A0A087XIB0_POEFO Loading...

Nucleobindin 2a

AlphaFold DB , UniProt , Accession A0A087XIB0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 496 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.2	Low	53.4	Low	243 Å²	243	135.3 Å²	135.3	100%	1.197	66%	0.659	S	S	*	*				0	48.6	0	-166.2	167.5	177.1	0	0	110.1
2	G	54.2	Low	53.9	Low	35 Å²	35	130 Å²	130	36%	0.361	65%	0.646	S	S	.	*			trans	-126.7	-33.1	-175.2	0	0	0	0	0	114.3	R4 V5	G2-R4 VanDerWaalsContact C-N 3.29Å; G2-R4 PolarHBondContact O-N 3.28Å; G2-V5 PolarHBondContact O-N 3.31Å; G2-V5 VanDerWaalsContact O-N 3.08Å
3	D	53	Low	54.3	Low	128 Å²	128	134.7 Å²	134.7	68%	0.684	65%	0.652	S	S	*	*	H	α-helix	trans	-66.6	-30.5	-165.9	-38.4	-82.6	0	0	0	112.6	V5	D3-V5 PolarHBondContact O-N 3.03Å
4	R	49.3	Very low	55.1	Low	218 Å²	218	129.4 Å²	129.4	82%	0.823	64%	0.641	S	S	*	*	H	α-helix	trans	-72.1	-9.9	178.9	-159.9	177	-76.3	-164.3	-2.5	113.6	G2	G2-R4 VanDerWaalsContact C-N 3.29Å; G2-R4 PolarHBondContact O-N 3.28Å
5	V	54.6	Low	55.9	Low	86 Å²	86	128.2 Å²	128.2	52%	0.521	64%	0.637	S	S	.	*	H	α-helix	trans	-89.8	-47.3	176.6	-176.7	0	0	0	0	111.2	G2 D3 I7 K8 M9	G2-V5 PolarHBondContact O-N 3.31Å; G2-V5 VanDerWaalsContact O-N 3.08Å; D3-V5 PolarHBondContact O-N 3.03Å; V5-I7 VanDerWaalsContact C-N 3.33Å; V5-I7 PolarHBondContact O-N 3.4Å; V5-K8 PolarHBondContact O-N 3.19Å; V5-M9 HydrophobicContact CG1-SD 4.14Å; V5-M9 PolarHBondContact O-N 2.72Å
6	H	51.4	Low	56.6	Low	135 Å²	135	127.4 Å²	127.4	63%	0.625	64%	0.636	S	S	*	*	H	α-helix	trans	-59.7	-40.3	-178.2	-81.3	-83.1	0	0	0	113.1	K8 M9 C10	H6-K8 VanDerWaalsContact C-N 3.33Å; H6-K8 PolarHBondContact O-N 2.74Å; H6-M9 PolarHBondContact O-N 3.01Å; H6-C10 PolarHBondContact O-N 3.04Å
7	I	54.3	Low	57.4	Low	106 Å²	106	125 Å²	125	54%	0.544	63%	0.629	S	S	.	*	H	α-helix	trans	-59.2	-44.2	178.8	-61.9	171.6	0	0	0	110.9	V5 M9 C10 W11	V5-I7 VanDerWaalsContact C-N 3.33Å; V5-I7 PolarHBondContact O-N 3.4Å; I7-M9 PolarHBondContact O-N 2.76Å; I7-C10 PolarHBondContact O-N 3.33Å; I7-W11 PolarHBondContact O-N 3.47Å; I7-W11 VanDerWaalsContact O-N 3.11Å
8	K	54.4	Low	58.2	Low	156 Å²	156	120.2 Å²	120.2	68%	0.678	62%	0.616	S	S	*	*	H	α-helix	trans	-63.4	-43	178	-71.8	-167.1	171.4	-165.6	0	112.2	V5 H6 C10 W11 S12	V5-K8 PolarHBondContact O-N 3.19Å; H6-K8 VanDerWaalsContact C-N 3.33Å; H6-K8 PolarHBondContact O-N 2.74Å; K8-C10 PolarHBondContact O-N 3.46Å; K8-W11 PolarHBondContact O-N 3.18Å; K8-S12 PolarHBondContact O-N 3.48Å; K8-S12 PolarHBondContact O-OG 2.66Å
9	M	52.7	Low	58.9	Low	113 Å²	113	123.2 Å²	123.2	56%	0.557	62%	0.619	S	S	*	*	H	α-helix	trans	-65.7	-35.1	179.1	-72.4	172.9	63.5	0	0	113	V5 H6 I7 R13	V5-M9 HydrophobicContact CG1-SD 4.14Å; V5-M9 PolarHBondContact O-N 2.72Å; H6-M9 PolarHBondContact O-N 3.01Å; I7-M9 PolarHBondContact O-N 2.76Å; M9-R13 WeakPolarHBondContact O-CG 3.32Å; M9-R13 PolarHBondContact O-N 3.42Å
10	C	54.2	Low	59.6	Low	83 Å²	83	121.4 Å²	121.4	56%	0.561	61%	0.614	S	S	*	*	H	α-helix	trans	-67	-43.6	173.2	-70.4	0	0	0	0	112.1	H6 I7 K8 R13 A14	H6-C10 PolarHBondContact O-N 3.04Å; I7-C10 PolarHBondContact O-N 3.33Å; K8-C10 PolarHBondContact O-N 3.46Å; C10-R13 PolarHBondContact O-N 3.07Å; C10-A14 PolarHBondContact O-N 2.99Å
11	W	55.6	Low	60.2	Low	185 Å²	185	121.2 Å²	121.2	70%	0.701	61%	0.614	S	S	*	*	H	α-helix	trans	-67.3	-42.3	-178.9	-78.7	49.9	0	0	0	112.4	I7 K8 R13 A14 L15	I7-W11 PolarHBondContact O-N 3.47Å; I7-W11 VanDerWaalsContact O-N 3.11Å; K8-W11 PolarHBondContact O-N 3.18Å; W11-R13 VanDerWaalsContact C-N 3.3Å; W11-R13 PolarHBondContact O-N 3.27Å; W11-A14 PolarHBondContact O-N 3.42Å; W11-L15 WeakPolarHBondContact O-CG 3.27Å; W11-L15 PolarHBondContact O-N 2.74Å
12	S	59.5	Low	61	Low	72 Å²	72	114.7 Å²	114.7	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-62.1	-36.5	173.5	-64.8	0	0	0	0	112.7	K8 L16	K8-S12 PolarHBondContact O-N 3.48Å; K8-S12 PolarHBondContact O-OG 2.66Å; S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 2.82Å; S12-L16 VanDerWaalsContact O-N 3.09Å
13	R	60.1	Low	61.7	Low	191 Å²	191	117.7 Å²	117.7	72%	0.721	59%	0.591	S	S	*	*	H	α-helix	trans	-67.6	-44	174.9	-82.3	-178.3	160	-171.4	-7.4	112.4	M9 C10 W11 L15 L16 T17	M9-R13 WeakPolarHBondContact O-CG 3.32Å; M9-R13 PolarHBondContact O-N 3.42Å; C10-R13 PolarHBondContact O-N 3.07Å; W11-R13 VanDerWaalsContact C-N 3.3Å; W11-R13 PolarHBondContact O-N 3.27Å; R13-L15 PolarHBondContact O-N 2.8Å; R13-L16 PolarHBondContact O-N 2.68Å; R13-T17 PolarHBondContact O-N 3.02Å; R13-T17 PolarHBondContact O-OG1 2.91Å; R13-T17 VanDerWaalsContact O-OG1 3.1Å
14	A	64.8	Low	62.5	Low	61 Å²	61	114.8 Å²	114.8	50%	0.504	58%	0.578	S	S	.	*	H	α-helix	trans	-60.7	-42.9	177.4	0	0	0	0	0	112.3	C10 W11 T17 G18	C10-A14 PolarHBondContact O-N 2.99Å; W11-A14 PolarHBondContact O-N 3.42Å; A14-T17 WeakPolarHBondContact CA-OG1 3.25Å; A14-T17 PolarHBondContact O-N 3.5Å; A14-T17 PolarHBondContact O-OG1 3.23Å; A14-G18 PolarHBondContact O-N 3.44Å
15	L	66.5	Low	63.2	Low	111 Å²	111	110.8 Å²	110.8	58%	0.581	57%	0.569	S	S	*	*	H	α-helix	trans	-63.3	-44.4	175.3	-73.7	165.6	0	0	0	112.1	W11 R13 T17 G18 W19	W11-L15 WeakPolarHBondContact O-CG 3.27Å; W11-L15 PolarHBondContact O-N 2.74Å; R13-L15 PolarHBondContact O-N 2.8Å; L15-T17 PolarHBondContact O-N 3.12Å; L15-G18 PolarHBondContact O-N 2.97Å; L15-W19 PolarHBondContact O-N 2.89Å
16	L	68.6	Low	63.5	Low	116 Å²	116	111.6 Å²	111.6	61%	0.607	57%	0.569	S	S	*	*	H	α-helix	trans	-60.7	-43.2	175.2	-89.9	158.9	0	0	0	112.4	S12 R13 G18 W19 V20	S12-L16 WeakPolarHBondContact O-CB 3.42Å; S12-L16 PolarHBondContact O-N 2.82Å; S12-L16 VanDerWaalsContact O-N 3.09Å; R13-L16 PolarHBondContact O-N 2.68Å; L16-G18 VanDerWaalsContact C-N 3.34Å; L16-G18 PolarHBondContact O-N 3.03Å; L16-W19 PolarHBondContact O-N 2.72Å; L16-V20 WeakPolarHBondContact O-CG2 3.27Å; L16-V20 PolarHBondContact O-N 3.36Å
17	T	69.4	Low	63.7	Low	86 Å²	86	112.3 Å²	112.3	53%	0.528	57%	0.573	S	S	.	*	H	α-helix	trans	-66.2	-35.1	175.6	45.8	0	0	0	0	112.9	R13 A14 L15 L21	R13-T17 PolarHBondContact O-N 3.02Å; R13-T17 PolarHBondContact O-OG1 2.91Å; R13-T17 VanDerWaalsContact O-OG1 3.1Å; A14-T17 WeakPolarHBondContact CA-OG1 3.25Å; A14-T17 PolarHBondContact O-N 3.5Å; A14-T17 PolarHBondContact O-OG1 3.23Å; L15-T17 PolarHBondContact O-N 3.12Å; T17-L21 WeakPolarHBondContact O-CG 3.47Å; T17-L21 PolarHBondContact O-N 2.64Å
18	G	72	Confident	63.7	Low	38 Å²	38	116.3 Å²	116.3	39%	0.392	58%	0.583	S	S	.	*	H	α-helix	trans	-65	-44.3	174.4	0	0	0	0	0	112.6	A14 L15 L16 L21 L22	A14-G18 PolarHBondContact O-N 3.44Å; L15-G18 PolarHBondContact O-N 2.97Å; L16-G18 VanDerWaalsContact C-N 3.34Å; L16-G18 PolarHBondContact O-N 3.03Å; G18-L21 PolarHBondContact O-N 2.69Å; G18-L22 WeakPolarHBondContact O-CB 3.33Å; G18-L22 PolarHBondContact O-N 2.65Å
19	W	70.9	Confident	63.4	Low	177 Å²	177	115.4 Å²	115.4	67%	0.67	59%	0.585	S	S	*	*	H	α-helix	trans	-64.4	-39.5	175.9	-89.6	75.6	0	0	0	112.9	L15 L16 L22 L23	L15-W19 PolarHBondContact O-N 2.89Å; L16-W19 PolarHBondContact O-N 2.72Å; W19-L22 PolarHBondContact O-N 3.2Å; W19-L23 WeakPolarHBondContact O-CB 3.43Å; W19-L23 WeakPolarHBondContact O-CG 3.15Å; W19-L23 PolarHBondContact O-N 2.9Å
20	V	73.8	Confident	63.1	Low	87 Å²	87	118.3 Å²	118.3	53%	0.527	60%	0.597	S	S	.	*	H	α-helix	trans	-65.1	-42.7	175.1	171	0	0	0	0	111.4	L16 L22 L23 V24	L16-V20 WeakPolarHBondContact O-CG2 3.27Å; L16-V20 PolarHBondContact O-N 3.36Å; V20-L22 PolarHBondContact O-N 3.22Å; V20-L23 PolarHBondContact O-N 3.21Å; V20-V24 WeakPolarHBondContact O-CG2 3.41Å; V20-V24 PolarHBondContact O-N 3.16Å
21	L	70.8	Confident	63	Low	118 Å²	118	118.7 Å²	118.7	62%	0.618	61%	0.606	S	S	*	*	H	α-helix	trans	-62.6	-41.4	175.2	-76.7	166.4	0	0	0	112.1	T17 G18 V24 Q25	T17-L21 WeakPolarHBondContact O-CG 3.47Å; T17-L21 PolarHBondContact O-N 2.64Å; G18-L21 PolarHBondContact O-N 2.69Å; L21-V24 PolarHBondContact O-N 2.72Å; L21-Q25 WeakPolarHBondContact O-CG 3.46Å; L21-Q25 PolarHBondContact O-N 2.76Å
22	L	70.2	Confident	62.4	Low	106 Å²	106	116 Å²	116	56%	0.555	61%	0.61	S	S	*	*	H	α-helix	trans	-67.7	-37.4	178.9	-169.2	143.6	0	0	0	112.2	G18 W19 V20 Q25 L26	G18-L22 WeakPolarHBondContact O-CB 3.33Å; G18-L22 PolarHBondContact O-N 2.65Å; W19-L22 PolarHBondContact O-N 3.2Å; V20-L22 PolarHBondContact O-N 3.22Å; L22-Q25 PolarHBondContact O-N 2.84Å; L22-L26 HydrophobicContact CD2-CD1 3.9Å; L22-L26 PolarHBondContact O-N 2.89Å
23	L	69.8	Low	61.7	Low	98 Å²	98	118.2 Å²	118.2	51%	0.513	62%	0.622	S	S	.	*	H	α-helix	trans	-65.3	-39.6	171.2	-76.9	166.6	0	0	0	112.5	W19 V20 L26 Q27	W19-L23 WeakPolarHBondContact O-CB 3.43Å; W19-L23 WeakPolarHBondContact O-CG 3.15Å; W19-L23 PolarHBondContact O-N 2.9Å; V20-L23 PolarHBondContact O-N 3.21Å; L23-L26 WeakPolarHBondContact O-CB 3.36Å; L23-L26 PolarHBondContact O-N 3.46Å; L23-Q27 VanDerWaalsContact O-CG 3.27Å; L23-Q27 WeakPolarHBondContact O-CG 3.31Å; L23-Q27 PolarHBondContact O-N 2.67Å; L23-Q27 VanDerWaalsContact O-N 3.15Å
24	V	70.6	Confident	61	Low	67 Å²	67	116.4 Å²	116.4	41%	0.406	63%	0.625	S	S	.	*	H	α-helix	trans	-64.4	-42.3	174.6	169.2	0	0	0	0	111.1	V20 L21 L26 Q27 Y28	V20-V24 WeakPolarHBondContact O-CG2 3.41Å; V20-V24 PolarHBondContact O-N 3.16Å; L21-V24 PolarHBondContact O-N 2.72Å; V24-L26 VanDerWaalsContact C-N 3.32Å; V24-L26 PolarHBondContact O-N 3.14Å; V24-Q27 PolarHBondContact O-N 2.95Å; V24-Q27 VanDerWaalsContact O-N 3.08Å; V24-Y28 HydrophobicContact CG1-CD2 4.28Å; V24-Y28 HydrophobicContact CG1-CE2 3.99Å; V24-Y28 WeakPolarHBondContact O-CD2 3.46Å; V24-Y28 PolarHBondContact O-N 3.34Å
25	Q	62.7	Low	59.6	Low	135 Å²	135	117.1 Å²	117.1	63%	0.631	64%	0.639	S	S	*	*	H	α-helix	trans	-60.6	-40.2	174.4	-68.5	-75.4	-89.4	0	0	112	L21 L22 Q27 Y28	L21-Q25 WeakPolarHBondContact O-CG 3.46Å; L21-Q25 PolarHBondContact O-N 2.76Å; L22-Q25 PolarHBondContact O-N 2.84Å; Q25-Q27 VanDerWaalsContact C-N 3.25Å; Q25-Q27 PolarHBondContact O-N 3.45Å; Q25-Y28 PolarHBondContact O-N 3.21Å; Q25-Y28 VanDerWaalsContact O-N 3.11Å
26	L	60.5	Low	58.6	Low	102 Å²	102	118 Å²	118	53%	0.534	64%	0.643	S	S	.	*	H	α-helix	trans	-63	-26.2	173.3	-95.3	154.2	0	0	0	113.9	L22 L23 V24 Y28 L29	L22-L26 HydrophobicContact CD2-CD1 3.9Å; L22-L26 PolarHBondContact O-N 2.89Å; L23-L26 WeakPolarHBondContact O-CB 3.36Å; L23-L26 PolarHBondContact O-N 3.46Å; V24-L26 VanDerWaalsContact C-N 3.32Å; V24-L26 PolarHBondContact O-N 3.14Å; L26-Y28 VanDerWaalsContact C-N 3.33Å; L26-L29 PolarHBondContact O-N 3.23Å
27	Q	56.2	Low	56.9	Low	151 Å²	151	118.1 Å²	118.1	71%	0.706	64%	0.644	S	S	*	*	H	α-helix	trans	-77.1	-18	174.7	-58.2	-127.2	-91.2	0	0	113.3	L23 V24 Q25 L29	L23-Q27 VanDerWaalsContact O-CG 3.27Å; L23-Q27 WeakPolarHBondContact O-CG 3.31Å; L23-Q27 PolarHBondContact O-N 2.67Å; L23-Q27 VanDerWaalsContact O-N 3.15Å; V24-Q27 PolarHBondContact O-N 2.95Å; V24-Q27 VanDerWaalsContact O-N 3.08Å; Q25-Q27 VanDerWaalsContact C-N 3.25Å; Q25-Q27 PolarHBondContact O-N 3.45Å; Q27-L29 VanDerWaalsContact C-N 3.33Å
28	Y	53.8	Low	55.4	Low	189 Å²	189	122.6 Å²	122.6	74%	0.741	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	1.7	173.8	-78.9	-77.4	0	0	0	113.8	V24 Q25 L26	V24-Y28 HydrophobicContact CG1-CD2 4.28Å; V24-Y28 HydrophobicContact CG1-CE2 3.99Å; V24-Y28 WeakPolarHBondContact O-CD2 3.46Å; V24-Y28 PolarHBondContact O-N 3.34Å; Q25-Y28 PolarHBondContact O-N 3.21Å; Q25-Y28 VanDerWaalsContact O-N 3.11Å; L26-Y28 VanDerWaalsContact C-N 3.33Å
29	L	49.3	Very low	53.8	Low	138 Å²	138	126.6 Å²	126.6	72%	0.723	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	16	174.5	-81.3	165.4	0	0	0	113.7	L26 Q27 A31	L26-L29 PolarHBondContact O-N 3.23Å; Q27-L29 VanDerWaalsContact C-N 3.33Å; L29-A31 PolarHBondContact O-N 3.3Å
30	Q	45.1	Very low	52.2	Low	173 Å²	173	127.9 Å²	127.9	81%	0.808	68%	0.683	S	S	*	*			trans	-69.7	114.2	163.6	-67	-154.7	-96.2	0	0	109.2
31	A	52.4	Low	50.2	Low	92 Å²	92	129.7 Å²	129.7	76%	0.76	70%	0.695	S	S	*	*			trans	-56.8	145	175.6	0	0	0	0	0	111.4	L29	L29-A31 PolarHBondContact O-N 3.3Å
32	V	43.8	Very low	48.4	Very low	129 Å²	129	133.2 Å²	133.2	78%	0.782	71%	0.705	S	S	*	*			trans	-63.3	129.3	171.5	179.2	0	0	0	0	108.1	I34	V32-I34 PolarHBondContact O-N 2.82Å
33	P	44.7	Very low	46.6	Very low	117 Å²	117	137 Å²	137	76%	0.76	72%	0.719	S	S	*	*			trans	-69	115.7	176.2	27.9	-33.1	0	0	0	109.7	G35	P33-G35 PolarHBondContact O-N 3.31Å
34	I	45.1	Very low	44.7	Very low	153 Å²	153	138.4 Å²	138.4	79%	0.785	73%	0.733	S	S	*	*			trans	-64	128.4	165.6	-61	176	0	0	0	107.4	V32 I36	V32-I34 PolarHBondContact O-N 2.82Å; I34-I36 VanDerWaalsContact C-N 3.3Å; I34-I36 PolarHBondContact O-N 3.5Å
35	G	35.9	Very low	42.9	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	76%	0.756	S	S	*	*			trans	-80	69	-173.3	0	0	0	0	0	113	P33 D37	P33-G35 PolarHBondContact O-N 3.31Å; G35-D37 PolarHBondContact O-N 3.09Å
36	I	45	Very low	41.5	Very low	130 Å²	130	147.7 Å²	147.7	67%	0.667	77%	0.768	S	S	*	*			trans	-65	114.3	172	-46.8	173	0	0	0	108.3	I34 K38	I34-I36 VanDerWaalsContact C-N 3.3Å; I34-I36 PolarHBondContact O-N 3.5Å; I36-K38 WeakPolarHBondContact O-CG 3.14Å; I36-K38 PolarHBondContact O-N 2.77Å
37	D	32	Very low	40.1	Very low	117 Å²	117	151.3 Å²	151.3	63%	0.626	78%	0.78	S	S	*	*			trans	-74.9	106.3	178.5	-162.9	-37	0	0	0	110.4	G35 T39	G35-D37 PolarHBondContact O-N 3.09Å; D37-T39 PolarHBondContact O-N 3.09Å; D37-T39 WeakPolarHBondContact OD1-CB 3.48Å; D37-T39 VanDerWaalsContact OD1-CG2 3.28Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.39Å; D37-T39 PolarHBondContact OD1-N 3.43Å; D37-T39 PolarHBondContact OD1-OG1 3.35Å
38	K	38.6	Very low	39.2	Very low	181 Å²	181	149.6 Å²	149.6	79%	0.787	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	36.7	-172.1	-59.4	-162	174.7	-164.2	0	113.6	I36	I36-K38 WeakPolarHBondContact O-CG 3.14Å; I36-K38 PolarHBondContact O-N 2.77Å
39	T	38.3	Very low	38.4	Very low	121 Å²	121	148.2 Å²	148.2	74%	0.742	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	6.7	-174.7	56.2	0	0	0	0	115.5	D37	D37-T39 PolarHBondContact O-N 3.09Å; D37-T39 WeakPolarHBondContact OD1-CB 3.48Å; D37-T39 VanDerWaalsContact OD1-CG2 3.28Å; D37-T39 WeakPolarHBondContact OD1-CG2 3.39Å; D37-T39 PolarHBondContact OD1-N 3.43Å; D37-T39 PolarHBondContact OD1-OG1 3.35Å
40	K	37.2	Very low	37.7	Very low	204 Å²	204	149.5 Å²	149.5	89%	0.887	79%	0.789	S	S	*	*	S	Bend	trans	-147.5	36.8	172.1	-146.1	-173.2	177.8	-166.7	0	116.8
41	V	32.5	Very low	37.4	Very low	126 Å²	126	146.7 Å²	146.7	76%	0.764	79%	0.786	S	S	*	*			trans	-93.4	118.4	168.4	-177.6	0	0	0	0	110
42	K	32.8	Very low	36.8	Very low	192 Å²	192	147.2 Å²	147.2	84%	0.835	78%	0.782	S	S	*	*			trans	-95.3	104.9	170.5	-176.8	-174.6	179.5	-169.1	0	107	T44	K42-T44 PolarHBondContact O-N 3.19Å; K42-T44 VanDerWaalsContact O-N 3.1Å
43	E	31.5	Very low	36.9	Very low	184 Å²	184	145.5 Å²	145.5	86%	0.86	78%	0.781	S	S	*	*			trans	-58.8	116	179.8	-71.4	-178.1	126.4	0	0	110.2
44	T	31.7	Very low	37.2	Very low	129 Å²	129	143.3 Å²	143.3	79%	0.791	77%	0.769	S	S	*	*			trans	-81.4	123.6	170	33.9	0	0	0	0	109.2	K42 K46	K42-T44 PolarHBondContact O-N 3.19Å; K42-T44 VanDerWaalsContact O-N 3.1Å; T44-K46 PolarHBondContact O-N 3.47Å
45	E	32.6	Very low	37.8	Very low	191 Å²	191	138.5 Å²	138.5	89%	0.893	75%	0.747	S	S	*	*			trans	-65.3	121.6	176.1	-65.7	-173.8	128.6	0	0	109.8	K47	E45-K47 PolarHBondContact O-N 3.14Å; E45-K47 VanDerWaalsContact O-N 3.1Å
46	K	32.6	Very low	39.3	Very low	206 Å²	206	139.2 Å²	139.2	90%	0.896	73%	0.732	S	S	*	*			trans	-66.6	110.5	171.7	-73	-159.3	169.7	-147.8	0	109.8	T44	T44-K46 PolarHBondContact O-N 3.47Å
47	K	31.4	Very low	40.4	Very low	178 Å²	178	134.6 Å²	134.6	77%	0.774	71%	0.71	S	S	*	*			trans	-58.4	153.8	157.4	-76.5	-178.3	178.5	177.4	0	109.6	E45	E45-K47 PolarHBondContact O-N 3.14Å; E45-K47 VanDerWaalsContact O-N 3.1Å
48	P	36.8	Very low	42.3	Very low	115 Å²	115	130.9 Å²	130.9	75%	0.747	70%	0.699	S	S	*	*			trans	-63.2	151.2	172.5	29.5	-35.9	0	0	0	110.6	E50	P48-E50 PolarHBondContact O-N 2.69Å; P48-E50 VanDerWaalsContact O-N 3.15Å
49	D	38.1	Very low	44.5	Very low	160 Å²	160	123 Å²	123	86%	0.856	67%	0.665	S	S	*	*			trans	-62.1	114.5	-175.2	-43.7	-75.5	0	0	0	111.1
50	E	33.7	Very low	46.8	Very low	164 Å²	164	122.2 Å²	122.2	77%	0.766	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-69.9	155	159.2	-73.3	175.7	152.7	0	0	108.4	P48	P48-E50 PolarHBondContact O-N 2.69Å; P48-E50 VanDerWaalsContact O-N 3.15Å
51	P	38	Very low	49.4	Very low	114 Å²	114	112.6 Å²	112.6	74%	0.74	61%	0.612	S	S	*	*	S	Bend	trans	-55.4	147.2	167.1	27.6	-35	0	0	0	108.8	A53	P51-A53 PolarHBondContact O-N 2.71Å
52	P	41.2	Very low	52.1	Low	104 Å²	104	106.7 Å²	106.7	68%	0.675	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-52.6	134.5	-175.6	22.3	-33.6	0	0	0	110.2	S54	P52-S54 VanDerWaalsContact C-N 3.35Å; P52-S54 PolarHBondContact O-N 2.86Å
53	A	45.2	Very low	54.9	Low	93 Å²	93	106.2 Å²	106.2	77%	0.769	57%	0.569	S	S	*	*			trans	-57.5	104.9	168.3	0	0	0	0	0	106.3	P51	P51-A53 PolarHBondContact O-N 2.71Å
54	S	50.9	Low	57.9	Low	71 Å²	71	97.9 Å²	97.9	50%	0.497	53%	0.529	S	S	.	.			trans	-93.2	134.5	179.5	33.5	0	0	0	0	107.3	P52 D56 R66	P52-S54 VanDerWaalsContact C-N 3.35Å; P52-S54 PolarHBondContact O-N 2.86Å; S54-D56 PolarHBondContact O-N 2.7Å; S54-D56 VanDerWaalsContact O-N 3.17Å; S54-R66 PolarHBondContact O-NH1 2.93Å; S54-R66 PolarHBondContact OG-NH1 3.48Å
55	V	58.2	Low	60.8	Low	52 Å²	52	92.5 Å²	92.5	32%	0.315	50%	0.496	S	S	.	.			trans	-31.7	115.3	-177.8	-161.8	0	0	0	0	110.9	R66 D271	V55-R66 PolarHBondContact O-NE 3.21Å; V55-R66 PolarHBondContact O-NH1 3.03Å; V55-R66 PolarHBondContact O-NH2 3.41Å; V55-D271 HydrophobicContact CG1-CB 4.14Å; V55-D271 HydrophobicContact CG2-CB 4.27Å; V55-D271 WeakPolarHBondContact CG2-OD2 3.36Å
56	D	66.2	Low	63.6	Low	92 Å²	92	86.9 Å²	86.9	49%	0.492	47%	0.466	S	S	.	.			trans	-91.3	107.5	172.7	-164.9	6.9	0	0	0	108	S54 G58 R66 Q273	S54-D56 PolarHBondContact O-N 2.7Å; S54-D56 VanDerWaalsContact O-N 3.17Å; D56-G58 PolarHBondContact O-N 3.5Å; D56-G58 VanDerWaalsContact O-N 3.14Å; D56-R66 IonicContact OD1-NH2 3.19Å; D56-R66 PolarHBondContact OD1-NH2 3.27Å; D56-Q273 VanDerWaalsContact N-NE2 3.11Å; D56-Q273 PolarHBondContact O-NE2 2.89Å
57	T	68.9	Low	66.5	Low	33 Å²	33	79.7 Å²	79.7	20%	0.202	44%	0.436	C	S	.	.			trans	-79.4	8.1	-170.3	71	0	0	0	0	113.1	L59 D62 L175	T57-L59 PolarHBondContact O-N 3.29Å; T57-L59 VanDerWaalsContact O-N 3.15Å; T57-L59 WeakPolarHBondContact OG1-CG 3.2Å; T57-D62 WeakPolarHBondContact CG2-OD1 3.33Å; T57-D62 PolarHBondContact N-OD2 2.93Å; T57-D62 VanDerWaalsContact N-OD2 3.08Å; T57-D62 WeakPolarHBondContact OG1-CB 3.16Å; T57-D62 PolarHBondContact OG1-OD1 3.38Å; T57-D62 PolarHBondContact OG1-OD2 2.79Å; T57-L175 WeakPolarHBondContact O-CD2 3.44Å
58	G	71.4	Confident	69.6	Low	39 Å²	39	71.3 Å²	71.3	40%	0.402	40%	0.399	S	S	.	.	S	Bend	trans	76	-12.2	-178	0	0	0	0	0	114.6	D56	D56-G58 PolarHBondContact O-N 3.5Å; D56-G58 VanDerWaalsContact O-N 3.14Å
59	L	85.3	Confident	72.2	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.073	38%	0.381	C	S	.	.			trans	-70.4	133.9	-178.3	-53.3	177.6	0	0	0	111.7	T57 Y61 D62 L65 A171 D174 L175	T57-L59 PolarHBondContact O-N 3.29Å; T57-L59 VanDerWaalsContact O-N 3.15Å; T57-L59 WeakPolarHBondContact OG1-CG 3.2Å; L59-Y61 HydrophobicContact CB-CE1 4.4Å; L59-Y61 HydrophobicContact CD1-CE2 3.95Å; L59-Y61 PolarHBondContact O-N 3.33Å; L59-D62 HydrophobicContact CB-CB 3.97Å; L59-D62 VanDerWaalsContact O-CB 3.26Å; L59-D62 WeakPolarHBondContact O-CB 3.48Å; L59-D62 PolarHBondContact O-N 2.98Å; L59-L65 HydrophobicContact CD1-CD2 4.13Å; L59-A171 HydrophobicContact CD1-CB 4.11Å; L59-D174 HydrophobicContact CD2-CB 3.45Å; L59-D174 VanDerWaalsContact CD2-CB 3.45Å; L59-L175 HydrophobicContact CD1-CD1 4.24Å; L59-L175 HydrophobicContact CD1-CD2 4.15Å; L59-L175 HydrophobicContact CD1-CG 3.98Å; L59-L175 HydrophobicContact CD2-CD2 3.97Å; L59-L175 HydrophobicContact CD2-CG 4.18Å; L59-L175 HydrophobicContact CG-CD2 3.93Å; L59-L175 HydrophobicContact CG-CG 4.25Å
60	H	87.4	Confident	74.8	Confident	105 Å²	105	66 Å²	66	49%	0.486	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-2.3	178.1	77.1	-88.7	0	0	0	114.7	R120 F148 H150	H60-R120 VanDerWaalsContact O-CZ 3.25Å; H60-R120 PolarHBondContact O-NH1 3.08Å; H60-R120 PolarHBondContact O-NH2 3.02Å; H60-F148 AromaticContact NE2-CD1 3.61Å; H60-F148 AromaticContact NE2-CE1 3.79Å; H60-H150 AromaticContact NE2-CE1 3.99Å
61	Y	91.3	Very high	77.6	Confident	3 Å²	3	60.8 Å²	60.8	1%	0.012	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	13.3	172.5	58.9	-92.2	0	0	0	112.9	L59 R63 Y64 L65 H150 L167 S170 A171 D174	L59-Y61 HydrophobicContact CB-CE1 4.4Å; L59-Y61 HydrophobicContact CD1-CE2 3.95Å; L59-Y61 PolarHBondContact O-N 3.33Å; Y61-R63 VanDerWaalsContact C-N 3.27Å; Y61-R63 PolarHBondContact O-N 3.16Å; Y61-Y64 WeakPolarHBondContact O-CA 3.18Å; Y61-Y64 WeakPolarHBondContact O-CB 3.41Å; Y61-Y64 PolarHBondContact O-N 3.48Å; Y61-L65 HydrophobicContact CD2-CB 4.49Å; Y61-L65 PolarHBondContact O-N 2.81Å; Y61-L65 VanDerWaalsContact O-N 3.11Å; Y61-H150 VanDerWaalsContact CB-NE2 3.34Å; Y61-H150 WeakPolarHBondContact CB-NE2 3.33Å; Y61-H150 HydrophobicContact CD1-CB 4.48Å; Y61-H150 AromaticContact CD1-CD2 3.93Å; Y61-H150 AromaticContact CD1-CE1 3.76Å; Y61-H150 AromaticContact CD1-CG 3.88Å; Y61-H150 AromaticContact CD1-ND1 3.82Å; Y61-H150 AromaticContact CD1-NE2 3.87Å; Y61-H150 HydrophobicContact CD2-CB 4.32Å; Y61-H150 AromaticContact CD2-CD2 3.7Å; Y61-H150 HydrophobicContact CE1-CB 4.24Å; Y61-H150 HydrophobicContact CE2-CB 4.05Å; Y61-H150 AromaticContact CG-CD2 3.49Å; Y61-H150 VanDerWaalsContact CG-CD2 3.49Å; Y61-H150 AromaticContact CG-CE1 3.93Å; Y61-H150 AromaticContact CG-CG 3.87Å; Y61-H150 AromaticContact CG-NE2 3.55Å; Y61-L167 HydrophobicContact CD2-CD1 3.88Å; Y61-L167 HydrophobicContact CE2-CD1 3.89Å; Y61-S170 WeakPolarHBondContact OH-CB 3.4Å; Y61-S170 PolarHBondContact OH-O 3.05Å; Y61-A171 HydrophobicContact CE2-CB 4.38Å; Y61-A171 WeakPolarHBondContact OH-CA 3.38Å; Y61-A171 PolarHBondContact OH-N 3.17Å; Y61-D174 VanDerWaalsContact CE1-OD2 3.23Å; Y61-D174 WeakPolarHBondContact CE1-OD2 3.48Å; Y61-D174 VanDerWaalsContact CZ-OD2 3.3Å; Y61-D174 PolarHBondContact OH-OD2 2.74Å
62	D	89.1	Confident	80.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.011	30%	0.304	C	S	.	.	H	α-helix	trans	-53.5	-42.3	-175.3	-176.3	39.9	0	0	0	112.7	T57 L59 Y64 L65 R66	T57-D62 WeakPolarHBondContact CG2-OD1 3.33Å; T57-D62 PolarHBondContact N-OD2 2.93Å; T57-D62 VanDerWaalsContact N-OD2 3.08Å; T57-D62 WeakPolarHBondContact OG1-CB 3.16Å; T57-D62 PolarHBondContact OG1-OD1 3.38Å; T57-D62 PolarHBondContact OG1-OD2 2.79Å; L59-D62 HydrophobicContact CB-CB 3.97Å; L59-D62 VanDerWaalsContact O-CB 3.26Å; L59-D62 WeakPolarHBondContact O-CB 3.48Å; L59-D62 PolarHBondContact O-N 2.98Å; D62-Y64 PolarHBondContact O-N 2.76Å; D62-L65 CarbonylContact O-C 3.54Å; D62-L65 WeakPolarHBondContact O-CA 3.49Å; D62-L65 WeakPolarHBondContact O-CB 3.41Å; D62-L65 PolarHBondContact O-N 3.46Å; D62-L65 VanDerWaalsContact O-N 3.07Å; D62-R66 WeakPolarHBondContact O-CB 3.26Å; D62-R66 PolarHBondContact O-N 3.41Å; D62-R66 IonicContact OD1-NE 2.75Å; D62-R66 IonicContact OD2-CZ 3.12Å; D62-R66 IonicContact OD2-NE 2.7Å; D62-R66 PolarHBondContact OD2-NE 3Å; D62-R66 IonicContact OD2-NH2 3.54Å; D62-R66 PolarHBondContact OD2-NH2 3.23Å
63	R	91.4	Very high	82.7	Confident	181 Å²	181	53.2 Å²	53.2	68%	0.683	29%	0.285	S	S	*	.	H	α-helix	trans	-54.6	-38.3	173.6	178.7	178.8	168.2	-179.7	-1.9	113.3	Y61 E67	Y61-R63 VanDerWaalsContact C-N 3.27Å; Y61-R63 PolarHBondContact O-N 3.16Å; R63-E67 HydrophobicContact CG-CG 4.44Å; R63-E67 IonicContact CZ-OE1 3.77Å; R63-E67 IonicContact NE-OE1 3.4Å; R63-E67 PolarHBondContact NE-OE1 2.91Å; R63-E67 IonicContact NH2-OE1 3.84Å; R63-E67 PolarHBondContact NH2-OE1 3.16Å; R63-E67 VanDerWaalsContact O-CB 3.31Å; R63-E67 WeakPolarHBondContact O-CB 3.42Å; R63-E67 VanDerWaalsContact O-CG 3.31Å; R63-E67 WeakPolarHBondContact O-CG 3.28Å; R63-E67 PolarHBondContact O-N 2.9Å
64	Y	94.1	Very high	85	Confident	9 Å²	9	53.9 Å²	53.9	4%	0.035	27%	0.27	C	S	.	.	H	α-helix	trans	-74.5	-37.4	177.6	168.7	-111.4	0	0	0	111.4	Y61 D62 V68 L113 E117 F159 L167	Y61-Y64 WeakPolarHBondContact O-CA 3.18Å; Y61-Y64 WeakPolarHBondContact O-CB 3.41Å; Y61-Y64 PolarHBondContact O-N 3.48Å; D62-Y64 PolarHBondContact O-N 2.76Å; Y64-V68 HydrophobicContact CD2-CG2 4.04Å; Y64-V68 HydrophobicContact CE2-CG2 3.72Å; Y64-V68 WeakPolarHBondContact O-CB 3.09Å; Y64-V68 VanDerWaalsContact O-CG2 3.27Å; Y64-V68 WeakPolarHBondContact O-CG2 3.34Å; Y64-V68 PolarHBondContact O-N 2.83Å; Y64-L113 HydrophobicContact CD2-CB 4.32Å; Y64-L113 HydrophobicContact CE2-CB 4.08Å; Y64-E117 HydrophobicContact CD1-CB 4.4Å; Y64-E117 HydrophobicContact CD1-CG 3.92Å; Y64-E117 HydrophobicContact CD2-CB 3.69Å; Y64-E117 HydrophobicContact CD2-CG 4.14Å; Y64-E117 HydrophobicContact CE1-CG 4.17Å; Y64-E117 HydrophobicContact CE2-CB 3.89Å; Y64-E117 HydrophobicContact CE2-CG 4.38Å; Y64-E117 HydrophobicContact CG-CB 3.95Å; Y64-E117 HydrophobicContact CG-CG 3.89Å; Y64-F159 WeakPolarHBondContact OH-CD2 3.44Å; Y64-F159 WeakPolarHBondContact OH-CE2 3.35Å; Y64-L167 HydrophobicContact CD1-CD1 3.9Å; Y64-L167 HydrophobicContact CD1-CD2 4.26Å; Y64-L167 HydrophobicContact CE1-CD1 3.92Å; Y64-L167 HydrophobicContact CE1-CD2 3.87Å; Y64-L167 HydrophobicContact CE1-CG 4.46Å
65	L	93.4	Very high	87.1	Confident	17 Å²	17	51.4 Å²	51.4	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-58.4	-54.6	170.7	177.3	68	0	0	0	110.8	L59 Y61 D62 V68 I69 L167 A171	L59-L65 HydrophobicContact CD1-CD2 4.13Å; Y61-L65 HydrophobicContact CD2-CB 4.49Å; Y61-L65 PolarHBondContact O-N 2.81Å; Y61-L65 VanDerWaalsContact O-N 3.11Å; D62-L65 CarbonylContact O-C 3.54Å; D62-L65 WeakPolarHBondContact O-CA 3.49Å; D62-L65 WeakPolarHBondContact O-CB 3.41Å; D62-L65 PolarHBondContact O-N 3.46Å; D62-L65 VanDerWaalsContact O-N 3.07Å; L65-V68 PolarHBondContact O-N 3.21Å; L65-I69 HydrophobicContact CD1-CD1 3.88Å; L65-I69 HydrophobicContact CD1-CG1 4.49Å; L65-I69 HydrophobicContact CG-CD1 3.95Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 3.07Å; L65-L167 HydrophobicContact CB-CD1 4.24Å; L65-L167 HydrophobicContact CD1-CD1 4Å; L65-L167 HydrophobicContact CD1-CD2 4.26Å; L65-L167 HydrophobicContact CD1-CG 3.77Å; L65-A171 HydrophobicContact CD1-CB 3.92Å; L65-A171 HydrophobicContact CD2-CB 3.62Å; L65-A171 HydrophobicContact CG-CB 4.42Å
66	R	90.9	Very high	88.8	Confident	73 Å²	73	55.7 Å²	55.7	28%	0.275	27%	0.268	S	S	.	.	H	α-helix	trans	-53.8	-58.9	174.3	-74	-169.5	-92.2	169.1	-15.4	110.9	S54 V55 D56 D62 V68 I69 D70	S54-R66 PolarHBondContact O-NH1 2.93Å; S54-R66 PolarHBondContact OG-NH1 3.48Å; V55-R66 PolarHBondContact O-NE 3.21Å; V55-R66 PolarHBondContact O-NH1 3.03Å; V55-R66 PolarHBondContact O-NH2 3.41Å; D56-R66 IonicContact OD1-NH2 3.19Å; D56-R66 PolarHBondContact OD1-NH2 3.27Å; D62-R66 WeakPolarHBondContact O-CB 3.26Å; D62-R66 PolarHBondContact O-N 3.41Å; D62-R66 IonicContact OD1-NE 2.75Å; D62-R66 IonicContact OD2-CZ 3.12Å; D62-R66 IonicContact OD2-NE 2.7Å; D62-R66 PolarHBondContact OD2-NE 3Å; D62-R66 IonicContact OD2-NH2 3.54Å; D62-R66 PolarHBondContact OD2-NH2 3.23Å; R66-V68 PolarHBondContact O-N 3.27Å; R66-V68 VanDerWaalsContact O-N 3.13Å; R66-I69 PolarHBondContact O-N 3.26Å; R66-I69 VanDerWaalsContact O-N 3.13Å; R66-D70 WeakPolarHBondContact O-CB 3.41Å; R66-D70 PolarHBondContact O-N 3.27Å
67	E	94.5	Very high	90	Very high	55 Å²	55	54.5 Å²	54.5	26%	0.257	26%	0.26	S	S	.	.	H	α-helix	trans	-56.8	-32.5	-179.3	-76	-179.4	-174.3	0	0	113.4	R63 F71 L113	R63-E67 HydrophobicContact CG-CG 4.44Å; R63-E67 IonicContact CZ-OE1 3.77Å; R63-E67 IonicContact NE-OE1 3.4Å; R63-E67 PolarHBondContact NE-OE1 2.91Å; R63-E67 IonicContact NH2-OE1 3.84Å; R63-E67 PolarHBondContact NH2-OE1 3.16Å; R63-E67 VanDerWaalsContact O-CB 3.31Å; R63-E67 WeakPolarHBondContact O-CB 3.42Å; R63-E67 VanDerWaalsContact O-CG 3.31Å; R63-E67 WeakPolarHBondContact O-CG 3.28Å; R63-E67 PolarHBondContact O-N 2.9Å; E67-F71 WeakPolarHBondContact O-CD2 3.3Å; E67-F71 PolarHBondContact O-N 3.28Å; E67-L113 HydrophobicContact CB-CD1 4.02Å; E67-L113 HydrophobicContact CB-CD2 4.08Å; E67-L113 VanDerWaalsContact O-CD1 3.31Å; E67-L113 WeakPolarHBondContact O-CD1 3.41Å; E67-L113 WeakPolarHBondContact OE2-CD2 3.32Å
68	V	94.7	Very high	91.2	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-70.9	-50.1	174.6	162.5	0	0	0	0	112	Y64 L65 R66 D70 F71 L72 L110 L113 F159 L164 L167	Y64-V68 HydrophobicContact CD2-CG2 4.04Å; Y64-V68 HydrophobicContact CE2-CG2 3.72Å; Y64-V68 WeakPolarHBondContact O-CB 3.09Å; Y64-V68 VanDerWaalsContact O-CG2 3.27Å; Y64-V68 WeakPolarHBondContact O-CG2 3.34Å; Y64-V68 PolarHBondContact O-N 2.83Å; L65-V68 PolarHBondContact O-N 3.21Å; R66-V68 PolarHBondContact O-N 3.27Å; R66-V68 VanDerWaalsContact O-N 3.13Å; V68-D70 VanDerWaalsContact C-N 3.33Å; V68-D70 PolarHBondContact O-N 3.08Å; V68-F71 PolarHBondContact O-N 2.81Å; V68-L72 HydrophobicContact CG1-CD1 3.69Å; V68-L72 HydrophobicContact CG1-CG 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.47Å; V68-L72 PolarHBondContact O-N 2.75Å; V68-L110 HydrophobicContact CB-CD2 4.24Å; V68-L110 HydrophobicContact CG1-CD2 3.94Å; V68-L110 HydrophobicContact CG2-CD2 4.09Å; V68-L113 HydrophobicContact CG2-CB 4.47Å; V68-L113 HydrophobicContact CG2-CD1 3.96Å; V68-F159 HydrophobicContact CG1-CE2 4.26Å; V68-F159 HydrophobicContact CG1-CZ 3.8Å; V68-F159 HydrophobicContact CG2-CE2 4.14Å; V68-F159 HydrophobicContact CG2-CZ 4.49Å; V68-L164 HydrophobicContact CG1-CD1 4.33Å; V68-L167 HydrophobicContact CB-CD2 3.99Å; V68-L167 HydrophobicContact CG1-CD2 3.83Å; V68-L167 HydrophobicContact CG2-CD2 4.09Å
69	I	92.1	Very high	92.2	Very high	70 Å²	70	56.5 Å²	56.5	36%	0.359	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-47.6	178.3	-67.5	169	0	0	0	109.8	L65 R66 F71 L72 E73	L65-I69 HydrophobicContact CD1-CD1 3.88Å; L65-I69 HydrophobicContact CD1-CG1 4.49Å; L65-I69 HydrophobicContact CG-CD1 3.95Å; L65-I69 WeakPolarHBondContact O-CG1 3.29Å; L65-I69 PolarHBondContact O-N 3.07Å; R66-I69 PolarHBondContact O-N 3.26Å; R66-I69 VanDerWaalsContact O-N 3.13Å; I69-F71 PolarHBondContact O-N 3.18Å; I69-L72 WeakPolarHBondContact O-CB 3.35Å; I69-L72 PolarHBondContact O-N 2.89Å; I69-E73 HydrophobicContact CG2-CG 4.3Å; I69-E73 PolarHBondContact O-N 3.06Å
70	D	92.5	Very high	92.6	Very high	93 Å²	93	61 Å²	61	50%	0.497	27%	0.272	S	S	.	.	H	α-helix	trans	-53.7	-39.3	179.5	-151.9	65.6	0	0	0	111.6	R66 V68 K74	R66-D70 WeakPolarHBondContact O-CB 3.41Å; R66-D70 PolarHBondContact O-N 3.27Å; V68-D70 VanDerWaalsContact C-N 3.33Å; V68-D70 PolarHBondContact O-N 3.08Å; D70-K74 WeakPolarHBondContact O-CE 3.24Å; D70-K74 WeakPolarHBondContact O-CG 3.39Å; D70-K74 PolarHBondContact O-NZ 2.86Å; D70-K74 IonicContact OD2-NZ 3.88Å; D70-K74 PolarHBondContact OD2-NZ 2.84Å
71	F	93.3	Very high	92.9	Very high	55 Å²	55	59.5 Å²	59.5	24%	0.241	26%	0.264	C	S	.	.	H	α-helix	trans	-83.5	-27.9	175.9	-88.8	-76.7	0	0	0	114.6	E67 V68 I69 K74 V106 K109 L110 L113	E67-F71 WeakPolarHBondContact O-CD2 3.3Å; E67-F71 PolarHBondContact O-N 3.28Å; V68-F71 PolarHBondContact O-N 2.81Å; I69-F71 PolarHBondContact O-N 3.18Å; F71-K74 HydrophobicContact CD1-CD 3.76Å; F71-K74 HydrophobicContact CE1-CD 3.94Å; F71-K74 HydrophobicContact CG-CD 4.4Å; F71-K74 PolarHBondContact O-N 3.05Å; F71-V106 VanDerWaalsContact O-CG1 3.24Å; F71-V106 WeakPolarHBondContact O-CG1 3.38Å; F71-K109 HydrophobicContact CB-CG 4.5Å; F71-K109 HydrophobicContact CD1-CB 4.31Å; F71-K109 HydrophobicContact CD1-CG 3.69Å; F71-K109 HydrophobicContact CD2-CG 3.94Å; F71-K109 HydrophobicContact CE1-CD 4.48Å; F71-K109 HydrophobicContact CE1-CG 3.82Å; F71-K109 HydrophobicContact CE2-CD 4.41Å; F71-K109 HydrophobicContact CE2-CG 4.06Å; F71-K109 HydrophobicContact CG-CG 3.76Å; F71-K109 HydrophobicContact CZ-CD 4.29Å; F71-K109 HydrophobicContact CZ-CG 4Å; F71-L110 HydrophobicContact CB-CD2 4.48Å; F71-L113 HydrophobicContact CD2-CD1 4.25Å
72	L	94.3	Very high	92.8	Very high	1 Å²	1	61.3 Å²	61.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-66.8	-44	172	-76.8	166.6	0	0	0	112	V68 I69 K74 D75 F78 L99 V102 V106 L110 L164	V68-L72 HydrophobicContact CG1-CD1 3.69Å; V68-L72 HydrophobicContact CG1-CG 4.46Å; V68-L72 WeakPolarHBondContact O-CG 3.47Å; V68-L72 PolarHBondContact O-N 2.75Å; I69-L72 WeakPolarHBondContact O-CB 3.35Å; I69-L72 PolarHBondContact O-N 2.89Å; L72-K74 PolarHBondContact O-N 2.96Å; L72-K74 VanDerWaalsContact O-N 3.16Å; L72-D75 WeakPolarHBondContact O-CB 3.46Å; L72-D75 PolarHBondContact O-N 3.46Å; L72-F78 HydrophobicContact CB-CD1 3.66Å; L72-F78 HydrophobicContact CB-CE1 3.72Å; L72-F78 HydrophobicContact CB-CG 4.23Å; L72-F78 HydrophobicContact CB-CZ 4.35Å; L72-F78 HydrophobicContact CD1-CE1 4.02Å; L72-F78 HydrophobicContact CD1-CE2 4.5Å; L72-F78 HydrophobicContact CD1-CZ 3.91Å; L72-F78 HydrophobicContact CD2-CD1 4.34Å; L72-F78 HydrophobicContact CD2-CD2 4.04Å; L72-F78 HydrophobicContact CD2-CE1 4.34Å; L72-F78 HydrophobicContact CD2-CE2 4.05Å; L72-F78 HydrophobicContact CD2-CG 4.18Å; L72-F78 HydrophobicContact CD2-CZ 4.19Å; L72-F78 HydrophobicContact CG-CD1 4.44Å; L72-F78 HydrophobicContact CG-CE1 4.25Å; L72-F78 HydrophobicContact CG-CZ 4.39Å; L72-L99 HydrophobicContact CD2-CD1 3.73Å; L72-V102 HydrophobicContact CD2-CG2 4.31Å; L72-V106 HydrophobicContact CD2-CG1 4.43Å; L72-L110 HydrophobicContact CD2-CD1 3.72Å; L72-L110 HydrophobicContact CG-CD1 4.19Å; L72-L110 HydrophobicContact CG-CD2 4.3Å; L72-L164 HydrophobicContact CD1-CD1 3.76Å; L72-L164 HydrophobicContact CD1-CD2 3.92Å
73	E	92.4	Very high	92.7	Very high	58 Å²	58	67.2 Å²	67.2	27%	0.271	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-22.9	177.3	-73.1	-153.6	159.3	0	0	113.8	I69 D75 R79 L82 H83	I69-E73 HydrophobicContact CG2-CG 4.3Å; I69-E73 PolarHBondContact O-N 3.06Å; E73-D75 PolarHBondContact O-N 3.07Å; E73-R79 PolarHBondContact O-NE 2.94Å; E73-R79 PolarHBondContact O-NH2 3.27Å; E73-L82 HydrophobicContact CG-CD2 3.86Å; E73-L82 WeakPolarHBondContact OE1-CD2 3.14Å; E73-H83 IonicContact OE1-CE1 3.01Å
74	K	93.3	Very high	92.6	Very high	107 Å²	107	65 Å²	65	47%	0.465	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.7	175.3	-67.4	170.3	-174.1	91.3	0	112	D70 F71 L72	D70-K74 WeakPolarHBondContact O-CE 3.24Å; D70-K74 WeakPolarHBondContact O-CG 3.39Å; D70-K74 PolarHBondContact O-NZ 2.86Å; D70-K74 IonicContact OD2-NZ 3.88Å; D70-K74 PolarHBondContact OD2-NZ 2.84Å; F71-K74 HydrophobicContact CD1-CD 3.76Å; F71-K74 HydrophobicContact CE1-CD 3.94Å; F71-K74 HydrophobicContact CG-CD 4.4Å; F71-K74 PolarHBondContact O-N 3.05Å; L72-K74 PolarHBondContact O-N 2.96Å; L72-K74 VanDerWaalsContact O-N 3.16Å
75	D	94.6	Very high	92.3	Very high	19 Å²	19	66.2 Å²	66.2	10%	0.102	31%	0.311	C	S	.	.	S	Bend	trans	-91.3	125.8	168.1	-159.9	-67.7	0	0	0	111.6	L72 E73 H77 F78 R79 V102 S103 V106	L72-D75 WeakPolarHBondContact O-CB 3.46Å; L72-D75 PolarHBondContact O-N 3.46Å; E73-D75 PolarHBondContact O-N 3.07Å; D75-H77 PolarHBondContact O-N 3.33Å; D75-H77 PolarHBondContact OD1-N 2.78Å; D75-F78 HydrophobicContact CB-CB 4.22Å; D75-F78 PolarHBondContact O-N 2.81Å; D75-R79 WeakPolarHBondContact O-CB 3.12Å; D75-R79 PolarHBondContact O-N 2.95Å; D75-V102 HydrophobicContact CB-CG1 4.36Å; D75-S103 WeakPolarHBondContact OD2-CB 3.2Å; D75-S103 PolarHBondContact OD2-N 2.94Å; D75-S103 PolarHBondContact OD2-OG 2.97Å; D75-V106 HydrophobicContact CB-CG2 4.4Å
76	Q	93.3	Very high	91.9	Very high	142 Å²	142	71.3 Å²	71.3	66%	0.664	34%	0.338	S	S	*	.	H	α-helix	trans	-63.1	-40	-177.1	-178.2	-179.9	-11.8	0	0	112.4	R79 E80	Q76-R79 PolarHBondContact O-N 3.17Å; Q76-E80 HydrophobicContact CG-CG 4.46Å; Q76-E80 WeakPolarHBondContact CG-OE1 3.45Å; Q76-E80 PolarHBondContact NE2-OE1 2.96Å; Q76-E80 WeakPolarHBondContact O-CB 3.23Å; Q76-E80 WeakPolarHBondContact O-CG 3.4Å; Q76-E80 PolarHBondContact O-N 2.91Å
77	H	92.1	Very high	91.4	Very high	68 Å²	68	72 Å²	72	32%	0.315	35%	0.346	S	S	.	.	H	α-helix	trans	-65.6	-45	-178.7	173.2	89.7	0	0	0	110.5	D75 E80 K81 E98	D75-H77 PolarHBondContact O-N 3.33Å; D75-H77 PolarHBondContact OD1-N 2.78Å; H77-E80 PolarHBondContact O-N 3.03Å; H77-K81 VanDerWaalsContact O-CG 3.27Å; H77-K81 WeakPolarHBondContact O-CG 3.33Å; H77-K81 PolarHBondContact O-N 3Å; H77-K81 VanDerWaalsContact O-N 3.09Å; H77-E98 IonicContact CD2-OE2 3.66Å; H77-E98 IonicContact CE1-OE2 3.63Å; H77-E98 PolarHBondContact CE1-OE2 3.25Å; H77-E98 IonicContact NE2-OE2 3.65Å; H77-E98 PolarHBondContact NE2-OE2 2.85Å
78	F	93.4	Very high	91	Very high	5 Å²	5	74.7 Å²	74.7	2%	0.022	36%	0.358	C	S	.	.	H	α-helix	trans	-67.7	-41.3	179.4	-165.2	-83.5	0	0	0	112.1	L72 D75 E80 K81 L82 L95 E98 V102 L164	L72-F78 HydrophobicContact CB-CD1 3.66Å; L72-F78 HydrophobicContact CB-CE1 3.72Å; L72-F78 HydrophobicContact CB-CG 4.23Å; L72-F78 HydrophobicContact CB-CZ 4.35Å; L72-F78 HydrophobicContact CD1-CE1 4.02Å; L72-F78 HydrophobicContact CD1-CE2 4.5Å; L72-F78 HydrophobicContact CD1-CZ 3.91Å; L72-F78 HydrophobicContact CD2-CD1 4.34Å; L72-F78 HydrophobicContact CD2-CD2 4.04Å; L72-F78 HydrophobicContact CD2-CE1 4.34Å; L72-F78 HydrophobicContact CD2-CE2 4.05Å; L72-F78 HydrophobicContact CD2-CG 4.18Å; L72-F78 HydrophobicContact CD2-CZ 4.19Å; L72-F78 HydrophobicContact CG-CD1 4.44Å; L72-F78 HydrophobicContact CG-CE1 4.25Å; L72-F78 HydrophobicContact CG-CZ 4.39Å; D75-F78 HydrophobicContact CB-CB 4.22Å; D75-F78 PolarHBondContact O-N 2.81Å; F78-E80 PolarHBondContact O-N 3.49Å; F78-K81 CarbonylContact O-C 3.51Å; F78-K81 WeakPolarHBondContact O-CA 3.34Å; F78-K81 WeakPolarHBondContact O-CB 3.4Å; F78-K81 PolarHBondContact O-N 3.13Å; F78-K81 VanDerWaalsContact O-N 3.09Å; F78-L82 HydrophobicContact CE1-CB 4.43Å; F78-L82 WeakPolarHBondContact O-CB 3.44Å; F78-L82 PolarHBondContact O-N 3.48Å; F78-L95 HydrophobicContact CE1-CD1 4.14Å; F78-L95 HydrophobicContact CE1-CD2 4.33Å; F78-L95 HydrophobicContact CE1-CG 4.37Å; F78-L95 HydrophobicContact CE2-CD1 4Å; F78-L95 HydrophobicContact CE2-CG 4.15Å; F78-L95 HydrophobicContact CZ-CD1 3.71Å; F78-L95 HydrophobicContact CZ-CD2 3.95Å; F78-L95 HydrophobicContact CZ-CG 3.65Å; F78-E98 HydrophobicContact CD2-CB 4.26Å; F78-E98 HydrophobicContact CE2-CB 4.43Å; F78-V102 HydrophobicContact CB-CG2 3.94Å; F78-V102 HydrophobicContact CD2-CG2 3.76Å; F78-V102 HydrophobicContact CG-CG2 4.2Å; F78-L164 HydrophobicContact CE2-CD2 3.94Å; F78-L164 HydrophobicContact CZ-CD2 3.97Å
79	R	93.3	Very high	90.6	Very high	109 Å²	109	77 Å²	77	41%	0.411	37%	0.37	S	S	.	.	H	α-helix	trans	-61.6	-44.4	175.9	-167.8	-166.1	-55.5	-148.3	-6.1	112.4	E73 D75 Q76 K81 L82 H83	E73-R79 PolarHBondContact O-NE 2.94Å; E73-R79 PolarHBondContact O-NH2 3.27Å; D75-R79 WeakPolarHBondContact O-CB 3.12Å; D75-R79 PolarHBondContact O-N 2.95Å; Q76-R79 PolarHBondContact O-N 3.17Å; R79-K81 PolarHBondContact O-N 2.98Å; R79-L82 PolarHBondContact O-N 3.31Å; R79-H83 VanDerWaalsContact CG-NE2 3.3Å; R79-H83 WeakPolarHBondContact CG-NE2 3.41Å; R79-H83 PolarHBondContact O-CD2 3.48Å; R79-H83 PolarHBondContact O-N 2.87Å; R79-H83 VanDerWaalsContact O-N 3.17Å
80	E	93.5	Very high	90.3	Very high	109 Å²	109	75.2 Å²	75.2	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-62.7	-28.4	174.7	-76	179.6	-155.7	0	0	112.1	Q76 H77 F78 N84	Q76-E80 HydrophobicContact CG-CG 4.46Å; Q76-E80 WeakPolarHBondContact CG-OE1 3.45Å; Q76-E80 PolarHBondContact NE2-OE1 2.96Å; Q76-E80 WeakPolarHBondContact O-CB 3.23Å; Q76-E80 WeakPolarHBondContact O-CG 3.4Å; Q76-E80 PolarHBondContact O-N 2.91Å; H77-E80 PolarHBondContact O-N 3.03Å; F78-E80 PolarHBondContact O-N 3.49Å; E80-N84 WeakPolarHBondContact O-CB 3.28Å; E80-N84 PolarHBondContact O-ND2 3.29Å
81	K	92.8	Very high	89.9	Confident	73 Å²	73	73 Å²	73	32%	0.317	35%	0.347	S	S	.	.	H	α-helix	trans	-76.1	-45.2	172.7	-70.8	-75.2	-177.7	152.8	0	112.7	H77 F78 R79 H83 N84 T85 L95 E98	H77-K81 VanDerWaalsContact O-CG 3.27Å; H77-K81 WeakPolarHBondContact O-CG 3.33Å; H77-K81 PolarHBondContact O-N 3Å; H77-K81 VanDerWaalsContact O-N 3.09Å; F78-K81 CarbonylContact O-C 3.51Å; F78-K81 WeakPolarHBondContact O-CA 3.34Å; F78-K81 WeakPolarHBondContact O-CB 3.4Å; F78-K81 PolarHBondContact O-N 3.13Å; F78-K81 VanDerWaalsContact O-N 3.09Å; R79-K81 PolarHBondContact O-N 2.98Å; K81-H83 PolarHBondContact O-N 3.27Å; K81-N84 PolarHBondContact O-N 3.18Å; K81-T85 WeakPolarHBondContact O-CB 3.48Å; K81-T85 PolarHBondContact O-N 2.84Å; K81-T85 VanDerWaalsContact O-N 3.16Å; K81-T85 PolarHBondContact O-OG1 3.18Å; K81-L95 HydrophobicContact CB-CD1 4.08Å; K81-E98 HydrophobicContact CB-CG 4.21Å; K81-E98 HydrophobicContact CD-CG 3.94Å; K81-E98 VanDerWaalsContact CE-OE1 3.25Å; K81-E98 WeakPolarHBondContact CE-OE1 3.36Å; K81-E98 VanDerWaalsContact CE-OE2 3.32Å; K81-E98 WeakPolarHBondContact CE-OE2 3.3Å; K81-E98 HydrophobicContact CG-CB 4.39Å; K81-E98 HydrophobicContact CG-CG 3.87Å; K81-E98 VanDerWaalsContact NZ-CD 3.33Å; K81-E98 IonicContact NZ-OE1 2.82Å; K81-E98 PolarHBondContact NZ-OE1 2.68Å; K81-E98 IonicContact NZ-OE2 2.75Å
82	L	89.9	Confident	89.7	Confident	40 Å²	40	75.4 Å²	75.4	21%	0.209	36%	0.36	C	S	.	.	H	α-helix	trans	-55.6	-53.6	-179.9	179.7	62.3	0	0	0	111.2	E73 F78 R79 N84 I90 L95	E73-L82 HydrophobicContact CG-CD2 3.86Å; E73-L82 WeakPolarHBondContact OE1-CD2 3.14Å; F78-L82 HydrophobicContact CE1-CB 4.43Å; F78-L82 WeakPolarHBondContact O-CB 3.44Å; F78-L82 PolarHBondContact O-N 3.48Å; R79-L82 PolarHBondContact O-N 3.31Å; L82-N84 VanDerWaalsContact C-N 3.25Å; L82-N84 PolarHBondContact O-N 2.69Å; L82-I90 HydrophobicContact CD1-CD1 4.35Å; L82-L95 HydrophobicContact CD1-CD2 3.7Å
83	H	86.8	Confident	89.3	Confident	127 Å²	127	75.6 Å²	75.6	59%	0.588	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-8.3	-178.7	-54.8	-47.2	0	0	0	115.3	E73 R79 K81	E73-H83 IonicContact OE1-CE1 3.01Å; R79-H83 VanDerWaalsContact CG-NE2 3.3Å; R79-H83 WeakPolarHBondContact CG-NE2 3.41Å; R79-H83 PolarHBondContact O-CD2 3.48Å; R79-H83 PolarHBondContact O-N 2.87Å; R79-H83 VanDerWaalsContact O-N 3.17Å; K81-H83 PolarHBondContact O-N 3.27Å
84	N	89.1	Confident	89.2	Confident	134 Å²	134	76.7 Å²	76.7	72%	0.717	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.6	11.8	-179.1	-70.2	-79.8	0	0	0	113.2	E80 K81 L82	E80-N84 WeakPolarHBondContact O-CB 3.28Å; E80-N84 PolarHBondContact O-ND2 3.29Å; K81-N84 PolarHBondContact O-N 3.18Å; L82-N84 VanDerWaalsContact C-N 3.25Å; L82-N84 PolarHBondContact O-N 2.69Å
85	T	87.6	Confident	89.1	Confident	34 Å²	34	71.9 Å²	71.9	21%	0.209	34%	0.344	C	S	.	.	S	Bend	trans	-112.7	122.4	177.8	-54.6	0	0	0	0	109.3	K81 D89 I90	K81-T85 WeakPolarHBondContact O-CB 3.48Å; K81-T85 PolarHBondContact O-N 2.84Å; K81-T85 VanDerWaalsContact O-N 3.16Å; K81-T85 PolarHBondContact O-OG1 3.18Å; T85-D89 HydrophobicContact CG2-CB 3.63Å; T85-I90 HydrophobicContact CG2-CG1 3.74Å
86	D	85.2	Confident	89	Confident	124 Å²	124	71 Å²	71	66%	0.663	34%	0.34	S	S	*	.			trans	-59.2	146.6	176.6	-58.1	-45.1	0	0	0	111	E88 D89 I90	D86-E88 VanDerWaalsContact C-N 3.27Å; D86-E88 PolarHBondContact O-N 3.2Å; D86-D89 WeakPolarHBondContact O-CA 3.48Å; D86-D89 WeakPolarHBondContact O-CB 3.42Å; D86-D89 PolarHBondContact O-N 3.27Å; D86-I90 PolarHBondContact O-N 2.95Å
87	M	81.5	Confident	89	Confident	89 Å²	89	70 Å²	70	44%	0.438	34%	0.335	S	S	.	.	H	α-helix	trans	-53.7	-42.7	-176.3	-170.1	-165.6	-72.6	0	0	112.6	D89 I90 K91 K318 D319	M87-D89 PolarHBondContact O-N 3.36Å; M87-I90 WeakPolarHBondContact O-CA 3.36Å; M87-I90 WeakPolarHBondContact O-CB 3.11Å; M87-I90 PolarHBondContact O-N 2.73Å; M87-K91 WeakPolarHBondContact O-CG 3.23Å; M87-K91 PolarHBondContact O-N 2.74Å; M87-K91 VanDerWaalsContact SD-CE 3.56Å; M87-K318 WeakPolarHBondContact CE-O 3.31Å; M87-D319 HydrophobicContact CE-CB 4.31Å
88	E	85.4	Confident	89	Confident	110 Å²	110	68.3 Å²	68.3	51%	0.514	33%	0.327	S	S	.	.	H	α-helix	trans	-61.6	-31.1	176.9	-69.6	-62	114.8	0	0	113	D86 K91 Q92	D86-E88 VanDerWaalsContact C-N 3.27Å; D86-E88 PolarHBondContact O-N 3.2Å; E88-K91 WeakPolarHBondContact OE1-CD 3.13Å; E88-K91 WeakPolarHBondContact OE1-CE 3.45Å; E88-K91 IonicContact OE1-NZ 2.65Å; E88-K91 PolarHBondContact OE1-NZ 3.47Å; E88-Q92 VanDerWaalsContact C-NE2 3.31Å; E88-Q92 WeakPolarHBondContact O-CB 3.26Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.02Å; E88-Q92 PolarHBondContact O-NE2 3.11Å
89	D	86.8	Confident	89	Confident	49 Å²	49	68 Å²	68	26%	0.262	33%	0.326	S	S	.	.	H	α-helix	trans	-78	-28.4	175.5	-91.7	21.2	0	0	0	112.1	T85 D86 M87 Q92 K94	T85-D89 HydrophobicContact CG2-CB 3.63Å; D86-D89 WeakPolarHBondContact O-CA 3.48Å; D86-D89 WeakPolarHBondContact O-CB 3.42Å; D86-D89 PolarHBondContact O-N 3.27Å; M87-D89 PolarHBondContact O-N 3.36Å; D89-Q92 PolarHBondContact OD1-NE2 2.93Å; D89-K94 HydrophobicContact CB-CD 3.71Å; D89-K94 WeakPolarHBondContact O-CB 3.46Å; D89-K94 PolarHBondContact O-N 3.24Å; D89-K94 IonicContact OD1-NZ 3.46Å; D89-K94 PolarHBondContact OD1-NZ 3.2Å; D89-K94 WeakPolarHBondContact OD2-CD 3.34Å; D89-K94 WeakPolarHBondContact OD2-CE 3.39Å; D89-K94 IonicContact OD2-NZ 3.88Å; D89-K94 PolarHBondContact OD2-NZ 3.38Å
90	I	86.3	Confident	88.9	Confident	33 Å²	33	67.9 Å²	67.9	17%	0.169	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-51	167.3	-61.2	177.7	0	0	0	109.9	L82 T85 D86 M87 Q92 G93 L95 I168	L82-I90 HydrophobicContact CD1-CD1 4.35Å; T85-I90 HydrophobicContact CG2-CG1 3.74Å; D86-I90 PolarHBondContact O-N 2.95Å; M87-I90 WeakPolarHBondContact O-CA 3.36Å; M87-I90 WeakPolarHBondContact O-CB 3.11Å; M87-I90 PolarHBondContact O-N 2.73Å; I90-Q92 VanDerWaalsContact C-N 3.26Å; I90-Q92 PolarHBondContact O-N 3.31Å; I90-G93 PolarHBondContact O-N 3.5Å; I90-L95 HydrophobicContact CD1-CD2 4.2Å; I90-L95 HydrophobicContact CG1-CB 4.25Å; I90-L95 HydrophobicContact CG1-CD2 4.08Å; I90-L95 HydrophobicContact CG2-CB 4.47Å; I90-L95 HydrophobicContact CG2-CD2 4.03Å; I90-I168 HydrophobicContact CG2-CD1 4.26Å; I90-I168 HydrophobicContact CG2-CG2 3.7Å
91	K	83.7	Confident	88.8	Confident	47 Å²	47	69.4 Å²	69.4	20%	0.204	34%	0.339	C	S	.	.	H	α-helix	trans	-57.4	-35.1	176.6	-64.2	-177.6	-167.3	177	0	113.1	M87 E88 G93 K169 T172 E176	M87-K91 WeakPolarHBondContact O-CG 3.23Å; M87-K91 PolarHBondContact O-N 2.74Å; M87-K91 VanDerWaalsContact SD-CE 3.56Å; E88-K91 WeakPolarHBondContact OE1-CD 3.13Å; E88-K91 WeakPolarHBondContact OE1-CE 3.45Å; E88-K91 IonicContact OE1-NZ 2.65Å; E88-K91 PolarHBondContact OE1-NZ 3.47Å; K91-G93 PolarHBondContact O-N 3.25Å; K91-K169 WeakPolarHBondContact O-CE 3.35Å; K91-T172 HydrophobicContact CD-CG2 3.74Å; K91-T172 HydrophobicContact CG-CG2 3.85Å; K91-E176 WeakPolarHBondContact CE-OE1 3.38Å; K91-E176 IonicContact NZ-OE1 2.69Å; K91-E176 PolarHBondContact NZ-OE1 2.83Å
92	Q	88.1	Confident	88.9	Confident	106 Å²	106	66.5 Å²	66.5	50%	0.495	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-6.8	174	-77	164.1	65	0	0	114.4	E88 D89 I90 K94	E88-Q92 VanDerWaalsContact C-NE2 3.31Å; E88-Q92 WeakPolarHBondContact O-CB 3.26Å; E88-Q92 WeakPolarHBondContact O-CG 3.41Å; E88-Q92 PolarHBondContact O-N 3.02Å; E88-Q92 PolarHBondContact O-NE2 3.11Å; D89-Q92 PolarHBondContact OD1-NE2 2.93Å; I90-Q92 VanDerWaalsContact C-N 3.26Å; I90-Q92 PolarHBondContact O-N 3.31Å; Q92-K94 HydrophobicContact CB-CD 4.42Å; Q92-K94 HydrophobicContact CB-CG 4.42Å
93	G	87.6	Confident	89	Confident	4 Å²	4	67.1 Å²	67.1	4%	0.041	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	80	18.4	-179.5	0	0	0	0	0	114.5	I90 K91 Q97 D165	I90-G93 PolarHBondContact O-N 3.5Å; K91-G93 PolarHBondContact O-N 3.25Å; G93-Q97 PolarHBondContact O-NE2 2.71Å; G93-D165 WeakPolarHBondContact CA-OD1 3.43Å
94	K	89.6	Confident	89.3	Confident	82 Å²	82	68.6 Å²	68.6	36%	0.357	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-42.9	177.1	-66.6	163.8	173.7	171	0	111.1	D89 Q92 A96 Q97	D89-K94 HydrophobicContact CB-CD 3.71Å; D89-K94 WeakPolarHBondContact O-CB 3.46Å; D89-K94 PolarHBondContact O-N 3.24Å; D89-K94 IonicContact OD1-NZ 3.46Å; D89-K94 PolarHBondContact OD1-NZ 3.2Å; D89-K94 WeakPolarHBondContact OD2-CD 3.34Å; D89-K94 WeakPolarHBondContact OD2-CE 3.39Å; D89-K94 IonicContact OD2-NZ 3.88Å; D89-K94 PolarHBondContact OD2-NZ 3.38Å; Q92-K94 HydrophobicContact CB-CD 4.42Å; Q92-K94 HydrophobicContact CB-CG 4.42Å; K94-A96 VanDerWaalsContact C-N 3.28Å; K94-A96 PolarHBondContact O-N 3.47Å; K94-Q97 WeakPolarHBondContact O-CB 3.27Å; K94-Q97 PolarHBondContact O-N 3.38Å
95	L	90.9	Very high	89.5	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.026	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-59.8	-37.8	176.7	-178.3	65.5	0	0	0	112.3	F78 K81 L82 I90 Q97 E98 I168	F78-L95 HydrophobicContact CE1-CD1 4.14Å; F78-L95 HydrophobicContact CE1-CD2 4.33Å; F78-L95 HydrophobicContact CE1-CG 4.37Å; F78-L95 HydrophobicContact CE2-CD1 4Å; F78-L95 HydrophobicContact CE2-CG 4.15Å; F78-L95 HydrophobicContact CZ-CD1 3.71Å; F78-L95 HydrophobicContact CZ-CD2 3.95Å; F78-L95 HydrophobicContact CZ-CG 3.65Å; K81-L95 HydrophobicContact CB-CD1 4.08Å; L82-L95 HydrophobicContact CD1-CD2 3.7Å; I90-L95 HydrophobicContact CD1-CD2 4.2Å; I90-L95 HydrophobicContact CG1-CB 4.25Å; I90-L95 HydrophobicContact CG1-CD2 4.08Å; I90-L95 HydrophobicContact CG2-CB 4.47Å; I90-L95 HydrophobicContact CG2-CD2 4.03Å; L95-Q97 PolarHBondContact O-N 3.34Å; L95-E98 WeakPolarHBondContact O-CB 3.49Å; L95-E98 PolarHBondContact O-N 2.97Å; L95-I168 HydrophobicContact CD2-CD1 4.28Å
96	A	92.4	Very high	89.8	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-59.7	-29.8	179.6	0	0	0	0	0	113.1	K94 E98 L99 V161 L164 D165	K94-A96 VanDerWaalsContact C-N 3.28Å; K94-A96 PolarHBondContact O-N 3.47Å; A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 PolarHBondContact O-N 2.88Å; A96-L99 WeakPolarHBondContact O-CB 3.31Å; A96-L99 PolarHBondContact O-N 3.38Å; A96-V161 HydrophobicContact CB-CG1 4.19Å; A96-L164 HydrophobicContact CB-CB 4.24Å; A96-L164 HydrophobicContact CB-CG 4.22Å; A96-D165 HydrophobicContact CB-CB 3.91Å
97	Q	92.6	Very high	90.2	Very high	121 Å²	121	64 Å²	64	57%	0.565	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-71.9	-19.3	178.4	-63.5	169.4	45.3	0	0	113.1	G93 K94 L95 L99 V161	G93-Q97 PolarHBondContact O-NE2 2.71Å; K94-Q97 WeakPolarHBondContact O-CB 3.27Å; K94-Q97 PolarHBondContact O-N 3.38Å; L95-Q97 PolarHBondContact O-N 3.34Å; Q97-L99 PolarHBondContact O-N 3.04Å; Q97-V161 HydrophobicContact CG-CG1 4.42Å
98	E	93.1	Very high	90.8	Very high	33 Å²	33	62.8 Å²	62.8	15%	0.154	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-73.3	-13	176.9	-60	-70.4	167.2	0	0	112.3	H77 F78 K81 L95 A96 D100 F101	H77-E98 IonicContact CD2-OE2 3.66Å; H77-E98 IonicContact CE1-OE2 3.63Å; H77-E98 PolarHBondContact CE1-OE2 3.25Å; H77-E98 IonicContact NE2-OE2 3.65Å; H77-E98 PolarHBondContact NE2-OE2 2.85Å; F78-E98 HydrophobicContact CD2-CB 4.26Å; F78-E98 HydrophobicContact CE2-CB 4.43Å; K81-E98 HydrophobicContact CB-CG 4.21Å; K81-E98 HydrophobicContact CD-CG 3.94Å; K81-E98 VanDerWaalsContact CE-OE1 3.25Å; K81-E98 WeakPolarHBondContact CE-OE1 3.36Å; K81-E98 VanDerWaalsContact CE-OE2 3.32Å; K81-E98 WeakPolarHBondContact CE-OE2 3.3Å; K81-E98 HydrophobicContact CG-CB 4.39Å; K81-E98 HydrophobicContact CG-CG 3.87Å; K81-E98 VanDerWaalsContact NZ-CD 3.33Å; K81-E98 IonicContact NZ-OE1 2.82Å; K81-E98 PolarHBondContact NZ-OE1 2.68Å; K81-E98 IonicContact NZ-OE2 2.75Å; L95-E98 WeakPolarHBondContact O-CB 3.49Å; L95-E98 PolarHBondContact O-N 2.97Å; A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 PolarHBondContact O-N 2.88Å; E98-D100 PolarHBondContact O-N 3.38Å; E98-F101 PolarHBondContact O-N 3.37Å
99	L	93.3	Very high	91.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-59.7	-22.8	176.6	-174.9	66.4	0	0	0	113.9	L72 A96 Q97 F101 V102 R107 L110 F159 E160 V161 L164	L72-L99 HydrophobicContact CD2-CD1 3.73Å; A96-L99 WeakPolarHBondContact O-CB 3.31Å; A96-L99 PolarHBondContact O-N 3.38Å; Q97-L99 PolarHBondContact O-N 3.04Å; L99-F101 VanDerWaalsContact C-N 3.29Å; L99-V102 HydrophobicContact CD1-CB 4.49Å; L99-V102 HydrophobicContact CD1-CG2 4.34Å; L99-V102 WeakPolarHBondContact O-CB 3.41Å; L99-V102 PolarHBondContact O-N 3.02Å; L99-R107 PolarHBondContact O-NE 3.4Å; L99-L110 HydrophobicContact CD1-CD1 3.68Å; L99-F159 HydrophobicContact CD1-CE1 4.25Å; L99-F159 HydrophobicContact CD2-CD1 3.93Å; L99-F159 HydrophobicContact CD2-CE1 3.79Å; L99-E160 VanDerWaalsContact CD2-C 3.44Å; L99-V161 HydrophobicContact CB-CG2 4.31Å; L99-V161 HydrophobicContact CD2-CG2 4.43Å; L99-L164 HydrophobicContact CB-CD2 4.21Å; L99-L164 HydrophobicContact CD1-CD2 4.29Å; L99-L164 HydrophobicContact CD2-CB 4.26Å; L99-L164 HydrophobicContact CD2-CD2 4.33Å
100	D	90.5	Very high	91.8	Very high	105 Å²	105	57.1 Å²	57.1	56%	0.561	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-78.8	-11.8	176.4	-77.1	-16.8	0	0	0	113.5	E98 R107	E98-D100 PolarHBondContact O-N 3.38Å; D100-R107 IonicContact OD1-CZ 3.52Å; D100-R107 IonicContact OD1-NH2 2.74Å; D100-R107 PolarHBondContact OD1-NH2 3.46Å
101	F	92.7	Very high	92.2	Very high	141 Å²	141	57 Å²	57	62%	0.618	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-8.9	172.5	-54.8	-69	0	0	0	113.1	E98 L99	E98-F101 PolarHBondContact O-N 3.37Å; L99-F101 VanDerWaalsContact C-N 3.29Å
102	V	93.3	Very high	92.8	Very high	12 Å²	12	58.2 Å²	58.2	7%	0.073	28%	0.283	C	S	.	.	S	Bend	trans	-66.2	140.4	179.2	170.5	0	0	0	0	111.5	L72 D75 F78 L99 V106	L72-V102 HydrophobicContact CD2-CG2 4.31Å; D75-V102 HydrophobicContact CB-CG1 4.36Å; F78-V102 HydrophobicContact CB-CG2 3.94Å; F78-V102 HydrophobicContact CD2-CG2 3.76Å; F78-V102 HydrophobicContact CG-CG2 4.2Å; L99-V102 HydrophobicContact CD1-CB 4.49Å; L99-V102 HydrophobicContact CD1-CG2 4.34Å; L99-V102 WeakPolarHBondContact O-CB 3.41Å; L99-V102 PolarHBondContact O-N 3.02Å; V102-V106 HydrophobicContact CG1-CB 3.55Å; V102-V106 HydrophobicContact CG1-CG1 3.49Å; V102-V106 VanDerWaalsContact CG1-CG1 3.49Å; V102-V106 HydrophobicContact CG1-CG2 4.47Å
103	S	92.7	Very high	93.2	Very high	54 Å²	54	53.2 Å²	53.2	38%	0.378	26%	0.26	S	S	.	.			trans	-59.9	143.5	-178.3	59.3	0	0	0	0	113.6	D75 H105 V106 R107	D75-S103 WeakPolarHBondContact OD2-CB 3.2Å; D75-S103 PolarHBondContact OD2-N 2.94Å; D75-S103 PolarHBondContact OD2-OG 2.97Å; S103-H105 PolarHBondContact O-N 2.82Å; S103-V106 PolarHBondContact O-N 3.14Å; S103-R107 PolarHBondContact O-N 3.42Å; S103-R107 VanDerWaalsContact O-N 3.12Å
104	H	93.1	Very high	93.6	Very high	158 Å²	158	53 Å²	53	73%	0.731	26%	0.258	S	S	*	.	H	α-helix	trans	-52.5	-33.4	-177.5	-175.1	-58	0	0	0	113.2	T108	H104-T108 PolarHBondContact CE1-OG1 3.06Å; H104-T108 VanDerWaalsContact CE1-OG1 3.28Å; H104-T108 PolarHBondContact ND1-OG1 2.96Å; H104-T108 WeakPolarHBondContact O-CB 3.33Å; H104-T108 PolarHBondContact O-N 2.94Å; H104-T108 PolarHBondContact O-OG1 3.11Å
105	H	92.6	Very high	93.8	Very high	144 Å²	144	53.4 Å²	53.4	67%	0.667	26%	0.257	S	S	*	.	H	α-helix	trans	-63.8	-43.6	178.2	179.6	37.6	0	0	0	112	S103 T108 K109	S103-H105 PolarHBondContact O-N 2.82Å; H105-T108 PolarHBondContact O-N 3.13Å; H105-K109 PolarHBondContact O-N 2.9Å; H105-K109 VanDerWaalsContact O-N 3.16Å
106	V	93.9	Very high	94	Very high	6 Å²	6	57.4 Å²	57.4	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-68.5	-49.1	177.2	173.6	0	0	0	0	110.3	F71 L72 D75 V102 S103 T108 K109 L110	F71-V106 VanDerWaalsContact O-CG1 3.24Å; F71-V106 WeakPolarHBondContact O-CG1 3.38Å; L72-V106 HydrophobicContact CD2-CG1 4.43Å; D75-V106 HydrophobicContact CB-CG2 4.4Å; V102-V106 HydrophobicContact CG1-CB 3.55Å; V102-V106 HydrophobicContact CG1-CG1 3.49Å; V102-V106 VanDerWaalsContact CG1-CG1 3.49Å; V102-V106 HydrophobicContact CG1-CG2 4.47Å; S103-V106 PolarHBondContact O-N 3.14Å; V106-T108 VanDerWaalsContact C-N 3.27Å; V106-T108 PolarHBondContact O-N 2.92Å; V106-K109 WeakPolarHBondContact O-CA 3.48Å; V106-K109 PolarHBondContact O-N 3.09Å; V106-L110 HydrophobicContact CG1-CD1 3.95Å; V106-L110 HydrophobicContact CG1-CG 4.19Å; V106-L110 WeakPolarHBondContact O-CG 3.24Å; V106-L110 PolarHBondContact O-N 2.99Å
107	R	94.7	Very high	94.1	Very high	45 Å²	45	57.9 Å²	57.9	17%	0.17	28%	0.278	C	S	.	.	H	α-helix	trans	-50	-46.3	172.2	-83.4	-68.5	-143.1	128.6	1.5	112.1	L99 D100 S103 K109 L110 D111 F159 E160	L99-R107 PolarHBondContact O-NE 3.4Å; D100-R107 IonicContact OD1-CZ 3.52Å; D100-R107 IonicContact OD1-NH2 2.74Å; D100-R107 PolarHBondContact OD1-NH2 3.46Å; S103-R107 PolarHBondContact O-N 3.42Å; S103-R107 VanDerWaalsContact O-N 3.12Å; R107-K109 VanDerWaalsContact C-N 3.27Å; R107-K109 PolarHBondContact O-N 2.91Å; R107-L110 PolarHBondContact O-N 3.12Å; R107-D111 VanDerWaalsContact O-CG 3.31Å; R107-D111 PolarHBondContact O-N 2.98Å; R107-F159 PolarHBondContact NH1-O 3.18Å; R107-E160 IonicContact CZ-OE2 3.42Å; R107-E160 IonicContact NH1-OE2 3.15Å; R107-E160 PolarHBondContact NH1-OE2 2.77Å; R107-E160 IonicContact NH2-OE2 2.73Å; R107-E160 PolarHBondContact NH2-OE2 3.42Å
108	T	94.7	Very high	94.1	Very high	63 Å²	63	52.2 Å²	52.2	39%	0.387	25%	0.251	S	S	.	.	H	α-helix	trans	-60.2	-34.1	177.3	-53.4	0	0	0	0	112.9	H104 H105 V106 E112	H104-T108 PolarHBondContact CE1-OG1 3.06Å; H104-T108 VanDerWaalsContact CE1-OG1 3.28Å; H104-T108 PolarHBondContact ND1-OG1 2.96Å; H104-T108 WeakPolarHBondContact O-CB 3.33Å; H104-T108 PolarHBondContact O-N 2.94Å; H104-T108 PolarHBondContact O-OG1 3.11Å; H105-T108 PolarHBondContact O-N 3.13Å; V106-T108 VanDerWaalsContact C-N 3.27Å; V106-T108 PolarHBondContact O-N 2.92Å; T108-E112 PolarHBondContact O-N 3.26Å
109	K	95.4	Very high	94	Very high	40 Å²	40	54.6 Å²	54.6	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-78.7	-39.6	178.3	-179.1	61.4	-164.8	173.7	0	111.9	F71 H105 V106 R107 D111 E112 L113	F71-K109 HydrophobicContact CB-CG 4.5Å; F71-K109 HydrophobicContact CD1-CB 4.31Å; F71-K109 HydrophobicContact CD1-CG 3.69Å; F71-K109 HydrophobicContact CD2-CG 3.94Å; F71-K109 HydrophobicContact CE1-CD 4.48Å; F71-K109 HydrophobicContact CE1-CG 3.82Å; F71-K109 HydrophobicContact CE2-CD 4.41Å; F71-K109 HydrophobicContact CE2-CG 4.06Å; F71-K109 HydrophobicContact CG-CG 3.76Å; F71-K109 HydrophobicContact CZ-CD 4.29Å; F71-K109 HydrophobicContact CZ-CG 4Å; H105-K109 PolarHBondContact O-N 2.9Å; H105-K109 VanDerWaalsContact O-N 3.16Å; V106-K109 WeakPolarHBondContact O-CA 3.48Å; V106-K109 PolarHBondContact O-N 3.09Å; R107-K109 VanDerWaalsContact C-N 3.27Å; R107-K109 PolarHBondContact O-N 2.91Å; K109-D111 VanDerWaalsContact C-N 3.29Å; K109-D111 PolarHBondContact O-N 3.13Å; K109-E112 HydrophobicContact CD-CB 4.38Å; K109-E112 VanDerWaalsContact CD-OE2 3.24Å; K109-E112 WeakPolarHBondContact CD-OE2 3.23Å; K109-E112 VanDerWaalsContact NZ-CD 3.27Å; K109-E112 IonicContact NZ-OE1 2.76Å; K109-E112 PolarHBondContact NZ-OE1 3.07Å; K109-E112 IonicContact NZ-OE2 3.94Å; K109-E112 PolarHBondContact NZ-OE2 3.2Å; K109-E112 WeakPolarHBondContact O-CA 3.42Å; K109-E112 VanDerWaalsContact O-CB 3.23Å; K109-E112 WeakPolarHBondContact O-CB 3.4Å; K109-E112 PolarHBondContact O-N 2.89Å; K109-L113 WeakPolarHBondContact O-CG 3.26Å; K109-L113 PolarHBondContact O-N 2.87Å
110	L	96.3	Very high	94	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-40.6	174.4	-63.7	172.7	0	0	0	111.4	V68 F71 L72 L99 V106 R107 E112 L113 K114 F159	V68-L110 HydrophobicContact CB-CD2 4.24Å; V68-L110 HydrophobicContact CG1-CD2 3.94Å; V68-L110 HydrophobicContact CG2-CD2 4.09Å; F71-L110 HydrophobicContact CB-CD2 4.48Å; L72-L110 HydrophobicContact CD2-CD1 3.72Å; L72-L110 HydrophobicContact CG-CD1 4.19Å; L72-L110 HydrophobicContact CG-CD2 4.3Å; L99-L110 HydrophobicContact CD1-CD1 3.68Å; V106-L110 HydrophobicContact CG1-CD1 3.95Å; V106-L110 HydrophobicContact CG1-CG 4.19Å; V106-L110 WeakPolarHBondContact O-CG 3.24Å; V106-L110 PolarHBondContact O-N 2.99Å; R107-L110 PolarHBondContact O-N 3.12Å; L110-E112 PolarHBondContact O-N 3.11Å; L110-L113 HydrophobicContact CD2-CD1 4.29Å; L110-L113 PolarHBondContact O-N 3.07Å; L110-K114 PolarHBondContact O-N 2.93Å; L110-F159 HydrophobicContact CB-CB 3.87Å; L110-F159 HydrophobicContact CB-CD1 3.69Å; L110-F159 HydrophobicContact CB-CE1 4.36Å; L110-F159 HydrophobicContact CB-CG 3.8Å; L110-F159 HydrophobicContact CD1-CD1 3.86Å; L110-F159 HydrophobicContact CD1-CE1 3.94Å; L110-F159 HydrophobicContact CG-CD1 4.27Å
111	D	95.8	Very high	94.1	Very high	30 Å²	30	53.9 Å²	53.9	16%	0.16	25%	0.254	C	S	.	.	H	α-helix	trans	-57.4	-34.7	170.4	-68.2	-15.4	0	0	0	112.9	R107 K109 R115 T158 F159	R107-D111 VanDerWaalsContact O-CG 3.31Å; R107-D111 PolarHBondContact O-N 2.98Å; K109-D111 VanDerWaalsContact C-N 3.29Å; K109-D111 PolarHBondContact O-N 3.13Å; D111-R115 VanDerWaalsContact C-CZ 3.48Å; D111-R115 VanDerWaalsContact O-CG 3.3Å; D111-R115 WeakPolarHBondContact O-CG 3.42Å; D111-R115 PolarHBondContact O-N 3.32Å; D111-R115 PolarHBondContact O-NE 3.29Å; D111-R115 PolarHBondContact O-NH1 3.24Å; D111-R115 PolarHBondContact O-NH2 2.81Å; D111-T158 VanDerWaalsContact OD1-CA 3.29Å; D111-T158 WeakPolarHBondContact OD1-CA 3.23Å; D111-T158 VanDerWaalsContact OD1-CG2 3.31Å; D111-T158 WeakPolarHBondContact OD1-CG2 3.49Å; D111-F159 PolarHBondContact OD1-N 2.73Å
112	E	95.9	Very high	93.9	Very high	73 Å²	73	50.3 Å²	50.3	34%	0.341	24%	0.237	S	C	.	.	H	α-helix	trans	-72.7	-46	177.1	-160.4	-157.7	154	0	0	111.7	T108 K109 L110 K114 R115 Q116	T108-E112 PolarHBondContact O-N 3.26Å; K109-E112 HydrophobicContact CD-CB 4.38Å; K109-E112 VanDerWaalsContact CD-OE2 3.24Å; K109-E112 WeakPolarHBondContact CD-OE2 3.23Å; K109-E112 VanDerWaalsContact NZ-CD 3.27Å; K109-E112 IonicContact NZ-OE1 2.76Å; K109-E112 PolarHBondContact NZ-OE1 3.07Å; K109-E112 IonicContact NZ-OE2 3.94Å; K109-E112 PolarHBondContact NZ-OE2 3.2Å; K109-E112 WeakPolarHBondContact O-CA 3.42Å; K109-E112 VanDerWaalsContact O-CB 3.23Å; K109-E112 WeakPolarHBondContact O-CB 3.4Å; K109-E112 PolarHBondContact O-N 2.89Å; L110-E112 PolarHBondContact O-N 3.11Å; E112-K114 PolarHBondContact O-N 3.05Å; E112-R115 PolarHBondContact O-N 3.4Å; E112-Q116 WeakPolarHBondContact O-CG 3.38Å; E112-Q116 PolarHBondContact O-N 2.78Å; E112-Q116 PolarHBondContact OE1-NE2 3.27Å
113	L	96.3	Very high	93.8	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-58.7	-46.8	176.8	-63.6	179.7	0	0	0	110.9	Y64 E67 V68 F71 K109 L110 R115 Q116 E117	Y64-L113 HydrophobicContact CD2-CB 4.32Å; Y64-L113 HydrophobicContact CE2-CB 4.08Å; E67-L113 HydrophobicContact CB-CD1 4.02Å; E67-L113 HydrophobicContact CB-CD2 4.08Å; E67-L113 VanDerWaalsContact O-CD1 3.31Å; E67-L113 WeakPolarHBondContact O-CD1 3.41Å; E67-L113 WeakPolarHBondContact OE2-CD2 3.32Å; V68-L113 HydrophobicContact CG2-CB 4.47Å; V68-L113 HydrophobicContact CG2-CD1 3.96Å; F71-L113 HydrophobicContact CD2-CD1 4.25Å; K109-L113 WeakPolarHBondContact O-CG 3.26Å; K109-L113 PolarHBondContact O-N 2.87Å; L110-L113 HydrophobicContact CD2-CD1 4.29Å; L110-L113 PolarHBondContact O-N 3.07Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 2.95Å; L113-Q116 WeakPolarHBondContact O-CA 3.42Å; L113-Q116 WeakPolarHBondContact O-CB 3.3Å; L113-Q116 PolarHBondContact O-N 3.15Å; L113-E117 PolarHBondContact O-N 3.01Å
114	K	95.4	Very high	93.6	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-39.7	177	-173.1	176	173.3	-176	0	112.5	L110 E112 Q116 E117 V118 N152 N155 T158 F159 D163	L110-K114 PolarHBondContact O-N 2.93Å; E112-K114 PolarHBondContact O-N 3.05Å; K114-Q116 VanDerWaalsContact C-N 3.34Å; K114-E117 PolarHBondContact O-N 2.75Å; K114-V118 HydrophobicContact CG-CG2 4.47Å; K114-V118 WeakPolarHBondContact O-CB 3.3Å; K114-V118 VanDerWaalsContact O-CG2 3.26Å; K114-V118 WeakPolarHBondContact O-CG2 3.3Å; K114-V118 PolarHBondContact O-N 2.74Å; K114-N152 PolarHBondContact NZ-O 3.48Å; K114-N152 VanDerWaalsContact NZ-O 3.14Å; K114-N155 WeakPolarHBondContact CE-O 3.23Å; K114-N155 PolarHBondContact NZ-O 3.03Å; K114-T158 WeakPolarHBondContact CD-O 3.33Å; K114-T158 PolarHBondContact NZ-O 3.49Å; K114-F159 HydrophobicContact CB-CB 4.22Å; K114-F159 HydrophobicContact CB-CD2 4.21Å; K114-F159 HydrophobicContact CD-CB 4.07Å; K114-F159 HydrophobicContact CD-CD2 4.22Å; K114-D163 WeakPolarHBondContact CE-OD1 3.34Å; K114-D163 IonicContact NZ-OD1 2.66Å; K114-D163 PolarHBondContact NZ-OD1 3.09Å; K114-D163 IonicContact NZ-OD2 2.72Å; K114-D163 PolarHBondContact NZ-OD2 3.3Å
115	R	95	Very high	93.3	Very high	90 Å²	90	49 Å²	49	34%	0.34	23%	0.233	S	C	.	.	H	α-helix	trans	-66.9	-33.7	174	-74.4	-178.7	-60.7	-104.7	0.1	112.5	D111 E112 L113 N119 H157	D111-R115 VanDerWaalsContact C-CZ 3.48Å; D111-R115 VanDerWaalsContact O-CG 3.3Å; D111-R115 WeakPolarHBondContact O-CG 3.42Å; D111-R115 PolarHBondContact O-N 3.32Å; D111-R115 PolarHBondContact O-NE 3.29Å; D111-R115 PolarHBondContact O-NH1 3.24Å; D111-R115 PolarHBondContact O-NH2 2.81Å; E112-R115 PolarHBondContact O-N 3.4Å; L113-R115 VanDerWaalsContact C-N 3.32Å; L113-R115 PolarHBondContact O-N 2.95Å; R115-N119 WeakPolarHBondContact O-CB 3.46Å; R115-N119 PolarHBondContact O-N 3.36Å; R115-N119 PolarHBondContact O-ND2 2.83Å; R115-H157 PolarHBondContact NH1-O 3.09Å
116	Q	94.8	Very high	93	Very high	89 Å²	89	47.1 Å²	47.1	42%	0.416	22%	0.223	S	C	.	.	H	α-helix	trans	-68.2	-47.5	175	-75.3	163.9	-9.1	0	0	110.6	E112 L113 K114 N119 R120	E112-Q116 WeakPolarHBondContact O-CG 3.38Å; E112-Q116 PolarHBondContact O-N 2.78Å; E112-Q116 PolarHBondContact OE1-NE2 3.27Å; L113-Q116 WeakPolarHBondContact O-CA 3.42Å; L113-Q116 WeakPolarHBondContact O-CB 3.3Å; L113-Q116 PolarHBondContact O-N 3.15Å; K114-Q116 VanDerWaalsContact C-N 3.34Å; Q116-N119 PolarHBondContact O-N 3.1Å; Q116-R120 PolarHBondContact O-N 2.71Å
117	E	94	Very high	92.6	Very high	10 Å²	10	49 Å²	49	5%	0.047	24%	0.239	C	C	.	.	H	α-helix	trans	-62	-49.6	177.1	174.8	61.7	173	0	0	112.4	Y64 L113 K114 N119 R120 L121 H150	Y64-E117 HydrophobicContact CD1-CB 4.4Å; Y64-E117 HydrophobicContact CD1-CG 3.92Å; Y64-E117 HydrophobicContact CD2-CB 3.69Å; Y64-E117 HydrophobicContact CD2-CG 4.14Å; Y64-E117 HydrophobicContact CE1-CG 4.17Å; Y64-E117 HydrophobicContact CE2-CB 3.89Å; Y64-E117 HydrophobicContact CE2-CG 4.38Å; Y64-E117 HydrophobicContact CG-CB 3.95Å; Y64-E117 HydrophobicContact CG-CG 3.89Å; L113-E117 PolarHBondContact O-N 3.01Å; K114-E117 PolarHBondContact O-N 2.75Å; E117-N119 PolarHBondContact O-N 2.98Å; E117-N119 VanDerWaalsContact O-N 3.12Å; E117-R120 WeakPolarHBondContact O-CA 3.22Å; E117-R120 WeakPolarHBondContact O-CB 3.35Å; E117-R120 PolarHBondContact O-N 3.41Å; E117-R120 IonicContact OE1-CZ 2.7Å; E117-R120 IonicContact OE1-NE 2.74Å; E117-R120 IonicContact OE1-NH2 3.92Å; E117-R120 PolarHBondContact OE1-NH2 3.31Å; E117-R120 IonicContact OE2-CZ 2.71Å; E117-R120 IonicContact OE2-NE 2.73Å; E117-R120 PolarHBondContact OE2-NE 3.29Å; E117-R120 IonicContact OE2-NH2 2.75Å; E117-R120 PolarHBondContact OE2-NH2 2.98Å; E117-R120 VanDerWaalsContact OE2-NH2 3.16Å; E117-L121 HydrophobicContact CG-CD1 4.03Å; E117-L121 HydrophobicContact CG-CG 4.37Å; E117-L121 WeakPolarHBondContact O-CG 3.5Å; E117-L121 PolarHBondContact O-N 2.79Å; E117-H150 IonicContact OE1-CD2 2.72Å; E117-H150 IonicContact OE1-CE1 2.84Å; E117-H150 IonicContact OE1-NE2 2.76Å; E117-H150 PolarHBondContact OE1-NE2 2.85Å
118	V	92.4	Very high	92	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-56.5	-33.7	176.2	169.1	0	0	0	0	112	K114 R122 L145 L151 P156	K114-V118 HydrophobicContact CG-CG2 4.47Å; K114-V118 WeakPolarHBondContact O-CB 3.3Å; K114-V118 VanDerWaalsContact O-CG2 3.26Å; K114-V118 WeakPolarHBondContact O-CG2 3.3Å; K114-V118 PolarHBondContact O-N 2.74Å; V118-R122 VanDerWaalsContact CG1-CZ 3.43Å; V118-R122 WeakPolarHBondContact O-CB 3.1Å; V118-R122 WeakPolarHBondContact O-CD 3.38Å; V118-R122 WeakPolarHBondContact O-CG 3.36Å; V118-R122 PolarHBondContact O-N 3.1Å; V118-R122 VanDerWaalsContact O-N 3.09Å; V118-L145 HydrophobicContact CG1-CD1 4.26Å; V118-L151 HydrophobicContact CG2-CD1 3.6Å; V118-P156 HydrophobicContact CG1-CB 3.98Å; V118-P156 HydrophobicContact CG2-CB 4.42Å
119	N	91.4	Very high	91.4	Very high	83 Å²	83	51.7 Å²	51.7	44%	0.444	25%	0.248	S	C	.	.	H	α-helix	trans	-77.9	-32.4	176.1	-71.1	-23.5	0	0	0	113.1	R115 Q116 E117 R122 T123	R115-N119 WeakPolarHBondContact O-CB 3.46Å; R115-N119 PolarHBondContact O-N 3.36Å; R115-N119 PolarHBondContact O-ND2 2.83Å; Q116-N119 PolarHBondContact O-N 3.1Å; E117-N119 PolarHBondContact O-N 2.98Å; E117-N119 VanDerWaalsContact O-N 3.12Å; N119-R122 PolarHBondContact OD1-NH1 3.38Å; N119-T123 PolarHBondContact O-N 3.43Å; N119-T123 VanDerWaalsContact O-N 3.09Å; N119-T123 PolarHBondContact O-OG1 3.38Å
120	R	93.5	Very high	90.7	Very high	90 Å²	90	54 Å²	54	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-59.4	-53.1	168.4	-174.7	-173.9	71.6	116.5	-4.7	110.4	H60 Q116 E117 R122 T123 L124	H60-R120 VanDerWaalsContact O-CZ 3.25Å; H60-R120 PolarHBondContact O-NH1 3.08Å; H60-R120 PolarHBondContact O-NH2 3.02Å; Q116-R120 PolarHBondContact O-N 2.71Å; E117-R120 WeakPolarHBondContact O-CA 3.22Å; E117-R120 WeakPolarHBondContact O-CB 3.35Å; E117-R120 PolarHBondContact O-N 3.41Å; E117-R120 IonicContact OE1-CZ 2.7Å; E117-R120 IonicContact OE1-NE 2.74Å; E117-R120 IonicContact OE1-NH2 3.92Å; E117-R120 PolarHBondContact OE1-NH2 3.31Å; E117-R120 IonicContact OE2-CZ 2.71Å; E117-R120 IonicContact OE2-NE 2.73Å; E117-R120 PolarHBondContact OE2-NE 3.29Å; E117-R120 IonicContact OE2-NH2 2.75Å; E117-R120 PolarHBondContact OE2-NH2 2.98Å; E117-R120 VanDerWaalsContact OE2-NH2 3.16Å; R120-R122 PolarHBondContact O-N 3.29Å; R120-T123 WeakPolarHBondContact O-CA 3.39Å; R120-T123 WeakPolarHBondContact O-CB 3.35Å; R120-T123 PolarHBondContact O-N 2.57Å; R120-L124 HydrophobicContact CG-CD1 4.31Å; R120-L124 PolarHBondContact O-N 3.49Å
121	L	91.8	Very high	89.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-40.4	-178.7	-61.9	175	0	0	0	112.3	E117 T123 L124 I125 L145 F148 L151	E117-L121 HydrophobicContact CG-CD1 4.03Å; E117-L121 HydrophobicContact CG-CG 4.37Å; E117-L121 WeakPolarHBondContact O-CG 3.5Å; E117-L121 PolarHBondContact O-N 2.79Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.83Å; L121-L124 HydrophobicContact CD2-CD1 4.44Å; L121-L124 PolarHBondContact O-N 3.28Å; L121-I125 WeakPolarHBondContact O-CB 3.48Å; L121-I125 VanDerWaalsContact O-CG1 3.32Å; L121-I125 WeakPolarHBondContact O-CG1 3.23Å; L121-I125 PolarHBondContact O-N 2.57Å; L121-L145 HydrophobicContact CB-CD2 3.62Å; L121-L145 HydrophobicContact CD1-CD2 4.24Å; L121-F148 HydrophobicContact CB-CD2 4.15Å; L121-F148 HydrophobicContact CB-CE2 4.02Å; L121-F148 HydrophobicContact CD1-CB 4.09Å; L121-F148 HydrophobicContact CD1-CD2 3.91Å; L121-F148 HydrophobicContact CD1-CG 3.92Å; L121-F148 HydrophobicContact CD2-CD1 3.88Å; L121-F148 HydrophobicContact CD2-CD2 4.05Å; L121-F148 HydrophobicContact CD2-CE1 3.8Å; L121-F148 HydrophobicContact CD2-CE2 3.97Å; L121-F148 HydrophobicContact CD2-CG 4.02Å; L121-F148 HydrophobicContact CD2-CZ 3.84Å; L121-F148 HydrophobicContact CG-CD2 4.26Å; L121-F148 HydrophobicContact CG-CE2 4.38Å; L121-F148 HydrophobicContact CG-CG 4.47Å; L121-L151 HydrophobicContact CD1-CD1 4.25Å; L121-L151 HydrophobicContact CD1-CD2 3.48Å; L121-L151 VanDerWaalsContact CD1-CD2 3.48Å
122	R	89.8	Confident	89	Confident	67 Å²	67	66.2 Å²	66.2	25%	0.253	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-37.2	171	-76.1	167	177.6	162.3	-1.6	113.2	V118 N119 R120 K126 L145	V118-R122 VanDerWaalsContact CG1-CZ 3.43Å; V118-R122 WeakPolarHBondContact O-CB 3.1Å; V118-R122 WeakPolarHBondContact O-CD 3.38Å; V118-R122 WeakPolarHBondContact O-CG 3.36Å; V118-R122 PolarHBondContact O-N 3.1Å; V118-R122 VanDerWaalsContact O-N 3.09Å; N119-R122 PolarHBondContact OD1-NH1 3.38Å; R120-R122 PolarHBondContact O-N 3.29Å; R122-K126 PolarHBondContact O-N 3.3Å; R122-L145 HydrophobicContact CG-CD1 4.12Å
123	T	89.9	Confident	87.4	Confident	98 Å²	98	65.7 Å²	65.7	60%	0.601	34%	0.336	S	S	*	.	H	α-helix	trans	-70.2	-40.3	178.6	-54.1	0	0	0	0	111	N119 R120 L121 K126 A127	N119-T123 PolarHBondContact O-N 3.43Å; N119-T123 VanDerWaalsContact O-N 3.09Å; N119-T123 PolarHBondContact O-OG1 3.38Å; R120-T123 WeakPolarHBondContact O-CA 3.39Å; R120-T123 WeakPolarHBondContact O-CB 3.35Å; R120-T123 PolarHBondContact O-N 2.57Å; L121-T123 VanDerWaalsContact C-N 3.3Å; L121-T123 PolarHBondContact O-N 2.83Å; T123-K126 PolarHBondContact O-N 2.87Å; T123-A127 WeakPolarHBondContact O-CB 3.4Å; T123-A127 PolarHBondContact O-N 2.87Å
124	L	87.9	Confident	85.6	Confident	88 Å²	88	67.4 Å²	67.4	46%	0.461	35%	0.354	S	S	.	.	H	α-helix	trans	-64.1	-45.4	173.4	-65.9	173.2	0	0	0	111.9	R120 L121 K126 A127 K128	R120-L124 HydrophobicContact CG-CD1 4.31Å; R120-L124 PolarHBondContact O-N 3.49Å; L121-L124 HydrophobicContact CD2-CD1 4.44Å; L121-L124 PolarHBondContact O-N 3.28Å; L124-K126 VanDerWaalsContact C-N 3.32Å; L124-K126 PolarHBondContact O-N 3.46Å; L124-A127 PolarHBondContact O-N 3.01Å; L124-K128 PolarHBondContact O-N 3.18Å
125	I	87.1	Confident	83.8	Confident	9 Å²	9	73.5 Å²	73.5	5%	0.046	39%	0.387	C	S	.	.	H	α-helix	trans	-54.4	-47.5	173.2	-75.6	163.3	0	0	0	111	L121 K128 H129 V139 L144 L145 F148	L121-I125 WeakPolarHBondContact O-CB 3.48Å; L121-I125 VanDerWaalsContact O-CG1 3.32Å; L121-I125 WeakPolarHBondContact O-CG1 3.23Å; L121-I125 PolarHBondContact O-N 2.57Å; I125-K128 PolarHBondContact O-N 2.79Å; I125-H129 PolarHBondContact O-N 2.89Å; I125-H129 VanDerWaalsContact O-N 3.13Å; I125-V139 HydrophobicContact CG2-CG1 4.34Å; I125-L144 HydrophobicContact CD1-CB 3.82Å; I125-L144 HydrophobicContact CG1-CB 4.14Å; I125-L144 HydrophobicContact CG2-CB 4.11Å; I125-L144 HydrophobicContact CG2-CD1 3.6Å; I125-L145 HydrophobicContact CD1-CD2 3.92Å; I125-L145 HydrophobicContact CD1-CG 3.91Å; I125-F148 HydrophobicContact CD1-CE2 4.06Å; I125-F148 HydrophobicContact CG1-CE2 4.26Å
126	K	86.1	Confident	81.9	Confident	106 Å²	106	77.8 Å²	77.8	46%	0.461	42%	0.417	S	S	.	.	H	α-helix	trans	-64.6	-47.2	178.4	-167.3	-174.2	179.9	-79	0	111.7	R122 T123 L124 K128 H129 D130	R122-K126 PolarHBondContact O-N 3.3Å; T123-K126 PolarHBondContact O-N 2.87Å; L124-K126 VanDerWaalsContact C-N 3.32Å; L124-K126 PolarHBondContact O-N 3.46Å; K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 2.71Å; K126-H129 PolarHBondContact O-N 3.14Å; K126-H129 VanDerWaalsContact O-N 3.17Å; K126-D130 IonicContact NZ-OD1 3.6Å; K126-D130 IonicContact NZ-OD2 3.92Å; K126-D130 PolarHBondContact NZ-OD2 2.93Å; K126-D130 WeakPolarHBondContact O-CB 3.46Å; K126-D130 VanDerWaalsContact O-CG 3.23Å; K126-D130 PolarHBondContact O-N 2.88Å
127	A	85.6	Confident	80.2	Confident	45 Å²	45	79.7 Å²	79.7	37%	0.372	43%	0.428	S	S	.	.	H	α-helix	trans	-59.1	-40.2	179.9	0	0	0	0	0	112	T123 L124 D130 L131	T123-A127 WeakPolarHBondContact O-CB 3.4Å; T123-A127 PolarHBondContact O-N 2.87Å; L124-A127 PolarHBondContact O-N 3.01Å; A127-D130 PolarHBondContact O-N 2.84Å; A127-L131 WeakPolarHBondContact O-CB 3.21Å; A127-L131 VanDerWaalsContact O-CG 3.27Å; A127-L131 WeakPolarHBondContact O-CG 3.37Å; A127-L131 PolarHBondContact O-N 3.38Å
128	K	83.6	Confident	78.7	Confident	115 Å²	115	83.9 Å²	83.9	50%	0.5	47%	0.465	S	S	.	.	H	α-helix	trans	-61.3	-48.8	173.5	-179	170.4	177.9	172	0	112	L124 I125 K126 D130 L131 E132	L124-K128 PolarHBondContact O-N 3.18Å; I125-K128 PolarHBondContact O-N 2.79Å; K126-K128 VanDerWaalsContact C-N 3.29Å; K126-K128 PolarHBondContact O-N 2.71Å; K128-D130 PolarHBondContact O-N 3.12Å; K128-L131 PolarHBondContact O-N 2.92Å; K128-E132 WeakPolarHBondContact CE-OE1 3.38Å; K128-E132 HydrophobicContact CG-CG 4.38Å; K128-E132 IonicContact NZ-OE1 3.96Å; K128-E132 WeakPolarHBondContact O-CB 3.47Å; K128-E132 WeakPolarHBondContact O-CG 3.36Å; K128-E132 PolarHBondContact O-N 3.34Å
129	H	81.9	Confident	77.5	Confident	49 Å²	49	85.5 Å²	85.5	23%	0.227	47%	0.474	C	S	.	.	H	α-helix	trans	-63.3	-39.6	178.4	179.5	-96.1	0	0	0	113.2	I125 K126 L131 E132 G134 V139	I125-H129 PolarHBondContact O-N 2.89Å; I125-H129 VanDerWaalsContact O-N 3.13Å; K126-H129 PolarHBondContact O-N 3.14Å; K126-H129 VanDerWaalsContact O-N 3.17Å; H129-L131 VanDerWaalsContact C-N 3.29Å; H129-L131 PolarHBondContact O-N 3.3Å; H129-E132 PolarHBondContact O-N 2.91Å; H129-G134 PolarHBondContact O-N 3.16Å; H129-G134 VanDerWaalsContact O-N 3.16Å; H129-V139 HydrophobicContact CB-CG2 4.29Å; H129-V139 WeakPolarHBondContact CD2-CG2 3.43Å; H129-V139 VanDerWaalsContact CE1-CG2 3.5Å; H129-V139 WeakPolarHBondContact CE1-CG2 3.12Å; H129-V139 WeakPolarHBondContact NE2-CG2 3.43Å
130	D	81.1	Confident	77	Confident	90 Å²	90	86.1 Å²	86.1	48%	0.481	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-33.3	176.6	-67	-11.8	0	0	0	111.2	K126 A127 K128	K126-D130 IonicContact NZ-OD1 3.6Å; K126-D130 IonicContact NZ-OD2 3.92Å; K126-D130 PolarHBondContact NZ-OD2 2.93Å; K126-D130 WeakPolarHBondContact O-CB 3.46Å; K126-D130 VanDerWaalsContact O-CG 3.23Å; K126-D130 PolarHBondContact O-N 2.88Å; A127-D130 PolarHBondContact O-N 2.84Å; K128-D130 PolarHBondContact O-N 3.12Å
131	L	78.6	Confident	76.2	Confident	153 Å²	153	84.7 Å²	84.7	80%	0.801	48%	0.475	S	S	*	.	H	α-helix	trans	-76	-36.9	174.6	-75.1	169.1	0	0	0	113.3	A127 K128 H129 G133	A127-L131 WeakPolarHBondContact O-CB 3.21Å; A127-L131 VanDerWaalsContact O-CG 3.27Å; A127-L131 WeakPolarHBondContact O-CG 3.37Å; A127-L131 PolarHBondContact O-N 3.38Å; K128-L131 PolarHBondContact O-N 2.92Å; H129-L131 VanDerWaalsContact C-N 3.29Å; H129-L131 PolarHBondContact O-N 3.3Å; L131-G133 PolarHBondContact O-N 3.42Å
132	E	76.3	Confident	75.5	Confident	133 Å²	133	87.6 Å²	87.6	62%	0.621	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	12.8	178.6	-72.4	175.5	166.2	0	0	113.5	K128 H129 G134	K128-E132 WeakPolarHBondContact CE-OE1 3.38Å; K128-E132 HydrophobicContact CG-CG 4.38Å; K128-E132 IonicContact NZ-OE1 3.96Å; K128-E132 WeakPolarHBondContact O-CB 3.47Å; K128-E132 WeakPolarHBondContact O-CG 3.36Å; K128-E132 PolarHBondContact O-N 3.34Å; H129-E132 PolarHBondContact O-N 2.91Å; E132-G134 VanDerWaalsContact C-N 3.34Å; E132-G134 PolarHBondContact O-N 2.77Å
133	G	64	Low	75.1	Confident	62 Å²	62	86.2 Å²	86.2	64%	0.639	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	29.7	177	0	0	0	0	0	113.4	L131 N135	L131-G133 PolarHBondContact O-N 3.42Å; G133-N135 PolarHBondContact O-N 2.86Å
134	G	56.9	Low	74.7	Confident	37 Å²	37	85.1 Å²	85.1	38%	0.381	48%	0.481	S	S	.	.			trans	-50.6	120.9	-172.3	0	0	0	0	0	114.5	H129 E132	H129-G134 PolarHBondContact O-N 3.16Å; H129-G134 VanDerWaalsContact O-N 3.16Å; E132-G134 VanDerWaalsContact C-N 3.34Å; E132-G134 PolarHBondContact O-N 2.77Å
135	N	58.3	Low	74.5	Confident	128 Å²	128	81 Å²	81	68%	0.684	46%	0.46	S	S	*	.			trans	-61.9	165.4	164.4	-75.4	-74.2	0	0	0	110.4	G133 I137	G133-N135 PolarHBondContact O-N 2.86Å; N135-I137 HydrophobicContact CB-CD1 4.41Å; N135-I137 HydrophobicContact CB-CG1 4.29Å; N135-I137 PolarHBondContact O-N 2.7Å
136	D	54.8	Low	74.3	Confident	181 Å²	181	86.5 Å²	86.5	97%	0.968	48%	0.483	S	S	*	.	S	Bend	trans	-69.9	32.1	-174.2	-137.7	2	0	0	0	114.5
137	I	59.5	Low	74.2	Confident	128 Å²	128	86.5 Å²	86.5	66%	0.656	49%	0.485	S	S	*	.			trans	-84.3	131.4	179.3	-58.5	176.7	0	0	0	108.6	N135 V139	N135-I137 HydrophobicContact CB-CD1 4.41Å; N135-I137 HydrophobicContact CB-CG1 4.29Å; N135-I137 PolarHBondContact O-N 2.7Å; I137-V139 PolarHBondContact O-N 2.83Å
138	A	61.8	Low	74.3	Confident	99 Å²	99	85.5 Å²	85.5	82%	0.818	47%	0.472	S	S	*	.			trans	-66	99.7	177.6	0	0	0	0	0	111.6	D140	A138-D140 PolarHBondContact O-N 3.19Å
139	V	68.6	Low	74.6	Confident	34 Å²	34	86.7 Å²	86.7	21%	0.206	48%	0.479	C	S	.	.			trans	-59.2	121.4	176.7	-179.9	0	0	0	0	110.7	I125 H129 I137 H141 L144	I125-V139 HydrophobicContact CG2-CG1 4.34Å; H129-V139 HydrophobicContact CB-CG2 4.29Å; H129-V139 WeakPolarHBondContact CD2-CG2 3.43Å; H129-V139 VanDerWaalsContact CE1-CG2 3.5Å; H129-V139 WeakPolarHBondContact CE1-CG2 3.12Å; H129-V139 WeakPolarHBondContact NE2-CG2 3.43Å; I137-V139 PolarHBondContact O-N 2.83Å; V139-H141 VanDerWaalsContact C-N 3.28Å; V139-H141 PolarHBondContact O-N 3.23Å; V139-H141 PolarHBondContact O-ND1 3.2Å; V139-L144 HydrophobicContact CG1-CD1 3.5Å; V139-L144 VanDerWaalsContact CG1-CD1 3.5Å
140	D	79.6	Confident	75	Confident	97 Å²	97	84.5 Å²	84.5	52%	0.519	47%	0.469	S	S	.	.			trans	-74.5	84.1	169.2	-172.9	-4.7	0	0	0	110.3	A138 Q142 A143 L144	A138-D140 PolarHBondContact O-N 3.19Å; D140-Q142 PolarHBondContact O-N 3.3Å; D140-Q142 WeakPolarHBondContact OD1-CA 3.44Å; D140-Q142 VanDerWaalsContact OD1-CB 3.3Å; D140-Q142 WeakPolarHBondContact OD1-CB 3.42Å; D140-Q142 PolarHBondContact OD1-N 2.95Å; D140-A143 HydrophobicContact CB-CB 3.95Å; D140-A143 VanDerWaalsContact CG-CB 3.5Å; D140-A143 PolarHBondContact O-N 2.97Å; D140-A143 VanDerWaalsContact O-N 3.13Å; D140-A143 PolarHBondContact OD1-N 3.09Å; D140-A143 WeakPolarHBondContact OD2-CB 3.49Å; D140-L144 PolarHBondContact O-N 2.95Å
141	H	77.1	Confident	75.3	Confident	60 Å²	60	80.2 Å²	80.2	28%	0.278	45%	0.447	S	S	.	.	H	α-helix	trans	-58.7	-25.4	174.8	-66.6	65.9	0	0	0	111.8	V139 L145	V139-H141 VanDerWaalsContact C-N 3.28Å; V139-H141 PolarHBondContact O-N 3.23Å; V139-H141 PolarHBondContact O-ND1 3.2Å; H141-L145 WeakPolarHBondContact O-CB 3.4Å; H141-L145 VanDerWaalsContact O-CG 3.23Å; H141-L145 WeakPolarHBondContact O-CG 3.48Å; H141-L145 PolarHBondContact O-N 3.41Å
142	Q	77.7	Confident	75.8	Confident	61 Å²	61	74.2 Å²	74.2	29%	0.285	42%	0.415	S	S	.	.	H	α-helix	trans	-79.4	-29.8	179.3	-170.9	65	21	0	0	111.8	D140 H153	D140-Q142 PolarHBondContact O-N 3.3Å; D140-Q142 WeakPolarHBondContact OD1-CA 3.44Å; D140-Q142 VanDerWaalsContact OD1-CB 3.3Å; D140-Q142 WeakPolarHBondContact OD1-CB 3.42Å; D140-Q142 PolarHBondContact OD1-N 2.95Å; Q142-H153 PolarHBondContact NE2-O 3.03Å
143	A	81.7	Confident	76.1	Confident	37 Å²	37	69.3 Å²	69.3	31%	0.306	39%	0.392	S	S	.	.	H	α-helix	trans	-70.8	-42.6	166.1	0	0	0	0	0	111.8	D140 L145 K146	D140-A143 HydrophobicContact CB-CB 3.95Å; D140-A143 VanDerWaalsContact CG-CB 3.5Å; D140-A143 PolarHBondContact O-N 2.97Å; D140-A143 VanDerWaalsContact O-N 3.13Å; D140-A143 PolarHBondContact OD1-N 3.09Å; D140-A143 WeakPolarHBondContact OD2-CB 3.49Å; A143-L145 VanDerWaalsContact C-N 3.34Å; A143-L145 PolarHBondContact O-N 3.04Å; A143-K146 VanDerWaalsContact O-CB 3.22Å; A143-K146 WeakPolarHBondContact O-CB 3.48Å; A143-K146 WeakPolarHBondContact O-CD 3.32Å; A143-K146 VanDerWaalsContact O-CG 3.3Å; A143-K146 WeakPolarHBondContact O-CG 3.28Å; A143-K146 PolarHBondContact O-N 2.75Å
144	L	80.9	Confident	77	Confident	76 Å²	76	72 Å²	72	40%	0.398	39%	0.39	S	S	.	.	H	α-helix	trans	-70.5	-26.2	179.9	-66.9	179.1	0	0	0	113.5	I125 V139 D140 K146 Q147	I125-L144 HydrophobicContact CD1-CB 3.82Å; I125-L144 HydrophobicContact CG1-CB 4.14Å; I125-L144 HydrophobicContact CG2-CB 4.11Å; I125-L144 HydrophobicContact CG2-CD1 3.6Å; V139-L144 HydrophobicContact CG1-CD1 3.5Å; V139-L144 VanDerWaalsContact CG1-CD1 3.5Å; D140-L144 PolarHBondContact O-N 2.95Å; L144-K146 PolarHBondContact O-N 2.96Å; L144-K146 VanDerWaalsContact O-N 3.11Å; L144-Q147 WeakPolarHBondContact O-CG 3.3Å; L144-Q147 PolarHBondContact O-N 3.36Å; L144-Q147 PolarHBondContact O-NE2 2.97Å
145	L	83.3	Confident	78.5	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-63.8	-10.2	171.2	-79.3	169.7	0	0	0	113.9	V118 L121 R122 I125 H141 A143 Q147 F148 H153	V118-L145 HydrophobicContact CG1-CD1 4.26Å; L121-L145 HydrophobicContact CB-CD2 3.62Å; L121-L145 HydrophobicContact CD1-CD2 4.24Å; R122-L145 HydrophobicContact CG-CD1 4.12Å; I125-L145 HydrophobicContact CD1-CD2 3.92Å; I125-L145 HydrophobicContact CD1-CG 3.91Å; H141-L145 WeakPolarHBondContact O-CB 3.4Å; H141-L145 VanDerWaalsContact O-CG 3.23Å; H141-L145 WeakPolarHBondContact O-CG 3.48Å; H141-L145 PolarHBondContact O-N 3.41Å; A143-L145 VanDerWaalsContact C-N 3.34Å; A143-L145 PolarHBondContact O-N 3.04Å; L145-Q147 PolarHBondContact O-N 3.04Å; L145-F148 HydrophobicContact CD2-CD2 4.09Å; L145-F148 HydrophobicContact CD2-CE2 4.48Å; L145-F148 PolarHBondContact O-N 3.49Å; L145-H153 HydrophobicContact CB-CB 3.97Å
146	K	83.6	Confident	79.8	Confident	124 Å²	124	67.5 Å²	67.5	54%	0.539	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-68.6	-18.7	174.8	-68.1	169	-177.7	173.7	0	114.3	A143 L144 F148 H153	A143-K146 VanDerWaalsContact O-CB 3.22Å; A143-K146 WeakPolarHBondContact O-CB 3.48Å; A143-K146 WeakPolarHBondContact O-CD 3.32Å; A143-K146 VanDerWaalsContact O-CG 3.3Å; A143-K146 WeakPolarHBondContact O-CG 3.28Å; A143-K146 PolarHBondContact O-N 2.75Å; L144-K146 PolarHBondContact O-N 2.96Å; L144-K146 VanDerWaalsContact O-N 3.11Å; K146-F148 PolarHBondContact O-N 2.96Å; K146-H153 VanDerWaalsContact CG-NE2 3.33Å; K146-H153 WeakPolarHBondContact CG-NE2 3.47Å
147	Q	83.3	Confident	81.4	Confident	107 Å²	107	63.9 Å²	63.9	50%	0.5	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-75.1	-9.3	178.7	82	-160.7	-69.5	0	0	113.2	L144 L145	L144-Q147 WeakPolarHBondContact O-CG 3.3Å; L144-Q147 PolarHBondContact O-N 3.36Å; L144-Q147 PolarHBondContact O-NE2 2.97Å; L145-Q147 PolarHBondContact O-N 3.04Å
148	F	87.9	Confident	83	Confident	24 Å²	24	59.9 Å²	59.9	11%	0.105	32%	0.317	C	S	.	.			trans	-105.8	98.4	-179.9	-59.3	-65.2	0	0	0	109	H60 L121 I125 L145 K146 H150 L151	H60-F148 AromaticContact NE2-CD1 3.61Å; H60-F148 AromaticContact NE2-CE1 3.79Å; L121-F148 HydrophobicContact CB-CD2 4.15Å; L121-F148 HydrophobicContact CB-CE2 4.02Å; L121-F148 HydrophobicContact CD1-CB 4.09Å; L121-F148 HydrophobicContact CD1-CD2 3.91Å; L121-F148 HydrophobicContact CD1-CG 3.92Å; L121-F148 HydrophobicContact CD2-CD1 3.88Å; L121-F148 HydrophobicContact CD2-CD2 4.05Å; L121-F148 HydrophobicContact CD2-CE1 3.8Å; L121-F148 HydrophobicContact CD2-CE2 3.97Å; L121-F148 HydrophobicContact CD2-CG 4.02Å; L121-F148 HydrophobicContact CD2-CZ 3.84Å; L121-F148 HydrophobicContact CG-CD2 4.26Å; L121-F148 HydrophobicContact CG-CE2 4.38Å; L121-F148 HydrophobicContact CG-CG 4.47Å; I125-F148 HydrophobicContact CD1-CE2 4.06Å; I125-F148 HydrophobicContact CG1-CE2 4.26Å; L145-F148 HydrophobicContact CD2-CD2 4.09Å; L145-F148 HydrophobicContact CD2-CE2 4.48Å; L145-F148 PolarHBondContact O-N 3.49Å; K146-F148 PolarHBondContact O-N 2.96Å; F148-H150 VanDerWaalsContact C-N 3.34Å; F148-L151 HydrophobicContact CB-CD2 3.73Å
149	E	88.9	Confident	84.6	Confident	139 Å²	139	55.2 Å²	55.2	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-23.4	-171	-54.9	-149.4	163.9	0	0	113.3	L151	E149-L151 PolarHBondContact O-N 3.24Å
150	H	90.6	Very high	85.8	Confident	3 Å²	3	56.9 Å²	56.9	1%	0.014	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	4.1	-175.9	67.5	-75.2	0	0	0	115.4	H60 Y61 E117 F148 L167 S170	H60-H150 AromaticContact NE2-CE1 3.99Å; Y61-H150 VanDerWaalsContact CB-NE2 3.34Å; Y61-H150 WeakPolarHBondContact CB-NE2 3.33Å; Y61-H150 HydrophobicContact CD1-CB 4.48Å; Y61-H150 AromaticContact CD1-CD2 3.93Å; Y61-H150 AromaticContact CD1-CE1 3.76Å; Y61-H150 AromaticContact CD1-CG 3.88Å; Y61-H150 AromaticContact CD1-ND1 3.82Å; Y61-H150 AromaticContact CD1-NE2 3.87Å; Y61-H150 HydrophobicContact CD2-CB 4.32Å; Y61-H150 AromaticContact CD2-CD2 3.7Å; Y61-H150 HydrophobicContact CE1-CB 4.24Å; Y61-H150 HydrophobicContact CE2-CB 4.05Å; Y61-H150 AromaticContact CG-CD2 3.49Å; Y61-H150 VanDerWaalsContact CG-CD2 3.49Å; Y61-H150 AromaticContact CG-CE1 3.93Å; Y61-H150 AromaticContact CG-CG 3.87Å; Y61-H150 AromaticContact CG-NE2 3.55Å; E117-H150 IonicContact OE1-CD2 2.72Å; E117-H150 IonicContact OE1-CE1 2.84Å; E117-H150 IonicContact OE1-NE2 2.76Å; E117-H150 PolarHBondContact OE1-NE2 2.85Å; F148-H150 VanDerWaalsContact C-N 3.34Å; H150-L167 HydrophobicContact CB-CD1 4.27Å; H150-S170 PolarHBondContact N-OG 3.2Å
151	L	88.8	Confident	86.5	Confident	1 Å²	1	54 Å²	54	1%	0.005	27%	0.27	C	S	.	.	S	Bend	trans	-147	147.9	177.1	62	140.3	0	0	0	113.8	V118 L121 F148 E149 H153	V118-L151 HydrophobicContact CG2-CD1 3.6Å; L121-L151 HydrophobicContact CD1-CD1 4.25Å; L121-L151 HydrophobicContact CD1-CD2 3.48Å; L121-L151 VanDerWaalsContact CD1-CD2 3.48Å; F148-L151 HydrophobicContact CB-CD2 3.73Å; E149-L151 PolarHBondContact O-N 3.24Å; L151-H153 HydrophobicContact CD1-CB 4.14Å; L151-H153 PolarHBondContact O-N 3.4Å
152	N	87.6	Confident	87.3	Confident	26 Å²	26	55 Å²	55	14%	0.139	27%	0.274	C	S	.	.			trans	-78.7	89.7	165	-176	-15.2	0	0	0	109.9	K114 M154 N155 E162 D163	K114-N152 PolarHBondContact NZ-O 3.48Å; K114-N152 VanDerWaalsContact NZ-O 3.14Å; N152-M154 PolarHBondContact O-N 2.96Å; N152-M154 WeakPolarHBondContact OD1-CA 3.48Å; N152-M154 VanDerWaalsContact OD1-CB 3.26Å; N152-M154 WeakPolarHBondContact OD1-CB 3.09Å; N152-M154 PolarHBondContact OD1-N 2.82Å; N152-N155 CarbonylContact O-C 3.6Å; N152-N155 PolarHBondContact O-N 2.71Å; N152-N155 PolarHBondContact OD1-N 2.74Å; N152-E162 PolarHBondContact ND2-OE2 3.16Å; N152-D163 WeakPolarHBondContact CB-OD1 3.41Å; N152-D163 PolarHBondContact N-OD1 3.1Å
153	H	82.6	Confident	88	Confident	30 Å²	30	52.1 Å²	52.1	14%	0.139	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-16.7	175.4	62.2	-88.7	0	0	0	114.1	Q142 L145 K146 L151 N155	Q142-H153 PolarHBondContact NE2-O 3.03Å; L145-H153 HydrophobicContact CB-CB 3.97Å; K146-H153 VanDerWaalsContact CG-NE2 3.33Å; K146-H153 WeakPolarHBondContact CG-NE2 3.47Å; L151-H153 HydrophobicContact CD1-CB 4.14Å; L151-H153 PolarHBondContact O-N 3.4Å; H153-N155 VanDerWaalsContact C-N 3.26Å; H153-N155 PolarHBondContact O-N 3.37Å
154	M	84.6	Confident	88.6	Confident	120 Å²	120	50.6 Å²	50.6	59%	0.591	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-22.9	171.9	-65.5	-76.2	108.2	0	0	112.3	N152 P156	N152-M154 PolarHBondContact O-N 2.96Å; N152-M154 WeakPolarHBondContact OD1-CA 3.48Å; N152-M154 VanDerWaalsContact OD1-CB 3.26Å; N152-M154 WeakPolarHBondContact OD1-CB 3.09Å; N152-M154 PolarHBondContact OD1-N 2.82Å; M154-P156 WeakPolarHBondContact O-CD 3.27Å
155	N	87.5	Confident	89.2	Confident	50 Å²	50	48.8 Å²	48.8	27%	0.267	24%	0.238	S	C	.	.	S	Bend	trans	-117.2	75.3	172.6	-179.1	6.1	0	0	0	110.8	K114 N152 H153 H157 T158	K114-N155 WeakPolarHBondContact CE-O 3.23Å; K114-N155 PolarHBondContact NZ-O 3.03Å; N152-N155 CarbonylContact O-C 3.6Å; N152-N155 PolarHBondContact O-N 2.71Å; N152-N155 PolarHBondContact OD1-N 2.74Å; H153-N155 VanDerWaalsContact C-N 3.26Å; H153-N155 PolarHBondContact O-N 3.37Å; N155-H157 PolarHBondContact O-N 3Å; N155-T158 PolarHBondContact ND2-O 3.46Å; N155-T158 PolarHBondContact OD1-N 2.86Å
156	P	85.8	Confident	89.7	Confident	20 Å²	20	53.1 Å²	53.1	13%	0.13	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	10.9	-171	30.8	-37.6	0	0	0	115.3	V118 M154	V118-P156 HydrophobicContact CG1-CB 3.98Å; V118-P156 HydrophobicContact CG2-CB 4.42Å; M154-P156 WeakPolarHBondContact O-CD 3.27Å
157	H	88.4	Confident	90.3	Very high	104 Å²	104	47.3 Å²	47.3	48%	0.481	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.2	-21.3	-165.4	-65.7	-22	0	0	0	116.2	R115 N155	R115-H157 PolarHBondContact NH1-O 3.09Å; N155-H157 PolarHBondContact O-N 3Å
158	T	92.4	Very high	90.6	Very high	45 Å²	45	43.3 Å²	43.3	28%	0.276	21%	0.211	S	C	.	.			trans	-128.7	138.7	177	-54.9	0	0	0	0	109.2	D111 K114 N155 E160	D111-T158 VanDerWaalsContact OD1-CA 3.29Å; D111-T158 WeakPolarHBondContact OD1-CA 3.23Å; D111-T158 VanDerWaalsContact OD1-CG2 3.31Å; D111-T158 WeakPolarHBondContact OD1-CG2 3.49Å; K114-T158 WeakPolarHBondContact CD-O 3.33Å; K114-T158 PolarHBondContact NZ-O 3.49Å; N155-T158 PolarHBondContact ND2-O 3.46Å; N155-T158 PolarHBondContact OD1-N 2.86Å; T158-E160 HydrophobicContact CG2-CG 4.26Å; T158-E160 VanDerWaalsContact CG2-OE1 3.27Å; T158-E160 WeakPolarHBondContact CG2-OE1 3.14Å
159	F	95.5	Very high	90.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.223	C	C	.	.			trans	-95.8	114.4	178.1	-178.3	-83.5	0	0	0	109.3	Y64 V68 L99 R107 L110 D111 K114 D163 L164 L167	Y64-F159 WeakPolarHBondContact OH-CD2 3.44Å; Y64-F159 WeakPolarHBondContact OH-CE2 3.35Å; V68-F159 HydrophobicContact CG1-CE2 4.26Å; V68-F159 HydrophobicContact CG1-CZ 3.8Å; V68-F159 HydrophobicContact CG2-CE2 4.14Å; V68-F159 HydrophobicContact CG2-CZ 4.49Å; L99-F159 HydrophobicContact CD1-CE1 4.25Å; L99-F159 HydrophobicContact CD2-CD1 3.93Å; L99-F159 HydrophobicContact CD2-CE1 3.79Å; R107-F159 PolarHBondContact NH1-O 3.18Å; L110-F159 HydrophobicContact CB-CB 3.87Å; L110-F159 HydrophobicContact CB-CD1 3.69Å; L110-F159 HydrophobicContact CB-CE1 4.36Å; L110-F159 HydrophobicContact CB-CG 3.8Å; L110-F159 HydrophobicContact CD1-CD1 3.86Å; L110-F159 HydrophobicContact CD1-CE1 3.94Å; L110-F159 HydrophobicContact CG-CD1 4.27Å; D111-F159 PolarHBondContact OD1-N 2.73Å; K114-F159 HydrophobicContact CB-CB 4.22Å; K114-F159 HydrophobicContact CB-CD2 4.21Å; K114-F159 HydrophobicContact CD-CB 4.07Å; K114-F159 HydrophobicContact CD-CD2 4.22Å; F159-D163 HydrophobicContact CD2-CB 3.65Å; F159-D163 HydrophobicContact CE2-CB 3.67Å; F159-D163 HydrophobicContact CG-CB 4.11Å; F159-D163 HydrophobicContact CZ-CB 4.15Å; F159-L164 HydrophobicContact CE1-CB 3.87Å; F159-L164 HydrophobicContact CZ-CB 3.8Å; F159-L164 HydrophobicContact CZ-CD1 4.21Å; F159-L167 HydrophobicContact CE2-CD2 4.47Å
160	E	94.4	Very high	90.9	Very high	70 Å²	70	40.3 Å²	40.3	33%	0.327	20%	0.197	S	C	.	.			trans	-115.6	176.3	-173.1	-60.5	-68.5	-172.8	0	0	112.2	L99 R107 T158 E162 D163 L164	L99-E160 VanDerWaalsContact CD2-C 3.44Å; R107-E160 IonicContact CZ-OE2 3.42Å; R107-E160 IonicContact NH1-OE2 3.15Å; R107-E160 PolarHBondContact NH1-OE2 2.77Å; R107-E160 IonicContact NH2-OE2 2.73Å; R107-E160 PolarHBondContact NH2-OE2 3.42Å; T158-E160 HydrophobicContact CG2-CG 4.26Å; T158-E160 VanDerWaalsContact CG2-OE1 3.27Å; T158-E160 WeakPolarHBondContact CG2-OE1 3.14Å; E160-E162 PolarHBondContact O-N 2.94Å; E160-E162 VanDerWaalsContact O-N 3.14Å; E160-D163 PolarHBondContact N-OD2 3.15Å; E160-D163 WeakPolarHBondContact O-CB 3.06Å; E160-D163 PolarHBondContact O-N 2.61Å; E160-L164 PolarHBondContact O-N 3.16Å
161	V	94.3	Very high	90.9	Very high	37 Å²	37	40.4 Å²	40.4	22%	0.224	20%	0.199	C	C	.	.	H	α-helix	trans	-51.3	-38.2	177	173.2	0	0	0	0	111.8	A96 Q97 L99 D163 L164 D165	A96-V161 HydrophobicContact CB-CG1 4.19Å; Q97-V161 HydrophobicContact CG-CG1 4.42Å; L99-V161 HydrophobicContact CB-CG2 4.31Å; L99-V161 HydrophobicContact CD2-CG2 4.43Å; V161-D163 VanDerWaalsContact C-N 3.33Å; V161-D163 PolarHBondContact O-N 3.35Å; V161-L164 PolarHBondContact O-N 3.48Å; V161-D165 VanDerWaalsContact O-CB 3.28Å; V161-D165 WeakPolarHBondContact O-CB 3.44Å; V161-D165 PolarHBondContact O-N 2.9Å
162	E	93	Very high	90.7	Very high	80 Å²	80	42 Å²	42	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-67.2	-29.9	177.5	-160.5	-164.5	157.6	0	0	113.1	N152 E160 R166	N152-E162 PolarHBondContact ND2-OE2 3.16Å; E160-E162 PolarHBondContact O-N 2.94Å; E160-E162 VanDerWaalsContact O-N 3.14Å; E162-R166 VanDerWaalsContact O-CB 3.28Å; E162-R166 WeakPolarHBondContact O-CB 3.32Å; E162-R166 WeakPolarHBondContact O-CD 3.47Å; E162-R166 WeakPolarHBondContact O-CG 3.47Å; E162-R166 PolarHBondContact O-N 2.97Å; E162-R166 IonicContact OE1-CZ 2.72Å; E162-R166 VanDerWaalsContact OE1-CZ 3.25Å; E162-R166 IonicContact OE1-NE 3.84Å; E162-R166 PolarHBondContact OE1-NE 3.09Å; E162-R166 IonicContact OE1-NH2 3.29Å; E162-R166 PolarHBondContact OE1-NH2 2.93Å
163	D	93.8	Very high	90.7	Very high	1 Å²	1	45 Å²	45	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-72.7	-42	176.6	-66.1	-72.3	0	0	0	111.6	K114 N152 F159 E160 V161 R166 L167	K114-D163 WeakPolarHBondContact CE-OD1 3.34Å; K114-D163 IonicContact NZ-OD1 2.66Å; K114-D163 PolarHBondContact NZ-OD1 3.09Å; K114-D163 IonicContact NZ-OD2 2.72Å; K114-D163 PolarHBondContact NZ-OD2 3.3Å; N152-D163 WeakPolarHBondContact CB-OD1 3.41Å; N152-D163 PolarHBondContact N-OD1 3.1Å; F159-D163 HydrophobicContact CD2-CB 3.65Å; F159-D163 HydrophobicContact CE2-CB 3.67Å; F159-D163 HydrophobicContact CG-CB 4.11Å; F159-D163 HydrophobicContact CZ-CB 4.15Å; E160-D163 PolarHBondContact N-OD2 3.15Å; E160-D163 WeakPolarHBondContact O-CB 3.06Å; E160-D163 PolarHBondContact O-N 2.61Å; V161-D163 VanDerWaalsContact C-N 3.33Å; V161-D163 PolarHBondContact O-N 3.35Å; D163-R166 PolarHBondContact O-N 2.89Å; D163-L167 WeakPolarHBondContact O-CB 3.38Å; D163-L167 PolarHBondContact O-N 2.95Å
164	L	94.6	Very high	90.9	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-67.7	-39.9	176.1	-173.9	53.1	0	0	0	111.2	V68 L72 F78 A96 L99 F159 E160 V161 I168	V68-L164 HydrophobicContact CG1-CD1 4.33Å; L72-L164 HydrophobicContact CD1-CD1 3.76Å; L72-L164 HydrophobicContact CD1-CD2 3.92Å; F78-L164 HydrophobicContact CE2-CD2 3.94Å; F78-L164 HydrophobicContact CZ-CD2 3.97Å; A96-L164 HydrophobicContact CB-CB 4.24Å; A96-L164 HydrophobicContact CB-CG 4.22Å; L99-L164 HydrophobicContact CB-CD2 4.21Å; L99-L164 HydrophobicContact CD1-CD2 4.29Å; L99-L164 HydrophobicContact CD2-CB 4.26Å; L99-L164 HydrophobicContact CD2-CD2 4.33Å; F159-L164 HydrophobicContact CE1-CB 3.87Å; F159-L164 HydrophobicContact CZ-CB 3.8Å; F159-L164 HydrophobicContact CZ-CD1 4.21Å; E160-L164 PolarHBondContact O-N 3.16Å; V161-L164 PolarHBondContact O-N 3.48Å; L164-I168 HydrophobicContact CD1-CD1 3.75Å; L164-I168 HydrophobicContact CD1-CG1 4.08Å; L164-I168 HydrophobicContact CG-CD1 3.85Å; L164-I168 VanDerWaalsContact O-CB 3.31Å; L164-I168 WeakPolarHBondContact O-CB 3.42Å; L164-I168 WeakPolarHBondContact O-CD1 3.26Å; L164-I168 VanDerWaalsContact O-CG1 3.23Å; L164-I168 WeakPolarHBondContact O-CG1 3.5Å; L164-I168 PolarHBondContact O-N 2.84Å
165	D	93.2	Very high	90.8	Very high	38 Å²	38	42.2 Å²	42.2	20%	0.203	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-44.5	174.1	-172.8	69.7	0	0	0	112.2	G93 A96 V161 K169	G93-D165 WeakPolarHBondContact CA-OD1 3.43Å; A96-D165 HydrophobicContact CB-CB 3.91Å; V161-D165 VanDerWaalsContact O-CB 3.28Å; V161-D165 WeakPolarHBondContact O-CB 3.44Å; V161-D165 PolarHBondContact O-N 2.9Å; D165-K169 WeakPolarHBondContact O-CB 3.31Å; D165-K169 WeakPolarHBondContact O-CD 3.44Å; D165-K169 VanDerWaalsContact O-CG 3.23Å; D165-K169 WeakPolarHBondContact O-CG 3.15Å; D165-K169 PolarHBondContact O-N 2.76Å; D165-K169 VanDerWaalsContact O-N 3.07Å; D165-K169 WeakPolarHBondContact OD1-CE 3.34Å; D165-K169 IonicContact OD1-NZ 3.37Å; D165-K169 PolarHBondContact OD1-NZ 2.67Å; D165-K169 IonicContact OD2-NZ 3.37Å; D165-K169 PolarHBondContact OD2-NZ 2.74Å
166	R	94.1	Very high	90.4	Very high	93 Å²	93	45.1 Å²	45.1	35%	0.351	23%	0.225	S	C	.	.	H	α-helix	trans	-65.3	-49.8	174.7	-77.3	171.4	179.2	-70.6	-8.2	112.4	E162 D163 I168 K169 S170	E162-R166 VanDerWaalsContact O-CB 3.28Å; E162-R166 WeakPolarHBondContact O-CB 3.32Å; E162-R166 WeakPolarHBondContact O-CD 3.47Å; E162-R166 WeakPolarHBondContact O-CG 3.47Å; E162-R166 PolarHBondContact O-N 2.97Å; E162-R166 IonicContact OE1-CZ 2.72Å; E162-R166 VanDerWaalsContact OE1-CZ 3.25Å; E162-R166 IonicContact OE1-NE 3.84Å; E162-R166 PolarHBondContact OE1-NE 3.09Å; E162-R166 IonicContact OE1-NH2 3.29Å; E162-R166 PolarHBondContact OE1-NH2 2.93Å; D163-R166 PolarHBondContact O-N 2.89Å; R166-I168 VanDerWaalsContact C-N 3.33Å; R166-I168 PolarHBondContact O-N 3.48Å; R166-K169 PolarHBondContact O-N 3.08Å; R166-K169 VanDerWaalsContact O-N 3.14Å; R166-S170 WeakPolarHBondContact O-CB 3.41Å; R166-S170 PolarHBondContact O-N 3.14Å; R166-S170 PolarHBondContact O-OG 2.79Å
167	L	94.3	Very high	90.4	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-60.4	-43.1	-178	179.8	59.6	0	0	0	111.3	Y61 Y64 L65 V68 H150 F159 D163 A171	Y61-L167 HydrophobicContact CD2-CD1 3.88Å; Y61-L167 HydrophobicContact CE2-CD1 3.89Å; Y64-L167 HydrophobicContact CD1-CD1 3.9Å; Y64-L167 HydrophobicContact CD1-CD2 4.26Å; Y64-L167 HydrophobicContact CE1-CD1 3.92Å; Y64-L167 HydrophobicContact CE1-CD2 3.87Å; Y64-L167 HydrophobicContact CE1-CG 4.46Å; L65-L167 HydrophobicContact CB-CD1 4.24Å; L65-L167 HydrophobicContact CD1-CD1 4Å; L65-L167 HydrophobicContact CD1-CD2 4.26Å; L65-L167 HydrophobicContact CD1-CG 3.77Å; V68-L167 HydrophobicContact CB-CD2 3.99Å; V68-L167 HydrophobicContact CG1-CD2 3.83Å; V68-L167 HydrophobicContact CG2-CD2 4.09Å; H150-L167 HydrophobicContact CB-CD1 4.27Å; F159-L167 HydrophobicContact CE2-CD2 4.47Å; D163-L167 WeakPolarHBondContact O-CB 3.38Å; D163-L167 PolarHBondContact O-N 2.95Å; L167-A171 WeakPolarHBondContact O-CB 3.46Å; L167-A171 PolarHBondContact O-N 3.13Å
168	I	90.9	Very high	90.1	Very high	23 Å²	23	43.6 Å²	43.6	12%	0.118	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-43.1	174.3	-72.5	168.7	0	0	0	111.2	I90 L95 L164 R166 T172	I90-I168 HydrophobicContact CG2-CD1 4.26Å; I90-I168 HydrophobicContact CG2-CG2 3.7Å; L95-I168 HydrophobicContact CD2-CD1 4.28Å; L164-I168 HydrophobicContact CD1-CD1 3.75Å; L164-I168 HydrophobicContact CD1-CG1 4.08Å; L164-I168 HydrophobicContact CG-CD1 3.85Å; L164-I168 VanDerWaalsContact O-CB 3.31Å; L164-I168 WeakPolarHBondContact O-CB 3.42Å; L164-I168 WeakPolarHBondContact O-CD1 3.26Å; L164-I168 VanDerWaalsContact O-CG1 3.23Å; L164-I168 WeakPolarHBondContact O-CG1 3.5Å; L164-I168 PolarHBondContact O-N 2.84Å; R166-I168 VanDerWaalsContact C-N 3.33Å; R166-I168 PolarHBondContact O-N 3.48Å; I168-T172 VanDerWaalsContact O-CB 3.3Å; I168-T172 WeakPolarHBondContact O-CB 3.38Å; I168-T172 PolarHBondContact O-N 3.5Å; I168-T172 PolarHBondContact O-OG1 3.27Å
169	K	91.1	Very high	89.7	Confident	85 Å²	85	42.9 Å²	42.9	37%	0.37	21%	0.212	S	C	.	.	H	α-helix	trans	-72.6	-42.5	-176.7	-76.3	169.5	-177.2	165.9	0	113.4	K91 D165 R166 N173	K91-K169 WeakPolarHBondContact O-CE 3.35Å; D165-K169 WeakPolarHBondContact O-CB 3.31Å; D165-K169 WeakPolarHBondContact O-CD 3.44Å; D165-K169 VanDerWaalsContact O-CG 3.23Å; D165-K169 WeakPolarHBondContact O-CG 3.15Å; D165-K169 PolarHBondContact O-N 2.76Å; D165-K169 VanDerWaalsContact O-N 3.07Å; D165-K169 WeakPolarHBondContact OD1-CE 3.34Å; D165-K169 IonicContact OD1-NZ 3.37Å; D165-K169 PolarHBondContact OD1-NZ 2.67Å; D165-K169 IonicContact OD2-NZ 3.37Å; D165-K169 PolarHBondContact OD2-NZ 2.74Å; R166-K169 PolarHBondContact O-N 3.08Å; R166-K169 VanDerWaalsContact O-N 3.14Å; K169-N173 VanDerWaalsContact O-CB 3.26Å; K169-N173 WeakPolarHBondContact O-CB 3.31Å; K169-N173 PolarHBondContact O-N 2.67Å
170	S	92	Very high	89.4	Confident	15 Å²	15	47.5 Å²	47.5	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-50.2	170.6	-64.5	0	0	0	0	109.9	Y61 H150 R166 T172 N173 D174	Y61-S170 WeakPolarHBondContact OH-CB 3.4Å; Y61-S170 PolarHBondContact OH-O 3.05Å; H150-S170 PolarHBondContact N-OG 3.2Å; R166-S170 WeakPolarHBondContact O-CB 3.41Å; R166-S170 PolarHBondContact O-N 3.14Å; R166-S170 PolarHBondContact O-OG 2.79Å; S170-T172 VanDerWaalsContact C-N 3.29Å; S170-T172 PolarHBondContact O-N 2.94Å; S170-N173 PolarHBondContact O-N 3.4Å; S170-N173 VanDerWaalsContact O-N 3.1Å; S170-D174 VanDerWaalsContact O-CB 3.23Å; S170-D174 WeakPolarHBondContact O-CB 3.47Å; S170-D174 PolarHBondContact O-N 3.41Å; S170-D174 VanDerWaalsContact O-OD1 3.11Å
171	A	90	Very high	89.2	Confident	6 Å²	6	50 Å²	50	5%	0.05	24%	0.243	C	C	.	.	H	α-helix	trans	-57.3	-43.7	178.5	0	0	0	0	0	112	L59 Y61 L65 L167 L175	L59-A171 HydrophobicContact CD1-CB 4.11Å; Y61-A171 HydrophobicContact CE2-CB 4.38Å; Y61-A171 WeakPolarHBondContact OH-CA 3.38Å; Y61-A171 PolarHBondContact OH-N 3.17Å; L65-A171 HydrophobicContact CD1-CB 3.92Å; L65-A171 HydrophobicContact CD2-CB 3.62Å; L65-A171 HydrophobicContact CG-CB 4.42Å; L167-A171 WeakPolarHBondContact O-CB 3.46Å; L167-A171 PolarHBondContact O-N 3.13Å; A171-L175 WeakPolarHBondContact O-CB 3.49Å; A171-L175 WeakPolarHBondContact O-CD1 3.32Å; A171-L175 WeakPolarHBondContact O-CG 3.46Å; A171-L175 PolarHBondContact O-N 3Å
172	T	85.1	Confident	88.9	Confident	33 Å²	33	51.8 Å²	51.8	20%	0.202	25%	0.246	C	C	.	.	H	α-helix	trans	-60.5	-51.7	174.6	-56.1	0	0	0	0	111.4	K91 I168 S170 L175 E176	K91-T172 HydrophobicContact CD-CG2 3.74Å; K91-T172 HydrophobicContact CG-CG2 3.85Å; I168-T172 VanDerWaalsContact O-CB 3.3Å; I168-T172 WeakPolarHBondContact O-CB 3.38Å; I168-T172 PolarHBondContact O-N 3.5Å; I168-T172 PolarHBondContact O-OG1 3.27Å; S170-T172 VanDerWaalsContact C-N 3.29Å; S170-T172 PolarHBondContact O-N 2.94Å; T172-L175 PolarHBondContact O-N 3.17Å; T172-E176 HydrophobicContact CG2-CG 4.29Å; T172-E176 WeakPolarHBondContact O-CB 3.33Å; T172-E176 VanDerWaalsContact O-CG 3.28Å; T172-E176 WeakPolarHBondContact O-CG 3.41Å; T172-E176 PolarHBondContact O-N 2.88Å
173	N	86.6	Confident	88.8	Confident	90 Å²	90	50.8 Å²	50.8	48%	0.481	24%	0.241	S	C	.	.	H	α-helix	trans	-71.6	-40.6	-171.6	-174.7	-136.6	0	0	0	112.1	K169 S170 E176 N177	K169-N173 VanDerWaalsContact O-CB 3.26Å; K169-N173 WeakPolarHBondContact O-CB 3.31Å; K169-N173 PolarHBondContact O-N 2.67Å; S170-N173 PolarHBondContact O-N 3.4Å; S170-N173 VanDerWaalsContact O-N 3.1Å; N173-E176 PolarHBondContact O-N 2.76Å; N173-N177 PolarHBondContact ND2-ND2 3.34Å; N173-N177 VanDerWaalsContact ND2-ND2 3.15Å; N173-N177 WeakPolarHBondContact O-CB 3.37Å; N173-N177 PolarHBondContact O-N 3.26Å; N173-N177 VanDerWaalsContact O-N 3.1Å; N173-N177 PolarHBondContact O-ND2 2.67Å
174	D	87.3	Confident	88.7	Confident	53 Å²	53	54.6 Å²	54.6	28%	0.283	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-45.3	174	-58.6	2.6	0	0	0	109.4	L59 Y61 S170 E176 N177 F178	L59-D174 HydrophobicContact CD2-CB 3.45Å; L59-D174 VanDerWaalsContact CD2-CB 3.45Å; Y61-D174 VanDerWaalsContact CE1-OD2 3.23Å; Y61-D174 WeakPolarHBondContact CE1-OD2 3.48Å; Y61-D174 VanDerWaalsContact CZ-OD2 3.3Å; Y61-D174 PolarHBondContact OH-OD2 2.74Å; S170-D174 VanDerWaalsContact O-CB 3.23Å; S170-D174 WeakPolarHBondContact O-CB 3.47Å; S170-D174 PolarHBondContact O-N 3.41Å; S170-D174 VanDerWaalsContact O-OD1 3.11Å; D174-E176 PolarHBondContact O-N 2.78Å; D174-N177 CarbonylContact O-C 3.55Å; D174-N177 PolarHBondContact O-N 3.25Å; D174-N177 VanDerWaalsContact O-N 3.16Å; D174-F178 WeakPolarHBondContact O-CA 3.16Å; D174-F178 WeakPolarHBondContact O-CB 3.22Å; D174-F178 PolarHBondContact O-N 2.88Å
175	L	82.5	Confident	88.7	Confident	38 Å²	38	60 Å²	60	20%	0.199	28%	0.284	C	S	.	.	H	α-helix	trans	-69.7	-29.1	176.4	-67.7	171.5	0	0	0	113.9	T57 L59 A171 T172 N177 R320	T57-L175 WeakPolarHBondContact O-CD2 3.44Å; L59-L175 HydrophobicContact CD1-CD1 4.24Å; L59-L175 HydrophobicContact CD1-CD2 4.15Å; L59-L175 HydrophobicContact CD1-CG 3.98Å; L59-L175 HydrophobicContact CD2-CD2 3.97Å; L59-L175 HydrophobicContact CD2-CG 4.18Å; L59-L175 HydrophobicContact CG-CD2 3.93Å; L59-L175 HydrophobicContact CG-CG 4.25Å; A171-L175 WeakPolarHBondContact O-CB 3.49Å; A171-L175 WeakPolarHBondContact O-CD1 3.32Å; A171-L175 WeakPolarHBondContact O-CG 3.46Å; A171-L175 PolarHBondContact O-N 3Å; T172-L175 PolarHBondContact O-N 3.17Å; L175-N177 VanDerWaalsContact C-N 3.26Å; L175-R320 PolarHBondContact O-NH1 3.02Å
176	E	79.6	Confident	88.7	Confident	111 Å²	111	58.7 Å²	58.7	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-74.1	-15.4	172.1	-77.7	176	173.9	0	0	112.7	K91 T172 N173 D174	K91-E176 WeakPolarHBondContact CE-OE1 3.38Å; K91-E176 IonicContact NZ-OE1 2.69Å; K91-E176 PolarHBondContact NZ-OE1 2.83Å; T172-E176 HydrophobicContact CG2-CG 4.29Å; T172-E176 WeakPolarHBondContact O-CB 3.33Å; T172-E176 VanDerWaalsContact O-CG 3.28Å; T172-E176 WeakPolarHBondContact O-CG 3.41Å; T172-E176 PolarHBondContact O-N 2.88Å; N173-E176 PolarHBondContact O-N 2.76Å; D174-E176 PolarHBondContact O-N 2.78Å
177	N	85	Confident	88.8	Confident	44 Å²	44	57 Å²	57	24%	0.235	27%	0.272	C	S	.	.	H	α-helix	trans	-121	-9	-177.7	-69.8	-91.3	0	0	0	114.6	N173 D174 L175 D179 K180 E181	N173-N177 PolarHBondContact ND2-ND2 3.34Å; N173-N177 VanDerWaalsContact ND2-ND2 3.15Å; N173-N177 WeakPolarHBondContact O-CB 3.37Å; N173-N177 PolarHBondContact O-N 3.26Å; N173-N177 VanDerWaalsContact O-N 3.1Å; N173-N177 PolarHBondContact O-ND2 2.67Å; D174-N177 CarbonylContact O-C 3.55Å; D174-N177 PolarHBondContact O-N 3.25Å; D174-N177 VanDerWaalsContact O-N 3.16Å; L175-N177 VanDerWaalsContact C-N 3.26Å; N177-D179 VanDerWaalsContact C-N 3.34Å; N177-D179 PolarHBondContact O-N 2.73Å; N177-K180 CarbonylContact O-C 3.58Å; N177-K180 WeakPolarHBondContact O-CA 3.12Å; N177-K180 WeakPolarHBondContact O-CB 3.39Å; N177-K180 PolarHBondContact O-N 3.29Å; N177-E181 PolarHBondContact O-N 3.31Å
178	F	82.7	Confident	88.9	Confident	48 Å²	48	62.3 Å²	62.3	21%	0.211	29%	0.292	C	S	.	.	H	α-helix	trans	-51.2	-51.6	-175.7	-177.1	-100.2	0	0	0	112.2	D174 K180 E181 R182	D174-F178 WeakPolarHBondContact O-CA 3.16Å; D174-F178 WeakPolarHBondContact O-CB 3.22Å; D174-F178 PolarHBondContact O-N 2.88Å; F178-K180 VanDerWaalsContact C-N 3.34Å; F178-K180 PolarHBondContact O-N 3.15Å; F178-E181 PolarHBondContact O-N 3.05Å; F178-R182 HydrophobicContact CD1-CG 4.45Å; F178-R182 HydrophobicContact CE1-CG 4.26Å; F178-R182 HydrophobicContact CZ-CG 4.5Å; F178-R182 WeakPolarHBondContact O-CG 3.36Å; F178-R182 PolarHBondContact O-N 3.42Å
179	D	84.6	Confident	89.1	Confident	31 Å²	31	65.3 Å²	65.3	17%	0.166	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-43	179.4	-55.8	-24	0	0	0	111.4	N177 R182 H183 R307 E308	N177-D179 VanDerWaalsContact C-N 3.34Å; N177-D179 PolarHBondContact O-N 2.73Å; D179-R182 WeakPolarHBondContact O-CB 3.38Å; D179-R182 PolarHBondContact O-N 2.94Å; D179-H183 PolarHBondContact O-CD2 3.15Å; D179-H183 PolarHBondContact O-N 2.93Å; D179-R307 IonicContact OD1-CZ 2.68Å; D179-R307 VanDerWaalsContact OD1-CZ 3.22Å; D179-R307 IonicContact OD1-NH1 3.42Å; D179-R307 PolarHBondContact OD1-NH1 3.37Å; D179-R307 IonicContact OD1-NH2 3.68Å; D179-R307 PolarHBondContact OD1-NH2 3.5Å; D179-R307 IonicContact OD2-NH1 3.46Å; D179-R307 IonicContact OD2-NH2 2.74Å; D179-E308 HydrophobicContact CB-CG 4.47Å
180	K	89.1	Confident	89.3	Confident	97 Å²	97	63 Å²	63	42%	0.422	29%	0.293	S	S	.	.	H	α-helix	trans	-65.6	-39.2	176.4	-175.2	-166.8	152	-68.2	0	112.2	N177 F178 E184	N177-K180 CarbonylContact O-C 3.58Å; N177-K180 WeakPolarHBondContact O-CA 3.12Å; N177-K180 WeakPolarHBondContact O-CB 3.39Å; N177-K180 PolarHBondContact O-N 3.29Å; F178-K180 VanDerWaalsContact C-N 3.34Å; F178-K180 PolarHBondContact O-N 3.15Å; K180-E184 VanDerWaalsContact CE-OE1 3.29Å; K180-E184 WeakPolarHBondContact CE-OE1 3.38Å; K180-E184 IonicContact NZ-OE1 3.6Å; K180-E184 PolarHBondContact NZ-OE1 3Å; K180-E184 IonicContact NZ-OE2 2.73Å; K180-E184 WeakPolarHBondContact O-CB 3.38Å; K180-E184 WeakPolarHBondContact O-CG 3.45Å; K180-E184 PolarHBondContact O-N 3.43Å
181	E	88.8	Confident	89.5	Confident	121 Å²	121	62.9 Å²	62.9	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-69.8	-35.6	176.5	-71.3	-168.9	175.5	0	0	111.7	N177 F178 E184 E185	N177-E181 PolarHBondContact O-N 3.31Å; F178-E181 PolarHBondContact O-N 3.05Å; E181-E184 PolarHBondContact O-N 3.41Å; E181-E185 WeakPolarHBondContact O-CB 3.5Å; E181-E185 PolarHBondContact O-N 3.02Å
182	R	88.4	Confident	89.8	Confident	76 Å²	76	66 Å²	66	29%	0.287	31%	0.305	S	S	.	.	H	α-helix	trans	-62.4	-49.6	170.6	-73.4	-74.2	-66.4	-125.8	-5.2	111.7	F178 D179 E184 E185 F186 E300 L304	F178-R182 HydrophobicContact CD1-CG 4.45Å; F178-R182 HydrophobicContact CE1-CG 4.26Å; F178-R182 HydrophobicContact CZ-CG 4.5Å; F178-R182 WeakPolarHBondContact O-CG 3.36Å; F178-R182 PolarHBondContact O-N 3.42Å; D179-R182 WeakPolarHBondContact O-CB 3.38Å; D179-R182 PolarHBondContact O-N 2.94Å; R182-E184 VanDerWaalsContact C-N 3.3Å; R182-E184 PolarHBondContact O-N 3.49Å; R182-E185 CarbonylContact O-C 3.59Å; R182-E185 WeakPolarHBondContact O-CA 3.36Å; R182-E185 WeakPolarHBondContact O-CB 3.37Å; R182-E185 PolarHBondContact O-N 3.24Å; R182-F186 PolarHBondContact O-N 3.28Å; R182-E300 IonicContact NH2-OE1 3.13Å; R182-L304 HydrophobicContact CB-CD1 4.07Å; R182-L304 HydrophobicContact CG-CD1 4.31Å
183	H	90.6	Very high	90.3	Very high	58 Å²	58	67.8 Å²	67.8	27%	0.269	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-38.8	173.6	-68.1	-28.8	0	0	0	112.9	D179 E185 K187 E301 E308	D179-H183 PolarHBondContact O-CD2 3.15Å; D179-H183 PolarHBondContact O-N 2.93Å; H183-E185 VanDerWaalsContact C-N 3.32Å; H183-K187 VanDerWaalsContact O-CB 3.28Å; H183-K187 WeakPolarHBondContact O-CB 3.42Å; H183-K187 PolarHBondContact O-N 2.97Å; H183-E301 IonicContact CE1-OE1 2.7Å; H183-E301 IonicContact CG-OE1 3.33Å; H183-E301 IonicContact ND1-OE1 3.8Å; H183-E301 PolarHBondContact ND1-OE1 2.94Å; H183-E301 IonicContact ND1-OE2 2.72Å; H183-E308 IonicContact CE1-OE1 2.84Å; H183-E308 IonicContact NE2-OE1 3.76Å; H183-E308 IonicContact NE2-OE2 2.67Å; H183-E308 PolarHBondContact NE2-OE2 3.42Å
184	E	93.1	Very high	90.7	Very high	81 Å²	81	64.6 Å²	64.6	38%	0.379	29%	0.292	S	S	.	.	H	α-helix	trans	-69.3	-29.2	174.4	-76.4	-177.6	-166.7	0	0	112.5	K180 E181 R182 R188	K180-E184 VanDerWaalsContact CE-OE1 3.29Å; K180-E184 WeakPolarHBondContact CE-OE1 3.38Å; K180-E184 IonicContact NZ-OE1 3.6Å; K180-E184 PolarHBondContact NZ-OE1 3Å; K180-E184 IonicContact NZ-OE2 2.73Å; K180-E184 WeakPolarHBondContact O-CB 3.38Å; K180-E184 WeakPolarHBondContact O-CG 3.45Å; K180-E184 PolarHBondContact O-N 3.43Å; E181-E184 PolarHBondContact O-N 3.41Å; R182-E184 VanDerWaalsContact C-N 3.3Å; R182-E184 PolarHBondContact O-N 3.49Å; E184-R188 VanDerWaalsContact O-CG 3.29Å; E184-R188 WeakPolarHBondContact O-CG 3.27Å; E184-R188 PolarHBondContact O-N 3.4Å; E184-R188 PolarHBondContact O-NE 2.71Å; E184-R188 PolarHBondContact O-NH1 2.92Å; E184-R188 VanDerWaalsContact O-NH1 3.16Å
185	E	92.8	Very high	91.1	Very high	117 Å²	117	63.6 Å²	63.6	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-72.8	-47	172.2	-172.5	159.5	-130.4	0	0	112.3	E181 R182 H183 K187 R188 Y189	E181-E185 WeakPolarHBondContact O-CB 3.5Å; E181-E185 PolarHBondContact O-N 3.02Å; R182-E185 CarbonylContact O-C 3.59Å; R182-E185 WeakPolarHBondContact O-CA 3.36Å; R182-E185 WeakPolarHBondContact O-CB 3.37Å; R182-E185 PolarHBondContact O-N 3.24Å; H183-E185 VanDerWaalsContact C-N 3.32Å; E185-K187 VanDerWaalsContact C-N 3.31Å; E185-K187 PolarHBondContact O-N 3.3Å; E185-R188 VanDerWaalsContact CA-NH2 3.28Å; E185-R188 WeakPolarHBondContact O-CB 3.33Å; E185-R188 PolarHBondContact O-N 3.35Å; E185-R188 VanDerWaalsContact O-N 3.08Å; E185-Y189 PolarHBondContact O-N 2.91Å
186	F	94.9	Very high	91.7	Very high	12 Å²	12	66.4 Å²	66.4	5%	0.053	30%	0.301	C	S	.	.	H	α-helix	trans	-58.3	-42.7	173.2	178.5	-104.6	0	0	0	111.6	R182 R188 Y189 E190 V297 E298 E301 L345 A350	R182-F186 PolarHBondContact O-N 3.28Å; F186-R188 VanDerWaalsContact C-N 3.33Å; F186-R188 PolarHBondContact O-N 2.98Å; F186-Y189 HydrophobicContact CD2-CD1 4.5Å; F186-Y189 HydrophobicContact CE2-CD1 4.47Å; F186-Y189 WeakPolarHBondContact O-CB 3.46Å; F186-Y189 PolarHBondContact O-N 3.49Å; F186-Y189 VanDerWaalsContact O-N 3.15Å; F186-E190 HydrophobicContact CD1-CG 4.38Å; F186-E190 HydrophobicContact CD2-CG 4.5Å; F186-E190 HydrophobicContact CE1-CG 3.76Å; F186-E190 HydrophobicContact CE2-CG 3.89Å; F186-E190 HydrophobicContact CZ-CG 3.48Å; F186-E190 VanDerWaalsContact CZ-CG 3.48Å; F186-E190 PolarHBondContact O-N 3Å; F186-V297 HydrophobicContact CD2-CG1 4.16Å; F186-V297 HydrophobicContact CE2-CG1 4.49Å; F186-E298 HydrophobicContact CE2-CB 4.39Å; F186-E298 HydrophobicContact CE2-CG 3.93Å; F186-E298 HydrophobicContact CZ-CG 3.97Å; F186-E301 HydrophobicContact CB-CB 4.5Å; F186-E301 HydrophobicContact CB-CG 4.14Å; F186-E301 HydrophobicContact CD1-CB 4.21Å; F186-E301 HydrophobicContact CD1-CG 3.49Å; F186-E301 VanDerWaalsContact CD1-CG 3.49Å; F186-E301 WeakPolarHBondContact CD1-OE1 3.05Å; F186-E301 HydrophobicContact CD2-CB 3.72Å; F186-E301 HydrophobicContact CD2-CG 3.95Å; F186-E301 HydrophobicContact CE1-CB 4.39Å; F186-E301 HydrophobicContact CE1-CG 3.81Å; F186-E301 HydrophobicContact CE2-CB 3.95Å; F186-E301 HydrophobicContact CE2-CG 4.26Å; F186-E301 HydrophobicContact CG-CB 3.86Å; F186-E301 HydrophobicContact CG-CG 3.56Å; F186-E301 HydrophobicContact CZ-CB 4.28Å; F186-E301 HydrophobicContact CZ-CG 4.19Å; F186-L345 HydrophobicContact CE1-CD1 4.3Å; F186-L345 HydrophobicContact CE1-CD2 3.96Å; F186-L345 HydrophobicContact CZ-CD1 3.92Å; F186-L345 HydrophobicContact CZ-CD2 4.36Å; F186-A350 HydrophobicContact CD1-CB 4.09Å; F186-A350 HydrophobicContact CE1-CB 3.85Å
187	K	95.6	Very high	92.5	Very high	58 Å²	58	64.4 Å²	64.4	25%	0.252	29%	0.289	S	S	.	.	H	α-helix	trans	-58.3	-42.7	173.2	-168	-173.2	-63.3	-157.8	0	112.3	H183 E185 M191 A350 E355	H183-K187 VanDerWaalsContact O-CB 3.28Å; H183-K187 WeakPolarHBondContact O-CB 3.42Å; H183-K187 PolarHBondContact O-N 2.97Å; E185-K187 VanDerWaalsContact C-N 3.31Å; E185-K187 PolarHBondContact O-N 3.3Å; K187-M191 HydrophobicContact CD-CE 4.47Å; K187-M191 HydrophobicContact CG-CE 4.13Å; K187-M191 HydrophobicContact CG-SD 4.49Å; K187-M191 WeakPolarHBondContact O-CB 3.47Å; K187-M191 VanDerWaalsContact O-CG 3.3Å; K187-M191 WeakPolarHBondContact O-CG 3.42Å; K187-M191 PolarHBondContact O-N 3.36Å; K187-A350 WeakPolarHBondContact CE-O 3.34Å; K187-E355 IonicContact NZ-OE1 3.72Å; K187-E355 PolarHBondContact NZ-OE1 2.93Å
188	R	95.3	Very high	92.9	Very high	111 Å²	111	65.6 Å²	65.6	42%	0.419	29%	0.29	S	S	.	.	H	α-helix	trans	-66.6	-37.1	175.9	-73.4	179.9	-59.1	-98.8	6.4	112.1	E184 E185 F186 M191 M192	E184-R188 VanDerWaalsContact O-CG 3.29Å; E184-R188 WeakPolarHBondContact O-CG 3.27Å; E184-R188 PolarHBondContact O-N 3.4Å; E184-R188 PolarHBondContact O-NE 2.71Å; E184-R188 PolarHBondContact O-NH1 2.92Å; E184-R188 VanDerWaalsContact O-NH1 3.16Å; E185-R188 VanDerWaalsContact CA-NH2 3.28Å; E185-R188 WeakPolarHBondContact O-CB 3.33Å; E185-R188 PolarHBondContact O-N 3.35Å; E185-R188 VanDerWaalsContact O-N 3.08Å; F186-R188 VanDerWaalsContact C-N 3.33Å; F186-R188 PolarHBondContact O-N 2.98Å; R188-M191 HydrophobicContact CG-CE 4.44Å; R188-M192 WeakPolarHBondContact O-CB 3.5Å; R188-M192 PolarHBondContact O-N 3.03Å
189	Y	95.9	Very high	93.5	Very high	87 Å²	87	67 Å²	67	34%	0.341	30%	0.298	S	S	.	.	H	α-helix	trans	-61.4	-52.8	174.7	174	-95.5	0	0	0	111.1	E185 F186 M191 M192 K193 D295 V297	E185-Y189 PolarHBondContact O-N 2.91Å; F186-Y189 HydrophobicContact CD2-CD1 4.5Å; F186-Y189 HydrophobicContact CE2-CD1 4.47Å; F186-Y189 WeakPolarHBondContact O-CB 3.46Å; F186-Y189 PolarHBondContact O-N 3.49Å; F186-Y189 VanDerWaalsContact O-N 3.15Å; Y189-M191 PolarHBondContact O-N 2.79Å; Y189-M192 PolarHBondContact O-N 3.26Å; Y189-M192 VanDerWaalsContact O-N 3.07Å; Y189-K193 HydrophobicContact CE1-CD 3.74Å; Y189-K193 WeakPolarHBondContact O-CB 3.46Å; Y189-K193 PolarHBondContact O-N 3.46Å; Y189-D295 WeakPolarHBondContact CE1-OD2 3.46Å; Y189-D295 PolarHBondContact OH-OD2 2.62Å; Y189-V297 HydrophobicContact CD1-CB 4.39Å; Y189-V297 HydrophobicContact CD1-CG1 3.95Å; Y189-V297 HydrophobicContact CE1-CB 3.97Å; Y189-V297 HydrophobicContact CE1-CG1 4.04Å; Y189-V297 HydrophobicContact CE1-CG2 4.38Å; Y189-V297 HydrophobicContact CE2-CG2 4.29Å; Y189-V297 HydrophobicContact CG-CG1 4.23Å
190	E	95.4	Very high	94.1	Very high	35 Å²	35	69.9 Å²	69.9	16%	0.164	31%	0.31	C	S	.	.	H	α-helix	trans	-61.5	-39.9	179.1	-84.6	-63.2	107.2	0	0	113.2	F186 K193 E194 Y351	F186-E190 HydrophobicContact CD1-CG 4.38Å; F186-E190 HydrophobicContact CD2-CG 4.5Å; F186-E190 HydrophobicContact CE1-CG 3.76Å; F186-E190 HydrophobicContact CE2-CG 3.89Å; F186-E190 HydrophobicContact CZ-CG 3.48Å; F186-E190 VanDerWaalsContact CZ-CG 3.48Å; F186-E190 PolarHBondContact O-N 3Å; E190-K193 WeakPolarHBondContact OE1-CD 3.5Å; E190-K193 WeakPolarHBondContact OE1-CE 3.42Å; E190-K193 IonicContact OE1-NZ 3.9Å; E190-K193 PolarHBondContact OE1-NZ 3.24Å; E190-E194 PolarHBondContact O-N 2.99Å; E190-E194 VanDerWaalsContact O-N 3.09Å; E190-Y351 HydrophobicContact CB-CD1 4.07Å; E190-Y351 HydrophobicContact CB-CE1 3.89Å
191	M	96.4	Very high	94.4	Very high	13 Å²	13	66.1 Å²	66.1	6%	0.064	29%	0.294	C	S	.	.	H	α-helix	trans	-67.6	-34.8	172.8	-69.6	-174.1	-56.7	0	0	112.6	K187 R188 Y189 H195 Y351 E355 M356 F359	K187-M191 HydrophobicContact CD-CE 4.47Å; K187-M191 HydrophobicContact CG-CE 4.13Å; K187-M191 HydrophobicContact CG-SD 4.49Å; K187-M191 WeakPolarHBondContact O-CB 3.47Å; K187-M191 VanDerWaalsContact O-CG 3.3Å; K187-M191 WeakPolarHBondContact O-CG 3.42Å; K187-M191 PolarHBondContact O-N 3.36Å; R188-M191 HydrophobicContact CG-CE 4.44Å; Y189-M191 PolarHBondContact O-N 2.79Å; M191-H195 VanDerWaalsContact O-CB 3.31Å; M191-H195 WeakPolarHBondContact O-CB 3.43Å; M191-H195 PolarHBondContact O-N 3.01Å; M191-Y351 HydrophobicContact CG-CD1 3.55Å; M191-Y351 HydrophobicContact CG-CD2 3.94Å; M191-Y351 HydrophobicContact CG-CE1 4.01Å; M191-Y351 HydrophobicContact CG-CE2 4.36Å; M191-Y351 HydrophobicContact CG-CG 3.52Å; M191-Y351 HydrophobicContact SD-CG 4.18Å; M191-E355 HydrophobicContact SD-CB 4.22Å; M191-M356 HydrophobicContact CB-SD 3.76Å; M191-M356 HydrophobicContact CG-SD 3.87Å; M191-M356 WeakPolarHBondContact O-CE 3.45Å; M191-F359 HydrophobicContact CB-CD1 3.61Å; M191-F359 HydrophobicContact CB-CD2 4.46Å; M191-F359 HydrophobicContact CB-CE1 3.72Å; M191-F359 HydrophobicContact CB-CG 3.99Å; M191-F359 HydrophobicContact CB-CZ 4.2Å; M191-F359 HydrophobicContact CE-CB 4.1Å; M191-F359 HydrophobicContact CE-CD2 3.66Å; M191-F359 HydrophobicContact CE-CE2 4.18Å; M191-F359 HydrophobicContact CE-CG 3.9Å; M191-F359 HydrophobicContact SD-CB 3.89Å; M191-F359 HydrophobicContact SD-CD2 4.49Å; M191-F359 HydrophobicContact SD-CG 4.13Å
192	M	95.7	Very high	94.7	Very high	71 Å²	71	66.2 Å²	66.2	35%	0.35	29%	0.293	S	S	.	.	H	α-helix	trans	-69.4	-44.4	175.5	-169.8	67.9	84.1	0	0	111.7	R188 Y189 E194 H195 D196 F359 L363	R188-M192 WeakPolarHBondContact O-CB 3.5Å; R188-M192 PolarHBondContact O-N 3.03Å; Y189-M192 PolarHBondContact O-N 3.26Å; Y189-M192 VanDerWaalsContact O-N 3.07Å; M192-E194 VanDerWaalsContact C-N 3.33Å; M192-E194 PolarHBondContact O-N 3.23Å; M192-H195 WeakPolarHBondContact O-CA 3.39Å; M192-H195 WeakPolarHBondContact O-CB 3.38Å; M192-H195 PolarHBondContact O-N 3.3Å; M192-D196 PolarHBondContact O-N 2.83Å; M192-F359 HydrophobicContact CB-CE1 4.33Å; M192-F359 HydrophobicContact CB-CZ 4.21Å; M192-F359 HydrophobicContact CE-CZ 4.04Å; M192-F359 HydrophobicContact SD-CE1 4.36Å; M192-F359 HydrophobicContact SD-CZ 4.37Å; M192-L363 HydrophobicContact CE-CD1 4.28Å; M192-L363 HydrophobicContact CE-CD2 4.02Å; M192-L363 HydrophobicContact SD-CD1 4.02Å
193	K	95.1	Very high	95	Very high	72 Å²	72	67.7 Å²	67.7	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-57.6	-43.1	176.8	177	170.1	152.2	-163.5	0	111.8	Y189 E190 R197 D295 E298	Y189-K193 HydrophobicContact CE1-CD 3.74Å; Y189-K193 WeakPolarHBondContact O-CB 3.46Å; Y189-K193 PolarHBondContact O-N 3.46Å; E190-K193 WeakPolarHBondContact OE1-CD 3.5Å; E190-K193 WeakPolarHBondContact OE1-CE 3.42Å; E190-K193 IonicContact OE1-NZ 3.9Å; E190-K193 PolarHBondContact OE1-NZ 3.24Å; K193-R197 WeakPolarHBondContact O-CB 3.35Å; K193-R197 PolarHBondContact O-N 3.06Å; K193-D295 IonicContact NZ-OD2 3.22Å; K193-D295 PolarHBondContact NZ-OD2 2.62Å; K193-E298 IonicContact NZ-OE1 2.79Å; K193-E298 PolarHBondContact NZ-OE1 3.48Å
194	E	94.9	Very high	95.3	Very high	22 Å²	22	66.2 Å²	66.2	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-70	-36.5	171.7	173.3	64.9	174.1	0	0	112.9	E190 M192 R197 R198 Y351 M356	E190-E194 PolarHBondContact O-N 2.99Å; E190-E194 VanDerWaalsContact O-N 3.09Å; M192-E194 VanDerWaalsContact C-N 3.33Å; M192-E194 PolarHBondContact O-N 3.23Å; E194-R197 VanDerWaalsContact CD-NH2 3.28Å; E194-R197 PolarHBondContact O-N 2.81Å; E194-R197 IonicContact OE1-NH2 3.8Å; E194-R197 PolarHBondContact OE1-NH2 3.44Å; E194-R197 IonicContact OE2-CZ 3.66Å; E194-R197 IonicContact OE2-NE 3.09Å; E194-R197 PolarHBondContact OE2-NE 2.92Å; E194-R197 IonicContact OE2-NH2 2.77Å; E194-R197 PolarHBondContact OE2-NH2 2.95Å; E194-R198 VanDerWaalsContact CD-NE 3.34Å; E194-R198 WeakPolarHBondContact O-CB 3.4Å; E194-R198 VanDerWaalsContact O-CG 3.25Å; E194-R198 WeakPolarHBondContact O-CG 3.5Å; E194-R198 PolarHBondContact O-N 2.98Å; E194-R198 IonicContact OE1-CZ 3.71Å; E194-R198 IonicContact OE1-NE 3.65Å; E194-R198 PolarHBondContact OE1-NE 3.23Å; E194-R198 IonicContact OE1-NH2 3.55Å; E194-R198 PolarHBondContact OE1-NH2 2.81Å; E194-Y351 VanDerWaalsContact CB-OH 3.29Å; E194-Y351 WeakPolarHBondContact CB-OH 3.4Å; E194-Y351 WeakPolarHBondContact CG-OH 3.44Å; E194-M356 HydrophobicContact CB-CE 4.07Å; E194-M356 HydrophobicContact CB-SD 4.49Å; E194-M356 HydrophobicContact CG-CE 3.76Å; E194-M356 HydrophobicContact CG-SD 4.31Å
195	H	96.1	Very high	95.4	Very high	32 Å²	32	66.3 Å²	66.3	15%	0.148	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-50	177.3	178.1	68.5	0	0	0	111.7	M191 M192 R197 R198 E199 M356	M191-H195 VanDerWaalsContact O-CB 3.31Å; M191-H195 WeakPolarHBondContact O-CB 3.43Å; M191-H195 PolarHBondContact O-N 3.01Å; M192-H195 WeakPolarHBondContact O-CA 3.39Å; M192-H195 WeakPolarHBondContact O-CB 3.38Å; M192-H195 PolarHBondContact O-N 3.3Å; H195-R197 VanDerWaalsContact C-N 3.3Å; H195-R197 PolarHBondContact O-N 2.81Å; H195-R198 WeakPolarHBondContact O-CB 3.23Å; H195-R198 PolarHBondContact O-N 3.32Å; H195-R198 VanDerWaalsContact O-N 3.08Å; H195-E199 IonicContact CE1-OE1 2.7Å; H195-E199 PolarHBondContact O-N 3.45Å; H195-M356 HydrophobicContact CB-CE 3.87Å
196	D	96	Very high	95.5	Very high	97 Å²	97	67.5 Å²	67.5	52%	0.519	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-38.7	178.1	-76.7	-19.5	0	0	0	111.2	M192 E199 H200	M192-D196 PolarHBondContact O-N 2.83Å; D196-E199 PolarHBondContact O-N 3.05Å; D196-H200 WeakPolarHBondContact O-CB 3.29Å; D196-H200 PolarHBondContact O-N 3.3Å
197	R	95.1	Very high	95.6	Very high	69 Å²	69	73.2 Å²	73.2	26%	0.26	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-46	171.7	-166.9	-175.1	71	99.8	4.6	111.4	K193 E194 H195 H200 L201	K193-R197 WeakPolarHBondContact O-CB 3.35Å; K193-R197 PolarHBondContact O-N 3.06Å; E194-R197 VanDerWaalsContact CD-NH2 3.28Å; E194-R197 PolarHBondContact O-N 2.81Å; E194-R197 IonicContact OE1-NH2 3.8Å; E194-R197 PolarHBondContact OE1-NH2 3.44Å; E194-R197 IonicContact OE2-CZ 3.66Å; E194-R197 IonicContact OE2-NE 3.09Å; E194-R197 PolarHBondContact OE2-NE 2.92Å; E194-R197 IonicContact OE2-NH2 2.77Å; E194-R197 PolarHBondContact OE2-NH2 2.95Å; H195-R197 VanDerWaalsContact C-N 3.3Å; H195-R197 PolarHBondContact O-N 2.81Å; R197-H200 PolarHBondContact O-N 2.72Å; R197-L201 HydrophobicContact CG-CD1 4.23Å; R197-L201 VanDerWaalsContact O-CG 3.23Å; R197-L201 WeakPolarHBondContact O-CG 3.41Å; R197-L201 PolarHBondContact O-N 2.8Å
198	R	95.1	Very high	95.6	Very high	69 Å²	69	74.8 Å²	74.8	26%	0.26	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-42.9	177.4	-74	170.5	-176.2	-173.8	8	112.5	E194 H195 K202 M356 E360	E194-R198 VanDerWaalsContact CD-NE 3.34Å; E194-R198 WeakPolarHBondContact O-CB 3.4Å; E194-R198 VanDerWaalsContact O-CG 3.25Å; E194-R198 WeakPolarHBondContact O-CG 3.5Å; E194-R198 PolarHBondContact O-N 2.98Å; E194-R198 IonicContact OE1-CZ 3.71Å; E194-R198 IonicContact OE1-NE 3.65Å; E194-R198 PolarHBondContact OE1-NE 3.23Å; E194-R198 IonicContact OE1-NH2 3.55Å; E194-R198 PolarHBondContact OE1-NH2 2.81Å; H195-R198 WeakPolarHBondContact O-CB 3.23Å; H195-R198 PolarHBondContact O-N 3.32Å; H195-R198 VanDerWaalsContact O-N 3.08Å; R198-K202 WeakPolarHBondContact O-CD 3.46Å; R198-K202 WeakPolarHBondContact O-CE 3.22Å; R198-K202 VanDerWaalsContact O-CG 3.26Å; R198-K202 WeakPolarHBondContact O-CG 3.39Å; R198-K202 PolarHBondContact O-N 2.92Å; R198-M356 VanDerWaalsContact NH1-CG 3.33Å; R198-E360 WeakPolarHBondContact CD-OE1 3.41Å; R198-E360 IonicContact CZ-OE1 2.72Å; R198-E360 IonicContact NE-OE1 2.64Å; R198-E360 IonicContact NH1-OE1 2.99Å; R198-E360 PolarHBondContact NH1-OE1 3.36Å
199	E	95.3	Very high	95.6	Very high	79 Å²	79	72.6 Å²	72.6	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-66.5	-42.1	175.2	-71.2	-52.4	133.9	0	0	111.6	H195 D196 L201 K202 T203	H195-E199 IonicContact CE1-OE1 2.7Å; H195-E199 PolarHBondContact O-N 3.45Å; D196-E199 PolarHBondContact O-N 3.05Å; E199-L201 PolarHBondContact O-N 2.81Å; E199-K202 WeakPolarHBondContact O-CB 3.5Å; E199-K202 PolarHBondContact O-N 3.21Å; E199-K202 VanDerWaalsContact O-N 3.09Å; E199-K202 IonicContact OE1-NZ 2.63Å; E199-K202 PolarHBondContact OE1-NZ 3.21Å; E199-T203 PolarHBondContact O-N 2.9Å
200	H	95.5	Very high	95.6	Very high	91 Å²	91	73.4 Å²	73.4	42%	0.421	35%	0.345	S	S	.	.	H	α-helix	trans	-57.1	-50	175.2	-172.1	56.5	0	0	0	111.7	D196 R197 K202 T203 L204	D196-H200 WeakPolarHBondContact O-CB 3.29Å; D196-H200 PolarHBondContact O-N 3.3Å; R197-H200 PolarHBondContact O-N 2.72Å; H200-K202 PolarHBondContact O-N 2.92Å; H200-T203 PolarHBondContact O-N 2.77Å; H200-T203 PolarHBondContact O-OG1 2.82Å; H200-L204 PolarHBondContact O-N 3.46Å
201	L	96.4	Very high	95.7	Very high	17 Å²	17	76.9 Å²	76.9	9%	0.089	36%	0.359	C	S	.	.	H	α-helix	trans	-60.1	-27.9	177.4	-67.2	169.6	0	0	0	113.2	R197 E199 R209 E212 E213	R197-L201 HydrophobicContact CG-CD1 4.23Å; R197-L201 VanDerWaalsContact O-CG 3.23Å; R197-L201 WeakPolarHBondContact O-CG 3.41Å; R197-L201 PolarHBondContact O-N 2.8Å; E199-L201 PolarHBondContact O-N 2.81Å; L201-R209 HydrophobicContact CB-CG 3.92Å; L201-R209 HydrophobicContact CD2-CG 3.55Å; L201-R209 HydrophobicContact CG-CG 4.28Å; L201-R209 WeakPolarHBondContact O-CD 3.5Å; L201-R209 PolarHBondContact O-NE 2.95Å; L201-E212 HydrophobicContact CD2-CB 3.76Å; L201-E212 HydrophobicContact CD2-CG 3.88Å; L201-E213 HydrophobicContact CD2-CG 4.29Å
202	K	95.3	Very high	95.6	Very high	124 Å²	124	79.9 Å²	79.9	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-72.3	-25.6	172.6	-68.4	163.5	-159.9	172.4	0	113	R198 E199 H200	R198-K202 WeakPolarHBondContact O-CD 3.46Å; R198-K202 WeakPolarHBondContact O-CE 3.22Å; R198-K202 VanDerWaalsContact O-CG 3.26Å; R198-K202 WeakPolarHBondContact O-CG 3.39Å; R198-K202 PolarHBondContact O-N 2.92Å; E199-K202 WeakPolarHBondContact O-CB 3.5Å; E199-K202 PolarHBondContact O-N 3.21Å; E199-K202 VanDerWaalsContact O-N 3.09Å; E199-K202 IonicContact OE1-NZ 2.63Å; E199-K202 PolarHBondContact OE1-NZ 3.21Å; H200-K202 PolarHBondContact O-N 2.92Å
203	T	95.4	Very high	95.6	Very high	107 Å²	107	80.5 Å²	80.5	66%	0.656	38%	0.375	S	S	*	.	H	α-helix	trans	-80	-23	175.8	70.4	0	0	0	0	114	E199 H200	E199-T203 PolarHBondContact O-N 2.9Å; H200-T203 PolarHBondContact O-N 2.77Å; H200-T203 PolarHBondContact O-OG1 2.82Å
204	L	96	Very high	95.7	Very high	26 Å²	26	82.5 Å²	82.5	14%	0.136	39%	0.386	C	S	.	.	S	Bend	trans	-82.1	150.6	-174.3	-66.7	-175	0	0	0	113.9	H200 Q208 R209 E212	H200-L204 PolarHBondContact O-N 3.46Å; L204-Q208 HydrophobicContact CB-CB 3.95Å; L204-Q208 HydrophobicContact CD1-CB 4.22Å; L204-Q208 HydrophobicContact CD2-CB 4.16Å; L204-Q208 HydrophobicContact CG-CB 4.33Å; L204-R209 HydrophobicContact CB-CB 4.17Å; L204-R209 PolarHBondContact O-NH2 2.94Å; L204-E212 HydrophobicContact CD1-CB 4.04Å; L204-E212 HydrophobicContact CD1-CG 4.22Å
205	D	96.1	Very high	95.7	Very high	83 Å²	83	85.1 Å²	85.1	44%	0.444	40%	0.398	S	S	.	.			trans	-70.8	170.2	168.7	82.3	38.6	0	0	0	112.6	E207 Q208 R209	D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 PolarHBondContact O-N 3.02Å; D205-E207 WeakPolarHBondContact OD1-CA 3.46Å; D205-E207 PolarHBondContact OD1-N 2.98Å; D205-Q208 VanDerWaalsContact N-OE1 3.16Å; D205-Q208 PolarHBondContact O-N 3.48Å; D205-Q208 WeakPolarHBondContact OD1-CG 3.34Å; D205-Q208 PolarHBondContact OD1-N 2.65Å; D205-R209 VanDerWaalsContact O-CB 3.3Å; D205-R209 WeakPolarHBondContact O-CB 3.46Å; D205-R209 PolarHBondContact O-N 3.15Å
206	E	94.8	Very high	95.6	Very high	143 Å²	143	88.2 Å²	88.2	67%	0.668	41%	0.409	S	S	*	.	H	α-helix	trans	-65	-29.7	-174.8	-161.1	71.3	-177.2	0	0	114	R209 K210	E206-R209 IonicContact OE1-NH1 2.72Å; E206-R209 IonicContact OE2-CZ 3.6Å; E206-R209 IonicContact OE2-NH1 3.98Å; E206-R209 PolarHBondContact OE2-NH1 3.48Å; E206-R209 IonicContact OE2-NH2 2.71Å; E206-K210 WeakPolarHBondContact O-CB 3.34Å
207	E	95.9	Very high	95.5	Very high	132 Å²	132	89.7 Å²	89.7	62%	0.617	41%	0.413	S	S	*	.	H	α-helix	trans	-83.5	-31.8	178	-161.1	-169.5	125.8	0	0	111.1	D205 K211	D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 PolarHBondContact O-N 3.02Å; D205-E207 WeakPolarHBondContact OD1-CA 3.46Å; D205-E207 PolarHBondContact OD1-N 2.98Å; E207-K211 WeakPolarHBondContact O-CD 3.35Å; E207-K211 VanDerWaalsContact O-CG 3.3Å; E207-K211 WeakPolarHBondContact O-CG 3.49Å; E207-K211 PolarHBondContact O-N 3.24Å; E207-K211 WeakPolarHBondContact OE1-CE 3.34Å; E207-K211 IonicContact OE1-NZ 3.67Å; E207-K211 PolarHBondContact OE1-NZ 3.1Å
208	Q	95.4	Very high	95.6	Very high	91 Å²	91	91.6 Å²	91.6	43%	0.425	43%	0.425	S	S	.	.	H	α-helix	trans	-71.1	-53.2	173.7	-69	175.6	-35.3	0	0	111.4	L204 D205 K210 K211 E212	L204-Q208 HydrophobicContact CB-CB 3.95Å; L204-Q208 HydrophobicContact CD1-CB 4.22Å; L204-Q208 HydrophobicContact CD2-CB 4.16Å; L204-Q208 HydrophobicContact CG-CB 4.33Å; D205-Q208 VanDerWaalsContact N-OE1 3.16Å; D205-Q208 PolarHBondContact O-N 3.48Å; D205-Q208 WeakPolarHBondContact OD1-CG 3.34Å; D205-Q208 PolarHBondContact OD1-N 2.65Å; Q208-K210 VanDerWaalsContact C-N 3.28Å; Q208-K210 PolarHBondContact O-N 3.22Å; Q208-K211 WeakPolarHBondContact O-CB 3.46Å; Q208-K211 PolarHBondContact O-N 3.33Å; Q208-E212 PolarHBondContact O-N 2.82Å
209	R	96.2	Very high	95.5	Very high	64 Å²	64	89.2 Å²	89.2	24%	0.242	42%	0.417	C	S	.	.	H	α-helix	trans	-55.7	-43.9	-178.8	-163.9	-170.2	-49	109.1	21.9	111.8	L201 L204 D205 E206 K211 E212 E213	L201-R209 HydrophobicContact CB-CG 3.92Å; L201-R209 HydrophobicContact CD2-CG 3.55Å; L201-R209 HydrophobicContact CG-CG 4.28Å; L201-R209 WeakPolarHBondContact O-CD 3.5Å; L201-R209 PolarHBondContact O-NE 2.95Å; L204-R209 HydrophobicContact CB-CB 4.17Å; L204-R209 PolarHBondContact O-NH2 2.94Å; D205-R209 VanDerWaalsContact O-CB 3.3Å; D205-R209 WeakPolarHBondContact O-CB 3.46Å; D205-R209 PolarHBondContact O-N 3.15Å; E206-R209 IonicContact OE1-NH1 2.72Å; E206-R209 IonicContact OE2-CZ 3.6Å; E206-R209 IonicContact OE2-NH1 3.98Å; E206-R209 PolarHBondContact OE2-NH1 3.48Å; E206-R209 IonicContact OE2-NH2 2.71Å; R209-K211 VanDerWaalsContact C-N 3.32Å; R209-K211 PolarHBondContact O-N 2.84Å; R209-E212 WeakPolarHBondContact O-CB 3.46Å; R209-E212 PolarHBondContact O-N 2.9Å; R209-E213 WeakPolarHBondContact CD-OE1 3.44Å; R209-E213 WeakPolarHBondContact CG-OE1 3.31Å; R209-E213 WeakPolarHBondContact O-CB 3.38Å; R209-E213 WeakPolarHBondContact O-CG 3.25Å; R209-E213 PolarHBondContact O-N 2.76Å
210	K	96.4	Very high	95.4	Very high	105 Å²	105	89.5 Å²	89.5	46%	0.457	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-35	176.8	-177	179.6	174.3	-66	0	113.1	E206 Q208 E214	E206-K210 WeakPolarHBondContact O-CB 3.34Å; Q208-K210 VanDerWaalsContact C-N 3.28Å; Q208-K210 PolarHBondContact O-N 3.22Å; K210-E214 IonicContact NZ-OE1 2.65Å; K210-E214 PolarHBondContact NZ-OE1 2.96Å; K210-E214 IonicContact NZ-OE2 2.63Å; K210-E214 PolarHBondContact NZ-OE2 3.26Å; K210-E214 WeakPolarHBondContact O-CB 3.47Å; K210-E214 VanDerWaalsContact O-CG 3.32Å; K210-E214 WeakPolarHBondContact O-CG 3.36Å; K210-E214 PolarHBondContact O-N 3.24Å
211	K	96.3	Very high	95.4	Very high	107 Å²	107	92.3 Å²	92.3	47%	0.465	43%	0.428	S	S	.	.	H	α-helix	trans	-72.1	-36.8	175.3	-71	165.2	-169.6	159.8	0	111.6	E207 Q208 R209 E214 H215	E207-K211 WeakPolarHBondContact O-CD 3.35Å; E207-K211 VanDerWaalsContact O-CG 3.3Å; E207-K211 WeakPolarHBondContact O-CG 3.49Å; E207-K211 PolarHBondContact O-N 3.24Å; E207-K211 WeakPolarHBondContact OE1-CE 3.34Å; E207-K211 IonicContact OE1-NZ 3.67Å; E207-K211 PolarHBondContact OE1-NZ 3.1Å; Q208-K211 WeakPolarHBondContact O-CB 3.46Å; Q208-K211 PolarHBondContact O-N 3.33Å; R209-K211 VanDerWaalsContact C-N 3.32Å; R209-K211 PolarHBondContact O-N 2.84Å; K211-E214 PolarHBondContact O-N 3.35Å; K211-H215 VanDerWaalsContact O-CB 3.29Å; K211-H215 WeakPolarHBondContact O-CB 3.33Å; K211-H215 PolarHBondContact O-N 3.5Å
212	E	95.5	Very high	95.3	Very high	76 Å²	76	95.1 Å²	95.1	36%	0.355	44%	0.439	S	S	.	.	H	α-helix	trans	-67.2	-41.2	176.9	-157.4	60.2	-140.5	0	0	111.2	L201 L204 Q208 R209 H215 Y216	L201-E212 HydrophobicContact CD2-CB 3.76Å; L201-E212 HydrophobicContact CD2-CG 3.88Å; L204-E212 HydrophobicContact CD1-CB 4.04Å; L204-E212 HydrophobicContact CD1-CG 4.22Å; Q208-E212 PolarHBondContact O-N 2.82Å; R209-E212 WeakPolarHBondContact O-CB 3.46Å; R209-E212 PolarHBondContact O-N 2.9Å; E212-H215 PolarHBondContact O-N 3.01Å; E212-Y216 WeakPolarHBondContact O-CB 3.44Å; E212-Y216 PolarHBondContact O-N 3.45Å
213	E	95.6	Very high	95.2	Very high	85 Å²	85	89.8 Å²	89.8	40%	0.397	42%	0.416	S	S	.	.	H	α-helix	trans	-62.3	-45.5	170.5	-71.4	165.7	-172.9	0	0	111.8	L201 R209 H215 Y216 E217	L201-E213 HydrophobicContact CD2-CG 4.29Å; R209-E213 WeakPolarHBondContact CD-OE1 3.44Å; R209-E213 WeakPolarHBondContact CG-OE1 3.31Å; R209-E213 WeakPolarHBondContact O-CB 3.38Å; R209-E213 WeakPolarHBondContact O-CG 3.25Å; R209-E213 PolarHBondContact O-N 2.76Å; E213-H215 VanDerWaalsContact C-N 3.31Å; E213-H215 PolarHBondContact O-N 3.38Å; E213-Y216 PolarHBondContact O-N 2.99Å; E213-E217 WeakPolarHBondContact O-CG 3.2Å; E213-E217 PolarHBondContact O-N 3.22Å; E213-E217 VanDerWaalsContact O-N 3.09Å
214	E	96.4	Very high	95	Very high	113 Å²	113	86.8 Å²	86.8	53%	0.528	40%	0.402	S	S	.	.	H	α-helix	trans	-65.5	-31.6	175.4	-77.6	175.8	149.3	0	0	112.8	K210 K211 E218	K210-E214 IonicContact NZ-OE1 2.65Å; K210-E214 PolarHBondContact NZ-OE1 2.96Å; K210-E214 IonicContact NZ-OE2 2.63Å; K210-E214 PolarHBondContact NZ-OE2 3.26Å; K210-E214 WeakPolarHBondContact O-CB 3.47Å; K210-E214 VanDerWaalsContact O-CG 3.32Å; K210-E214 WeakPolarHBondContact O-CG 3.36Å; K210-E214 PolarHBondContact O-N 3.24Å; K211-E214 PolarHBondContact O-N 3.35Å; E214-E218 PolarHBondContact O-N 3.4Å
215	H	95.1	Very high	94.9	Very high	77 Å²	77	92.2 Å²	92.2	36%	0.356	43%	0.431	S	S	.	.	H	α-helix	trans	-71	-49.8	174.5	-172.4	-116.4	0	0	0	111.2	K211 E212 E213 E217 E218 M219	K211-H215 VanDerWaalsContact O-CB 3.29Å; K211-H215 WeakPolarHBondContact O-CB 3.33Å; K211-H215 PolarHBondContact O-N 3.5Å; E212-H215 PolarHBondContact O-N 3.01Å; E213-H215 VanDerWaalsContact C-N 3.31Å; E213-H215 PolarHBondContact O-N 3.38Å; H215-E217 VanDerWaalsContact C-N 3.32Å; H215-E217 PolarHBondContact O-N 3.16Å; H215-E218 CarbonylContact O-C 3.51Å; H215-E218 WeakPolarHBondContact O-CA 2.8Å; H215-E218 WeakPolarHBondContact O-CB 3.33Å; H215-E218 PolarHBondContact O-N 2.92Å; H215-M219 WeakPolarHBondContact O-CG 3.35Å; H215-M219 PolarHBondContact O-N 3.2Å
216	Y	93.9	Very high	94.7	Very high	97 Å²	97	90.6 Å²	90.6	38%	0.38	42%	0.421	S	S	.	.	H	α-helix	trans	-57.1	-42.8	178.3	179.8	-99.2	0	0	0	112.6	E212 E213 E218 M219 K220	E212-Y216 WeakPolarHBondContact O-CB 3.44Å; E212-Y216 PolarHBondContact O-N 3.45Å; E213-Y216 PolarHBondContact O-N 2.99Å; Y216-E218 VanDerWaalsContact C-N 3.33Å; Y216-E218 PolarHBondContact O-N 3.46Å; Y216-M219 PolarHBondContact O-N 3.46Å; Y216-K220 WeakPolarHBondContact O-CB 3.36Å; Y216-K220 PolarHBondContact O-N 2.94Å
217	E	94.7	Very high	94.6	Very high	129 Å²	129	87.7 Å²	87.7	60%	0.603	41%	0.414	S	S	*	.	H	α-helix	trans	-66.8	-30.3	173.3	-70	-76	147.1	0	0	112.9	E213 H215 K221	E213-E217 WeakPolarHBondContact O-CG 3.2Å; E213-E217 PolarHBondContact O-N 3.22Å; E213-E217 VanDerWaalsContact O-N 3.09Å; H215-E217 VanDerWaalsContact C-N 3.32Å; H215-E217 PolarHBondContact O-N 3.16Å; E217-K221 WeakPolarHBondContact O-CB 3.48Å; E217-K221 PolarHBondContact O-N 3.02Å
218	E	96.1	Very high	94.3	Very high	109 Å²	109	88.5 Å²	88.5	51%	0.509	42%	0.416	S	S	.	.	H	α-helix	trans	-69.1	-45.7	171.5	-163.2	-172.2	109.9	0	0	111.2	E214 H215 Y216 K221 K222	E214-E218 PolarHBondContact O-N 3.4Å; H215-E218 CarbonylContact O-C 3.51Å; H215-E218 WeakPolarHBondContact O-CA 2.8Å; H215-E218 WeakPolarHBondContact O-CB 3.33Å; H215-E218 PolarHBondContact O-N 2.92Å; Y216-E218 VanDerWaalsContact C-N 3.33Å; Y216-E218 PolarHBondContact O-N 3.46Å; E218-K221 PolarHBondContact O-N 3.32Å; E218-K222 WeakPolarHBondContact O-CG 3.3Å; E218-K222 PolarHBondContact O-N 3.49Å; E218-K222 WeakPolarHBondContact OE1-CE 3.45Å; E218-K222 IonicContact OE1-NZ 3.53Å; E218-K222 PolarHBondContact OE1-NZ 2.97Å
219	M	93.9	Very high	94.1	Very high	19 Å²	19	84.6 Å²	84.6	9%	0.094	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-50.4	-179.8	-61.4	-48.7	-80.7	0	0	111.7	H215 Y216 K221 K222 H223 E292 E293	H215-M219 WeakPolarHBondContact O-CG 3.35Å; H215-M219 PolarHBondContact O-N 3.2Å; Y216-M219 PolarHBondContact O-N 3.46Å; M219-K221 PolarHBondContact O-N 3.35Å; M219-K222 WeakPolarHBondContact O-CB 3.39Å; M219-K222 PolarHBondContact O-N 2.65Å; M219-K222 HydrophobicContact SD-CD 4.12Å; M219-K222 PolarHBondContact SD-NZ 2.76Å; M219-H223 PolarHBondContact O-N 3.05Å; M219-H223 VanDerWaalsContact O-N 3.09Å; M219-E292 HydrophobicContact CE-CB 4.07Å; M219-E292 HydrophobicContact CE-CG 3.55Å; M219-E293 HydrophobicContact CB-CB 4.29Å; M219-E293 HydrophobicContact CE-CB 3.68Å; M219-E293 HydrophobicContact CE-CG 4.43Å
220	K	92.8	Very high	94	Very high	84 Å²	84	82.4 Å²	82.4	37%	0.365	39%	0.391	S	S	.	.	H	α-helix	trans	-55.5	-37.6	174.5	176.9	161.4	177.3	139	0	111.8	Y216 A224 E346	Y216-K220 WeakPolarHBondContact O-CB 3.36Å; Y216-K220 PolarHBondContact O-N 2.94Å; K220-A224 WeakPolarHBondContact O-CB 3.43Å; K220-A224 PolarHBondContact O-N 3.5Å; K220-A224 VanDerWaalsContact O-N 3.11Å; K220-E346 WeakPolarHBondContact CE-OE1 3.44Å; K220-E346 IonicContact NZ-OE1 3.58Å; K220-E346 PolarHBondContact NZ-OE1 3.4Å; K220-E346 VanDerWaalsContact NZ-OE1 3.09Å
221	K	94.2	Very high	94	Very high	150 Å²	150	78.8 Å²	78.8	65%	0.652	38%	0.376	S	S	*	.	H	α-helix	trans	-73.3	-27.5	177.3	-176.7	171.2	171.9	-80	0	114	E217 E218 M219 D225	E217-K221 WeakPolarHBondContact O-CB 3.48Å; E217-K221 PolarHBondContact O-N 3.02Å; E218-K221 PolarHBondContact O-N 3.32Å; M219-K221 PolarHBondContact O-N 3.35Å; K221-D225 PolarHBondContact O-N 3.4Å
222	K	94.5	Very high	94	Very high	76 Å²	76	73.9 Å²	73.9	33%	0.33	36%	0.355	S	S	.	.	H	α-helix	trans	-69.1	-50.3	172.4	-69.7	172.6	-165.4	150.8	0	110.2	E218 M219 A224 D225 E293	E218-K222 WeakPolarHBondContact O-CG 3.3Å; E218-K222 PolarHBondContact O-N 3.49Å; E218-K222 WeakPolarHBondContact OE1-CE 3.45Å; E218-K222 IonicContact OE1-NZ 3.53Å; E218-K222 PolarHBondContact OE1-NZ 2.97Å; M219-K222 WeakPolarHBondContact O-CB 3.39Å; M219-K222 PolarHBondContact O-N 2.65Å; M219-K222 HydrophobicContact SD-CD 4.12Å; M219-K222 PolarHBondContact SD-NZ 2.76Å; K222-A224 VanDerWaalsContact C-N 3.26Å; K222-A224 PolarHBondContact O-N 3.3Å; K222-D225 PolarHBondContact O-N 3.05Å; K222-E293 HydrophobicContact CB-CB 4.44Å; K222-E293 HydrophobicContact CB-CG 4.06Å; K222-E293 VanDerWaalsContact CB-OE1 3.24Å; K222-E293 WeakPolarHBondContact CB-OE1 3.38Å; K222-E293 WeakPolarHBondContact CD-OE1 3.46Å
223	H	93.3	Very high	93.9	Very high	13 Å²	13	71.4 Å²	71.4	6%	0.06	35%	0.35	C	S	.	.	H	α-helix	trans	-54.1	-42.7	176.2	-170.4	65.4	0	0	0	112	M219 D225 H226 I286 Y287 E293 D294	M219-H223 PolarHBondContact O-N 3.05Å; M219-H223 VanDerWaalsContact O-N 3.09Å; H223-D225 VanDerWaalsContact C-N 3.29Å; H223-D225 PolarHBondContact O-N 3.39Å; H223-H226 PolarHBondContact O-CD2 3.24Å; H223-I286 PolarHBondContact CE1-O 2.95Å; H223-I286 PolarHBondContact ND1-O 3.49Å; H223-Y287 AromaticContact CE1-CD1 3.57Å; H223-Y287 AromaticContact CE1-CE1 3.25Å; H223-Y287 WeakPolarHBondContact CE1-CE1 3.39Å; H223-Y287 AromaticContact CE1-CZ 3.74Å; H223-Y287 AromaticContact NE2-CE1 3.69Å; H223-Y287 AromaticContact NE2-CZ 3.83Å; H223-E293 HydrophobicContact CB-CB 4.38Å; H223-D294 IonicContact CE1-OD1 2.66Å; H223-D294 IonicContact CG-OD1 3.54Å; H223-D294 IonicContact ND1-OD1 3.01Å; H223-D294 PolarHBondContact ND1-OD1 2.93Å
224	A	92.4	Very high	93.9	Very high	44 Å²	44	67.4 Å²	67.4	36%	0.364	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-8.9	177.1	0	0	0	0	0	115.9	K220 K222 H226	K220-A224 WeakPolarHBondContact O-CB 3.43Å; K220-A224 PolarHBondContact O-N 3.5Å; K220-A224 VanDerWaalsContact O-N 3.11Å; K222-A224 VanDerWaalsContact C-N 3.26Å; K222-A224 PolarHBondContact O-N 3.3Å; A224-H226 VanDerWaalsContact C-N 3.28Å; A224-H226 PolarHBondContact O-N 3.42Å
225	D	92.8	Very high	93.9	Very high	140 Å²	140	64.8 Å²	64.8	75%	0.749	32%	0.319	S	S	*	.	S	Bend	trans	-94.1	38.8	-179.4	-155.3	14.6	0	0	0	112	K221 K222 H223	K221-D225 PolarHBondContact O-N 3.4Å; K222-D225 PolarHBondContact O-N 3.05Å; H223-D225 VanDerWaalsContact C-N 3.29Å; H223-D225 PolarHBondContact O-N 3.39Å
226	H	91.7	Very high	93.9	Very high	49 Å²	49	64.8 Å²	64.8	23%	0.227	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-87.1	155.9	-175.6	69.4	83.5	0	0	0	113.5	H223 A224	H223-H226 PolarHBondContact O-CD2 3.24Å; A224-H226 VanDerWaalsContact C-N 3.28Å; A224-H226 PolarHBondContact O-N 3.42Å
227	P	92.6	Very high	94	Very high	81 Å²	81	60.2 Å²	60.2	53%	0.526	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-57.9	149.4	169.5	-22.1	34.1	0	0	0	112	V229 K285	P227-V229 PolarHBondContact O-N 3.49Å; P227-V229 VanDerWaalsContact O-N 3.09Å; P227-K285 HydrophobicContact CB-CB 4.34Å; P227-K285 VanDerWaalsContact CD-O 3.26Å; P227-K285 WeakPolarHBondContact CD-O 3.32Å; P227-K285 HydrophobicContact CG-CB 4.39Å
228	K	90.2	Very high	94.1	Very high	150 Å²	150	54.1 Å²	54.1	65%	0.652	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-63.6	117.7	-177.9	-165.2	-141.4	166.8	-166.6	0	111.2
229	V	92.6	Very high	94.1	Very high	8 Å²	8	50.9 Å²	50.9	5%	0.048	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-69.3	139.3	172	-174.6	0	0	0	0	110	P227 E282 I286 M306	P227-V229 PolarHBondContact O-N 3.49Å; P227-V229 VanDerWaalsContact O-N 3.09Å; V229-E282 WeakPolarHBondContact CA-OE2 3.3Å; V229-E282 HydrophobicContact CG1-CB 4.13Å; V229-I286 HydrophobicContact CG1-CD1 4.41Å; V229-I286 HydrophobicContact CG2-CD1 3.5Å; V229-I286 HydrophobicContact CG2-CG1 3.5Å; V229-I286 VanDerWaalsContact CG2-CG1 3.5Å; V229-M306 HydrophobicContact CG1-CE 3.91Å
230	N	94.1	Very high	94.2	Very high	19 Å²	19	52.1 Å²	52.1	10%	0.102	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-82.9	162.9	171.8	-63.6	-62.3	0	0	0	110.9	N236 Q237 E240 E282 K285	N230-N236 HydrophobicContact CB-CB 4.42Å; N230-N236 WeakPolarHBondContact OD1-CB 3.46Å; N230-Q237 HydrophobicContact CB-CB 3.81Å; N230-E240 PolarHBondContact ND2-OE2 3.11Å; N230-E282 WeakPolarHBondContact CB-OE1 3.49Å; N230-E282 PolarHBondContact N-OE2 3.4Å; N230-E282 PolarHBondContact ND2-OE1 3.44Å; N230-K285 PolarHBondContact ND2-NZ 3.33Å
231	H	95	Very high	94.4	Very high	28 Å²	28	48.4 Å²	48.4	13%	0.13	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-73.7	134	175.1	-165.8	97.8	0	0	0	109.8	G233 S234 H309 P339 D340	H231-G233 PolarHBondContact O-N 2.99Å; H231-S234 WeakPolarHBondContact O-CB 3.35Å; H231-S234 PolarHBondContact O-N 3.08Å; H231-S234 VanDerWaalsContact O-N 3.12Å; H231-S234 PolarHBondContact O-OG 3.1Å; H231-H309 AromaticContact CD2-NE2 3.79Å; H231-H309 AromaticContact CE1-NE2 3.85Å; H231-H309 AromaticContact NE2-CE1 3.74Å; H231-H309 AromaticContact NE2-NE2 3.08Å; H231-H309 PolarHBondContact NE2-NE2 3.49Å; H231-P339 HydrophobicContact CB-CB 3.46Å; H231-P339 VanDerWaalsContact CB-CB 3.46Å; H231-P339 HydrophobicContact CB-CG 4.05Å; H231-D340 PolarHBondContact ND1-O 3.48Å
232	P	95.6	Very high	94.5	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.032	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	137.6	-178.3	-26.3	36.2	0	0	0	112.3	S234 F279 M306 V310 W342	P232-S234 PolarHBondContact O-N 3.44Å; P232-S234 VanDerWaalsContact O-N 3.08Å; P232-F279 HydrophobicContact CB-CD1 4.31Å; P232-F279 HydrophobicContact CB-CE1 3.91Å; P232-F279 HydrophobicContact CB-CZ 4.5Å; P232-M306 HydrophobicContact CB-CB 3.98Å; P232-M306 HydrophobicContact CB-CG 4.22Å; P232-M306 HydrophobicContact CG-CB 3.73Å; P232-M306 HydrophobicContact CG-CE 4.44Å; P232-M306 HydrophobicContact CG-CG 3.45Å; P232-M306 VanDerWaalsContact CG-CG 3.45Å; P232-M306 HydrophobicContact CG-SD 3.89Å; P232-V310 HydrophobicContact CB-CG2 3.68Å; P232-W342 HydrophobicContact CG-CD2 3.91Å; P232-W342 HydrophobicContact CG-CE3 3.72Å; P232-W342 HydrophobicContact CG-CH2 4.1Å; P232-W342 HydrophobicContact CG-CZ2 4.27Å; P232-W342 HydrophobicContact CG-CZ3 3.83Å
233	G	94.7	Very high	94.6	Very high	23 Å²	23	43.5 Å²	43.5	24%	0.237	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	-2.2	-178.2	0	0	0	0	0	115.5	H231 F336	H231-G233 PolarHBondContact O-N 2.99Å; G233-F336 WeakPolarHBondContact O-CD2 3.32Å; G233-F336 WeakPolarHBondContact O-CE2 3.5Å
234	S	96	Very high	94.7	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.007	25%	0.254	C	S	.	.	S	Bend	trans	-75.8	160.9	-178.6	72.4	0	0	0	0	113.4	H231 P232 N236 Q237 L238	H231-S234 WeakPolarHBondContact O-CB 3.35Å; H231-S234 PolarHBondContact O-N 3.08Å; H231-S234 VanDerWaalsContact O-N 3.12Å; H231-S234 PolarHBondContact O-OG 3.1Å; P232-S234 PolarHBondContact O-N 3.44Å; P232-S234 VanDerWaalsContact O-N 3.08Å; S234-N236 PolarHBondContact O-N 3.43Å; S234-N236 VanDerWaalsContact O-N 3.12Å; S234-Q237 PolarHBondContact O-N 3.27Å; S234-Q237 VanDerWaalsContact O-N 3.13Å; S234-L238 PolarHBondContact O-N 3.28Å
235	Q	95.6	Very high	94.8	Very high	58 Å²	58	49.7 Å²	49.7	27%	0.271	26%	0.262	S	S	.	.	H	α-helix	trans	-56.8	-33.4	-177.4	-168.9	176	37.7	0	0	113.3	K239 F253 F336 L337	Q235-K239 HydrophobicContact CG-CD 4.08Å; Q235-K239 HydrophobicContact CG-CG 4.48Å; Q235-K239 VanDerWaalsContact O-CB 3.27Å; Q235-K239 WeakPolarHBondContact O-CB 3.27Å; Q235-K239 VanDerWaalsContact O-CG 3.29Å; Q235-K239 WeakPolarHBondContact O-CG 3.36Å; Q235-K239 PolarHBondContact O-N 2.99Å; Q235-F253 HydrophobicContact CG-CE1 4.47Å; Q235-F336 HydrophobicContact CB-CD1 4Å; Q235-F336 HydrophobicContact CB-CD2 4.5Å; Q235-F336 HydrophobicContact CB-CE1 3.58Å; Q235-F336 HydrophobicContact CB-CE2 4.12Å; Q235-F336 HydrophobicContact CB-CG 4.44Å; Q235-F336 HydrophobicContact CB-CZ 3.64Å; Q235-F336 VanDerWaalsContact CB-O 3.32Å; Q235-F336 WeakPolarHBondContact CB-O 3.41Å; Q235-F336 HydrophobicContact CG-CE1 3.79Å; Q235-F336 HydrophobicContact CG-CZ 3.91Å; Q235-F336 PolarHBondContact N-O 3.44Å; Q235-L337 VanDerWaalsContact OE1-CD2 3.31Å
236	N	95.3	Very high	94.8	Very high	78 Å²	78	45.3 Å²	45.3	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-70.6	-46	179.6	-61.9	-33.5	0	0	0	111.2	N230 S234 K239 E240	N230-N236 HydrophobicContact CB-CB 4.42Å; N230-N236 WeakPolarHBondContact OD1-CB 3.46Å; S234-N236 PolarHBondContact O-N 3.43Å; S234-N236 VanDerWaalsContact O-N 3.12Å; N236-K239 PolarHBondContact O-N 2.82Å; N236-E240 WeakPolarHBondContact O-CB 3.27Å; N236-E240 PolarHBondContact O-N 2.9Å
237	Q	96.1	Very high	95	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-46.7	177.9	-175.4	-104.3	-39	0	0	111.3	N230 S234 K239 E240 V241 L278 E282	N230-Q237 HydrophobicContact CB-CB 3.81Å; S234-Q237 PolarHBondContact O-N 3.27Å; S234-Q237 VanDerWaalsContact O-N 3.13Å; Q237-K239 PolarHBondContact O-N 2.95Å; Q237-E240 PolarHBondContact O-N 3.1Å; Q237-V241 WeakPolarHBondContact O-CG2 3.34Å; Q237-V241 PolarHBondContact O-N 2.65Å; Q237-L278 PolarHBondContact NE2-O 3.29Å; Q237-E282 HydrophobicContact CG-CG 3.56Å; Q237-E282 WeakPolarHBondContact CG-OE1 3.35Å
238	L	96.7	Very high	95.2	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-33.6	178.7	-55.9	-168.8	0	0	0	113	S234 E240 W242 F253 F258 L278 F327 F336	S234-L238 PolarHBondContact O-N 3.28Å; L238-E240 VanDerWaalsContact C-N 3.33Å; L238-W242 VanDerWaalsContact O-CB 3.28Å; L238-W242 WeakPolarHBondContact O-CB 3.28Å; L238-W242 PolarHBondContact O-N 3.27Å; L238-W242 VanDerWaalsContact O-N 3.08Å; L238-F253 HydrophobicContact CB-CE2 3.79Å; L238-F253 HydrophobicContact CB-CZ 3.65Å; L238-F253 HydrophobicContact CD1-CZ 4.38Å; L238-F258 HydrophobicContact CB-CE1 4.37Å; L238-F258 HydrophobicContact CB-CE2 4.12Å; L238-F258 HydrophobicContact CB-CZ 4.05Å; L238-F258 HydrophobicContact CD1-CD1 4.37Å; L238-F258 HydrophobicContact CD1-CE1 4.18Å; L238-F258 HydrophobicContact CD2-CE1 3.8Å; L238-F258 HydrophobicContact CD2-CZ 3.72Å; L238-F258 HydrophobicContact CG-CE1 4.34Å; L238-F258 HydrophobicContact CG-CZ 4.34Å; L238-F258 VanDerWaalsContact O-CE2 3.24Å; L238-F258 WeakPolarHBondContact O-CE2 3.3Å; L238-L278 HydrophobicContact CD2-CD1 4.05Å; L238-F327 HydrophobicContact CD1-CE2 3.78Å; L238-F327 HydrophobicContact CD1-CZ 3.63Å; L238-F336 HydrophobicContact CD1-CE2 3.89Å; L238-F336 HydrophobicContact CD1-CZ 4.45Å
239	K	96.4	Very high	95.4	Very high	41 Å²	41	42.8 Å²	42.8	18%	0.178	24%	0.244	C	C	.	.	H	α-helix	trans	-65.9	-34.9	171.3	-85.3	172.4	170.3	-89	0	112.4	Q235 N236 Q237 W242 E243 P250 F253	Q235-K239 HydrophobicContact CG-CD 4.08Å; Q235-K239 HydrophobicContact CG-CG 4.48Å; Q235-K239 VanDerWaalsContact O-CB 3.27Å; Q235-K239 WeakPolarHBondContact O-CB 3.27Å; Q235-K239 VanDerWaalsContact O-CG 3.29Å; Q235-K239 WeakPolarHBondContact O-CG 3.36Å; Q235-K239 PolarHBondContact O-N 2.99Å; N236-K239 PolarHBondContact O-N 2.82Å; Q237-K239 PolarHBondContact O-N 2.95Å; K239-W242 PolarHBondContact O-N 3.35Å; K239-E243 PolarHBondContact O-N 3.38Å; K239-P250 PolarHBondContact NZ-O 3.16Å; K239-F253 HydrophobicContact CG-CB 4.02Å; K239-F253 HydrophobicContact CG-CD1 4.17Å; K239-F253 HydrophobicContact CG-CD2 3.91Å; K239-F253 HydrophobicContact CG-CE2 4.43Å; K239-F253 HydrophobicContact CG-CG 3.77Å
240	E	95.7	Very high	95.5	Very high	45 Å²	45	43.8 Å²	43.8	21%	0.21	25%	0.25	C	S	.	.	H	α-helix	trans	-71.7	-42.5	179.8	-158.7	-176.7	109.7	0	0	111.5	N230 N236 Q237 L238 W242 E243 E244 K285	N230-E240 PolarHBondContact ND2-OE2 3.11Å; N236-E240 WeakPolarHBondContact O-CB 3.27Å; N236-E240 PolarHBondContact O-N 2.9Å; Q237-E240 PolarHBondContact O-N 3.1Å; L238-E240 VanDerWaalsContact C-N 3.33Å; E240-W242 VanDerWaalsContact C-N 3.31Å; E240-W242 PolarHBondContact O-N 2.76Å; E240-E243 PolarHBondContact O-N 3.49Å; E240-E244 PolarHBondContact O-N 3.01Å; E240-K285 WeakPolarHBondContact OE1-CE 3.48Å; E240-K285 IonicContact OE1-NZ 2.77Å; E240-K285 PolarHBondContact OE1-NZ 3.19Å; E240-K285 IonicContact OE2-NZ 3.83Å; E240-K285 PolarHBondContact OE2-NZ 3Å
241	V	96.6	Very high	95.5	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.03	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-43.8	170.5	176.1	0	0	0	0	110.9	Q237 E243 E244 A245 D246 F258 H262 L278 K281	Q237-V241 WeakPolarHBondContact O-CG2 3.34Å; Q237-V241 PolarHBondContact O-N 2.65Å; V241-E243 VanDerWaalsContact C-N 3.32Å; V241-E243 PolarHBondContact O-N 3.08Å; V241-E244 PolarHBondContact O-N 3.45Å; V241-A245 HydrophobicContact CG1-CB 4.08Å; V241-A245 WeakPolarHBondContact O-CA 3.16Å; V241-A245 VanDerWaalsContact O-CB 3.25Å; V241-A245 WeakPolarHBondContact O-CB 3.43Å; V241-A245 PolarHBondContact O-N 3.4Å; V241-D246 PolarHBondContact O-N 2.98Å; V241-F258 HydrophobicContact CB-CE2 4.1Å; V241-F258 HydrophobicContact CB-CZ 4.31Å; V241-F258 HydrophobicContact CG1-CE2 4.03Å; V241-F258 HydrophobicContact CG1-CZ 4.13Å; V241-H262 VanDerWaalsContact CG1-NE2 3.31Å; V241-H262 WeakPolarHBondContact CG1-NE2 3.42Å; V241-L278 WeakPolarHBondContact CG2-O 3.45Å; V241-K281 HydrophobicContact CG2-CB 4.38Å; V241-K281 HydrophobicContact CG2-CG 4.49Å
242	W	97.3	Very high	95.5	Very high	11 Å²	11	55.4 Å²	55.4	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-63	-31.4	176.1	177.7	-91.7	0	0	0	113.7	L238 K239 E240 D246 G247 L248 D249 F253 T257 F258 L261	L238-W242 VanDerWaalsContact O-CB 3.28Å; L238-W242 WeakPolarHBondContact O-CB 3.28Å; L238-W242 PolarHBondContact O-N 3.27Å; L238-W242 VanDerWaalsContact O-N 3.08Å; K239-W242 PolarHBondContact O-N 3.35Å; E240-W242 VanDerWaalsContact C-N 3.31Å; E240-W242 PolarHBondContact O-N 2.76Å; W242-D246 WeakPolarHBondContact O-CB 3.29Å; W242-G247 PolarHBondContact O-N 3.37Å; W242-L248 HydrophobicContact CD2-CB 3.88Å; W242-L248 HydrophobicContact CD2-CD1 3.81Å; W242-L248 HydrophobicContact CD2-CG 4.47Å; W242-L248 HydrophobicContact CE3-CD1 3.67Å; W242-L248 HydrophobicContact CG-CB 4.07Å; W242-L248 HydrophobicContact CH2-CD1 3.68Å; W242-L248 HydrophobicContact CZ2-CB 4.11Å; W242-L248 HydrophobicContact CZ2-CD1 3.78Å; W242-L248 HydrophobicContact CZ3-CD1 3.6Å; W242-L248 PolarHBondContact O-N 2.63Å; W242-D249 PolarHBondContact NE1-O 2.66Å; W242-F253 HydrophobicContact CB-CD2 4Å; W242-F253 HydrophobicContact CB-CE2 4.4Å; W242-F253 HydrophobicContact CD2-CD2 4.04Å; W242-F253 AromaticContact CG-CD2 3.85Å; W242-F253 HydrophobicContact CG-CD2 3.85Å; W242-T257 HydrophobicContact CH2-CG2 3.75Å; W242-T257 HydrophobicContact CZ3-CG2 4.04Å; W242-F258 HydrophobicContact CB-CD2 4.19Å; W242-F258 HydrophobicContact CB-CE2 4.37Å; W242-F258 HydrophobicContact CE3-CB 4.2Å; W242-F258 AromaticContact CE3-CD2 3.93Å; W242-F258 HydrophobicContact CE3-CD2 3.93Å; W242-F258 HydrophobicContact CZ3-CB 4.23Å; W242-L261 HydrophobicContact CZ3-CD2 4.3Å
243	E	96.7	Very high	95.6	Very high	113 Å²	113	56.3 Å²	56.3	53%	0.528	31%	0.312	S	S	.	.	H	α-helix	trans	-80.1	-48.4	174.1	-164.7	172	177.6	0	0	112.3	K239 E240 V241 G247 P250	K239-E243 PolarHBondContact O-N 3.38Å; E240-E243 PolarHBondContact O-N 3.49Å; V241-E243 VanDerWaalsContact C-N 3.32Å; V241-E243 PolarHBondContact O-N 3.08Å; E243-G247 VanDerWaalsContact O-CA 3.3Å; E243-G247 WeakPolarHBondContact O-CA 3.44Å; E243-G247 PolarHBondContact O-N 3.43Å; E243-P250 HydrophobicContact CB-CG 4.02Å; E243-P250 HydrophobicContact CG-CG 3.96Å; E243-P250 WeakPolarHBondContact OE2-CG 3.49Å
244	E	94.9	Very high	95.7	Very high	122 Å²	122	58.4 Å²	58.4	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-87.7	-37	-169.8	-67.3	-149	171	0	0	114.8	E240 V241 K281	E240-E244 PolarHBondContact O-N 3.01Å; V241-E244 PolarHBondContact O-N 3.45Å; E244-K281 HydrophobicContact CB-CD 4.11Å; E244-K281 WeakPolarHBondContact OE2-CD 3.48Å; E244-K281 IonicContact OE2-NZ 2.65Å
245	A	93.5	Very high	95.7	Very high	64 Å²	64	59.6 Å²	59.6	53%	0.529	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-49.9	-179.6	0	0	0	0	0	111.5	V241	V241-A245 HydrophobicContact CG1-CB 4.08Å; V241-A245 WeakPolarHBondContact O-CA 3.16Å; V241-A245 VanDerWaalsContact O-CB 3.25Å; V241-A245 WeakPolarHBondContact O-CB 3.43Å; V241-A245 PolarHBondContact O-N 3.4Å
246	D	94.4	Very high	95.8	Very high	49 Å²	49	61.7 Å²	61.7	26%	0.262	33%	0.333	S	S	.	.	S	Bend	trans	-82.1	-25.5	-178.1	-59.5	-41.9	0	0	0	113.3	V241 W242 L248 L261 H262	V241-D246 PolarHBondContact O-N 2.98Å; W242-D246 WeakPolarHBondContact O-CB 3.29Å; D246-L248 HydrophobicContact CB-CB 4.41Å; D246-L248 HydrophobicContact CB-CD1 3.73Å; D246-L248 HydrophobicContact CB-CG 3.77Å; D246-L261 HydrophobicContact CB-CD2 4.02Å; D246-L261 WeakPolarHBondContact OD1-CD2 3.43Å; D246-L261 WeakPolarHBondContact OD2-CD2 3.49Å; D246-H262 IonicContact OD1-CE1 2.74Å; D246-H262 IonicContact OD2-CE1 3.06Å; D246-H262 PolarHBondContact OD2-CE1 3.03Å; D246-H262 VanDerWaalsContact OD2-CE1 3.29Å
247	G	95.2	Very high	95.9	Very high	63 Å²	63	61.4 Å²	61.4	65%	0.649	34%	0.335	S	S	*	.			trans	72.3	31.1	-175.7	0	0	0	0	0	113.8	W242 E243	W242-G247 PolarHBondContact O-N 3.37Å; E243-G247 VanDerWaalsContact O-CA 3.3Å; E243-G247 WeakPolarHBondContact O-CA 3.44Å; E243-G247 PolarHBondContact O-N 3.43Å
248	L	96.5	Very high	96	Very high	70 Å²	70	61.4 Å²	61.4	37%	0.366	34%	0.335	S	S	.	.			trans	-104.3	158.3	-176.2	-61.1	175.2	0	0	0	111.5	W242 D246 P250 L261	W242-L248 HydrophobicContact CD2-CB 3.88Å; W242-L248 HydrophobicContact CD2-CD1 3.81Å; W242-L248 HydrophobicContact CD2-CG 4.47Å; W242-L248 HydrophobicContact CE3-CD1 3.67Å; W242-L248 HydrophobicContact CG-CB 4.07Å; W242-L248 HydrophobicContact CH2-CD1 3.68Å; W242-L248 HydrophobicContact CZ2-CB 4.11Å; W242-L248 HydrophobicContact CZ2-CD1 3.78Å; W242-L248 HydrophobicContact CZ3-CD1 3.6Å; W242-L248 PolarHBondContact O-N 2.63Å; D246-L248 HydrophobicContact CB-CB 4.41Å; D246-L248 HydrophobicContact CB-CD1 3.73Å; D246-L248 HydrophobicContact CB-CG 3.77Å; L248-P250 WeakPolarHBondContact O-CD 3.44Å; L248-L261 HydrophobicContact CD1-CD2 3.97Å
249	D	95.6	Very high	96	Very high	93 Å²	93	61.4 Å²	61.4	50%	0.497	34%	0.335	S	S	.	.			trans	-73.3	124.8	-177.5	-167.3	-46.8	0	0	0	110.3	W242 E251 D252	W242-D249 PolarHBondContact NE1-O 2.66Å; D249-E251 PolarHBondContact O-N 2.9Å; D249-E251 VanDerWaalsContact O-N 3.15Å; D249-E251 WeakPolarHBondContact OD1-CB 3.48Å; D249-E251 PolarHBondContact OD1-N 3.01Å; D249-D252 HydrophobicContact CB-CB 4.44Å; D249-D252 PolarHBondContact O-N 3.2Å; D249-D252 VanDerWaalsContact O-N 3.08Å
250	P	93.8	Very high	96	Very high	29 Å²	29	63.9 Å²	63.9	19%	0.188	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-54.9	-30.1	177.4	-26.6	33.5	0	0	0	114.1	K239 E243 L248 D252 F253	K239-P250 PolarHBondContact NZ-O 3.16Å; E243-P250 HydrophobicContact CB-CG 4.02Å; E243-P250 HydrophobicContact CG-CG 3.96Å; E243-P250 WeakPolarHBondContact OE2-CG 3.49Å; L248-P250 WeakPolarHBondContact O-CD 3.44Å; P250-D252 VanDerWaalsContact C-N 3.33Å; P250-F253 VanDerWaalsContact O-CB 3.27Å; P250-F253 WeakPolarHBondContact O-CB 3.44Å; P250-F253 PolarHBondContact O-N 2.82Å
251	E	93.9	Very high	96.1	Very high	162 Å²	162	65.6 Å²	65.6	76%	0.757	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-75.1	-23.7	-178.8	-65.5	-67.2	100.7	0	0	112.6	D249 F253	D249-E251 PolarHBondContact O-N 2.9Å; D249-E251 VanDerWaalsContact O-N 3.15Å; D249-E251 WeakPolarHBondContact OD1-CB 3.48Å; D249-E251 PolarHBondContact OD1-N 3.01Å; E251-F253 VanDerWaalsContact C-N 3.33Å
252	D	95.8	Very high	96.1	Very high	130 Å²	130	66.6 Å²	66.6	70%	0.695	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-89.3	8.7	175	-83.3	-23.9	0	0	0	112.9	D249 P250 D254	D249-D252 HydrophobicContact CB-CB 4.44Å; D249-D252 PolarHBondContact O-N 3.2Å; D249-D252 VanDerWaalsContact O-N 3.08Å; P250-D252 VanDerWaalsContact C-N 3.33Å; D252-D254 PolarHBondContact O-N 2.75Å; D252-D254 VanDerWaalsContact O-N 3.14Å
253	F	97	Very high	96	Very high	24 Å²	24	67.2 Å²	67.2	11%	0.105	37%	0.369	C	S	.	.			trans	-57.1	113.3	-179.9	178.2	-93.1	0	0	0	113.1	Q235 L238 K239 W242 P250 E251 P255 F258 F336	Q235-F253 HydrophobicContact CG-CE1 4.47Å; L238-F253 HydrophobicContact CB-CE2 3.79Å; L238-F253 HydrophobicContact CB-CZ 3.65Å; L238-F253 HydrophobicContact CD1-CZ 4.38Å; K239-F253 HydrophobicContact CG-CB 4.02Å; K239-F253 HydrophobicContact CG-CD1 4.17Å; K239-F253 HydrophobicContact CG-CD2 3.91Å; K239-F253 HydrophobicContact CG-CE2 4.43Å; K239-F253 HydrophobicContact CG-CG 3.77Å; W242-F253 HydrophobicContact CB-CD2 4Å; W242-F253 HydrophobicContact CB-CE2 4.4Å; W242-F253 HydrophobicContact CD2-CD2 4.04Å; W242-F253 AromaticContact CG-CD2 3.85Å; W242-F253 HydrophobicContact CG-CD2 3.85Å; P250-F253 VanDerWaalsContact O-CB 3.27Å; P250-F253 WeakPolarHBondContact O-CB 3.44Å; P250-F253 PolarHBondContact O-N 2.82Å; E251-F253 VanDerWaalsContact C-N 3.33Å; F253-P255 HydrophobicContact CE1-CG 3.89Å; F253-F258 HydrophobicContact CD2-CD2 4.49Å; F253-F258 HydrophobicContact CE2-CB 4.12Å; F253-F258 AromaticContact CE2-CD2 3.7Å; F253-F258 HydrophobicContact CE2-CD2 3.7Å; F253-F258 HydrophobicContact CE2-CE2 4.41Å; F253-F258 HydrophobicContact CE2-CG 4.01Å; F253-F258 HydrophobicContact CZ-CB 4.49Å; F253-F258 HydrophobicContact CZ-CG 4.48Å; F253-F336 HydrophobicContact CE1-CZ 4.33Å
254	D	96.6	Very high	95.8	Very high	67 Å²	67	67.3 Å²	67.3	36%	0.358	38%	0.377	S	S	.	.			trans	-115.4	117.9	171.9	168	52.5	0	0	0	110.1	D252 K256 T257 F258	D252-D254 PolarHBondContact O-N 2.75Å; D252-D254 VanDerWaalsContact O-N 3.14Å; D254-K256 PolarHBondContact O-N 3.27Å; D254-K256 VanDerWaalsContact O-N 3.15Å; D254-T257 PolarHBondContact O-N 2.84Å; D254-T257 WeakPolarHBondContact OD2-CB 3.33Å; D254-T257 PolarHBondContact OD2-N 2.92Å; D254-T257 PolarHBondContact OD2-OG1 3.37Å; D254-F258 PolarHBondContact O-N 3.41Å
255	P	96.7	Very high	95.4	Very high	26 Å²	26	64.4 Å²	64.4	17%	0.169	37%	0.365	C	S	.	.	H	α-helix	trans	-54.2	-36.3	-179.7	-27	33.3	0	0	0	113.8	F253 F258 F259 F327 L328 T331	F253-P255 HydrophobicContact CE1-CG 3.89Å; P255-F258 PolarHBondContact O-N 3.31Å; P255-F259 WeakPolarHBondContact O-CB 3.39Å; P255-F259 PolarHBondContact O-N 2.89Å; P255-F327 HydrophobicContact CB-CE1 3.79Å; P255-F327 VanDerWaalsContact O-CE1 3.31Å; P255-F327 WeakPolarHBondContact O-CE1 3.34Å; P255-L328 HydrophobicContact CB-CD2 4.08Å; P255-T331 HydrophobicContact CB-CG2 3.87Å; P255-T331 HydrophobicContact CG-CG2 4.17Å
256	K	97.3	Very high	95.4	Very high	101 Å²	101	64.2 Å²	64.2	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-67.7	-42.9	179.2	177.2	161.1	179.9	145.4	0	111.5	D254 F259 N260 L324 L328	D254-K256 PolarHBondContact O-N 3.27Å; D254-K256 VanDerWaalsContact O-N 3.15Å; K256-F259 PolarHBondContact O-N 3.08Å; K256-N260 PolarHBondContact O-N 3.5Å; K256-N260 VanDerWaalsContact O-N 3.1Å; K256-N260 PolarHBondContact O-ND2 2.98Å; K256-L324 HydrophobicContact CD-CD2 4.29Å; K256-L324 HydrophobicContact CG-CD1 4.27Å; K256-L324 HydrophobicContact CG-CD2 4.49Å; K256-L328 HydrophobicContact CB-CD2 4.3Å
257	T	97.2	Very high	95	Very high	73 Å²	73	65.6 Å²	65.6	45%	0.448	38%	0.377	S	S	.	.	H	α-helix	trans	-66.7	-40.3	177.3	-55	0	0	0	0	111	W242 D254 F259 N260 L261	W242-T257 HydrophobicContact CH2-CG2 3.75Å; W242-T257 HydrophobicContact CZ3-CG2 4.04Å; D254-T257 PolarHBondContact O-N 2.84Å; D254-T257 WeakPolarHBondContact OD2-CB 3.33Å; D254-T257 PolarHBondContact OD2-N 2.92Å; D254-T257 PolarHBondContact OD2-OG1 3.37Å; T257-F259 VanDerWaalsContact C-N 3.35Å; T257-F259 PolarHBondContact O-N 3.41Å; T257-N260 PolarHBondContact O-N 3.28Å; T257-L261 WeakPolarHBondContact O-CB 3.21Å; T257-L261 PolarHBondContact O-N 3.1Å
258	F	97.9	Very high	94.9	Very high	0 Å²	0	64 Å²	64	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-55.5	-47.7	171.9	-177.6	-85.1	0	0	0	112	L238 V241 W242 F253 D254 P255 L261 H262 F270 L278 F327	L238-F258 HydrophobicContact CB-CE1 4.37Å; L238-F258 HydrophobicContact CB-CE2 4.12Å; L238-F258 HydrophobicContact CB-CZ 4.05Å; L238-F258 HydrophobicContact CD1-CD1 4.37Å; L238-F258 HydrophobicContact CD1-CE1 4.18Å; L238-F258 HydrophobicContact CD2-CE1 3.8Å; L238-F258 HydrophobicContact CD2-CZ 3.72Å; L238-F258 HydrophobicContact CG-CE1 4.34Å; L238-F258 HydrophobicContact CG-CZ 4.34Å; L238-F258 VanDerWaalsContact O-CE2 3.24Å; L238-F258 WeakPolarHBondContact O-CE2 3.3Å; V241-F258 HydrophobicContact CB-CE2 4.1Å; V241-F258 HydrophobicContact CB-CZ 4.31Å; V241-F258 HydrophobicContact CG1-CE2 4.03Å; V241-F258 HydrophobicContact CG1-CZ 4.13Å; W242-F258 HydrophobicContact CB-CD2 4.19Å; W242-F258 HydrophobicContact CB-CE2 4.37Å; W242-F258 HydrophobicContact CE3-CB 4.2Å; W242-F258 AromaticContact CE3-CD2 3.93Å; W242-F258 HydrophobicContact CE3-CD2 3.93Å; W242-F258 HydrophobicContact CZ3-CB 4.23Å; F253-F258 HydrophobicContact CD2-CD2 4.49Å; F253-F258 HydrophobicContact CE2-CB 4.12Å; F253-F258 AromaticContact CE2-CD2 3.7Å; F253-F258 HydrophobicContact CE2-CD2 3.7Å; F253-F258 HydrophobicContact CE2-CE2 4.41Å; F253-F258 HydrophobicContact CE2-CG 4.01Å; F253-F258 HydrophobicContact CZ-CB 4.49Å; F253-F258 HydrophobicContact CZ-CG 4.48Å; D254-F258 PolarHBondContact O-N 3.41Å; P255-F258 PolarHBondContact O-N 3.31Å; F258-L261 PolarHBondContact O-N 2.98Å; F258-H262 AromaticContact CD1-ND1 3.95Å; F258-H262 AromaticContact CD2-CE1 3.79Å; F258-H262 AromaticContact CD2-ND1 3.93Å; F258-H262 AromaticContact CE1-ND1 3.72Å; F258-H262 AromaticContact CE2-CE1 3.35Å; F258-H262 WeakPolarHBondContact CE2-CE1 3.24Å; F258-H262 AromaticContact CE2-ND1 3.73Å; F258-H262 AromaticContact CZ-CE1 3.53Å; F258-H262 AromaticContact CZ-ND1 3.61Å; F258-H262 PolarHBondContact O-N 3.29Å; F258-H262 PolarHBondContact O-ND1 3.49Å; F258-F270 HydrophobicContact CD1-CZ 4.45Å; F258-F270 HydrophobicContact CE1-CZ 4.36Å; F258-L278 HydrophobicContact CE1-CD1 4.04Å; F258-L278 HydrophobicContact CE1-CD2 4.29Å; F258-L278 HydrophobicContact CZ-CD1 4.31Å; F258-L278 HydrophobicContact CZ-CD2 4.05Å; F258-F327 HydrophobicContact CD1-CZ 4.08Å
259	F	97.9	Very high	94.8	Very high	2 Å²	2	64 Å²	64	1%	0.009	36%	0.358	C	S	.	.	H	α-helix	trans	-58.8	-50.6	177.5	-173.4	-78.5	0	0	0	111.9	P255 K256 T257 L261 H262 D263 G268 F270 L324 F327	P255-F259 WeakPolarHBondContact O-CB 3.39Å; P255-F259 PolarHBondContact O-N 2.89Å; K256-F259 PolarHBondContact O-N 3.08Å; T257-F259 VanDerWaalsContact C-N 3.35Å; T257-F259 PolarHBondContact O-N 3.41Å; F259-L261 PolarHBondContact O-N 2.86Å; F259-H262 PolarHBondContact O-N 3.13Å; F259-D263 HydrophobicContact CE1-CB 4.43Å; F259-D263 WeakPolarHBondContact O-CB 3.33Å; F259-D263 PolarHBondContact O-N 3.31Å; F259-G268 WeakPolarHBondContact CE1-O 3.26Å; F259-G268 WeakPolarHBondContact CZ-O 3.31Å; F259-F270 HydrophobicContact CB-CZ 4.24Å; F259-F270 HydrophobicContact CD2-CD1 4.2Å; F259-F270 HydrophobicContact CD2-CD2 4Å; F259-F270 AromaticContact CD2-CE1 3.89Å; F259-F270 HydrophobicContact CD2-CE1 3.89Å; F259-F270 AromaticContact CD2-CE2 3.71Å; F259-F270 HydrophobicContact CD2-CE2 3.71Å; F259-F270 HydrophobicContact CD2-CG 4.27Å; F259-F270 AromaticContact CD2-CZ 3.68Å; F259-F270 HydrophobicContact CD2-CZ 3.68Å; F259-F270 AromaticContact CE2-CD1 3.99Å; F259-F270 HydrophobicContact CE2-CD1 3.99Å; F259-F270 AromaticContact CE2-CD2 3.9Å; F259-F270 HydrophobicContact CE2-CD2 3.9Å; F259-F270 HydrophobicContact CE2-CE1 4.16Å; F259-F270 HydrophobicContact CE2-CE2 4.11Å; F259-F270 AromaticContact CE2-CG 3.88Å; F259-F270 HydrophobicContact CE2-CG 3.88Å; F259-F270 HydrophobicContact CE2-CZ 4.26Å; F259-F270 HydrophobicContact CG-CE1 4.09Å; F259-F270 HydrophobicContact CG-CZ 4.06Å; F259-F270 HydrophobicContact CZ-CD1 4.28Å; F259-F270 HydrophobicContact CZ-CG 4.43Å; F259-F270 WeakPolarHBondContact O-CE1 3.35Å; F259-L324 HydrophobicContact CB-CD1 3.81Å; F259-L324 HydrophobicContact CD1-CB 4.15Å; F259-L324 HydrophobicContact CD1-CD1 3.69Å; F259-L324 HydrophobicContact CD1-CG 4.4Å; F259-L324 HydrophobicContact CD2-CD1 4.08Å; F259-L324 HydrophobicContact CE1-CB 3.83Å; F259-L324 HydrophobicContact CE1-CD1 4.27Å; F259-L324 HydrophobicContact CE2-CB 4.32Å; F259-L324 HydrophobicContact CG-CD1 3.57Å; F259-L324 HydrophobicContact CZ-CB 3.91Å; F259-F327 HydrophobicContact CB-CD1 4.17Å; F259-F327 HydrophobicContact CB-CE1 4.18Å; F259-F327 HydrophobicContact CD2-CB 3.92Å; F259-F327 AromaticContact CD2-CD1 3.8Å; F259-F327 HydrophobicContact CD2-CD1 3.8Å; F259-F327 HydrophobicContact CD2-CD2 4.36Å; F259-F327 HydrophobicContact CD2-CE1 4.42Å; F259-F327 AromaticContact CD2-CG 3.77Å; F259-F327 HydrophobicContact CD2-CG 3.77Å; F259-F327 HydrophobicContact CE2-CB 4.07Å; F259-F327 HydrophobicContact CE2-CG 4.37Å; F259-F327 HydrophobicContact CG-CD1 4.42Å
260	N	96.5	Very high	94.8	Very high	92 Å²	92	59.6 Å²	59.6	49%	0.492	33%	0.334	S	S	.	.	H	α-helix	trans	-73	4.4	-177.7	-70.6	-116.7	0	0	0	113.4	K256 T257	K256-N260 PolarHBondContact O-N 3.5Å; K256-N260 VanDerWaalsContact O-N 3.1Å; K256-N260 PolarHBondContact O-ND2 2.98Å; T257-N260 PolarHBondContact O-N 3.28Å
261	L	96.5	Very high	94.6	Very high	82 Å²	82	58.6 Å²	58.6	43%	0.429	33%	0.327	S	S	.	.	H	α-helix	trans	-109	-26.6	176.5	-174.9	52.7	0	0	0	112.1	W242 D246 L248 T257 F258 F259	W242-L261 HydrophobicContact CZ3-CD2 4.3Å; D246-L261 HydrophobicContact CB-CD2 4.02Å; D246-L261 WeakPolarHBondContact OD1-CD2 3.43Å; D246-L261 WeakPolarHBondContact OD2-CD2 3.49Å; L248-L261 HydrophobicContact CD1-CD2 3.97Å; T257-L261 WeakPolarHBondContact O-CB 3.21Å; T257-L261 PolarHBondContact O-N 3.1Å; F258-L261 PolarHBondContact O-N 2.98Å; F259-L261 PolarHBondContact O-N 2.86Å
262	H	96	Very high	94.4	Very high	25 Å²	25	52.2 Å²	52.2	12%	0.116	30%	0.297	C	S	.	.	H	α-helix	trans	-103.5	-9.8	177.2	-65.1	85.1	0	0	0	113.8	V241 D246 F258 F259 T264 F270 L278	V241-H262 VanDerWaalsContact CG1-NE2 3.31Å; V241-H262 WeakPolarHBondContact CG1-NE2 3.42Å; D246-H262 IonicContact OD1-CE1 2.74Å; D246-H262 IonicContact OD2-CE1 3.06Å; D246-H262 PolarHBondContact OD2-CE1 3.03Å; D246-H262 VanDerWaalsContact OD2-CE1 3.29Å; F258-H262 AromaticContact CD1-ND1 3.95Å; F258-H262 AromaticContact CD2-CE1 3.79Å; F258-H262 AromaticContact CD2-ND1 3.93Å; F258-H262 AromaticContact CE1-ND1 3.72Å; F258-H262 AromaticContact CE2-CE1 3.35Å; F258-H262 WeakPolarHBondContact CE2-CE1 3.24Å; F258-H262 AromaticContact CE2-ND1 3.73Å; F258-H262 AromaticContact CZ-CE1 3.53Å; F258-H262 AromaticContact CZ-ND1 3.61Å; F258-H262 PolarHBondContact O-N 3.29Å; F258-H262 PolarHBondContact O-ND1 3.49Å; F259-H262 PolarHBondContact O-N 3.13Å; H262-T264 VanDerWaalsContact O-CG2 3.3Å; H262-T264 WeakPolarHBondContact O-CG2 3.5Å; H262-T264 PolarHBondContact O-N 3.48Å; H262-F270 HydrophobicContact CB-CE1 3.65Å; H262-F270 HydrophobicContact CB-CZ 3.85Å; H262-L278 HydrophobicContact CB-CD2 4.02Å; H262-L278 WeakPolarHBondContact CD2-CD2 3.47Å
263	D	95.9	Very high	94.1	Very high	25 Å²	25	50.3 Å²	50.3	13%	0.134	28%	0.284	C	S	.	.			trans	-66.4	85.4	158.1	173.2	2.8	0	0	0	106.8	F259 G266 D267 G268	F259-D263 HydrophobicContact CE1-CB 4.43Å; F259-D263 WeakPolarHBondContact O-CB 3.33Å; F259-D263 PolarHBondContact O-N 3.31Å; D263-G266 WeakPolarHBondContact OD1-CA 3.4Å; D263-G266 PolarHBondContact OD1-N 3.06Å; D263-D267 PolarHBondContact OD1-N 3.14Å; D263-G268 WeakPolarHBondContact OD2-CA 3.39Å; D263-G268 PolarHBondContact OD2-N 3.3Å; D263-G268 VanDerWaalsContact OD2-N 3.14Å
264	T	92	Very high	94	Very high	115 Å²	115	49.6 Å²	49.6	71%	0.706	28%	0.282	S	S	*	.			trans	-78.6	-30	-171.3	69.7	0	0	0	0	111.6	H262 E274	H262-T264 VanDerWaalsContact O-CG2 3.3Å; H262-T264 WeakPolarHBondContact O-CG2 3.5Å; H262-T264 PolarHBondContact O-N 3.48Å; T264-E274 WeakPolarHBondContact CA-OE1 3.39Å; T264-E274 WeakPolarHBondContact CB-OE1 3.38Å; T264-E274 HydrophobicContact CG2-CG 4.42Å; T264-E274 PolarHBondContact N-OE1 3.41Å; T264-E274 PolarHBondContact OG1-OE1 2.82Å
265	N	87	Confident	93.9	Very high	60 Å²	60	46.7 Å²	46.7	32%	0.321	27%	0.266	S	S	.	.	S	Bend	trans	-86.4	-29.6	-177.5	92.7	49.8	0	0	0	111.9	D267 E274	N265-D267 PolarHBondContact ND2-OD2 3.47Å; N265-D267 WeakPolarHBondContact OD1-CB 3.43Å; N265-D267 PolarHBondContact OD1-N 2.95Å; N265-D267 PolarHBondContact OD1-OD2 3.44Å; N265-D267 VanDerWaalsContact OD1-OD2 3.12Å; N265-E274 PolarHBondContact N-OE1 2.92Å
266	G	92.7	Very high	93.8	Very high	60 Å²	60	46.7 Å²	46.7	62%	0.619	26%	0.264	S	S	*	.	S	Bend	trans	91.9	19.2	175.9	0	0	0	0	0	115.7	D263	D263-G266 WeakPolarHBondContact OD1-CA 3.4Å; D263-G266 PolarHBondContact OD1-N 3.06Å
267	D	87.2	Confident	93.7	Very high	78 Å²	78	44.8 Å²	44.8	42%	0.417	27%	0.266	S	S	.	.	S	Bend	trans	-87	-16.6	-178.1	70.5	26.9	0	0	0	114.6	D263 N265 F269	D263-D267 PolarHBondContact OD1-N 3.14Å; N265-D267 PolarHBondContact ND2-OD2 3.47Å; N265-D267 WeakPolarHBondContact OD1-CB 3.43Å; N265-D267 PolarHBondContact OD1-N 2.95Å; N265-D267 PolarHBondContact OD1-OD2 3.44Å; N265-D267 VanDerWaalsContact OD1-OD2 3.12Å; D267-F269 WeakPolarHBondContact OD1-CB 3.34Å; D267-F269 WeakPolarHBondContact OD1-CD2 3.31Å; D267-F269 PolarHBondContact OD1-N 3.33Å
268	G	93.3	Very high	93.6	Very high	30 Å²	30	41.5 Å²	41.5	31%	0.309	25%	0.246	S	C	.	.	S	Bend	trans	96.3	9.3	178.8	0	0	0	0	0	115.8	F259 D263	F259-G268 WeakPolarHBondContact CE1-O 3.26Å; F259-G268 WeakPolarHBondContact CZ-O 3.31Å; D263-G268 WeakPolarHBondContact OD2-CA 3.39Å; D263-G268 PolarHBondContact OD2-N 3.3Å; D263-G268 VanDerWaalsContact OD2-N 3.14Å
269	F	94.2	Very high	93.5	Very high	70 Å²	70	41.6 Å²	41.6	31%	0.307	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	174.2	171.4	-61.2	-96.2	0	0	0	110.3	D267 L321 V322	D267-F269 WeakPolarHBondContact OD1-CB 3.34Å; D267-F269 WeakPolarHBondContact OD1-CD2 3.31Å; D267-F269 PolarHBondContact OD1-N 3.33Å; F269-L321 HydrophobicContact CB-CB 4.18Å; F269-L321 HydrophobicContact CB-CD1 4.49Å; F269-L321 HydrophobicContact CD1-CB 3.79Å; F269-L321 HydrophobicContact CD1-CD1 4.17Å; F269-L321 HydrophobicContact CG-CB 4.24Å; F269-L321 HydrophobicContact CG-CD1 4.18Å; F269-V322 CarbonylContact C-O 3.52Å; F269-V322 WeakPolarHBondContact CA-O 3.35Å
270	F	95	Very high	93.4	Very high	1 Å²	1	44.4 Å²	44.4	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.9	150.1	-69	-30	0	0	0	107.8	F258 F259 H262 E274 L275 L278 V322 F327	F258-F270 HydrophobicContact CD1-CZ 4.45Å; F258-F270 HydrophobicContact CE1-CZ 4.36Å; F259-F270 HydrophobicContact CB-CZ 4.24Å; F259-F270 HydrophobicContact CD2-CD1 4.2Å; F259-F270 HydrophobicContact CD2-CD2 4Å; F259-F270 AromaticContact CD2-CE1 3.89Å; F259-F270 HydrophobicContact CD2-CE1 3.89Å; F259-F270 AromaticContact CD2-CE2 3.71Å; F259-F270 HydrophobicContact CD2-CE2 3.71Å; F259-F270 HydrophobicContact CD2-CG 4.27Å; F259-F270 AromaticContact CD2-CZ 3.68Å; F259-F270 HydrophobicContact CD2-CZ 3.68Å; F259-F270 AromaticContact CE2-CD1 3.99Å; F259-F270 HydrophobicContact CE2-CD1 3.99Å; F259-F270 AromaticContact CE2-CD2 3.9Å; F259-F270 HydrophobicContact CE2-CD2 3.9Å; F259-F270 HydrophobicContact CE2-CE1 4.16Å; F259-F270 HydrophobicContact CE2-CE2 4.11Å; F259-F270 AromaticContact CE2-CG 3.88Å; F259-F270 HydrophobicContact CE2-CG 3.88Å; F259-F270 HydrophobicContact CE2-CZ 4.26Å; F259-F270 HydrophobicContact CG-CE1 4.09Å; F259-F270 HydrophobicContact CG-CZ 4.06Å; F259-F270 HydrophobicContact CZ-CD1 4.28Å; F259-F270 HydrophobicContact CZ-CG 4.43Å; F259-F270 WeakPolarHBondContact O-CE1 3.35Å; H262-F270 HydrophobicContact CB-CE1 3.65Å; H262-F270 HydrophobicContact CB-CZ 3.85Å; F270-E274 HydrophobicContact CB-CB 4.49Å; F270-L275 HydrophobicContact CB-CD2 4.11Å; F270-L275 HydrophobicContact CB-CG 4.18Å; F270-L275 HydrophobicContact CD2-CD2 3.62Å; F270-L275 HydrophobicContact CE2-CD2 4.35Å; F270-L275 HydrophobicContact CG-CD2 4.26Å; F270-L278 HydrophobicContact CE2-CD1 4.31Å; F270-V322 HydrophobicContact CB-CB 4.29Å; F270-V322 PolarHBondContact N-O 2.77Å; F270-V322 PolarHBondContact O-N 2.94Å; F270-F327 HydrophobicContact CE2-CD2 4.09Å; F270-F327 HydrophobicContact CE2-CE2 4.01Å
271	D	90.3	Very high	93.2	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.043	25%	0.252	C	S	.	.			trans	-84.1	179.8	163.7	81.9	20.9	0	0	0	112	V55 Q273 E274 L275 L321	V55-D271 HydrophobicContact CG1-CB 4.14Å; V55-D271 HydrophobicContact CG2-CB 4.27Å; V55-D271 WeakPolarHBondContact CG2-OD2 3.36Å; D271-Q273 VanDerWaalsContact C-N 3.35Å; D271-Q273 WeakPolarHBondContact OD1-CA 3.41Å; D271-Q273 WeakPolarHBondContact OD1-CB 3.32Å; D271-Q273 PolarHBondContact OD1-N 3.46Å; D271-E274 PolarHBondContact N-OE2 2.99Å; D271-E274 PolarHBondContact O-N 2.95Å; D271-E274 PolarHBondContact OD1-N 3.29Å; D271-L275 PolarHBondContact O-N 3.42Å; D271-L321 HydrophobicContact CB-CD2 3.86Å
272	E	89.7	Confident	93.1	Very high	27 Å²	27	38.8 Å²	38.8	13%	0.126	23%	0.232	C	C	.	.	H	α-helix	trans	-66.4	-33.9	179.9	-72.9	178.9	-163.3	0	0	113.7	L275 E276 R307 M311 R320	E272-L275 PolarHBondContact O-N 3.24Å; E272-E276 VanDerWaalsContact O-CB 3.25Å; E272-E276 WeakPolarHBondContact O-CB 3.5Å; E272-E276 WeakPolarHBondContact O-CG 3.38Å; E272-E276 PolarHBondContact O-N 2.89Å; E272-R307 HydrophobicContact CB-CG 4.34Å; E272-R307 HydrophobicContact CG-CG 4.22Å; E272-R307 IonicContact OE2-CZ 2.81Å; E272-R307 IonicContact OE2-NH1 2.87Å; E272-R307 PolarHBondContact OE2-NH1 2.89Å; E272-M311 HydrophobicContact CG-CE 3.46Å; E272-M311 VanDerWaalsContact CG-CE 3.46Å; E272-R320 IonicContact OE1-CZ 3.47Å; E272-R320 IonicContact OE1-NE 3.94Å; E272-R320 PolarHBondContact OE1-NE 3.06Å; E272-R320 IonicContact OE1-NH2 2.71Å; E272-R320 PolarHBondContact OE1-NH2 3.19Å; E272-R320 IonicContact OE2-CZ 3.86Å; E272-R320 IonicContact OE2-NH2 2.97Å; E272-R320 PolarHBondContact OE2-NH2 3.44Å
273	Q	90.2	Very high	93.1	Very high	90 Å²	90	37.7 Å²	37.7	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-71.9	-37	-180	-48.7	-171.3	5.8	0	0	110.1	D56 D271 E276 A277	D56-Q273 VanDerWaalsContact N-NE2 3.11Å; D56-Q273 PolarHBondContact O-NE2 2.89Å; D271-Q273 VanDerWaalsContact C-N 3.35Å; D271-Q273 WeakPolarHBondContact OD1-CA 3.41Å; D271-Q273 WeakPolarHBondContact OD1-CB 3.32Å; D271-Q273 PolarHBondContact OD1-N 3.46Å; Q273-E276 PolarHBondContact O-N 2.72Å; Q273-A277 WeakPolarHBondContact O-CB 3.46Å; Q273-A277 PolarHBondContact O-N 3.31Å
274	E	94.7	Very high	93.1	Very high	10 Å²	10	41.9 Å²	41.9	5%	0.047	25%	0.245	C	C	.	.	H	α-helix	trans	-68.1	-40.4	173.9	-67.4	178.7	144.9	0	0	111.9	T264 N265 F270 D271 L278	T264-E274 WeakPolarHBondContact CA-OE1 3.39Å; T264-E274 WeakPolarHBondContact CB-OE1 3.38Å; T264-E274 HydrophobicContact CG2-CG 4.42Å; T264-E274 PolarHBondContact N-OE1 3.41Å; T264-E274 PolarHBondContact OG1-OE1 2.82Å; N265-E274 PolarHBondContact N-OE1 2.92Å; F270-E274 HydrophobicContact CB-CB 4.49Å; D271-E274 PolarHBondContact N-OE2 2.99Å; D271-E274 PolarHBondContact O-N 2.95Å; D271-E274 PolarHBondContact OD1-N 3.29Å; E274-L278 WeakPolarHBondContact O-CG 3.46Å
275	L	94.4	Very high	93.2	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.026	22%	0.22	C	C	.	.	H	α-helix	trans	-63.9	-48.2	169.7	-73.4	-174.7	0	0	0	112.2	F270 D271 E272 A277 L278 F279 V310 M311 V322	F270-L275 HydrophobicContact CB-CD2 4.11Å; F270-L275 HydrophobicContact CB-CG 4.18Å; F270-L275 HydrophobicContact CD2-CD2 3.62Å; F270-L275 HydrophobicContact CE2-CD2 4.35Å; F270-L275 HydrophobicContact CG-CD2 4.26Å; D271-L275 PolarHBondContact O-N 3.42Å; E272-L275 PolarHBondContact O-N 3.24Å; L275-A277 PolarHBondContact O-N 2.73Å; L275-L278 HydrophobicContact CD2-CD1 4.26Å; L275-L278 WeakPolarHBondContact O-CB 3.43Å; L275-L278 PolarHBondContact O-N 3.37Å; L275-F279 HydrophobicContact CB-CE2 4.31Å; L275-F279 HydrophobicContact CB-CZ 4.35Å; L275-F279 WeakPolarHBondContact O-CD2 3.35Å; L275-F279 VanDerWaalsContact O-CE2 3.24Å; L275-F279 WeakPolarHBondContact O-CE2 3.42Å; L275-F279 WeakPolarHBondContact O-CZ 3.34Å; L275-V310 HydrophobicContact CD1-CG1 4.07Å; L275-V310 HydrophobicContact CD2-CG1 4.24Å; L275-M311 HydrophobicContact CD1-CE 3.73Å; L275-M311 HydrophobicContact CD1-CG 3.98Å; L275-M311 HydrophobicContact CD1-SD 3.72Å; L275-V322 HydrophobicContact CD1-CG2 4.25Å
276	E	94.3	Very high	93.5	Very high	27 Å²	27	35.8 Å²	35.8	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-57.2	-38.7	179.3	-81.1	-176.1	-149.2	0	0	112.1	E272 Q273 L278 F279 R303 R307	E272-E276 VanDerWaalsContact O-CB 3.25Å; E272-E276 WeakPolarHBondContact O-CB 3.5Å; E272-E276 WeakPolarHBondContact O-CG 3.38Å; E272-E276 PolarHBondContact O-N 2.89Å; Q273-E276 PolarHBondContact O-N 2.72Å; E276-L278 VanDerWaalsContact C-N 3.26Å; E276-L278 PolarHBondContact O-N 2.95Å; E276-F279 PolarHBondContact O-N 3.07Å; E276-F279 VanDerWaalsContact O-N 3.11Å; E276-R303 HydrophobicContact CB-CG 4.08Å; E276-R303 HydrophobicContact CG-CG 4.02Å; E276-R303 IonicContact OE2-CZ 3.79Å; E276-R303 IonicContact OE2-NE 2.67Å; E276-R303 PolarHBondContact OE2-NE 3.31Å; E276-R303 IonicContact OE2-NH2 2.76Å; E276-R303 PolarHBondContact OE2-NH2 3Å; E276-R307 HydrophobicContact CG-CB 3.98Å; E276-R307 HydrophobicContact CG-CG 4.23Å; E276-R307 WeakPolarHBondContact OE1-CD 3.45Å; E276-R307 IonicContact OE1-NE 3.56Å
277	A	94.8	Very high	93.7	Very high	60 Å²	60	33.1 Å²	33.1	50%	0.496	18%	0.178	S	C	.	.	H	α-helix	trans	-59.1	-35	175.8	0	0	0	0	0	112.6	Q273 L275 F279 T280	Q273-A277 WeakPolarHBondContact O-CB 3.46Å; Q273-A277 PolarHBondContact O-N 3.31Å; L275-A277 PolarHBondContact O-N 2.73Å; A277-F279 PolarHBondContact O-N 3.43Å; A277-T280 WeakPolarHBondContact O-CB 3.11Å; A277-T280 PolarHBondContact O-N 3.33Å; A277-T280 PolarHBondContact O-OG1 2.97Å
278	L	95.6	Very high	94.1	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-64.6	-28.6	178.2	-49.3	-175.2	0	0	0	112.4	Q237 L238 V241 F258 H262 F270 E274 L275 E276	Q237-L278 PolarHBondContact NE2-O 3.29Å; L238-L278 HydrophobicContact CD2-CD1 4.05Å; V241-L278 WeakPolarHBondContact CG2-O 3.45Å; F258-L278 HydrophobicContact CE1-CD1 4.04Å; F258-L278 HydrophobicContact CE1-CD2 4.29Å; F258-L278 HydrophobicContact CZ-CD1 4.31Å; F258-L278 HydrophobicContact CZ-CD2 4.05Å; H262-L278 HydrophobicContact CB-CD2 4.02Å; H262-L278 WeakPolarHBondContact CD2-CD2 3.47Å; F270-L278 HydrophobicContact CE2-CD1 4.31Å; E274-L278 WeakPolarHBondContact O-CG 3.46Å; L275-L278 HydrophobicContact CD2-CD1 4.26Å; L275-L278 WeakPolarHBondContact O-CB 3.43Å; L275-L278 PolarHBondContact O-N 3.37Å; E276-L278 VanDerWaalsContact C-N 3.26Å; E276-L278 PolarHBondContact O-N 2.95Å
279	F	96.3	Very high	94.1	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	19%	0.191	C	C	.	.	H	α-helix	trans	-82.3	-14.9	-177.5	-49.1	-42.6	0	0	0	113.1	P232 L275 E276 A277 K281 E282 L283 R303 M306 R307 V310	P232-F279 HydrophobicContact CB-CD1 4.31Å; P232-F279 HydrophobicContact CB-CE1 3.91Å; P232-F279 HydrophobicContact CB-CZ 4.5Å; L275-F279 HydrophobicContact CB-CE2 4.31Å; L275-F279 HydrophobicContact CB-CZ 4.35Å; L275-F279 WeakPolarHBondContact O-CD2 3.35Å; L275-F279 VanDerWaalsContact O-CE2 3.24Å; L275-F279 WeakPolarHBondContact O-CE2 3.42Å; L275-F279 WeakPolarHBondContact O-CZ 3.34Å; E276-F279 PolarHBondContact O-N 3.07Å; E276-F279 VanDerWaalsContact O-N 3.11Å; A277-F279 PolarHBondContact O-N 3.43Å; F279-K281 PolarHBondContact O-N 3.26Å; F279-K281 VanDerWaalsContact O-N 3.11Å; F279-E282 WeakPolarHBondContact O-CB 3.01Å; F279-E282 PolarHBondContact O-N 2.9Å; F279-L283 HydrophobicContact CB-CD1 4.25Å; F279-L283 WeakPolarHBondContact O-CG 3.31Å; F279-L283 PolarHBondContact O-N 3.46Å; F279-R303 HydrophobicContact CB-CG 4.4Å; F279-R303 HydrophobicContact CD2-CG 4.32Å; F279-M306 HydrophobicContact CB-CB 4.4Å; F279-M306 HydrophobicContact CB-SD 3.79Å; F279-M306 HydrophobicContact CD1-CB 4.15Å; F279-M306 HydrophobicContact CD1-SD 4.25Å; F279-M306 HydrophobicContact CD2-CB 3.61Å; F279-M306 HydrophobicContact CE1-CB 4.41Å; F279-M306 HydrophobicContact CE2-CB 3.93Å; F279-M306 HydrophobicContact CG-CB 3.77Å; F279-M306 HydrophobicContact CG-SD 3.99Å; F279-M306 HydrophobicContact CZ-CB 4.32Å; F279-R307 VanDerWaalsContact CE2-CA 3.49Å; F279-R307 HydrophobicContact CE2-CB 3.96Å; F279-R307 VanDerWaalsContact CE2-N 3.34Å; F279-V310 HydrophobicContact CE1-CG2 4.03Å; F279-V310 HydrophobicContact CZ-CB 4.24Å; F279-V310 HydrophobicContact CZ-CG2 3.78Å
280	T	94.6	Very high	94.1	Very high	61 Å²	61	38.3 Å²	38.3	37%	0.374	21%	0.212	S	C	.	.	H	α-helix	trans	-48.4	-43.3	178.9	-44.7	0	0	0	0	112.3	A277 E282 L283 E284	A277-T280 WeakPolarHBondContact O-CB 3.11Å; A277-T280 PolarHBondContact O-N 3.33Å; A277-T280 PolarHBondContact O-OG1 2.97Å; T280-E282 VanDerWaalsContact C-N 3.34Å; T280-E282 PolarHBondContact O-N 2.98Å; T280-L283 PolarHBondContact O-N 2.91Å; T280-E284 HydrophobicContact CG2-CG 4.41Å; T280-E284 WeakPolarHBondContact O-CB 3.49Å; T280-E284 VanDerWaalsContact O-CG 3.31Å; T280-E284 WeakPolarHBondContact O-CG 3.47Å; T280-E284 PolarHBondContact O-N 3Å
281	K	93	Very high	94	Very high	55 Å²	55	41.9 Å²	41.9	24%	0.239	23%	0.231	C	C	.	.	H	α-helix	trans	-66.5	-30	179.2	-77.5	-74.2	140.7	-156	0	114.4	V241 E244 F279 E284 K285	V241-K281 HydrophobicContact CG2-CB 4.38Å; V241-K281 HydrophobicContact CG2-CG 4.49Å; E244-K281 HydrophobicContact CB-CD 4.11Å; E244-K281 WeakPolarHBondContact OE2-CD 3.48Å; E244-K281 IonicContact OE2-NZ 2.65Å; F279-K281 PolarHBondContact O-N 3.26Å; F279-K281 VanDerWaalsContact O-N 3.11Å; K281-E284 WeakPolarHBondContact CE-OE2 3.44Å; K281-E284 IonicContact NZ-OE2 2.75Å; K281-E284 PolarHBondContact NZ-OE2 3.28Å; K281-K285 WeakPolarHBondContact O-CE 3.28Å
282	E	94.8	Very high	94.1	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-78.8	-37.2	175.5	-66.7	-59.5	155	0	0	111.6	V229 N230 Q237 F279 T280 K285 M306	V229-E282 WeakPolarHBondContact CA-OE2 3.3Å; V229-E282 HydrophobicContact CG1-CB 4.13Å; N230-E282 WeakPolarHBondContact CB-OE1 3.49Å; N230-E282 PolarHBondContact N-OE2 3.4Å; N230-E282 PolarHBondContact ND2-OE1 3.44Å; Q237-E282 HydrophobicContact CG-CG 3.56Å; Q237-E282 WeakPolarHBondContact CG-OE1 3.35Å; F279-E282 WeakPolarHBondContact O-CB 3.01Å; F279-E282 PolarHBondContact O-N 2.9Å; T280-E282 VanDerWaalsContact C-N 3.34Å; T280-E282 PolarHBondContact O-N 2.98Å; E282-K285 WeakPolarHBondContact O-CB 3.46Å; E282-K285 PolarHBondContact O-N 3.17Å; E282-K285 IonicContact OE1-NZ 3.95Å; E282-K285 PolarHBondContact OE1-NZ 3.33Å; E282-K285 VanDerWaalsContact OE1-NZ 3.14Å; E282-K285 IonicContact OE2-NZ 3.15Å; E282-K285 PolarHBondContact OE2-NZ 2.99Å; E282-M306 HydrophobicContact CB-CE 4.34Å; E282-M306 HydrophobicContact CB-SD 4.45Å
283	L	95.4	Very high	94.2	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.016	27%	0.266	C	S	.	.	H	α-helix	trans	-73.7	-37.9	-179.4	-64.8	167.3	0	0	0	112.4	F279 T280 K285 I286 Y287 M299 E302 R303 M306	F279-L283 HydrophobicContact CB-CD1 4.25Å; F279-L283 WeakPolarHBondContact O-CG 3.31Å; F279-L283 PolarHBondContact O-N 3.46Å; T280-L283 PolarHBondContact O-N 2.91Å; L283-K285 PolarHBondContact O-N 3.13Å; L283-I286 PolarHBondContact O-N 3.41Å; L283-Y287 PolarHBondContact O-N 3.26Å; L283-M299 HydrophobicContact CB-CG 3.99Å; L283-M299 HydrophobicContact CB-SD 4.42Å; L283-M299 HydrophobicContact CD1-CG 4.39Å; L283-M299 HydrophobicContact CD2-CG 4.34Å; L283-M299 HydrophobicContact CG-CG 4.47Å; L283-E302 HydrophobicContact CD2-CB 3.82Å; L283-E302 HydrophobicContact CD2-CG 3.6Å; L283-R303 HydrophobicContact CD1-CB 3.54Å; L283-R303 HydrophobicContact CD1-CG 3.61Å; L283-M306 HydrophobicContact CD2-CE 4.11Å; L283-M306 HydrophobicContact CD2-SD 4.37Å
284	E	95.3	Very high	94.4	Very high	112 Å²	112	46.2 Å²	46.2	52%	0.523	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-11.5	172.1	-79.9	178.7	175.1	0	0	113.8	T280 K281	T280-E284 HydrophobicContact CG2-CG 4.41Å; T280-E284 WeakPolarHBondContact O-CB 3.49Å; T280-E284 VanDerWaalsContact O-CG 3.31Å; T280-E284 WeakPolarHBondContact O-CG 3.47Å; T280-E284 PolarHBondContact O-N 3Å; K281-E284 WeakPolarHBondContact CE-OE2 3.44Å; K281-E284 IonicContact NZ-OE2 2.75Å; K281-E284 PolarHBondContact NZ-OE2 3.28Å
285	K	94.3	Very high	94.3	Very high	41 Å²	41	47 Å²	47	18%	0.178	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-29	171.9	-59.6	169.3	-173.5	175.8	0	112.4	P227 N230 E240 K281 E282 L283	P227-K285 HydrophobicContact CB-CB 4.34Å; P227-K285 VanDerWaalsContact CD-O 3.26Å; P227-K285 WeakPolarHBondContact CD-O 3.32Å; P227-K285 HydrophobicContact CG-CB 4.39Å; N230-K285 PolarHBondContact ND2-NZ 3.33Å; E240-K285 WeakPolarHBondContact OE1-CE 3.48Å; E240-K285 IonicContact OE1-NZ 2.77Å; E240-K285 PolarHBondContact OE1-NZ 3.19Å; E240-K285 IonicContact OE2-NZ 3.83Å; E240-K285 PolarHBondContact OE2-NZ 3Å; K281-K285 WeakPolarHBondContact O-CE 3.28Å; E282-K285 WeakPolarHBondContact O-CB 3.46Å; E282-K285 PolarHBondContact O-N 3.17Å; E282-K285 IonicContact OE1-NZ 3.95Å; E282-K285 PolarHBondContact OE1-NZ 3.33Å; E282-K285 VanDerWaalsContact OE1-NZ 3.14Å; E282-K285 IonicContact OE2-NZ 3.15Å; E282-K285 PolarHBondContact OE2-NZ 2.99Å; L283-K285 PolarHBondContact O-N 3.13Å
286	I	94.2	Very high	94.3	Very high	6 Å²	6	50.2 Å²	50.2	3%	0.031	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-36.2	-168.2	-37.4	169.2	0	0	0	110.8	H223 V229 L283 T344	H223-I286 PolarHBondContact CE1-O 2.95Å; H223-I286 PolarHBondContact ND1-O 3.49Å; V229-I286 HydrophobicContact CG1-CD1 4.41Å; V229-I286 HydrophobicContact CG2-CD1 3.5Å; V229-I286 HydrophobicContact CG2-CG1 3.5Å; V229-I286 VanDerWaalsContact CG2-CG1 3.5Å; L283-I286 PolarHBondContact O-N 3.41Å; I286-T344 HydrophobicContact CD1-CG2 4.07Å
287	Y	96	Very high	94.3	Very high	5 Å²	5	51.9 Å²	51.9	2%	0.02	28%	0.283	C	S	.	.			trans	-125.9	116.1	-172.1	-59.5	-85.6	0	0	0	111.3	H223 L283 D294 D295 E298 M299 E302	H223-Y287 AromaticContact CE1-CD1 3.57Å; H223-Y287 AromaticContact CE1-CE1 3.25Å; H223-Y287 WeakPolarHBondContact CE1-CE1 3.39Å; H223-Y287 AromaticContact CE1-CZ 3.74Å; H223-Y287 AromaticContact NE2-CE1 3.69Å; H223-Y287 AromaticContact NE2-CZ 3.83Å; L283-Y287 PolarHBondContact O-N 3.26Å; Y287-D294 HydrophobicContact CD1-CB 4.2Å; Y287-D295 WeakPolarHBondContact CD1-O 3.34Å; Y287-D295 WeakPolarHBondContact CE1-O 3.4Å; Y287-E298 HydrophobicContact CE1-CB 3.69Å; Y287-M299 HydrophobicContact CD1-CB 3.96Å; Y287-M299 HydrophobicContact CD2-CB 3.62Å; Y287-M299 HydrophobicContact CD2-CG 3.57Å; Y287-M299 HydrophobicContact CE1-CB 4.41Å; Y287-M299 HydrophobicContact CE2-CB 4.11Å; Y287-M299 HydrophobicContact CE2-CG 4.33Å; Y287-M299 HydrophobicContact CG-CB 3.57Å; Y287-M299 HydrophobicContact CG-CG 3.78Å; Y287-E302 HydrophobicContact CE2-CB 4.42Å
288	D	94.9	Very high	94.3	Very high	71 Å²	71	50.3 Å²	50.3	38%	0.38	27%	0.266	S	S	.	.			trans	-109.8	121.7	168.2	-172.5	-43.9	0	0	0	110.3	T290 N291 D294	D288-T290 PolarHBondContact O-N 3.11Å; D288-T290 WeakPolarHBondContact OD1-CA 3.21Å; D288-T290 VanDerWaalsContact OD1-CB 3.32Å; D288-T290 WeakPolarHBondContact OD1-CB 3.39Å; D288-T290 PolarHBondContact OD1-N 3.27Å; D288-T290 PolarHBondContact OD1-OG1 2.76Å; D288-N291 HydrophobicContact CB-CB 4.49Å; D288-N291 WeakPolarHBondContact O-CB 3.32Å; D288-N291 PolarHBondContact O-N 3.1Å; D288-D294 PolarHBondContact N-OD2 2.74Å
289	P	93.8	Very high	94.3	Very high	95 Å²	95	51.7 Å²	51.7	62%	0.617	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-1.6	178.3	-18.1	26.7	0	0	0	116.2	M296	P289-M296 HydrophobicContact CB-CE 4.42Å; P289-M296 HydrophobicContact CB-SD 3.81Å; P289-M296 HydrophobicContact CG-CE 3.8Å; P289-M296 HydrophobicContact CG-SD 3.67Å
290	T	94.3	Very high	94.1	Very high	121 Å²	121	54.6 Å²	54.6	74%	0.742	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-6.9	177.1	69.7	0	0	0	0	114.2	D288	D288-T290 PolarHBondContact O-N 3.11Å; D288-T290 WeakPolarHBondContact OD1-CA 3.21Å; D288-T290 VanDerWaalsContact OD1-CB 3.32Å; D288-T290 WeakPolarHBondContact OD1-CB 3.39Å; D288-T290 PolarHBondContact OD1-N 3.27Å; D288-T290 PolarHBondContact OD1-OG1 2.76Å
291	N	93.5	Very high	94.1	Very high	75 Å²	75	52.4 Å²	52.4	40%	0.401	27%	0.271	S	S	.	.			trans	-81.7	165.5	169.4	-74.5	-14.9	0	0	0	111.1	D288 E293 D294	D288-N291 HydrophobicContact CB-CB 4.49Å; D288-N291 WeakPolarHBondContact O-CB 3.32Å; D288-N291 PolarHBondContact O-N 3.1Å; N291-E293 HydrophobicContact CB-CG 4.08Å; N291-E293 WeakPolarHBondContact CB-OE2 3.32Å; N291-D294 HydrophobicContact CB-CB 4.1Å; N291-D294 WeakPolarHBondContact CB-OD2 3.48Å; N291-D294 PolarHBondContact ND2-OD2 3.11Å
292	E	92.1	Very high	94.2	Very high	152 Å²	152	49.8 Å²	49.8	71%	0.71	26%	0.26	S	S	*	.	S	Bend	trans	-109.9	-10.1	174.8	38.7	161.1	-145.8	0	0	112.9	M219	M219-E292 HydrophobicContact CE-CB 4.07Å; M219-E292 HydrophobicContact CE-CG 3.55Å
293	E	91.3	Very high	94.3	Very high	45 Å²	45	51.7 Å²	51.7	21%	0.21	27%	0.267	C	S	.	.	S	Bend	trans	-82.2	-20.8	169.8	50.7	-92.4	-106.2	0	0	113.8	M219 K222 H223 N291	M219-E293 HydrophobicContact CB-CB 4.29Å; M219-E293 HydrophobicContact CE-CB 3.68Å; M219-E293 HydrophobicContact CE-CG 4.43Å; K222-E293 HydrophobicContact CB-CB 4.44Å; K222-E293 HydrophobicContact CB-CG 4.06Å; K222-E293 VanDerWaalsContact CB-OE1 3.24Å; K222-E293 WeakPolarHBondContact CB-OE1 3.38Å; K222-E293 WeakPolarHBondContact CD-OE1 3.46Å; H223-E293 HydrophobicContact CB-CB 4.38Å; N291-E293 HydrophobicContact CB-CG 4.08Å; N291-E293 WeakPolarHBondContact CB-OE2 3.32Å
294	D	94.2	Very high	94.1	Very high	20 Å²	20	51.8 Å²	51.8	11%	0.107	27%	0.268	C	S	.	.			trans	-101.4	113	-168.3	-64	-18.5	0	0	0	111.8	H223 Y287 D288 N291	H223-D294 IonicContact CE1-OD1 2.66Å; H223-D294 IonicContact CG-OD1 3.54Å; H223-D294 IonicContact ND1-OD1 3.01Å; H223-D294 PolarHBondContact ND1-OD1 2.93Å; Y287-D294 HydrophobicContact CD1-CB 4.2Å; D288-D294 PolarHBondContact N-OD2 2.74Å; N291-D294 HydrophobicContact CB-CB 4.1Å; N291-D294 WeakPolarHBondContact CB-OD2 3.48Å; N291-D294 PolarHBondContact ND2-OD2 3.11Å
295	D	94.3	Very high	94.1	Very high	27 Å²	27	48.5 Å²	48.5	14%	0.144	25%	0.251	C	S	.	.			trans	-89.8	117	-178.8	-166.1	-25.8	0	0	0	112.1	Y189 K193 Y287 V297 E298 M299	Y189-D295 WeakPolarHBondContact CE1-OD2 3.46Å; Y189-D295 PolarHBondContact OH-OD2 2.62Å; K193-D295 IonicContact NZ-OD2 3.22Å; K193-D295 PolarHBondContact NZ-OD2 2.62Å; Y287-D295 WeakPolarHBondContact CD1-O 3.34Å; Y287-D295 WeakPolarHBondContact CE1-O 3.4Å; D295-V297 PolarHBondContact O-N 3.46Å; D295-V297 WeakPolarHBondContact OD1-CB 3.46Å; D295-V297 PolarHBondContact OD1-N 3.2Å; D295-E298 HydrophobicContact CB-CB 4.08Å; D295-E298 HydrophobicContact CB-CG 3.76Å; D295-E298 WeakPolarHBondContact O-CB 3.39Å; D295-E298 PolarHBondContact O-N 3.19Å; D295-E298 VanDerWaalsContact O-N 3.12Å; D295-M299 PolarHBondContact O-N 2.91Å
296	M	94.1	Very high	94.1	Very high	72 Å²	72	46.6 Å²	46.6	36%	0.355	24%	0.242	S	C	.	.	H	α-helix	trans	-65.6	-20	178.2	-59.3	-52.5	-52.3	0	0	113.8	P289 M299 E300	P289-M296 HydrophobicContact CB-CE 4.42Å; P289-M296 HydrophobicContact CB-SD 3.81Å; P289-M296 HydrophobicContact CG-CE 3.8Å; P289-M296 HydrophobicContact CG-SD 3.67Å; M296-M299 HydrophobicContact CE-CB 4.46Å; M296-M299 HydrophobicContact CE-CE 3.55Å; M296-M299 HydrophobicContact CE-SD 3.46Å; M296-M299 WeakPolarHBondContact CE-SD 3.37Å; M296-E300 PolarHBondContact O-N 2.68Å
297	V	93.8	Very high	94.2	Very high	61 Å²	61	46.4 Å²	46.4	37%	0.37	24%	0.241	S	C	.	.	H	α-helix	trans	-77.1	-37.7	173.3	-173.7	0	0	0	0	110.6	F186 Y189 D295 E300 E301	F186-V297 HydrophobicContact CD2-CG1 4.16Å; F186-V297 HydrophobicContact CE2-CG1 4.49Å; Y189-V297 HydrophobicContact CD1-CB 4.39Å; Y189-V297 HydrophobicContact CD1-CG1 3.95Å; Y189-V297 HydrophobicContact CE1-CB 3.97Å; Y189-V297 HydrophobicContact CE1-CG1 4.04Å; Y189-V297 HydrophobicContact CE1-CG2 4.38Å; Y189-V297 HydrophobicContact CE2-CG2 4.29Å; Y189-V297 HydrophobicContact CG-CG1 4.23Å; D295-V297 PolarHBondContact O-N 3.46Å; D295-V297 WeakPolarHBondContact OD1-CB 3.46Å; D295-V297 PolarHBondContact OD1-N 3.2Å; V297-E300 PolarHBondContact O-N 3.25Å; V297-E301 PolarHBondContact O-N 3.34Å; V297-E301 VanDerWaalsContact O-N 3.1Å
298	E	94.6	Very high	94	Very high	28 Å²	28	47.7 Å²	47.7	13%	0.131	25%	0.247	C	C	.	.	H	α-helix	trans	-65.5	-42.1	171.2	-65.2	179.4	-144.4	0	0	111.1	F186 K193 Y287 D295 E300 E301 E302 L345	F186-E298 HydrophobicContact CE2-CB 4.39Å; F186-E298 HydrophobicContact CE2-CG 3.93Å; F186-E298 HydrophobicContact CZ-CG 3.97Å; K193-E298 IonicContact NZ-OE1 2.79Å; K193-E298 PolarHBondContact NZ-OE1 3.48Å; Y287-E298 HydrophobicContact CE1-CB 3.69Å; D295-E298 HydrophobicContact CB-CB 4.08Å; D295-E298 HydrophobicContact CB-CG 3.76Å; D295-E298 WeakPolarHBondContact O-CB 3.39Å; D295-E298 PolarHBondContact O-N 3.19Å; D295-E298 VanDerWaalsContact O-N 3.12Å; E298-E300 VanDerWaalsContact C-N 3.29Å; E298-E300 PolarHBondContact O-N 2.75Å; E298-E301 PolarHBondContact O-N 2.87Å; E298-E302 WeakPolarHBondContact O-CB 3.29Å; E298-E302 PolarHBondContact O-N 3.44Å; E298-L345 HydrophobicContact CB-CD1 3.99Å; E298-L345 WeakPolarHBondContact O-CD1 3.16Å
299	M	94.8	Very high	93.9	Very high	34 Å²	34	46.5 Å²	46.5	17%	0.167	24%	0.24	C	C	.	.	H	α-helix	trans	-57.7	-41.1	174.8	-168.3	-156.1	71.4	0	0	112.4	L283 Y287 D295 M296 R303	L283-M299 HydrophobicContact CB-CG 3.99Å; L283-M299 HydrophobicContact CB-SD 4.42Å; L283-M299 HydrophobicContact CD1-CG 4.39Å; L283-M299 HydrophobicContact CD2-CG 4.34Å; L283-M299 HydrophobicContact CG-CG 4.47Å; Y287-M299 HydrophobicContact CD1-CB 3.96Å; Y287-M299 HydrophobicContact CD2-CB 3.62Å; Y287-M299 HydrophobicContact CD2-CG 3.57Å; Y287-M299 HydrophobicContact CE1-CB 4.41Å; Y287-M299 HydrophobicContact CE2-CB 4.11Å; Y287-M299 HydrophobicContact CE2-CG 4.33Å; Y287-M299 HydrophobicContact CG-CB 3.57Å; Y287-M299 HydrophobicContact CG-CG 3.78Å; D295-M299 PolarHBondContact O-N 2.91Å; M296-M299 HydrophobicContact CE-CB 4.46Å; M296-M299 HydrophobicContact CE-CE 3.55Å; M296-M299 HydrophobicContact CE-SD 3.46Å; M296-M299 WeakPolarHBondContact CE-SD 3.37Å; M299-R303 PolarHBondContact O-N 3.31Å
300	E	93.4	Very high	94	Very high	62 Å²	62	42.4 Å²	42.4	29%	0.29	21%	0.213	S	C	.	.	H	α-helix	trans	-65.5	-45.7	178.2	-171.6	75.2	-169.3	0	0	111.3	R182 M296 V297 E298 R303 L304	R182-E300 IonicContact NH2-OE1 3.13Å; M296-E300 PolarHBondContact O-N 2.68Å; V297-E300 PolarHBondContact O-N 3.25Å; E298-E300 VanDerWaalsContact C-N 3.29Å; E298-E300 PolarHBondContact O-N 2.75Å; E300-R303 VanDerWaalsContact CD-NH2 3.32Å; E300-R303 WeakPolarHBondContact O-CB 3.28Å; E300-R303 PolarHBondContact O-N 3.11Å; E300-R303 IonicContact OE1-CZ 3.14Å; E300-R303 IonicContact OE1-NH1 2.74Å; E300-R303 IonicContact OE1-NH2 2.67Å; E300-R303 PolarHBondContact OE1-NH2 2.91Å; E300-R303 IonicContact OE2-CZ 2.84Å; E300-R303 IonicContact OE2-NH1 3.65Å; E300-R303 PolarHBondContact OE2-NH1 3.21Å; E300-R303 IonicContact OE2-NH2 2.67Å; E300-R303 PolarHBondContact OE2-NH2 3.48Å; E300-L304 PolarHBondContact O-N 3.15Å; E300-L304 VanDerWaalsContact O-N 3.13Å
301	E	94.6	Very high	93.9	Very high	14 Å²	14	37.3 Å²	37.3	7%	0.065	18%	0.181	C	C	.	.	H	α-helix	trans	-63.8	-42.5	175.4	179.4	78.9	161.6	0	0	111.8	H183 F186 V297 E298 R303 L304 R305 L345	H183-E301 IonicContact CE1-OE1 2.7Å; H183-E301 IonicContact CG-OE1 3.33Å; H183-E301 IonicContact ND1-OE1 3.8Å; H183-E301 PolarHBondContact ND1-OE1 2.94Å; H183-E301 IonicContact ND1-OE2 2.72Å; F186-E301 HydrophobicContact CB-CB 4.5Å; F186-E301 HydrophobicContact CB-CG 4.14Å; F186-E301 HydrophobicContact CD1-CB 4.21Å; F186-E301 HydrophobicContact CD1-CG 3.49Å; F186-E301 VanDerWaalsContact CD1-CG 3.49Å; F186-E301 WeakPolarHBondContact CD1-OE1 3.05Å; F186-E301 HydrophobicContact CD2-CB 3.72Å; F186-E301 HydrophobicContact CD2-CG 3.95Å; F186-E301 HydrophobicContact CE1-CB 4.39Å; F186-E301 HydrophobicContact CE1-CG 3.81Å; F186-E301 HydrophobicContact CE2-CB 3.95Å; F186-E301 HydrophobicContact CE2-CG 4.26Å; F186-E301 HydrophobicContact CG-CB 3.86Å; F186-E301 HydrophobicContact CG-CG 3.56Å; F186-E301 HydrophobicContact CZ-CB 4.28Å; F186-E301 HydrophobicContact CZ-CG 4.19Å; V297-E301 PolarHBondContact O-N 3.34Å; V297-E301 VanDerWaalsContact O-N 3.1Å; E298-E301 PolarHBondContact O-N 2.87Å; E301-R303 VanDerWaalsContact C-N 3.28Å; E301-R303 PolarHBondContact O-N 3.46Å; E301-L304 WeakPolarHBondContact O-CB 3.37Å; E301-L304 PolarHBondContact O-N 3.29Å; E301-L304 VanDerWaalsContact O-N 3.12Å; E301-R305 WeakPolarHBondContact O-CG 3.37Å; E301-R305 PolarHBondContact O-N 3.35Å; E301-L345 HydrophobicContact CB-CD1 4.04Å; E301-L345 HydrophobicContact CG-CD1 4.07Å; E301-L345 HydrophobicContact CG-CD2 4.23Å
302	E	95.4	Very high	93.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-39.1	175.8	-168.8	67.3	-92.6	0	0	110.6	L283 Y287 E298 L304 R305 M306 W342 T344 L345	L283-E302 HydrophobicContact CD2-CB 3.82Å; L283-E302 HydrophobicContact CD2-CG 3.6Å; Y287-E302 HydrophobicContact CE2-CB 4.42Å; E298-E302 WeakPolarHBondContact O-CB 3.29Å; E298-E302 PolarHBondContact O-N 3.44Å; E302-L304 PolarHBondContact O-N 2.8Å; E302-R305 VanDerWaalsContact CD-NH1 3.29Å; E302-R305 PolarHBondContact O-N 3.23Å; E302-R305 IonicContact OE1-CZ 3.24Å; E302-R305 IonicContact OE1-NE 2.72Å; E302-R305 IonicContact OE1-NH1 3.66Å; E302-R305 PolarHBondContact OE1-NH1 2.87Å; E302-R305 IonicContact OE2-NH1 3.87Å; E302-R305 PolarHBondContact OE2-NH1 3.49Å; E302-R305 VanDerWaalsContact OE2-NH1 3.12Å; E302-M306 HydrophobicContact CG-CE 4.15Å; E302-M306 VanDerWaalsContact O-CG 3.28Å; E302-M306 WeakPolarHBondContact O-CG 3.27Å; E302-M306 PolarHBondContact O-N 2.88Å; E302-W342 WeakPolarHBondContact OE1-CZ2 2.92Å; E302-W342 PolarHBondContact OE1-NE1 2.85Å; E302-T344 WeakPolarHBondContact OE2-CA 3.44Å; E302-L345 HydrophobicContact CB-CD1 4Å; E302-L345 HydrophobicContact CB-CG 4.48Å; E302-L345 PolarHBondContact OE2-N 2.88Å
303	R	95.6	Very high	93.8	Very high	42 Å²	42	35.2 Å²	35.2	16%	0.158	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-42.4	173	-157.7	173.8	73.2	-110.7	-8.3	112.3	E276 F279 L283 M299 E300 E301 M306 R307	E276-R303 HydrophobicContact CB-CG 4.08Å; E276-R303 HydrophobicContact CG-CG 4.02Å; E276-R303 IonicContact OE2-CZ 3.79Å; E276-R303 IonicContact OE2-NE 2.67Å; E276-R303 PolarHBondContact OE2-NE 3.31Å; E276-R303 IonicContact OE2-NH2 2.76Å; E276-R303 PolarHBondContact OE2-NH2 3Å; F279-R303 HydrophobicContact CB-CG 4.4Å; F279-R303 HydrophobicContact CD2-CG 4.32Å; L283-R303 HydrophobicContact CD1-CB 3.54Å; L283-R303 HydrophobicContact CD1-CG 3.61Å; M299-R303 PolarHBondContact O-N 3.31Å; E300-R303 VanDerWaalsContact CD-NH2 3.32Å; E300-R303 WeakPolarHBondContact O-CB 3.28Å; E300-R303 PolarHBondContact O-N 3.11Å; E300-R303 IonicContact OE1-CZ 3.14Å; E300-R303 IonicContact OE1-NH1 2.74Å; E300-R303 IonicContact OE1-NH2 2.67Å; E300-R303 PolarHBondContact OE1-NH2 2.91Å; E300-R303 IonicContact OE2-CZ 2.84Å; E300-R303 IonicContact OE2-NH1 3.65Å; E300-R303 PolarHBondContact OE2-NH1 3.21Å; E300-R303 IonicContact OE2-NH2 2.67Å; E300-R303 PolarHBondContact OE2-NH2 3.48Å; E301-R303 VanDerWaalsContact C-N 3.28Å; E301-R303 PolarHBondContact O-N 3.46Å; R303-M306 PolarHBondContact O-N 2.88Å; R303-R307 WeakPolarHBondContact O-CB 3.46Å; R303-R307 PolarHBondContact O-N 2.7Å
304	L	92.7	Very high	94	Very high	5 Å²	5	33.8 Å²	33.8	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-64.3	-44.3	175.5	-64.2	179.7	0	0	0	111.7	R182 E300 E301 E302 M306 R307 E308	R182-L304 HydrophobicContact CB-CD1 4.07Å; R182-L304 HydrophobicContact CG-CD1 4.31Å; E300-L304 PolarHBondContact O-N 3.15Å; E300-L304 VanDerWaalsContact O-N 3.13Å; E301-L304 WeakPolarHBondContact O-CB 3.37Å; E301-L304 PolarHBondContact O-N 3.29Å; E301-L304 VanDerWaalsContact O-N 3.12Å; E302-L304 PolarHBondContact O-N 2.8Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.12Å; L304-R307 PolarHBondContact O-N 2.91Å; L304-E308 WeakPolarHBondContact O-CB 3.39Å; L304-E308 PolarHBondContact O-N 2.98Å
305	R	94.3	Very high	93.9	Very high	43 Å²	43	33.1 Å²	33.1	16%	0.162	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-43.7	173.8	-69.4	178.5	67.9	-140.6	5.3	112.1	E301 E302 H309 W342 E343	E301-R305 WeakPolarHBondContact O-CG 3.37Å; E301-R305 PolarHBondContact O-N 3.35Å; E302-R305 VanDerWaalsContact CD-NH1 3.29Å; E302-R305 PolarHBondContact O-N 3.23Å; E302-R305 IonicContact OE1-CZ 3.24Å; E302-R305 IonicContact OE1-NE 2.72Å; E302-R305 IonicContact OE1-NH1 3.66Å; E302-R305 PolarHBondContact OE1-NH1 2.87Å; E302-R305 IonicContact OE2-NH1 3.87Å; E302-R305 PolarHBondContact OE2-NH1 3.49Å; E302-R305 VanDerWaalsContact OE2-NH1 3.12Å; R305-H309 VanDerWaalsContact O-CB 3.3Å; R305-H309 WeakPolarHBondContact O-CB 3.49Å; R305-H309 PolarHBondContact O-N 3.44Å; R305-W342 HydrophobicContact CB-CH2 4.4Å; R305-W342 HydrophobicContact CB-CZ2 3.95Å; R305-E343 PolarHBondContact NH1-O 2.92Å; R305-E343 PolarHBondContact NH2-O 3.02Å
306	M	95.2	Very high	93.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-46.3	177.6	-69.2	-164.9	178.7	0	0	111.6	V229 P232 F279 E282 L283 E302 R303 L304 H309 V310 W342	V229-M306 HydrophobicContact CG1-CE 3.91Å; P232-M306 HydrophobicContact CB-CB 3.98Å; P232-M306 HydrophobicContact CB-CG 4.22Å; P232-M306 HydrophobicContact CG-CB 3.73Å; P232-M306 HydrophobicContact CG-CE 4.44Å; P232-M306 HydrophobicContact CG-CG 3.45Å; P232-M306 VanDerWaalsContact CG-CG 3.45Å; P232-M306 HydrophobicContact CG-SD 3.89Å; F279-M306 HydrophobicContact CB-CB 4.4Å; F279-M306 HydrophobicContact CB-SD 3.79Å; F279-M306 HydrophobicContact CD1-CB 4.15Å; F279-M306 HydrophobicContact CD1-SD 4.25Å; F279-M306 HydrophobicContact CD2-CB 3.61Å; F279-M306 HydrophobicContact CE1-CB 4.41Å; F279-M306 HydrophobicContact CE2-CB 3.93Å; F279-M306 HydrophobicContact CG-CB 3.77Å; F279-M306 HydrophobicContact CG-SD 3.99Å; F279-M306 HydrophobicContact CZ-CB 4.32Å; E282-M306 HydrophobicContact CB-CE 4.34Å; E282-M306 HydrophobicContact CB-SD 4.45Å; L283-M306 HydrophobicContact CD2-CE 4.11Å; L283-M306 HydrophobicContact CD2-SD 4.37Å; E302-M306 HydrophobicContact CG-CE 4.15Å; E302-M306 VanDerWaalsContact O-CG 3.28Å; E302-M306 WeakPolarHBondContact O-CG 3.27Å; E302-M306 PolarHBondContact O-N 2.88Å; R303-M306 PolarHBondContact O-N 2.88Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.12Å; M306-H309 PolarHBondContact O-N 2.97Å; M306-V310 WeakPolarHBondContact O-CG2 3.44Å; M306-V310 PolarHBondContact O-N 2.92Å; M306-V310 VanDerWaalsContact O-N 3.1Å; M306-W342 HydrophobicContact CG-CZ2 3.84Å
307	R	94.6	Very high	93.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-57.8	-52.3	174.2	170.6	-152.9	58.7	147.4	-4.4	111.7	D179 E272 E276 F279 R303 L304 H309 V310 M311	D179-R307 IonicContact OD1-CZ 2.68Å; D179-R307 VanDerWaalsContact OD1-CZ 3.22Å; D179-R307 IonicContact OD1-NH1 3.42Å; D179-R307 PolarHBondContact OD1-NH1 3.37Å; D179-R307 IonicContact OD1-NH2 3.68Å; D179-R307 PolarHBondContact OD1-NH2 3.5Å; D179-R307 IonicContact OD2-NH1 3.46Å; D179-R307 IonicContact OD2-NH2 2.74Å; E272-R307 HydrophobicContact CB-CG 4.34Å; E272-R307 HydrophobicContact CG-CG 4.22Å; E272-R307 IonicContact OE2-CZ 2.81Å; E272-R307 IonicContact OE2-NH1 2.87Å; E272-R307 PolarHBondContact OE2-NH1 2.89Å; E276-R307 HydrophobicContact CG-CB 3.98Å; E276-R307 HydrophobicContact CG-CG 4.23Å; E276-R307 WeakPolarHBondContact OE1-CD 3.45Å; E276-R307 IonicContact OE1-NE 3.56Å; F279-R307 VanDerWaalsContact CE2-CA 3.49Å; F279-R307 HydrophobicContact CE2-CB 3.96Å; F279-R307 VanDerWaalsContact CE2-N 3.34Å; R303-R307 WeakPolarHBondContact O-CB 3.46Å; R303-R307 PolarHBondContact O-N 2.7Å; L304-R307 PolarHBondContact O-N 2.91Å; R307-H309 VanDerWaalsContact C-N 3.31Å; R307-H309 PolarHBondContact O-N 3.3Å; R307-V310 PolarHBondContact O-N 2.86Å; R307-M311 HydrophobicContact CG-CG 4.42Å; R307-M311 WeakPolarHBondContact O-CB 3.28Å; R307-M311 WeakPolarHBondContact O-CG 3.27Å; R307-M311 PolarHBondContact O-N 3.27Å
308	E	92.5	Very high	92.8	Very high	32 Å²	32	38.4 Å²	38.4	15%	0.15	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-36.4	-178	-79.3	169.1	-115.7	0	0	112.4	D179 H183 L304 N312	D179-E308 HydrophobicContact CB-CG 4.47Å; H183-E308 IonicContact CE1-OE1 2.84Å; H183-E308 IonicContact NE2-OE1 3.76Å; H183-E308 IonicContact NE2-OE2 2.67Å; H183-E308 PolarHBondContact NE2-OE2 3.42Å; L304-E308 WeakPolarHBondContact O-CB 3.39Å; L304-E308 PolarHBondContact O-N 2.98Å; E308-N312 VanDerWaalsContact O-CB 3.22Å; E308-N312 WeakPolarHBondContact O-CB 3.34Å; E308-N312 PolarHBondContact O-N 3.44Å; E308-N312 PolarHBondContact O-ND2 2.94Å
309	H	94	Very high	92.1	Very high	47 Å²	47	40.1 Å²	40.1	22%	0.218	20%	0.203	C	C	.	.	H	α-helix	trans	-61	-50.2	173.1	174.8	68.8	0	0	0	111.1	H231 R305 M306 R307 N312 E313 W342	H231-H309 AromaticContact CD2-NE2 3.79Å; H231-H309 AromaticContact CE1-NE2 3.85Å; H231-H309 AromaticContact NE2-CE1 3.74Å; H231-H309 AromaticContact NE2-NE2 3.08Å; H231-H309 PolarHBondContact NE2-NE2 3.49Å; R305-H309 VanDerWaalsContact O-CB 3.3Å; R305-H309 WeakPolarHBondContact O-CB 3.49Å; R305-H309 PolarHBondContact O-N 3.44Å; M306-H309 PolarHBondContact O-N 2.97Å; R307-H309 VanDerWaalsContact C-N 3.31Å; R307-H309 PolarHBondContact O-N 3.3Å; H309-N312 PolarHBondContact O-N 2.87Å; H309-E313 IonicContact CE1-OE1 3.16Å; H309-E313 WeakPolarHBondContact O-CG 3.24Å; H309-E313 PolarHBondContact O-N 3.45Å; H309-W342 HydrophobicContact CB-CH2 3.8Å; H309-W342 HydrophobicContact CB-CZ3 3.88Å; H309-W342 AromaticContact CD2-CZ3 3.92Å; H309-W342 AromaticContact CG-CZ3 3.69Å
310	V	94.8	Very high	91.6	Very high	8 Å²	8	41.2 Å²	41.2	5%	0.048	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-42.9	178.3	175.6	0	0	0	0	111.8	P232 L275 F279 M306 R307 N312 E313 V314	P232-V310 HydrophobicContact CB-CG2 3.68Å; L275-V310 HydrophobicContact CD1-CG1 4.07Å; L275-V310 HydrophobicContact CD2-CG1 4.24Å; F279-V310 HydrophobicContact CE1-CG2 4.03Å; F279-V310 HydrophobicContact CZ-CB 4.24Å; F279-V310 HydrophobicContact CZ-CG2 3.78Å; M306-V310 WeakPolarHBondContact O-CG2 3.44Å; M306-V310 PolarHBondContact O-N 2.92Å; M306-V310 VanDerWaalsContact O-N 3.1Å; R307-V310 PolarHBondContact O-N 2.86Å; V310-N312 VanDerWaalsContact C-N 3.34Å; V310-N312 PolarHBondContact O-N 3.38Å; V310-E313 PolarHBondContact O-N 3.32Å; V310-V314 HydrophobicContact CG1-CG2 3.93Å; V310-V314 WeakPolarHBondContact O-CB 3.48Å; V310-V314 WeakPolarHBondContact O-CG2 3.4Å; V310-V314 PolarHBondContact O-N 2.93Å
311	M	92.3	Very high	91.5	Very high	15 Å²	15	40.4 Å²	40.4	7%	0.074	20%	0.203	C	C	.	.	H	α-helix	trans	-63.8	-36.7	174.6	-76.6	-60	-156.6	0	0	112.2	E272 L275 R307 E313 D315 K318 R320 V322	E272-M311 HydrophobicContact CG-CE 3.46Å; E272-M311 VanDerWaalsContact CG-CE 3.46Å; L275-M311 HydrophobicContact CD1-CE 3.73Å; L275-M311 HydrophobicContact CD1-CG 3.98Å; L275-M311 HydrophobicContact CD1-SD 3.72Å; R307-M311 HydrophobicContact CG-CG 4.42Å; R307-M311 WeakPolarHBondContact O-CB 3.28Å; R307-M311 WeakPolarHBondContact O-CG 3.27Å; R307-M311 PolarHBondContact O-N 3.27Å; M311-E313 VanDerWaalsContact C-N 3.35Å; M311-D315 WeakPolarHBondContact O-CB 3.47Å; M311-D315 PolarHBondContact O-N 2.94Å; M311-D315 HydrophobicContact SD-CB 4.1Å; M311-K318 PolarHBondContact O-NZ 3.41Å; M311-R320 WeakPolarHBondContact CE-O 3.46Å; M311-V322 HydrophobicContact SD-CG2 3.75Å
312	N	91.8	Very high	91.5	Very high	114 Å²	114	39.8 Å²	39.8	61%	0.61	20%	0.2	S	C	*	.	H	α-helix	trans	-67.4	-35.9	175.5	-85.5	-68.2	0	0	0	112.5	E308 H309 V310 K318	E308-N312 VanDerWaalsContact O-CB 3.22Å; E308-N312 WeakPolarHBondContact O-CB 3.34Å; E308-N312 PolarHBondContact O-N 3.44Å; E308-N312 PolarHBondContact O-ND2 2.94Å; H309-N312 PolarHBondContact O-N 2.87Å; V310-N312 VanDerWaalsContact C-N 3.34Å; V310-N312 PolarHBondContact O-N 3.38Å; N312-K318 PolarHBondContact O-NZ 2.9Å
313	E	92.1	Very high	91.6	Very high	69 Å²	69	41 Å²	41	32%	0.322	21%	0.209	S	C	.	.	H	α-helix	trans	-78	-44.4	177.8	-74.5	-113.9	161.4	0	0	114.3	H309 V310 M311 K333	H309-E313 IonicContact CE1-OE1 3.16Å; H309-E313 WeakPolarHBondContact O-CG 3.24Å; H309-E313 PolarHBondContact O-N 3.45Å; V310-E313 PolarHBondContact O-N 3.32Å; M311-E313 VanDerWaalsContact C-N 3.35Å; E313-K333 PolarHBondContact O-NZ 2.73Å; E313-K333 IonicContact OE2-NZ 2.75Å
314	V	94.8	Very high	91.6	Very high	15 Å²	15	40.6 Å²	40.6	9%	0.091	21%	0.209	C	C	.	.	S	Bend	trans	-98	-57.1	-163.4	-176.2	0	0	0	0	112.7	V310 S316 V322 E326 A330	V310-V314 HydrophobicContact CG1-CG2 3.93Å; V310-V314 WeakPolarHBondContact O-CB 3.48Å; V310-V314 WeakPolarHBondContact O-CG2 3.4Å; V310-V314 PolarHBondContact O-N 2.93Å; V314-S316 PolarHBondContact O-N 2.99Å; V314-S316 VanDerWaalsContact O-N 3.09Å; V314-S316 PolarHBondContact O-OG 2.87Å; V314-V322 HydrophobicContact CB-CG2 4.11Å; V314-V322 HydrophobicContact CG1-CB 4.38Å; V314-V322 HydrophobicContact CG1-CG1 3.53Å; V314-V322 HydrophobicContact CG1-CG2 3.9Å; V314-E326 HydrophobicContact CG1-CB 4.33Å; V314-A330 HydrophobicContact CB-CB 4.29Å; V314-A330 HydrophobicContact CG1-CB 3.88Å; V314-A330 HydrophobicContact CG2-CB 3.7Å
315	D	92.4	Very high	91.8	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.027	24%	0.239	C	C	.	.			trans	-57.3	116.4	173.5	163.2	12	0	0	0	108.2	M311 N317 K318 R320 V322	M311-D315 WeakPolarHBondContact O-CB 3.47Å; M311-D315 PolarHBondContact O-N 2.94Å; M311-D315 HydrophobicContact SD-CB 4.1Å; D315-N317 PolarHBondContact OD1-N 3.37Å; D315-K318 WeakPolarHBondContact O-CE 3.49Å; D315-K318 PolarHBondContact O-NZ 2.83Å; D315-K318 WeakPolarHBondContact OD1-CA 3.25Å; D315-K318 PolarHBondContact OD1-N 3.08Å; D315-K318 VanDerWaalsContact OD2-CA 3.3Å; D315-K318 WeakPolarHBondContact OD2-CA 3.43Å; D315-K318 WeakPolarHBondContact OD2-CD 3.49Å; D315-R320 PolarHBondContact OD2-N 3.12Å; D315-V322 HydrophobicContact CB-CG2 4.24Å
316	S	90.4	Very high	92	Very high	90 Å²	90	45.4 Å²	45.4	63%	0.629	24%	0.237	S	C	*	.	S	Bend	trans	-106.9	-7.2	-173.7	-62.9	0	0	0	0	112.6	V314 E326	V314-S316 PolarHBondContact O-N 2.99Å; V314-S316 VanDerWaalsContact O-N 3.09Å; V314-S316 PolarHBondContact O-OG 2.87Å; S316-E326 WeakPolarHBondContact CB-OE1 3.39Å; S316-E326 PolarHBondContact N-OE1 3.15Å
317	N	84.4	Confident	92.1	Very high	85 Å²	85	46.1 Å²	46.1	46%	0.455	24%	0.24	S	C	.	.	S	Bend	trans	-110.4	-20.6	-174.2	83.6	50.8	0	0	0	112.6	D315 D319	D315-N317 PolarHBondContact OD1-N 3.37Å; N317-D319 PolarHBondContact ND2-OD2 3.12Å; N317-D319 WeakPolarHBondContact OD1-CB 3.42Å; N317-D319 PolarHBondContact OD1-N 3.39Å; N317-D319 PolarHBondContact OD1-OD1 3.46Å; N317-D319 PolarHBondContact OD1-OD2 3.13Å; N317-D319 VanDerWaalsContact OD1-OD2 3.08Å
318	K	83.9	Confident	92.2	Very high	96 Å²	96	47.7 Å²	47.7	42%	0.417	25%	0.249	S	C	.	.	S	Bend	trans	68.1	40	-178	-56.6	-47	-170.4	-164.4	0	115.9	M87 M311 N312 D315	M87-K318 WeakPolarHBondContact CE-O 3.31Å; M311-K318 PolarHBondContact O-NZ 3.41Å; N312-K318 PolarHBondContact O-NZ 2.9Å; D315-K318 WeakPolarHBondContact O-CE 3.49Å; D315-K318 PolarHBondContact O-NZ 2.83Å; D315-K318 WeakPolarHBondContact OD1-CA 3.25Å; D315-K318 PolarHBondContact OD1-N 3.08Å; D315-K318 VanDerWaalsContact OD2-CA 3.3Å; D315-K318 WeakPolarHBondContact OD2-CA 3.43Å; D315-K318 WeakPolarHBondContact OD2-CD 3.49Å
319	D	80.3	Confident	92.4	Very high	64 Å²	64	50.3 Å²	50.3	34%	0.342	27%	0.267	S	S	.	.	S	Bend	trans	-91.8	1.5	169.9	68.7	14.3	0	0	0	114.7	M87 N317 L321	M87-D319 HydrophobicContact CE-CB 4.31Å; N317-D319 PolarHBondContact ND2-OD2 3.12Å; N317-D319 WeakPolarHBondContact OD1-CB 3.42Å; N317-D319 PolarHBondContact OD1-N 3.39Å; N317-D319 PolarHBondContact OD1-OD1 3.46Å; N317-D319 PolarHBondContact OD1-OD2 3.13Å; N317-D319 VanDerWaalsContact OD1-OD2 3.08Å; D319-L321 VanDerWaalsContact C-N 3.26Å; D319-L321 PolarHBondContact O-N 3.12Å; D319-L321 WeakPolarHBondContact OD1-CB 3.38Å; D319-L321 PolarHBondContact OD1-N 2.65Å
320	R	85.1	Confident	92.4	Very high	58 Å²	58	48.6 Å²	48.6	22%	0.219	26%	0.261	C	S	.	.	S	Bend	trans	65	22.8	-177.3	-61.5	176.9	60.8	165.3	-7.4	113.9	L175 E272 M311 D315	L175-R320 PolarHBondContact O-NH1 3.02Å; E272-R320 IonicContact OE1-CZ 3.47Å; E272-R320 IonicContact OE1-NE 3.94Å; E272-R320 PolarHBondContact OE1-NE 3.06Å; E272-R320 IonicContact OE1-NH2 2.71Å; E272-R320 PolarHBondContact OE1-NH2 3.19Å; E272-R320 IonicContact OE2-CZ 3.86Å; E272-R320 IonicContact OE2-NH2 2.97Å; E272-R320 PolarHBondContact OE2-NH2 3.44Å; M311-R320 WeakPolarHBondContact CE-O 3.46Å; D315-R320 PolarHBondContact OD2-N 3.12Å
321	L	90.4	Very high	92.4	Very high	45 Å²	45	49 Å²	49	24%	0.236	26%	0.264	C	S	.	.			trans	-123.9	149.5	167.8	-60.8	174.6	0	0	0	110	F269 D271 D319	F269-L321 HydrophobicContact CB-CB 4.18Å; F269-L321 HydrophobicContact CB-CD1 4.49Å; F269-L321 HydrophobicContact CD1-CB 3.79Å; F269-L321 HydrophobicContact CD1-CD1 4.17Å; F269-L321 HydrophobicContact CG-CB 4.24Å; F269-L321 HydrophobicContact CG-CD1 4.18Å; D271-L321 HydrophobicContact CB-CD2 3.86Å; D319-L321 VanDerWaalsContact C-N 3.26Å; D319-L321 PolarHBondContact O-N 3.12Å; D319-L321 WeakPolarHBondContact OD1-CB 3.38Å; D319-L321 PolarHBondContact OD1-N 2.65Å
322	V	94.6	Very high	92.5	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	108.5	171.9	166.6	0	0	0	0	109.4	F269 F270 L275 M311 V314 D315 F327	F269-V322 CarbonylContact C-O 3.52Å; F269-V322 WeakPolarHBondContact CA-O 3.35Å; F270-V322 HydrophobicContact CB-CB 4.29Å; F270-V322 PolarHBondContact N-O 2.77Å; F270-V322 PolarHBondContact O-N 2.94Å; L275-V322 HydrophobicContact CD1-CG2 4.25Å; M311-V322 HydrophobicContact SD-CG2 3.75Å; V314-V322 HydrophobicContact CB-CG2 4.11Å; V314-V322 HydrophobicContact CG1-CB 4.38Å; V314-V322 HydrophobicContact CG1-CG1 3.53Å; V314-V322 HydrophobicContact CG1-CG2 3.9Å; D315-V322 HydrophobicContact CB-CG2 4.24Å; V322-F327 HydrophobicContact CG1-CB 3.84Å
323	S	96.4	Very high	92.6	Very high	26 Å²	26	53.3 Å²	53.3	18%	0.182	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	153.8	174.1	73.4	0	0	0	0	112	D325 E326 F327	S323-D325 PolarHBondContact O-N 3.1Å; S323-D325 VanDerWaalsContact O-N 3.16Å; S323-E326 VanDerWaalsContact CB-OE2 3.27Å; S323-E326 WeakPolarHBondContact CB-OE2 3.29Å; S323-E326 PolarHBondContact N-OE2 3.34Å; S323-E326 PolarHBondContact O-N 3.29Å; S323-E326 VanDerWaalsContact O-N 3.09Å; S323-E326 PolarHBondContact OG-N 2.89Å; S323-E326 PolarHBondContact OG-OE2 3.22Å; S323-F327 PolarHBondContact O-N 3.01Å
324	L	96.9	Very high	92.5	Very high	32 Å²	32	55.4 Å²	55.4	17%	0.168	28%	0.284	C	S	.	.	H	α-helix	trans	-53.5	-35.7	174.3	175.9	63.4	0	0	0	113	K256 F259 L328	K256-L324 HydrophobicContact CD-CD2 4.29Å; K256-L324 HydrophobicContact CG-CD1 4.27Å; K256-L324 HydrophobicContact CG-CD2 4.49Å; F259-L324 HydrophobicContact CB-CD1 3.81Å; F259-L324 HydrophobicContact CD1-CB 4.15Å; F259-L324 HydrophobicContact CD1-CD1 3.69Å; F259-L324 HydrophobicContact CD1-CG 4.4Å; F259-L324 HydrophobicContact CD2-CD1 4.08Å; F259-L324 HydrophobicContact CE1-CB 3.83Å; F259-L324 HydrophobicContact CE1-CD1 4.27Å; F259-L324 HydrophobicContact CE2-CB 4.32Å; F259-L324 HydrophobicContact CG-CD1 3.57Å; F259-L324 HydrophobicContact CZ-CB 3.91Å; L324-L328 HydrophobicContact CD1-CD1 3.84Å; L324-L328 HydrophobicContact CD1-CG 3.94Å; L324-L328 HydrophobicContact CG-CD1 3.91Å; L324-L328 HydrophobicContact CG-CG 4.36Å; L324-L328 WeakPolarHBondContact O-CB 3.42Å; L324-L328 WeakPolarHBondContact O-CG 3.2Å; L324-L328 PolarHBondContact O-N 2.9Å
325	D	97.5	Very high	92.3	Very high	123 Å²	123	58.8 Å²	58.8	66%	0.658	30%	0.299	S	S	*	.	H	α-helix	trans	-73.5	-35.4	179.7	-88.8	-19	0	0	0	112	S323 L328 V329	S323-D325 PolarHBondContact O-N 3.1Å; S323-D325 VanDerWaalsContact O-N 3.16Å; D325-L328 PolarHBondContact O-N 3.11Å; D325-V329 VanDerWaalsContact O-CG2 3.32Å; D325-V329 WeakPolarHBondContact O-CG2 3.35Å; D325-V329 PolarHBondContact O-N 3.27Å
326	E	97.3	Very high	92.3	Very high	27 Å²	27	59.3 Å²	59.3	13%	0.126	30%	0.301	C	S	.	.	H	α-helix	trans	-68.4	-45.4	173.2	-76.6	159.9	127.1	0	0	111.6	V314 S316 S323 L328 V329 A330	V314-E326 HydrophobicContact CG1-CB 4.33Å; S316-E326 WeakPolarHBondContact CB-OE1 3.39Å; S316-E326 PolarHBondContact N-OE1 3.15Å; S323-E326 VanDerWaalsContact CB-OE2 3.27Å; S323-E326 WeakPolarHBondContact CB-OE2 3.29Å; S323-E326 PolarHBondContact N-OE2 3.34Å; S323-E326 PolarHBondContact O-N 3.29Å; S323-E326 VanDerWaalsContact O-N 3.09Å; S323-E326 PolarHBondContact OG-N 2.89Å; S323-E326 PolarHBondContact OG-OE2 3.22Å; E326-L328 VanDerWaalsContact C-N 3.32Å; E326-L328 PolarHBondContact O-N 3.31Å; E326-V329 CarbonylContact O-C 3.35Å; E326-V329 WeakPolarHBondContact O-CA 3.38Å; E326-V329 WeakPolarHBondContact O-CB 3.34Å; E326-V329 PolarHBondContact O-N 3.41Å; E326-A330 PolarHBondContact O-N 2.9Å
327	F	97.4	Very high	92.3	Very high	14 Å²	14	59.3 Å²	59.3	6%	0.061	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-43.7	172.5	-179	-96.9	0	0	0	111.9	L238 P255 F258 F259 F270 V322 S323 V329 A330 T331	L238-F327 HydrophobicContact CD1-CE2 3.78Å; L238-F327 HydrophobicContact CD1-CZ 3.63Å; P255-F327 HydrophobicContact CB-CE1 3.79Å; P255-F327 VanDerWaalsContact O-CE1 3.31Å; P255-F327 WeakPolarHBondContact O-CE1 3.34Å; F258-F327 HydrophobicContact CD1-CZ 4.08Å; F259-F327 HydrophobicContact CB-CD1 4.17Å; F259-F327 HydrophobicContact CB-CE1 4.18Å; F259-F327 HydrophobicContact CD2-CB 3.92Å; F259-F327 AromaticContact CD2-CD1 3.8Å; F259-F327 HydrophobicContact CD2-CD1 3.8Å; F259-F327 HydrophobicContact CD2-CD2 4.36Å; F259-F327 HydrophobicContact CD2-CE1 4.42Å; F259-F327 AromaticContact CD2-CG 3.77Å; F259-F327 HydrophobicContact CD2-CG 3.77Å; F259-F327 HydrophobicContact CE2-CB 4.07Å; F259-F327 HydrophobicContact CE2-CG 4.37Å; F259-F327 HydrophobicContact CG-CD1 4.42Å; F270-F327 HydrophobicContact CE2-CD2 4.09Å; F270-F327 HydrophobicContact CE2-CE2 4.01Å; V322-F327 HydrophobicContact CG1-CB 3.84Å; S323-F327 PolarHBondContact O-N 3.01Å; F327-V329 PolarHBondContact O-N 3.11Å; F327-A330 PolarHBondContact O-N 3.48Å; F327-T331 HydrophobicContact CD1-CG2 4.29Å; F327-T331 HydrophobicContact CE1-CG2 3.91Å; F327-T331 HydrophobicContact CE2-CG2 4.43Å; F327-T331 HydrophobicContact CZ-CG2 3.99Å; F327-T331 WeakPolarHBondContact O-CG2 3.4Å; F327-T331 PolarHBondContact O-N 3.21Å; F327-T331 PolarHBondContact O-OG1 3.01Å
328	L	96.9	Very high	92.5	Very high	35 Å²	35	61.3 Å²	61.3	18%	0.183	30%	0.3	C	S	.	.	H	α-helix	trans	-68.4	-20.5	174.1	-72.3	176.9	0	0	0	112.8	P255 K256 L324 D325 E326 T331 K332	P255-L328 HydrophobicContact CB-CD2 4.08Å; K256-L328 HydrophobicContact CB-CD2 4.3Å; L324-L328 HydrophobicContact CD1-CD1 3.84Å; L324-L328 HydrophobicContact CD1-CG 3.94Å; L324-L328 HydrophobicContact CG-CD1 3.91Å; L324-L328 HydrophobicContact CG-CG 4.36Å; L324-L328 WeakPolarHBondContact O-CB 3.42Å; L324-L328 WeakPolarHBondContact O-CG 3.2Å; L324-L328 PolarHBondContact O-N 2.9Å; D325-L328 PolarHBondContact O-N 3.11Å; E326-L328 VanDerWaalsContact C-N 3.32Å; E326-L328 PolarHBondContact O-N 3.31Å; L328-T331 WeakPolarHBondContact CA-OG1 3.31Å; L328-T331 PolarHBondContact O-OG1 3.41Å; L328-K332 WeakPolarHBondContact O-CG 3.46Å; L328-K332 PolarHBondContact O-NZ 2.66Å
329	V	96.4	Very high	92.7	Very high	87 Å²	87	58.4 Å²	58.4	53%	0.527	29%	0.291	S	S	.	.	H	α-helix	trans	-80.1	-43.5	169.5	165.9	0	0	0	0	111.1	D325 E326 F327 T331 K332	D325-V329 VanDerWaalsContact O-CG2 3.32Å; D325-V329 WeakPolarHBondContact O-CG2 3.35Å; D325-V329 PolarHBondContact O-N 3.27Å; E326-V329 CarbonylContact O-C 3.35Å; E326-V329 WeakPolarHBondContact O-CA 3.38Å; E326-V329 WeakPolarHBondContact O-CB 3.34Å; E326-V329 PolarHBondContact O-N 3.41Å; F327-V329 PolarHBondContact O-N 3.11Å; V329-T331 PolarHBondContact O-N 3.06Å; V329-K332 WeakPolarHBondContact O-CB 3.21Å; V329-K332 PolarHBondContact O-N 3.08Å
330	A	95.1	Very high	93	Very high	12 Å²	12	61.8 Å²	61.8	10%	0.099	31%	0.309	C	S	.	.	H	α-helix	trans	-58.5	-44.5	177.5	0	0	0	0	0	112.5	V314 E326 F327 K332 K333	V314-A330 HydrophobicContact CB-CB 4.29Å; V314-A330 HydrophobicContact CG1-CB 3.88Å; V314-A330 HydrophobicContact CG2-CB 3.7Å; E326-A330 PolarHBondContact O-N 2.9Å; F327-A330 PolarHBondContact O-N 3.48Å; A330-K332 PolarHBondContact O-N 3.33Å; A330-K333 VanDerWaalsContact O-CB 3.23Å; A330-K333 WeakPolarHBondContact O-CB 3.35Å; A330-K333 WeakPolarHBondContact O-CG 3.33Å; A330-K333 PolarHBondContact O-N 3.08Å
331	T	94.6	Very high	92.9	Very high	17 Å²	17	62.9 Å²	62.9	10%	0.104	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-3.5	175.6	51.9	0	0	0	0	115	P255 F327 L328 V329 F336	P255-T331 HydrophobicContact CB-CG2 3.87Å; P255-T331 HydrophobicContact CG-CG2 4.17Å; F327-T331 HydrophobicContact CD1-CG2 4.29Å; F327-T331 HydrophobicContact CE1-CG2 3.91Å; F327-T331 HydrophobicContact CE2-CG2 4.43Å; F327-T331 HydrophobicContact CZ-CG2 3.99Å; F327-T331 WeakPolarHBondContact O-CG2 3.4Å; F327-T331 PolarHBondContact O-N 3.21Å; F327-T331 PolarHBondContact O-OG1 3.01Å; L328-T331 WeakPolarHBondContact CA-OG1 3.31Å; L328-T331 PolarHBondContact O-OG1 3.41Å; V329-T331 PolarHBondContact O-N 3.06Å; T331-F336 HydrophobicContact CG2-CD1 4.41Å; T331-F336 HydrophobicContact CG2-CD2 4.13Å; T331-F336 HydrophobicContact CG2-CE1 3.94Å; T331-F336 HydrophobicContact CG2-CE2 3.65Å; T331-F336 HydrophobicContact CG2-CG 4.5Å; T331-F336 HydrophobicContact CG2-CZ 3.55Å; T331-F336 VanDerWaalsContact O-CD1 3.27Å; T331-F336 WeakPolarHBondContact O-CD1 3.4Å
332	K	93.4	Very high	93	Very high	156 Å²	156	62.4 Å²	62.4	68%	0.678	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-3.5	172.3	-58.9	-179.5	-176	80.6	0	113.8	L328 V329 A330	L328-K332 WeakPolarHBondContact O-CG 3.46Å; L328-K332 PolarHBondContact O-NZ 2.66Å; V329-K332 WeakPolarHBondContact O-CB 3.21Å; V329-K332 PolarHBondContact O-N 3.08Å; A330-K332 PolarHBondContact O-N 3.33Å
333	K	93.4	Very high	92.7	Very high	63 Å²	63	67.9 Å²	67.9	27%	0.274	35%	0.346	S	S	.	.	S	Bend	trans	-71.2	166.6	175.4	-66	-177	-175.9	-179.3	0	111	E313 A330 E335	E313-K333 PolarHBondContact O-NZ 2.73Å; E313-K333 IonicContact OE2-NZ 2.75Å; A330-K333 VanDerWaalsContact O-CB 3.23Å; A330-K333 WeakPolarHBondContact O-CB 3.35Å; A330-K333 WeakPolarHBondContact O-CG 3.33Å; A330-K333 PolarHBondContact O-N 3.08Å; K333-E335 WeakPolarHBondContact CB-OE2 3.48Å
334	K	91.6	Very high	92.4	Very high	113 Å²	113	66.8 Å²	66.8	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-72.3	-40.6	176.3	-175.6	-157.9	173.6	-68.9	0	110.1	F336 L337 E338	K334-F336 PolarHBondContact O-N 3.04Å; K334-L337 PolarHBondContact O-N 3.45Å; K334-E338 WeakPolarHBondContact CE-OE2 3.41Å; K334-E338 HydrophobicContact CG-CB 4.43Å; K334-E338 PolarHBondContact NZ-O 2.67Å; K334-E338 IonicContact NZ-OE2 2.62Å; K334-E338 PolarHBondContact NZ-OE2 2.75Å; K334-E338 PolarHBondContact O-N 2.98Å
335	E	89.9	Confident	92	Very high	86 Å²	86	66.1 Å²	66.1	40%	0.402	34%	0.335	S	S	.	.	H	α-helix	trans	-57.3	-36.3	-174.4	-63.2	65.4	-145.8	0	0	110.8	K333 L337 P339	K333-E335 WeakPolarHBondContact CB-OE2 3.48Å; E335-L337 PolarHBondContact O-N 3.3Å; E335-P339 VanDerWaalsContact O-CA 3.28Å; E335-P339 WeakPolarHBondContact O-CA 3.37Å; E335-P339 VanDerWaalsContact O-CB 3.32Å; E335-P339 WeakPolarHBondContact O-CB 3.39Å
336	F	92.6	Very high	91.3	Very high	15 Å²	15	63 Å²	63	7%	0.066	32%	0.317	C	S	.	.	H	α-helix	trans	-64.5	-36.7	172.9	-178.7	-108.1	0	0	0	114.5	G233 Q235 L238 F253 T331 K334	G233-F336 WeakPolarHBondContact O-CD2 3.32Å; G233-F336 WeakPolarHBondContact O-CE2 3.5Å; Q235-F336 HydrophobicContact CB-CD1 4Å; Q235-F336 HydrophobicContact CB-CD2 4.5Å; Q235-F336 HydrophobicContact CB-CE1 3.58Å; Q235-F336 HydrophobicContact CB-CE2 4.12Å; Q235-F336 HydrophobicContact CB-CG 4.44Å; Q235-F336 HydrophobicContact CB-CZ 3.64Å; Q235-F336 VanDerWaalsContact CB-O 3.32Å; Q235-F336 WeakPolarHBondContact CB-O 3.41Å; Q235-F336 HydrophobicContact CG-CE1 3.79Å; Q235-F336 HydrophobicContact CG-CZ 3.91Å; Q235-F336 PolarHBondContact N-O 3.44Å; L238-F336 HydrophobicContact CD1-CE2 3.89Å; L238-F336 HydrophobicContact CD1-CZ 4.45Å; F253-F336 HydrophobicContact CE1-CZ 4.33Å; T331-F336 HydrophobicContact CG2-CD1 4.41Å; T331-F336 HydrophobicContact CG2-CD2 4.13Å; T331-F336 HydrophobicContact CG2-CE1 3.94Å; T331-F336 HydrophobicContact CG2-CE2 3.65Å; T331-F336 HydrophobicContact CG2-CG 4.5Å; T331-F336 HydrophobicContact CG2-CZ 3.55Å; T331-F336 VanDerWaalsContact O-CD1 3.27Å; T331-F336 WeakPolarHBondContact O-CD1 3.4Å; K334-F336 PolarHBondContact O-N 3.04Å
337	L	90.8	Very high	90.6	Very high	91 Å²	91	67.4 Å²	67.4	48%	0.476	34%	0.338	S	S	.	.	H	α-helix	trans	-98.1	-33.7	-171.2	-61.4	174.9	0	0	0	113.2	Q235 K334 E335 P339	Q235-L337 VanDerWaalsContact OE1-CD2 3.31Å; K334-L337 PolarHBondContact O-N 3.45Å; E335-L337 PolarHBondContact O-N 3.3Å; L337-P339 VanDerWaalsContact C-CD 3.45Å
338	E	88	Confident	89.9	Confident	126 Å²	126	70.6 Å²	70.6	59%	0.589	36%	0.355	S	S	*	.	S	Bend	trans	-130.9	67.7	178.3	-67.5	-178.5	-174.3	0	0	108.9	K334	K334-E338 WeakPolarHBondContact CE-OE2 3.41Å; K334-E338 HydrophobicContact CG-CB 4.43Å; K334-E338 PolarHBondContact NZ-O 2.67Å; K334-E338 IonicContact NZ-OE2 2.62Å; K334-E338 PolarHBondContact NZ-OE2 2.75Å; K334-E338 PolarHBondContact O-N 2.98Å
339	P	87.7	Confident	89.2	Confident	35 Å²	35	74.5 Å²	74.5	23%	0.227	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-70.7	152.6	177.7	29.9	-37	0	0	0	112.1	H231 E335 L337	H231-P339 HydrophobicContact CB-CB 3.46Å; H231-P339 VanDerWaalsContact CB-CB 3.46Å; H231-P339 HydrophobicContact CB-CG 4.05Å; E335-P339 VanDerWaalsContact O-CA 3.28Å; E335-P339 WeakPolarHBondContact O-CA 3.37Å; E335-P339 VanDerWaalsContact O-CB 3.32Å; E335-P339 WeakPolarHBondContact O-CB 3.39Å; L337-P339 VanDerWaalsContact C-CD 3.45Å
340	D	86.5	Confident	88.8	Confident	135 Å²	135	72 Å²	72	72%	0.722	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-75.2	167.1	164.7	-71.6	-47.2	0	0	0	111	H231	H231-D340 PolarHBondContact ND1-O 3.48Å
341	S	84.3	Confident	88.7	Confident	81 Å²	81	72.4 Å²	72.4	57%	0.566	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-65.7	137.3	175.7	42.8	0	0	0	0	111.6
342	W	91.7	Very high	88.7	Confident	35 Å²	35	75.4 Å²	75.4	13%	0.133	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-68.2	135.8	166.1	-170.1	-111.3	0	0	0	110	P232 E302 R305 M306 H309	P232-W342 HydrophobicContact CG-CD2 3.91Å; P232-W342 HydrophobicContact CG-CE3 3.72Å; P232-W342 HydrophobicContact CG-CH2 4.1Å; P232-W342 HydrophobicContact CG-CZ2 4.27Å; P232-W342 HydrophobicContact CG-CZ3 3.83Å; E302-W342 WeakPolarHBondContact OE1-CZ2 2.92Å; E302-W342 PolarHBondContact OE1-NE1 2.85Å; R305-W342 HydrophobicContact CB-CH2 4.4Å; R305-W342 HydrophobicContact CB-CZ2 3.95Å; M306-W342 HydrophobicContact CG-CZ2 3.84Å; H309-W342 HydrophobicContact CB-CH2 3.8Å; H309-W342 HydrophobicContact CB-CZ3 3.88Å; H309-W342 AromaticContact CD2-CZ3 3.92Å; H309-W342 AromaticContact CG-CZ3 3.69Å
343	E	89.1	Confident	88.6	Confident	116 Å²	116	74.1 Å²	74.1	54%	0.542	38%	0.379	S	S	.	.			trans	-102	107.6	175.5	-66.2	-177.3	165.7	0	0	108.3	R305	R305-E343 PolarHBondContact NH1-O 2.92Å; R305-E343 PolarHBondContact NH2-O 3.02Å
344	T	89.1	Confident	88.8	Confident	4 Å²	4	75.9 Å²	75.9	3%	0.025	39%	0.388	C	S	.	.			trans	-69.5	162.2	-178	51	0	0	0	0	112.3	I286 E302 E346 Q347 N348	I286-T344 HydrophobicContact CD1-CG2 4.07Å; E302-T344 WeakPolarHBondContact OE2-CA 3.44Å; T344-E346 PolarHBondContact O-N 3.33Å; T344-Q347 WeakPolarHBondContact O-CB 3.46Å; T344-Q347 PolarHBondContact O-N 3.39Å; T344-N348 PolarHBondContact O-N 3.42Å
345	L	88.8	Confident	88.9	Confident	18 Å²	18	73.5 Å²	73.5	9%	0.094	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-51.2	-38.7	176.4	-75.2	171.9	0	0	0	113.3	F186 E298 E301 E302 Q347 N348	F186-L345 HydrophobicContact CE1-CD1 4.3Å; F186-L345 HydrophobicContact CE1-CD2 3.96Å; F186-L345 HydrophobicContact CZ-CD1 3.92Å; F186-L345 HydrophobicContact CZ-CD2 4.36Å; E298-L345 HydrophobicContact CB-CD1 3.99Å; E298-L345 WeakPolarHBondContact O-CD1 3.16Å; E301-L345 HydrophobicContact CB-CD1 4.04Å; E301-L345 HydrophobicContact CG-CD1 4.07Å; E301-L345 HydrophobicContact CG-CD2 4.23Å; E302-L345 HydrophobicContact CB-CD1 4Å; E302-L345 HydrophobicContact CB-CG 4.48Å; E302-L345 PolarHBondContact OE2-N 2.88Å; L345-Q347 PolarHBondContact O-N 2.95Å; L345-Q347 VanDerWaalsContact O-N 3.12Å; L345-N348 CarbonylContact O-C 3.58Å; L345-N348 PolarHBondContact O-N 2.68Å; L345-N348 VanDerWaalsContact O-N 3.08Å
346	E	83.2	Confident	89.2	Confident	58 Å²	58	69.4 Å²	69.4	27%	0.271	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-57.9	-26.8	177	-166.7	-99	135.7	0	0	113.6	K220 T344	K220-E346 WeakPolarHBondContact CE-OE1 3.44Å; K220-E346 IonicContact NZ-OE1 3.58Å; K220-E346 PolarHBondContact NZ-OE1 3.4Å; K220-E346 VanDerWaalsContact NZ-OE1 3.09Å; T344-E346 PolarHBondContact O-N 3.33Å
347	Q	82.2	Confident	89.4	Confident	119 Å²	119	73.3 Å²	73.3	56%	0.556	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-96	-21.3	179.9	-58.2	175.3	14.3	0	0	112.8	T344 L345	T344-Q347 WeakPolarHBondContact O-CB 3.46Å; T344-Q347 PolarHBondContact O-N 3.39Å; L345-Q347 PolarHBondContact O-N 2.95Å; L345-Q347 VanDerWaalsContact O-N 3.12Å
348	N	82.8	Confident	89.7	Confident	81 Å²	81	74.3 Å²	74.3	43%	0.433	38%	0.376	S	S	.	.	S	Bend	trans	-125.6	79.8	-174.6	-177.9	38.1	0	0	0	111.1	T344 L345 A350	T344-N348 PolarHBondContact O-N 3.42Å; L345-N348 CarbonylContact O-C 3.58Å; L345-N348 PolarHBondContact O-N 2.68Å; L345-N348 VanDerWaalsContact O-N 3.08Å; N348-A350 PolarHBondContact O-N 3.16Å
349	Q	82.8	Confident	90.1	Very high	117 Å²	117	69.8 Å²	69.8	55%	0.547	35%	0.354	S	S	.	.			trans	-54.5	125.9	-176.2	-171.8	-176.9	-9.7	0	0	112.7	Y351	Q349-Y351 VanDerWaalsContact C-N 3.27Å; Q349-Y351 VanDerWaalsContact CD-O 3.28Å; Q349-Y351 WeakPolarHBondContact CG-O 3.31Å; Q349-Y351 PolarHBondContact NE2-O 3.43Å; Q349-Y351 PolarHBondContact O-N 3.35Å
350	A	87.4	Confident	90.5	Very high	34 Å²	34	70.6 Å²	70.6	28%	0.281	36%	0.355	S	S	.	.	S	Bend	trans	-66.1	-21.1	-173.4	0	0	0	0	0	115.3	F186 K187 N348	F186-A350 HydrophobicContact CD1-CB 4.09Å; F186-A350 HydrophobicContact CE1-CB 3.85Å; K187-A350 WeakPolarHBondContact CE-O 3.34Å; N348-A350 PolarHBondContact O-N 3.16Å
351	Y	92.1	Very high	90.9	Very high	20 Å²	20	68.9 Å²	68.9	8%	0.078	34%	0.343	C	S	.	.	S	Bend	trans	-136.3	157.5	-177.8	63.1	-93.5	0	0	0	112.1	E190 M191 E194 Q349 M356	E190-Y351 HydrophobicContact CB-CD1 4.07Å; E190-Y351 HydrophobicContact CB-CE1 3.89Å; M191-Y351 HydrophobicContact CG-CD1 3.55Å; M191-Y351 HydrophobicContact CG-CD2 3.94Å; M191-Y351 HydrophobicContact CG-CE1 4.01Å; M191-Y351 HydrophobicContact CG-CE2 4.36Å; M191-Y351 HydrophobicContact CG-CG 3.52Å; M191-Y351 HydrophobicContact SD-CG 4.18Å; E194-Y351 VanDerWaalsContact CB-OH 3.29Å; E194-Y351 WeakPolarHBondContact CB-OH 3.4Å; E194-Y351 WeakPolarHBondContact CG-OH 3.44Å; Q349-Y351 VanDerWaalsContact C-N 3.27Å; Q349-Y351 VanDerWaalsContact CD-O 3.28Å; Q349-Y351 WeakPolarHBondContact CG-O 3.31Å; Q349-Y351 PolarHBondContact NE2-O 3.43Å; Q349-Y351 PolarHBondContact O-N 3.35Å; Y351-M356 HydrophobicContact CD2-CB 3.85Å; Y351-M356 HydrophobicContact CE2-CB 3.82Å; Y351-M356 HydrophobicContact CE2-CG 4.05Å; Y351-M356 HydrophobicContact CE2-SD 4.05Å
352	T	94.4	Very high	91.5	Very high	80 Å²	80	70.1 Å²	70.1	49%	0.491	34%	0.339	S	S	.	.			trans	-94.5	158.2	173.2	61.3	0	0	0	0	112.5	E354 E355 M356	T352-E354 PolarHBondContact O-N 2.84Å; T352-E354 VanDerWaalsContact O-N 3.09Å; T352-E355 WeakPolarHBondContact CB-OE2 3.46Å; T352-E355 WeakPolarHBondContact CG2-OE2 3.3Å; T352-E355 PolarHBondContact N-OE2 3.21Å; T352-E355 PolarHBondContact O-N 2.92Å; T352-E355 VanDerWaalsContact O-N 3.11Å; T352-E355 WeakPolarHBondContact OG1-CG 3.47Å; T352-E355 PolarHBondContact OG1-N 3.02Å; T352-E355 PolarHBondContact OG1-OE2 2.97Å; T352-M356 PolarHBondContact O-N 3.08Å
353	D	93.4	Very high	91.6	Very high	129 Å²	129	69.8 Å²	69.8	69%	0.69	34%	0.34	S	S	*	.	H	α-helix	trans	-52.6	-31.7	176	-71.8	-35.9	0	0	0	113.7	R357	D353-R357 WeakPolarHBondContact O-CB 3.5Å; D353-R357 PolarHBondContact O-N 3.1Å
354	E	95.9	Very high	91.9	Very high	101 Å²	101	66.3 Å²	66.3	47%	0.472	33%	0.331	S	S	.	.	H	α-helix	trans	-79	-38.7	179.7	-173.7	67.3	177	0	0	112	T352 M356 R357 E358	T352-E354 PolarHBondContact O-N 2.84Å; T352-E354 VanDerWaalsContact O-N 3.09Å; E354-M356 VanDerWaalsContact C-N 3.31Å; E354-M356 PolarHBondContact O-N 3.09Å; E354-R357 VanDerWaalsContact CD-NE 3.26Å; E354-R357 WeakPolarHBondContact O-CB 3.21Å; E354-R357 PolarHBondContact O-N 3.04Å; E354-R357 IonicContact OE1-CZ 2.67Å; E354-R357 IonicContact OE1-NE 3.57Å; E354-R357 PolarHBondContact OE1-NE 3.38Å; E354-R357 IonicContact OE1-NH2 3.78Å; E354-R357 PolarHBondContact OE1-NH2 2.93Å; E354-R357 WeakPolarHBondContact OE2-CD 3.25Å; E354-R357 IonicContact OE2-CZ 3.26Å; E354-R357 IonicContact OE2-NE 3.79Å; E354-R357 PolarHBondContact OE2-NE 3.18Å; E354-R357 IonicContact OE2-NH2 3.57Å; E354-E358 WeakPolarHBondContact O-CG 3.38Å; E354-E358 PolarHBondContact O-N 3.07Å
355	E	95.1	Very high	92.2	Very high	62 Å²	62	71.3 Å²	71.3	29%	0.29	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-42.3	170.9	-73.1	164.3	109.7	0	0	110.8	K187 M191 T352 R357 E358 F359	K187-E355 IonicContact NZ-OE1 3.72Å; K187-E355 PolarHBondContact NZ-OE1 2.93Å; M191-E355 HydrophobicContact SD-CB 4.22Å; T352-E355 WeakPolarHBondContact CB-OE2 3.46Å; T352-E355 WeakPolarHBondContact CG2-OE2 3.3Å; T352-E355 PolarHBondContact N-OE2 3.21Å; T352-E355 PolarHBondContact O-N 2.92Å; T352-E355 VanDerWaalsContact O-N 3.11Å; T352-E355 WeakPolarHBondContact OG1-CG 3.47Å; T352-E355 PolarHBondContact OG1-N 3.02Å; T352-E355 PolarHBondContact OG1-OE2 2.97Å; E355-R357 VanDerWaalsContact C-N 3.32Å; E355-R357 PolarHBondContact O-N 3.21Å; E355-E358 PolarHBondContact O-N 3.02Å; E355-F359 WeakPolarHBondContact O-CB 3.39Å; E355-F359 PolarHBondContact O-N 2.96Å
356	M	96.3	Very high	92.4	Very high	0 Å²	0	75 Å²	75	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-61.1	-40.8	174.1	-174.3	64.7	-166.3	0	0	111.9	M191 E194 H195 R198 Y351 T352 E354 F359 E360	M191-M356 HydrophobicContact CB-SD 3.76Å; M191-M356 HydrophobicContact CG-SD 3.87Å; M191-M356 WeakPolarHBondContact O-CE 3.45Å; E194-M356 HydrophobicContact CB-CE 4.07Å; E194-M356 HydrophobicContact CB-SD 4.49Å; E194-M356 HydrophobicContact CG-CE 3.76Å; E194-M356 HydrophobicContact CG-SD 4.31Å; H195-M356 HydrophobicContact CB-CE 3.87Å; R198-M356 VanDerWaalsContact NH1-CG 3.33Å; Y351-M356 HydrophobicContact CD2-CB 3.85Å; Y351-M356 HydrophobicContact CE2-CB 3.82Å; Y351-M356 HydrophobicContact CE2-CG 4.05Å; Y351-M356 HydrophobicContact CE2-SD 4.05Å; T352-M356 PolarHBondContact O-N 3.08Å; E354-M356 VanDerWaalsContact C-N 3.31Å; E354-M356 PolarHBondContact O-N 3.09Å; M356-F359 PolarHBondContact O-N 3.42Å; M356-E360 HydrophobicContact CE-CG 3.94Å; M356-E360 WeakPolarHBondContact CE-OE1 3.25Å; M356-E360 WeakPolarHBondContact O-CG 3.29Å; M356-E360 PolarHBondContact O-N 3.09Å
357	R	96.1	Very high	92.9	Very high	97 Å²	97	77.9 Å²	77.9	37%	0.366	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-41	176.5	-168.5	-158.2	60.5	61.7	-0.1	112.1	D353 E354 E355 F359 E361	D353-R357 WeakPolarHBondContact O-CB 3.5Å; D353-R357 PolarHBondContact O-N 3.1Å; E354-R357 VanDerWaalsContact CD-NE 3.26Å; E354-R357 WeakPolarHBondContact O-CB 3.21Å; E354-R357 PolarHBondContact O-N 3.04Å; E354-R357 IonicContact OE1-CZ 2.67Å; E354-R357 IonicContact OE1-NE 3.57Å; E354-R357 PolarHBondContact OE1-NE 3.38Å; E354-R357 IonicContact OE1-NH2 3.78Å; E354-R357 PolarHBondContact OE1-NH2 2.93Å; E354-R357 WeakPolarHBondContact OE2-CD 3.25Å; E354-R357 IonicContact OE2-CZ 3.26Å; E354-R357 IonicContact OE2-NE 3.79Å; E354-R357 PolarHBondContact OE2-NE 3.18Å; E354-R357 IonicContact OE2-NH2 3.57Å; E355-R357 VanDerWaalsContact C-N 3.32Å; E355-R357 PolarHBondContact O-N 3.21Å; R357-F359 VanDerWaalsContact C-N 3.35Å; R357-E361 IonicContact CZ-OE2 2.87Å; R357-E361 IonicContact NH1-OE2 2.65Å; R357-E361 PolarHBondContact NH1-OE2 3.2Å; R357-E361 WeakPolarHBondContact O-CB 3.26Å; R357-E361 PolarHBondContact O-N 3.12Å; R357-E361 VanDerWaalsContact O-N 3.07Å
358	E	96.6	Very high	93.5	Very high	112 Å²	112	78.5 Å²	78.5	52%	0.523	39%	0.387	S	S	.	.	H	α-helix	trans	-68.4	-34.6	175.3	-69.9	-171.5	161.3	0	0	111.8	E354 E355 E361 H362	E354-E358 WeakPolarHBondContact O-CG 3.38Å; E354-E358 PolarHBondContact O-N 3.07Å; E355-E358 PolarHBondContact O-N 3.02Å; E358-E361 PolarHBondContact O-N 3.03Å; E358-H362 WeakPolarHBondContact O-CB 3.48Å; E358-H362 PolarHBondContact O-N 2.76Å
359	F	96.3	Very high	94	Very high	31 Å²	31	78.5 Å²	78.5	14%	0.136	39%	0.387	C	S	.	.	H	α-helix	trans	-67.2	-48.3	174.8	-175.4	-102.7	0	0	0	112.5	M191 M192 E355 M356 R357 E361 H362 L363	M191-F359 HydrophobicContact CB-CD1 3.61Å; M191-F359 HydrophobicContact CB-CD2 4.46Å; M191-F359 HydrophobicContact CB-CE1 3.72Å; M191-F359 HydrophobicContact CB-CG 3.99Å; M191-F359 HydrophobicContact CB-CZ 4.2Å; M191-F359 HydrophobicContact CE-CB 4.1Å; M191-F359 HydrophobicContact CE-CD2 3.66Å; M191-F359 HydrophobicContact CE-CE2 4.18Å; M191-F359 HydrophobicContact CE-CG 3.9Å; M191-F359 HydrophobicContact SD-CB 3.89Å; M191-F359 HydrophobicContact SD-CD2 4.49Å; M191-F359 HydrophobicContact SD-CG 4.13Å; M192-F359 HydrophobicContact CB-CE1 4.33Å; M192-F359 HydrophobicContact CB-CZ 4.21Å; M192-F359 HydrophobicContact CE-CZ 4.04Å; M192-F359 HydrophobicContact SD-CE1 4.36Å; M192-F359 HydrophobicContact SD-CZ 4.37Å; E355-F359 WeakPolarHBondContact O-CB 3.39Å; E355-F359 PolarHBondContact O-N 2.96Å; M356-F359 PolarHBondContact O-N 3.42Å; R357-F359 VanDerWaalsContact C-N 3.35Å; F359-E361 VanDerWaalsContact C-N 3.29Å; F359-E361 PolarHBondContact O-N 2.87Å; F359-H362 PolarHBondContact O-N 2.88Å; F359-L363 HydrophobicContact CD1-CD1 3.89Å; F359-L363 HydrophobicContact CD1-CG 4.45Å; F359-L363 HydrophobicContact CE1-CD1 3.5Å; F359-L363 HydrophobicContact CE1-CG 4.25Å; F359-L363 HydrophobicContact CZ-CD1 4.02Å; F359-L363 HydrophobicContact CZ-CG 4.43Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 3.41Å
360	E	95.8	Very high	94.5	Very high	52 Å²	52	77.3 Å²	77.3	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-58.2	-40.5	172.6	-72.1	-174.6	-173.1	0	0	111.6	R198 M356 A364	R198-E360 WeakPolarHBondContact CD-OE1 3.41Å; R198-E360 IonicContact CZ-OE1 2.72Å; R198-E360 IonicContact NE-OE1 2.64Å; R198-E360 IonicContact NH1-OE1 2.99Å; R198-E360 PolarHBondContact NH1-OE1 3.36Å; M356-E360 HydrophobicContact CE-CG 3.94Å; M356-E360 WeakPolarHBondContact CE-OE1 3.25Å; M356-E360 WeakPolarHBondContact O-CG 3.29Å; M356-E360 PolarHBondContact O-N 3.09Å; E360-A364 WeakPolarHBondContact O-CB 3.4Å; E360-A364 PolarHBondContact O-N 2.72Å
361	E	96.5	Very high	94.8	Very high	99 Å²	99	79.5 Å²	79.5	46%	0.463	39%	0.391	S	S	.	.	H	α-helix	trans	-65.7	-40.3	176.9	-176.6	171.2	-177	0	0	112.2	R357 E358 F359 Q365	R357-E361 IonicContact CZ-OE2 2.87Å; R357-E361 IonicContact NH1-OE2 2.65Å; R357-E361 PolarHBondContact NH1-OE2 3.2Å; R357-E361 WeakPolarHBondContact O-CB 3.26Å; R357-E361 PolarHBondContact O-N 3.12Å; R357-E361 VanDerWaalsContact O-N 3.07Å; E358-E361 PolarHBondContact O-N 3.03Å; F359-E361 VanDerWaalsContact C-N 3.29Å; F359-E361 PolarHBondContact O-N 2.87Å; E361-Q365 VanDerWaalsContact O-CG 3.31Å; E361-Q365 WeakPolarHBondContact O-CG 3.49Å; E361-Q365 PolarHBondContact O-N 2.95Å; E361-Q365 VanDerWaalsContact O-N 3.11Å
362	H	95.4	Very high	95	Very high	107 Å²	107	83.2 Å²	83.2	50%	0.495	41%	0.409	S	S	.	.	H	α-helix	trans	-67	-43.9	175.5	179.8	-91.1	0	0	0	112.4	E358 F359 A364 Q365 Q366	E358-H362 WeakPolarHBondContact O-CB 3.48Å; E358-H362 PolarHBondContact O-N 2.76Å; F359-H362 PolarHBondContact O-N 2.88Å; H362-A364 PolarHBondContact O-N 2.85Å; H362-Q365 PolarHBondContact O-N 2.8Å; H362-Q366 WeakPolarHBondContact O-CB 3.49Å; H362-Q366 PolarHBondContact O-N 2.76Å
363	L	94.4	Very high	94.9	Very high	29 Å²	29	86.4 Å²	86.4	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-59.8	-45.7	175.6	-72.1	178.4	0	0	0	111.5	M192 F359 Q365 Q366 E367	M192-L363 HydrophobicContact CE-CD1 4.28Å; M192-L363 HydrophobicContact CE-CD2 4.02Å; M192-L363 HydrophobicContact SD-CD1 4.02Å; F359-L363 HydrophobicContact CD1-CD1 3.89Å; F359-L363 HydrophobicContact CD1-CG 4.45Å; F359-L363 HydrophobicContact CE1-CD1 3.5Å; F359-L363 HydrophobicContact CE1-CG 4.25Å; F359-L363 HydrophobicContact CZ-CD1 4.02Å; F359-L363 HydrophobicContact CZ-CG 4.43Å; F359-L363 WeakPolarHBondContact O-CG 3.28Å; F359-L363 PolarHBondContact O-N 3.41Å; L363-Q365 VanDerWaalsContact C-N 3.29Å; L363-Q365 PolarHBondContact O-N 2.74Å; L363-Q366 PolarHBondContact O-N 2.94Å; L363-Q366 VanDerWaalsContact O-N 3.15Å; L363-E367 PolarHBondContact O-N 3.07Å
364	A	94.8	Very high	94.9	Very high	43 Å²	43	84.3 Å²	84.3	36%	0.355	41%	0.405	S	S	.	.	H	α-helix	trans	-63.7	-31.8	177.7	0	0	0	0	0	113.1	E360 H362 Q368	E360-A364 WeakPolarHBondContact O-CB 3.4Å; E360-A364 PolarHBondContact O-N 2.72Å; H362-A364 PolarHBondContact O-N 2.85Å; A364-Q368 VanDerWaalsContact O-CG 3.29Å; A364-Q368 WeakPolarHBondContact O-CG 3.26Å; A364-Q368 PolarHBondContact O-N 3.24Å; A364-Q368 PolarHBondContact O-NE2 2.96Å
365	Q	95.8	Very high	94.9	Very high	108 Å²	108	82.7 Å²	82.7	51%	0.505	40%	0.401	S	S	.	.	H	α-helix	trans	-70.4	-44.3	171.4	-72	175.9	37.1	0	0	111.4	E361 H362 L363 E367 Q368 D369	E361-Q365 VanDerWaalsContact O-CG 3.31Å; E361-Q365 WeakPolarHBondContact O-CG 3.49Å; E361-Q365 PolarHBondContact O-N 2.95Å; E361-Q365 VanDerWaalsContact O-N 3.11Å; H362-Q365 PolarHBondContact O-N 2.8Å; L363-Q365 VanDerWaalsContact C-N 3.29Å; L363-Q365 PolarHBondContact O-N 2.74Å; Q365-E367 PolarHBondContact O-N 2.93Å; Q365-Q368 PolarHBondContact O-N 3Å; Q365-D369 PolarHBondContact O-N 3.46Å
366	Q	92.7	Very high	94.9	Very high	97 Å²	97	82.7 Å²	82.7	45%	0.453	40%	0.403	S	S	.	.	H	α-helix	trans	-63	-40.5	178.7	-171.6	175.2	11.3	0	0	112.1	H362 L363 D369 L370	H362-Q366 WeakPolarHBondContact O-CB 3.49Å; H362-Q366 PolarHBondContact O-N 2.76Å; L363-Q366 PolarHBondContact O-N 2.94Å; L363-Q366 VanDerWaalsContact O-N 3.15Å; Q366-D369 PolarHBondContact O-N 2.9Å; Q366-L370 HydrophobicContact CG-CD1 4.28Å; Q366-L370 WeakPolarHBondContact O-CB 3.42Å; Q366-L370 WeakPolarHBondContact O-CG 2.8Å; Q366-L370 PolarHBondContact O-N 3.32Å
367	E	93.4	Very high	94.8	Very high	118 Å²	118	87.9 Å²	87.9	55%	0.551	43%	0.43	S	S	*	.	H	α-helix	trans	-63.6	-43.3	175.7	-160.5	-130.8	141.9	0	0	111.6	L363 Q365 D369 L370 N371	L363-E367 PolarHBondContact O-N 3.07Å; Q365-E367 PolarHBondContact O-N 2.93Å; E367-D369 VanDerWaalsContact C-N 3.33Å; E367-D369 PolarHBondContact O-N 3.01Å; E367-L370 PolarHBondContact O-N 3.4Å; E367-N371 WeakPolarHBondContact O-CB 3.49Å; E367-N371 PolarHBondContact O-N 3.43Å; E367-N371 PolarHBondContact O-ND2 2.82Å; E367-N371 PolarHBondContact OE1-ND2 2.87Å
368	Q	94.9	Very high	94.7	Very high	131 Å²	131	88.7 Å²	88.7	61%	0.612	44%	0.439	S	S	*	.	H	α-helix	trans	-61.4	-41.4	174.6	-75.2	170.1	56.5	0	0	112	A364 Q365 N371 Q372	A364-Q368 VanDerWaalsContact O-CG 3.29Å; A364-Q368 WeakPolarHBondContact O-CG 3.26Å; A364-Q368 PolarHBondContact O-N 3.24Å; A364-Q368 PolarHBondContact O-NE2 2.96Å; Q365-Q368 PolarHBondContact O-N 3Å; Q368-N371 PolarHBondContact O-N 3.12Å; Q368-Q372 WeakPolarHBondContact O-CB 3.41Å; Q368-Q372 PolarHBondContact O-N 2.95Å
369	D	94.9	Very high	94.6	Very high	81 Å²	81	88.4 Å²	88.4	43%	0.433	44%	0.436	S	S	.	.	H	α-helix	trans	-67.6	-40.2	179.3	-140.4	65	0	0	0	111.7	Q365 Q366 E367 Q372 R373	Q365-D369 PolarHBondContact O-N 3.46Å; Q366-D369 PolarHBondContact O-N 2.9Å; E367-D369 VanDerWaalsContact C-N 3.33Å; E367-D369 PolarHBondContact O-N 3.01Å; D369-Q372 PolarHBondContact O-N 2.99Å; D369-R373 WeakPolarHBondContact O-CB 3.41Å; D369-R373 WeakPolarHBondContact O-CD 3.35Å; D369-R373 WeakPolarHBondContact O-CG 3.39Å; D369-R373 PolarHBondContact O-N 2.65Å; D369-R373 IonicContact OD2-CZ 3.7Å; D369-R373 VanDerWaalsContact OD2-CZ 3.22Å; D369-R373 IonicContact OD2-NE 2.77Å; D369-R373 PolarHBondContact OD2-NE 3.19Å; D369-R373 IonicContact OD2-NH2 3.16Å; D369-R373 PolarHBondContact OD2-NH2 3.19Å
370	L	92.4	Very high	94.5	Very high	92 Å²	92	92.6 Å²	92.6	48%	0.482	46%	0.455	S	S	.	.	H	α-helix	trans	-67.3	-41.3	173.8	-71.7	172.6	0	0	0	112.6	Q366 E367 R373 T374	Q366-L370 HydrophobicContact CG-CD1 4.28Å; Q366-L370 WeakPolarHBondContact O-CB 3.42Å; Q366-L370 WeakPolarHBondContact O-CG 2.8Å; Q366-L370 PolarHBondContact O-N 3.32Å; E367-L370 PolarHBondContact O-N 3.4Å; L370-R373 PolarHBondContact O-N 2.93Å; L370-T374 WeakPolarHBondContact O-CB 3.32Å; L370-T374 PolarHBondContact O-N 3.18Å; L370-T374 PolarHBondContact O-OG1 2.75Å
371	N	94.1	Very high	94.4	Very high	80 Å²	80	97 Å²	97	43%	0.428	47%	0.47	S	S	.	.	H	α-helix	trans	-62	-44.6	174	-82	-53.8	0	0	0	111.4	E367 Q368 T374 V375	E367-N371 WeakPolarHBondContact O-CB 3.49Å; E367-N371 PolarHBondContact O-N 3.43Å; E367-N371 PolarHBondContact O-ND2 2.82Å; E367-N371 PolarHBondContact OE1-ND2 2.87Å; Q368-N371 PolarHBondContact O-N 3.12Å; N371-T374 PolarHBondContact O-N 3.14Å; N371-V375 WeakPolarHBondContact O-CG2 3.46Å; N371-V375 PolarHBondContact O-N 2.67Å
372	Q	95.6	Very high	94.4	Very high	98 Å²	98	95.5 Å²	95.5	46%	0.458	46%	0.463	S	S	.	.	H	α-helix	trans	-62.5	-45.3	176.5	179.8	58.6	49	0	0	111.7	Q368 D369 T374 V375 D376	Q368-Q372 WeakPolarHBondContact O-CB 3.41Å; Q368-Q372 PolarHBondContact O-N 2.95Å; D369-Q372 PolarHBondContact O-N 2.99Å; Q372-T374 VanDerWaalsContact C-N 3.32Å; Q372-T374 PolarHBondContact O-N 3.45Å; Q372-V375 PolarHBondContact O-N 2.9Å; Q372-D376 VanDerWaalsContact NE2-CG 3.31Å; Q372-D376 PolarHBondContact NE2-OD1 2.93Å; Q372-D376 PolarHBondContact NE2-OD2 2.75Å; Q372-D376 PolarHBondContact O-N 3.15Å
373	R	93.2	Very high	94.4	Very high	148 Å²	148	94.4 Å²	94.4	56%	0.558	46%	0.458	S	S	*	.	H	α-helix	trans	-59.7	-41.5	174.4	-69.8	165.9	-164.2	-154.3	7.9	111.8	D369 L370 D376 L377	D369-R373 WeakPolarHBondContact O-CB 3.41Å; D369-R373 WeakPolarHBondContact O-CD 3.35Å; D369-R373 WeakPolarHBondContact O-CG 3.39Å; D369-R373 PolarHBondContact O-N 2.65Å; D369-R373 IonicContact OD2-CZ 3.7Å; D369-R373 VanDerWaalsContact OD2-CZ 3.22Å; D369-R373 IonicContact OD2-NE 2.77Å; D369-R373 PolarHBondContact OD2-NE 3.19Å; D369-R373 IonicContact OD2-NH2 3.16Å; D369-R373 PolarHBondContact OD2-NH2 3.19Å; L370-R373 PolarHBondContact O-N 2.93Å; R373-D376 PolarHBondContact O-N 2.85Å; R373-L377 WeakPolarHBondContact O-CB 3.33Å; R373-L377 VanDerWaalsContact O-CG 3.31Å; R373-L377 WeakPolarHBondContact O-CG 3.49Å; R373-L377 PolarHBondContact O-N 2.72Å
374	T	93.3	Very high	94.4	Very high	85 Å²	85	98.3 Å²	98.3	52%	0.521	48%	0.479	S	S	.	.	H	α-helix	trans	-62.9	-44.8	177.3	-59.4	0	0	0	0	111.4	L370 N371 Q372 D376 L377 Q378	L370-T374 WeakPolarHBondContact O-CB 3.32Å; L370-T374 PolarHBondContact O-N 3.18Å; L370-T374 PolarHBondContact O-OG1 2.75Å; N371-T374 PolarHBondContact O-N 3.14Å; Q372-T374 VanDerWaalsContact C-N 3.32Å; Q372-T374 PolarHBondContact O-N 3.45Å; T374-D376 VanDerWaalsContact C-N 3.33Å; T374-D376 PolarHBondContact O-N 2.83Å; T374-L377 PolarHBondContact O-N 2.99Å; T374-Q378 PolarHBondContact O-N 2.98Å
375	V	95.9	Very high	94.3	Very high	67 Å²	67	100.9 Å²	100.9	41%	0.406	48%	0.483	S	S	.	.	H	α-helix	trans	-62.5	-37.7	175.5	165.2	0	0	0	0	112	N371 Q372 K379	N371-V375 WeakPolarHBondContact O-CG2 3.46Å; N371-V375 PolarHBondContact O-N 2.67Å; Q372-V375 PolarHBondContact O-N 2.9Å; V375-K379 VanDerWaalsContact CG1-CE 3.46Å; V375-K379 WeakPolarHBondContact O-CG 3.49Å; V375-K379 PolarHBondContact O-N 3.4Å
376	D	95	Very high	94.3	Very high	61 Å²	61	101 Å²	101	33%	0.326	48%	0.479	S	S	.	.	H	α-helix	trans	-77	-35.5	177.9	-72.2	-28.4	0	0	0	113.2	Q372 R373 T374 Q378 K379 Q380	Q372-D376 VanDerWaalsContact NE2-CG 3.31Å; Q372-D376 PolarHBondContact NE2-OD1 2.93Å; Q372-D376 PolarHBondContact NE2-OD2 2.75Å; Q372-D376 PolarHBondContact O-N 3.15Å; R373-D376 PolarHBondContact O-N 2.85Å; T374-D376 VanDerWaalsContact C-N 3.33Å; T374-D376 PolarHBondContact O-N 2.83Å; D376-Q378 VanDerWaalsContact C-N 3.32Å; D376-Q378 PolarHBondContact O-N 2.73Å; D376-K379 PolarHBondContact O-N 2.59Å; D376-K379 WeakPolarHBondContact OD1-CE 3.49Å; D376-K379 IonicContact OD1-NZ 3.83Å; D376-K379 PolarHBondContact OD1-NZ 3.45Å; D376-Q380 WeakPolarHBondContact O-CG 3.46Å; D376-Q380 PolarHBondContact O-N 3.05Å
377	L	93.4	Very high	94.4	Very high	109 Å²	109	100.5 Å²	100.5	57%	0.571	48%	0.477	S	S	*	.	H	α-helix	trans	-61.9	-39.1	169.2	-74.4	169.5	0	0	0	111.6	R373 T374 Q380 R381	R373-L377 WeakPolarHBondContact O-CB 3.33Å; R373-L377 VanDerWaalsContact O-CG 3.31Å; R373-L377 WeakPolarHBondContact O-CG 3.49Å; R373-L377 PolarHBondContact O-N 2.72Å; T374-L377 PolarHBondContact O-N 2.99Å; L377-Q380 PolarHBondContact O-N 2.64Å; L377-R381 PolarHBondContact O-N 3.36Å
378	Q	93.9	Very high	94.3	Very high	115 Å²	115	99.7 Å²	99.7	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.3	-175.7	178.2	-25.4	0	0	111.8	T374 D376 Q380 R381 E382	T374-Q378 PolarHBondContact O-N 2.98Å; D376-Q378 VanDerWaalsContact C-N 3.32Å; D376-Q378 PolarHBondContact O-N 2.73Å; Q378-Q380 VanDerWaalsContact C-N 3.34Å; Q378-Q380 PolarHBondContact O-N 2.7Å; Q378-R381 WeakPolarHBondContact O-CB 3.23Å; Q378-R381 PolarHBondContact O-N 3.4Å; Q378-E382 PolarHBondContact O-N 3.09Å
379	K	95.8	Very high	94.3	Very high	106 Å²	106	99.9 Å²	99.9	46%	0.461	47%	0.474	S	S	.	.	H	α-helix	trans	-60.7	-42	174.3	-67	166.1	-156.7	161.9	0	112	V375 D376 E382 E383	V375-K379 VanDerWaalsContact CG1-CE 3.46Å; V375-K379 WeakPolarHBondContact O-CG 3.49Å; V375-K379 PolarHBondContact O-N 3.4Å; D376-K379 PolarHBondContact O-N 2.59Å; D376-K379 WeakPolarHBondContact OD1-CE 3.49Å; D376-K379 IonicContact OD1-NZ 3.83Å; D376-K379 PolarHBondContact OD1-NZ 3.45Å; K379-E382 PolarHBondContact O-N 3.18Å; K379-E383 WeakPolarHBondContact O-CB 3.38Å; K379-E383 PolarHBondContact O-N 3.03Å
380	Q	93.8	Very high	94.3	Very high	118 Å²	118	102.2 Å²	102.2	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-42.1	175.8	-71.5	177	11.3	0	0	111.5	D376 L377 Q378 E383 L384	D376-Q380 WeakPolarHBondContact O-CG 3.46Å; D376-Q380 PolarHBondContact O-N 3.05Å; L377-Q380 PolarHBondContact O-N 2.64Å; Q378-Q380 VanDerWaalsContact C-N 3.34Å; Q378-Q380 PolarHBondContact O-N 2.7Å; Q380-E383 PolarHBondContact O-N 2.87Å; Q380-L384 WeakPolarHBondContact O-CG 3.46Å; Q380-L384 PolarHBondContact O-N 3.44Å
381	R	93.2	Very high	94.3	Very high	145 Å²	145	102.8 Å²	102.8	55%	0.547	49%	0.485	S	S	.	.	H	α-helix	trans	-59.4	-48.3	174.9	-170.5	-164.7	162.2	-67.8	-14.4	111.6	L377 Q378 E383 L384 E385	L377-R381 PolarHBondContact O-N 3.36Å; Q378-R381 WeakPolarHBondContact O-CB 3.23Å; Q378-R381 PolarHBondContact O-N 3.4Å; R381-E383 VanDerWaalsContact C-N 3.32Å; R381-E383 PolarHBondContact O-N 2.8Å; R381-L384 PolarHBondContact O-N 3.19Å; R381-E385 IonicContact CZ-OE1 2.83Å; R381-E385 IonicContact CZ-OE2 2.75Å; R381-E385 IonicContact NH1-OE1 2.59Å; R381-E385 IonicContact NH1-OE2 3.21Å; R381-E385 PolarHBondContact NH1-OE2 2.99Å; R381-E385 IonicContact NH2-OE1 2.73Å; R381-E385 PolarHBondContact NH2-OE1 3.42Å; R381-E385 VanDerWaalsContact NH2-OE1 3.16Å; R381-E385 IonicContact NH2-OE2 3.81Å; R381-E385 PolarHBondContact NH2-OE2 3.36Å; R381-E385 WeakPolarHBondContact O-CB 3.33Å; R381-E385 PolarHBondContact O-N 3.08Å
382	E	95.8	Very high	94.2	Very high	68 Å²	68	102.9 Å²	102.9	32%	0.318	49%	0.485	S	S	.	.	H	α-helix	trans	-62.3	-37	177.3	-72.6	-177	-153.5	0	0	113	Q378 K379 E385 R386	Q378-E382 PolarHBondContact O-N 3.09Å; K379-E382 PolarHBondContact O-N 3.18Å; E382-E385 PolarHBondContact O-N 2.77Å; E382-R386 WeakPolarHBondContact O-CG 3.36Å; E382-R386 PolarHBondContact O-N 3.48Å; E382-R386 IonicContact OE2-CZ 3.8Å; E382-R386 IonicContact OE2-NH1 3.22Å; E382-R386 IonicContact OE2-NH2 2.8Å; E382-R386 PolarHBondContact OE2-NH2 3.25Å
383	E	95.6	Very high	94.2	Very high	83 Å²	83	101.1 Å²	101.1	39%	0.388	49%	0.488	S	S	.	.	H	α-helix	trans	-71.3	-40.4	179	-178.2	53.3	-152.5	0	0	111.9	K379 Q380 R381 E385 R386 Q387	K379-E383 WeakPolarHBondContact O-CB 3.38Å; K379-E383 PolarHBondContact O-N 3.03Å; Q380-E383 PolarHBondContact O-N 2.87Å; R381-E383 VanDerWaalsContact C-N 3.32Å; R381-E383 PolarHBondContact O-N 2.8Å; E383-E385 VanDerWaalsContact C-N 3.32Å; E383-E385 PolarHBondContact O-N 2.64Å; E383-R386 PolarHBondContact O-N 3.39Å; E383-Q387 WeakPolarHBondContact O-CG 3.35Å; E383-Q387 PolarHBondContact O-N 2.87Å; E383-Q387 PolarHBondContact OE1-NE2 3.19Å
384	L	94	Very high	94	Very high	112 Å²	112	100.3 Å²	100.3	59%	0.586	49%	0.49	S	S	*	.	H	α-helix	trans	-62.8	-38.2	171.4	-70.9	170.1	0	0	0	111.9	Q380 R381 Q387 Q388	Q380-L384 WeakPolarHBondContact O-CG 3.46Å; Q380-L384 PolarHBondContact O-N 3.44Å; R381-L384 PolarHBondContact O-N 3.19Å; L384-Q387 PolarHBondContact O-N 3.09Å; L384-Q388 WeakPolarHBondContact O-CB 3.49Å; L384-Q388 PolarHBondContact O-N 3.28Å
385	E	94.4	Very high	94	Very high	96 Å²	96	102.8 Å²	102.8	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-45.5	175.4	-165.5	159.5	-142.1	0	0	111	R381 E382 E383 Q387 Q388 E389	R381-E385 IonicContact CZ-OE1 2.83Å; R381-E385 IonicContact CZ-OE2 2.75Å; R381-E385 IonicContact NH1-OE1 2.59Å; R381-E385 IonicContact NH1-OE2 3.21Å; R381-E385 PolarHBondContact NH1-OE2 2.99Å; R381-E385 IonicContact NH2-OE1 2.73Å; R381-E385 PolarHBondContact NH2-OE1 3.42Å; R381-E385 VanDerWaalsContact NH2-OE1 3.16Å; R381-E385 IonicContact NH2-OE2 3.81Å; R381-E385 PolarHBondContact NH2-OE2 3.36Å; R381-E385 WeakPolarHBondContact O-CB 3.33Å; R381-E385 PolarHBondContact O-N 3.08Å; E382-E385 PolarHBondContact O-N 2.77Å; E383-E385 VanDerWaalsContact C-N 3.32Å; E383-E385 PolarHBondContact O-N 2.64Å; E385-Q387 PolarHBondContact O-N 3.11Å; E385-Q388 PolarHBondContact O-N 2.97Å; E385-E389 WeakPolarHBondContact O-CG 3.22Å; E385-E389 PolarHBondContact O-N 3.09Å
386	R	95.4	Very high	93.9	Very high	111 Å²	111	103.4 Å²	103.4	42%	0.419	50%	0.498	S	S	.	.	H	α-helix	trans	-62	-39.7	173.3	-70.3	171.7	-168.3	114.9	13.9	113.1	E382 E383 E389 Q390	E382-R386 WeakPolarHBondContact O-CG 3.36Å; E382-R386 PolarHBondContact O-N 3.48Å; E382-R386 IonicContact OE2-CZ 3.8Å; E382-R386 IonicContact OE2-NH1 3.22Å; E382-R386 IonicContact OE2-NH2 2.8Å; E382-R386 PolarHBondContact OE2-NH2 3.25Å; E383-R386 PolarHBondContact O-N 3.39Å; R386-E389 PolarHBondContact O-N 2.85Å; R386-Q390 WeakPolarHBondContact O-CG 3.36Å; R386-Q390 PolarHBondContact O-N 3.34Å
387	Q	93.8	Very high	93.7	Very high	87 Å²	87	107.1 Å²	107.1	41%	0.407	51%	0.513	S	S	.	.	H	α-helix	trans	-68.5	-36.5	177.2	-71.5	175	23.1	0	0	111.6	E383 L384 E385 Q390 L391	E383-Q387 WeakPolarHBondContact O-CG 3.35Å; E383-Q387 PolarHBondContact O-N 2.87Å; E383-Q387 PolarHBondContact OE1-NE2 3.19Å; L384-Q387 PolarHBondContact O-N 3.09Å; E385-Q387 PolarHBondContact O-N 3.11Å; Q387-Q390 PolarHBondContact O-N 2.94Å; Q387-L391 PolarHBondContact O-N 2.99Å
388	Q	92.3	Very high	93.5	Very high	101 Å²	101	107.5 Å²	107.5	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-37.8	174.3	-175.4	56.7	85.1	0	0	112.2	L384 E385 N392	L384-Q388 WeakPolarHBondContact O-CB 3.49Å; L384-Q388 PolarHBondContact O-N 3.28Å; E385-Q388 PolarHBondContact O-N 2.97Å; Q388-N392 PolarHBondContact NE2-ND2 3.09Å; Q388-N392 PolarHBondContact NE2-OD1 3.49Å; Q388-N392 WeakPolarHBondContact O-CB 3.45Å; Q388-N392 PolarHBondContact O-N 2.63Å; Q388-N392 PolarHBondContact O-ND2 3.21Å; Q388-N392 VanDerWaalsContact O-ND2 3.13Å
389	E	95	Very high	93.3	Very high	134 Å²	134	107.4 Å²	107.4	63%	0.626	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-46	170.6	-72.6	-174.2	147.9	0	0	112	E385 R386 N392 A393	E385-E389 WeakPolarHBondContact O-CG 3.22Å; E385-E389 PolarHBondContact O-N 3.09Å; R386-E389 PolarHBondContact O-N 2.85Å; E389-N392 PolarHBondContact O-N 2.85Å; E389-A393 PolarHBondContact O-N 3.44Å
390	Q	94.1	Very high	93	Very high	131 Å²	131	108.2 Å²	108.2	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-62.4	-43.6	177.9	-71.3	174	36	0	0	112.4	R386 Q387 N392 A393 Q394	R386-Q390 WeakPolarHBondContact O-CG 3.36Å; R386-Q390 PolarHBondContact O-N 3.34Å; Q387-Q390 PolarHBondContact O-N 2.94Å; Q390-N392 VanDerWaalsContact C-N 3.34Å; Q390-N392 PolarHBondContact O-N 3.28Å; Q390-A393 PolarHBondContact O-N 2.76Å; Q390-Q394 WeakPolarHBondContact O-CB 2.94Å; Q390-Q394 PolarHBondContact O-N 3.25Å
391	L	92.7	Very high	92.7	Very high	103 Å²	103	105.2 Å²	105.2	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-41.5	174.2	-95.7	163	0	0	0	112.2	Q387 Q394 K395	Q387-L391 PolarHBondContact O-N 2.99Å; L391-Q394 PolarHBondContact O-N 3.38Å; L391-K395 WeakPolarHBondContact O-CB 3.39Å; L391-K395 PolarHBondContact O-N 2.87Å
392	N	93.1	Very high	92.5	Very high	82 Å²	82	101.9 Å²	101.9	44%	0.439	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-41.5	176.6	-74.7	-28.2	0	0	0	111.8	Q388 E389 Q390 K395 V396	Q388-N392 PolarHBondContact NE2-ND2 3.09Å; Q388-N392 PolarHBondContact NE2-OD1 3.49Å; Q388-N392 WeakPolarHBondContact O-CB 3.45Å; Q388-N392 PolarHBondContact O-N 2.63Å; Q388-N392 PolarHBondContact O-ND2 3.21Å; Q388-N392 VanDerWaalsContact O-ND2 3.13Å; E389-N392 PolarHBondContact O-N 2.85Å; Q390-N392 VanDerWaalsContact C-N 3.34Å; Q390-N392 PolarHBondContact O-N 3.28Å; N392-K395 PolarHBondContact O-N 2.71Å; N392-V396 WeakPolarHBondContact O-CG2 3.3Å; N392-V396 PolarHBondContact O-N 3.34Å; N392-V396 VanDerWaalsContact O-N 3.11Å
393	A	93.8	Very high	92	Very high	62 Å²	62	103 Å²	103	51%	0.512	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-47.1	175.4	0	0	0	0	0	112	E389 Q390 K395 V396 E397	E389-A393 PolarHBondContact O-N 3.44Å; Q390-A393 PolarHBondContact O-N 2.76Å; A393-K395 VanDerWaalsContact C-N 3.31Å; A393-K395 PolarHBondContact O-N 3.46Å; A393-V396 PolarHBondContact O-N 3.09Å; A393-E397 PolarHBondContact O-N 3.35Å
394	Q	90.8	Very high	91.4	Very high	130 Å²	130	104.4 Å²	104.4	61%	0.607	52%	0.522	S	S	*	.	H	α-helix	trans	-62.1	-37.9	177.1	-177.6	175.7	78	0	0	112.2	Q390 L391 V396 E397 L398	Q390-Q394 WeakPolarHBondContact O-CB 2.94Å; Q390-Q394 PolarHBondContact O-N 3.25Å; L391-Q394 PolarHBondContact O-N 3.38Å; Q394-V396 VanDerWaalsContact C-N 3.35Å; Q394-E397 PolarHBondContact O-N 2.87Å; Q394-L398 WeakPolarHBondContact O-CB 3.41Å; Q394-L398 PolarHBondContact O-N 2.97Å
395	K	92	Very high	90.6	Very high	138 Å²	138	105.5 Å²	105.5	60%	0.6	53%	0.526	S	S	*	.	H	α-helix	trans	-62.6	-40.4	174.8	-176.5	178.8	178	-178.8	0	112.1	L391 N392 A393 Q399	L391-K395 WeakPolarHBondContact O-CB 3.39Å; L391-K395 PolarHBondContact O-N 2.87Å; N392-K395 PolarHBondContact O-N 2.71Å; A393-K395 VanDerWaalsContact C-N 3.31Å; A393-K395 PolarHBondContact O-N 3.46Å; K395-Q399 WeakPolarHBondContact O-CB 3.24Å; K395-Q399 PolarHBondContact O-N 2.92Å
396	V	93.7	Very high	90	Very high	80 Å²	80	106.8 Å²	106.8	49%	0.485	53%	0.532	S	S	.	.	H	α-helix	trans	-67.5	-43.7	176	171.2	0	0	0	0	111.3	N392 A393 Q394 Q399 Q400	N392-V396 WeakPolarHBondContact O-CG2 3.3Å; N392-V396 PolarHBondContact O-N 3.34Å; N392-V396 VanDerWaalsContact O-N 3.11Å; A393-V396 PolarHBondContact O-N 3.09Å; Q394-V396 VanDerWaalsContact C-N 3.35Å; V396-Q399 PolarHBondContact O-N 2.88Å; V396-Q400 WeakPolarHBondContact O-CG 2.99Å; V396-Q400 PolarHBondContact O-N 3.34Å
397	E	91.2	Very high	89.1	Confident	139 Å²	139	109.9 Å²	109.9	65%	0.65	54%	0.544	S	S	*	.	H	α-helix	trans	-60.7	-46.2	175.8	-175.5	178.2	-166.3	0	0	111.7	A393 Q394 Q399 Q400 A401	A393-E397 PolarHBondContact O-N 3.35Å; Q394-E397 PolarHBondContact O-N 2.87Å; E397-Q399 VanDerWaalsContact C-N 3.34Å; E397-Q399 PolarHBondContact O-N 3.49Å; E397-Q400 PolarHBondContact O-N 2.95Å; E397-A401 PolarHBondContact O-N 3.2Å
398	L	89.4	Confident	88.2	Confident	116 Å²	116	110.4 Å²	110.4	61%	0.607	55%	0.549	S	S	*	.	H	α-helix	trans	-60.2	-42.5	176.8	-179.8	61.4	0	0	0	111.9	Q394 A401 V402	Q394-L398 WeakPolarHBondContact O-CB 3.41Å; Q394-L398 PolarHBondContact O-N 2.97Å; L398-A401 PolarHBondContact O-N 3.23Å; L398-V402 WeakPolarHBondContact O-CG2 3.49Å; L398-V402 PolarHBondContact O-N 2.79Å
399	Q	89.1	Confident	87.1	Confident	114 Å²	114	113.7 Å²	113.7	53%	0.533	56%	0.562	S	S	.	*	H	α-helix	trans	-67.1	-40.1	178.8	-173.2	161.5	-19.5	0	0	112.1	K395 V396 E397 A401 V402 E403	K395-Q399 WeakPolarHBondContact O-CB 3.24Å; K395-Q399 PolarHBondContact O-N 2.92Å; V396-Q399 PolarHBondContact O-N 2.88Å; E397-Q399 VanDerWaalsContact C-N 3.34Å; E397-Q399 PolarHBondContact O-N 3.49Å; Q399-A401 VanDerWaalsContact C-N 3.31Å; Q399-A401 PolarHBondContact O-N 3.13Å; Q399-V402 PolarHBondContact O-N 2.71Å; Q399-E403 PolarHBondContact O-N 2.9Å
400	Q	88.9	Confident	85.5	Confident	123 Å²	123	111.8 Å²	111.8	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-61.9	-38.1	172.3	-70.2	176.7	16.8	0	0	112.3	V396 E397 H404	V396-Q400 WeakPolarHBondContact O-CG 2.99Å; V396-Q400 PolarHBondContact O-N 3.34Å; E397-Q400 PolarHBondContact O-N 2.95Å; Q400-H404 WeakPolarHBondContact O-CB 3.32Å; Q400-H404 PolarHBondContact O-N 3.36Å
401	A	88.3	Confident	83.8	Confident	54 Å²	54	113.5 Å²	113.5	45%	0.446	57%	0.571	S	S	.	*	H	α-helix	trans	-66.1	-37.1	175.7	0	0	0	0	0	112.6	E397 L398 Q399 M405	E397-A401 PolarHBondContact O-N 3.2Å; L398-A401 PolarHBondContact O-N 3.23Å; Q399-A401 VanDerWaalsContact C-N 3.31Å; Q399-A401 PolarHBondContact O-N 3.13Å; A401-M405 WeakPolarHBondContact O-CB 3.48Å; A401-M405 PolarHBondContact O-N 3.38Å
402	V	88.7	Confident	81.8	Confident	75 Å²	75	117.3 Å²	117.3	46%	0.455	58%	0.583	S	S	.	*	H	α-helix	trans	-65.5	-50.5	173.5	171.3	0	0	0	0	110.9	L398 Q399 H404 M405 E406	L398-V402 WeakPolarHBondContact O-CG2 3.49Å; L398-V402 PolarHBondContact O-N 2.79Å; Q399-V402 PolarHBondContact O-N 2.71Å; V402-H404 VanDerWaalsContact C-N 3.26Å; V402-H404 PolarHBondContact O-N 2.81Å; V402-M405 WeakPolarHBondContact O-CA 3.38Å; V402-M405 WeakPolarHBondContact O-CB 3.45Å; V402-M405 PolarHBondContact O-N 3.19Å; V402-E406 PolarHBondContact O-N 2.87Å
403	E	85.1	Confident	79.4	Confident	92 Å²	92	119.2 Å²	119.2	43%	0.43	60%	0.598	S	S	.	*	H	α-helix	trans	-57.8	-38.4	177	-71.9	177.8	-159.2	0	0	112.4	Q399 E406 R407	Q399-E403 PolarHBondContact O-N 2.9Å; E403-E406 PolarHBondContact O-N 2.98Å; E403-R407 PolarHBondContact O-N 3.5Å; E403-R407 VanDerWaalsContact O-N 3.1Å
404	H	83.1	Confident	76.6	Confident	113 Å²	113	125.2 Å²	125.2	52%	0.523	62%	0.615	S	S	.	*	H	α-helix	trans	-67.4	-38.3	174.9	-170.5	-90.3	0	0	0	112.3	Q400 V402 R407 L408	Q400-H404 WeakPolarHBondContact O-CB 3.32Å; Q400-H404 PolarHBondContact O-N 3.36Å; V402-H404 VanDerWaalsContact C-N 3.26Å; V402-H404 PolarHBondContact O-N 2.81Å; H404-R407 PolarHBondContact O-N 3.31Å; H404-L408 WeakPolarHBondContact O-CG 3.35Å; H404-L408 PolarHBondContact O-N 3.27Å; H404-L408 VanDerWaalsContact O-N 3.1Å
405	M	78.8	Confident	74.3	Confident	134 Å²	134	124.5 Å²	124.5	66%	0.66	62%	0.622	S	S	*	*	H	α-helix	trans	-67.4	-38.8	175.4	-166.7	-178.3	-60	0	0	112	A401 V402 L408 K409	A401-M405 WeakPolarHBondContact O-CB 3.48Å; A401-M405 PolarHBondContact O-N 3.38Å; V402-M405 WeakPolarHBondContact O-CA 3.38Å; V402-M405 WeakPolarHBondContact O-CB 3.45Å; V402-M405 PolarHBondContact O-N 3.19Å; M405-L408 PolarHBondContact O-N 2.81Å; M405-K409 WeakPolarHBondContact O-CB 3.3Å; M405-K409 PolarHBondContact O-N 2.83Å
406	E	80.2	Confident	72.1	Confident	123 Å²	123	123.6 Å²	123.6	58%	0.575	63%	0.63	S	S	*	*	H	α-helix	trans	-64.5	-38.9	174.6	-69.7	-161.5	133.7	0	0	112.5	V402 E403 K409 S410	V402-E406 PolarHBondContact O-N 2.87Å; E403-E406 PolarHBondContact O-N 2.98Å; E406-K409 PolarHBondContact O-N 2.72Å; E406-S410 WeakPolarHBondContact O-CB 3.29Å; E406-S410 PolarHBondContact O-N 3.39Å; E406-S410 PolarHBondContact O-OG 2.97Å
407	R	76.6	Confident	69.6	Low	177 Å²	177	126.1 Å²	126.1	67%	0.668	65%	0.648	S	S	*	*	H	α-helix	trans	-59.5	-50.8	170.8	-77.9	-177.1	174.8	144.3	5.5	112.1	E403 H404 K409 S410 E411	E403-R407 PolarHBondContact O-N 3.5Å; E403-R407 VanDerWaalsContact O-N 3.1Å; H404-R407 PolarHBondContact O-N 3.31Å; R407-K409 VanDerWaalsContact C-N 3.26Å; R407-K409 PolarHBondContact O-N 2.63Å; R407-S410 WeakPolarHBondContact O-CA 3.45Å; R407-S410 WeakPolarHBondContact O-CB 3.47Å; R407-S410 PolarHBondContact O-N 2.98Å; R407-E411 PolarHBondContact O-N 2.88Å
408	L	75.1	Confident	66.9	Low	98 Å²	98	128.3 Å²	128.3	51%	0.513	66%	0.658	S	S	.	*	H	α-helix	trans	-61	-33.6	178.2	-71.4	174.3	0	0	0	113.1	H404 M405	H404-L408 WeakPolarHBondContact O-CG 3.35Å; H404-L408 PolarHBondContact O-N 3.27Å; H404-L408 VanDerWaalsContact O-N 3.1Å; M405-L408 PolarHBondContact O-N 2.81Å
409	K	69.2	Low	64.2	Low	170 Å²	170	128.1 Å²	128.1	74%	0.739	66%	0.662	S	S	*	*	H	α-helix	trans	-71.1	-33.6	174.1	-170.5	179.6	178.9	-174	0	112.1	M405 E406 R407	M405-K409 WeakPolarHBondContact O-CB 3.3Å; M405-K409 PolarHBondContact O-N 2.83Å; E406-K409 PolarHBondContact O-N 2.72Å; R407-K409 VanDerWaalsContact C-N 3.26Å; R407-K409 PolarHBondContact O-N 2.63Å
410	S	61.6	Low	61.5	Low	93 Å²	93	130.4 Å²	130.4	65%	0.65	67%	0.672	S	S	*	*	H	α-helix	trans	-74.2	-30.7	177.5	-56.5	0	0	0	0	113	E406 R407 K412	E406-S410 WeakPolarHBondContact O-CB 3.29Å; E406-S410 PolarHBondContact O-N 3.39Å; E406-S410 PolarHBondContact O-OG 2.97Å; R407-S410 WeakPolarHBondContact O-CA 3.45Å; R407-S410 WeakPolarHBondContact O-CB 3.47Å; R407-S410 PolarHBondContact O-N 2.98Å; S410-K412 VanDerWaalsContact C-N 3.33Å
411	E	58.1	Low	58.8	Low	167 Å²	167	130.1 Å²	130.1	78%	0.78	68%	0.678	S	S	*	*	S	Bend	trans	-81.2	-10.1	-178.2	-159.3	170.3	176.4	0	0	113.4	R407	R407-E411 PolarHBondContact O-N 2.88Å
412	K	51	Low	56.2	Low	184 Å²	184	136.8 Å²	136.8	80%	0.8	70%	0.7	S	S	*	*			trans	-110.9	69.8	-173.9	-161.7	175.1	-177.2	177.5	0	113.5	S410	S410-K412 VanDerWaalsContact C-N 3.33Å
413	V	42.4	Very low	53.3	Low	122 Å²	122	136.7 Å²	136.7	74%	0.739	72%	0.715	S	S	*	*			trans	-125.2	89.7	175.6	-174.4	0	0	0	0	111.8
414	E	36	Very low	50.9	Low	187 Å²	187	140.5 Å²	140.5	87%	0.874	74%	0.738	S	S	*	*			trans	-138.6	132.1	155.3	-82.6	-162.4	138.7	0	0	109.4
415	P	40.9	Very low	48.3	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	75%	0.752	S	S	*	*			trans	-86.4	147.8	172.3	34.1	-33	0	0	0	112
416	P	46.2	Very low	46.2	Very low	118 Å²	118	141 Å²	141	77%	0.766	76%	0.76	S	S	*	*			trans	-84.1	158.2	-178.4	34.6	-36.4	0	0	0	113.7
417	P	40.9	Very low	44.6	Very low	134 Å²	134	140.1 Å²	140.1	87%	0.87	77%	0.766	S	S	*	*			trans	-77.7	175.4	164	34.6	-35	0	0	0	112.5
418	E	34.5	Very low	42.6	Very low	184 Å²	184	139.1 Å²	139.1	86%	0.86	77%	0.769	S	S	*	*			trans	-113.2	171.1	-151.9	-147.2	-172.8	174.7	0	0	115.2
419	V	34.6	Very low	40.6	Very low	113 Å²	113	139.4 Å²	139.4	69%	0.685	77%	0.774	S	S	*	*			trans	91.3	112.6	152	169.5	0	0	0	0	121.8
420	H	30.8	Very low	38.8	Very low	161 Å²	161	139.4 Å²	139.4	75%	0.745	78%	0.776	S	S	*	*			trans	77.8	115.2	143.7	-85	45	0	0	0	121.6
421	V	33.8	Very low	37.5	Very low	118 Å²	118	139.3 Å²	139.3	72%	0.715	78%	0.781	S	S	*	*				90.2	136	87	159.2	0	0	0	0	111.3
422	E	31.9	Very low	36.1	Very low	194 Å²	194	136 Å²	136	91%	0.907	78%	0.783	S	S	*	*			cis	-150.7	163.1	32.7	-158.1	174.5	144.2	0	0	112.3
423	G	29.3	Very low	35.2	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	78%	0.782	S	S	*	*			trans	148.9	106.4	161.4	0	0	0	0	0	117.7
424	N	32.9	Very low	34.8	Very low	171 Å²	171	133.6 Å²	133.6	91%	0.914	77%	0.774	S	S	*	*			trans	-60.7	144.1	175.2	-77.5	-12.9	0	0	0	114.8
425	A	30.6	Very low	34.6	Very low	99 Å²	99	131.8 Å²	131.8	82%	0.818	77%	0.766	S	S	*	*				-176.3	109.6	112.9	0	0	0	0	0	113.4
426	D	33.4	Very low	33.9	Very low	158 Å²	158	133.4 Å²	133.4	85%	0.845	77%	0.767	S	S	*	*			trans	-83.1	165.8	157.4	-96.5	-59.6	0	0	0	109.9
427	P	46.1	Very low	33.2	Very low	105 Å²	105	135 Å²	135	68%	0.682	77%	0.765	S	S	*	*			cis	-149.6	169.6	34.1	44.5	-24.5	0	0	0	120.6
428	E	34.4	Very low	33.8	Very low	157 Å²	157	134.1 Å²	134.1	73%	0.734	76%	0.759	S	S	*	*			trans	82.5	104.3	134.2	-90.8	-175.1	110.4	0	0	124.7
429	V	33.9	Very low	33.7	Very low	104 Å²	104	131.1 Å²	131.1	63%	0.63	75%	0.748	S	S	*	*			trans	52.6	160	130.5	-59.1	0	0	0	0	122.6
430	H	31	Very low	33.4	Very low	169 Å²	169	133.5 Å²	133.5	78%	0.782	75%	0.752	S	S	*	*			cis	-128.2	157.1	1.2	-75.3	-82.3	0	0	0	109.7
431	A	34.3	Very low	33.3	Very low	91 Å²	91	133.8 Å²	133.8	75%	0.752	75%	0.754	S	S	*	*			cis	103.2	87.8	16.9	0	0	0	0	0	116.9
432	A	29.2	Very low	33	Very low	98 Å²	98	131.7 Å²	131.7	81%	0.81	75%	0.749	S	S	*	*			trans	-168.7	124	149.9	0	0	0	0	0	106.9
433	D	32.7	Very low	32.8	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	75%	0.746	S	S	*	*			cis	74.8	125.6	45.5	-141.3	70.9	0	0	0	111.4
434	N	33	Very low	33.2	Very low	110 Å²	110	132.9 Å²	132.9	59%	0.588	74%	0.744	S	S	*	*			cis	-165	175	2.1	-129.3	-32.3	0	0	0	108.1
435	Q	31.8	Very low	33.4	Very low	149 Å²	149	131 Å²	131	70%	0.696	74%	0.741	S	S	*	*			cis	-165.4	-171.5	-4.3	-159.5	165.5	99.8	0	0	109.3
436	L	27.1	Very low	33.1	Very low	149 Å²	149	129.8 Å²	129.8	78%	0.78	74%	0.738	S	S	*	*			trans	91.8	100.8	151	-69.6	160.6	0	0	0	122.3
437	H	31.9	Very low	33	Very low	153 Å²	153	131 Å²	131	71%	0.708	74%	0.738	S	S	*	*			trans	-86.1	-178.4	137.2	-91.6	-107.4	0	0	0	109.4	D439	H437-D439 IonicContact CE1-OD1 2.74Å; H437-D439 IonicContact CG-OD1 2.76Å; H437-D439 IonicContact ND1-OD1 3.2Å; H437-D439 PolarHBondContact ND1-OD1 2.65Å; H437-D439 IonicContact ND1-OD2 3.25Å
438	P	51.8	Low	32	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	74%	0.74	S	S	*	*			cis	-136	-155.1	15.4	41.2	-20.5	0	0	0	114.6
439	D	32.4	Very low	31.7	Very low	120 Å²	120	133.6 Å²	133.6	64%	0.642	74%	0.741	S	S	*	*				-164.2	-155.7	-62.7	-72	-35.8	0	0	0	107.7	H437	H437-D439 IonicContact CE1-OD1 2.74Å; H437-D439 IonicContact CG-OD1 2.76Å; H437-D439 IonicContact ND1-OD1 3.2Å; H437-D439 PolarHBondContact ND1-OD1 2.65Å; H437-D439 IonicContact ND1-OD2 3.25Å
440	Q	29.6	Very low	31.7	Very low	164 Å²	164	136.5 Å²	136.5	77%	0.766	75%	0.751	S	S	*	*			trans	84.7	108.6	168.3	-60.7	-161	-93.7	0	0	122
441	E	27.3	Very low	31.8	Very low	167 Å²	167	134 Å²	134	78%	0.78	75%	0.75	S	S	*	*				56.1	142.1	118.7	-67.9	173.2	121.8	0	0	122.4
442	A	27.4	Very low	31.6	Very low	74 Å²	74	137.6 Å²	137.6	61%	0.612	75%	0.752	S	S	*	*			cis	-167.6	155.1	-2.4	0	0	0	0	0	116
443	H	29.3	Very low	31.6	Very low	184 Å²	184	139.1 Å²	139.1	85%	0.852	74%	0.741	S	S	*	*			trans	72.6	159	147.1	-74.5	-45.2	0	0	0	123
444	P	36.9	Very low	31.4	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	74%	0.737	S	S	*	*			trans	-122.6	172.2	-146.8	44.2	-33	0	0	0	116.9
445	P	36.9	Very low	31.3	Very low	132 Å²	132	142 Å²	142	86%	0.857	75%	0.746	S	S	*	*			trans	-87.2	159	169.5	35.8	-35	0	0	0	113.8
446	G	24.9	Very low	31.1	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	75%	0.753	S	S	*	*			trans	-122.9	-178.7	175.5	0	0	0	0	0	114
447	H	30.1	Very low	31.2	Very low	184 Å²	184	141 Å²	141	85%	0.852	75%	0.751	S	S	*	*			trans	-56.2	159.2	179.1	-46	-58.1	0	0	0	112.9
448	Q	26.6	Very low	31.8	Very low	155 Å²	155	139.6 Å²	139.6	72%	0.724	76%	0.756	S	S	*	*				-160.8	158.3	50.7	-79.8	174.2	-98.4	0	0	114.8
449	E	27.2	Very low	30.6	Very low	162 Å²	162	143 Å²	143	76%	0.757	76%	0.761	S	S	*	*			trans	61.9	131.7	139.5	-72.2	161.4	-150.3	0	0	123.4
450	I	33.7	Very low	30.4	Very low	164 Å²	164	144.7 Å²	144.7	84%	0.841	77%	0.766	S	S	*	*			trans	-120.2	135.5	164.8	-61	167.1	0	0	0	107.8
451	P	33.4	Very low	30.4	Very low	118 Å²	118	145.9 Å²	145.9	77%	0.766	77%	0.771	S	S	*	*			trans	-107.2	150	151.8	-8.2	28.3	0	0	0	112.8
452	Q	30.2	Very low	30.4	Very low	166 Å²	166	146 Å²	146	78%	0.776	77%	0.772	S	S	*	*			trans	-71.6	175.3	168.3	-54.6	171.6	-78.1	0	0	109.9
453	H	28.8	Very low	30.5	Very low	129 Å²	129	150.6 Å²	150.6	60%	0.597	78%	0.78	S	S	*	*			cis	-177.5	173.3	40.1	-150.7	-78.2	0	0	0	112.1
454	H	29.8	Very low	30.5	Very low	149 Å²	149	150.9 Å²	150.9	69%	0.69	78%	0.782	S	S	*	*			trans	90.1	150.3	155.3	-73.2	-61.7	0	0	0	122.6
455	Q	29.3	Very low	30.1	Very low	168 Å²	168	153.4 Å²	153.4	79%	0.785	78%	0.784	S	S	*	*			trans	-85.6	161	176.6	-49.8	129.1	-87.6	0	0	110.7
456	D	28.6	Very low	29.7	Very low	154 Å²	154	154.7 Å²	154.7	82%	0.824	78%	0.784	S	S	*	*				-161.9	176.2	106.7	-133.8	-47.9	0	0	0	112
457	T	28.7	Very low	30	Very low	123 Å²	123	158.7 Å²	158.7	76%	0.755	78%	0.783	S	S	*	*			trans	-92.1	169.5	-172.7	9.9	0	0	0	0	113.7
458	P	44	Very low	29.9	Very low	123 Å²	123	157.6 Å²	157.6	80%	0.799	78%	0.784	S	S	*	*			trans	-91.2	170.3	-155	37.3	-40.1	0	0	0	115.9
459	Q	27.7	Very low	30.1	Very low	186 Å²	186	158.1 Å²	158.1	87%	0.869	79%	0.79	S	S	*	*			trans	-147	158.8	159	-143.4	175.7	-13.3	0	0	112.7
460	E	28.3	Very low	30.6	Very low	157 Å²	157	156.1 Å²	156.1	73%	0.734	79%	0.791	S	S	*	*			trans	-68.5	161.8	-171.1	-49.5	143.6	91.6	0	0	114.5
461	H	29.4	Very low	30.4	Very low	189 Å²	189	157.7 Å²	157.7	88%	0.875	80%	0.795	S	S	*	*			trans	-159.6	100.4	138.2	-108.8	43.4	0	0	0	113.4
462	Q	27.8	Very low	30.2	Very low	170 Å²	170	161.5 Å²	161.5	79%	0.794	80%	0.803	S	S	*	*			trans	29.5	146.9	130.8	-154.9	161.1	27.5	0	0	122.9
463	E	29.5	Very low	30.2	Very low	169 Å²	169	156.8 Å²	156.8	79%	0.79	80%	0.799	S	S	*	*			trans	-57.7	152.4	178.9	-51.7	147.9	76.9	0	0	116
464	Q	28.9	Very low	30.1	Very low	191 Å²	191	159.7 Å²	159.7	89%	0.893	81%	0.813	S	S	*	*			trans	-154.7	110	133.9	-124.6	174.6	22.3	0	0	115.4
465	H	29.1	Very low	31.1	Very low	159 Å²	159	157.3 Å²	157.3	74%	0.736	81%	0.81	S	S	*	*			trans	31.1	111.5	131.6	-147.6	84.9	0	0	0	119.1
466	N	28.4	Very low	31.2	Very low	160 Å²	160	158.9 Å²	158.9	86%	0.856	82%	0.818	S	S	*	*			trans	-98.1	145.8	170.6	-162.9	18.2	0	0	0	111
467	Q	29.9	Very low	31.1	Very low	157 Å²	157	154.3 Å²	154.3	73%	0.734	81%	0.807	S	S	*	*			trans	-122.6	153.8	-177	-78	-169.6	-7.3	0	0	113.8
468	D	29.4	Very low	31.2	Very low	161 Å²	161	156.9 Å²	156.9	86%	0.861	81%	0.81	S	S	*	*			trans	-50.8	148.7	176.4	-86.8	-79.4	0	0	0	115.5
469	L	30.2	Very low	30.6	Very low	165 Å²	165	158 Å²	158	86%	0.864	80%	0.804	S	S	*	*			trans	-134.9	117.1	162.3	-156.1	77.6	0	0	0	110.3
470	P	37.2	Very low	30.6	Very low	120 Å²	120	156.1 Å²	156.1	78%	0.779	80%	0.8	S	S	*	*			trans	-81	145.6	-169.5	31.2	-35.9	0	0	0	113.6
471	Q	29.7	Very low	30.6	Very low	197 Å²	197	152.5 Å²	152.5	92%	0.921	81%	0.805	S	S	*	*			trans	-87.1	132.1	176.5	-163.5	-177.8	105.5	0	0	111.6
472	Q	30	Very low	30.8	Very low	198 Å²	198	151.3 Å²	151.3	93%	0.925	80%	0.804	S	S	*	*			trans	-124.5	149.8	162.5	-90.3	-172.3	-3	0	0	108.6
473	G	28.9	Very low	31.6	Very low	68 Å²	68	149 Å²	149	70%	0.701	80%	0.803	S	S	*	*			trans	-156.6	-167.6	-171.4	0	0	0	0	0	116.4
474	Q	27.8	Very low	31.6	Very low	189 Å²	189	146.9 Å²	146.9	88%	0.883	80%	0.798	S	S	*	*			trans	65.6	166.6	173.9	-76.8	-162.4	-8.8	0	0	117.3
475	P	50.1	Low	31.7	Very low	99 Å²	99	144.3 Å²	144.3	64%	0.643	79%	0.786	S	S	*	*			cis	-140.3	162.8	-42.3	37.9	-23.2	0	0	0	114.5
476	Q	30.5	Very low	31.8	Very low	202 Å²	202	143.7 Å²	143.7	94%	0.944	78%	0.783	S	S	*	*			trans	179	149.1	154.2	-101.7	153.6	44.7	0	0	109.3
477	G	28.1	Very low	31.9	Very low	57 Å²	57	142.4 Å²	142.4	59%	0.588	78%	0.776	S	S	*	*			cis	146.4	135	-11.4	0	0	0	0	0	113.3
478	H	30.7	Very low	31.9	Very low	177 Å²	177	141 Å²	141	82%	0.819	78%	0.778	S	S	*	*			trans	75.6	148.9	175.9	-54	71.8	0	0	0	116.6
479	H	29.9	Very low	31.9	Very low	147 Å²	147	137.5 Å²	137.5	68%	0.681	77%	0.772	S	S	*	*			cis	-161.1	163.9	-15.1	-127.9	-116	0	0	0	111
480	D	29.6	Very low	32.1	Very low	147 Å²	147	139.3 Å²	139.3	79%	0.786	78%	0.776	S	S	*	*			trans	34.5	146	154.2	-68.1	-35.6	0	0	0	124.4
481	G	27.6	Very low	31.8	Very low	80 Å²	80	137.5 Å²	137.5	83%	0.825	78%	0.779	S	S	*	*			trans	155	73.7	146.8	0	0	0	0	0	120.5
482	L	32.4	Very low	32.2	Very low	165 Å²	165	137 Å²	137	86%	0.864	78%	0.777	S	S	*	*			trans	-118.9	139.3	155.9	-92.7	170.6	0	0	0	108.5
483	P	44.6	Very low	32.5	Very low	120 Å²	120	136.6 Å²	136.6	78%	0.779	77%	0.774	S	S	*	*				-158	137.7	93.3	38.8	-18	0	0	0	119
484	N	30.2	Very low	33	Very low	125 Å²	125	139.8 Å²	139.8	67%	0.668	78%	0.775	S	S	*	*				64.6	120.4	118.3	-161.2	43.6	0	0	0	124.2
485	Q	31.3	Very low	33.7	Very low	137 Å²	137	138.7 Å²	138.7	64%	0.64	77%	0.774	S	S	*	*			trans	92.9	147.4	132.8	-108.2	176.7	78.7	0	0	126.5
486	Q	31.2	Very low	33.4	Very low	146 Å²	146	142.4 Å²	142.4	68%	0.682	81%	0.814	S	S	*	*			trans	71	138.5	156.6	-68.2	173.8	26.6	0	0	118.2
487	N	29.8	Very low	33.5	Very low	134 Å²	134	139.5 Å²	139.5	72%	0.717	81%	0.807	S	S	*	*			cis	-136.6	159.6	17	-85.1	-57.8	0	0	0	110.8
488	V	29.8	Very low	33.8	Very low	126 Å²	126	143.8 Å²	143.8	76%	0.764	82%	0.819	S	S	*	*			cis	79.6	99.1	42.4	-177.1	0	0	0	0	115.6
489	A	31.1	Very low	34	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	82%	0.819	S	S	*	*			trans	-179.4	106.3	145	0	0	0	0	0	108.6
490	Q	32.9	Very low	34.2	Very low	202 Å²	202	141.6 Å²	141.6	94%	0.944	83%	0.827	S	S	*	*				67.4	118.7	87	-77.8	-166	-25.1	0	0	116.2
491	G	31.4	Very low	34.5	Very low	82 Å²	82	141.3 Å²	141.3	85%	0.845	83%	0.83	S	S	*	*			trans	-170	76.6	173.6	0	0	0	0	0	111.7
492	Q	38.2	Very low	35	Very low	188 Å²	188	145.4 Å²	145.4	88%	0.879	83%	0.83	S	S	*	*			trans	-76	145.7	172.3	-65.7	175.2	-48.7	0	0	110.5
493	H	36.9	Very low	35.2	Very low	189 Å²	189	144 Å²	144	88%	0.875	83%	0.828	S	S	*	*			trans	-153.9	163.5	136.2	-126.9	-94.6	0	0	0	112.3
494	N	38.2	Very low	34.4	Very low	135 Å²	135	145.8 Å²	145.8	72%	0.722	83%	0.831	S	S	*	*			trans	-96.2	152.5	-161.7	-79.6	-37.3	0	0	0	115.5
495	L	43.5	Very low	34.8	Very low	165 Å²	165	147.6 Å²	147.6	86%	0.864	85%	0.845	S	S	*	*			trans	24.5	118.6	136.6	-64.8	152.2	0	0	0	118.7
496	A	43.3	Very low	35.1	Very low	178 Å²	178	148.5 Å²	148.5	100%	1.471	86%	0.863	S	S	*	*			trans	-140.5	0	130.9	0	0	0	0	0	108.3

Retrieved 496 of 496 residues in 295.8 ms (Link to these results)

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