact O-N 2.99Å; L606-V608 PolarHBondContact O-N 3.03Å; V608-G611 WeakPolarHBondContact O-CA 3.36Å; V608-G611 PolarHBondContact O-N 2.88Å; V608-N612 PolarHBondContact O-N 2.93Å; V608-I663 HydrophobicContact CG1-CB 3.57Å; V608-I663 HydrophobicContact CG1-CD1 3.83Å; V608-I663 HydrophobicContact CG1-CG1 3.5Å; V608-I663 HydrophobicContact CG1-CG2 3.71Å
609	L	88.9	Confident	84.6	Confident	32 Å²	32	38.8 Å²	38.8	17%	0.168	22%	0.219	C	C	.	.	H	α-helix	trans	-59.3	-41.8	-178.2	-75.9	172.2	0	0	0	114.7	M298 M301 V305 L606 G611 N612 I613	M298-L609 HydrophobicContact CG-CD2 3.91Å; M301-L609 HydrophobicContact CB-CD2 3.58Å; M301-L609 HydrophobicContact CB-CG 4.21Å; V305-L609 HydrophobicContact CG2-CD1 4.11Å; L606-L609 HydrophobicContact CD1-CD1 4.35Å; L606-L609 PolarHBondContact O-N 3.34Å; L609-G611 VanDerWaalsContact C-N 3.26Å; L609-G611 PolarHBondContact O-N 3.36Å; L609-N612 WeakPolarHBondContact O-CB 3.4Å; L609-N612 PolarHBondContact O-N 2.99Å; L609-I613 WeakPolarHBondContact O-CG1 3.3Å; L609-I613 PolarHBondContact O-N 3.3Å; L609-I613 VanDerWaalsContact O-N 3.14Å
610	P	90.4	Very high	85.2	Confident	76 Å²	76	36.3 Å²	36.3	49%	0.494	21%	0.21	S	C	.	.	H	α-helix	trans	-57.1	-37.4	170.9	-27.1	35.5	0	0	0	113.4	L606 I613 V614	L606-P610 VanDerWaalsContact O-CD 3.29Å; L606-P610 WeakPolarHBondContact O-CD 3.3Å; P610-I613 PolarHBondContact O-N 2.86Å; P610-V614 WeakPolarHBondContact O-CB 3.35Å; P610-V614 VanDerWaalsContact O-CG2 3.3Å; P610-V614 WeakPolarHBondContact O-CG2 3.37Å; P610-V614 PolarHBondContact O-N 2.73Å
611	G	88.6	Confident	85.8	Confident	7 Å²	7	42.1 Å²	42.1	7%	0.072	23%	0.234	C	C	.	.	H	α-helix	trans	-61.4	-43.6	175.8	0	0	0	0	0	112.5	V608 L609 V614 S615 G660	V608-G611 WeakPolarHBondContact O-CA 3.36Å; V608-G611 PolarHBondContact O-N 2.88Å; L609-G611 VanDerWaalsContact C-N 3.26Å; L609-G611 PolarHBondContact O-N 3.36Å; G611-V614 PolarHBondContact O-N 3.35Å; G611-S615 WeakPolarHBondContact O-CB 3.43Å; G611-S615 PolarHBondContact O-N 3Å; G611-S615 PolarHBondContact O-OG 2.86Å; G611-G660 VanDerWaalsContact CA-O 3.24Å; G611-G660 WeakPolarHBondContact CA-O 3.42Å
612	N	90.4	Very high	86.4	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.011	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-50	174.4	-80.6	-12.8	0	0	0	112	M301 V608 L609 V614 S615 A616 I663 N667	M301-N612 VanDerWaalsContact CG-ND2 3.29Å; M301-N612 WeakPolarHBondContact CG-ND2 3.26Å; V608-N612 PolarHBondContact O-N 2.93Å; L609-N612 WeakPolarHBondContact O-CB 3.4Å; L609-N612 PolarHBondContact O-N 2.99Å; N612-V614 VanDerWaalsContact C-N 3.35Å; N612-V614 PolarHBondContact O-N 3.35Å; N612-S615 PolarHBondContact O-N 2.93Å; N612-S615 VanDerWaalsContact O-N 3.16Å; N612-S615 PolarHBondContact O-OG 2.81Å; N612-A616 PolarHBondContact O-N 3.47Å; N612-I663 WeakPolarHBondContact OD1-CG1 3.27Å; N612-N667 PolarHBondContact OD1-ND2 2.96Å
613	I	91.6	Very high	86.6	Confident	68 Å²	68	40.5 Å²	40.5	35%	0.349	22%	0.224	S	C	.	.	H	α-helix	trans	-61.1	-43.8	-179.6	-63.8	164.4	0	0	0	111	W295 M298 L609 P610 L617	W295-I613 HydrophobicContact CH2-CG2 4.23Å; W295-I613 HydrophobicContact CZ3-CG1 4.23Å; M298-I613 HydrophobicContact SD-CG1 4.38Å; L609-I613 WeakPolarHBondContact O-CG1 3.3Å; L609-I613 PolarHBondContact O-N 3.3Å; L609-I613 VanDerWaalsContact O-N 3.14Å; P610-I613 PolarHBondContact O-N 2.86Å; I613-L617 HydrophobicContact CG2-CD1 3.87Å; I613-L617 WeakPolarHBondContact O-CB 3.42Å; I613-L617 VanDerWaalsContact O-CG 3.3Å; I613-L617 WeakPolarHBondContact O-CG 3.26Å; I613-L617 PolarHBondContact O-N 2.81Å; I613-L617 VanDerWaalsContact O-N 3.16Å
614	V	90.7	Very high	87.1	Confident	81 Å²	81	38 Å²	38	49%	0.491	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-41.6	175.9	169.1	0	0	0	0	111.3	P610 G611 N612 L618	P610-V614 WeakPolarHBondContact O-CB 3.35Å; P610-V614 VanDerWaalsContact O-CG2 3.3Å; P610-V614 WeakPolarHBondContact O-CG2 3.37Å; P610-V614 PolarHBondContact O-N 2.73Å; G611-V614 PolarHBondContact O-N 3.35Å; N612-V614 VanDerWaalsContact C-N 3.35Å; N612-V614 PolarHBondContact O-N 3.35Å; V614-L618 HydrophobicContact CG1-CD1 3.68Å; V614-L618 WeakPolarHBondContact O-CB 3.42Å; V614-L618 VanDerWaalsContact O-CG 3.27Å; V614-L618 WeakPolarHBondContact O-CG 3.37Å; V614-L618 PolarHBondContact O-N 2.88Å
615	S	89.3	Confident	87.6	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-64.2	-45.8	178.8	75.1	0	0	0	0	112.2	S294 G611 N612 L617 L618 M619 N667	S294-S615 PolarHBondContact OG-OG 3.04Å; G611-S615 WeakPolarHBondContact O-CB 3.43Å; G611-S615 PolarHBondContact O-N 3Å; G611-S615 PolarHBondContact O-OG 2.86Å; N612-S615 PolarHBondContact O-N 2.93Å; N612-S615 VanDerWaalsContact O-N 3.16Å; N612-S615 PolarHBondContact O-OG 2.81Å; S615-L617 PolarHBondContact O-N 3.29Å; S615-L618 PolarHBondContact O-N 2.94Å; S615-M619 WeakPolarHBondContact O-CB 3.46Å; S615-M619 PolarHBondContact O-N 3.33Å; S615-N667 PolarHBondContact OG-ND2 3.49Å
616	A	88.1	Confident	88	Confident	3 Å²	3	44.7 Å²	44.7	3%	0.025	23%	0.231	C	C	.	.	H	α-helix	trans	-62.6	-44.9	179.5	0	0	0	0	0	112.1	S294 W295 N612 L618	S294-A616 WeakPolarHBondContact OG-CA 3.42Å; S294-A616 PolarHBondContact OG-N 3.37Å; W295-A616 HydrophobicContact CD2-CB 3.84Å; W295-A616 HydrophobicContact CE3-CB 4.4Å; W295-A616 HydrophobicContact CG-CB 3.95Å; W295-A616 HydrophobicContact CZ2-CB 4.39Å; N612-A616 PolarHBondContact O-N 3.47Å; A616-L618 PolarHBondContact O-N 3.41Å
617	L	90.1	Very high	88.2	Confident	81 Å²	81	41.7 Å²	41.7	42%	0.424	22%	0.216	S	C	.	.	H	α-helix	trans	-71.1	-12.6	-179.6	-67.7	174	0	0	0	114.8	W295 I613 S615 K621	W295-L617 HydrophobicContact CZ2-CD2 4.06Å; W295-L617 HydrophobicContact CZ2-CG 4.31Å; I613-L617 HydrophobicContact CG2-CD1 3.87Å; I613-L617 WeakPolarHBondContact O-CB 3.42Å; I613-L617 VanDerWaalsContact O-CG 3.3Å; I613-L617 WeakPolarHBondContact O-CG 3.26Å; I613-L617 PolarHBondContact O-N 2.81Å; I613-L617 VanDerWaalsContact O-N 3.16Å; S615-L617 PolarHBondContact O-N 3.29Å; L617-K621 PolarHBondContact O-NZ 3.3Å
618	L	89	Confident	88.6	Confident	63 Å²	63	40.4 Å²	40.4	33%	0.33	21%	0.205	S	C	.	.	H	α-helix	trans	-113.4	-20	-179.1	-67.1	179.6	0	0	0	114	V614 S615 A616 D620 K621 I622	V614-L618 HydrophobicContact CG1-CD1 3.68Å; V614-L618 WeakPolarHBondContact O-CB 3.42Å; V614-L618 VanDerWaalsContact O-CG 3.27Å; V614-L618 WeakPolarHBondContact O-CG 3.37Å; V614-L618 PolarHBondContact O-N 2.88Å; S615-L618 PolarHBondContact O-N 2.94Å; A616-L618 PolarHBondContact O-N 3.41Å; L618-D620 VanDerWaalsContact C-N 3.33Å; L618-D620 PolarHBondContact O-N 2.89Å; L618-K621 HydrophobicContact CD2-CD 4.42Å; L618-K621 PolarHBondContact O-N 3.39Å; L618-I622 HydrophobicContact CB-CD1 3.96Å; L618-I622 HydrophobicContact CB-CG1 4.29Å; L618-I622 HydrophobicContact CD1-CD1 4.01Å; L618-I622 HydrophobicContact CD2-CD1 4.3Å; L618-I622 HydrophobicContact CG-CD1 4.33Å; L618-I622 PolarHBondContact O-N 2.88Å
619	M	85.8	Confident	88.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-47.9	-52.2	-175.5	-165.3	120.7	-165.3	0	0	112.9	S615 K621 G623 R624 M627 A668 V671	S615-M619 WeakPolarHBondContact O-CB 3.46Å; S615-M619 PolarHBondContact O-N 3.33Å; M619-K621 VanDerWaalsContact C-N 3.34Å; M619-K621 PolarHBondContact O-N 2.85Å; M619-G623 PolarHBondContact O-N 3.38Å; M619-G623 VanDerWaalsContact O-N 3.08Å; M619-R624 HydrophobicContact CE-CB 4.09Å; M619-R624 HydrophobicContact CE-CG 3.48Å; M619-R624 VanDerWaalsContact CE-CG 3.48Å; M619-R624 HydrophobicContact CG-CG 4.21Å; M619-M627 HydrophobicContact CB-CE 4.24Å; M619-M627 HydrophobicContact CE-CE 4.13Å; M619-M627 HydrophobicContact CG-CE 4.16Å; M619-M627 HydrophobicContact SD-CE 3.39Å; M619-M627 WeakPolarHBondContact SD-CE 3.25Å; M619-A668 HydrophobicContact CE-CB 4.5Å; M619-V671 HydrophobicContact CE-CB 3.44Å; M619-V671 VanDerWaalsContact CE-CB 3.44Å; M619-V671 HydrophobicContact CE-CG1 3.79Å; M619-V671 HydrophobicContact CE-CG2 3.62Å; M619-V671 HydrophobicContact SD-CG2 4.37Å
620	D	83.8	Confident	88.9	Confident	35 Å²	35	40.4 Å²	40.4	19%	0.187	21%	0.214	C	C	.	.	H	α-helix	trans	-88.7	0.2	-175.9	-67.9	-20.5	0	0	0	113.6	G290 E291 L618 R624 R737	G290-D620 WeakPolarHBondContact CA-OD1 3.35Å; E291-D620 WeakPolarHBondContact CB-OD2 3.36Å; E291-D620 PolarHBondContact N-OD2 3.26Å; L618-D620 VanDerWaalsContact C-N 3.33Å; L618-D620 PolarHBondContact O-N 2.89Å; D620-R624 IonicContact OD1-CZ 3.58Å; D620-R624 IonicContact OD1-NE 2.68Å; D620-R624 PolarHBondContact OD1-NE 2.84Å; D620-R624 IonicContact OD1-NH2 3.09Å; D620-R624 PolarHBondContact OD1-NH2 3.41Å; D620-R737 VanDerWaalsContact O-CZ 3.22Å; D620-R737 PolarHBondContact O-NH2 2.84Å
621	K	85.2	Confident	89	Confident	142 Å²	142	37 Å²	37	62%	0.617	19%	0.192	S	C	*	.	H	α-helix	trans	-95.6	-49.4	170.1	-67.5	173.9	-173.1	145.2	0	111.9	L617 L618 M619 R737	L617-K621 PolarHBondContact O-NZ 3.3Å; L618-K621 HydrophobicContact CD2-CD 4.42Å; L618-K621 PolarHBondContact O-N 3.39Å; M619-K621 VanDerWaalsContact C-N 3.34Å; M619-K621 PolarHBondContact O-N 2.85Å; K621-R737 PolarHBondContact O-NH1 2.73Å; K621-R737 PolarHBondContact O-NH2 2.77Å
622	I	85	Confident	89.2	Confident	68 Å²	68	36.9 Å²	36.9	35%	0.349	19%	0.19	S	C	.	.	H	α-helix	trans	-83.6	-35	-174.1	-63.6	-175.2	0	0	0	111.6	L618 R626	L618-I622 HydrophobicContact CB-CD1 3.96Å; L618-I622 HydrophobicContact CB-CG1 4.29Å; L618-I622 HydrophobicContact CD1-CD1 4.01Å; L618-I622 HydrophobicContact CD2-CD1 4.3Å; L618-I622 HydrophobicContact CG-CD1 4.33Å; L618-I622 PolarHBondContact O-N 2.88Å; I622-R626 HydrophobicContact CG2-CB 3.71Å; I622-R626 PolarHBondContact O-NE 2.95Å
623	G	84.8	Confident	89.3	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.211	C	C	.	.			trans	96.3	149.2	-167.9	0	0	0	0	0	111.6	M619 M627	M619-G623 PolarHBondContact O-N 3.38Å; M619-G623 VanDerWaalsContact O-N 3.08Å; G623-M627 WeakPolarHBondContact O-CB 3.28Å; G623-M627 PolarHBondContact O-N 2.59Å
624	R	87.6	Confident	89.4	Confident	5 Å²	5	42.6 Å²	42.6	2%	0.019	22%	0.221	C	C	.	.	H	α-helix	trans	-72.7	-41.9	-168	-60.8	88.9	-169.1	-122.9	2.9	110.2	M619 D620 R626 M627 L628 V671 E675 E735	M619-R624 HydrophobicContact CE-CB 4.09Å; M619-R624 HydrophobicContact CE-CG 3.48Å; M619-R624 VanDerWaalsContact CE-CG 3.48Å; M619-R624 HydrophobicContact CG-CG 4.21Å; D620-R624 IonicContact OD1-CZ 3.58Å; D620-R624 IonicContact OD1-NE 2.68Å; D620-R624 PolarHBondContact OD1-NE 2.84Å; D620-R624 IonicContact OD1-NH2 3.09Å; D620-R624 PolarHBondContact OD1-NH2 3.41Å; R624-R626 PolarHBondContact O-N 2.95Å; R624-M627 PolarHBondContact O-N 2.83Å; R624-L628 WeakPolarHBondContact O-CB 3.49Å; R624-L628 PolarHBondContact O-N 2.96Å; R624-V671 HydrophobicContact CG-CG1 4.49Å; R624-E675 IonicContact CZ-OE1 2.95Å; R624-E675 IonicContact CZ-OE2 3.92Å; R624-E675 IonicContact NH1-OE1 2.69Å; R624-E675 PolarHBondContact NH1-OE1 3.06Å; R624-E675 IonicContact NH1-OE2 2.64Å; R624-E675 PolarHBondContact NH1-OE2 3.34Å; R624-E735 PolarHBondContact N-OE1 2.91Å
625	L	88.6	Confident	89.5	Confident	21 Å²	21	38.8 Å²	38.8	11%	0.11	20%	0.198	C	C	.	.	H	α-helix	trans	-61.5	-44.8	177.6	-162.6	77.8	0	0	0	112.3	A629 L672 A730 L733 E735	L625-A629 PolarHBondContact O-N 2.79Å; L625-A629 VanDerWaalsContact O-N 3.07Å; L625-L672 HydrophobicContact CD1-CD2 4.41Å; L625-A730 WeakPolarHBondContact CD1-O 3.49Å; L625-L733 HydrophobicContact CD1-CB 3.74Å; L625-L733 WeakPolarHBondContact CD2-O 3.42Å; L625-E735 HydrophobicContact CB-CB 4.3Å; L625-E735 WeakPolarHBondContact CB-OE1 3.32Å; L625-E735 HydrophobicContact CD2-CB 4.22Å; L625-E735 PolarHBondContact N-OE1 3.06Å
626	R	90	Very high	89.6	Confident	141 Å²	141	40.1 Å²	40.1	53%	0.532	21%	0.207	S	C	.	.	H	α-helix	trans	-74.2	-33.2	-179	-84.6	171.7	-78.6	179.9	-6.8	112.9	I622 R624 G630 E735	I622-R626 HydrophobicContact CG2-CB 3.71Å; I622-R626 PolarHBondContact O-NE 2.95Å; R624-R626 PolarHBondContact O-N 2.95Å; R626-G630 PolarHBondContact O-N 3.02Å; R626-E735 IonicContact CZ-OE2 3.88Å; R626-E735 IonicContact NE-OE2 2.75Å; R626-E735 PolarHBondContact NE-OE2 3Å; R626-E735 IonicContact NH2-OE2 3.7Å; R626-E735 PolarHBondContact NH2-OE2 2.67Å
627	M	90.9	Very high	89.8	Confident	14 Å²	14	43.6 Å²	43.6	7%	0.069	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-54.7	170.5	-167.5	162	81.5	0	0	110.1	M619 G623 R624 A629 G630 S631 A668	M619-M627 HydrophobicContact CB-CE 4.24Å; M619-M627 HydrophobicContact CE-CE 4.13Å; M619-M627 HydrophobicContact CG-CE 4.16Å; M619-M627 HydrophobicContact SD-CE 3.39Å; M619-M627 WeakPolarHBondContact SD-CE 3.25Å; G623-M627 WeakPolarHBondContact O-CB 3.28Å; G623-M627 PolarHBondContact O-N 2.59Å; R624-M627 PolarHBondContact O-N 2.83Å; M627-A629 PolarHBondContact O-N 3.3Å; M627-G630 PolarHBondContact O-N 3.06Å; M627-G630 VanDerWaalsContact O-N 3.17Å; M627-S631 PolarHBondContact O-N 3.45Å; M627-S631 PolarHBondContact O-OG 3.11Å; M627-A668 HydrophobicContact CB-CB 4.26Å; M627-A668 HydrophobicContact CE-CB 3.82Å; M627-A668 HydrophobicContact CG-CB 4.38Å
628	L	92.3	Very high	89.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-50.8	-51.5	178.9	177.2	57.2	0	0	0	113.1	V453 M457 R624 S632 S665 A668 L669 L672 A730	V453-L628 HydrophobicContact CG1-CD1 4.5Å; V453-L628 HydrophobicContact CG1-CD2 4.38Å; M457-L628 HydrophobicContact SD-CD1 4.18Å; R624-L628 WeakPolarHBondContact O-CB 3.49Å; R624-L628 PolarHBondContact O-N 2.96Å; L628-S632 VanDerWaalsContact O-CB 3.25Å; L628-S632 WeakPolarHBondContact O-CB 3.38Å; L628-S632 PolarHBondContact O-N 3.42Å; L628-S632 PolarHBondContact O-OG 3.27Å; L628-S665 WeakPolarHBondContact CD1-O 3.24Å; L628-S665 PolarHBondContact O-OG 3.04Å; L628-A668 HydrophobicContact CB-CB 3.72Å; L628-A668 HydrophobicContact CD1-CB 4.47Å; L628-L669 HydrophobicContact CD1-CB 4.03Å; L628-L669 HydrophobicContact CD2-CD1 4.15Å; L628-L672 HydrophobicContact CD2-CD2 3.69Å; L628-A730 HydrophobicContact CD2-CB 3.9Å; L628-A730 HydrophobicContact CG-CB 4Å
629	A	92.2	Very high	89.8	Confident	6 Å²	6	36.9 Å²	36.9	5%	0.05	19%	0.193	C	C	.	.	H	α-helix	trans	-68.1	-46.1	178.5	0	0	0	0	0	112	L625 M627 S632 V633 S727 L731	L625-A629 PolarHBondContact O-N 2.79Å; L625-A629 VanDerWaalsContact O-N 3.07Å; M627-A629 PolarHBondContact O-N 3.3Å; A629-S632 PolarHBondContact O-N 3.44Å; A629-V633 WeakPolarHBondContact O-CG2 3.4Å; A629-V633 PolarHBondContact O-N 3.49Å; A629-S727 PolarHBondContact O-OG 3Å; A629-L731 HydrophobicContact CB-CD2 3.6Å; A629-L731 HydrophobicContact CB-CG 3.81Å
630	G	92.3	Very high	89.7	Confident	34 Å²	34	42.9 Å²	42.9	35%	0.351	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-51.3	-177.7	0	0	0	0	0	113.1	R626 M627 S632 V633 M634	R626-G630 PolarHBondContact O-N 3.02Å; M627-G630 PolarHBondContact O-N 3.06Å; M627-G630 VanDerWaalsContact O-N 3.17Å; G630-S632 VanDerWaalsContact C-N 3.31Å; G630-S632 PolarHBondContact O-N 2.85Å; G630-V633 PolarHBondContact O-N 2.96Å; G630-M634 WeakPolarHBondContact O-CG 3.43Å; G630-M634 PolarHBondContact O-N 2.88Å
631	S	92.9	Very high	89.9	Confident	6 Å²	6	46.2 Å²	46.2	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-28.7	177.3	49.5	0	0	0	0	112.6	M627 M634 S635 V661 S665	M627-S631 PolarHBondContact O-N 3.45Å; M627-S631 PolarHBondContact O-OG 3.11Å; S631-M634 PolarHBondContact O-N 3.42Å; S631-S635 VanDerWaalsContact O-CB 3.31Å; S631-S635 WeakPolarHBondContact O-CB 3.35Å; S631-S635 PolarHBondContact O-N 3.03Å; S631-S635 PolarHBondContact O-OG 3.06Å; S631-V661 WeakPolarHBondContact O-CG1 3.16Å; S631-S665 WeakPolarHBondContact CB-OG 3.35Å; S631-S665 WeakPolarHBondContact OG-CA 3.44Å; S631-S665 PolarHBondContact OG-N 3.03Å; S631-S665 PolarHBondContact OG-OG 2.79Å
632	S	91.9	Very high	89.8	Confident	4 Å²	4	39.5 Å²	39.5	3%	0.028	20%	0.204	C	C	.	.	H	α-helix	trans	-68.7	-38.5	174	-59.9	0	0	0	0	112.4	L628 A629 G630 S635 C636 S665	L628-S632 VanDerWaalsContact O-CB 3.25Å; L628-S632 WeakPolarHBondContact O-CB 3.38Å; L628-S632 PolarHBondContact O-N 3.42Å; L628-S632 PolarHBondContact O-OG 3.27Å; A629-S632 PolarHBondContact O-N 3.44Å; G630-S632 VanDerWaalsContact C-N 3.31Å; G630-S632 PolarHBondContact O-N 2.85Å; S632-S635 PolarHBondContact O-N 3.49Å; S632-C636 WeakPolarHBondContact O-CB 3.07Å; S632-C636 PolarHBondContact O-N 2.95Å; S632-S665 PolarHBondContact N-OG 3.23Å; S632-S665 PolarHBondContact OG-OG 3.13Å
633	V	93.4	Very high	89.6	Confident	76 Å²	76	39.2 Å²	39.2	46%	0.461	21%	0.208	S	C	.	.	H	α-helix	trans	-66.2	-45.5	172	173.6	0	0	0	0	111.2	A629 G630 S635 C636 V637 S727	A629-V633 WeakPolarHBondContact O-CG2 3.4Å; A629-V633 PolarHBondContact O-N 3.49Å; G630-V633 PolarHBondContact O-N 2.96Å; V633-S635 VanDerWaalsContact C-N 3.28Å; V633-S635 PolarHBondContact O-N 2.87Å; V633-C636 WeakPolarHBondContact O-CB 3.29Å; V633-C636 PolarHBondContact O-N 2.85Å; V633-V637 WeakPolarHBondContact O-CG2 3.28Å; V633-V637 PolarHBondContact O-N 3.35Å; V633-S727 WeakPolarHBondContact CG2-OG 3.46Å
634	M	93.3	Very high	89.5	Confident	113 Å²	113	45.7 Å²	45.7	56%	0.557	24%	0.236	S	C	*	.	H	α-helix	trans	-62.4	-36.1	175.9	-65.6	-165.7	-47.5	0	0	111.9	G630 S631 V637 S638 V661	G630-M634 WeakPolarHBondContact O-CG 3.43Å; G630-M634 PolarHBondContact O-N 2.88Å; S631-M634 PolarHBondContact O-N 3.42Å; M634-V637 PolarHBondContact O-N 3.27Å; M634-S638 PolarHBondContact O-N 2.73Å; M634-V661 HydrophobicContact CB-CG1 3.55Å; M634-V661 HydrophobicContact CE-CG1 3.99Å
635	S	93	Very high	89.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.007	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-47.9	173.3	-57.9	0	0	0	0	110.9	S631 S632 V633 V637 S638 C639 V661 S662	S631-S635 VanDerWaalsContact O-CB 3.31Å; S631-S635 WeakPolarHBondContact O-CB 3.35Å; S631-S635 PolarHBondContact O-N 3.03Å; S631-S635 PolarHBondContact O-OG 3.06Å; S632-S635 PolarHBondContact O-N 3.49Å; V633-S635 VanDerWaalsContact C-N 3.28Å; V633-S635 PolarHBondContact O-N 2.87Å; S635-V637 VanDerWaalsContact C-N 3.3Å; S635-V637 PolarHBondContact O-N 3.07Å; S635-S638 PolarHBondContact O-N 3.09Å; S635-S638 PolarHBondContact O-OG 3.06Å; S635-C639 PolarHBondContact O-N 2.93Å; S635-C639 PolarHBondContact O-SG 3.38Å; S635-V661 WeakPolarHBondContact OG-CG1 3.39Å; S635-S662 WeakPolarHBondContact OG-CA 3.45Å; S635-S662 PolarHBondContact OG-N 3.38Å; S635-S662 PolarHBondContact OG-OG 2.94Å
636	C	91.6	Very high	88.8	Confident	29 Å²	29	50.1 Å²	50.1	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-56.7	-41	174.9	-178.3	0	0	0	0	112.7	S632 V633 C639 F640 S720 L723	S632-C636 WeakPolarHBondContact O-CB 3.07Å; S632-C636 PolarHBondContact O-N 2.95Å; V633-C636 WeakPolarHBondContact O-CB 3.29Å; V633-C636 PolarHBondContact O-N 2.85Å; C636-C639 WeakPolarHBondContact O-CB 3.45Å; C636-C639 PolarHBondContact O-N 3.34Å; C636-F640 PolarHBondContact O-N 3.42Å; C636-F640 VanDerWaalsContact O-N 3.12Å; C636-S720 PolarHBondContact SG-O 2.86Å; C636-S720 VanDerWaalsContact SG-O 3.39Å; C636-L723 HydrophobicContact CB-CB 4.14Å
637	V	91.5	Very high	88.5	Confident	76 Å²	76	45.9 Å²	45.9	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-42.1	174.1	172.1	0	0	0	0	111.4	V633 M634 S635 C639 F640 F641	V633-V637 WeakPolarHBondContact O-CG2 3.28Å; V633-V637 PolarHBondContact O-N 3.35Å; M634-V637 PolarHBondContact O-N 3.27Å; S635-V637 VanDerWaalsContact C-N 3.3Å; S635-V637 PolarHBondContact O-N 3.07Å; V637-C639 VanDerWaalsContact C-N 3.33Å; V637-C639 PolarHBondContact O-N 3.21Å; V637-F640 WeakPolarHBondContact O-CB 3.49Å; V637-F640 PolarHBondContact O-N 2.85Å; V637-F641 HydrophobicContact CG1-CD2 4.15Å; V637-F641 HydrophobicContact CG1-CE2 3.72Å; V637-F641 VanDerWaalsContact O-CD2 3.26Å; V637-F641 WeakPolarHBondContact O-CD2 3.44Å; V637-F641 PolarHBondContact O-N 3.27Å
638	S	90.6	Very high	88	Confident	4 Å²	4	48.9 Å²	48.9	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-63.8	-36	175	75.4	0	0	0	0	112.7	M634 S635 F640 F641	M634-S638 PolarHBondContact O-N 2.73Å; S635-S638 PolarHBondContact O-N 3.09Å; S635-S638 PolarHBondContact O-OG 3.06Å; S638-F640 PolarHBondContact O-N 2.69Å; S638-F641 PolarHBondContact O-N 2.88Å
639	C	88.1	Confident	87.6	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-42	172.2	-63.1	0	0	0	0	111.7	S635 C636 V637 F641 L642 F658 I716	S635-C639 PolarHBondContact O-N 2.93Å; S635-C639 PolarHBondContact O-SG 3.38Å; C636-C639 WeakPolarHBondContact O-CB 3.45Å; C636-C639 PolarHBondContact O-N 3.34Å; V637-C639 VanDerWaalsContact C-N 3.33Å; V637-C639 PolarHBondContact O-N 3.21Å; C639-F641 VanDerWaalsContact C-N 3.28Å; C639-F641 PolarHBondContact O-N 2.97Å; C639-L642 WeakPolarHBondContact O-CB 3.45Å; C639-L642 WeakPolarHBondContact O-CG 3.34Å; C639-L642 PolarHBondContact O-N 2.93Å; C639-F658 VanDerWaalsContact SG-CD2 3.54Å; C639-F658 WeakPolarHBondContact SG-CE2 3.12Å; C639-I716 VanDerWaalsContact O-CG2 3.24Å; C639-I716 WeakPolarHBondContact O-CG2 3.49Å
640	F	85.7	Confident	87.3	Confident	125 Å²	125	54.1 Å²	54.1	55%	0.548	30%	0.304	S	S	.	.	H	α-helix	trans	-59.6	-38.8	178.1	-178.8	-100.1	0	0	0	112.2	C636 V637 S638 L642 S643 F644	C636-F640 PolarHBondContact O-N 3.42Å; C636-F640 VanDerWaalsContact O-N 3.12Å; V637-F640 WeakPolarHBondContact O-CB 3.49Å; V637-F640 PolarHBondContact O-N 2.85Å; S638-F640 PolarHBondContact O-N 2.69Å; F640-L642 PolarHBondContact O-N 3.33Å; F640-S643 WeakPolarHBondContact O-CB 3.23Å; F640-S643 PolarHBondContact O-N 2.99Å; F640-S643 VanDerWaalsContact O-N 3.16Å; F640-F644 HydrophobicContact CD1-CE2 4.45Å; F640-F644 AromaticContact CE1-CE2 3.98Å; F640-F644 HydrophobicContact CE1-CE2 3.98Å; F640-F644 HydrophobicContact CE1-CZ 4.47Å
641	F	86.7	Confident	87	Confident	106 Å²	106	52.5 Å²	52.5	47%	0.465	29%	0.287	S	S	.	.	H	α-helix	trans	-64.6	-20.1	176.6	-75.1	-65.5	0	0	0	114.1	V637 S638 C639 S643 F644 L654	V637-F641 HydrophobicContact CG1-CD2 4.15Å; V637-F641 HydrophobicContact CG1-CE2 3.72Å; V637-F641 VanDerWaalsContact O-CD2 3.26Å; V637-F641 WeakPolarHBondContact O-CD2 3.44Å; V637-F641 PolarHBondContact O-N 3.27Å; S638-F641 PolarHBondContact O-N 2.88Å; C639-F641 VanDerWaalsContact C-N 3.28Å; C639-F641 PolarHBondContact O-N 2.97Å; F641-S643 PolarHBondContact O-N 3.01Å; F641-F644 HydrophobicContact CD1-CD2 4.34Å; F641-F644 PolarHBondContact O-N 3.34Å; F641-F644 VanDerWaalsContact O-N 3.12Å; F641-L654 HydrophobicContact CB-CD2 3.95Å
642	L	82.5	Confident	86.6	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-60.5	-24.2	173.1	-61.3	172.2	0	0	0	113.4	L464 F468 C639 F640 F644 G645 L654 I716	L464-L642 HydrophobicContact CD1-CD1 4.38Å; F468-L642 HydrophobicContact CE1-CD1 4.2Å; F468-L642 HydrophobicContact CE1-CD2 3.4Å; F468-L642 HydrophobicContact CE1-CG 4.45Å; F468-L642 HydrophobicContact CE2-CD1 4.37Å; F468-L642 HydrophobicContact CZ-CD1 3.62Å; F468-L642 HydrophobicContact CZ-CD2 3.47Å; F468-L642 VanDerWaalsContact CZ-CD2 3.47Å; F468-L642 HydrophobicContact CZ-CG 4.19Å; C639-L642 WeakPolarHBondContact O-CB 3.45Å; C639-L642 WeakPolarHBondContact O-CG 3.34Å; C639-L642 PolarHBondContact O-N 2.93Å; F640-L642 PolarHBondContact O-N 3.33Å; L642-F644 PolarHBondContact O-N 3.16Å; L642-G645 PolarHBondContact O-N 3.21Å; L642-L654 HydrophobicContact CD2-CB 3.43Å; L642-L654 VanDerWaalsContact CD2-CB 3.43Å; L642-L654 HydrophobicContact CD2-CD1 4.03Å; L642-L654 HydrophobicContact CD2-CG 4.33Å; L642-I716 HydrophobicContact CB-CD1 3.58Å; L642-I716 HydrophobicContact CB-CG1 3.97Å; L642-I716 HydrophobicContact CD1-CG1 4.37Å
643	S	82	Confident	86.4	Confident	62 Å²	62	56.4 Å²	56.4	43%	0.434	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-61.1	-25.3	177	-160.1	0	0	0	0	112.5	F640 F641	F640-S643 WeakPolarHBondContact O-CB 3.23Å; F640-S643 PolarHBondContact O-N 2.99Å; F640-S643 VanDerWaalsContact O-N 3.16Å; F641-S643 PolarHBondContact O-N 3.01Å
644	F	83.3	Confident	86.1	Confident	135 Å²	135	54.1 Å²	54.1	59%	0.592	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-94.6	-3.3	177.1	-52.9	-79	0	0	0	113.2	F640 F641 L642 N646	F640-F644 HydrophobicContact CD1-CE2 4.45Å; F640-F644 AromaticContact CE1-CE2 3.98Å; F640-F644 HydrophobicContact CE1-CE2 3.98Å; F640-F644 HydrophobicContact CE1-CZ 4.47Å; F641-F644 HydrophobicContact CD1-CD2 4.34Å; F641-F644 PolarHBondContact O-N 3.34Å; F641-F644 VanDerWaalsContact O-N 3.12Å; L642-F644 PolarHBondContact O-N 3.16Å; F644-N646 PolarHBondContact O-N 3.19Å
645	G	79.8	Confident	85.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.279	C	S	.	.			trans	-71.4	91.9	-178.8	0	0	0	0	0	112.6	L642 K712	L642-G645 PolarHBondContact O-N 3.21Å; G645-K712 PolarHBondContact O-NZ 2.99Å
646	N	80.3	Confident	85.6	Confident	119 Å²	119	51.2 Å²	51.2	64%	0.636	29%	0.289	S	S	*	.			trans	-110.8	-12.2	-179	-74.2	-36.7	0	0	0	115.3	F644 K712	F644-N646 PolarHBondContact O-N 3.19Å; N646-K712 PolarHBondContact OD1-NZ 3.3Å
647	S	84.1	Confident	85.5	Confident	52 Å²	52	53.9 Å²	53.9	36%	0.364	30%	0.301	S	S	.	.	S	Bend	trans	-105.9	153.3	167.1	69.5	0	0	0	0	111.4	S649 A650 M651	S647-S649 VanDerWaalsContact C-N 3.28Å; S647-S649 PolarHBondContact O-N 2.89Å; S647-S649 PolarHBondContact OG-OG 2.67Å; S647-A650 PolarHBondContact O-N 2.97Å; S647-A650 VanDerWaalsContact O-N 3.16Å; S647-A650 VanDerWaalsContact OG-CB 3.32Å; S647-A650 WeakPolarHBondContact OG-CB 3.41Å; S647-A650 PolarHBondContact OG-N 3.36Å; S647-A650 VanDerWaalsContact OG-N 3.09Å; S647-M651 WeakPolarHBondContact O-CG 3.48Å; S647-M651 PolarHBondContact O-N 3.49Å
648	E	81	Confident	85.5	Confident	78 Å²	78	50.2 Å²	50.2	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-51.6	-46.7	169.6	171.8	173.5	-162.3	0	0	111.9	I472 Q476 A650 M651 I652	I472-E648 HydrophobicContact CG2-CG 4.07Å; Q476-E648 PolarHBondContact NE2-OE1 2.94Å; E648-A650 VanDerWaalsContact C-N 3.33Å; E648-A650 PolarHBondContact O-N 3.37Å; E648-M651 PolarHBondContact O-N 3.07Å; E648-I652 HydrophobicContact CG-CD1 3.8Å; E648-I652 WeakPolarHBondContact O-CG1 3.5Å; E648-I652 PolarHBondContact O-N 3.39Å
649	S	83.6	Confident	85.4	Confident	85 Å²	85	50.3 Å²	50.3	59%	0.594	28%	0.28	S	S	*	.	H	α-helix	trans	-60.4	-37.5	177.9	52.9	0	0	0	0	113.6	S647 A653	S647-S649 VanDerWaalsContact C-N 3.28Å; S647-S649 PolarHBondContact O-N 2.89Å; S647-S649 PolarHBondContact OG-OG 2.67Å; S649-A653 WeakPolarHBondContact O-CB 3.41Å; S649-A653 PolarHBondContact O-N 2.96Å
650	A	85.9	Confident	85.5	Confident	30 Å²	30	51.1 Å²	51.1	25%	0.248	29%	0.289	C	S	.	.	H	α-helix	trans	-71.4	-40.1	175.7	0	0	0	0	0	111.6	S647 E648 A653 L654	S647-A650 PolarHBondContact O-N 2.97Å; S647-A650 VanDerWaalsContact O-N 3.16Å; S647-A650 VanDerWaalsContact OG-CB 3.32Å; S647-A650 WeakPolarHBondContact OG-CB 3.41Å; S647-A650 PolarHBondContact OG-N 3.36Å; S647-A650 VanDerWaalsContact OG-N 3.09Å; E648-A650 VanDerWaalsContact C-N 3.33Å; E648-A650 PolarHBondContact O-N 3.37Å; A650-A653 PolarHBondContact O-N 3.25Å; A650-L654 WeakPolarHBondContact O-CB 3.44Å; A650-L654 VanDerWaalsContact O-CG 3.26Å; A650-L654 WeakPolarHBondContact O-CG 3.49Å; A650-L654 PolarHBondContact O-N 3.36Å
651	M	84.6	Confident	85.8	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-42.9	175.7	-69.1	-61.3	-64.1	0	0	111.8	W467 F468 M471 I472 L475 S647 E648 L654 L655	W467-M651 HydrophobicContact CH2-CE 4.14Å; W467-M651 HydrophobicContact CZ3-CE 3.92Å; F468-M651 HydrophobicContact CD1-CE 3.91Å; F468-M651 HydrophobicContact CE1-CE 4.05Å; M471-M651 HydrophobicContact CG-CE 3.97Å; I472-M651 HydrophobicContact CD1-CB 4.34Å; I472-M651 HydrophobicContact CG1-CB 4.01Å; L475-M651 HydrophobicContact CD1-CG 4.07Å; S647-M651 WeakPolarHBondContact O-CG 3.48Å; S647-M651 PolarHBondContact O-N 3.49Å; E648-M651 PolarHBondContact O-N 3.07Å; M651-L654 PolarHBondContact O-N 3.03Å; M651-L655 WeakPolarHBondContact O-CB 3.22Å; M651-L655 PolarHBondContact O-N 2.94Å
652	I	85.1	Confident	86.1	Confident	31 Å²	31	41.5 Å²	41.5	16%	0.159	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-45.9	176	-65.1	164.1	0	0	0	110.9	I472 V600 E648 L654 L655 C656	I472-I652 HydrophobicContact CD1-CG1 3.72Å; V600-I652 HydrophobicContact CG1-CD1 4.44Å; V600-I652 HydrophobicContact CG1-CG1 4.2Å; V600-I652 HydrophobicContact CG2-CD1 3.86Å; E648-I652 HydrophobicContact CG-CD1 3.8Å; E648-I652 WeakPolarHBondContact O-CG1 3.5Å; E648-I652 PolarHBondContact O-N 3.39Å; I652-L654 VanDerWaalsContact C-N 3.32Å; I652-L654 PolarHBondContact O-N 2.94Å; I652-L655 WeakPolarHBondContact O-CB 3.4Å; I652-L655 PolarHBondContact O-N 3.29Å; I652-C656 PolarHBondContact O-N 3.33Å; I652-C656 PolarHBondContact O-SG 2.85Å
653	A	87.9	Confident	86.5	Confident	60 Å²	60	41.8 Å²	41.8	50%	0.496	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-39.3	178.7	0	0	0	0	0	112.5	S649 A650 C656 L657	S649-A653 WeakPolarHBondContact O-CB 3.41Å; S649-A653 PolarHBondContact O-N 2.96Å; A650-A653 PolarHBondContact O-N 3.25Å; A653-C656 PolarHBondContact O-N 3.07Å; A653-L657 PolarHBondContact O-N 3.08Å
654	L	87.8	Confident	87	Confident	29 Å²	29	39.4 Å²	39.4	15%	0.152	24%	0.235	C	C	.	.	H	α-helix	trans	-76.6	-31	178.3	-66.6	167.5	0	0	0	112.9	F641 L642 A650 M651 I652 L657 F658	F641-L654 HydrophobicContact CB-CD2 3.95Å; L642-L654 HydrophobicContact CD2-CB 3.43Å; L642-L654 VanDerWaalsContact CD2-CB 3.43Å; L642-L654 HydrophobicContact CD2-CD1 4.03Å; L642-L654 HydrophobicContact CD2-CG 4.33Å; A650-L654 WeakPolarHBondContact O-CB 3.44Å; A650-L654 VanDerWaalsContact O-CG 3.26Å; A650-L654 WeakPolarHBondContact O-CG 3.49Å; A650-L654 PolarHBondContact O-N 3.36Å; M651-L654 PolarHBondContact O-N 3.03Å; I652-L654 VanDerWaalsContact C-N 3.32Å; I652-L654 PolarHBondContact O-N 2.94Å; L654-L657 HydrophobicContact CD2-CD2 4.31Å; L654-L657 PolarHBondContact O-N 2.84Å; L654-F658 VanDerWaalsContact O-CB 3.29Å; L654-F658 WeakPolarHBondContact O-CB 3.42Å; L654-F658 PolarHBondContact O-N 2.93Å
655	L	86	Confident	87.5	Confident	21 Å²	21	33 Å²	33	11%	0.11	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-50.1	166.5	165	62.7	0	0	0	110.8	F468 M651 I652 L657 F658 G659	F468-L655 HydrophobicContact CB-CD1 4.12Å; F468-L655 HydrophobicContact CB-CD2 4.21Å; F468-L655 HydrophobicContact CD1-CB 3.75Å; F468-L655 HydrophobicContact CD1-CD1 4.45Å; F468-L655 HydrophobicContact CD2-CB 4.24Å; F468-L655 HydrophobicContact CD2-CD1 3.49Å; F468-L655 VanDerWaalsContact CD2-CD1 3.49Å; F468-L655 HydrophobicContact CD2-CG 4.37Å; F468-L655 HydrophobicContact CE1-CB 3.71Å; F468-L655 HydrophobicContact CE2-CB 4.25Å; F468-L655 HydrophobicContact CE2-CD1 3.86Å; F468-L655 HydrophobicContact CG-CB 4.01Å; F468-L655 HydrophobicContact CG-CD1 3.83Å; F468-L655 HydrophobicContact CG-CD2 4.46Å; F468-L655 HydrophobicContact CG-CG 4.3Å; F468-L655 HydrophobicContact CZ-CB 3.97Å; F468-L655 HydrophobicContact CZ-CD1 4.45Å; M651-L655 WeakPolarHBondContact O-CB 3.22Å; M651-L655 PolarHBondContact O-N 2.94Å; I652-L655 WeakPolarHBondContact O-CB 3.4Å; I652-L655 PolarHBondContact O-N 3.29Å; L655-L657 VanDerWaalsContact C-N 3.32Å; L655-L657 PolarHBondContact O-N 2.8Å; L655-F658 PolarHBondContact O-N 3.28Å; L655-G659 PolarHBondContact O-N 2.96Å
656	C	88.6	Confident	88.1	Confident	31 Å²	31	33.7 Å²	33.7	21%	0.209	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-41.9	178.8	-70.3	0	0	0	0	112	A607 I652 A653 G660	A607-C656 HydrophobicContact CB-CB 3.51Å; I652-C656 PolarHBondContact O-N 3.33Å; I652-C656 PolarHBondContact O-SG 2.85Å; A653-C656 PolarHBondContact O-N 3.07Å; C656-G660 PolarHBondContact O-N 2.9Å
657	L	90.8	Very high	88.7	Confident	85 Å²	85	28.2 Å²	28.2	45%	0.445	18%	0.18	S	C	.	.	H	α-helix	trans	-63.9	-48.5	174.5	-179.3	63.6	0	0	0	111.9	A653 L654 L655 V661	A653-L657 PolarHBondContact O-N 3.08Å; L654-L657 HydrophobicContact CD2-CD2 4.31Å; L654-L657 PolarHBondContact O-N 2.84Å; L655-L657 VanDerWaalsContact C-N 3.32Å; L655-L657 PolarHBondContact O-N 2.8Å; L657-V661 HydrophobicContact CD1-CG2 4.18Å; L657-V661 WeakPolarHBondContact O-CB 3.32Å; L657-V661 VanDerWaalsContact O-CG2 3.28Å; L657-V661 WeakPolarHBondContact O-CG2 3.46Å; L657-V661 PolarHBondContact O-N 2.84Å
658	F	91.3	Very high	89.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.6	-47.8	179.6	171	-105.5	0	0	0	112	Y461 L464 F468 C639 L654 L655 V661 S662 L723	Y461-F658 HydrophobicContact CD2-CE1 4.01Å; Y461-F658 HydrophobicContact CD2-CZ 4.24Å; L464-F658 HydrophobicContact CB-CE1 3.98Å; L464-F658 HydrophobicContact CB-CZ 4.33Å; L464-F658 HydrophobicContact CD1-CD2 4.44Å; L464-F658 HydrophobicContact CD1-CE1 4.04Å; L464-F658 HydrophobicContact CD1-CE2 3.95Å; L464-F658 HydrophobicContact CD1-CZ 3.73Å; F468-F658 AromaticContact CE2-CD1 3.91Å; F468-F658 HydrophobicContact CE2-CD1 3.91Å; F468-F658 HydrophobicContact CE2-CG 4.43Å; C639-F658 VanDerWaalsContact SG-CD2 3.54Å; C639-F658 WeakPolarHBondContact SG-CE2 3.12Å; L654-F658 VanDerWaalsContact O-CB 3.29Å; L654-F658 WeakPolarHBondContact O-CB 3.42Å; L654-F658 PolarHBondContact O-N 2.93Å; L655-F658 PolarHBondContact O-N 3.28Å; F658-V661 PolarHBondContact O-N 3.09Å; F658-S662 VanDerWaalsContact CE2-OG 3.26Å; F658-S662 WeakPolarHBondContact CE2-OG 3.47Å; F658-S662 WeakPolarHBondContact CZ-OG 3.49Å; F658-S662 WeakPolarHBondContact O-CB 3.36Å; F658-S662 PolarHBondContact O-N 2.74Å; F658-S662 PolarHBondContact O-OG 2.68Å; F658-L723 HydrophobicContact CE2-CD1 4.05Å
659	G	88.8	Confident	89.7	Confident	6 Å²	6	22 Å²	22	6%	0.062	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-47.9	179.4	0	0	0	0	0	112.7	L655 V661 S662 I663	L655-G659 PolarHBondContact O-N 2.96Å; G659-V661 VanDerWaalsContact C-N 3.26Å; G659-V661 PolarHBondContact O-N 3.14Å; G659-S662 PolarHBondContact O-N 3.01Å; G659-I663 PolarHBondContact O-N 3.04Å; G659-I663 VanDerWaalsContact O-N 3.13Å
660	G	90.1	Very high	90.1	Very high	17 Å²	17	18.9 Å²	18.9	18%	0.175	12%	0.122	C	C	.	.	H	α-helix	trans	-64	-26.7	179	0	0	0	0	0	114.2	G611 C656	G611-G660 VanDerWaalsContact CA-O 3.24Å; G611-G660 WeakPolarHBondContact CA-O 3.42Å; C656-G660 PolarHBondContact O-N 2.9Å
661	V	92.2	Very high	90.4	Very high	25 Å²	25	17.4 Å²	17.4	15%	0.152	11%	0.11	C	C	.	.	H	α-helix	trans	-85.5	-43.5	172.9	175.6	0	0	0	0	111.8	S631 M634 S635 L657 F658 G659 I663 A664	S631-V661 WeakPolarHBondContact O-CG1 3.16Å; M634-V661 HydrophobicContact CB-CG1 3.55Å; M634-V661 HydrophobicContact CE-CG1 3.99Å; S635-V661 WeakPolarHBondContact OG-CG1 3.39Å; L657-V661 HydrophobicContact CD1-CG2 4.18Å; L657-V661 WeakPolarHBondContact O-CB 3.32Å; L657-V661 VanDerWaalsContact O-CG2 3.28Å; L657-V661 WeakPolarHBondContact O-CG2 3.46Å; L657-V661 PolarHBondContact O-N 2.84Å; F658-V661 PolarHBondContact O-N 3.09Å; G659-V661 VanDerWaalsContact C-N 3.26Å; G659-V661 PolarHBondContact O-N 3.14Å; V661-I663 VanDerWaalsContact C-N 3.29Å; V661-I663 PolarHBondContact O-N 3.4Å; V661-A664 PolarHBondContact O-N 3.32Å
662	S	92	Very high	90.7	Very high	4 Å²	4	17.4 Å²	17.4	3%	0.028	11%	0.11	C	C	.	.	H	α-helix	trans	-64	-30.6	-176.5	-62.2	0	0	0	0	113.3	S635 F658 G659 A664 S665 W666	S635-S662 WeakPolarHBondContact OG-CA 3.45Å; S635-S662 PolarHBondContact OG-N 3.38Å; S635-S662 PolarHBondContact OG-OG 2.94Å; F658-S662 VanDerWaalsContact CE2-OG 3.26Å; F658-S662 WeakPolarHBondContact CE2-OG 3.47Å; F658-S662 WeakPolarHBondContact CZ-OG 3.49Å; F658-S662 WeakPolarHBondContact O-CB 3.36Å; F658-S662 PolarHBondContact O-N 2.74Å; F658-S662 PolarHBondContact O-OG 2.68Å; G659-S662 PolarHBondContact O-N 3.01Å; S662-A664 VanDerWaalsContact C-N 3.27Å; S662-A664 PolarHBondContact O-N 3.39Å; S662-S665 WeakPolarHBondContact O-CA 3.24Å; S662-S665 VanDerWaalsContact O-CB 3.29Å; S662-S665 WeakPolarHBondContact O-CB 3.42Å; S662-S665 PolarHBondContact O-N 2.85Å; S662-W666 PolarHBondContact O-N 3.16Å; S662-W666 VanDerWaalsContact O-N 3.17Å
663	I	92	Very high	91	Very high	7 Å²	7	15.9 Å²	15.9	4%	0.036	10%	0.102	C	C	.	.	H	α-helix	trans	-66.7	-28.1	-179.2	-153.6	72.1	0	0	0	113.2	V608 N612 G659 V661 S665 W666 N667	V608-I663 HydrophobicContact CG1-CB 3.57Å; V608-I663 HydrophobicContact CG1-CD1 3.83Å; V608-I663 HydrophobicContact CG1-CG1 3.5Å; V608-I663 HydrophobicContact CG1-CG2 3.71Å; N612-I663 WeakPolarHBondContact OD1-CG1 3.27Å; G659-I663 PolarHBondContact O-N 3.04Å; G659-I663 VanDerWaalsContact O-N 3.13Å; V661-I663 VanDerWaalsContact C-N 3.29Å; V661-I663 PolarHBondContact O-N 3.4Å; I663-S665 PolarHBondContact O-N 3.01Å; I663-W666 HydrophobicContact CD1-CB 4.13Å; I663-W666 HydrophobicContact CD1-CG 4.35Å; I663-W666 PolarHBondContact O-N 2.9Å; I663-W666 VanDerWaalsContact O-N 3.12Å; I663-N667 PolarHBondContact O-N 3.03Å; I663-N667 PolarHBondContact O-OD1 3.22Å
664	A	92.1	Very high	91.1	Very high	12 Å²	12	13 Å²	13	10%	0.099	8%	0.078	C	C	.	.	H	α-helix	trans	-65.2	-28.8	172	0	0	0	0	0	111.8	V661 S662 A668	V661-A664 PolarHBondContact O-N 3.32Å; S662-A664 VanDerWaalsContact C-N 3.27Å; S662-A664 PolarHBondContact O-N 3.39Å; A664-A668 VanDerWaalsContact O-CB 3.26Å; A664-A668 WeakPolarHBondContact O-CB 3.29Å; A664-A668 PolarHBondContact O-N 3.43Å
665	S	93.1	Very high	91.2	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.007	8%	0.075	C	C	.	.	H	α-helix	trans	-72.5	-40.7	169.7	-59.7	0	0	0	0	111.9	M457 L628 S631 S632 S662 I663 A668 L669	M457-S665 VanDerWaalsContact CE-C 3.48Å; M457-S665 WeakPolarHBondContact SD-CB 3.43Å; L628-S665 WeakPolarHBondContact CD1-O 3.24Å; L628-S665 PolarHBondContact O-OG 3.04Å; S631-S665 WeakPolarHBondContact CB-OG 3.35Å; S631-S665 WeakPolarHBondContact OG-CA 3.44Å; S631-S665 PolarHBondContact OG-N 3.03Å; S631-S665 PolarHBondContact OG-OG 2.79Å; S632-S665 PolarHBondContact N-OG 3.23Å; S632-S665 PolarHBondContact OG-OG 3.13Å; S662-S665 WeakPolarHBondContact O-CA 3.24Å; S662-S665 VanDerWaalsContact O-CB 3.29Å; S662-S665 WeakPolarHBondContact O-CB 3.42Å; S662-S665 PolarHBondContact O-N 2.85Å; I663-S665 PolarHBondContact O-N 3.01Å; S665-A668 PolarHBondContact O-N 2.87Å; S665-L669 WeakPolarHBondContact O-CB 3.41Å; S665-L669 PolarHBondContact O-N 3.13Å
666	W	93	Very high	91.3	Very high	13 Å²	13	12.3 Å²	12.3	5%	0.049	7%	0.074	C	C	.	.	H	α-helix	trans	-58.9	-54.8	177.7	-77.7	112.2	0	0	0	111.8	W454 M457 Y461 Y462 S662 I663 A668 L669 D670	W454-W666 AromaticContact CE3-CZ3 3.88Å; W454-W666 HydrophobicContact CE3-CZ3 3.88Å; W454-W666 HydrophobicContact CZ3-CE3 4.33Å; W454-W666 AromaticContact CZ3-CZ3 3.64Å; W454-W666 HydrophobicContact CZ3-CZ3 3.64Å; M457-W666 VanDerWaalsContact CE-CA 3.49Å; M457-W666 HydrophobicContact CE-CB 4.16Å; M457-W666 HydrophobicContact CE-CD2 3.31Å; M457-W666 HydrophobicContact CE-CE3 3.47Å; M457-W666 VanDerWaalsContact CE-CE3 3.47Å; M457-W666 HydrophobicContact CE-CG 3.64Å; M457-W666 HydrophobicContact CE-CH2 4.27Å; M457-W666 HydrophobicContact CE-CZ2 4.17Å; M457-W666 HydrophobicContact CE-CZ3 3.94Å; M457-W666 HydrophobicContact CG-CZ2 4.35Å; Y461-W666 AromaticContact CD1-CE2 3.79Å; Y461-W666 AromaticContact CD1-CZ2 3.87Å; Y461-W666 HydrophobicContact CD1-CZ2 3.87Å; Y461-W666 AromaticContact CD1-NE1 3.26Å; Y461-W666 VanDerWaalsContact CD1-NE1 3.26Å; Y461-W666 AromaticContact CD2-NE1 3.44Å; Y461-W666 AromaticContact CE1-NE1 3.6Å; Y461-W666 AromaticContact CE2-NE1 3.77Å; Y461-W666 AromaticContact CG-CE2 3.91Å; Y461-W666 HydrophobicContact CG-CZ2 4.04Å; Y461-W666 AromaticContact CG-NE1 3.17Å; Y461-W666 AromaticContact CZ-NE1 3.84Å; Y462-W666 HydrophobicContact CD2-CZ2 4.27Å; Y462-W666 AromaticContact CE2-CH2 3.93Å; Y462-W666 HydrophobicContact CE2-CH2 3.93Å; Y462-W666 AromaticContact CE2-CZ2 3.82Å; Y462-W666 HydrophobicContact CE2-CZ2 3.82Å; S662-W666 PolarHBondContact O-N 3.16Å; S662-W666 VanDerWaalsContact O-N 3.17Å; I663-W666 HydrophobicContact CD1-CB 4.13Å; I663-W666 HydrophobicContact CD1-CG 4.35Å; I663-W666 PolarHBondContact O-N 2.9Å; I663-W666 VanDerWaalsContact O-N 3.12Å; W666-A668 PolarHBondContact O-N 3.09Å; W666-L669 HydrophobicContact CE3-CD2 4.43Å; W666-L669 HydrophobicContact CZ3-CD2 4.26Å; W666-L669 WeakPolarHBondContact O-CA 3.5Å; W666-L669 WeakPolarHBondContact O-CB 3.34Å; W666-L669 PolarHBondContact O-N 2.93Å; W666-D670 PolarHBondContact O-N 2.91Å
667	N	92.6	Very high	91.3	Very high	4 Å²	4	11.1 Å²	11.1	2%	0.021	7%	0.065	C	C	.	.	H	α-helix	trans	-61.4	-34.2	179.7	-55.3	-4.9	0	0	0	111.7	C297 N612 S615 I663 V671	C297-N667 HydrophobicContact CB-CB 4.32Å; C297-N667 VanDerWaalsContact CB-CG 3.45Å; C297-N667 WeakPolarHBondContact CB-OD1 3.46Å; C297-N667 VanDerWaalsContact SG-CG 3.5Å; C297-N667 PolarHBondContact SG-OD1 3.08Å; N612-N667 PolarHBondContact OD1-ND2 2.96Å; S615-N667 PolarHBondContact OG-ND2 3.49Å; I663-N667 PolarHBondContact O-N 3.03Å; I663-N667 PolarHBondContact O-OD1 3.22Å; N667-V671 WeakPolarHBondContact O-CG2 3.37Å; N667-V671 PolarHBondContact O-N 2.81Å
668	A	92.2	Very high	90.9	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-66.8	-39.1	173.6	0	0	0	0	0	112.8	M619 M627 L628 A664 S665 W666 L672	M619-A668 HydrophobicContact CE-CB 4.5Å; M627-A668 HydrophobicContact CB-CB 4.26Å; M627-A668 HydrophobicContact CE-CB 3.82Å; M627-A668 HydrophobicContact CG-CB 4.38Å; L628-A668 HydrophobicContact CB-CB 3.72Å; L628-A668 HydrophobicContact CD1-CB 4.47Å; A664-A668 VanDerWaalsContact O-CB 3.26Å; A664-A668 WeakPolarHBondContact O-CB 3.29Å; A664-A668 PolarHBondContact O-N 3.43Å; S665-A668 PolarHBondContact O-N 2.87Å; W666-A668 PolarHBondContact O-N 3.09Å; A668-L672 WeakPolarHBondContact O-CB 3.36Å; A668-L672 PolarHBondContact O-N 3.17Å
669	L	93.9	Very high	90.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-71.9	-41.2	-180	-174.6	60.8	0	0	0	112.4	M450 V453 W454 M457 L628 S665 W666 L672 T673	M450-L669 HydrophobicContact CE-CD1 3.86Å; V453-L669 HydrophobicContact CB-CD1 4.39Å; V453-L669 HydrophobicContact CG1-CD1 3.7Å; V453-L669 HydrophobicContact CG1-CD2 4.27Å; W454-L669 HydrophobicContact CD2-CD2 3.62Å; W454-L669 HydrophobicContact CD2-CG 4.04Å; W454-L669 HydrophobicContact CE3-CD2 3.92Å; W454-L669 HydrophobicContact CG-CD1 4.47Å; W454-L669 HydrophobicContact CG-CD2 3.9Å; W454-L669 HydrophobicContact CG-CG 4.36Å; W454-L669 HydrophobicContact CZ2-CD2 4.33Å; W454-L669 HydrophobicContact CZ2-CG 4.02Å; W454-L669 HydrophobicContact CZ3-CD2 4.43Å; M457-L669 HydrophobicContact CE-CB 4.1Å; M457-L669 HydrophobicContact CE-CD2 3.63Å; M457-L669 HydrophobicContact SD-CD2 4.33Å; L628-L669 HydrophobicContact CD1-CB 4.03Å; L628-L669 HydrophobicContact CD2-CD1 4.15Å; S665-L669 WeakPolarHBondContact O-CB 3.41Å; S665-L669 PolarHBondContact O-N 3.13Å; W666-L669 HydrophobicContact CE3-CD2 4.43Å; W666-L669 HydrophobicContact CZ3-CD2 4.26Å; W666-L669 WeakPolarHBondContact O-CA 3.5Å; W666-L669 WeakPolarHBondContact O-CB 3.34Å; W666-L669 PolarHBondContact O-N 2.93Å; L669-L672 PolarHBondContact O-N 3.35Å; L669-T673 WeakPolarHBondContact O-CB 3.44Å; L669-T673 PolarHBondContact O-N 2.86Å; L669-T673 PolarHBondContact O-OG1 2.93Å
670	D	92.6	Very high	89.9	Confident	19 Å²	19	8.5 Å²	8.5	10%	0.102	5%	0.051	C	C	.	.	H	α-helix	trans	-60.5	-53.8	177.5	-67.6	-39.6	0	0	0	110.7	F277 W454 W666 L672 T673 V674 F686	F277-D670 HydrophobicContact CD1-CB 4.03Å; F277-D670 HydrophobicContact CE1-CB 3.51Å; F277-D670 HydrophobicContact CZ-CB 3.88Å; W454-D670 VanDerWaalsContact CH2-OD1 3.27Å; W454-D670 WeakPolarHBondContact CH2-OD1 3.46Å; W666-D670 PolarHBondContact O-N 2.91Å; D670-L672 PolarHBondContact O-N 3.48Å; D670-T673 WeakPolarHBondContact O-CB 3.19Å; D670-T673 PolarHBondContact O-N 2.96Å; D670-T673 VanDerWaalsContact O-N 3.14Å; D670-V674 WeakPolarHBondContact O-CG2 3.42Å; D670-V674 PolarHBondContact O-N 2.81Å; D670-V674 VanDerWaalsContact O-N 3.09Å; D670-F686 HydrophobicContact CB-CZ 4.13Å
671	V	91	Very high	89.6	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63.9	-41.1	178.7	179.3	0	0	0	0	111.7	L293 M619 R624 N667 T673 V674 E675	L293-V671 HydrophobicContact CB-CG2 3.53Å; L293-V671 HydrophobicContact CD1-CG1 4.05Å; L293-V671 HydrophobicContact CD1-CG2 4.16Å; L293-V671 HydrophobicContact CG-CG2 4.49Å; M619-V671 HydrophobicContact CE-CB 3.44Å; M619-V671 VanDerWaalsContact CE-CB 3.44Å; M619-V671 HydrophobicContact CE-CG1 3.79Å; M619-V671 HydrophobicContact CE-CG2 3.62Å; M619-V671 HydrophobicContact SD-CG2 4.37Å; R624-V671 HydrophobicContact CG-CG1 4.49Å; N667-V671 WeakPolarHBondContact O-CG2 3.37Å; N667-V671 PolarHBondContact O-N 2.81Å; V671-T673 PolarHBondContact O-N 3.1Å; V671-V674 WeakPolarHBondContact O-CB 3.23Å; V671-V674 PolarHBondContact O-N 3.01Å; V671-E675 HydrophobicContact CG1-CG 4.21Å; V671-E675 WeakPolarHBondContact O-CG 3.4Å; V671-E675 PolarHBondContact O-N 3.43Å
672	L	91.8	Very high	89.6	Confident	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-62.1	-34.9	176.4	-176.5	62.1	0	0	0	111.2	M450 L625 L628 A668 L669 D670 E675 L676 L733 T736	M450-L672 HydrophobicContact SD-CD2 4.45Å; L625-L672 HydrophobicContact CD1-CD2 4.41Å; L628-L672 HydrophobicContact CD2-CD2 3.69Å; A668-L672 WeakPolarHBondContact O-CB 3.36Å; A668-L672 PolarHBondContact O-N 3.17Å; L669-L672 PolarHBondContact O-N 3.35Å; D670-L672 PolarHBondContact O-N 3.48Å; L672-E675 PolarHBondContact O-N 2.95Å; L672-L676 HydrophobicContact CD1-CD1 3.97Å; L672-L676 HydrophobicContact CD1-CD2 4.42Å; L672-L676 HydrophobicContact CD1-CG 3.98Å; L672-L676 HydrophobicContact CD2-CD1 4.47Å; L672-L676 HydrophobicContact CG-CD1 3.74Å; L672-L676 HydrophobicContact CG-CG 4.23Å; L672-L676 WeakPolarHBondContact O-CB 3.36Å; L672-L676 WeakPolarHBondContact O-CD1 3.48Å; L672-L676 WeakPolarHBondContact O-CG 3.48Å; L672-L676 PolarHBondContact O-N 3.5Å; L672-L676 VanDerWaalsContact O-N 3.11Å; L672-L733 HydrophobicContact CD2-CD1 3.95Å; L672-T736 HydrophobicContact CD1-CG2 3.73Å
673	T	92.3	Very high	89.5	Confident	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-66.1	-41.7	175.2	-54.7	0	0	0	0	111.7	M450 W454 L669 D670 V671 Y677 F686 L689	M450-T673 HydrophobicContact CE-CG2 4.37Å; M450-T673 WeakPolarHBondContact CE-OG1 3.15Å; W454-T673 HydrophobicContact CZ2-CG2 4.47Å; W454-T673 WeakPolarHBondContact CZ2-OG1 3.4Å; W454-T673 PolarHBondContact NE1-OG1 2.83Å; L669-T673 WeakPolarHBondContact O-CB 3.44Å; L669-T673 PolarHBondContact O-N 2.86Å; L669-T673 PolarHBondContact O-OG1 2.93Å; D670-T673 WeakPolarHBondContact O-CB 3.19Å; D670-T673 PolarHBondContact O-N 2.96Å; D670-T673 VanDerWaalsContact O-N 3.14Å; V671-T673 PolarHBondContact O-N 3.1Å; T673-Y677 WeakPolarHBondContact O-CD2 3.33Å; T673-F686 HydrophobicContact CG2-CB 3.81Å; T673-F686 HydrophobicContact CG2-CD1 4.07Å; T673-F686 HydrophobicContact CG2-CD2 3.74Å; T673-F686 HydrophobicContact CG2-CE2 4.36Å; T673-F686 HydrophobicContact CG2-CG 3.59Å; T673-L689 HydrophobicContact CG2-CD1 3.71Å
674	V	89.7	Confident	89.6	Confident	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-60.9	-44.2	173.4	174	0	0	0	0	111.6	F277 S281 L293 D670 V671 R682 F686	F277-V674 HydrophobicContact CB-CG2 3.74Å; F277-V674 HydrophobicContact CD1-CG2 4.28Å; F277-V674 HydrophobicContact CG-CG2 4.49Å; S281-V674 WeakPolarHBondContact OG-CG1 3.37Å; L293-V674 HydrophobicContact CD1-CG1 4.36Å; D670-V674 WeakPolarHBondContact O-CG2 3.42Å; D670-V674 PolarHBondContact O-N 2.81Å; D670-V674 VanDerWaalsContact O-N 3.09Å; V671-V674 WeakPolarHBondContact O-CB 3.23Å; V671-V674 PolarHBondContact O-N 3.01Å; V674-R682 WeakPolarHBondContact O-CD 3.42Å; V674-R682 PolarHBondContact O-NE 3.12Å; V674-F686 HydrophobicContact CG2-CD1 3.97Å; V674-F686 HydrophobicContact CG2-CE1 3.68Å
675	E	88.6	Confident	89.6	Confident	18 Å²	18	7.7 Å²	7.7	8%	0.084	4%	0.038	C	C	.	.	H	α-helix	trans	-80.9	-15.9	-172.1	-66.8	-169.1	138.5	0	0	115	R289 R624 V671 L672 T736 L741	R289-E675 IonicContact CZ-OE1 2.76Å; R289-E675 VanDerWaalsContact CZ-OE1 3.22Å; R289-E675 IonicContact NE-OE1 2.67Å; R289-E675 PolarHBondContact NE-OE1 3.46Å; R289-E675 IonicContact NH2-OE1 2.69Å; R289-E675 PolarHBondContact NH2-OE1 3.22Å; R624-E675 IonicContact CZ-OE1 2.95Å; R624-E675 IonicContact CZ-OE2 3.92Å; R624-E675 IonicContact NH1-OE1 2.69Å; R624-E675 PolarHBondContact NH1-OE1 3.06Å; R624-E675 IonicContact NH1-OE2 2.64Å; R624-E675 PolarHBondContact NH1-OE2 3.34Å; V671-E675 HydrophobicContact CG1-CG 4.21Å; V671-E675 WeakPolarHBondContact O-CG 3.4Å; V671-E675 PolarHBondContact O-N 3.43Å; L672-E675 PolarHBondContact O-N 2.95Å; E675-T736 HydrophobicContact CB-CG2 3.8Å; E675-T736 WeakPolarHBondContact OE2-CB 3.36Å; E675-T736 PolarHBondContact OE2-OG1 3.44Å; E675-L741 HydrophobicContact CB-CD2 4.48Å; E675-L741 HydrophobicContact CG-CD2 4.37Å
676	L	88.1	Confident	89.7	Confident	16 Å²	16	7.7 Å²	7.7	8%	0.084	4%	0.038	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-14	-178.6	-78.6	171	0	0	0	115	I446 M450 L672 P734 T736	I446-L676 HydrophobicContact CG2-CB 4.26Å; I446-L676 HydrophobicContact CG2-CD1 3.85Å; I446-L676 HydrophobicContact CG2-CD2 4.03Å; I446-L676 HydrophobicContact CG2-CG 4.28Å; M450-L676 HydrophobicContact CE-CD1 3.93Å; M450-L676 HydrophobicContact CG-CD1 3.84Å; M450-L676 HydrophobicContact SD-CD1 3.49Å; M450-L676 WeakPolarHBondContact SD-CD1 3.47Å; L672-L676 HydrophobicContact CD1-CD1 3.97Å; L672-L676 HydrophobicContact CD1-CD2 4.42Å; L672-L676 HydrophobicContact CD1-CG 3.98Å; L672-L676 HydrophobicContact CD2-CD1 4.47Å; L672-L676 HydrophobicContact CG-CD1 3.74Å; L672-L676 HydrophobicContact CG-CG 4.23Å; L672-L676 WeakPolarHBondContact O-CB 3.36Å; L672-L676 WeakPolarHBondContact O-CD1 3.48Å; L672-L676 WeakPolarHBondContact O-CG 3.48Å; L672-L676 PolarHBondContact O-N 3.5Å; L672-L676 VanDerWaalsContact O-N 3.11Å; L676-P734 HydrophobicContact CD2-CG 3.69Å; L676-T736 HydrophobicContact CD2-CG2 3.85Å; L676-T736 HydrophobicContact CG-CG2 4.1Å
677	Y	88.3	Confident	89.7	Confident	6 Å²	6	7 Å²	7	2%	0.024	4%	0.036	C	C	.	.	S	Bend	trans	-122.1	139.8	-174	-65.6	-76.4	0	0	0	113	Y443 T447 T673 R682 A685 L689	Y443-Y677 HydrophobicContact CD1-CD1 4.3Å; Y443-Y677 HydrophobicContact CD1-CE1 4.47Å; T447-Y677 VanDerWaalsContact CA-OH 3.28Å; T447-Y677 WeakPolarHBondContact CA-OH 3.26Å; T447-Y677 WeakPolarHBondContact CB-OH 3.38Å; T447-Y677 PolarHBondContact OG1-OH 3.36Å; T673-Y677 WeakPolarHBondContact O-CD2 3.33Å; Y677-R682 PolarHBondContact O-NE 2.91Å; Y677-R682 PolarHBondContact O-NH2 3.3Å; Y677-A685 HydrophobicContact CD1-CB 3.81Å; Y677-A685 HydrophobicContact CD2-CB 3.63Å; Y677-A685 HydrophobicContact CE1-CB 3.89Å; Y677-A685 HydrophobicContact CE2-CB 3.72Å; Y677-A685 HydrophobicContact CG-CB 3.68Å; Y677-L689 HydrophobicContact CE2-CD1 4.03Å
678	P	84.2	Confident	89.8	Confident	4 Å²	4	8.4 Å²	8.4	3%	0.026	4%	0.041	C	C	.	.			trans	-64.7	152.3	173.9	29.5	-36.3	0	0	0	111.3	D680 K681 R682 Q742	P678-D680 WeakPolarHBondContact CG-OD1 3.49Å; P678-D680 PolarHBondContact O-N 3.31Å; P678-D680 VanDerWaalsContact O-N 3.15Å; P678-K681 HydrophobicContact CG-CD 4.45Å; P678-K681 PolarHBondContact O-N 3.25Å; P678-K681 VanDerWaalsContact O-N 3.14Å; P678-R682 WeakPolarHBondContact O-CB 3.28Å; P678-R682 PolarHBondContact O-N 3.41Å; P678-Q742 WeakPolarHBondContact CA-O 3.37Å; P678-Q742 HydrophobicContact CB-CB 4.08Å; P678-Q742 VanDerWaalsContact CB-OXT 3.26Å; P678-Q742 WeakPolarHBondContact CB-OXT 3.24Å
679	S	79.3	Confident	90	Very high	3 Å²	3	8.4 Å²	8.4	2%	0.021	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-25.3	-170.4	36.6	0	0	0	0	114.3	E282 R359 E363 K681 R682 Q742	E282-S679 WeakPolarHBondContact OE1-CB 3.39Å; R359-S679 WeakPolarHBondContact CD-OG 3.24Å; R359-S679 PolarHBondContact NH1-OG 2.89Å; E363-S679 VanDerWaalsContact OE1-C 3.26Å; E363-S679 WeakPolarHBondContact OE1-CB 3.22Å; E363-S679 PolarHBondContact OE1-OG 3.05Å; S679-K681 PolarHBondContact O-N 2.95Å; S679-R682 VanDerWaalsContact N-NH2 3.17Å; S679-Q742 PolarHBondContact N-O 3.3Å
680	D	78.9	Confident	90	Very high	30 Å²	30	8.6 Å²	8.6	16%	0.16	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.7	177.6	74.5	-24.8	0	0	0	115.1	R145 E363 N434 P678	R145-D680 IonicContact CZ-OD2 2.69Å; R145-D680 VanDerWaalsContact CZ-OD2 3.25Å; R145-D680 VanDerWaalsContact NH1-CG 3.28Å; R145-D680 IonicContact NH1-OD1 2.75Å; R145-D680 PolarHBondContact NH1-OD1 3.19Å; R145-D680 IonicContact NH1-OD2 2.71Å; R145-D680 PolarHBondContact NH1-OD2 2.98Å; R145-D680 IonicContact NH2-OD2 3.62Å; R145-D680 PolarHBondContact NH2-OD2 3.39Å; E363-D680 PolarHBondContact OE1-N 3.49Å; E363-D680 VanDerWaalsContact OE1-N 3.14Å; N434-D680 PolarHBondContact ND2-O 3.22Å; P678-D680 WeakPolarHBondContact CG-OD1 3.49Å; P678-D680 PolarHBondContact O-N 3.31Å; P678-D680 VanDerWaalsContact O-N 3.15Å
681	K	84.8	Confident	90.1	Very high	40 Å²	40	8.2 Å²	8.2	17%	0.174	4%	0.042	C	C	.	.	T	Hydrogen-bonded Turn	trans	-135.5	-1.5	-177.5	-67.9	146.9	-169.8	133.3	0	113.6	D227 S437 P678 S679 T683 T684 A685	D227-K681 VanDerWaalsContact OD2-C 3.31Å; D227-K681 WeakPolarHBondContact OD2-CA 3.39Å; S437-K681 VanDerWaalsContact OG-CD 3.23Å; S437-K681 WeakPolarHBondContact OG-CD 3.2Å; S437-K681 WeakPolarHBondContact OG-CE 3.43Å; P678-K681 HydrophobicContact CG-CD 4.45Å; P678-K681 PolarHBondContact O-N 3.25Å; P678-K681 VanDerWaalsContact O-N 3.14Å; S679-K681 PolarHBondContact O-N 2.95Å; K681-T683 PolarHBondContact O-N 3.13Å; K681-T684 PolarHBondContact O-N 3.44Å; K681-A685 WeakPolarHBondContact O-CB 3.5Å; K681-A685 PolarHBondContact O-N 3.02Å
682	R	90.2	Very high	90.3	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-62.2	-46	-168.2	-175.1	179.1	-63.6	134.6	14.9	111.9	E282 V674 Y677 P678 S679 A685 F686 Q742	E282-R682 IonicContact OE1-NH1 3.9Å; V674-R682 WeakPolarHBondContact O-CD 3.42Å; V674-R682 PolarHBondContact O-NE 3.12Å; Y677-R682 PolarHBondContact O-NE 2.91Å; Y677-R682 PolarHBondContact O-NH2 3.3Å; P678-R682 WeakPolarHBondContact O-CB 3.28Å; P678-R682 PolarHBondContact O-N 3.41Å; S679-R682 VanDerWaalsContact N-NH2 3.17Å; R682-A685 PolarHBondContact O-N 3.21Å; R682-F686 WeakPolarHBondContact O-CB 3.27Å; R682-F686 PolarHBondContact O-N 2.86Å; R682-Q742 PolarHBondContact NH2-O 3.4Å; R682-Q742 VanDerWaalsContact NH2-O 3.09Å
683	T	91.6	Very high	90.4	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-75.6	-32.8	-175.8	-28.2	0	0	0	0	111.1	G223 A226 D227 P274 I275 K681 G687	G223-T683 CarbonylContact C-O 3.46Å; G223-T683 WeakPolarHBondContact CA-O 3.26Å; G223-T683 CarbonylContact O-C 3.55Å; G223-T683 WeakPolarHBondContact O-CB 3.33Å; A226-T683 HydrophobicContact CB-CG2 3.77Å; D227-T683 WeakPolarHBondContact OD1-CA 3.19Å; D227-T683 WeakPolarHBondContact OD1-CB 3.24Å; D227-T683 PolarHBondContact OD1-N 2.98Å; D227-T683 PolarHBondContact OD1-OG1 3.03Å; D227-T683 PolarHBondContact OD2-N 3.42Å; P274-T683 HydrophobicContact CB-CG2 4.23Å; I275-T683 HydrophobicContact CB-CG2 4.34Å; I275-T683 HydrophobicContact CG1-CG2 3.78Å; K681-T683 PolarHBondContact O-N 3.13Å; T683-G687 WeakPolarHBondContact O-CA 3.48Å; T683-G687 PolarHBondContact O-N 3.28Å
684	T	92.5	Very high	90.5	Very high	5 Å²	5	9.6 Å²	9.6	3%	0.031	5%	0.049	C	C	.	.	H	α-helix	trans	-60.7	-49.8	169.7	-56.3	0	0	0	0	111.1	G223 D227 N434 F435 K681 G687 F688	G223-T684 PolarHBondContact O-N 3.16Å; D227-T684 VanDerWaalsContact OD2-CB 3.26Å; D227-T684 WeakPolarHBondContact OD2-CB 3.46Å; D227-T684 PolarHBondContact OD2-N 3.37Å; D227-T684 PolarHBondContact OD2-OG1 3.37Å; N434-T684 HydrophobicContact CB-CG2 4.18Å; F435-T684 HydrophobicContact CB-CG2 4.01Å; K681-T684 PolarHBondContact O-N 3.44Å; T684-G687 PolarHBondContact O-N 2.75Å; T684-F688 PolarHBondContact O-N 2.94Å
685	A	93.1	Very high	90.8	Very high	3 Å²	3	13 Å²	13	3%	0.025	7%	0.067	C	C	.	.	H	α-helix	trans	-65.4	-45.6	-178.1	0	0	0	0	0	112.2	Y677 K681 R682 F688 L689	Y677-A685 HydrophobicContact CD1-CB 3.81Å; Y677-A685 HydrophobicContact CD2-CB 3.63Å; Y677-A685 HydrophobicContact CE1-CB 3.89Å; Y677-A685 HydrophobicContact CE2-CB 3.72Å; Y677-A685 HydrophobicContact CG-CB 3.68Å; K681-A685 WeakPolarHBondContact O-CB 3.5Å; K681-A685 PolarHBondContact O-N 3.02Å; R682-A685 PolarHBondContact O-N 3.21Å; A685-F688 PolarHBondContact O-N 3.47Å; A685-L689 WeakPolarHBondContact O-CB 3.34Å; A685-L689 WeakPolarHBondContact O-CG 3.33Å; A685-L689 PolarHBondContact O-N 3Å
686	F	94.4	Very high	91.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-66	-43.2	176	-162.3	166	0	0	0	110.6	I273 P274 F277 W454 D670 T673 V674 R682 F688 L689 N690	I273-F686 HydrophobicContact CG2-CE2 4.19Å; I273-F686 HydrophobicContact CG2-CZ 3.97Å; P274-F686 HydrophobicContact CB-CB 3.73Å; P274-F686 HydrophobicContact CB-CD1 4.06Å; P274-F686 HydrophobicContact CB-CD2 3.97Å; P274-F686 HydrophobicContact CB-CG 3.65Å; F277-F686 HydrophobicContact CB-CD1 4.45Å; F277-F686 HydrophobicContact CB-CE1 3.63Å; F277-F686 HydrophobicContact CB-CZ 4.4Å; F277-F686 HydrophobicContact CD1-CE1 4.49Å; F277-F686 HydrophobicContact CG-CE1 4.05Å; F277-F686 HydrophobicContact CG-CZ 4.39Å; W454-F686 HydrophobicContact CH2-CD2 4.41Å; W454-F686 AromaticContact CH2-CE2 3.64Å; W454-F686 HydrophobicContact CH2-CE2 3.64Å; W454-F686 HydrophobicContact CH2-CZ 4.47Å; W454-F686 HydrophobicContact CZ2-CD2 4.06Å; W454-F686 AromaticContact CZ2-CE2 3.55Å; W454-F686 HydrophobicContact CZ2-CE2 3.55Å; W454-F686 HydrophobicContact CZ2-CZ 4.37Å; D670-F686 HydrophobicContact CB-CZ 4.13Å; T673-F686 HydrophobicContact CG2-CB 3.81Å; T673-F686 HydrophobicContact CG2-CD1 4.07Å; T673-F686 HydrophobicContact CG2-CD2 3.74Å; T673-F686 HydrophobicContact CG2-CE2 4.36Å; T673-F686 HydrophobicContact CG2-CG 3.59Å; V674-F686 HydrophobicContact CG2-CD1 3.97Å; V674-F686 HydrophobicContact CG2-CE1 3.68Å; R682-F686 WeakPolarHBondContact O-CB 3.27Å; R682-F686 PolarHBondContact O-N 2.86Å; F686-F688 VanDerWaalsContact C-N 3.34Å; F686-F688 PolarHBondContact O-N 3.45Å; F686-L689 PolarHBondContact O-N 2.99Å; F686-N690 WeakPolarHBondContact O-CB 3.33Å; F686-N690 PolarHBondContact O-N 2.79Å
687	G	94.2	Very high	91.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-55.8	-44.4	175.1	0	0	0	0	0	113.4	A219 T683 T684 A691	A219-G687 CarbonylContact C-O 3.55Å; A219-G687 WeakPolarHBondContact CB-O 2.97Å; A219-G687 CarbonylContact O-C 3.09Å; A219-G687 WeakPolarHBondContact O-CA 3.45Å; T683-G687 WeakPolarHBondContact O-CA 3.48Å; T683-G687 PolarHBondContact O-N 3.28Å; T684-G687 PolarHBondContact O-N 2.75Å; G687-A691 WeakPolarHBondContact O-CB 3.41Å; G687-A691 PolarHBondContact O-N 2.85Å
688	F	94.7	Very high	91.6	Very high	32 Å²	32	12.6 Å²	12.6	14%	0.14	7%	0.067	C	C	.	.	H	α-helix	trans	-66.6	-43.3	174.1	170.6	-110.4	0	0	0	113.5	F220 F435 F439 M451 T684 A685 F686 N690 A691 L692	F220-F688 HydrophobicContact CD2-CB 4.31Å; F220-F688 HydrophobicContact CD2-CD2 4.16Å; F220-F688 HydrophobicContact CE2-CD2 4.2Å; F435-F688 HydrophobicContact CD2-CB 4.34Å; F435-F688 HydrophobicContact CD2-CD2 4.3Å; F435-F688 HydrophobicContact CD2-CG 4.17Å; F435-F688 HydrophobicContact CE2-CB 4.28Å; F435-F688 AromaticContact CE2-CD1 3.99Å; F435-F688 HydrophobicContact CE2-CD1 3.99Å; F435-F688 AromaticContact CE2-CD2 3.48Å; F435-F688 HydrophobicContact CE2-CD2 3.48Å; F435-F688 VanDerWaalsContact CE2-CD2 3.48Å; F435-F688 HydrophobicContact CE2-CE1 4.18Å; F435-F688 AromaticContact CE2-CE2 3.69Å; F435-F688 HydrophobicContact CE2-CE2 3.69Å; F435-F688 AromaticContact CE2-CG 3.63Å; F435-F688 HydrophobicContact CE2-CG 3.63Å; F435-F688 HydrophobicContact CE2-CZ 4.03Å; F435-F688 HydrophobicContact CZ-CD2 4.24Å; F435-F688 HydrophobicContact CZ-CE2 4.07Å; F435-F688 HydrophobicContact CZ-CZ 4.41Å; F439-F688 HydrophobicContact CE2-CE1 4.11Å; F439-F688 HydrophobicContact CE2-CZ 4.43Å; F439-F688 AromaticContact CZ-CE1 3.7Å; F439-F688 HydrophobicContact CZ-CE1 3.7Å; F439-F688 AromaticContact CZ-CZ 3.99Å; F439-F688 HydrophobicContact CZ-CZ 3.99Å; M451-F688 HydrophobicContact CE-CE1 4.06Å; M451-F688 HydrophobicContact CE-CZ 3.83Å; M451-F688 HydrophobicContact CG-CE1 3.96Å; M451-F688 HydrophobicContact SD-CE1 3.76Å; M451-F688 HydrophobicContact SD-CZ 4.14Å; T684-F688 PolarHBondContact O-N 2.94Å; A685-F688 PolarHBondContact O-N 3.47Å; F686-F688 VanDerWaalsContact C-N 3.34Å; F686-F688 PolarHBondContact O-N 3.45Å; F688-N690 VanDerWaalsContact C-N 3.33Å; F688-N690 PolarHBondContact O-N 3.35Å; F688-A691 WeakPolarHBondContact O-CB 3.49Å; F688-A691 PolarHBondContact O-N 2.93Å; F688-L692 PolarHBondContact O-N 3.09Å
689	L	95.1	Very high	92	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-65	-36.5	177.2	-72.3	168.3	0	0	0	112	M450 M451 W454 T673 Y677 A685 F686 L692 C693	M450-L689 HydrophobicContact CB-CD1 3.91Å; M450-L689 HydrophobicContact CB-CD2 3.95Å; M451-L689 HydrophobicContact CB-CD2 4.3Å; M451-L689 HydrophobicContact CG-CD2 3.69Å; W454-L689 HydrophobicContact CD2-CB 4.31Å; W454-L689 HydrophobicContact CG-CB 4.12Å; W454-L689 HydrophobicContact CG-CD2 4.42Å; T673-L689 HydrophobicContact CG2-CD1 3.71Å; Y677-L689 HydrophobicContact CE2-CD1 4.03Å; A685-L689 WeakPolarHBondContact O-CB 3.34Å; A685-L689 WeakPolarHBondContact O-CG 3.33Å; A685-L689 PolarHBondContact O-N 3Å; F686-L689 PolarHBondContact O-N 2.99Å; L689-L692 PolarHBondContact O-N 3.16Å; L689-C693 WeakPolarHBondContact O-CB 3.39Å; L689-C693 PolarHBondContact O-N 2.91Å
690	N	94.2	Very high	92.6	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-69.7	-36.6	172	-173.4	29.8	0	0	0	111.7	A219 G270 F686 F688 L692 C693 K694	A219-N690 HydrophobicContact CB-CB 4.08Å; G270-N690 PolarHBondContact O-ND2 3.44Å; F686-N690 WeakPolarHBondContact O-CB 3.33Å; F686-N690 PolarHBondContact O-N 2.79Å; F688-N690 VanDerWaalsContact C-N 3.33Å; F688-N690 PolarHBondContact O-N 3.35Å; N690-L692 PolarHBondContact O-N 3.05Å; N690-C693 WeakPolarHBondContact O-CB 3.3Å; N690-C693 PolarHBondContact O-N 2.94Å; N690-K694 WeakPolarHBondContact O-CG 3.41Å; N690-K694 PolarHBondContact O-N 3.42Å; N690-K694 VanDerWaalsContact OD1-CE 3.31Å; N690-K694 WeakPolarHBondContact OD1-CE 3.29Å
691	A	95.3	Very high	93.1	Very high	11 Å²	11	15 Å²	15	9%	0.091	8%	0.079	C	C	.	.	H	α-helix	trans	-60.3	-46.6	171.5	0	0	0	0	0	111.5	M216 A219 F220 G687 F688 C693 K694 L695	M216-A691 HydrophobicContact CG-CB 4.25Å; M216-A691 WeakPolarHBondContact CG-O 3.16Å; M216-A691 VanDerWaalsContact O-CB 3.29Å; M216-A691 WeakPolarHBondContact O-CB 3.41Å; A219-A691 HydrophobicContact CB-CB 4.2Å; F220-A691 HydrophobicContact CB-CB 4.17Å; G687-A691 WeakPolarHBondContact O-CB 3.41Å; G687-A691 PolarHBondContact O-N 2.85Å; F688-A691 WeakPolarHBondContact O-CB 3.49Å; F688-A691 PolarHBondContact O-N 2.93Å; A691-C693 VanDerWaalsContact C-N 3.29Å; A691-C693 PolarHBondContact O-N 3.39Å; A691-K694 PolarHBondContact O-N 3.33Å; A691-L695 PolarHBondContact O-N 3.36Å
692	L	95.4	Very high	93.3	Very high	29 Å²	29	15.8 Å²	15.8	15%	0.152	9%	0.09	C	C	.	.	H	α-helix	trans	-61.2	-37.1	173.8	-177.1	65.2	0	0	0	112.3	M451 F455 F688 L689 N690 L695 A696	M451-L692 HydrophobicContact CB-CD2 3.56Å; M451-L692 HydrophobicContact CE-CD2 4.01Å; M451-L692 HydrophobicContact CG-CD2 3.71Å; F455-L692 HydrophobicContact CB-CD2 4.45Å; F455-L692 HydrophobicContact CB-CG 4.46Å; F455-L692 HydrophobicContact CD2-CD1 4.03Å; F455-L692 HydrophobicContact CD2-CG 4.38Å; F688-L692 PolarHBondContact O-N 3.09Å; L689-L692 PolarHBondContact O-N 3.16Å; N690-L692 PolarHBondContact O-N 3.05Å; L692-L695 HydrophobicContact CD1-CD2 4.45Å; L692-L695 PolarHBondContact O-N 3.3Å; L692-A696 WeakPolarHBondContact O-CB 3.42Å; L692-A696 PolarHBondContact O-N 3.38Å
693	C	94.7	Very high	93.4	Very high	1 Å²	1	19 Å²	19	1%	0.007	11%	0.106	C	C	.	.	H	α-helix	trans	-58	-50.3	172.5	-178.9	0	0	0	0	111.8	W454 S458 L689 N690 A691 L695 A696 A697	W454-C693 HydrophobicContact CE3-CB 3.52Å; W454-C693 HydrophobicContact CZ3-CB 3.9Å; S458-C693 WeakPolarHBondContact CB-O 3.23Å; S458-C693 VanDerWaalsContact CB-SG 3.52Å; S458-C693 PolarHBondContact OG-O 3.19Å; S458-C693 PolarHBondContact OG-SG 2.85Å; S458-C693 VanDerWaalsContact OG-SG 3.4Å; L689-C693 WeakPolarHBondContact O-CB 3.39Å; L689-C693 PolarHBondContact O-N 2.91Å; N690-C693 WeakPolarHBondContact O-CB 3.3Å; N690-C693 PolarHBondContact O-N 2.94Å; A691-C693 VanDerWaalsContact C-N 3.29Å; A691-C693 PolarHBondContact O-N 3.39Å; C693-L695 VanDerWaalsContact C-N 3.35Å; C693-L695 PolarHBondContact O-N 3.23Å; C693-A696 WeakPolarHBondContact O-CB 3.39Å; C693-A696 PolarHBondContact O-N 2.88Å; C693-A697 PolarHBondContact O-N 2.96Å
694	K	94.3	Very high	93.4	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-68	-33.6	-179.6	-56.6	-63	173.8	173.8	0	112	Y212 M215 M216 Y462 N690 A691 A697 V698	Y212-K694 HydrophobicContact CD1-CD 4.08Å; M215-K694 HydrophobicContact CB-CD 4.03Å; M215-K694 HydrophobicContact CB-CG 3.85Å; M215-K694 HydrophobicContact SD-CD 3.88Å; M215-K694 PolarHBondContact SD-NZ 2.91Å; M216-K694 HydrophobicContact CB-CB 3.98Å; Y462-K694 PolarHBondContact OH-NZ 2.92Å; N690-K694 WeakPolarHBondContact O-CG 3.41Å; N690-K694 PolarHBondContact O-N 3.42Å; N690-K694 VanDerWaalsContact OD1-CE 3.31Å; N690-K694 WeakPolarHBondContact OD1-CE 3.29Å; A691-K694 PolarHBondContact O-N 3.33Å; K694-A697 WeakPolarHBondContact O-CB 3.44Å; K694-A697 PolarHBondContact O-N 2.98Å; K694-V698 WeakPolarHBondContact O-CG2 3.49Å; K694-V698 PolarHBondContact O-N 3.32Å; K694-V698 VanDerWaalsContact O-N 3.09Å
695	L	94.7	Very high	93.1	Very high	72 Å²	72	21.4 Å²	21.4	38%	0.377	12%	0.121	S	C	.	.	H	α-helix	trans	-61.3	-46.2	169.9	179.4	61.3	0	0	0	112	M216 A691 L692 C693 A697 V698 L699	M216-L695 HydrophobicContact SD-CB 3.87Å; M216-L695 HydrophobicContact SD-CD1 4.09Å; M216-L695 HydrophobicContact SD-CG 4.46Å; A691-L695 PolarHBondContact O-N 3.36Å; L692-L695 HydrophobicContact CD1-CD2 4.45Å; L692-L695 PolarHBondContact O-N 3.3Å; C693-L695 VanDerWaalsContact C-N 3.35Å; C693-L695 PolarHBondContact O-N 3.23Å; L695-A697 VanDerWaalsContact C-N 3.29Å; L695-A697 PolarHBondContact O-N 2.9Å; L695-V698 PolarHBondContact O-N 3.01Å; L695-L699 HydrophobicContact CG-CD1 4.38Å; L695-L699 WeakPolarHBondContact O-CG 3.21Å; L695-L699 PolarHBondContact O-N 3.41Å; L695-L699 VanDerWaalsContact O-N 3.09Å
696	A	95.3	Very high	92.8	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-63.6	-34	177.2	0	0	0	0	0	112.6	F455 F459 L692 C693 G700	F455-A696 HydrophobicContact CB-CB 4.41Å; F455-A696 HydrophobicContact CD2-CB 3.55Å; F455-A696 HydrophobicContact CE2-CB 3.83Å; F455-A696 HydrophobicContact CG-CB 3.94Å; F455-A696 HydrophobicContact CZ-CB 4.42Å; F455-A696 WeakPolarHBondContact O-CB 3.36Å; F459-A696 HydrophobicContact CB-CB 4.41Å; L692-A696 WeakPolarHBondContact O-CB 3.42Å; L692-A696 PolarHBondContact O-N 3.38Å; C693-A696 WeakPolarHBondContact O-CB 3.39Å; C693-A696 PolarHBondContact O-N 2.88Å; A696-G700 PolarHBondContact O-N 3.09Å
697	A	92.9	Very high	92.6	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-47.3	173.2	0	0	0	0	0	111.8	Y212 S458 Y462 C693 K694 L695 L699 G700 I701	Y212-A697 HydrophobicContact CD1-CB 4.11Å; Y212-A697 HydrophobicContact CE1-CB 4.28Å; S458-A697 PolarHBondContact OG-N 3.46Å; Y462-A697 HydrophobicContact CD1-CB 4.37Å; Y462-A697 HydrophobicContact CD2-CB 3.77Å; Y462-A697 HydrophobicContact CE2-CB 4.49Å; Y462-A697 HydrophobicContact CG-CB 3.69Å; C693-A697 PolarHBondContact O-N 2.96Å; K694-A697 WeakPolarHBondContact O-CB 3.44Å; K694-A697 PolarHBondContact O-N 2.98Å; L695-A697 VanDerWaalsContact C-N 3.29Å; L695-A697 PolarHBondContact O-N 2.9Å; A697-L699 VanDerWaalsContact C-N 3.31Å; A697-L699 PolarHBondContact O-N 2.95Å; A697-G700 PolarHBondContact O-N 2.82Å; A697-I701 WeakPolarHBondContact O-CB 3.08Å; A697-I701 WeakPolarHBondContact O-CD1 3.27Å; A697-I701 VanDerWaalsContact O-CG1 3.23Å; A697-I701 WeakPolarHBondContact O-CG1 3.47Å; A697-I701 PolarHBondContact O-N 2.74Å
698	V	92.9	Very high	92.1	Very high	30 Å²	30	28.7 Å²	28.7	18%	0.182	16%	0.164	C	C	.	.	H	α-helix	trans	-58.1	-43.1	176.4	169.8	0	0	0	0	111.3	L209 K694 L695 S702	L209-V698 HydrophobicContact CD2-CB 4.49Å; L209-V698 HydrophobicContact CD2-CG1 4.28Å; L209-V698 HydrophobicContact CD2-CG2 4.36Å; K694-V698 WeakPolarHBondContact O-CG2 3.49Å; K694-V698 PolarHBondContact O-N 3.32Å; K694-V698 VanDerWaalsContact O-N 3.09Å; L695-V698 PolarHBondContact O-N 3.01Å; V698-S702 VanDerWaalsContact O-CB 3.31Å; V698-S702 WeakPolarHBondContact O-CB 3.36Å; V698-S702 PolarHBondContact O-N 2.98Å; V698-S702 VanDerWaalsContact O-N 3.09Å; V698-S702 PolarHBondContact O-OG 3.12Å
699	L	92.9	Very high	91.4	Very high	71 Å²	71	29.2 Å²	29.2	37%	0.372	18%	0.178	S	C	.	.	H	α-helix	trans	-66.3	-45.9	175.9	-68	171.4	0	0	0	112.3	F455 L695 A697 S702 I703	F455-L699 HydrophobicContact CE2-CD1 4.09Å; F455-L699 HydrophobicContact CZ-CD1 4.17Å; L695-L699 HydrophobicContact CG-CD1 4.38Å; L695-L699 WeakPolarHBondContact O-CG 3.21Å; L695-L699 PolarHBondContact O-N 3.41Å; L695-L699 VanDerWaalsContact O-N 3.09Å; A697-L699 VanDerWaalsContact C-N 3.31Å; A697-L699 PolarHBondContact O-N 2.95Å; L699-S702 PolarHBondContact O-N 3.18Å; L699-I703 WeakPolarHBondContact O-CB 3.38Å; L699-I703 VanDerWaalsContact O-CG1 3.28Å; L699-I703 WeakPolarHBondContact O-CG1 3.25Å; L699-I703 PolarHBondContact O-N 2.83Å
700	G	92.1	Very high	91	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62	-46.6	179.9	0	0	0	0	0	112.8	F459 A696 A697 F704	F459-G700 VanDerWaalsContact CD2-CA 3.47Å; A696-G700 PolarHBondContact O-N 3.09Å; A697-G700 PolarHBondContact O-N 2.82Å; G700-F704 WeakPolarHBondContact O-CB 3.32Å; G700-F704 WeakPolarHBondContact O-CG 3.45Å; G700-F704 PolarHBondContact O-N 3.19Å
701	I	90.1	Very high	90.5	Very high	18 Å²	18	37.9 Å²	37.9	9%	0.092	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-53.4	175.5	-66.2	165.1	0	0	0	109.9	L209 Y212 V466 A697 I703 F704 T705	L209-I701 HydrophobicContact CD2-CB 4.18Å; L209-I701 HydrophobicContact CD2-CD1 4.34Å; L209-I701 HydrophobicContact CD2-CG2 3.93Å; Y212-I701 HydrophobicContact CD2-CD1 4.48Å; Y212-I701 HydrophobicContact CE2-CD1 4.17Å; V466-I701 HydrophobicContact CB-CG1 4.23Å; V466-I701 HydrophobicContact CB-CG2 4.35Å; V466-I701 HydrophobicContact CG1-CG2 4.07Å; V466-I701 HydrophobicContact CG2-CD1 3.99Å; V466-I701 HydrophobicContact CG2-CG1 3.86Å; V466-I701 HydrophobicContact CG2-CG2 4.46Å; A697-I701 WeakPolarHBondContact O-CB 3.08Å; A697-I701 WeakPolarHBondContact O-CD1 3.27Å; A697-I701 VanDerWaalsContact O-CG1 3.23Å; A697-I701 WeakPolarHBondContact O-CG1 3.47Å; A697-I701 PolarHBondContact O-N 2.74Å; I701-I703 VanDerWaalsContact C-N 3.31Å; I701-I703 PolarHBondContact O-N 2.8Å; I701-F704 PolarHBondContact O-N 3Å; I701-T705 WeakPolarHBondContact O-CB 3.14Å; I701-T705 PolarHBondContact O-N 2.75Å; I701-T705 PolarHBondContact O-OG1 2.92Å
702	S	89.4	Confident	90	Very high	56 Å²	56	39.7 Å²	39.7	39%	0.392	23%	0.231	S	C	.	.	H	α-helix	trans	-58.5	-41.9	-177.3	-56.9	0	0	0	0	112.6	V698 L699	V698-S702 VanDerWaalsContact O-CB 3.31Å; V698-S702 WeakPolarHBondContact O-CB 3.36Å; V698-S702 PolarHBondContact O-N 2.98Å; V698-S702 VanDerWaalsContact O-N 3.09Å; V698-S702 PolarHBondContact O-OG 3.12Å; L699-S702 PolarHBondContact O-N 3.18Å
703	I	91.8	Very high	89.6	Confident	67 Å²	67	40.6 Å²	40.6	34%	0.344	24%	0.243	S	C	.	.	H	α-helix	trans	-74.7	-45.4	-179.2	-67.3	167.7	0	0	0	110.8	F459 L699 I701 S706 F707	F459-I703 HydrophobicContact CE2-CD1 4.14Å; L699-I703 WeakPolarHBondContact O-CB 3.38Å; L699-I703 VanDerWaalsContact O-CG1 3.28Å; L699-I703 WeakPolarHBondContact O-CG1 3.25Å; L699-I703 PolarHBondContact O-N 2.83Å; I701-I703 VanDerWaalsContact C-N 3.31Å; I701-I703 PolarHBondContact O-N 2.8Å; I703-S706 WeakPolarHBondContact O-CB 3.14Å; I703-S706 PolarHBondContact O-N 3.17Å; I703-S706 PolarHBondContact O-OG 2.95Å; I703-F707 HydrophobicContact CG2-CD2 4.38Å; I703-F707 HydrophobicContact CG2-CE2 3.86Å; I703-F707 WeakPolarHBondContact O-CD2 3.31Å
704	F	90.9	Very high	89.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-73.4	-38.8	-174.2	-68	7.4	0	0	0	112.2	F459 L464 W467 G700 I701 S706 F707 P715 F718 A719	F459-F704 HydrophobicContact CD1-CZ 4.15Å; F459-F704 AromaticContact CE1-CE1 3.66Å; F459-F704 HydrophobicContact CE1-CE1 3.66Å; F459-F704 AromaticContact CE1-CZ 3.64Å; F459-F704 HydrophobicContact CE1-CZ 3.64Å; F459-F704 HydrophobicContact CE2-CE1 4.41Å; F459-F704 AromaticContact CZ-CE1 3.59Å; F459-F704 HydrophobicContact CZ-CE1 3.59Å; F459-F704 HydrophobicContact CZ-CZ 4.02Å; L464-F704 HydrophobicContact CD2-CD2 4.05Å; L464-F704 HydrophobicContact CD2-CE2 4Å; L464-F704 HydrophobicContact CG-CD2 4.32Å; L464-F704 HydrophobicContact CG-CE2 3.99Å; W467-F704 HydrophobicContact CB-CB 4.07Å; W467-F704 VanDerWaalsContact CD1-O 3.31Å; W467-F704 HydrophobicContact CG-CB 4.32Å; G700-F704 WeakPolarHBondContact O-CB 3.32Å; G700-F704 WeakPolarHBondContact O-CG 3.45Å; G700-F704 PolarHBondContact O-N 3.19Å; I701-F704 PolarHBondContact O-N 3Å; F704-S706 PolarHBondContact O-N 3.35Å; F704-F707 PolarHBondContact O-N 3.16Å; F704-F707 VanDerWaalsContact O-N 3.07Å; F704-P715 HydrophobicContact CB-CB 4.35Å; F704-P715 HydrophobicContact CD1-CB 4.28Å; F704-P715 HydrophobicContact CD2-CB 4.16Å; F704-P715 HydrophobicContact CG-CB 4.01Å; F704-F718 HydrophobicContact CE1-CB 3.92Å; F704-F718 HydrophobicContact CZ-CB 4.21Å; F704-A719 HydrophobicContact CE2-CB 3.98Å; F704-A719 HydrophobicContact CZ-CB 4.04Å
705	T	85.8	Confident	89.2	Confident	55 Å²	55	41.6 Å²	41.6	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-33	173.4	-63.1	0	0	0	0	111.4	I701 F707 V708	I701-T705 WeakPolarHBondContact O-CB 3.14Å; I701-T705 PolarHBondContact O-N 2.75Å; I701-T705 PolarHBondContact O-OG1 2.92Å; T705-F707 PolarHBondContact O-N 3.03Å; T705-V708 WeakPolarHBondContact O-CB 3.32Å; T705-V708 WeakPolarHBondContact O-CG2 3.49Å; T705-V708 PolarHBondContact O-N 2.77Å
706	S	88	Confident	89	Confident	70 Å²	70	38.4 Å²	38.4	49%	0.49	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.2	176.4	82.7	0	0	0	0	114.9	I703 F704 I710	I703-S706 WeakPolarHBondContact O-CB 3.14Å; I703-S706 PolarHBondContact O-N 3.17Å; I703-S706 PolarHBondContact O-OG 2.95Å; F704-S706 PolarHBondContact O-N 3.35Å; S706-I710 WeakPolarHBondContact O-CD1 3.35Å
707	F	89.1	Confident	88.8	Confident	52 Å²	52	43.8 Å²	43.8	23%	0.228	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-5	178	-72	-67.2	0	0	0	114.4	I703 F704 T705 G709 I710 T711 A714 P715 F718	I703-F707 HydrophobicContact CG2-CD2 4.38Å; I703-F707 HydrophobicContact CG2-CE2 3.86Å; I703-F707 WeakPolarHBondContact O-CD2 3.31Å; F704-F707 PolarHBondContact O-N 3.16Å; F704-F707 VanDerWaalsContact O-N 3.07Å; T705-F707 PolarHBondContact O-N 3.03Å; F707-G709 PolarHBondContact O-N 3.19Å; F707-I710 PolarHBondContact O-N 2.85Å; F707-T711 PolarHBondContact O-N 3.16Å; F707-A714 HydrophobicContact CD1-CB 4.16Å; F707-A714 HydrophobicContact CD2-CB 4.49Å; F707-A714 HydrophobicContact CE1-CB 4.13Å; F707-A714 HydrophobicContact CE2-CB 4.47Å; F707-A714 HydrophobicContact CG-CB 4.34Å; F707-A714 HydrophobicContact CZ-CB 4.3Å; F707-P715 HydrophobicContact CB-CG 3.65Å; F707-P715 HydrophobicContact CD2-CG 4.15Å; F707-P715 HydrophobicContact CG-CG 4.19Å; F707-F718 HydrophobicContact CE2-CD2 4.42Å; F707-F718 AromaticContact CE2-CE2 3.9Å; F707-F718 HydrophobicContact CE2-CE2 3.9Å; F707-F718 HydrophobicContact CZ-CE2 4.13Å
708	V	84.6	Confident	88.8	Confident	35 Å²	35	48.5 Å²	48.5	21%	0.212	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	132.6	176.5	178.8	0	0	0	0	109.4	D470 M471 H474 T705 I710	D470-V708 HydrophobicContact CB-CG1 4.36Å; D470-V708 HydrophobicContact CB-CG2 3.94Å; M471-V708 HydrophobicContact CE-CG1 4.43Å; H474-V708 HydrophobicContact CB-CG1 3.92Å; T705-V708 WeakPolarHBondContact O-CB 3.32Å; T705-V708 WeakPolarHBondContact O-CG2 3.49Å; T705-V708 PolarHBondContact O-N 2.77Å; V708-I710 PolarHBondContact O-N 3.16Å; V708-I710 VanDerWaalsContact O-N 3.16Å
709	G	79.4	Confident	88.8	Confident	43 Å²	43	47 Å²	47	44%	0.443	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-17.9	-172.9	0	0	0	0	0	116.1	H474 F707	H474-G709 VanDerWaalsContact NE2-CA 3.33Å; H474-G709 WeakPolarHBondContact NE2-CA 3.2Å; F707-G709 PolarHBondContact O-N 3.19Å
710	I	86.3	Confident	88.7	Confident	122 Å²	122	44.5 Å²	44.5	63%	0.626	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-61.7	179.5	-51.1	-177.7	0	0	0	111.2	S706 F707 V708	S706-I710 WeakPolarHBondContact O-CD1 3.35Å; F707-I710 PolarHBondContact O-N 2.85Å; V708-I710 PolarHBondContact O-N 3.16Å; V708-I710 VanDerWaalsContact O-N 3.16Å
711	T	85.4	Confident	88.8	Confident	63 Å²	63	47 Å²	47	39%	0.387	28%	0.283	S	S	.	.			trans	-148.5	144.7	173.9	64.9	0	0	0	0	112.3	F707	F707-T711 PolarHBondContact O-N 3.16Å
712	K	84.5	Confident	88.9	Confident	50 Å²	50	46.7 Å²	46.7	22%	0.217	28%	0.283	C	S	.	.	S	Bend	trans	-73.6	-33.8	166.8	-62.5	-176.6	-177.9	-178.2	0	112.3	M471 G645 N646 I716	M471-K712 HydrophobicContact CE-CG 4.41Å; M471-K712 HydrophobicContact SD-CG 4.31Å; G645-K712 PolarHBondContact O-NZ 2.99Å; N646-K712 PolarHBondContact OD1-NZ 3.3Å; K712-I716 HydrophobicContact CB-CD1 4.39Å; K712-I716 VanDerWaalsContact O-CD1 3.27Å; K712-I716 WeakPolarHBondContact O-CD1 3.42Å; K712-I716 WeakPolarHBondContact O-CG1 3.28Å
713	A	87.6	Confident	89.1	Confident	48 Å²	48	44.2 Å²	44.2	40%	0.397	27%	0.266	S	S	.	.	H	α-helix	trans	-69.4	-39.2	-167.1	0	0	0	0	0	114.2	I716 L717	A713-I716 PolarHBondContact O-N 3.42Å; A713-L717 WeakPolarHBondContact O-CB 3.32Å; A713-L717 VanDerWaalsContact O-CG 3.3Å; A713-L717 WeakPolarHBondContact O-CG 3.38Å; A713-L717 PolarHBondContact O-N 2.9Å
714	A	89.5	Confident	89.2	Confident	21 Å²	21	43 Å²	43	17%	0.174	27%	0.266	C	S	.	.	H	α-helix	trans	-64.5	-50.1	-174	0	0	0	0	0	113.2	F707 I716 L717 F718	F707-A714 HydrophobicContact CD1-CB 4.16Å; F707-A714 HydrophobicContact CD2-CB 4.49Å; F707-A714 HydrophobicContact CE1-CB 4.13Å; F707-A714 HydrophobicContact CE2-CB 4.47Å; F707-A714 HydrophobicContact CG-CB 4.34Å; F707-A714 HydrophobicContact CZ-CB 4.3Å; A714-I716 VanDerWaalsContact C-N 3.33Å; A714-I716 PolarHBondContact O-N 2.75Å; A714-L717 PolarHBondContact O-N 3.34Å; A714-F718 HydrophobicContact CB-CD2 4.48Å; A714-F718 HydrophobicContact CB-CE2 4.18Å; A714-F718 WeakPolarHBondContact O-CD2 3.3Å; A714-F718 WeakPolarHBondContact O-CG 3.42Å; A714-F718 PolarHBondContact O-N 2.83Å
715	P	90.6	Very high	89.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.5	-41.4	173.4	-27.9	37.4	0	0	0	113.5	W467 F704 F707 F718 A719	W467-P715 HydrophobicContact CD2-CB 4.39Å; W467-P715 HydrophobicContact CZ2-CB 4.32Å; W467-P715 HydrophobicContact CZ2-CG 4.38Å; F704-P715 HydrophobicContact CB-CB 4.35Å; F704-P715 HydrophobicContact CD1-CB 4.28Å; F704-P715 HydrophobicContact CD2-CB 4.16Å; F704-P715 HydrophobicContact CG-CB 4.01Å; F707-P715 HydrophobicContact CB-CG 3.65Å; F707-P715 HydrophobicContact CD2-CG 4.15Å; F707-P715 HydrophobicContact CG-CG 4.19Å; P715-F718 PolarHBondContact O-N 3.39Å; P715-A719 VanDerWaalsContact O-CB 3.22Å; P715-A719 WeakPolarHBondContact O-CB 3.25Å; P715-A719 PolarHBondContact O-N 2.87Å
716	I	90.4	Very high	89.5	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-63.7	-44.7	178.9	-65.6	167.8	0	0	0	111.2	W467 C639 L642 K712 A713 A714 S720	W467-I716 HydrophobicContact CH2-CD1 4.3Å; W467-I716 HydrophobicContact CH2-CG1 4.23Å; C639-I716 VanDerWaalsContact O-CG2 3.24Å; C639-I716 WeakPolarHBondContact O-CG2 3.49Å; L642-I716 HydrophobicContact CB-CD1 3.58Å; L642-I716 HydrophobicContact CB-CG1 3.97Å; L642-I716 HydrophobicContact CD1-CG1 4.37Å; K712-I716 HydrophobicContact CB-CD1 4.39Å; K712-I716 VanDerWaalsContact O-CD1 3.27Å; K712-I716 WeakPolarHBondContact O-CD1 3.42Å; K712-I716 WeakPolarHBondContact O-CG1 3.28Å; A713-I716 PolarHBondContact O-N 3.42Å; A714-I716 VanDerWaalsContact C-N 3.33Å; A714-I716 PolarHBondContact O-N 2.75Å; I716-S720 VanDerWaalsContact O-CB 3.32Å; I716-S720 WeakPolarHBondContact O-CB 3.46Å; I716-S720 PolarHBondContact O-N 2.67Å; I716-S720 PolarHBondContact O-OG 3.13Å
717	L	90.9	Very high	89.7	Confident	112 Å²	112	42.8 Å²	42.8	59%	0.586	26%	0.258	S	S	*	.	H	α-helix	trans	-68.1	-42.4	178.9	-72.3	171.5	0	0	0	112	A713 A714 S720 A721	A713-L717 WeakPolarHBondContact O-CB 3.32Å; A713-L717 VanDerWaalsContact O-CG 3.3Å; A713-L717 WeakPolarHBondContact O-CG 3.38Å; A713-L717 PolarHBondContact O-N 2.9Å; A714-L717 PolarHBondContact O-N 3.34Å; L717-S720 PolarHBondContact O-OG 2.82Å; L717-A721 WeakPolarHBondContact O-CB 3.24Å; L717-A721 PolarHBondContact O-N 3.38Å
718	F	92.7	Very high	89.8	Confident	99 Å²	99	43.5 Å²	43.5	43%	0.434	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-45.2	174.7	-69	-47.2	0	0	0	111.9	F459 F704 F707 A714 P715 A722	F459-F718 HydrophobicContact CE1-CB 4.25Å; F704-F718 HydrophobicContact CE1-CB 3.92Å; F704-F718 HydrophobicContact CZ-CB 4.21Å; F707-F718 HydrophobicContact CE2-CD2 4.42Å; F707-F718 AromaticContact CE2-CE2 3.9Å; F707-F718 HydrophobicContact CE2-CE2 3.9Å; F707-F718 HydrophobicContact CZ-CE2 4.13Å; A714-F718 HydrophobicContact CB-CD2 4.48Å; A714-F718 HydrophobicContact CB-CE2 4.18Å; A714-F718 WeakPolarHBondContact O-CD2 3.3Å; A714-F718 WeakPolarHBondContact O-CG 3.42Å; A714-F718 PolarHBondContact O-N 2.83Å; P715-F718 PolarHBondContact O-N 3.39Å; F718-A722 VanDerWaalsContact O-CB 3.28Å; F718-A722 WeakPolarHBondContact O-CB 3.25Å; F718-A722 PolarHBondContact O-N 2.83Å
719	A	92.3	Very high	90.2	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.4	-43.3	-178.9	0	0	0	0	0	112.8	S460 L464 F704 P715 L723	S460-A719 VanDerWaalsContact OG-CA 3.28Å; S460-A719 WeakPolarHBondContact OG-CA 3.43Å; S460-A719 PolarHBondContact OG-O 2.94Å; L464-A719 HydrophobicContact CD1-CB 3.64Å; L464-A719 HydrophobicContact CD2-CB 4.11Å; L464-A719 HydrophobicContact CG-CB 3.8Å; F704-A719 HydrophobicContact CE2-CB 3.98Å; F704-A719 HydrophobicContact CZ-CB 4.04Å; P715-A719 VanDerWaalsContact O-CB 3.22Å; P715-A719 WeakPolarHBondContact O-CB 3.25Å; P715-A719 PolarHBondContact O-N 2.87Å; A719-L723 WeakPolarHBondContact O-CB 3.43Å; A719-L723 VanDerWaalsContact O-CG 3.28Å; A719-L723 WeakPolarHBondContact O-CG 3.28Å; A719-L723 PolarHBondContact O-N 3.3Å
720	S	92.1	Very high	90.6	Very high	18 Å²	18	42.4 Å²	42.4	13%	0.126	25%	0.252	C	S	.	.	H	α-helix	trans	-69	-42.5	177.7	53.9	0	0	0	0	112.4	C636 I716 L717 A722 L723 A724	C636-S720 PolarHBondContact SG-O 2.86Å; C636-S720 VanDerWaalsContact SG-O 3.39Å; I716-S720 VanDerWaalsContact O-CB 3.32Å; I716-S720 WeakPolarHBondContact O-CB 3.46Å; I716-S720 PolarHBondContact O-N 2.67Å; I716-S720 PolarHBondContact O-OG 3.13Å; L717-S720 PolarHBondContact O-OG 2.82Å; S720-A722 PolarHBondContact O-N 2.81Å; S720-L723 PolarHBondContact O-N 2.77Å; S720-A724 WeakPolarHBondContact O-CB 3.49Å; S720-A724 PolarHBondContact O-N 2.65Å
721	A	92.8	Very high	90.7	Very high	52 Å²	52	41.7 Å²	41.7	43%	0.43	25%	0.249	S	C	.	.	H	α-helix	trans	-61.8	-43.6	174.5	0	0	0	0	0	112.1	L717 A724 L725	L717-A721 WeakPolarHBondContact O-CB 3.24Å; L717-A721 PolarHBondContact O-N 3.38Å; A721-A724 PolarHBondContact O-N 3.25Å; A721-L725 WeakPolarHBondContact O-CB 3.39Å; A721-L725 VanDerWaalsContact O-CG 3.32Å; A721-L725 WeakPolarHBondContact O-CG 3.41Å; A721-L725 PolarHBondContact O-N 2.92Å
722	A	93.6	Very high	90.8	Very high	11 Å²	11	44.7 Å²	44.7	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-63.1	-44.7	176.1	0	0	0	0	0	111.9	T456 F459 S460 F718 S720 A724 L725 G726	T456-A722 WeakPolarHBondContact CB-O 3.49Å; T456-A722 HydrophobicContact CG2-CB 4.27Å; F459-A722 HydrophobicContact CD1-CB 4.17Å; S460-A722 WeakPolarHBondContact OG-CB 3.49Å; F718-A722 VanDerWaalsContact O-CB 3.28Å; F718-A722 WeakPolarHBondContact O-CB 3.25Å; F718-A722 PolarHBondContact O-N 2.83Å; S720-A722 PolarHBondContact O-N 2.81Å; A722-A724 PolarHBondContact O-N 3.3Å; A722-L725 PolarHBondContact O-N 2.69Å; A722-G726 PolarHBondContact O-N 3.08Å
723	L	93	Very high	90.9	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-37.4	176.5	-72.1	167.6	0	0	0	112.8	M457 C636 F658 A719 S720 G726 S727	M457-L723 HydrophobicContact CG-CD2 4.23Å; C636-L723 HydrophobicContact CB-CB 4.14Å; F658-L723 HydrophobicContact CE2-CD1 4.05Å; A719-L723 WeakPolarHBondContact O-CB 3.43Å; A719-L723 VanDerWaalsContact O-CG 3.28Å; A719-L723 WeakPolarHBondContact O-CG 3.28Å; A719-L723 PolarHBondContact O-N 3.3Å; S720-L723 PolarHBondContact O-N 2.77Å; L723-G726 PolarHBondContact O-N 2.99Å; L723-S727 WeakPolarHBondContact O-CB 3.48Å; L723-S727 PolarHBondContact O-N 3.04Å
724	A	92.8	Very high	90.7	Very high	42 Å²	42	43.2 Å²	43.2	35%	0.347	25%	0.248	S	C	.	.	H	α-helix	trans	-65.8	-41.6	175.4	0	0	0	0	0	112.4	S720 A721 A722 S728	S720-A724 WeakPolarHBondContact O-CB 3.49Å; S720-A724 PolarHBondContact O-N 2.65Å; A721-A724 PolarHBondContact O-N 3.25Å; A722-A724 PolarHBondContact O-N 3.3Å; A724-S728 WeakPolarHBondContact O-CB 3.43Å; A724-S728 PolarHBondContact O-N 3.06Å; A724-S728 PolarHBondContact O-OG 3.19Å
725	L	92.9	Very high	90.1	Very high	110 Å²	110	44.4 Å²	44.4	58%	0.576	25%	0.249	S	C	*	.	H	α-helix	trans	-64.8	-46.4	173.2	-72	169.8	0	0	0	111.4	A721 A722 S727 S728 L729	A721-L725 WeakPolarHBondContact O-CB 3.39Å; A721-L725 VanDerWaalsContact O-CG 3.32Å; A721-L725 WeakPolarHBondContact O-CG 3.41Å; A721-L725 PolarHBondContact O-N 2.92Å; A722-L725 PolarHBondContact O-N 2.69Å; L725-S727 PolarHBondContact O-N 3.02Å; L725-S728 CarbonylContact O-C 3.57Å; L725-S728 PolarHBondContact O-N 3.32Å; L725-S728 VanDerWaalsContact O-N 3.11Å; L725-L729 WeakPolarHBondContact O-CG 3.45Å; L725-L729 PolarHBondContact O-N 2.94Å
726	G	91.8	Very high	89.3	Confident	5 Å²	5	44.5 Å²	44.5	5%	0.052	25%	0.25	C	S	.	.	H	α-helix	trans	-56.4	-47.7	175	0	0	0	0	0	112.1	T456 A722 L723 S728 L729 A730	T456-G726 VanDerWaalsContact OG1-CA 3.28Å; T456-G726 WeakPolarHBondContact OG1-CA 3.36Å; A722-G726 PolarHBondContact O-N 3.08Å; L723-G726 PolarHBondContact O-N 2.99Å; G726-S728 VanDerWaalsContact C-N 3.31Å; G726-S728 PolarHBondContact O-N 2.9Å; G726-L729 PolarHBondContact O-N 2.82Å; G726-A730 WeakPolarHBondContact O-CB 3.49Å; G726-A730 PolarHBondContact O-N 2.76Å
727	S	91.4	Very high	88.1	Confident	4 Å²	4	49.3 Å²	49.3	3%	0.028	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-35	175.3	-172.7	0	0	0	0	113.1	A629 V633 L723 L725 L729 A730 L731	A629-S727 PolarHBondContact O-OG 3Å; V633-S727 WeakPolarHBondContact CG2-OG 3.46Å; L723-S727 WeakPolarHBondContact O-CB 3.48Å; L723-S727 PolarHBondContact O-N 3.04Å; L725-S727 PolarHBondContact O-N 3.02Å; S727-L729 VanDerWaalsContact C-N 3.34Å; S727-A730 PolarHBondContact O-N 2.71Å; S727-L731 WeakPolarHBondContact O-CG 3.3Å; S727-L731 PolarHBondContact O-N 3.18Å; S727-L731 VanDerWaalsContact O-N 3.16Å
728	S	91.6	Very high	86.5	Confident	68 Å²	68	46.6 Å²	46.6	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-75.4	-22.4	178.7	-67.4	0	0	0	0	113.4	A724 L725 G726	A724-S728 WeakPolarHBondContact O-CB 3.43Å; A724-S728 PolarHBondContact O-N 3.06Å; A724-S728 PolarHBondContact O-OG 3.19Å; L725-S728 CarbonylContact O-C 3.57Å; L725-S728 PolarHBondContact O-N 3.32Å; L725-S728 VanDerWaalsContact O-N 3.11Å; G726-S728 VanDerWaalsContact C-N 3.31Å; G726-S728 PolarHBondContact O-N 2.9Å
729	L	91.8	Very high	85.3	Confident	54 Å²	54	46.8 Å²	46.8	28%	0.283	27%	0.269	S	S	.	.	H	α-helix	trans	-80.5	-42.7	167.5	-70.3	173.1	0	0	0	111.3	V453 L725 G726 S727 L731 K732	V453-L729 HydrophobicContact CG2-CB 3.82Å; L725-L729 WeakPolarHBondContact O-CG 3.45Å; L725-L729 PolarHBondContact O-N 2.94Å; G726-L729 PolarHBondContact O-N 2.82Å; S727-L729 VanDerWaalsContact C-N 3.34Å; L729-L731 VanDerWaalsContact C-N 3.32Å; L729-L731 PolarHBondContact O-N 3.4Å; L729-K732 WeakPolarHBondContact O-CB 3.38Å; L729-K732 PolarHBondContact O-N 2.92Å
730	A	89.3	Confident	83.8	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-55.7	-44.9	178.6	0	0	0	0	0	111.8	V453 L625 L628 G726 S727 K732 L733	V453-A730 HydrophobicContact CG2-CB 4.25Å; L625-A730 WeakPolarHBondContact CD1-O 3.49Å; L628-A730 HydrophobicContact CD2-CB 3.9Å; L628-A730 HydrophobicContact CG-CB 4Å; G726-A730 WeakPolarHBondContact O-CB 3.49Å; G726-A730 PolarHBondContact O-N 2.76Å; S727-A730 PolarHBondContact O-N 2.71Å; A730-K732 PolarHBondContact O-N 2.86Å; A730-L733 PolarHBondContact O-N 2.75Å; A730-L733 VanDerWaalsContact O-N 3.12Å
731	L	87.6	Confident	82.3	Confident	106 Å²	106	48.6 Å²	48.6	56%	0.555	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-4.3	176.3	-69.3	172.4	0	0	0	115.3	A629 S727 L729	A629-L731 HydrophobicContact CB-CD2 3.6Å; A629-L731 HydrophobicContact CB-CG 3.81Å; S727-L731 WeakPolarHBondContact O-CG 3.3Å; S727-L731 PolarHBondContact O-N 3.18Å; S727-L731 VanDerWaalsContact O-N 3.16Å; L729-L731 VanDerWaalsContact C-N 3.32Å; L729-L731 PolarHBondContact O-N 3.4Å
732	K	87.9	Confident	80	Confident	127 Å²	127	49.8 Å²	49.8	55%	0.552	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-2.1	177.8	-61	179.4	-176.2	177.8	0	114	M449 L729 A730	M449-K732 HydrophobicContact CE-CB 3.96Å; M449-K732 HydrophobicContact CE-CD 4.39Å; M449-K732 HydrophobicContact SD-CB 4.01Å; L729-K732 WeakPolarHBondContact O-CB 3.38Å; L729-K732 PolarHBondContact O-N 2.92Å; A730-K732 PolarHBondContact O-N 2.86Å
733	L	86.8	Confident	79.3	Confident	9 Å²	9	51.7 Å²	51.7	5%	0.047	28%	0.284	C	S	.	.	S	Bend	trans	-81.1	155.8	171.4	-66.7	165.9	0	0	0	110.5	I446 M449 M450 L625 L672 A730	I446-L733 HydrophobicContact CG2-CD2 4.23Å; M449-L733 HydrophobicContact CB-CD2 3.62Å; M449-L733 HydrophobicContact CB-CG 4.27Å; M449-L733 HydrophobicContact SD-CD2 4.45Å; M450-L733 HydrophobicContact CG-CD1 4.45Å; M450-L733 HydrophobicContact CG-CD2 4.11Å; M450-L733 HydrophobicContact SD-CD1 3.43Å; M450-L733 WeakPolarHBondContact SD-CD1 3.38Å; M450-L733 HydrophobicContact SD-CD2 4.1Å; M450-L733 HydrophobicContact SD-CG 4.43Å; L625-L733 HydrophobicContact CD1-CB 3.74Å; L625-L733 WeakPolarHBondContact CD2-O 3.42Å; L672-L733 HydrophobicContact CD2-CD1 3.95Å; A730-L733 PolarHBondContact O-N 2.75Å; A730-L733 VanDerWaalsContact O-N 3.12Å
734	P	82.3	Confident	78.6	Confident	58 Å²	58	54.2 Å²	54.2	38%	0.377	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-71.4	146	173.2	30.3	-33.5	0	0	0	111.5	L676	L676-P734 HydrophobicContact CD2-CG 3.69Å
735	E	77.6	Confident	77.8	Confident	46 Å²	46	54.8 Å²	54.8	22%	0.215	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-80.3	116.5	171.9	175.6	96.2	-94.3	0	0	109.4	R624 L625 R626 R737	R624-E735 PolarHBondContact N-OE1 2.91Å; L625-E735 HydrophobicContact CB-CB 4.3Å; L625-E735 WeakPolarHBondContact CB-OE1 3.32Å; L625-E735 HydrophobicContact CD2-CB 4.22Å; L625-E735 PolarHBondContact N-OE1 3.06Å; R626-E735 IonicContact CZ-OE2 3.88Å; R626-E735 IonicContact NE-OE2 2.75Å; R626-E735 PolarHBondContact NE-OE2 3Å; R626-E735 IonicContact NH2-OE2 3.7Å; R626-E735 PolarHBondContact NH2-OE2 2.67Å; E735-R737 VanDerWaalsContact C-N 3.33Å; E735-R737 HydrophobicContact CG-CB 3.9Å
736	T	74.6	Confident	77	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.012	28%	0.279	C	S	.	.			trans	-83.1	-3.8	-178.1	54.3	0	0	0	0	114.3	L672 E675 L676 G738 Q739	L672-T736 HydrophobicContact CD1-CG2 3.73Å; E675-T736 HydrophobicContact CB-CG2 3.8Å; E675-T736 WeakPolarHBondContact OE2-CB 3.36Å; E675-T736 PolarHBondContact OE2-OG1 3.44Å; L676-T736 HydrophobicContact CD2-CG2 3.85Å; L676-T736 HydrophobicContact CG-CG2 4.1Å; T736-G738 PolarHBondContact O-N 3.48Å; T736-G738 VanDerWaalsContact O-N 3.12Å; T736-Q739 WeakPolarHBondContact O-CB 3.35Å; T736-Q739 PolarHBondContact O-N 2.81Å
737	R	64.3	Low	76	Confident	107 Å²	107	54.5 Å²	54.5	40%	0.404	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	116.5	-176.5	-177.5	-175.8	178.4	177.6	-1.4	110.7	D620 K621 E735	D620-R737 VanDerWaalsContact O-CZ 3.22Å; D620-R737 PolarHBondContact O-NH2 2.84Å; K621-R737 PolarHBondContact O-NH1 2.73Å; K621-R737 PolarHBondContact O-NH2 2.77Å; E735-R737 VanDerWaalsContact C-N 3.33Å; E735-R737 HydrophobicContact CG-CB 3.9Å
738	G	58.4	Low	75	Confident	54 Å²	54	57.9 Å²	57.9	56%	0.557	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	24	-179.7	0	0	0	0	0	114	Q286 T736	Q286-G738 PolarHBondContact NE2-O 3.41Å; T736-G738 PolarHBondContact O-N 3.48Å; T736-G738 VanDerWaalsContact O-N 3.12Å
739	Q	67.1	Low	73.8	Confident	103 Å²	103	57.1 Å²	57.1	48%	0.481	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-101.1	142.2	169.3	-64.4	-175.1	-13.5	0	0	111.5	Q286 R289 T736	Q286-Q739 PolarHBondContact NE2-O 3.48Å; R289-Q739 PolarHBondContact NH2-O 3.38Å; T736-Q739 WeakPolarHBondContact O-CB 3.35Å; T736-Q739 PolarHBondContact O-N 2.81Å
740	V	60.3	Low	72.4	Confident	49 Å²	49	57.4 Å²	57.4	30%	0.297	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-75.5	141.3	176.9	-177.6	0	0	0	0	107.5	A149 E153 Q286 Q742	A149-V740 HydrophobicContact CB-CG1 4.11Å; A149-V740 WeakPolarHBondContact O-CG1 3.45Å; E153-V740 HydrophobicContact CB-CG1 4.01Å; E153-V740 HydrophobicContact CG-CG1 4.48Å; E153-V740 HydrophobicContact CG-CG2 4.45Å; Q286-V740 VanDerWaalsContact NE2-N 3.18Å; V740-Q742 PolarHBondContact O-N 2.88Å
741	L	60.3	Low	71	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.037	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-68.7	120	175.3	-71	169.7	0	0	0	109	A149 R359 E675	A149-L741 WeakPolarHBondContact CB-O 3.23Å; R359-L741 PolarHBondContact NH1-O 3.13Å; R359-L741 PolarHBondContact NH2-O 3.08Å; E675-L741 HydrophobicContact CB-CD2 4.48Å; E675-L741 HydrophobicContact CG-CD2 4.37Å
742	Q	45.4	Very low	69.5	Low	77 Å²	77	58.1 Å²	58.1	36%	0.36	30%	0.303	S	S	.	.			trans	-69.7	0	164.3	-60.8	-171.8	-37	0	0	111.1	E146 R359 P678 S679 R682 V740	E146-Q742 PolarHBondContact OE1-NE2 2.82Å; R359-Q742 PolarHBondContact NH1-O 3.3Å; P678-Q742 WeakPolarHBondContact CA-O 3.37Å; P678-Q742 HydrophobicContact CB-CB 4.08Å; P678-Q742 VanDerWaalsContact CB-OXT 3.26Å; P678-Q742 WeakPolarHBondContact CB-OXT 3.24Å; S679-Q742 PolarHBondContact N-O 3.3Å; R682-Q742 PolarHBondContact NH2-O 3.4Å; R682-Q742 VanDerWaalsContact NH2-O 3.09Å; V740-Q742 PolarHBondContact O-N 2.88Å

Retrieved 742 of 742 residues in 4984.3 ms (Link to these results)

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