A0A3B3UX11_9TELE Loading...

Zinc finger and BTB domain containing 14

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A3B3UX11, Species 9TELE (Poecilia latipinna, sailfin molly), Gene ZBTB14, Length 435 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	29.9	Very low	28	Very low	241 Å²	241	153 Å²	153	100%	1.187	78%	0.778	S	S	*	*				0	117.7	0	-59	179.1	84.6	0	0	105.9
2	T	20.9	Very low	28.9	Very low	138 Å²	138	149.3 Å²	149.3	85%	0.847	76%	0.755	S	S	*	*			trans	-116.1	104.2	-179.8	42.1	0	0	0	0	107.1	T4	T2-T4 PolarHBondContact O-N 3.24Å
3	E	19.7	Very low	29.6	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.864	74%	0.738	S	S	*	*			trans	-72	115.3	179.6	-68.7	179.9	138.1	0	0	109.6	V5	E3-V5 PolarHBondContact O-N 3.41Å; E3-V5 VanDerWaalsContact O-N 3.16Å
4	T	20.5	Very low	30.3	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	71%	0.714	S	S	*	*			trans	-77.5	92.4	169.1	39.2	0	0	0	0	109	T2 K6	T2-T4 PolarHBondContact O-N 3.24Å; T4-K6 PolarHBondContact O-N 3.19Å; T4-K6 VanDerWaalsContact O-N 3.07Å
5	V	20.9	Very low	31.1	Very low	102 Å²	102	136.9 Å²	136.9	62%	0.618	69%	0.694	S	S	*	*			trans	-70.4	103.5	171.4	-173.4	0	0	0	0	108.6	E3 Y7	E3-V5 PolarHBondContact O-N 3.41Å; E3-V5 VanDerWaalsContact O-N 3.16Å; V5-Y7 HydrophobicContact CB-CE2 4.3Å; V5-Y7 HydrophobicContact CG1-CD2 3.87Å; V5-Y7 HydrophobicContact CG1-CE2 3.41Å; V5-Y7 VanDerWaalsContact CG1-CE2 3.41Å; V5-Y7 PolarHBondContact O-N 3.45Å
6	K	22.9	Very low	31.7	Very low	189 Å²	189	130.6 Å²	130.6	82%	0.822	66%	0.661	S	S	*	*			trans	-77.7	112.9	171.6	-67.7	-174.8	176	-172.6	0	109.5	T4	T4-K6 PolarHBondContact O-N 3.19Å; T4-K6 VanDerWaalsContact O-N 3.07Å
7	Y	25.7	Very low	32.3	Very low	202 Å²	202	127.9 Å²	127.9	79%	0.792	65%	0.648	S	S	*	*			trans	-89.5	148.2	162.2	-77.9	-86.1	0	0	0	109.4	V5	V5-Y7 HydrophobicContact CB-CE2 4.3Å; V5-Y7 HydrophobicContact CG1-CD2 3.87Å; V5-Y7 HydrophobicContact CG1-CE2 3.41Å; V5-Y7 VanDerWaalsContact CG1-CE2 3.41Å; V5-Y7 PolarHBondContact O-N 3.45Å
8	V	29.5	Very low	32.8	Very low	118 Å²	118	128.2 Å²	128.2	72%	0.715	64%	0.644	S	S	*	*			trans	-91.2	130.5	-171.6	178.2	0	0	0	0	110.5	D10	V8-D10 PolarHBondContact O-N 3.45Å
9	D	42	Very low	33.2	Very low	118 Å²	118	125.3 Å²	125.3	63%	0.631	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-15.8	-159.5	-66.4	-64.7	0	0	0	117.5	E11	D9-E11 PolarHBondContact O-N 3.15Å
10	D	38.1	Very low	33.4	Very low	115 Å²	115	122.3 Å²	122.3	62%	0.615	62%	0.616	S	S	*	*	H	α-helix	trans	-73	-29.5	-161	-70.3	-48.7	0	0	0	115.1	V8 S14	V8-D10 PolarHBondContact O-N 3.45Å; D10-S14 WeakPolarHBondContact O-CB 3.47Å; D10-S14 PolarHBondContact O-N 3.02Å; D10-S14 VanDerWaalsContact O-N 3.12Å
11	E	37.6	Very low	33.5	Very low	150 Å²	150	123.4 Å²	123.4	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-77.2	-39.5	-171	-152.3	170.5	-147.3	0	0	112.6	D9 S14 I15	D9-E11 PolarHBondContact O-N 3.15Å; E11-S14 WeakPolarHBondContact O-CB 3.48Å; E11-S14 PolarHBondContact O-N 3.41Å; E11-I15 WeakPolarHBondContact O-CD1 3.42Å; E11-I15 WeakPolarHBondContact O-CG1 3.36Å; E11-I15 PolarHBondContact O-N 3.29Å; E11-I15 VanDerWaalsContact O-N 3.16Å
12	H	39	Very low	33.8	Very low	109 Å²	109	118.9 Å²	118.9	51%	0.505	60%	0.6	S	S	.	*	H	α-helix	trans	-68.9	-40	176.1	-68.3	102.6	0	0	0	112	S14 I15 F16	H12-S14 PolarHBondContact O-N 3.43Å; H12-I15 PolarHBondContact O-N 3.12Å; H12-F16 PolarHBondContact O-N 3.45Å
13	K	38.8	Very low	34.5	Very low	121 Å²	121	118.2 Å²	118.2	53%	0.526	59%	0.587	S	S	.	*	H	α-helix	trans	-59.6	-44.1	174.7	-172	174.4	-178.5	176.8	0	111.7	L17	K13-L17 HydrophobicContact CG-CD1 4.08Å; K13-L17 WeakPolarHBondContact O-CB 3.49Å; K13-L17 VanDerWaalsContact O-CG 3.27Å; K13-L17 WeakPolarHBondContact O-CG 3.41Å; K13-L17 PolarHBondContact O-N 3.49Å
14	S	39.2	Very low	35	Very low	58 Å²	58	120 Å²	120	41%	0.406	59%	0.586	S	S	.	*	H	α-helix	trans	-59.7	-44.9	174.6	177.8	0	0	0	0	112.9	D10 E11 H12 K18	D10-S14 WeakPolarHBondContact O-CB 3.47Å; D10-S14 PolarHBondContact O-N 3.02Å; D10-S14 VanDerWaalsContact O-N 3.12Å; E11-S14 WeakPolarHBondContact O-CB 3.48Å; E11-S14 PolarHBondContact O-N 3.41Å; H12-S14 PolarHBondContact O-N 3.43Å; S14-K18 WeakPolarHBondContact O-CG 3.43Å; S14-K18 PolarHBondContact O-N 3.12Å
15	I	42.4	Very low	35.6	Very low	82 Å²	82	118.6 Å²	118.6	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-67.2	-43.8	-179.9	-67.6	164	0	0	0	111.6	E11 H12 K18 L19	E11-I15 WeakPolarHBondContact O-CD1 3.42Å; E11-I15 WeakPolarHBondContact O-CG1 3.36Å; E11-I15 PolarHBondContact O-N 3.29Å; E11-I15 VanDerWaalsContact O-N 3.16Å; H12-I15 PolarHBondContact O-N 3.12Å; I15-K18 PolarHBondContact O-N 3.17Å; I15-L19 HydrophobicContact CG2-CD1 4.15Å; I15-L19 PolarHBondContact O-N 3.32Å
16	F	40.8	Very low	36	Very low	37 Å²	37	122.3 Å²	122.3	16%	0.162	58%	0.584	C	S	.	*	H	α-helix	trans	-64.2	-43.8	178.8	-175.7	-108.5	0	0	0	112	H12 L19 L20 F41 Y54	H12-F16 PolarHBondContact O-N 3.45Å; F16-L19 PolarHBondContact O-N 3.29Å; F16-L20 HydrophobicContact CD1-CD1 3.87Å; F16-L20 HydrophobicContact CE1-CD1 3.47Å; F16-L20 VanDerWaalsContact CE1-CD1 3.47Å; F16-L20 HydrophobicContact CZ-CD1 3.83Å; F16-L20 PolarHBondContact O-N 3.18Å; F16-L20 VanDerWaalsContact O-N 3.14Å; F16-F41 HydrophobicContact CD1-CE1 4.28Å; F16-F41 HydrophobicContact CD1-CZ 4.13Å; F16-F41 HydrophobicContact CE1-CD1 4.09Å; F16-F41 HydrophobicContact CE1-CD2 4.3Å; F16-F41 AromaticContact CE1-CE1 3.87Å; F16-F41 HydrophobicContact CE1-CE1 3.87Å; F16-F41 HydrophobicContact CE1-CE2 4.08Å; F16-F41 HydrophobicContact CE1-CG 4.29Å; F16-F41 AromaticContact CE1-CZ 3.85Å; F16-F41 HydrophobicContact CE1-CZ 3.85Å; F16-Y54 HydrophobicContact CB-CE2 4.42Å; F16-Y54 HydrophobicContact CD2-CD1 4.36Å; F16-Y54 AromaticContact CD2-CD2 3.89Å; F16-Y54 HydrophobicContact CD2-CD2 3.89Å; F16-Y54 HydrophobicContact CD2-CE1 4.28Å; F16-Y54 AromaticContact CD2-CE2 3.8Å; F16-Y54 HydrophobicContact CD2-CE2 3.8Å; F16-Y54 HydrophobicContact CD2-CG 4.17Å; F16-Y54 AromaticContact CD2-CZ 4Å; F16-Y54 HydrophobicContact CE2-CD1 4.35Å; F16-Y54 HydrophobicContact CE2-CD2 4.47Å; F16-Y54 HydrophobicContact CE2-CG 4.31Å
17	L	40.7	Very low	36.3	Very low	85 Å²	85	115.8 Å²	115.8	45%	0.445	57%	0.571	S	S	.	*	H	α-helix	trans	-68.1	-35.5	178.4	-69.3	171.3	0	0	0	112.9	K13 L20 N21	K13-L17 HydrophobicContact CG-CD1 4.08Å; K13-L17 WeakPolarHBondContact O-CB 3.49Å; K13-L17 VanDerWaalsContact O-CG 3.27Å; K13-L17 WeakPolarHBondContact O-CG 3.41Å; K13-L17 PolarHBondContact O-N 3.49Å; L17-L20 PolarHBondContact O-N 3.23Å; L17-N21 WeakPolarHBondContact O-CB 3.34Å; L17-N21 PolarHBondContact O-N 3.21Å
18	K	41	Very low	36.4	Very low	132 Å²	132	114.9 Å²	114.9	57%	0.574	57%	0.574	S	S	*	*	H	α-helix	trans	-61.7	-46.9	172	-81.4	-177.3	176.1	-179.1	0	112.3	S14 I15 L20 N21 E22	S14-K18 WeakPolarHBondContact O-CG 3.43Å; S14-K18 PolarHBondContact O-N 3.12Å; I15-K18 PolarHBondContact O-N 3.17Å; K18-L20 VanDerWaalsContact C-N 3.26Å; K18-L20 PolarHBondContact O-N 3.35Å; K18-N21 PolarHBondContact O-N 3.22Å; K18-N21 VanDerWaalsContact O-N 3.14Å; K18-E22 WeakPolarHBondContact O-CG 3.35Å; K18-E22 PolarHBondContact O-N 3.48Å
19	L	40.6	Very low	36.3	Very low	73 Å²	73	117.5 Å²	117.5	38%	0.382	58%	0.578	S	S	.	*	H	α-helix	trans	-61.8	-32	178.4	-82.5	161.6	0	0	0	113.3	I15 F16	I15-L19 HydrophobicContact CG2-CD1 4.15Å; I15-L19 PolarHBondContact O-N 3.32Å; F16-L19 PolarHBondContact O-N 3.29Å
20	L	38.5	Very low	35.5	Very low	66 Å²	66	114.8 Å²	114.8	35%	0.346	57%	0.567	S	S	.	*	H	α-helix	trans	-71.5	-41.9	172.6	-92.6	156.9	0	0	0	112.4	F16 L17 K18 Q23	F16-L20 HydrophobicContact CD1-CD1 3.87Å; F16-L20 HydrophobicContact CE1-CD1 3.47Å; F16-L20 VanDerWaalsContact CE1-CD1 3.47Å; F16-L20 HydrophobicContact CZ-CD1 3.83Å; F16-L20 PolarHBondContact O-N 3.18Å; F16-L20 VanDerWaalsContact O-N 3.14Å; L17-L20 PolarHBondContact O-N 3.23Å; K18-L20 VanDerWaalsContact C-N 3.26Å; K18-L20 PolarHBondContact O-N 3.35Å; L20-Q23 PolarHBondContact O-N 3.23Å
21	N	35.8	Very low	35	Very low	145 Å²	145	113.3 Å²	113.3	78%	0.775	56%	0.559	S	S	*	*	H	α-helix	trans	-78	-22.6	-173.6	-155.2	33.9	0	0	0	113.7	L17 K18 Q23	L17-N21 WeakPolarHBondContact O-CB 3.34Å; L17-N21 PolarHBondContact O-N 3.21Å; K18-N21 PolarHBondContact O-N 3.22Å; K18-N21 VanDerWaalsContact O-N 3.14Å; N21-Q23 VanDerWaalsContact C-N 3.27Å; N21-Q23 PolarHBondContact O-N 3.02Å
22	E	35.8	Very low	34.6	Very low	147 Å²	147	107 Å²	107	69%	0.687	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-13.3	175.2	-74.7	172.9	-178.1	0	0	113.6	K18	K18-E22 WeakPolarHBondContact O-CG 3.35Å; K18-E22 PolarHBondContact O-N 3.48Å
23	Q	35.4	Very low	34.2	Very low	124 Å²	124	103.5 Å²	103.5	58%	0.579	52%	0.52	S	S	*	.			trans	-103.7	89.7	179.5	-65.4	-91.9	-61.6	0	0	110.2	L20 N21 L25	L20-Q23 PolarHBondContact O-N 3.23Å; N21-Q23 VanDerWaalsContact C-N 3.27Å; N21-Q23 PolarHBondContact O-N 3.02Å; Q23-L25 HydrophobicContact CB-CD1 3.91Å; Q23-L25 HydrophobicContact CB-CG 4.09Å; Q23-L25 WeakPolarHBondContact O-CG 3.41Å; Q23-L25 PolarHBondContact O-N 3.34Å; Q23-L25 VanDerWaalsContact O-N 3.08Å
24	R	29.3	Very low	33.8	Very low	221 Å²	221	98.6 Å²	98.6	83%	0.834	50%	0.5	S	S	*	.			trans	-65.8	107.7	167.1	-78.6	-179.9	69.3	169.2	-1	109	E26	R24-E26 IonicContact NH2-OE1 2.75Å
25	L	34.6	Very low	33.4	Very low	97 Å²	97	97.8 Å²	97.8	51%	0.508	49%	0.493	S	S	.	.			trans	-115.8	103.5	-174.5	-70.4	160.1	0	0	0	110	Q23 C46	Q23-L25 HydrophobicContact CB-CD1 3.91Å; Q23-L25 HydrophobicContact CB-CG 4.09Å; Q23-L25 WeakPolarHBondContact O-CG 3.41Å; Q23-L25 PolarHBondContact O-N 3.34Å; Q23-L25 VanDerWaalsContact O-N 3.08Å; L25-C46 HydrophobicContact CD2-CB 4.25Å
26	E	29	Very low	32.8	Very low	179 Å²	179	97.1 Å²	97.1	84%	0.836	49%	0.492	S	S	*	.			trans	-95.9	122	171.4	-68.5	173.8	-170.4	0	0	108.6	R24	R24-E26 IonicContact NH2-OE1 2.75Å
27	G	28.9	Very low	32.3	Very low	53 Å²	53	103.7 Å²	103.7	55%	0.546	52%	0.524	S	S	.	.			trans	172.4	142.8	-179.1	0	0	0	0	0	114.6	H44	G27-H44 PolarHBondContact O-NE2 3.42Å
28	E	27.2	Very low	31.7	Very low	182 Å²	182	107.3 Å²	107.3	85%	0.85	54%	0.543	S	S	*	.			trans	-66.3	160.6	-172.1	-62	-170.2	136.4	0	0	114.5	H44	E28-H44 PolarHBondContact O-CE1 3.13Å; E28-H44 PolarHBondContact O-NE2 2.86Å
29	H	27.1	Very low	31	Very low	173 Å²	173	104.2 Å²	104.2	80%	0.801	54%	0.536	S	S	*	.			trans	-73.1	135.1	-153.8	-52.6	-48.6	0	0	0	116.3
30	C	26.6	Very low	30.7	Very low	61 Å²	61	107 Å²	107	41%	0.412	55%	0.545	S	S	.	.			trans	-139.2	129.9	157.9	-80.6	0	0	0	0	108.5
31	D	27.1	Very low	30.3	Very low	84 Å²	84	106.9 Å²	106.9	45%	0.449	54%	0.542	S	S	.	.			trans	-106.5	102.9	-173.6	-75.4	-32.1	0	0	0	111.6	R42 I79	D31-R42 IonicContact OD1-CZ 2.78Å; D31-R42 IonicContact OD1-NE 3.3Å; D31-R42 PolarHBondContact OD1-NE 3.5Å; D31-R42 IonicContact OD1-NH2 2.74Å; D31-R42 PolarHBondContact OD1-NH2 3.5Å; D31-R42 IonicContact OD2-CZ 2.84Å; D31-R42 IonicContact OD2-NH2 3.16Å; D31-R42 PolarHBondContact OD2-NH2 3.4Å; D31-I79 WeakPolarHBondContact O-CD1 3.33Å
32	I	29.6	Very low	30.1	Very low	18 Å²	18	107 Å²	107	9%	0.092	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.8	169.3	-51.3	-178.9	0	0	0	107.6	V34 A43 L48 I79 V83	I32-V34 HydrophobicContact CG2-CG2 4.3Å; I32-A43 HydrophobicContact CB-CB 4.3Å; I32-A43 WeakPolarHBondContact CB-O 3.44Å; I32-A43 PolarHBondContact N-O 3.49Å; I32-A43 VanDerWaalsContact N-O 3.08Å; I32-A43 WeakPolarHBondContact O-CB 3.28Å; I32-A43 PolarHBondContact O-N 2.97Å; I32-L48 HydrophobicContact CD1-CD1 3.59Å; I32-L48 HydrophobicContact CD1-CD2 4.45Å; I32-L48 HydrophobicContact CD1-CG 3.98Å; I32-I79 HydrophobicContact CD1-CG2 4.41Å; I32-I79 HydrophobicContact CG1-CG2 4.22Å; I32-V83 HydrophobicContact CD1-CG2 4.42Å
33	A	29.9	Very low	29.9	Very low	36 Å²	36	100.2 Å²	100.2	30%	0.298	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.8	169	0	0	0	0	0	108.5	F41 I75	A33-F41 WeakPolarHBondContact CA-O 3.17Å; A33-I75 HydrophobicContact CB-CD1 4.22Å
34	V	31.1	Very low	29.9	Very low	17 Å²	17	97.1 Å²	97.1	10%	0.103	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.8	171.1	-175.7	0	0	0	0	107.6	I32 V36 F41 A43	I32-V34 HydrophobicContact CG2-CG2 4.3Å; V34-V36 HydrophobicContact CG1-CG2 4.42Å; V34-F41 PolarHBondContact N-O 3.44Å; V34-F41 PolarHBondContact O-N 3.47Å; V34-A43 HydrophobicContact CG2-CB 4.18Å
35	V	30.7	Very low	30.1	Very low	42 Å²	42	93.8 Å²	93.8	26%	0.255	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.8	178.6	-170.8	0	0	0	0	108.1	K40	V35-K40 HydrophobicContact CG2-CG 4.14Å
36	V	30	Very low	30.1	Very low	67 Å²	67	91.3 Å²	91.3	41%	0.406	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	120.5	167.2	-176.6	0	0	0	0	106.4	V34 D38 V39	V34-V36 HydrophobicContact CG1-CG2 4.42Å; V36-D38 PolarHBondContact O-N 2.96Å; V36-V39 PolarHBondContact N-O 3.38Å; V36-V39 PolarHBondContact O-N 3.01Å; V36-V39 VanDerWaalsContact O-N 3.12Å
37	E	28.8	Very low	30.5	Very low	175 Å²	175	83.7 Å²	83.7	82%	0.818	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.8	62.9	176.7	-63.2	-178.1	149.7	0	0	113	V39	E37-V39 PolarHBondContact O-N 2.96Å
38	D	29.1	Very low	31.2	Very low	161 Å²	161	82.6 Å²	82.6	86%	0.861	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	4.9	178.8	-67	-32.9	0	0	0	117.5	V36	V36-D38 PolarHBondContact O-N 2.96Å
39	V	27.1	Very low	31.8	Very low	68 Å²	68	76 Å²	76	41%	0.412	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	115.7	168.9	-168.6	0	0	0	0	110.4	V36 E37 F41	V36-V39 PolarHBondContact N-O 3.38Å; V36-V39 PolarHBondContact O-N 3.01Å; V36-V39 VanDerWaalsContact O-N 3.12Å; E37-V39 PolarHBondContact O-N 2.96Å; V39-F41 HydrophobicContact CB-CD2 4.48Å; V39-F41 HydrophobicContact CB-CE2 3.75Å; V39-F41 HydrophobicContact CB-CZ 4.1Å; V39-F41 HydrophobicContact CG1-CD2 4.15Å; V39-F41 HydrophobicContact CG1-CE1 4.02Å; V39-F41 HydrophobicContact CG1-CE2 3.47Å; V39-F41 VanDerWaalsContact CG1-CE2 3.47Å; V39-F41 HydrophobicContact CG1-CZ 3.4Å
40	K	32.8	Very low	32.4	Very low	131 Å²	131	70.1 Å²	70.1	57%	0.57	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	118.6	176	-68.9	170.4	179.6	169.2	0	110.5	V35 Y260	V35-K40 HydrophobicContact CG2-CG 4.14Å; K40-Y260 VanDerWaalsContact CD-OH 3.3Å; K40-Y260 WeakPolarHBondContact CD-OH 3.23Å
41	F	29.9	Very low	33.2	Very low	64 Å²	64	67.9 Å²	67.9	28%	0.281	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	136.4	173	-63.1	-84.3	0	0	0	111.4	F16 A33 V34 V39	F16-F41 HydrophobicContact CD1-CE1 4.28Å; F16-F41 HydrophobicContact CD1-CZ 4.13Å; F16-F41 HydrophobicContact CE1-CD1 4.09Å; F16-F41 HydrophobicContact CE1-CD2 4.3Å; F16-F41 AromaticContact CE1-CE1 3.87Å; F16-F41 HydrophobicContact CE1-CE1 3.87Å; F16-F41 HydrophobicContact CE1-CE2 4.08Å; F16-F41 HydrophobicContact CE1-CG 4.29Å; F16-F41 AromaticContact CE1-CZ 3.85Å; F16-F41 HydrophobicContact CE1-CZ 3.85Å; A33-F41 WeakPolarHBondContact CA-O 3.17Å; V34-F41 PolarHBondContact N-O 3.44Å; V34-F41 PolarHBondContact O-N 3.47Å; V39-F41 HydrophobicContact CB-CD2 4.48Å; V39-F41 HydrophobicContact CB-CE2 3.75Å; V39-F41 HydrophobicContact CB-CZ 4.1Å; V39-F41 HydrophobicContact CG1-CD2 4.15Å; V39-F41 HydrophobicContact CG1-CE1 4.02Å; V39-F41 HydrophobicContact CG1-CE2 3.47Å; V39-F41 VanDerWaalsContact CG1-CE2 3.47Å; V39-F41 HydrophobicContact CG1-CZ 3.4Å
42	R	31.5	Very low	33.9	Very low	148 Å²	148	64.9 Å²	64.9	56%	0.558	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	126.8	169.3	-166.6	177.5	-172.6	161.1	2.1	108.9	D31	D31-R42 IonicContact OD1-CZ 2.78Å; D31-R42 IonicContact OD1-NE 3.3Å; D31-R42 PolarHBondContact OD1-NE 3.5Å; D31-R42 IonicContact OD1-NH2 2.74Å; D31-R42 PolarHBondContact OD1-NH2 3.5Å; D31-R42 IonicContact OD2-CZ 2.84Å; D31-R42 IonicContact OD2-NH2 3.16Å; D31-R42 PolarHBondContact OD2-NH2 3.4Å
43	A	32.5	Very low	34.5	Very low	3 Å²	3	68.6 Å²	68.6	3%	0.025	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.1	-165.6	0	0	0	0	0	110.6	I32 V34 V47	I32-A43 HydrophobicContact CB-CB 4.3Å; I32-A43 WeakPolarHBondContact CB-O 3.44Å; I32-A43 PolarHBondContact N-O 3.49Å; I32-A43 VanDerWaalsContact N-O 3.08Å; I32-A43 WeakPolarHBondContact O-CB 3.28Å; I32-A43 PolarHBondContact O-N 2.97Å; V34-A43 HydrophobicContact CG2-CB 4.18Å; A43-V47 HydrophobicContact CB-CB 3.71Å; A43-V47 HydrophobicContact CB-CG1 3.5Å; A43-V47 VanDerWaalsContact CB-CG1 3.5Å; A43-V47 HydrophobicContact CB-CG2 4.42Å
44	H	34.4	Very low	35.2	Very low	59 Å²	59	69.5 Å²	69.5	27%	0.273	36%	0.355	S	S	.	.			trans	-78.8	171.2	172.5	-165.6	-69	0	0	0	110.6	G27 E28 C46 V47 L48	G27-H44 PolarHBondContact O-NE2 3.42Å; E28-H44 PolarHBondContact O-CE1 3.13Å; E28-H44 PolarHBondContact O-NE2 2.86Å; H44-C46 PolarHBondContact ND1-SG 3.29Å; H44-C46 VanDerWaalsContact ND1-SG 3.42Å; H44-C46 PolarHBondContact O-N 3Å; H44-V47 HydrophobicContact CB-CG2 4.19Å; H44-V47 WeakPolarHBondContact O-CA 3.23Å; H44-V47 WeakPolarHBondContact O-CB 3.39Å; H44-V47 PolarHBondContact O-N 3.49Å; H44-L48 PolarHBondContact O-N 3.1Å
45	R	33.8	Very low	35.9	Very low	152 Å²	152	70.6 Å²	70.6	57%	0.574	36%	0.358	S	S	*	.	H	α-helix	trans	-58.2	-30.7	174.8	-165.2	172.2	178.1	112.4	-6	112.1	E82	R45-E82 IonicContact CZ-OE2 2.67Å; R45-E82 IonicContact NH1-OE1 3.99Å; R45-E82 PolarHBondContact NH1-OE1 2.66Å; R45-E82 IonicContact NH1-OE2 3.41Å; R45-E82 PolarHBondContact NH1-OE2 3.12Å; R45-E82 IonicContact NH2-OE1 2.89Å
46	C	35.1	Very low	36.5	Very low	44 Å²	44	74.6 Å²	74.6	30%	0.297	37%	0.372	S	S	.	.	H	α-helix	trans	-72.9	-22.6	170.6	52.2	0	0	0	0	113.9	L25 H44 A49 A50	L25-C46 HydrophobicContact CD2-CB 4.25Å; H44-C46 PolarHBondContact ND1-SG 3.29Å; H44-C46 VanDerWaalsContact ND1-SG 3.42Å; H44-C46 PolarHBondContact O-N 3Å; C46-A49 WeakPolarHBondContact O-CB 3.39Å; C46-A49 PolarHBondContact O-N 2.92Å; C46-A50 PolarHBondContact O-N 3.41Å
47	V	38.1	Very low	37.1	Very low	19 Å²	19	78.1 Å²	78.1	12%	0.115	38%	0.382	C	S	.	.	H	α-helix	trans	-73.1	-28	175	-180	0	0	0	0	111.4	A43 H44 A49 A50 C51	A43-V47 HydrophobicContact CB-CB 3.71Å; A43-V47 HydrophobicContact CB-CG1 3.5Å; A43-V47 VanDerWaalsContact CB-CG1 3.5Å; A43-V47 HydrophobicContact CB-CG2 4.42Å; H44-V47 HydrophobicContact CB-CG2 4.19Å; H44-V47 WeakPolarHBondContact O-CA 3.23Å; H44-V47 WeakPolarHBondContact O-CB 3.39Å; H44-V47 PolarHBondContact O-N 3.49Å; V47-A49 VanDerWaalsContact C-N 3.25Å; V47-A49 PolarHBondContact O-N 3.36Å; V47-A50 PolarHBondContact O-N 3.09Å; V47-C51 VanDerWaalsContact O-CB 3.26Å; V47-C51 WeakPolarHBondContact O-CB 3.36Å; V47-C51 PolarHBondContact O-N 3.08Å; V47-C51 PolarHBondContact O-SG 2.97Å
48	L	42.9	Very low	37.5	Very low	31 Å²	31	72.5 Å²	72.5	16%	0.162	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-34.6	168.7	-72.4	176.8	0	0	0	112.5	I32 H44 S52 V83 Y86	I32-L48 HydrophobicContact CD1-CD1 3.59Å; I32-L48 HydrophobicContact CD1-CD2 4.45Å; I32-L48 HydrophobicContact CD1-CG 3.98Å; H44-L48 PolarHBondContact O-N 3.1Å; L48-S52 WeakPolarHBondContact O-CB 3.47Å; L48-S52 PolarHBondContact O-N 3.45Å; L48-V83 HydrophobicContact CD1-CG2 4.3Å; L48-Y86 HydrophobicContact CB-CE1 4.22Å
49	A	39.3	Very low	38.1	Very low	43 Å²	43	69.6 Å²	69.6	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-73.2	-39.7	173.8	0	0	0	0	0	112.1	C46 V47 S52 N53	C46-A49 WeakPolarHBondContact O-CB 3.39Å; C46-A49 PolarHBondContact O-N 2.92Å; V47-A49 VanDerWaalsContact C-N 3.25Å; V47-A49 PolarHBondContact O-N 3.36Å; A49-S52 WeakPolarHBondContact O-CB 3.49Å; A49-S52 PolarHBondContact O-N 3.26Å; A49-N53 PolarHBondContact O-N 2.95Å
50	A	39.2	Very low	38.7	Very low	49 Å²	49	75.3 Å²	75.3	41%	0.405	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-46.1	173.4	0	0	0	0	0	111.8	C46 V47 N53 Y54	C46-A50 PolarHBondContact O-N 3.41Å; V47-A50 PolarHBondContact O-N 3.09Å; A50-N53 CarbonylContact O-C 3.59Å; A50-N53 PolarHBondContact O-N 3.1Å; A50-Y54 WeakPolarHBondContact O-CB 3.29Å; A50-Y54 PolarHBondContact O-N 2.85Å
51	C	43.9	Very low	38.9	Very low	15 Å²	15	77.4 Å²	77.4	10%	0.101	37%	0.365	C	S	.	.	H	α-helix	trans	-58.8	-44.7	170.9	-72.6	0	0	0	0	111.2	V47 N53 Y54 F55	V47-C51 VanDerWaalsContact O-CB 3.26Å; V47-C51 WeakPolarHBondContact O-CB 3.36Å; V47-C51 PolarHBondContact O-N 3.08Å; V47-C51 PolarHBondContact O-SG 2.97Å; C51-N53 VanDerWaalsContact C-N 3.29Å; C51-N53 PolarHBondContact O-N 3.45Å; C51-Y54 PolarHBondContact O-N 3.47Å; C51-F55 HydrophobicContact CB-CD2 4.14Å; C51-F55 HydrophobicContact CB-CE2 4.03Å; C51-F55 WeakPolarHBondContact O-CB 3.07Å; C51-F55 WeakPolarHBondContact O-CD2 3.49Å; C51-F55 WeakPolarHBondContact O-CG 3.16Å; C51-F55 PolarHBondContact O-N 3.48Å
52	S	42.9	Very low	39.2	Very low	20 Å²	20	79.5 Å²	79.5	14%	0.14	38%	0.376	C	S	.	.	H	α-helix	trans	-56.5	-43.3	175	-168.4	0	0	0	0	111.7	L48 A49 K56	L48-S52 WeakPolarHBondContact O-CB 3.47Å; L48-S52 PolarHBondContact O-N 3.45Å; A49-S52 WeakPolarHBondContact O-CB 3.49Å; A49-S52 PolarHBondContact O-N 3.26Å; S52-K56 WeakPolarHBondContact O-CB 3.37Å; S52-K56 VanDerWaalsContact O-CD 3.32Å; S52-K56 WeakPolarHBondContact O-CD 3.49Å; S52-K56 WeakPolarHBondContact O-CG 3.46Å; S52-K56 PolarHBondContact O-N 3.03Å; S52-K56 WeakPolarHBondContact OG-CE 3.2Å; S52-K56 PolarHBondContact OG-NZ 3.23Å
53	N	42.3	Very low	39.3	Very low	97 Å²	97	82 Å²	82	52%	0.519	39%	0.394	S	S	.	.	H	α-helix	trans	-74	-33	177.3	-76.2	-26.4	0	0	0	113.5	A49 A50 C51 K57	A49-N53 PolarHBondContact O-N 2.95Å; A50-N53 CarbonylContact O-C 3.59Å; A50-N53 PolarHBondContact O-N 3.1Å; C51-N53 VanDerWaalsContact C-N 3.29Å; C51-N53 PolarHBondContact O-N 3.45Å; N53-K57 WeakPolarHBondContact O-CB 3.21Å; N53-K57 WeakPolarHBondContact O-CG 3.47Å; N53-K57 PolarHBondContact O-N 3.07Å
54	Y	44.3	Very low	39.4	Very low	55 Å²	55	84.3 Å²	84.3	22%	0.216	41%	0.407	C	S	.	.	H	α-helix	trans	-65.2	-54	172.7	178.7	-102.7	0	0	0	110.6	F16 A50 C51 K56 K57 L58	F16-Y54 HydrophobicContact CB-CE2 4.42Å; F16-Y54 HydrophobicContact CD2-CD1 4.36Å; F16-Y54 AromaticContact CD2-CD2 3.89Å; F16-Y54 HydrophobicContact CD2-CD2 3.89Å; F16-Y54 HydrophobicContact CD2-CE1 4.28Å; F16-Y54 AromaticContact CD2-CE2 3.8Å; F16-Y54 HydrophobicContact CD2-CE2 3.8Å; F16-Y54 HydrophobicContact CD2-CG 4.17Å; F16-Y54 AromaticContact CD2-CZ 4Å; F16-Y54 HydrophobicContact CE2-CD1 4.35Å; F16-Y54 HydrophobicContact CE2-CD2 4.47Å; F16-Y54 HydrophobicContact CE2-CG 4.31Å; A50-Y54 WeakPolarHBondContact O-CB 3.29Å; A50-Y54 PolarHBondContact O-N 2.85Å; C51-Y54 PolarHBondContact O-N 3.47Å; Y54-K56 PolarHBondContact O-N 3.43Å; Y54-K57 CarbonylContact O-C 3.55Å; Y54-K57 WeakPolarHBondContact O-CA 3.38Å; Y54-K57 PolarHBondContact O-N 3.16Å; Y54-L58 HydrophobicContact CE1-CD1 4.26Å; Y54-L58 WeakPolarHBondContact O-CB 3.48Å; Y54-L58 PolarHBondContact O-N 3.33Å
55	F	44.4	Very low	39.2	Very low	40 Å²	40	87.3 Å²	87.3	18%	0.175	43%	0.426	C	S	.	.	H	α-helix	trans	-58.8	-44.7	174.8	-71.4	-57.9	0	0	0	111.6	C51 K57 L58 F59 I70	C51-F55 HydrophobicContact CB-CD2 4.14Å; C51-F55 HydrophobicContact CB-CE2 4.03Å; C51-F55 WeakPolarHBondContact O-CB 3.07Å; C51-F55 WeakPolarHBondContact O-CD2 3.49Å; C51-F55 WeakPolarHBondContact O-CG 3.16Å; C51-F55 PolarHBondContact O-N 3.48Å; F55-K57 VanDerWaalsContact C-N 3.29Å; F55-K57 PolarHBondContact O-N 3.32Å; F55-L58 WeakPolarHBondContact O-CB 3.47Å; F55-L58 PolarHBondContact O-N 3.19Å; F55-L58 VanDerWaalsContact O-N 3.12Å; F55-F59 HydrophobicContact CB-CD2 4.09Å; F55-F59 HydrophobicContact CB-CE2 3.97Å; F55-F59 HydrophobicContact CD1-CE2 4.33Å; F55-F59 HydrophobicContact CG-CE2 4.49Å; F55-F59 WeakPolarHBondContact O-CB 3.47Å; F55-F59 WeakPolarHBondContact O-CD2 3.36Å; F55-F59 WeakPolarHBondContact O-CG 3.39Å; F55-F59 PolarHBondContact O-N 3Å; F55-I70 HydrophobicContact CD1-CD1 4.28Å; F55-I70 HydrophobicContact CE1-CD1 3.91Å
56	K	43.8	Very low	39.2	Very low	125 Å²	125	88.8 Å²	88.8	54%	0.543	45%	0.445	S	S	.	.	H	α-helix	trans	-60.1	-34	173.4	-77.4	164.8	-178.5	154.4	0	113.3	S52 Y54 K60	S52-K56 WeakPolarHBondContact O-CB 3.37Å; S52-K56 VanDerWaalsContact O-CD 3.32Å; S52-K56 WeakPolarHBondContact O-CD 3.49Å; S52-K56 WeakPolarHBondContact O-CG 3.46Å; S52-K56 PolarHBondContact O-N 3.03Å; S52-K56 WeakPolarHBondContact OG-CE 3.2Å; S52-K56 PolarHBondContact OG-NZ 3.23Å; Y54-K56 PolarHBondContact O-N 3.43Å; K56-K60 WeakPolarHBondContact O-CB 3.32Å; K56-K60 PolarHBondContact O-N 3.43Å
57	K	42	Very low	39.1	Very low	142 Å²	142	91.2 Å²	91.2	62%	0.617	46%	0.462	S	S	*	.	H	α-helix	trans	-74.3	-37.7	172.8	-80.8	179.1	175.5	178.5	0	111.8	N53 Y54 F55 K60 K61	N53-K57 WeakPolarHBondContact O-CB 3.21Å; N53-K57 WeakPolarHBondContact O-CG 3.47Å; N53-K57 PolarHBondContact O-N 3.07Å; Y54-K57 CarbonylContact O-C 3.55Å; Y54-K57 WeakPolarHBondContact O-CA 3.38Å; Y54-K57 PolarHBondContact O-N 3.16Å; F55-K57 VanDerWaalsContact C-N 3.29Å; F55-K57 PolarHBondContact O-N 3.32Å; K57-K60 PolarHBondContact O-N 3.44Å; K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 3.41Å
58	L	38.5	Very low	38.8	Very low	57 Å²	57	94 Å²	94	30%	0.298	48%	0.483	S	S	.	.	H	α-helix	trans	-62.4	-56.3	177.2	-149.6	83.2	0	0	0	110.5	Y54 F55 K60 K61 H62	Y54-L58 HydrophobicContact CE1-CD1 4.26Å; Y54-L58 WeakPolarHBondContact O-CB 3.48Å; Y54-L58 PolarHBondContact O-N 3.33Å; F55-L58 WeakPolarHBondContact O-CB 3.47Å; F55-L58 PolarHBondContact O-N 3.19Å; F55-L58 VanDerWaalsContact O-N 3.12Å; L58-K60 PolarHBondContact O-N 3.02Å; L58-K60 VanDerWaalsContact O-N 3.15Å; L58-K61 PolarHBondContact O-N 3.06Å; L58-K61 VanDerWaalsContact O-N 3.14Å; L58-H62 PolarHBondContact O-N 3.16Å
59	F	40.6	Very low	38.4	Very low	99 Å²	99	96.3 Å²	96.3	43%	0.434	50%	0.498	S	S	.	.	H	α-helix	trans	-65.3	-12.8	177.2	-68.8	-58.4	0	0	0	114.7	F55 H62 V64 I70	F55-F59 HydrophobicContact CB-CD2 4.09Å; F55-F59 HydrophobicContact CB-CE2 3.97Å; F55-F59 HydrophobicContact CD1-CE2 4.33Å; F55-F59 HydrophobicContact CG-CE2 4.49Å; F55-F59 WeakPolarHBondContact O-CB 3.47Å; F55-F59 WeakPolarHBondContact O-CD2 3.36Å; F55-F59 WeakPolarHBondContact O-CG 3.39Å; F55-F59 PolarHBondContact O-N 3Å; F59-H62 CarbonylContact C-O 3.57Å; F59-V64 HydrophobicContact CD1-CB 3.87Å; F59-V64 HydrophobicContact CD1-CG1 4.4Å; F59-V64 HydrophobicContact CD1-CG2 3.84Å; F59-V64 HydrophobicContact CE1-CB 4.05Å; F59-V64 HydrophobicContact CE1-CG1 4.07Å; F59-V64 HydrophobicContact CE1-CG2 4.2Å; F59-I70 HydrophobicContact CZ-CD1 4.14Å
60	K	39.6	Very low	38.1	Very low	189 Å²	189	97 Å²	97	82%	0.822	50%	0.495	S	S	*	.	H	α-helix	trans	-103.6	-12	176.5	-165.2	175.1	-174.6	-177.8	0	113.1	K56 K57 L58	K56-K60 WeakPolarHBondContact O-CB 3.32Å; K56-K60 PolarHBondContact O-N 3.43Å; K57-K60 PolarHBondContact O-N 3.44Å; L58-K60 PolarHBondContact O-N 3.02Å; L58-K60 VanDerWaalsContact O-N 3.15Å
61	K	37.7	Very low	37.8	Very low	174 Å²	174	99 Å²	99	76%	0.757	50%	0.496	S	S	*	.	H	α-helix	trans	-105.7	-26.6	178.6	-164	-175.9	179.9	-162.7	0	112.4	K57 L58	K57-K61 WeakPolarHBondContact O-CB 3.43Å; K57-K61 PolarHBondContact O-N 3.41Å; L58-K61 PolarHBondContact O-N 3.06Å; L58-K61 VanDerWaalsContact O-N 3.14Å
62	H	36.1	Very low	37.6	Very low	109 Å²	109	100.5 Å²	100.5	51%	0.505	50%	0.502	S	S	.	.	S	Bend	trans	-117.7	134.1	168	-71.1	-93.9	0	0	0	109.2	L58 F59 V64	L58-H62 PolarHBondContact O-N 3.16Å; F59-H62 CarbonylContact C-O 3.57Å; H62-V64 HydrophobicContact CB-CG2 4.03Å; H62-V64 PolarHBondContact O-N 2.85Å
63	E	33.1	Very low	37.1	Very low	200 Å²	200	104.8 Å²	104.8	94%	0.935	52%	0.524	S	S	*	.			trans	-68.1	85.5	159.9	-71.9	-178.5	133.6	0	0	107.4	D65	E63-D65 PolarHBondContact O-N 3.47Å
64	V	35.7	Very low	36.8	Very low	51 Å²	51	103.2 Å²	103.2	31%	0.309	51%	0.512	S	S	.	.			trans	-75.6	110.4	174.7	-175.6	0	0	0	0	107.2	F59 H62 S68	F59-V64 HydrophobicContact CD1-CB 3.87Å; F59-V64 HydrophobicContact CD1-CG1 4.4Å; F59-V64 HydrophobicContact CD1-CG2 3.84Å; F59-V64 HydrophobicContact CE1-CB 4.05Å; F59-V64 HydrophobicContact CE1-CG1 4.07Å; F59-V64 HydrophobicContact CE1-CG2 4.2Å; H62-V64 HydrophobicContact CB-CG2 4.03Å; H62-V64 PolarHBondContact O-N 2.85Å; V64-S68 WeakPolarHBondContact CG1-OG 3.33Å
65	D	30.4	Very low	36.2	Very low	123 Å²	123	107.9 Å²	107.9	66%	0.658	54%	0.54	S	S	*	.			trans	-53.2	145.2	175.5	-80.2	-49.5	0	0	0	111.3	E63 S67 S68	E63-D65 PolarHBondContact O-N 3.47Å; D65-S67 PolarHBondContact O-N 3.41Å; D65-S68 PolarHBondContact O-N 3.03Å
66	N	33.8	Very low	35.6	Very low	183 Å²	183	112.7 Å²	112.7	98%	0.979	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	15.1	-175.2	-67	-62.9	0	0	0	115.1
67	S	32.7	Very low	35.3	Very low	95 Å²	95	111.7 Å²	111.7	66%	0.664	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-12.5	-179.8	54.3	0	0	0	0	114	D65 V69	D65-S67 PolarHBondContact O-N 3.41Å; S67-V69 PolarHBondContact O-N 2.88Å
68	S	32	Very low	35.2	Very low	77 Å²	77	109.6 Å²	109.6	54%	0.538	56%	0.561	S	S	.	*			trans	-71.4	108.2	177.9	-61.8	0	0	0	0	111.8	V64 D65	V64-S68 WeakPolarHBondContact CG1-OG 3.33Å; D65-S68 PolarHBondContact O-N 3.03Å
69	V	32.9	Very low	35.2	Very low	80 Å²	80	108.4 Å²	108.4	49%	0.485	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-89.9	122.2	176	-179	0	0	0	0	109.5	S67 E71	S67-V69 PolarHBondContact O-N 2.88Å; V69-E71 HydrophobicContact CG1-CG 4.22Å
70	I	34.3	Very low	35.3	Very low	56 Å²	56	108.1 Å²	108.1	29%	0.287	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-95.9	117.3	169.3	-56.1	175.2	0	0	0	107.4	F55 F59 I72	F55-I70 HydrophobicContact CD1-CD1 4.28Å; F55-I70 HydrophobicContact CE1-CD1 3.91Å; F59-I70 HydrophobicContact CZ-CD1 4.14Å; I70-I72 HydrophobicContact CG2-CD1 4.36Å; I70-I72 HydrophobicContact CG2-CG1 4.02Å
71	E	33.8	Very low	35.4	Very low	92 Å²	92	106.5 Å²	106.5	43%	0.43	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-91.7	134.6	171.9	-61.5	-168.4	153.5	0	0	109.7	V69 K96	V69-E71 HydrophobicContact CG1-CG 4.22Å; E71-K96 WeakPolarHBondContact OE1-CD 3.39Å; E71-K96 WeakPolarHBondContact OE1-CE 3.31Å; E71-K96 WeakPolarHBondContact OE1-CG 3.39Å; E71-K96 IonicContact OE1-NZ 2.67Å; E71-K96 PolarHBondContact OE1-NZ 3.28Å; E71-K96 WeakPolarHBondContact OE2-CE 3.42Å; E71-K96 IonicContact OE2-NZ 3.7Å; E71-K96 PolarHBondContact OE2-NZ 3.48Å
72	I	37.8	Very low	35.7	Very low	46 Å²	46	103.8 Å²	103.8	24%	0.236	54%	0.539	C	S	.	.			trans	-133.6	108.9	178.5	-53.4	177.6	0	0	0	107.5	I70 F74 M87	I70-I72 HydrophobicContact CG2-CD1 4.36Å; I70-I72 HydrophobicContact CG2-CG1 4.02Å; I72-F74 HydrophobicContact CB-CE2 4.08Å; I72-F74 HydrophobicContact CB-CZ 4.27Å; I72-F74 HydrophobicContact CG2-CD2 4.44Å; I72-F74 HydrophobicContact CG2-CE1 4.13Å; I72-F74 HydrophobicContact CG2-CE2 3.74Å; I72-F74 HydrophobicContact CG2-CZ 3.56Å; I72-F74 WeakPolarHBondContact O-CD2 3.21Å; I72-F74 WeakPolarHBondContact O-CE2 3.4Å; I72-M87 HydrophobicContact CD1-SD 4.46Å
73	D	32.8	Very low	36.1	Very low	110 Å²	110	99 Å²	99	59%	0.588	52%	0.517	S	S	*	.			trans	-88.7	127.1	178.5	-72.5	-30.8	0	0	0	111
74	F	36.2	Very low	36.8	Very low	64 Å²	64	92.5 Å²	92.5	28%	0.281	49%	0.489	S	S	.	.			trans	-103.8	125.2	-180	-64.8	-86.2	0	0	0	111.3	I72 R76 F80 V83	I72-F74 HydrophobicContact CB-CE2 4.08Å; I72-F74 HydrophobicContact CB-CZ 4.27Å; I72-F74 HydrophobicContact CG2-CD2 4.44Å; I72-F74 HydrophobicContact CG2-CE1 4.13Å; I72-F74 HydrophobicContact CG2-CE2 3.74Å; I72-F74 HydrophobicContact CG2-CZ 3.56Å; I72-F74 WeakPolarHBondContact O-CD2 3.21Å; I72-F74 WeakPolarHBondContact O-CE2 3.4Å; F74-R76 VanDerWaalsContact C-N 3.3Å; F74-R76 PolarHBondContact O-N 3.44Å; F74-F80 AromaticContact CD2-CD2 3.71Å; F74-F80 HydrophobicContact CD2-CD2 3.71Å; F74-F80 HydrophobicContact CD2-CE2 4.1Å; F74-F80 HydrophobicContact CE2-CD2 4.14Å; F74-F80 HydrophobicContact CE2-CE2 4.37Å; F74-F80 HydrophobicContact CG-CD2 4.14Å; F74-V83 HydrophobicContact CE1-CB 3.96Å; F74-V83 HydrophobicContact CE1-CG1 3.72Å; F74-V83 HydrophobicContact CE1-CG2 4.07Å; F74-V83 HydrophobicContact CZ-CB 4.15Å; F74-V83 HydrophobicContact CZ-CG1 3.57Å
75	I	32.6	Very low	37.1	Very low	154 Å²	154	95.8 Å²	95.8	79%	0.79	50%	0.504	S	S	*	.	S	Bend	trans	-80.1	-12.7	-177.2	-59.6	172.3	0	0	0	112.1	A33	A33-I75 HydrophobicContact CB-CD1 4.22Å
76	R	31.9	Very low	37.7	Very low	140 Å²	140	94.4 Å²	94.4	53%	0.528	49%	0.491	S	S	.	.			trans	-138.9	135.3	179.9	-84.8	175.5	50.9	173.4	-10	111.9	F74 D78 I79	F74-R76 VanDerWaalsContact C-N 3.3Å; F74-R76 PolarHBondContact O-N 3.44Å; R76-D78 WeakPolarHBondContact CB-OD1 3.28Å; R76-D78 IonicContact CZ-OD1 2.85Å; R76-D78 IonicContact CZ-OD2 3.73Å; R76-D78 IonicContact NE-OD1 3.83Å; R76-D78 PolarHBondContact NE-OD1 2.96Å; R76-D78 IonicContact NE-OD2 3.04Å; R76-D78 IonicContact NH2-OD1 3.36Å; R76-D78 PolarHBondContact NH2-OD1 3.35Å; R76-D78 IonicContact NH2-OD2 3.53Å; R76-D78 PolarHBondContact NH2-OD2 3.18Å; R76-I79 HydrophobicContact CB-CD1 4.29Å
77	S	37	Very low	38.1	Very low	105 Å²	105	87.5 Å²	87.5	73%	0.734	45%	0.453	S	S	*	.	H	α-helix	trans	-75.6	-22.7	-177.9	49.9	0	0	0	0	114.7	F80	S77-F80 WeakPolarHBondContact O-CB 3.48Å; S77-F80 PolarHBondContact O-N 3.49Å
78	D	39	Very low	38.3	Very low	98 Å²	98	90.5 Å²	90.5	52%	0.524	45%	0.451	S	S	.	.	H	α-helix	trans	-79.6	-20.5	-179.2	63.8	-19.7	0	0	0	113.7	R76	R76-D78 WeakPolarHBondContact CB-OD1 3.28Å; R76-D78 IonicContact CZ-OD1 2.85Å; R76-D78 IonicContact CZ-OD2 3.73Å; R76-D78 IonicContact NE-OD1 3.83Å; R76-D78 PolarHBondContact NE-OD1 2.96Å; R76-D78 IonicContact NE-OD2 3.04Å; R76-D78 IonicContact NH2-OD1 3.36Å; R76-D78 PolarHBondContact NH2-OD1 3.35Å; R76-D78 IonicContact NH2-OD2 3.53Å; R76-D78 PolarHBondContact NH2-OD2 3.18Å
79	I	39.4	Very low	38.5	Very low	32 Å²	32	92.2 Å²	92.2	16%	0.164	46%	0.458	C	S	.	.	H	α-helix	trans	-84	-22.5	172.3	-61.4	172.9	0	0	0	110.9	D31 I32 R76 E81 E82 V83	D31-I79 WeakPolarHBondContact O-CD1 3.33Å; I32-I79 HydrophobicContact CD1-CG2 4.41Å; I32-I79 HydrophobicContact CG1-CG2 4.22Å; R76-I79 HydrophobicContact CB-CD1 4.29Å; I79-E81 PolarHBondContact O-N 3.27Å; I79-E82 PolarHBondContact O-N 3.25Å; I79-V83 HydrophobicContact CG2-CG2 3.89Å; I79-V83 WeakPolarHBondContact O-CG2 3.46Å; I79-V83 PolarHBondContact O-N 2.95Å; I79-V83 VanDerWaalsContact O-N 3.12Å
80	F	41.9	Very low	38.6	Very low	93 Å²	93	90.6 Å²	90.6	41%	0.408	45%	0.453	S	S	.	.	H	α-helix	trans	-61.7	-40.8	-176.3	-175.8	-117.1	0	0	0	112.7	F74 S77 L84	F74-F80 AromaticContact CD2-CD2 3.71Å; F74-F80 HydrophobicContact CD2-CD2 3.71Å; F74-F80 HydrophobicContact CD2-CE2 4.1Å; F74-F80 HydrophobicContact CE2-CD2 4.14Å; F74-F80 HydrophobicContact CE2-CE2 4.37Å; F74-F80 HydrophobicContact CG-CD2 4.14Å; S77-F80 WeakPolarHBondContact O-CB 3.48Å; S77-F80 PolarHBondContact O-N 3.49Å; F80-L84 HydrophobicContact CD1-CD1 3.71Å; F80-L84 HydrophobicContact CD2-CD1 4.44Å; F80-L84 HydrophobicContact CE1-CD1 3.32Å; F80-L84 HydrophobicContact CE1-CG 4.35Å; F80-L84 HydrophobicContact CE2-CD1 4.11Å; F80-L84 HydrophobicContact CE2-CG 4.32Å; F80-L84 HydrophobicContact CG-CD1 4.26Å; F80-L84 HydrophobicContact CZ-CD1 3.55Å; F80-L84 HydrophobicContact CZ-CG 4.2Å; F80-L84 VanDerWaalsContact O-CB 3.25Å; F80-L84 WeakPolarHBondContact O-CB 3.2Å; F80-L84 PolarHBondContact O-N 3.13Å
81	E	42.3	Very low	38.5	Very low	155 Å²	155	97.6 Å²	97.6	72%	0.724	48%	0.482	S	S	*	.	H	α-helix	trans	-68.5	-43.5	179.4	-68.8	-169.1	164.6	0	0	112.8	I79 V83 L84 N85	I79-E81 PolarHBondContact O-N 3.27Å; E81-V83 PolarHBondContact O-N 3.43Å; E81-L84 PolarHBondContact O-N 3.2Å; E81-N85 WeakPolarHBondContact O-CB 3.34Å; E81-N85 PolarHBondContact O-N 2.39Å
82	E	44.2	Very low	38.7	Very low	116 Å²	116	96.8 Å²	96.8	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-62.2	-42.7	175.8	-75.3	-153.8	141.5	0	0	111.6	R45 I79 N85 Y86	R45-E82 IonicContact CZ-OE2 2.67Å; R45-E82 IonicContact NH1-OE1 3.99Å; R45-E82 PolarHBondContact NH1-OE1 2.66Å; R45-E82 IonicContact NH1-OE2 3.41Å; R45-E82 PolarHBondContact NH1-OE2 3.12Å; R45-E82 IonicContact NH2-OE1 2.89Å; I79-E82 PolarHBondContact O-N 3.25Å; E82-N85 PolarHBondContact O-N 3.24Å; E82-Y86 PolarHBondContact O-N 2.87Å
83	V	45.3	Very low	38.5	Very low	9 Å²	9	99.2 Å²	99.2	6%	0.055	50%	0.5	C	S	.	.	H	α-helix	trans	-72.6	-37.1	-179.7	-179.9	0	0	0	0	111.6	I32 L48 F74 I79 E81 N85 Y86 M87	I32-V83 HydrophobicContact CD1-CG2 4.42Å; L48-V83 HydrophobicContact CD1-CG2 4.3Å; F74-V83 HydrophobicContact CE1-CB 3.96Å; F74-V83 HydrophobicContact CE1-CG1 3.72Å; F74-V83 HydrophobicContact CE1-CG2 4.07Å; F74-V83 HydrophobicContact CZ-CB 4.15Å; F74-V83 HydrophobicContact CZ-CG1 3.57Å; I79-V83 HydrophobicContact CG2-CG2 3.89Å; I79-V83 WeakPolarHBondContact O-CG2 3.46Å; I79-V83 PolarHBondContact O-N 2.95Å; I79-V83 VanDerWaalsContact O-N 3.12Å; E81-V83 PolarHBondContact O-N 3.43Å; V83-N85 VanDerWaalsContact C-N 3.35Å; V83-Y86 PolarHBondContact O-N 3.46Å; V83-M87 HydrophobicContact CG1-CG 4.44Å; V83-M87 HydrophobicContact CG1-SD 4.44Å; V83-M87 WeakPolarHBondContact O-CB 3.13Å; V83-M87 WeakPolarHBondContact O-CG 3.38Å; V83-M87 PolarHBondContact O-N 2.83Å
84	L	46	Very low	38.5	Very low	64 Å²	64	97.3 Å²	97.3	34%	0.335	49%	0.493	S	S	.	.	H	α-helix	trans	-58.6	-46.7	170.4	-97.6	170.2	0	0	0	111.3	F80 E81 Y86 M87 Y88	F80-L84 HydrophobicContact CD1-CD1 3.71Å; F80-L84 HydrophobicContact CD2-CD1 4.44Å; F80-L84 HydrophobicContact CE1-CD1 3.32Å; F80-L84 HydrophobicContact CE1-CG 4.35Å; F80-L84 HydrophobicContact CE2-CD1 4.11Å; F80-L84 HydrophobicContact CE2-CG 4.32Å; F80-L84 HydrophobicContact CG-CD1 4.26Å; F80-L84 HydrophobicContact CZ-CD1 3.55Å; F80-L84 HydrophobicContact CZ-CG 4.2Å; F80-L84 VanDerWaalsContact O-CB 3.25Å; F80-L84 WeakPolarHBondContact O-CB 3.2Å; F80-L84 PolarHBondContact O-N 3.13Å; E81-L84 PolarHBondContact O-N 3.2Å; L84-Y86 VanDerWaalsContact C-N 3.32Å; L84-Y86 PolarHBondContact O-N 3.16Å; L84-M87 CarbonylContact O-C 3.59Å; L84-M87 PolarHBondContact O-N 3.46Å; L84-Y88 WeakPolarHBondContact O-CB 3.44Å; L84-Y88 PolarHBondContact O-N 2.75Å
85	N	43	Very low	38.1	Very low	120 Å²	120	100.3 Å²	100.3	64%	0.642	51%	0.506	S	S	*	.	H	α-helix	trans	-63	-40.9	-179.4	-141.8	-3	0	0	0	110.8	E81 E82 V83 Y88 T89	E81-N85 WeakPolarHBondContact O-CB 3.34Å; E81-N85 PolarHBondContact O-N 2.39Å; E82-N85 PolarHBondContact O-N 3.24Å; V83-N85 VanDerWaalsContact C-N 3.35Å; N85-Y88 WeakPolarHBondContact O-CB 3.39Å; N85-Y88 PolarHBondContact O-N 3.21Å; N85-T89 PolarHBondContact O-N 2.97Å
86	Y	43.4	Very low	38	Very low	94 Å²	94	98.3 Å²	98.3	37%	0.369	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-44.9	173	-167.3	-104.7	0	0	0	112.4	L48 E82 V83 L84 Y88 T89 A90	L48-Y86 HydrophobicContact CB-CE1 4.22Å; E82-Y86 PolarHBondContact O-N 2.87Å; V83-Y86 PolarHBondContact O-N 3.46Å; L84-Y86 VanDerWaalsContact C-N 3.32Å; L84-Y86 PolarHBondContact O-N 3.16Å; Y86-Y88 VanDerWaalsContact C-N 3.33Å; Y86-Y88 PolarHBondContact O-N 3.37Å; Y86-T89 PolarHBondContact O-N 3.2Å; Y86-T89 PolarHBondContact O-OG1 3.25Å; Y86-A90 PolarHBondContact O-N 3.18Å
87	M	42.3	Very low	38.2	Very low	38 Å²	38	101.2 Å²	101.2	19%	0.187	51%	0.508	C	S	.	.	H	α-helix	trans	-66.9	-30.6	175.4	-75	-170.8	66.1	0	0	113.3	I72 V83 L84 T89 A90 K91 I92 V94	I72-M87 HydrophobicContact CD1-SD 4.46Å; V83-M87 HydrophobicContact CG1-CG 4.44Å; V83-M87 HydrophobicContact CG1-SD 4.44Å; V83-M87 WeakPolarHBondContact O-CB 3.13Å; V83-M87 WeakPolarHBondContact O-CG 3.38Å; V83-M87 PolarHBondContact O-N 2.83Å; L84-M87 CarbonylContact O-C 3.59Å; L84-M87 PolarHBondContact O-N 3.46Å; M87-T89 VanDerWaalsContact C-N 3.29Å; M87-T89 PolarHBondContact O-N 2.91Å; M87-A90 CarbonylContact O-C 3.6Å; M87-A90 WeakPolarHBondContact O-CA 3.4Å; M87-A90 WeakPolarHBondContact O-CB 3.48Å; M87-A90 PolarHBondContact O-N 3.05Å; M87-K91 PolarHBondContact O-N 3.5Å; M87-I92 HydrophobicContact CE-CB 3.89Å; M87-I92 HydrophobicContact CE-CD1 4.32Å; M87-I92 HydrophobicContact CE-CG2 3.83Å; M87-V94 HydrophobicContact CE-CG2 4Å
88	Y	37.1	Very low	38.1	Very low	157 Å²	157	103.9 Å²	103.9	62%	0.616	51%	0.514	S	S	*	.	H	α-helix	trans	-59.8	-41.2	174.1	-138.3	-91.9	0	0	0	110.9	L84 N85 Y86 A90	L84-Y88 WeakPolarHBondContact O-CB 3.44Å; L84-Y88 PolarHBondContact O-N 2.75Å; N85-Y88 WeakPolarHBondContact O-CB 3.39Å; N85-Y88 PolarHBondContact O-N 3.21Å; Y86-Y88 VanDerWaalsContact C-N 3.33Å; Y86-Y88 PolarHBondContact O-N 3.37Å; Y88-A90 PolarHBondContact O-N 3.48Å
89	T	35.9	Very low	37.6	Very low	113 Å²	113	103.9 Å²	103.9	69%	0.693	52%	0.517	S	S	*	.	H	α-helix	trans	-69.1	-20.9	173.6	71	0	0	0	0	113.6	N85 Y86 M87	N85-T89 PolarHBondContact O-N 2.97Å; Y86-T89 PolarHBondContact O-N 3.2Å; Y86-T89 PolarHBondContact O-OG1 3.25Å; M87-T89 VanDerWaalsContact C-N 3.29Å; M87-T89 PolarHBondContact O-N 2.91Å
90	A	34.8	Very low	37.1	Very low	47 Å²	47	108.6 Å²	108.6	39%	0.388	54%	0.543	S	S	.	.	H	α-helix	trans	-93	-7	-176.9	0	0	0	0	0	114.9	Y86 M87 Y88 I92	Y86-A90 PolarHBondContact O-N 3.18Å; M87-A90 CarbonylContact O-C 3.6Å; M87-A90 WeakPolarHBondContact O-CA 3.4Å; M87-A90 WeakPolarHBondContact O-CB 3.48Å; M87-A90 PolarHBondContact O-N 3.05Å; Y88-A90 PolarHBondContact O-N 3.48Å; A90-I92 HydrophobicContact CB-CD1 4.11Å; A90-I92 HydrophobicContact CB-CG1 4.2Å; A90-I92 PolarHBondContact O-N 2.87Å
91	K	32.4	Very low	36.4	Very low	202 Å²	202	110.7 Å²	110.7	88%	0.878	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.8	41.1	179.6	-60.3	-174.2	177.9	-178.2	0	115.3	M87	M87-K91 PolarHBondContact O-N 3.5Å
92	I	36.9	Very low	35.5	Very low	76 Å²	76	110 Å²	110	39%	0.39	56%	0.556	S	S	.	*			trans	-93.4	132.3	178.6	-59	172.8	0	0	0	110.2	M87 A90	M87-I92 HydrophobicContact CE-CB 3.89Å; M87-I92 HydrophobicContact CE-CD1 4.32Å; M87-I92 HydrophobicContact CE-CG2 3.83Å; A90-I92 HydrophobicContact CB-CD1 4.11Å; A90-I92 HydrophobicContact CB-CG1 4.2Å; A90-I92 PolarHBondContact O-N 2.87Å
93	S	33.4	Very low	34.5	Very low	96 Å²	96	112.4 Å²	112.4	67%	0.671	57%	0.569	S	S	*	*			trans	-90.9	128.3	178.9	162	0	0	0	0	111.3
94	V	33.7	Very low	33.7	Very low	71 Å²	71	116.4 Å²	116.4	43%	0.43	60%	0.598	S	S	.	*			trans	-123.4	137.7	177.4	-175.3	0	0	0	0	109.8	M87	M87-V94 HydrophobicContact CE-CG2 4Å
95	K	26.5	Very low	32.9	Very low	127 Å²	127	119.1 Å²	119.1	55%	0.552	62%	0.622	S	S	*	*			trans	-136.1	125.2	170.7	-71.7	-178.1	-179.6	174.7	0	109.7
96	K	32	Very low	32.6	Very low	111 Å²	111	117.1 Å²	117.1	48%	0.483	63%	0.629	S	S	.	*	B	Isolated β-bridge	trans	-143	156	158.9	-157.2	172.5	-171.9	165	0	109.1	E71 D98 V99	E71-K96 WeakPolarHBondContact OE1-CD 3.39Å; E71-K96 WeakPolarHBondContact OE1-CE 3.31Å; E71-K96 WeakPolarHBondContact OE1-CG 3.39Å; E71-K96 IonicContact OE1-NZ 2.67Å; E71-K96 PolarHBondContact OE1-NZ 3.28Å; E71-K96 WeakPolarHBondContact OE2-CE 3.42Å; E71-K96 IonicContact OE2-NZ 3.7Å; E71-K96 PolarHBondContact OE2-NZ 3.48Å; K96-D98 PolarHBondContact O-N 3.48Å; K96-V99 PolarHBondContact O-N 3.32Å; K96-V99 VanDerWaalsContact O-N 3.13Å
97	K	35.8	Very low	31.8	Very low	201 Å²	201	121.5 Å²	121.5	87%	0.874	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-9.3	-160.9	-92.2	-178.2	174.7	177.1	0	117.6
98	D	34.1	Very low	31.2	Very low	162 Å²	162	127.6 Å²	127.6	87%	0.866	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.7	8.9	178.4	-65.5	-70.3	0	0	0	114.8	K96	K96-D98 PolarHBondContact O-N 3.48Å
99	V	29.5	Very low	30.5	Very low	98 Å²	98	128.1 Å²	128.1	59%	0.594	70%	0.697	S	S	*	*	B	Isolated β-bridge	trans	-139.3	107.9	164.3	-175.6	0	0	0	0	110.2	K96	K96-V99 PolarHBondContact O-N 3.32Å; K96-V99 VanDerWaalsContact O-N 3.13Å
100	N	28.6	Very low	29.9	Very low	130 Å²	130	126 Å²	126	70%	0.695	70%	0.697	S	S	*	*			trans	-100.4	106.8	170.3	-91.9	-37.6	0	0	0	110.2
101	L	27	Very low	29.5	Very low	137 Å²	137	130.5 Å²	130.5	72%	0.717	71%	0.713	S	S	*	*			trans	-107.3	107.6	159.2	-84.1	165.1	0	0	0	108.3
102	M	23.5	Very low	29	Very low	142 Å²	142	132.4 Å²	132.4	70%	0.7	72%	0.715	S	S	*	*			trans	-124.5	120.6	176	-162.9	-178.5	-54.9	0	0	108.7
103	M	24.1	Very low	28.4	Very low	166 Å²	166	137.7 Å²	137.7	82%	0.818	74%	0.736	S	S	*	*			trans	-92.3	106.6	178.3	-66.4	-150.6	-52.7	0	0	111.6
104	S	26.9	Very low	28	Very low	93 Å²	93	141.6 Å²	141.6	65%	0.65	75%	0.748	S	S	*	*	S	Bend	trans	-143.2	115.5	152.7	48.5	0	0	0	0	109.2
105	S	29.3	Very low	27.7	Very low	121 Å²	121	145 Å²	145	85%	0.846	76%	0.764	S	S	*	*	S	Bend	trans	45.5	82.6	171.6	55.9	0	0	0	0	117.4
106	G	36.9	Very low	27.7	Very low	77 Å²	77	147.2 Å²	147.2	79%	0.794	77%	0.774	S	S	*	*			trans	32.1	96.1	149.9	0	0	0	0	0	121.1
107	Q	26.5	Very low	27.4	Very low	186 Å²	186	150.8 Å²	150.8	87%	0.869	80%	0.797	S	S	*	*			trans	-167.4	144.7	132.7	-107.8	172.3	5.1	0	0	109.7
108	I	29.1	Very low	26.8	Very low	167 Å²	167	146.5 Å²	146.5	86%	0.856	79%	0.791	S	S	*	*			trans	-91.9	119.4	177.1	-61.6	172.6	0	0	0	108.9
109	L	22.7	Very low	26.4	Very low	168 Å²	168	143.6 Å²	143.6	88%	0.88	78%	0.783	S	S	*	*			trans	-111.7	67.1	177	-82.1	167.7	0	0	0	112.3
110	G	24	Very low	26.3	Very low	67 Å²	67	148.1 Å²	148.1	69%	0.691	80%	0.798	S	S	*	*			trans	77.8	146.9	157.8	0	0	0	0	0	118
111	I	26.3	Very low	26.1	Very low	142 Å²	142	151.1 Å²	151.1	73%	0.728	81%	0.805	S	S	*	*			trans	-115.1	135.7	169.1	-59	173.3	0	0	0	107.4	F113	I111-F113 HydrophobicContact CG2-CD2 4.29Å; I111-F113 HydrophobicContact CG2-CE2 3.85Å; I111-F113 HydrophobicContact CG2-CZ 4.29Å
112	R	22.1	Very low	25.9	Very low	243 Å²	243	156 Å²	156	92%	0.917	81%	0.814	S	S	*	*			trans	-123.8	135.1	165.4	-87	-170.7	-179.1	172.2	2	109.8
113	F	25.1	Very low	25.8	Very low	186 Å²	186	155.9 Å²	155.9	82%	0.816	82%	0.816	S	S	*	*			trans	-95.8	142.3	166.5	-66.4	-91.7	0	0	0	109.1	I111	I111-F113 HydrophobicContact CG2-CD2 4.29Å; I111-F113 HydrophobicContact CG2-CE2 3.85Å; I111-F113 HydrophobicContact CG2-CZ 4.29Å
114	L	24	Very low	25.8	Very low	179 Å²	179	155 Å²	155	94%	0.937	82%	0.82	S	S	*	*			trans	-122.4	117	157.5	-82.8	175.7	0	0	0	108.9
115	D	27.9	Very low	25.5	Very low	143 Å²	143	155.2 Å²	155.2	77%	0.765	82%	0.821	S	S	*	*			trans	-85.2	163.5	174	-174	19.8	0	0	0	110.2
116	K	27	Very low	25.3	Very low	173 Å²	173	153.7 Å²	153.7	75%	0.752	81%	0.811	S	S	*	*			trans	80.3	112.5	173.3	-53.9	175.9	179.6	176.6	0	119
117	L	25	Very low	24.6	Very low	186 Å²	186	157.3 Å²	157.3	97%	0.974	81%	0.812	S	S	*	*				-121.3	94	127.5	-90.5	173.3	0	0	0	110
118	C	23.3	Very low	24.6	Very low	111 Å²	111	154.1 Å²	154.1	75%	0.75	80%	0.801	S	S	*	*			trans	-154.1	140	153.2	-153.5	0	0	0	0	111.8
119	S	25.7	Very low	24.4	Very low	100 Å²	100	153.5 Å²	153.5	70%	0.699	79%	0.792	S	S	*	*			trans	74.2	97.7	165.8	-60.2	0	0	0	0	120.6
120	Q	27.1	Very low	24.6	Very low	194 Å²	194	152.1 Å²	152.1	91%	0.907	78%	0.781	S	S	*	*				55.7	135	127.5	-78.9	174.9	-20.3	0	0	122.4
121	K	24.2	Very low	24.6	Very low	193 Å²	193	157.4 Å²	157.4	84%	0.839	78%	0.784	S	S	*	*			trans	-60	143.5	173.3	-64.5	-179.5	174.9	-175.4	0	113.4
122	R	22.5	Very low	24.6	Very low	240 Å²	240	160.1 Å²	160.1	91%	0.906	79%	0.792	S	S	*	*			trans	-145.9	141.1	134.6	-136.4	-178.7	-68.7	174.6	-1.2	109
123	D	22.7	Very low	25.2	Very low	138 Å²	138	152.9 Å²	152.9	74%	0.738	78%	0.776	S	S	*	*			trans	-81.1	144.5	-162.6	-44.5	-87.3	0	0	0	113.8
124	V	23.2	Very low	25.2	Very low	149 Å²	149	153.4 Å²	153.4	90%	0.903	77%	0.774	S	S	*	*			trans	-146.2	136.3	149	-174.7	0	0	0	0	108.2
125	S	21.6	Very low	25.1	Very low	97 Å²	97	151.6 Å²	151.6	68%	0.678	77%	0.765	S	S	*	*			trans	-94.1	155.9	176.3	59.2	0	0	0	0	113
126	S	24.2	Very low	25.2	Very low	89 Å²	89	152.6 Å²	152.6	62%	0.622	77%	0.769	S	S	*	*			trans	60.3	111.6	146.9	57.8	0	0	0	0	120.3
127	D	23.5	Very low	25	Very low	153 Å²	153	150.2 Å²	150.2	82%	0.818	77%	0.769	S	S	*	*				93.1	142.7	125.1	-61	-23.6	0	0	0	123.4
128	D	25.5	Very low	25	Very low	119 Å²	119	150.9 Å²	150.9	64%	0.636	76%	0.764	S	S	*	*			trans	83.5	99.8	153.6	-81.1	-4.2	0	0	0	123.3
129	K	24.9	Very low	25.1	Very low	154 Å²	154	154.3 Å²	154.3	67%	0.67	77%	0.771	S	S	*	*				82.9	122.4	116.3	-73.4	175.9	-176.6	103	0	121.8
130	E	26.2	Very low	24.8	Very low	139 Å²	139	154.4 Å²	154.4	65%	0.65	78%	0.778	S	S	*	*				100.7	127.2	129.7	-80.3	-177.5	-157.4	0	0	123.5
131	K	24	Very low	24.6	Very low	177 Å²	177	152.9 Å²	152.9	77%	0.77	78%	0.775	S	S	*	*			trans	81.8	101.9	142.3	-72	163.9	179.1	152.3	0	122.1
132	F	26.5	Very low	25.2	Very low	200 Å²	200	149 Å²	149	88%	0.877	77%	0.77	S	S	*	*			trans	-64.8	176.4	136.6	-71.7	-83.4	0	0	0	111.1
133	P	35.5	Very low	25.8	Very low	90 Å²	90	143.4 Å²	143.4	58%	0.584	76%	0.764	S	S	*	*			cis	-131.2	-176.1	11.8	26.9	0.4	0	0	0	113.9
134	Y	24.4	Very low	25.9	Very low	197 Å²	197	145.4 Å²	145.4	77%	0.773	77%	0.769	S	S	*	*				-174.1	136.4	76.6	-94.2	-77.2	0	0	0	115.5
135	D	23.5	Very low	26	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	76%	0.76	S	S	*	*			trans	28.8	150.2	137	-61.8	-29	0	0	0	127.1
136	I	28.6	Very low	26.2	Very low	164 Å²	164	146.8 Å²	146.8	84%	0.841	77%	0.77	S	S	*	*			trans	-103.9	131.6	178	-61.5	161	0	0	0	110.4
137	V	23.7	Very low	26.3	Very low	124 Å²	124	150.7 Å²	150.7	75%	0.752	78%	0.783	S	S	*	*			trans	-144	110.1	163.6	-177.8	0	0	0	0	114.3
138	K	23.7	Very low	26.3	Very low	200 Å²	200	147.8 Å²	147.8	87%	0.87	78%	0.78	S	S	*	*			trans	53.5	148.1	141.5	-61.5	176.2	-178.5	174.4	0	123.7
139	M	25.7	Very low	26.2	Very low	183 Å²	183	146.3 Å²	146.3	90%	0.901	79%	0.785	S	S	*	*			trans	-79.2	155.7	173.2	-55.6	158.9	75.8	0	0	113.2
140	A	21.1	Very low	26.2	Very low	102 Å²	102	146.6 Å²	146.6	84%	0.843	79%	0.793	S	S	*	*			trans	-153.2	143.6	151.7	0	0	0	0	0	112.2
141	L	22.2	Very low	26.2	Very low	161 Å²	161	145.3 Å²	145.3	84%	0.843	80%	0.8	S	S	*	*			trans	-112.4	176.1	160.6	-91.8	134.4	0	0	0	106.8
142	P	36.8	Very low	26.4	Very low	113 Å²	113	145.6 Å²	145.6	73%	0.734	80%	0.804	S	S	*	*			cis	-114.8	-139.5	-7.3	33.7	-10.2	0	0	0	107.9
143	P	34.4	Very low	26.2	Very low	121 Å²	121	143.5 Å²	143.5	79%	0.786	80%	0.802	S	S	*	*			cis	-127.8	-126.6	-6.1	41.8	-20.5	0	0	0	114.9
144	E	25.8	Very low	25.8	Very low	180 Å²	180	146.8 Å²	146.8	84%	0.841	81%	0.813	S	S	*	*			trans	-131.9	158.2	-146.3	-59	175.7	133.5	0	0	115.5
145	A	25.3	Very low	25.8	Very low	87 Å²	87	140.5 Å²	140.5	72%	0.719	81%	0.809	S	S	*	*			trans	68.9	115.3	139.6	0	0	0	0	0	123.1
146	Q	25.2	Very low	25.9	Very low	188 Å²	188	142.7 Å²	142.7	88%	0.879	82%	0.815	S	S	*	*				-175.9	109.7	115.1	-95	165.8	22	0	0	107.8
147	L	26.3	Very low	26.2	Very low	171 Å²	171	143.6 Å²	143.6	90%	0.895	82%	0.815	S	S	*	*				65.8	92.3	78.6	-81.9	175.4	0	0	0	116.6
148	A	23.4	Very low	26.2	Very low	93 Å²	93	144.4 Å²	144.4	77%	0.769	82%	0.815	S	S	*	*			trans	-164.2	113.6	138.3	0	0	0	0	0	105.6
149	A	24.4	Very low	26.2	Very low	88 Å²	88	138.7 Å²	138.7	73%	0.727	79%	0.794	S	S	*	*				75.1	137.3	71.5	0	0	0	0	0	112.4
150	D	23.3	Very low	26.2	Very low	160 Å²	160	133.6 Å²	133.6	86%	0.856	78%	0.781	S	S	*	*			trans	93.2	131.7	-174	-56	-15.2	0	0	0	115.8
151	S	26.4	Very low	26.6	Very low	112 Å²	112	131.1 Å²	131.1	78%	0.783	76%	0.756	S	S	*	*			cis	-158.8	159.8	-24.6	47.7	0	0	0	0	108
152	E	27.8	Very low	26.8	Very low	182 Å²	182	126 Å²	126	85%	0.85	74%	0.743	S	S	*	*			trans	-52.8	138.1	177.4	-58.5	170	152.7	0	0	112.6
153	D	22.9	Very low	26.4	Very low	156 Å²	156	124.6 Å²	124.6	83%	0.834	73%	0.732	S	S	*	*			trans	-139.5	124.8	141.9	-163.6	8.7	0	0	0	109.9
154	L	27.2	Very low	26	Very low	159 Å²	159	126.1 Å²	126.1	83%	0.832	73%	0.734	S	S	*	*			trans	-108.4	102.3	-173.3	-85.4	171.4	0	0	0	109.9
155	G	24.4	Very low	26	Very low	66 Å²	66	122.1 Å²	122.1	68%	0.68	72%	0.718	S	S	*	*			trans	96	127.2	153.1	0	0	0	0	0	116
156	E	24.8	Very low	26.1	Very low	187 Å²	187	126.4 Å²	126.4	87%	0.874	73%	0.728	S	S	*	*			trans	-144.1	123.3	131.4	-114	170.6	-172.6	0	0	108.1	D158	E156-D158 PolarHBondContact O-N 3.36Å
157	H	34.7	Very low	26.2	Very low	182 Å²	182	122.6 Å²	122.6	84%	0.843	72%	0.717	S	S	*	*			trans	-83.4	103.2	177.3	-97.7	-71.5	0	0	0	109.3
158	D	24.1	Very low	26.1	Very low	142 Å²	142	122.3 Å²	122.3	76%	0.759	71%	0.711	S	S	*	*			trans	-130.1	64.7	172.1	-99.2	-28.7	0	0	0	111.8	E156 A160	E156-D158 PolarHBondContact O-N 3.36Å; D158-A160 PolarHBondContact O-N 3.46Å
159	D	24.7	Very low	26.2	Very low	79 Å²	79	122.3 Å²	122.3	42%	0.422	71%	0.712	S	S	.	*			trans	-80.2	70.5	167.2	-84.3	-63.8	0	0	0	111.2	V343	D159-V343 HydrophobicContact CB-CG1 3.55Å; D159-V343 HydrophobicContact CB-CG2 4.23Å
160	A	25.5	Very low	26.3	Very low	76 Å²	76	122.9 Å²	122.9	63%	0.628	71%	0.71	S	S	*	*			trans	-103.1	111.4	161.6	0	0	0	0	0	109.2	D158 G162	D158-A160 PolarHBondContact O-N 3.46Å; A160-G162 PolarHBondContact O-N 3.22Å
161	P	29.6	Very low	26.4	Very low	50 Å²	50	121.9 Å²	121.9	33%	0.325	71%	0.71	S	S	.	*			trans	-71.2	105.1	176.3	28.2	-32.1	0	0	0	109.4	T163	P161-T163 PolarHBondContact O-N 2.87Å
162	G	25.2	Very low	26.4	Very low	54 Å²	54	123.8 Å²	123.8	56%	0.557	71%	0.711	S	S	*	*			trans	-61.3	101.9	172.3	0	0	0	0	0	110.9	A160 D164	A160-G162 PolarHBondContact O-N 3.22Å; G162-D164 PolarHBondContact O-N 3.45Å
163	T	29.5	Very low	26.4	Very low	84 Å²	84	123.7 Å²	123.7	52%	0.515	71%	0.711	S	S	.	*			trans	-75.6	108.7	160.7	48.9	0	0	0	0	108	P161 D165	P161-T163 PolarHBondContact O-N 2.87Å; T163-D165 PolarHBondContact O-N 3.27Å
164	D	26.1	Very low	26.8	Very low	153 Å²	153	125.4 Å²	125.4	82%	0.818	71%	0.714	S	S	*	*			trans	-69.1	62.5	161.4	-73.8	-41.4	0	0	0	109.9	G162	G162-D164 PolarHBondContact O-N 3.45Å
165	D	25.2	Very low	27	Very low	96 Å²	96	124.7 Å²	124.7	51%	0.513	71%	0.71	S	S	.	*			trans	-97.7	119.3	157.5	-82.9	-50.2	0	0	0	106.2	T163 V167 R333	T163-D165 PolarHBondContact O-N 3.27Å; D165-V167 PolarHBondContact O-N 3.22Å; D165-R333 IonicContact OD2-NH2 3.68Å
166	L	27.8	Very low	27.4	Very low	177 Å²	177	129.9 Å²	129.9	93%	0.927	72%	0.722	S	S	*	*			trans	-68	84.3	175.2	-78.1	166.3	0	0	0	109.7	E168	L166-E168 PolarHBondContact O-N 2.7Å
167	V	26.8	Very low	27.8	Very low	108 Å²	108	129.4 Å²	129.4	66%	0.655	72%	0.717	S	S	*	*			trans	-81.5	89.8	164.8	-173.9	0	0	0	0	107.5	D165 A169	D165-V167 PolarHBondContact O-N 3.22Å; V167-A169 PolarHBondContact O-N 3.41Å
168	E	25.1	Very low	27.8	Very low	164 Å²	164	124.6 Å²	124.6	77%	0.766	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-57.4	129.4	158.6	-73.2	-178.2	146.7	0	0	108.7	L166	L166-E168 PolarHBondContact O-N 2.7Å
169	A	25	Very low	28.7	Very low	94 Å²	94	123 Å²	123	78%	0.777	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-77.7	136.3	-178.7	0	0	0	0	0	109.9	V167	V167-A169 PolarHBondContact O-N 3.41Å
170	S	27	Very low	29.4	Very low	99 Å²	99	125 Å²	125	69%	0.692	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-59.5	135	179.5	-46.6	0	0	0	0	111.9	N172	S170-N172 PolarHBondContact O-N 3.18Å
171	T	24.4	Very low	30.2	Very low	140 Å²	140	124 Å²	124	86%	0.859	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-70.6	120	148.6	38.4	0	0	0	0	107.9	Q173	T171-Q173 PolarHBondContact O-N 3.46Å
172	N	26	Very low	31	Very low	152 Å²	152	124.5 Å²	124.5	81%	0.813	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-71	127.9	172.9	-73.9	-17.5	0	0	0	109.2	S170	S170-N172 PolarHBondContact O-N 3.18Å
173	Q	28.1	Very low	32.3	Very low	180 Å²	180	126.4 Å²	126.4	84%	0.841	71%	0.709	S	S	*	*			trans	-131.8	110.5	156.5	-159.8	166.4	28.1	0	0	107	T171 L175	T171-Q173 PolarHBondContact O-N 3.46Å; Q173-L175 PolarHBondContact O-N 2.81Å
174	E	31.5	Very low	33.5	Very low	191 Å²	191	128.7 Å²	128.7	89%	0.893	71%	0.714	S	S	*	*			trans	-65.7	127.9	179.8	-67.4	173.1	131.1	0	0	109.4
175	L	32.4	Very low	34.9	Very low	144 Å²	144	123.9 Å²	123.9	75%	0.754	69%	0.69	S	S	*	*			trans	-130.9	106.2	168.2	-83.6	171	0	0	0	107.8	Q173 K177	Q173-L175 PolarHBondContact O-N 2.81Å; L175-K177 PolarHBondContact O-N 2.78Å
176	D	31.8	Very low	36.4	Very low	176 Å²	176	123.1 Å²	123.1	94%	0.941	68%	0.684	S	S	*	*			trans	-50.5	109.7	174.7	-86.1	-48	0	0	0	111.1
177	K	33.5	Very low	38.1	Very low	176 Å²	176	119 Å²	119	77%	0.765	66%	0.659	S	S	*	*			trans	-133.4	126.1	165.5	-71.6	-172.6	179.6	177.1	0	109.1	L175	L175-K177 PolarHBondContact O-N 2.78Å
178	S	34.4	Very low	39.7	Very low	81 Å²	81	116.4 Å²	116.4	57%	0.566	65%	0.649	S	S	*	*			trans	-47	135	-172.6	177.6	0	0	0	0	113.1	N180 A181	S178-N180 PolarHBondContact O-N 2.99Å; S178-A181 PolarHBondContact O-N 2.87Å
179	P	42.5	Very low	41.5	Very low	110 Å²	110	109.6 Å²	109.6	71%	0.714	62%	0.618	S	S	*	*	H	α-helix	trans	-59.2	-22.9	-173.3	21.5	-33.2	0	0	0	114.3	A181 L183	P179-A181 VanDerWaalsContact C-N 3.32Å; P179-A181 PolarHBondContact O-N 3.04Å; P179-L183 PolarHBondContact O-N 3.1Å
180	N	40.5	Very low	43.4	Very low	120 Å²	120	108.1 Å²	108.1	64%	0.642	60%	0.597	S	S	*	*	H	α-helix	trans	-66	-28.7	176.2	-103.8	-6.3	0	0	0	113.8	S178 H184	S178-N180 PolarHBondContact O-N 2.99Å; N180-H184 PolarHBondContact O-N 3.21Å
181	A	42.4	Very low	45.2	Very low	56 Å²	56	109.8 Å²	109.8	46%	0.463	59%	0.592	S	S	.	*	H	α-helix	trans	-74.8	-42	-178.6	0	0	0	0	0	111.8	S178 P179 L183 H184 V185	S178-A181 PolarHBondContact O-N 2.87Å; P179-A181 VanDerWaalsContact C-N 3.32Å; P179-A181 PolarHBondContact O-N 3.04Å; A181-L183 VanDerWaalsContact C-N 3.31Å; A181-L183 PolarHBondContact O-N 3.38Å; A181-H184 PolarHBondContact O-N 3.24Å; A181-V185 WeakPolarHBondContact O-CG2 3.36Å; A181-V185 PolarHBondContact O-N 2.92Å; A181-V185 VanDerWaalsContact O-N 3.12Å
182	A	45.1	Very low	47	Very low	60 Å²	60	109.4 Å²	109.4	50%	0.496	58%	0.58	S	S	.	*	H	α-helix	trans	-63.6	-38.1	178	0	0	0	0	0	112.1	V185 Q186	A182-V185 PolarHBondContact O-N 2.81Å; A182-Q186 PolarHBondContact O-N 3.12Å
183	L	53.5	Low	48.8	Very low	93 Å²	93	102.3 Å²	102.3	49%	0.487	54%	0.542	S	S	.	.	H	α-helix	trans	-69.5	-43.3	-179.3	-154	150.4	0	0	0	111.5	P179 A181 V185 Q186 E187	P179-L183 PolarHBondContact O-N 3.1Å; A181-L183 VanDerWaalsContact C-N 3.31Å; A181-L183 PolarHBondContact O-N 3.38Å; L183-V185 VanDerWaalsContact C-N 3.33Å; L183-V185 PolarHBondContact O-N 2.84Å; L183-Q186 PolarHBondContact O-N 2.94Å; L183-E187 HydrophobicContact CD2-CG 4.32Å; L183-E187 PolarHBondContact O-N 3.24Å
184	H	53.9	Low	50.2	Low	132 Å²	132	97.5 Å²	97.5	61%	0.611	53%	0.525	S	S	*	.	H	α-helix	trans	-60.7	-38.9	172.1	-95.8	-57	0	0	0	113.3	N180 A181 E187 A188	N180-H184 PolarHBondContact O-N 3.21Å; A181-H184 PolarHBondContact O-N 3.24Å; H184-E187 PolarHBondContact O-N 3.23Å; H184-A188 WeakPolarHBondContact O-CB 3.37Å; H184-A188 PolarHBondContact O-N 2.93Å
185	V	56.5	Low	51.2	Low	52 Å²	52	95.1 Å²	95.1	32%	0.315	52%	0.518	S	S	.	.	H	α-helix	trans	-66.9	-43.4	176.2	169.8	0	0	0	0	110.9	A181 A182 L183 E187 A188 I189 I298	A181-V185 WeakPolarHBondContact O-CG2 3.36Å; A181-V185 PolarHBondContact O-N 2.92Å; A181-V185 VanDerWaalsContact O-N 3.12Å; A182-V185 PolarHBondContact O-N 2.81Å; L183-V185 VanDerWaalsContact C-N 3.33Å; L183-V185 PolarHBondContact O-N 2.84Å; V185-E187 PolarHBondContact O-N 3.21Å; V185-A188 PolarHBondContact O-N 3.32Å; V185-I189 HydrophobicContact CG1-CD1 3.61Å; V185-I189 HydrophobicContact CG1-CG1 4.42Å; V185-I189 WeakPolarHBondContact O-CB 3.25Å; V185-I189 WeakPolarHBondContact O-CD1 3.47Å; V185-I189 WeakPolarHBondContact O-CG1 3.42Å; V185-I189 PolarHBondContact O-N 2.8Å; V185-I298 HydrophobicContact CG1-CD1 4.35Å; V185-I298 HydrophobicContact CG1-CG1 4.39Å
186	Q	56.4	Low	52.1	Low	81 Å²	81	92.5 Å²	92.5	38%	0.379	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-40.5	175	-77.6	-179.1	-42.1	0	0	112.7	A182 L183 I189 L190 H316	A182-Q186 PolarHBondContact O-N 3.12Å; L183-Q186 PolarHBondContact O-N 2.94Å; Q186-I189 PolarHBondContact O-N 2.72Å; Q186-L190 WeakPolarHBondContact O-CB 3.37Å; Q186-L190 WeakPolarHBondContact O-CG 3.47Å; Q186-L190 PolarHBondContact O-N 3.24Å; Q186-H316 PolarHBondContact NE2-O 2.77Å
187	E	62.3	Low	52.8	Low	89 Å²	89	90.7 Å²	90.7	42%	0.416	49%	0.493	S	S	.	.	H	α-helix	trans	-66.6	-39.3	175.4	-75.1	-171.2	173.8	0	0	113.3	L183 H184 V185 L190 K191	L183-E187 HydrophobicContact CD2-CG 4.32Å; L183-E187 PolarHBondContact O-N 3.24Å; H184-E187 PolarHBondContact O-N 3.23Å; V185-E187 PolarHBondContact O-N 3.21Å; E187-L190 PolarHBondContact O-N 2.83Å; E187-K191 WeakPolarHBondContact O-CG 3.26Å; E187-K191 PolarHBondContact O-N 3.06Å; E187-K191 VanDerWaalsContact O-N 3.08Å
188	A	62	Low	53.4	Low	54 Å²	54	87.3 Å²	87.3	45%	0.446	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-45.4	175.2	0	0	0	0	0	111.2	H184 V185 L190 K191 E192	H184-A188 WeakPolarHBondContact O-CB 3.37Å; H184-A188 PolarHBondContact O-N 2.93Å; V185-A188 PolarHBondContact O-N 3.32Å; A188-L190 VanDerWaalsContact C-N 3.35Å; A188-L190 PolarHBondContact O-N 2.9Å; A188-K191 PolarHBondContact O-N 2.85Å; A188-E192 PolarHBondContact O-N 3.48Å
189	I	62.5	Low	54.1	Low	22 Å²	22	89 Å²	89	11%	0.113	49%	0.485	C	S	.	.	H	α-helix	trans	-63.2	-40.9	175.6	-65.9	162.7	0	0	0	110.8	V185 Q186 K191 E192 L193 I298 L313 T317	V185-I189 HydrophobicContact CG1-CD1 3.61Å; V185-I189 HydrophobicContact CG1-CG1 4.42Å; V185-I189 WeakPolarHBondContact O-CB 3.25Å; V185-I189 WeakPolarHBondContact O-CD1 3.47Å; V185-I189 WeakPolarHBondContact O-CG1 3.42Å; V185-I189 PolarHBondContact O-N 2.8Å; Q186-I189 PolarHBondContact O-N 2.72Å; I189-K191 VanDerWaalsContact C-N 3.33Å; I189-K191 PolarHBondContact O-N 3.36Å; I189-E192 PolarHBondContact O-N 2.91Å; I189-L193 HydrophobicContact CG2-CD1 3.72Å; I189-L193 HydrophobicContact CG2-CG 4.2Å; I189-L193 WeakPolarHBondContact O-CB 3.21Å; I189-L193 WeakPolarHBondContact O-CG 2.93Å; I189-L193 PolarHBondContact O-N 3.1Å; I189-I298 HydrophobicContact CD1-CD1 3.71Å; I189-L313 HydrophobicContact CD1-CD2 4.15Å; I189-L313 HydrophobicContact CG1-CD1 4.47Å; I189-L313 HydrophobicContact CG2-CB 3.84Å; I189-L313 HydrophobicContact CG2-CD1 4.18Å; I189-L313 HydrophobicContact CG2-CG 4.46Å; I189-T317 HydrophobicContact CB-CG2 3.99Å; I189-T317 HydrophobicContact CG2-CG2 3.5Å
190	L	63.8	Low	54	Low	63 Å²	63	92.8 Å²	92.8	33%	0.33	49%	0.491	S	S	.	.	H	α-helix	trans	-59.6	-43.3	175.8	-81.1	168.3	0	0	0	111.5	Q186 E187 A188 E192 L193 T194 T317 F319	Q186-L190 WeakPolarHBondContact O-CB 3.37Å; Q186-L190 WeakPolarHBondContact O-CG 3.47Å; Q186-L190 PolarHBondContact O-N 3.24Å; E187-L190 PolarHBondContact O-N 2.83Å; A188-L190 VanDerWaalsContact C-N 3.35Å; A188-L190 PolarHBondContact O-N 2.9Å; L190-E192 VanDerWaalsContact C-N 3.34Å; L190-E192 PolarHBondContact O-N 2.85Å; L190-L193 CarbonylContact O-C 3.37Å; L190-L193 WeakPolarHBondContact O-CA 3.43Å; L190-L193 PolarHBondContact O-N 2.94Å; L190-T194 VanDerWaalsContact O-CG2 3.32Å; L190-T194 WeakPolarHBondContact O-CG2 3.45Å; L190-T194 PolarHBondContact O-N 3.34Å; L190-T194 PolarHBondContact O-OG1 3.36Å; L190-T194 VanDerWaalsContact O-OG1 3.06Å; L190-T317 HydrophobicContact CD2-CG2 4.21Å; L190-T317 HydrophobicContact CG-CG2 3.97Å; L190-F319 HydrophobicContact CD2-CB 4.38Å; L190-F319 HydrophobicContact CD2-CD2 4.48Å
191	K	64.9	Low	53.8	Low	134 Å²	134	91.1 Å²	91.1	58%	0.583	48%	0.484	S	S	*	.	H	α-helix	trans	-60	-40.6	176.7	-71.8	166.8	-176.4	167.8	0	112.9	E187 A188 I189 L193 T194	E187-K191 WeakPolarHBondContact O-CG 3.26Å; E187-K191 PolarHBondContact O-N 3.06Å; E187-K191 VanDerWaalsContact O-N 3.08Å; A188-K191 PolarHBondContact O-N 2.85Å; I189-K191 VanDerWaalsContact C-N 3.33Å; I189-K191 PolarHBondContact O-N 3.36Å; K191-L193 VanDerWaalsContact C-N 3.28Å; K191-L193 PolarHBondContact O-N 3.45Å; K191-T194 WeakPolarHBondContact CA-OG1 3.15Å; K191-T194 PolarHBondContact O-OG1 3.2Å
192	E	62.9	Low	53.2	Low	132 Å²	132	93.4 Å²	93.4	62%	0.617	50%	0.497	S	S	*	.	H	α-helix	trans	-68.6	-23.7	173.9	-70.5	-61.8	140.4	0	0	113.7	A188 I189 L190 K310	A188-E192 PolarHBondContact O-N 3.48Å; I189-E192 PolarHBondContact O-N 2.91Å; L190-E192 VanDerWaalsContact C-N 3.34Å; L190-E192 PolarHBondContact O-N 2.85Å; E192-K310 WeakPolarHBondContact O-CE 3.18Å; E192-K310 PolarHBondContact O-NZ 3.12Å
193	L	63.6	Low	52.4	Low	2 Å²	2	94.3 Å²	94.3	1%	0.01	50%	0.499	C	S	.	.	H	α-helix	trans	-91.1	-26.6	178.6	-68.2	175.2	0	0	0	113.6	I189 L190 K191 N195 K310 K314 T317 F319	I189-L193 HydrophobicContact CG2-CD1 3.72Å; I189-L193 HydrophobicContact CG2-CG 4.2Å; I189-L193 WeakPolarHBondContact O-CB 3.21Å; I189-L193 WeakPolarHBondContact O-CG 2.93Å; I189-L193 PolarHBondContact O-N 3.1Å; L190-L193 CarbonylContact O-C 3.37Å; L190-L193 WeakPolarHBondContact O-CA 3.43Å; L190-L193 PolarHBondContact O-N 2.94Å; K191-L193 VanDerWaalsContact C-N 3.28Å; K191-L193 PolarHBondContact O-N 3.45Å; L193-N195 VanDerWaalsContact C-N 3.34Å; L193-N195 PolarHBondContact O-N 3.21Å; L193-K310 HydrophobicContact CD2-CD 4.34Å; L193-K310 HydrophobicContact CD2-CG 3.59Å; L193-K314 HydrophobicContact CD1-CG 3.96Å; L193-K314 HydrophobicContact CD2-CD 4.41Å; L193-K314 HydrophobicContact CD2-CG 3.79Å; L193-T317 HydrophobicContact CD1-CG2 4.19Å; L193-F319 HydrophobicContact CB-CD1 4.46Å; L193-F319 HydrophobicContact CD1-CB 4.44Å
194	T	57.5	Low	51.1	Low	80 Å²	80	98.7 Å²	98.7	49%	0.491	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-5.5	-174.6	46.4	0	0	0	0	115.4	L190 K191 E196	L190-T194 VanDerWaalsContact O-CG2 3.32Å; L190-T194 WeakPolarHBondContact O-CG2 3.45Å; L190-T194 PolarHBondContact O-N 3.34Å; L190-T194 PolarHBondContact O-OG1 3.36Å; L190-T194 VanDerWaalsContact O-OG1 3.06Å; K191-T194 WeakPolarHBondContact CA-OG1 3.15Å; K191-T194 PolarHBondContact O-OG1 3.2Å; T194-E196 PolarHBondContact O-N 3.08Å
195	N	53.8	Low	50.1	Low	140 Å²	140	99.3 Å²	99.3	75%	0.749	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	9.6	175.9	-70.1	-22.2	0	0	0	113.9	L193	L193-N195 VanDerWaalsContact C-N 3.34Å; L193-N195 PolarHBondContact O-N 3.21Å
196	E	50.6	Low	48.8	Very low	90 Å²	90	105.5 Å²	105.5	42%	0.421	54%	0.544	S	S	.	.	S	Bend	trans	-112.7	125.8	174.4	-77.4	164.7	-158	0	0	109.4	T194 K310 K314	T194-E196 PolarHBondContact O-N 3.08Å; E196-K310 IonicContact OE1-NZ 2.7Å; E196-K310 PolarHBondContact OE1-NZ 3.34Å; E196-K314 IonicContact OE2-NZ 3.27Å; E196-K314 PolarHBondContact OE2-NZ 2.91Å
197	D	45.4	Very low	47.6	Very low	138 Å²	138	109.7 Å²	109.7	74%	0.738	57%	0.569	S	S	*	*			trans	-56.7	142.1	-179.6	-74.5	-57.6	0	0	0	112.9	H199	D197-H199 VanDerWaalsContact C-N 3.33Å; D197-H199 PolarHBondContact O-N 2.95Å
198	V	48	Very low	45.9	Very low	104 Å²	104	110.5 Å²	110.5	63%	0.63	58%	0.579	S	S	*	*			trans	-72.8	88.1	177.1	-178	0	0	0	0	109.5	K200	V198-K200 PolarHBondContact O-N 3.43Å
199	H	47.6	Very low	44.3	Very low	116 Å²	116	114.5 Å²	114.5	54%	0.537	60%	0.598	S	S	.	*			trans	-66.7	98.4	177.7	-66.7	-52.3	0	0	0	112	D197 V201 Y322	D197-H199 VanDerWaalsContact C-N 3.33Å; D197-H199 PolarHBondContact O-N 2.95Å; H199-V201 PolarHBondContact O-N 2.94Å; H199-Y322 HydrophobicContact CB-CE1 4.37Å
200	K	40.8	Very low	42.6	Very low	191 Å²	191	119.2 Å²	119.2	83%	0.83	63%	0.628	S	S	*	*			trans	-68.7	121.5	156.8	-70.2	-176.8	177.7	-178.6	0	108.6	V198	V198-K200 PolarHBondContact O-N 3.43Å
201	V	36	Very low	40.8	Very low	84 Å²	84	124.7 Å²	124.7	51%	0.509	65%	0.652	S	S	.	*			trans	-114	91.9	171.6	-178	0	0	0	0	107.2	H199	H199-V201 PolarHBondContact O-N 2.94Å
202	S	29.9	Very low	39	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	67%	0.668	S	S	*	*			trans	-87.4	116.4	172.3	57.4	0	0	0	0	109.4
203	C	28.8	Very low	37.1	Very low	79 Å²	79	130.3 Å²	130.3	53%	0.534	68%	0.682	S	S	.	*			trans	-130.3	88.1	167.8	44.4	0	0	0	0	111.5
204	Y	26.7	Very low	35.3	Very low	185 Å²	185	134.7 Å²	134.7	73%	0.725	72%	0.718	S	S	*	*	S	Bend	trans	-134.8	119.9	150.9	-99.3	-81.6	0	0	0	107.9
205	D	31.6	Very low	33.7	Very low	145 Å²	145	140.1 Å²	140.1	78%	0.775	74%	0.738	S	S	*	*			trans	14.1	112.4	171.9	-53.7	-44.5	0	0	0	119.8
206	Q	29.7	Very low	32.5	Very low	183 Å²	183	138.9 Å²	138.9	86%	0.855	74%	0.738	S	S	*	*			trans	-160.9	122.6	138.8	-115.3	162	25.5	0	0	112.9	V208	Q206-V208 PolarHBondContact O-N 2.65Å
207	D	31.9	Very low	31.3	Very low	169 Å²	169	144.7 Å²	144.7	90%	0.904	76%	0.762	S	S	*	*			trans	-68.3	112.7	161.4	-65.2	-67.7	0	0	0	109.4
208	V	26.6	Very low	30.4	Very low	105 Å²	105	146.9 Å²	146.9	64%	0.636	77%	0.768	S	S	*	*			trans	-137.3	117.9	162.9	-178	0	0	0	0	109.7	Q206 T210	Q206-V208 PolarHBondContact O-N 2.65Å; V208-T210 HydrophobicContact CG1-CG2 4.23Å
209	V	28.8	Very low	29.3	Very low	138 Å²	138	150.6 Å²	150.6	84%	0.836	78%	0.783	S	S	*	*			trans	-82	120.6	165.6	-179.6	0	0	0	0	107.7
210	T	26.6	Very low	28.2	Very low	121 Å²	121	148.6 Å²	148.6	74%	0.742	79%	0.793	S	S	*	*			trans	-141.8	128.6	161.1	37.9	0	0	0	0	110.5	V208	V208-T210 HydrophobicContact CG1-CG2 4.23Å
211	E	25.6	Very low	27.5	Very low	179 Å²	179	144.2 Å²	144.2	84%	0.836	79%	0.793	S	S	*	*			trans	-62.2	151.2	-169.5	-65.5	139.1	148.5	0	0	114.5
212	M	26.3	Very low	26.9	Very low	188 Å²	188	148.7 Å²	148.7	93%	0.926	81%	0.808	S	S	*	*			trans	-90.3	104.1	163.7	-70.4	173.8	62.3	0	0	108.9
213	E	23.9	Very low	26.7	Very low	196 Å²	196	150.9 Å²	150.9	92%	0.916	81%	0.807	S	S	*	*			trans	-82.5	127.4	160.9	-70.5	-168.6	145.2	0	0	109.6
214	A	24.5	Very low	26.4	Very low	93 Å²	93	155.3 Å²	155.3	77%	0.769	82%	0.819	S	S	*	*			trans	-129.3	120.6	174.2	0	0	0	0	0	109.2
215	E	23.7	Very low	26.3	Very low	194 Å²	194	150.4 Å²	150.4	91%	0.907	82%	0.817	S	S	*	*			trans	-121.7	150.1	167.3	-83.2	-151.8	149.5	0	0	111.5
216	P	29.6	Very low	26	Very low	114 Å²	114	149.8 Å²	149.8	74%	0.74	82%	0.819	S	S	*	*			trans	-93.6	161.3	-164.4	37.3	-36.4	0	0	0	113.6
217	K	26.3	Very low	25.8	Very low	213 Å²	213	149.9 Å²	149.9	93%	0.926	82%	0.819	S	S	*	*			trans	-134.1	121.5	159.2	-77.2	-173.9	176.6	174.7	0	111
218	E	25.6	Very low	25.3	Very low	183 Å²	183	147.7 Å²	147.7	86%	0.855	81%	0.812	S	S	*	*			trans	-85	165.3	166.6	-62.9	-158.4	153.6	0	0	112
219	L	25.4	Very low	25.1	Very low	183 Å²	183	150.7 Å²	150.7	96%	0.958	82%	0.824	S	S	*	*			trans	136.1	124.4	165.3	-79.1	158.3	0	0	0	108.1
220	G	24.6	Very low	25.1	Very low	73 Å²	73	150 Å²	150	75%	0.753	82%	0.82	S	S	*	*			cis	-166.3	172	-4.9	0	0	0	0	0	109.2
221	A	24.8	Very low	24.8	Very low	99 Å²	99	154 Å²	154	82%	0.818	83%	0.827	S	S	*	*			trans	-76.4	160.5	-180	0	0	0	0	0	112.8
222	E	23.7	Very low	24.8	Very low	178 Å²	178	149.9 Å²	149.9	83%	0.832	82%	0.815	S	S	*	*				-173.8	124.6	128.9	-99.2	-175.6	-147.9	0	0	114.1
223	H	25.8	Very low	24.7	Very low	150 Å²	150	147.4 Å²	147.4	69%	0.694	81%	0.805	S	S	*	*			trans	43.9	130.3	144.1	-75.1	-68.8	0	0	0	127.2
224	H	23.4	Very low	24.9	Very low	172 Å²	172	144.2 Å²	144.2	80%	0.796	80%	0.804	S	S	*	*			trans	68.2	145.9	140.8	-76.2	-62.9	0	0	0	120.3
225	A	23.8	Very low	25.1	Very low	82 Å²	82	147.3 Å²	147.3	68%	0.678	81%	0.807	S	S	*	*			cis	-151.8	153.5	-4.9	0	0	0	0	0	112
226	T	25.1	Very low	25.1	Very low	133 Å²	133	141.8 Å²	141.8	82%	0.816	80%	0.801	S	S	*	*			trans	-69.1	138.4	164.4	40.9	0	0	0	0	112
227	Q	25.2	Very low	25	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	80%	0.804	S	S	*	*			trans	-122.4	112.3	160	-76.1	-170.8	-3.6	0	0	110.8
228	T	22.8	Very low	25	Very low	124 Å²	124	141.2 Å²	141.2	76%	0.761	80%	0.802	S	S	*	*			trans	-85.5	135.2	165.3	-13.7	0	0	0	0	108.6
229	L	22.8	Very low	25	Very low	168 Å²	168	140.3 Å²	140.3	88%	0.88	80%	0.795	S	S	*	*			trans	-133.6	122.6	163.5	-75.8	176.5	0	0	0	110.1
230	T	27.6	Very low	24.9	Very low	123 Å²	123	138.3 Å²	138.3	76%	0.755	79%	0.785	S	S	*	*			trans	-113.1	140.4	175.7	49.3	0	0	0	0	109.3
231	F	21.3	Very low	25	Very low	204 Å²	204	143.8 Å²	143.8	90%	0.895	79%	0.791	S	S	*	*			trans	-148.8	155.9	156.2	-147.2	-96.2	0	0	0	111.5
232	T	25.5	Very low	25.3	Very low	94 Å²	94	144.1 Å²	144.1	58%	0.577	79%	0.794	S	S	*	*			trans	-116.8	169.3	-159.8	59.5	0	0	0	0	114.4
233	D	24.6	Very low	25.3	Very low	136 Å²	136	140.4 Å²	140.4	73%	0.727	79%	0.794	S	S	*	*			trans	64.4	120.4	152.5	-53.1	-36.9	0	0	0	121.5
234	S	27.3	Very low	25.7	Very low	128 Å²	128	138.9 Å²	138.9	90%	0.895	80%	0.797	S	S	*	*			trans	-155.6	124.6	131.8	-78.8	0	0	0	0	109.8
235	I	27.8	Very low	26	Very low	159 Å²	159	134.3 Å²	134.3	82%	0.815	80%	0.797	S	S	*	*			trans	-88.8	143	-177.5	-65	169.4	0	0	0	110	E237	I235-E237 HydrophobicContact CG2-CG 4.43Å
236	G	25.1	Very low	26.1	Very low	77 Å²	77	141.9 Å²	141.9	79%	0.794	81%	0.808	S	S	*	*			trans	-150.2	95.1	165.3	0	0	0	0	0	110.9
237	E	26.6	Very low	26.5	Very low	170 Å²	170	139.6 Å²	139.6	79%	0.794	80%	0.798	S	S	*	*			trans	-82.7	131	171.8	-67.8	-171.6	143.1	0	0	111.1	I235	I235-E237 HydrophobicContact CG2-CG 4.43Å
238	V	25.7	Very low	26.9	Very low	146 Å²	146	134.6 Å²	134.6	89%	0.885	79%	0.788	S	S	*	*			trans	-138	135.3	147.6	-172.5	0	0	0	0	107
239	K	26.6	Very low	27.4	Very low	164 Å²	164	131.5 Å²	131.5	71%	0.713	77%	0.774	S	S	*	*			trans	-89.6	163	-176.7	-62.6	175.2	172.3	176.4	0	112.5
240	D	24	Very low	27.7	Very low	141 Å²	141	126.1 Å²	126.1	75%	0.754	76%	0.755	S	S	*	*				132.1	136.3	126.4	-72.5	-36.4	0	0	0	117.2
241	E	24.6	Very low	27.9	Very low	187 Å²	187	123.3 Å²	123.3	87%	0.874	74%	0.743	S	S	*	*			trans	75.5	91.5	153.2	-49.6	-110.1	128.2	0	0	121.4
242	A	31.2	Very low	28.5	Very low	106 Å²	106	118.7 Å²	118.7	88%	0.876	73%	0.728	S	S	*	*			trans	23.3	115.2	138.7	0	0	0	0	0	123
243	A	25.5	Very low	28.9	Very low	100 Å²	100	120.7 Å²	120.7	83%	0.826	73%	0.733	S	S	*	*			trans	-152.8	158.8	145.3	0	0	0	0	0	110.4
244	P	32.8	Very low	29.2	Very low	118 Å²	118	121.7 Å²	121.7	77%	0.766	73%	0.731	S	S	*	*			trans	-100.7	147.6	-143.9	35.4	-34.4	0	0	0	117.6
245	G	31	Very low	29.4	Very low	77 Å²	77	122.3 Å²	122.3	79%	0.794	72%	0.717	S	S	*	*			trans	55.8	78.6	136.3	0	0	0	0	0	118.7	S247	G245-S247 PolarHBondContact O-N 3.17Å
246	W	24.8	Very low	29.6	Very low	240 Å²	240	119.1 Å²	119.1	91%	0.909	70%	0.699	S	S	*	*			trans	-87.2	105.1	163.5	-73.4	23.1	0	0	0	109.6
247	S	32.8	Very low	30.1	Very low	86 Å²	86	123.8 Å²	123.8	60%	0.601	69%	0.694	S	S	*	*			trans	-69.1	157.2	177.1	74.8	0	0	0	0	112.3	G245 A249 A250	G245-S247 PolarHBondContact O-N 3.17Å; S247-A249 PolarHBondContact O-N 3.38Å; S247-A250 PolarHBondContact O-N 3.41Å
248	A	34.2	Very low	30.5	Very low	79 Å²	79	122.4 Å²	122.4	65%	0.653	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-20.7	-175.5	0	0	0	0	0	115	A250 A251	A248-A250 PolarHBondContact O-N 3.02Å; A248-A250 VanDerWaalsContact O-N 3.08Å; A248-A251 WeakPolarHBondContact O-CB 3.24Å; A248-A251 PolarHBondContact O-N 2.97Å
249	A	32.6	Very low	31.1	Very low	58 Å²	58	121.7 Å²	121.7	48%	0.479	68%	0.682	S	S	.	*	H	α-helix	trans	-55.5	-26.5	177.1	0	0	0	0	0	114.3	S247 A251 D252 M253	S247-A249 PolarHBondContact O-N 3.38Å; A249-A251 VanDerWaalsContact C-N 3.31Å; A249-A251 PolarHBondContact O-N 3.39Å; A249-D252 PolarHBondContact O-N 3.12Å; A249-M253 PolarHBondContact O-N 3.22Å; A249-M253 VanDerWaalsContact O-N 3.15Å
250	A	29.9	Very low	31.7	Very low	56 Å²	56	118.9 Å²	118.9	46%	0.463	67%	0.667	S	S	.	*	H	α-helix	trans	-71.2	-23.6	176.5	0	0	0	0	0	113.5	S247 A248	S247-A250 PolarHBondContact O-N 3.41Å; A248-A250 PolarHBondContact O-N 3.02Å; A248-A250 VanDerWaalsContact O-N 3.08Å
251	A	31.6	Very low	32.3	Very low	63 Å²	63	114.5 Å²	114.5	52%	0.521	66%	0.655	S	S	.	*	H	α-helix	trans	-77.6	-40.8	173.6	0	0	0	0	0	111.2	A248 A249 K254 F255	A248-A251 WeakPolarHBondContact O-CB 3.24Å; A248-A251 PolarHBondContact O-N 2.97Å; A249-A251 VanDerWaalsContact C-N 3.31Å; A249-A251 PolarHBondContact O-N 3.39Å; A251-K254 WeakPolarHBondContact O-CB 3.28Å; A251-K254 PolarHBondContact O-N 3.37Å; A251-K254 VanDerWaalsContact O-N 3.12Å; A251-F255 PolarHBondContact O-N 2.75Å; A251-F255 VanDerWaalsContact O-N 3.16Å
252	D	34.6	Very low	33.2	Very low	107 Å²	107	113.6 Å²	113.6	57%	0.572	65%	0.651	S	S	*	*	H	α-helix	trans	-66.4	-37.9	178.7	-69.2	-32.5	0	0	0	112.3	A249 K254 F255 E256	A249-D252 PolarHBondContact O-N 3.12Å; D252-K254 PolarHBondContact O-N 2.81Å; D252-F255 CarbonylContact O-C 3.6Å; D252-F255 WeakPolarHBondContact O-CA 3.26Å; D252-F255 PolarHBondContact O-N 2.8Å; D252-E256 PolarHBondContact O-N 3.41Å
253	M	34	Very low	33.9	Very low	137 Å²	137	115.8 Å²	115.8	68%	0.675	64%	0.637	S	S	*	*	H	α-helix	trans	-58.8	-32.5	171.7	-76.8	-174.3	70.9	0	0	112.9	A249 Y257	A249-M253 PolarHBondContact O-N 3.22Å; A249-M253 VanDerWaalsContact O-N 3.15Å; M253-Y257 PolarHBondContact O-N 3.39Å
254	K	31.3	Very low	35.1	Very low	157 Å²	157	116.3 Å²	116.3	68%	0.683	62%	0.622	S	S	*	*	H	α-helix	trans	-77.1	-24.6	176.1	-166.6	172.4	-178.6	177.5	0	112.4	A251 D252	A251-K254 WeakPolarHBondContact O-CB 3.28Å; A251-K254 PolarHBondContact O-N 3.37Å; A251-K254 VanDerWaalsContact O-N 3.12Å; D252-K254 PolarHBondContact O-N 2.81Å
255	F	29.9	Very low	36.4	Very low	140 Å²	140	116.2 Å²	116.2	61%	0.614	61%	0.611	S	S	*	*	H	α-helix	trans	-79.7	-39.3	173.7	-119.2	-91.9	0	0	0	112.2	A251 D252 Y257 L258 L259	A251-F255 PolarHBondContact O-N 2.75Å; A251-F255 VanDerWaalsContact O-N 3.16Å; D252-F255 CarbonylContact O-C 3.6Å; D252-F255 WeakPolarHBondContact O-CA 3.26Å; D252-F255 PolarHBondContact O-N 2.8Å; F255-Y257 VanDerWaalsContact C-N 3.3Å; F255-Y257 PolarHBondContact O-N 3.2Å; F255-L258 PolarHBondContact O-N 3.3Å; F255-L259 HydrophobicContact CD1-CD1 4.06Å; F255-L259 PolarHBondContact O-N 3.22Å
256	E	32.1	Very low	38.2	Very low	93 Å²	93	115.2 Å²	115.2	44%	0.435	59%	0.587	S	S	.	*	H	α-helix	trans	-57.6	-44	169	-77	-157.5	120.7	0	0	110.8	D252 L258 L259 Y260	D252-E256 PolarHBondContact O-N 3.41Å; E256-L258 PolarHBondContact O-N 2.82Å; E256-L258 VanDerWaalsContact O-N 3.08Å; E256-L259 PolarHBondContact O-N 3.22Å; E256-L259 VanDerWaalsContact O-N 3.1Å; E256-Y260 HydrophobicContact CB-CD2 3.94Å; E256-Y260 HydrophobicContact CB-CE2 3.88Å; E256-Y260 HydrophobicContact CG-CD2 4.38Å; E256-Y260 HydrophobicContact CG-CE2 3.81Å; E256-Y260 VanDerWaalsContact O-CD2 3.28Å; E256-Y260 WeakPolarHBondContact O-CD2 3.22Å; E256-Y260 PolarHBondContact O-N 3.25Å; E256-Y260 VanDerWaalsContact OE1-CE2 3.26Å; E256-Y260 WeakPolarHBondContact OE1-CE2 3.23Å; E256-Y260 PolarHBondContact OE1-OH 3.36Å
257	Y	36.3	Very low	40.5	Very low	174 Å²	174	105.4 Å²	105.4	68%	0.682	56%	0.558	S	S	*	*	H	α-helix	trans	-62	-16.9	-179.9	-141	-85.9	0	0	0	114.5	M253 F255 E264	M253-Y257 PolarHBondContact O-N 3.39Å; F255-Y257 VanDerWaalsContact C-N 3.3Å; F255-Y257 PolarHBondContact O-N 3.2Å; Y257-E264 PolarHBondContact OH-OE1 2.83Å
258	L	34.6	Very low	42.7	Very low	141 Å²	141	101.4 Å²	101.4	74%	0.738	53%	0.53	S	S	*	.	H	α-helix	trans	-99.6	-18.9	176.9	-74.1	167.7	0	0	0	113.8	F255 E256	F255-L258 PolarHBondContact O-N 3.3Å; E256-L258 PolarHBondContact O-N 2.82Å; E256-L258 VanDerWaalsContact O-N 3.08Å
259	L	37.8	Very low	44.7	Very low	131 Å²	131	105.7 Å²	105.7	69%	0.686	54%	0.536	S	S	*	.	H	α-helix	trans	-100.3	-34.3	-177.6	-82.9	158.5	0	0	0	113	F255 E256 G261	F255-L259 HydrophobicContact CD1-CD1 4.06Å; F255-L259 PolarHBondContact O-N 3.22Å; E256-L259 PolarHBondContact O-N 3.22Å; E256-L259 VanDerWaalsContact O-N 3.1Å; L259-G261 PolarHBondContact O-N 3.23Å; L259-G261 VanDerWaalsContact O-N 3.11Å
260	Y	40.8	Very low	46.7	Very low	105 Å²	105	107.9 Å²	107.9	41%	0.412	54%	0.543	S	S	.	.	S	Bend	trans	-78.5	98.7	169.6	-64.9	-75.5	0	0	0	109.7	K40 E256 H262	K40-Y260 VanDerWaalsContact CD-OH 3.3Å; K40-Y260 WeakPolarHBondContact CD-OH 3.23Å; E256-Y260 HydrophobicContact CB-CD2 3.94Å; E256-Y260 HydrophobicContact CB-CE2 3.88Å; E256-Y260 HydrophobicContact CG-CD2 4.38Å; E256-Y260 HydrophobicContact CG-CE2 3.81Å; E256-Y260 VanDerWaalsContact O-CD2 3.28Å; E256-Y260 WeakPolarHBondContact O-CD2 3.22Å; E256-Y260 PolarHBondContact O-N 3.25Å; E256-Y260 VanDerWaalsContact OE1-CE2 3.26Å; E256-Y260 WeakPolarHBondContact OE1-CE2 3.23Å; E256-Y260 PolarHBondContact OE1-OH 3.36Å; Y260-H262 PolarHBondContact O-N 3.12Å
261	G	36.1	Very low	49	Very low	49 Å²	49	107.8 Å²	107.8	51%	0.505	54%	0.539	S	S	.	.			trans	-66.3	52.5	171.2	0	0	0	0	0	114.4	L259 R263	L259-G261 PolarHBondContact O-N 3.23Å; L259-G261 VanDerWaalsContact O-N 3.11Å; G261-R263 PolarHBondContact O-N 2.8Å
262	H	42.5	Very low	51	Low	169 Å²	169	107.5 Å²	107.5	78%	0.782	54%	0.542	S	S	*	.			trans	-57.9	94.8	141.4	-96.2	-86.5	0	0	0	106.3	Y260 E264	Y260-H262 PolarHBondContact O-N 3.12Å; H262-E264 VanDerWaalsContact C-N 3.29Å; H262-E264 PolarHBondContact O-N 2.87Å
263	R	46.3	Very low	52.8	Low	151 Å²	151	108.3 Å²	108.3	57%	0.57	54%	0.54	S	S	*	.			trans	-53.9	108.3	149.2	-86.2	169.5	171.6	-123.8	9.1	104.7	G261 Q265 L276 D277	G261-R263 PolarHBondContact O-N 2.8Å; R263-Q265 PolarHBondContact O-N 2.7Å; R263-L276 VanDerWaalsContact CD-O 3.31Å; R263-L276 WeakPolarHBondContact CD-O 3.34Å; R263-L276 PolarHBondContact NH1-O 3.5Å; R263-D277 IonicContact NH1-OD2 3.12Å
264	E	50.4	Low	54.8	Low	112 Å²	112	105.5 Å²	105.5	52%	0.523	53%	0.531	S	S	.	.			trans	-49.7	115.8	172.7	-71.6	-173.4	154.4	0	0	106.3	Y257 H262 L266	Y257-E264 PolarHBondContact OH-OE1 2.83Å; H262-E264 VanDerWaalsContact C-N 3.29Å; H262-E264 PolarHBondContact O-N 2.87Å; E264-L266 PolarHBondContact O-N 3.22Å
265	Q	61.3	Low	57	Low	115 Å²	115	99.9 Å²	99.9	54%	0.537	51%	0.507	S	S	.	.			trans	-75.8	87.4	-176.4	-86.1	-162.8	22.4	0	0	107	R263 A267 T274 F275	R263-Q265 PolarHBondContact O-N 2.7Å; Q265-A267 PolarHBondContact O-N 3.47Å; Q265-T274 HydrophobicContact CB-CG2 4.07Å; Q265-T274 VanDerWaalsContact OE1-CB 3.29Å; Q265-T274 PolarHBondContact OE1-OG1 3.06Å; Q265-F275 CarbonylContact C-O 3.56Å; Q265-F275 WeakPolarHBondContact CA-O 3.46Å
266	L	68.7	Low	59.1	Low	56 Å²	56	97.3 Å²	97.3	29%	0.293	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	105.4	-173.8	-75.1	167.9	0	0	0	108.6	E264 F275 E278 L281	E264-L266 PolarHBondContact O-N 3.22Å; L266-F275 PolarHBondContact N-O 2.86Å; L266-F275 WeakPolarHBondContact O-CD2 3.4Å; L266-F275 PolarHBondContact O-N 3.2Å; L266-E278 VanDerWaalsContact CD1-CA 3.43Å; L266-E278 HydrophobicContact CD1-CB 3.59Å; L266-E278 HydrophobicContact CD1-CG 4.02Å; L266-L281 HydrophobicContact CB-CB 4.13Å; L266-L281 HydrophobicContact CB-CD2 3.74Å; L266-L281 HydrophobicContact CB-CG 4.47Å
267	A	73.6	Confident	61.3	Low	35 Å²	35	94.8 Å²	94.8	29%	0.289	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	129.2	-173.5	0	0	0	0	0	110.1	Q265 Q269 K273 T274	Q265-A267 PolarHBondContact O-N 3.47Å; A267-Q269 PolarHBondContact O-N 3.31Å; A267-Q269 PolarHBondContact O-NE2 2.94Å; A267-Q269 VanDerWaalsContact O-NE2 3.09Å; A267-K273 WeakPolarHBondContact CA-O 3.43Å; A267-T274 HydrophobicContact CB-CG2 4.22Å
268	C	78.1	Confident	63.2	Low	1 Å²	1	91.2 Å²	91.2	1%	0.007	48%	0.478	C	S	.	.			trans	-69.1	118.5	174.4	-177.9	0	0	0	0	110.6	V270 C271 G272 K273 F275 L281 H284 H288	C268-V270 PolarHBondContact O-N 2.9Å; C268-V270 VanDerWaalsContact O-N 3.11Å; C268-C271 PolarHBondContact O-N 3.31Å; C268-G272 WeakPolarHBondContact O-CA 3.37Å; C268-G272 PolarHBondContact O-N 3.39Å; C268-K273 PolarHBondContact N-O 2.99Å; C268-F275 HydrophobicContact CB-CE2 4.23Å; C268-L281 HydrophobicContact CB-CD1 3.68Å; C268-H284 VanDerWaalsContact CB-CD2 3.49Å; C268-H284 WeakPolarHBondContact CB-CD2 3.48Å; C268-H288 PolarHBondContact SG-CD2 2.97Å; C268-H288 PolarHBondContact SG-NE2 3.48Å
269	Q	76.8	Confident	65.2	Low	170 Å²	170	88.2 Å²	88.2	79%	0.794	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-19.9	-177.8	-57.8	-56.3	-49.8	0	0	113.4	A267	A267-Q269 PolarHBondContact O-N 3.31Å; A267-Q269 PolarHBondContact O-NE2 2.94Å; A267-Q269 VanDerWaalsContact O-NE2 3.09Å
270	V	74.5	Confident	67	Low	104 Å²	104	88.5 Å²	88.5	63%	0.63	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-31.8	-179.3	-173	0	0	0	0	112.9	C268 H288	C268-V270 PolarHBondContact O-N 2.9Å; C268-V270 VanDerWaalsContact O-N 3.11Å; V270-H288 HydrophobicContact CB-CB 4.34Å; V270-H288 HydrophobicContact CG1-CB 4.15Å; V270-H288 HydrophobicContact CG2-CB 4.18Å
271	C	77.6	Confident	68.9	Low	54 Å²	54	84.1 Å²	84.1	37%	0.365	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.1	10.4	-174.5	77.8	0	0	0	0	116.1	C268 K273 H284 H288	C268-C271 PolarHBondContact O-N 3.31Å; C271-K273 PolarHBondContact O-N 2.83Å; C271-H284 PolarHBondContact SG-NE2 3.34Å; C271-H288 VanDerWaalsContact SG-CE1 3.59Å; C271-H288 PolarHBondContact SG-NE2 2.92Å; C271-H288 VanDerWaalsContact SG-NE2 3.39Å
272	G	74.2	Confident	70.8	Confident	57 Å²	57	89 Å²	89	59%	0.588	45%	0.447	S	S	*	.			trans	68.4	1.8	173.9	0	0	0	0	0	116.2	C268 T274	C268-G272 WeakPolarHBondContact O-CA 3.37Å; C268-G272 PolarHBondContact O-N 3.39Å; G272-T274 PolarHBondContact O-N 3.48Å
273	K	72.1	Confident	72.3	Confident	123 Å²	123	88.2 Å²	88.2	54%	0.535	44%	0.442	S	S	.	.			trans	-68.9	131.5	178.7	-71.6	179.5	-176.2	174.8	0	110.8	A267 C268 C271 F275	A267-K273 WeakPolarHBondContact CA-O 3.43Å; C268-K273 PolarHBondContact N-O 2.99Å; C271-K273 PolarHBondContact O-N 2.83Å; K273-F275 HydrophobicContact CB-CE2 3.67Å; K273-F275 HydrophobicContact CB-CZ 3.81Å; K273-F275 WeakPolarHBondContact O-CD2 3.49Å; K273-F275 WeakPolarHBondContact O-CE2 3.21Å
274	T	75.1	Confident	73.8	Confident	78 Å²	78	81.9 Å²	81.9	48%	0.479	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	142.2	178.7	49.2	0	0	0	0	112.4	Q265 A267 G272	Q265-T274 HydrophobicContact CB-CG2 4.07Å; Q265-T274 VanDerWaalsContact OE1-CB 3.29Å; Q265-T274 PolarHBondContact OE1-OG1 3.06Å; A267-T274 HydrophobicContact CB-CG2 4.22Å; G272-T274 PolarHBondContact O-N 3.48Å
275	F	77.6	Confident	75	Confident	40 Å²	40	80 Å²	80	18%	0.175	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	146.1	-179.7	-62.7	-83.6	0	0	0	111.5	Q265 L266 C268 K273 D277 R280 L281 H284	Q265-F275 CarbonylContact C-O 3.56Å; Q265-F275 WeakPolarHBondContact CA-O 3.46Å; L266-F275 PolarHBondContact N-O 2.86Å; L266-F275 WeakPolarHBondContact O-CD2 3.4Å; L266-F275 PolarHBondContact O-N 3.2Å; C268-F275 HydrophobicContact CB-CE2 4.23Å; K273-F275 HydrophobicContact CB-CE2 3.67Å; K273-F275 HydrophobicContact CB-CZ 3.81Å; K273-F275 WeakPolarHBondContact O-CD2 3.49Å; K273-F275 WeakPolarHBondContact O-CE2 3.21Å; F275-D277 VanDerWaalsContact C-N 3.31Å; F275-D277 PolarHBondContact O-N 3.26Å; F275-R280 HydrophobicContact CB-CB 4.13Å; F275-R280 HydrophobicContact CD1-CB 3.93Å; F275-R280 HydrophobicContact CG-CB 4.35Å; F275-L281 HydrophobicContact CB-CB 4.18Å; F275-L281 HydrophobicContact CD2-CB 4.19Å; F275-L281 HydrophobicContact CD2-CD1 3.73Å; F275-L281 HydrophobicContact CE2-CD1 4.13Å; F275-L281 HydrophobicContact CG-CB 4.35Å; F275-H284 HydrophobicContact CE1-CB 3.87Å; F275-H284 HydrophobicContact CE2-CB 3.88Å; F275-H284 AromaticContact CE2-CD2 3.25Å; F275-H284 WeakPolarHBondContact CE2-CD2 3.49Å; F275-H284 AromaticContact CE2-CG 3.54Å; F275-H284 AromaticContact CE2-NE2 3.92Å; F275-H284 HydrophobicContact CZ-CB 3.47Å; F275-H284 VanDerWaalsContact CZ-CB 3.47Å; F275-H284 AromaticContact CZ-CD2 3.37Å; F275-H284 WeakPolarHBondContact CZ-CD2 3.22Å; F275-H284 AromaticContact CZ-CG 3.16Å; F275-H284 AromaticContact CZ-ND1 3.66Å; F275-H284 AromaticContact CZ-NE2 3.93Å
276	L	74.8	Confident	75.5	Confident	85 Å²	85	80.3 Å²	80.3	45%	0.445	41%	0.409	S	S	.	.	S	Bend	trans	-79.2	-10.4	-176.9	-65.4	172.9	0	0	0	114	R263	R263-L276 VanDerWaalsContact CD-O 3.31Å; R263-L276 WeakPolarHBondContact CD-O 3.34Å; R263-L276 PolarHBondContact NH1-O 3.5Å
277	D	77.8	Confident	75.5	Confident	41 Å²	41	82.8 Å²	82.8	22%	0.219	42%	0.423	C	S	.	.	S	Bend	trans	-157.8	157	178	58.9	66.5	0	0	0	111	R263 F275 S279 R280 L281	R263-D277 IonicContact NH1-OD2 3.12Å; F275-D277 VanDerWaalsContact C-N 3.31Å; F275-D277 PolarHBondContact O-N 3.26Å; D277-S279 PolarHBondContact O-N 3.43Å; D277-S279 WeakPolarHBondContact OD1-CB 3.5Å; D277-S279 PolarHBondContact OD1-N 3.41Å; D277-R280 PolarHBondContact O-N 3.48Å; D277-R280 WeakPolarHBondContact OD1-CB 3.47Å; D277-R280 WeakPolarHBondContact OD1-CG 3.5Å; D277-R280 PolarHBondContact OD1-N 2.93Å; D277-R280 IonicContact OD1-NE 3.79Å; D277-R280 VanDerWaalsContact OD2-CD 3.3Å; D277-R280 WeakPolarHBondContact OD2-CD 3.33Å; D277-R280 IonicContact OD2-CZ 3.41Å; D277-R280 IonicContact OD2-NE 3.96Å; D277-R280 PolarHBondContact OD2-NE 2.28Å; D277-R280 IonicContact OD2-NH2 2.75Å; D277-L281 PolarHBondContact O-N 3Å; D277-L281 VanDerWaalsContact O-N 3.09Å
278	E	76.5	Confident	75.3	Confident	98 Å²	98	84.6 Å²	84.6	46%	0.458	43%	0.425	S	S	.	.	H	α-helix	trans	-66.6	-28.6	-176.7	-159.6	-165.6	158.1	0	0	112.1	L266 R280 L281 R282	L266-E278 VanDerWaalsContact CD1-CA 3.43Å; L266-E278 HydrophobicContact CD1-CB 3.59Å; L266-E278 HydrophobicContact CD1-CG 4.02Å; E278-R280 PolarHBondContact O-N 2.79Å; E278-L281 PolarHBondContact O-N 3.27Å; E278-R282 HydrophobicContact CG-CG 4.37Å; E278-R282 WeakPolarHBondContact O-CB 3.33Å; E278-R282 WeakPolarHBondContact O-CG 3.31Å; E278-R282 PolarHBondContact O-N 2.97Å; E278-R282 IonicContact OE1-CZ 2.8Å; E278-R282 IonicContact OE1-NE 2.7Å; E278-R282 PolarHBondContact OE1-NE 3.29Å; E278-R282 IonicContact OE1-NH2 3.52Å; E278-R282 PolarHBondContact OE1-NH2 3.18Å
279	S	76	Confident	74.7	Confident	79 Å²	79	86.5 Å²	86.5	55%	0.552	44%	0.438	S	S	*	.	H	α-helix	trans	-64.7	-38.9	176	-75.4	0	0	0	0	112.1	D277 K283	D277-S279 PolarHBondContact O-N 3.43Å; D277-S279 WeakPolarHBondContact OD1-CB 3.5Å; D277-S279 PolarHBondContact OD1-N 3.41Å; S279-K283 WeakPolarHBondContact O-CB 3.41Å; S279-K283 WeakPolarHBondContact O-CD 3.45Å; S279-K283 WeakPolarHBondContact O-CG 3.46Å; S279-K283 PolarHBondContact O-N 3.47Å; S279-K283 VanDerWaalsContact O-N 3.14Å
280	R	76.6	Confident	74	Confident	136 Å²	136	83 Å²	83	51%	0.513	44%	0.438	S	S	.	.	H	α-helix	trans	-72.1	-41.4	173	-71.1	171	-157.2	-139.7	-2.6	111.6	F275 D277 E278 K283 H284	F275-R280 HydrophobicContact CB-CB 4.13Å; F275-R280 HydrophobicContact CD1-CB 3.93Å; F275-R280 HydrophobicContact CG-CB 4.35Å; D277-R280 PolarHBondContact O-N 3.48Å; D277-R280 WeakPolarHBondContact OD1-CB 3.47Å; D277-R280 WeakPolarHBondContact OD1-CG 3.5Å; D277-R280 PolarHBondContact OD1-N 2.93Å; D277-R280 IonicContact OD1-NE 3.79Å; D277-R280 VanDerWaalsContact OD2-CD 3.3Å; D277-R280 WeakPolarHBondContact OD2-CD 3.33Å; D277-R280 IonicContact OD2-CZ 3.41Å; D277-R280 IonicContact OD2-NE 3.96Å; D277-R280 PolarHBondContact OD2-NE 2.28Å; D277-R280 IonicContact OD2-NH2 2.75Å; E278-R280 PolarHBondContact O-N 2.79Å; R280-K283 PolarHBondContact O-N 2.92Å; R280-H284 WeakPolarHBondContact O-CB 3.44Å; R280-H284 PolarHBondContact O-N 3Å
281	L	80	Confident	73.6	Confident	14 Å²	14	85 Å²	85	7%	0.073	44%	0.441	C	S	.	.	H	α-helix	trans	-59.3	-55.1	174.5	175.7	61.9	0	0	0	110.7	L266 C268 F275 D277 E278 K283 H284 E285	L266-L281 HydrophobicContact CB-CB 4.13Å; L266-L281 HydrophobicContact CB-CD2 3.74Å; L266-L281 HydrophobicContact CB-CG 4.47Å; C268-L281 HydrophobicContact CB-CD1 3.68Å; F275-L281 HydrophobicContact CB-CB 4.18Å; F275-L281 HydrophobicContact CD2-CB 4.19Å; F275-L281 HydrophobicContact CD2-CD1 3.73Å; F275-L281 HydrophobicContact CE2-CD1 4.13Å; F275-L281 HydrophobicContact CG-CB 4.35Å; D277-L281 PolarHBondContact O-N 3Å; D277-L281 VanDerWaalsContact O-N 3.09Å; E278-L281 PolarHBondContact O-N 3.27Å; L281-K283 VanDerWaalsContact C-N 3.29Å; L281-K283 PolarHBondContact O-N 3.46Å; L281-H284 CarbonylContact O-C 3.53Å; L281-H284 WeakPolarHBondContact O-CA 3.3Å; L281-H284 WeakPolarHBondContact O-CB 3.43Å; L281-H284 PolarHBondContact O-N 3.14Å; L281-E285 HydrophobicContact CD1-CG 3.81Å; L281-E285 HydrophobicContact CG-CG 4.13Å; L281-E285 WeakPolarHBondContact O-CG 3.3Å; L281-E285 PolarHBondContact O-N 3.25Å
282	R	75.8	Confident	73.4	Confident	150 Å²	150	89.6 Å²	89.6	57%	0.566	45%	0.451	S	S	*	.	H	α-helix	trans	-58	-38.6	179.3	-72.4	-178.3	-177.5	-143.8	8.1	112.7	E278 H284 E285 K286	E278-R282 HydrophobicContact CG-CG 4.37Å; E278-R282 WeakPolarHBondContact O-CB 3.33Å; E278-R282 WeakPolarHBondContact O-CG 3.31Å; E278-R282 PolarHBondContact O-N 2.97Å; E278-R282 IonicContact OE1-CZ 2.8Å; E278-R282 IonicContact OE1-NE 2.7Å; E278-R282 PolarHBondContact OE1-NE 3.29Å; E278-R282 IonicContact OE1-NH2 3.52Å; E278-R282 PolarHBondContact OE1-NH2 3.18Å; R282-H284 VanDerWaalsContact C-N 3.3Å; R282-H284 PolarHBondContact O-N 2.85Å; R282-E285 PolarHBondContact O-N 3.43Å; R282-K286 WeakPolarHBondContact O-CG 3.14Å; R282-K286 PolarHBondContact O-N 2.66Å; R282-K286 VanDerWaalsContact O-N 3.17Å
283	K	73.9	Confident	73.5	Confident	153 Å²	153	91.5 Å²	91.5	67%	0.665	45%	0.453	S	S	*	.	H	α-helix	trans	-64.2	-34.4	173.5	-79.4	173	-177.6	178.7	0	112.5	S279 R280 L281	S279-K283 WeakPolarHBondContact O-CB 3.41Å; S279-K283 WeakPolarHBondContact O-CD 3.45Å; S279-K283 WeakPolarHBondContact O-CG 3.46Å; S279-K283 PolarHBondContact O-N 3.47Å; S279-K283 VanDerWaalsContact O-N 3.14Å; R280-K283 PolarHBondContact O-N 2.92Å; L281-K283 VanDerWaalsContact C-N 3.29Å; L281-K283 PolarHBondContact O-N 3.46Å
284	H	78.4	Confident	73.9	Confident	18 Å²	18	89 Å²	89	8%	0.083	44%	0.442	C	S	.	.	H	α-helix	trans	-77.4	-36	175.8	170.7	69.6	0	0	0	112.7	C268 C271 F275 R280 L281 R282 K286 L287 H288	C268-H284 VanDerWaalsContact CB-CD2 3.49Å; C268-H284 WeakPolarHBondContact CB-CD2 3.48Å; C271-H284 PolarHBondContact SG-NE2 3.34Å; F275-H284 HydrophobicContact CE1-CB 3.87Å; F275-H284 HydrophobicContact CE2-CB 3.88Å; F275-H284 AromaticContact CE2-CD2 3.25Å; F275-H284 WeakPolarHBondContact CE2-CD2 3.49Å; F275-H284 AromaticContact CE2-CG 3.54Å; F275-H284 AromaticContact CE2-NE2 3.92Å; F275-H284 HydrophobicContact CZ-CB 3.47Å; F275-H284 VanDerWaalsContact CZ-CB 3.47Å; F275-H284 AromaticContact CZ-CD2 3.37Å; F275-H284 WeakPolarHBondContact CZ-CD2 3.22Å; F275-H284 AromaticContact CZ-CG 3.16Å; F275-H284 AromaticContact CZ-ND1 3.66Å; F275-H284 AromaticContact CZ-NE2 3.93Å; R280-H284 WeakPolarHBondContact O-CB 3.44Å; R280-H284 PolarHBondContact O-N 3Å; L281-H284 CarbonylContact O-C 3.53Å; L281-H284 WeakPolarHBondContact O-CA 3.3Å; L281-H284 WeakPolarHBondContact O-CB 3.43Å; L281-H284 PolarHBondContact O-N 3.14Å; R282-H284 VanDerWaalsContact C-N 3.3Å; R282-H284 PolarHBondContact O-N 2.85Å; H284-K286 VanDerWaalsContact C-N 3.26Å; H284-K286 PolarHBondContact O-N 3.12Å; H284-L287 WeakPolarHBondContact O-CA 3.37Å; H284-L287 WeakPolarHBondContact O-CB 3.45Å; H284-L287 WeakPolarHBondContact O-CG 3.37Å; H284-L287 PolarHBondContact O-N 2.92Å; H284-H288 AromaticContact CD2-NE2 3.8Å; H284-H288 AromaticContact CE1-NE2 3.37Å; H284-H288 PolarHBondContact CE1-NE2 3.39Å; H284-H288 AromaticContact NE2-CD2 3.76Å; H284-H288 AromaticContact NE2-CE1 3.97Å; H284-H288 AromaticContact NE2-NE2 2.96Å; H284-H288 PolarHBondContact NE2-NE2 3.49Å
285	E	75.4	Confident	74.2	Confident	73 Å²	73	88.1 Å²	88.1	34%	0.341	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-32	175.3	-71.8	173.9	149.8	0	0	112.1	L281 R282 L287 H288 S289	L281-E285 HydrophobicContact CD1-CG 3.81Å; L281-E285 HydrophobicContact CG-CG 4.13Å; L281-E285 WeakPolarHBondContact O-CG 3.3Å; L281-E285 PolarHBondContact O-N 3.25Å; R282-E285 PolarHBondContact O-N 3.43Å; E285-L287 PolarHBondContact O-N 2.94Å; E285-L287 VanDerWaalsContact O-N 3.09Å; E285-H288 PolarHBondContact O-N 2.91Å; E285-S289 PolarHBondContact O-N 2.96Å
286	K	72.8	Confident	74.5	Confident	121 Å²	121	86.2 Å²	86.2	53%	0.526	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-3.9	166.6	-71	-178.3	179.4	-164.6	0	115.2	R282 H284 T304	R282-K286 WeakPolarHBondContact O-CG 3.14Å; R282-K286 PolarHBondContact O-N 2.66Å; R282-K286 VanDerWaalsContact O-N 3.17Å; H284-K286 VanDerWaalsContact C-N 3.26Å; H284-K286 PolarHBondContact O-N 3.12Å; K286-T304 VanDerWaalsContact O-CG2 3.22Å; K286-T304 WeakPolarHBondContact O-CG2 3.41Å
287	L	67.9	Low	74.9	Confident	109 Å²	109	90.7 Å²	90.7	57%	0.571	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-19.4	168.1	-52.8	175.9	0	0	0	112.1	H284 E285 T304	H284-L287 WeakPolarHBondContact O-CA 3.37Å; H284-L287 WeakPolarHBondContact O-CB 3.45Å; H284-L287 WeakPolarHBondContact O-CG 3.37Å; H284-L287 PolarHBondContact O-N 2.92Å; E285-L287 PolarHBondContact O-N 2.94Å; E285-L287 VanDerWaalsContact O-N 3.09Å; L287-T304 HydrophobicContact CD2-CG2 4.27Å
288	H	70	Confident	75.1	Confident	72 Å²	72	92.2 Å²	92.2	33%	0.333	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	-31.4	174.5	-61.3	-63.1	0	0	0	112	C268 V270 C271 H284 E285	C268-H288 PolarHBondContact SG-CD2 2.97Å; C268-H288 PolarHBondContact SG-NE2 3.48Å; V270-H288 HydrophobicContact CB-CB 4.34Å; V270-H288 HydrophobicContact CG1-CB 4.15Å; V270-H288 HydrophobicContact CG2-CB 4.18Å; C271-H288 VanDerWaalsContact SG-CE1 3.59Å; C271-H288 PolarHBondContact SG-NE2 2.92Å; C271-H288 VanDerWaalsContact SG-NE2 3.39Å; H284-H288 AromaticContact CD2-NE2 3.8Å; H284-H288 AromaticContact CE1-NE2 3.37Å; H284-H288 PolarHBondContact CE1-NE2 3.39Å; H284-H288 AromaticContact NE2-CD2 3.76Å; H284-H288 AromaticContact NE2-CE1 3.97Å; H284-H288 AromaticContact NE2-NE2 2.96Å; H284-H288 PolarHBondContact NE2-NE2 3.49Å; E285-H288 PolarHBondContact O-N 2.91Å
289	S	64.7	Low	75.5	Confident	41 Å²	41	89.8 Å²	89.8	29%	0.287	45%	0.453	S	S	.	.	S	Bend	trans	-67.3	134.2	165.3	69.2	0	0	0	0	109.6	E285 E291	E285-S289 PolarHBondContact O-N 2.96Å; S289-E291 PolarHBondContact O-N 3.09Å; S289-E291 VanDerWaalsContact O-N 3.13Å
290	A	61.3	Low	75.7	Confident	97 Å²	97	90.9 Å²	90.9	80%	0.802	46%	0.461	S	S	*	.			trans	-69.7	-1.6	172.6	0	0	0	0	0	112.6	R292	A290-R292 PolarHBondContact O-N 2.89Å
291	E	66.4	Low	75.9	Confident	147 Å²	147	88.6 Å²	88.6	69%	0.687	46%	0.455	S	S	*	.			trans	-67.3	98.3	178.6	-64.7	-176.9	174.2	0	0	111.1	S289 P293	S289-E291 PolarHBondContact O-N 3.09Å; S289-E291 VanDerWaalsContact O-N 3.13Å; E291-P293 WeakPolarHBondContact O-CD 3.42Å
292	R	74.5	Confident	76	Confident	149 Å²	149	89.1 Å²	89.1	56%	0.562	46%	0.462	S	S	*	.			trans	-110.1	74.9	171.4	-69.8	165.3	169.8	-128.6	13.5	108.6	A290 F294 A302 F303 T304	A290-R292 PolarHBondContact O-N 2.89Å; R292-F294 PolarHBondContact O-N 3.13Å; R292-F294 VanDerWaalsContact O-N 3.12Å; R292-A302 HydrophobicContact CB-CB 3.42Å; R292-A302 VanDerWaalsContact CB-CB 3.42Å; R292-A302 WeakPolarHBondContact CD-O 3.27Å; R292-A302 HydrophobicContact CG-CB 4.38Å; R292-A302 PolarHBondContact NH1-O 2.58Å; R292-F303 CarbonylContact C-O 3.54Å; R292-F303 VanDerWaalsContact C-O 3.29Å; R292-F303 WeakPolarHBondContact CA-O 3.43Å; R292-T304 HydrophobicContact CG-CG2 4.02Å
293	P	76.3	Confident	76.3	Confident	97 Å²	97	84 Å²	84	63%	0.63	44%	0.443	S	S	*	.			trans	-68.2	-12.3	-170.3	27.2	-35.5	0	0	0	114	E291	E291-P293 WeakPolarHBondContact O-CD 3.42Å
294	F	79.8	Confident	76.5	Confident	71 Å²	71	77.8 Å²	77.8	31%	0.311	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	88.6	-179.1	-56	-75.3	0	0	0	110.2	R292 F303 H306 L309	R292-F294 PolarHBondContact O-N 3.13Å; R292-F294 VanDerWaalsContact O-N 3.12Å; F294-F303 HydrophobicContact CB-CB 4.35Å; F294-F303 PolarHBondContact N-O 3.34Å; F294-F303 WeakPolarHBondContact O-CD2 3.42Å; F294-F303 PolarHBondContact O-N 3.44Å; F294-H306 HydrophobicContact CD1-CB 3.94Å; F294-H306 HydrophobicContact CE1-CB 3.81Å; F294-H306 HydrophobicContact CG-CB 4.39Å; F294-H306 HydrophobicContact CZ-CB 4.15Å; F294-L309 HydrophobicContact CB-CB 4.13Å; F294-L309 HydrophobicContact CB-CD2 3.92Å
295	A	82.4	Confident	76.5	Confident	59 Å²	59	79.3 Å²	79.3	49%	0.488	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.7	176.8	0	0	0	0	0	112.3
296	C	83.8	Confident	76.6	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.007	44%	0.437	C	S	.	.			trans	-80.3	122	166.9	179.2	0	0	0	0	110.2	I298 S300 K301 F303 L309 H312	C296-I298 PolarHBondContact O-N 3.26Å; C296-I298 PolarHBondContact SG-N 3.43Å; C296-S300 WeakPolarHBondContact O-CA 3.41Å; C296-S300 PolarHBondContact O-N 3.17Å; C296-K301 WeakPolarHBondContact CB-O 3.25Å; C296-K301 PolarHBondContact N-O 3.31Å; C296-F303 HydrophobicContact CB-CE2 4.35Å; C296-L309 HydrophobicContact CB-CD1 3.78Å; C296-H312 PolarHBondContact SG-NE2 3.14Å
297	E	81.9	Confident	77	Confident	178 Å²	178	78.5 Å²	78.5	83%	0.832	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.8	179.4	-59	-176.7	167.6	0	0	113.8
298	I	82.6	Confident	77.7	Confident	74 Å²	74	77.6 Å²	77.6	38%	0.379	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-38.8	-175.4	-56.3	173.9	0	0	0	112.2	V185 I189 C296 H316	V185-I298 HydrophobicContact CG1-CD1 4.35Å; V185-I298 HydrophobicContact CG1-CG1 4.39Å; I189-I298 HydrophobicContact CD1-CD1 3.71Å; C296-I298 PolarHBondContact O-N 3.26Å; C296-I298 PolarHBondContact SG-N 3.43Å; I298-H316 HydrophobicContact CD1-CB 3.61Å; I298-H316 WeakPolarHBondContact CG2-ND1 3.24Å
299	C	84.5	Confident	78.4	Confident	46 Å²	46	75 Å²	75	31%	0.311	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	10.7	-177.6	71.1	0	0	0	0	114.8	K301 H312 H316	C299-K301 PolarHBondContact O-N 3.35Å; C299-H312 PolarHBondContact SG-NE2 3.38Å; C299-H316 PolarHBondContact SG-NE2 3.43Å
300	S	81.2	Confident	79.3	Confident	102 Å²	102	75.5 Å²	75.5	71%	0.713	42%	0.416	S	S	*	.			trans	56.7	7.1	-179.1	-55.8	0	0	0	0	115.7	C296 A302	C296-S300 WeakPolarHBondContact O-CA 3.41Å; C296-S300 PolarHBondContact O-N 3.17Å; S300-A302 PolarHBondContact O-N 2.76Å
301	K	80.1	Confident	80.4	Confident	88 Å²	88	74.4 Å²	74.4	38%	0.383	39%	0.394	S	S	.	.			trans	-67.3	127.6	175.8	-72.1	-173.8	177.6	-173.5	0	109.8	C296 C299 F303	C296-K301 WeakPolarHBondContact CB-O 3.25Å; C296-K301 PolarHBondContact N-O 3.31Å; C299-K301 PolarHBondContact O-N 3.35Å; K301-F303 HydrophobicContact CB-CE2 4.02Å; K301-F303 HydrophobicContact CB-CZ 4.11Å; K301-F303 WeakPolarHBondContact O-CD2 3.45Å; K301-F303 WeakPolarHBondContact O-CE2 3.48Å
302	A	82.4	Confident	81.4	Confident	26 Å²	26	68.5 Å²	68.5	22%	0.215	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.1	-174.3	0	0	0	0	0	112.1	R292 S300	R292-A302 HydrophobicContact CB-CB 3.42Å; R292-A302 VanDerWaalsContact CB-CB 3.42Å; R292-A302 WeakPolarHBondContact CD-O 3.27Å; R292-A302 HydrophobicContact CG-CB 4.38Å; R292-A302 PolarHBondContact NH1-O 2.58Å; S300-A302 PolarHBondContact O-N 2.76Å
303	F	82.1	Confident	81.9	Confident	41 Å²	41	62.9 Å²	62.9	18%	0.18	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	151.5	-174.2	-59.4	-87.8	0	0	0	111.8	R292 F294 C296 K301 H308 L309 H312	R292-F303 CarbonylContact C-O 3.54Å; R292-F303 VanDerWaalsContact C-O 3.29Å; R292-F303 WeakPolarHBondContact CA-O 3.43Å; F294-F303 HydrophobicContact CB-CB 4.35Å; F294-F303 PolarHBondContact N-O 3.34Å; F294-F303 WeakPolarHBondContact O-CD2 3.42Å; F294-F303 PolarHBondContact O-N 3.44Å; C296-F303 HydrophobicContact CB-CE2 4.35Å; K301-F303 HydrophobicContact CB-CE2 4.02Å; K301-F303 HydrophobicContact CB-CZ 4.11Å; K301-F303 WeakPolarHBondContact O-CD2 3.45Å; K301-F303 WeakPolarHBondContact O-CE2 3.48Å; F303-H308 HydrophobicContact CB-CB 4.18Å; F303-H308 HydrophobicContact CD1-CB 3.87Å; F303-H308 HydrophobicContact CG-CB 4.3Å; F303-L309 HydrophobicContact CB-CB 4.37Å; F303-L309 HydrophobicContact CD2-CB 4.03Å; F303-L309 HydrophobicContact CD2-CD1 3.83Å; F303-L309 HydrophobicContact CE2-CD1 4.04Å; F303-L309 HydrophobicContact CG-CB 4.36Å; F303-H312 HydrophobicContact CE1-CB 3.92Å; F303-H312 HydrophobicContact CE2-CB 3.9Å; F303-H312 AromaticContact CE2-CD2 3.37Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.19Å; F303-H312 AromaticContact CE2-CG 3.62Å; F303-H312 HydrophobicContact CZ-CB 3.44Å; F303-H312 VanDerWaalsContact CZ-CB 3.44Å; F303-H312 AromaticContact CZ-CD2 3.47Å; F303-H312 VanDerWaalsContact CZ-CD2 3.47Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.35Å; F303-H312 AromaticContact CZ-CG 3.22Å; F303-H312 AromaticContact CZ-ND1 3.7Å
304	T	77.6	Confident	82.4	Confident	23 Å²	23	59.2 Å²	59.2	14%	0.141	32%	0.322	C	S	.	.	S	Bend	trans	-81.7	-14.6	179.1	54.8	0	0	0	0	113.4	K286 L287 R292	K286-T304 VanDerWaalsContact O-CG2 3.22Å; K286-T304 WeakPolarHBondContact O-CG2 3.41Å; L287-T304 HydrophobicContact CD2-CG2 4.27Å; R292-T304 HydrophobicContact CG-CG2 4.02Å
305	T	78.5	Confident	82.8	Confident	50 Å²	50	60.7 Å²	60.7	31%	0.307	33%	0.332	S	S	.	.	S	Bend	trans	-140.4	148.7	176.5	79	0	0	0	0	111.6	A307 H308 L309	T305-A307 PolarHBondContact O-N 3.46Å; T305-H308 PolarHBondContact O-N 3.49Å; T305-H308 VanDerWaalsContact OG1-CG 3.25Å; T305-H308 PolarHBondContact OG1-N 2.99Å; T305-H308 PolarHBondContact OG1-ND1 3.14Å; T305-L309 PolarHBondContact O-N 3.18Å
306	H	78.8	Confident	82.9	Confident	112 Å²	112	60.3 Å²	60.3	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-60.8	-32.9	173.9	-171.2	-101.2	0	0	0	112.6	F294 L309 K310	F294-H306 HydrophobicContact CD1-CB 3.94Å; F294-H306 HydrophobicContact CE1-CB 3.81Å; F294-H306 HydrophobicContact CG-CB 4.39Å; F294-H306 HydrophobicContact CZ-CB 4.15Å; H306-L309 PolarHBondContact O-N 2.93Å; H306-K310 PolarHBondContact O-N 3.28Å
307	A	79.3	Confident	82.8	Confident	66 Å²	66	61.5 Å²	61.5	55%	0.545	33%	0.328	S	S	.	.	H	α-helix	trans	-63	-43.4	177.3	0	0	0	0	0	112	T305 L309 K310 E311	T305-A307 PolarHBondContact O-N 3.46Å; A307-L309 VanDerWaalsContact C-N 3.34Å; A307-K310 PolarHBondContact O-N 2.93Å; A307-E311 WeakPolarHBondContact O-CB 3.46Å; A307-E311 PolarHBondContact O-N 3.22Å
308	H	83.3	Confident	82.9	Confident	90 Å²	90	55.2 Å²	55.2	42%	0.417	31%	0.31	S	S	.	.	H	α-helix	trans	-66.9	-35.1	175.1	-61.1	155.1	0	0	0	112.1	F303 T305 H312	F303-H308 HydrophobicContact CB-CB 4.18Å; F303-H308 HydrophobicContact CD1-CB 3.87Å; F303-H308 HydrophobicContact CG-CB 4.3Å; T305-H308 PolarHBondContact O-N 3.49Å; T305-H308 VanDerWaalsContact OG1-CG 3.25Å; T305-H308 PolarHBondContact OG1-N 2.99Å; T305-H308 PolarHBondContact OG1-ND1 3.14Å; H308-H312 VanDerWaalsContact O-CB 3.26Å; H308-H312 WeakPolarHBondContact O-CB 3.48Å; H308-H312 PolarHBondContact O-N 3.29Å
309	L	84.3	Confident	82.9	Confident	18 Å²	18	53.7 Å²	53.7	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-63.9	-49.9	171.8	175.6	60.6	0	0	0	111	F294 C296 F303 T305 H306 A307 E311 H312 L313	F294-L309 HydrophobicContact CB-CB 4.13Å; F294-L309 HydrophobicContact CB-CD2 3.92Å; C296-L309 HydrophobicContact CB-CD1 3.78Å; F303-L309 HydrophobicContact CB-CB 4.37Å; F303-L309 HydrophobicContact CD2-CB 4.03Å; F303-L309 HydrophobicContact CD2-CD1 3.83Å; F303-L309 HydrophobicContact CE2-CD1 4.04Å; F303-L309 HydrophobicContact CG-CB 4.36Å; T305-L309 PolarHBondContact O-N 3.18Å; H306-L309 PolarHBondContact O-N 2.93Å; A307-L309 VanDerWaalsContact C-N 3.34Å; L309-E311 VanDerWaalsContact C-N 3.29Å; L309-E311 PolarHBondContact O-N 2.78Å; L309-H312 WeakPolarHBondContact O-CB 3.46Å; L309-H312 PolarHBondContact O-N 3.27Å; L309-H312 VanDerWaalsContact O-N 3.1Å; L309-L313 HydrophobicContact CD1-CD1 4.45Å; L309-L313 HydrophobicContact CD1-CD2 4.33Å; L309-L313 HydrophobicContact CD1-CG 4.12Å; L309-L313 HydrophobicContact CG-CD1 4.31Å; L309-L313 HydrophobicContact CG-CG 4.41Å; L309-L313 WeakPolarHBondContact O-CG 3.4Å; L309-L313 PolarHBondContact O-N 3.15Å
310	K	83.2	Confident	83.1	Confident	50 Å²	50	56.7 Å²	56.7	22%	0.217	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-41.8	177.5	-170.7	-179.5	-174.6	-175.5	0	111.7	E192 L193 E196 H306 A307 L313	E192-K310 WeakPolarHBondContact O-CE 3.18Å; E192-K310 PolarHBondContact O-NZ 3.12Å; L193-K310 HydrophobicContact CD2-CD 4.34Å; L193-K310 HydrophobicContact CD2-CG 3.59Å; E196-K310 IonicContact OE1-NZ 2.7Å; E196-K310 PolarHBondContact OE1-NZ 3.34Å; H306-K310 PolarHBondContact O-N 3.28Å; A307-K310 PolarHBondContact O-N 2.93Å; K310-L313 PolarHBondContact O-N 2.96Å
311	E	85.4	Confident	83.3	Confident	74 Å²	74	52.9 Å²	52.9	35%	0.346	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-43.8	174.3	-177.4	172.5	-121.8	0	0	112.3	A307 L309 L313 K314 R333	A307-E311 WeakPolarHBondContact O-CB 3.46Å; A307-E311 PolarHBondContact O-N 3.22Å; L309-E311 VanDerWaalsContact C-N 3.29Å; L309-E311 PolarHBondContact O-N 2.78Å; E311-L313 PolarHBondContact O-N 3.37Å; E311-K314 VanDerWaalsContact O-CB 3.28Å; E311-K314 WeakPolarHBondContact O-CB 3.26Å; E311-K314 PolarHBondContact O-N 3.35Å; E311-R333 WeakPolarHBondContact OE1-CD 3.19Å; E311-R333 VanDerWaalsContact OE1-CG 3.25Å; E311-R333 WeakPolarHBondContact OE1-CG 3.42Å
312	H	86.6	Confident	83.7	Confident	23 Å²	23	51 Å²	51	11%	0.106	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-38.2	176	166.9	69.3	0	0	0	112.9	C296 C299 F303 H308 L309 K314 I315 H316	C296-H312 PolarHBondContact SG-NE2 3.14Å; C299-H312 PolarHBondContact SG-NE2 3.38Å; F303-H312 HydrophobicContact CE1-CB 3.92Å; F303-H312 HydrophobicContact CE2-CB 3.9Å; F303-H312 AromaticContact CE2-CD2 3.37Å; F303-H312 WeakPolarHBondContact CE2-CD2 3.19Å; F303-H312 AromaticContact CE2-CG 3.62Å; F303-H312 HydrophobicContact CZ-CB 3.44Å; F303-H312 VanDerWaalsContact CZ-CB 3.44Å; F303-H312 AromaticContact CZ-CD2 3.47Å; F303-H312 VanDerWaalsContact CZ-CD2 3.47Å; F303-H312 WeakPolarHBondContact CZ-CD2 3.35Å; F303-H312 AromaticContact CZ-CG 3.22Å; F303-H312 AromaticContact CZ-ND1 3.7Å; H308-H312 VanDerWaalsContact O-CB 3.26Å; H308-H312 WeakPolarHBondContact O-CB 3.48Å; H308-H312 PolarHBondContact O-N 3.29Å; L309-H312 WeakPolarHBondContact O-CB 3.46Å; L309-H312 PolarHBondContact O-N 3.27Å; L309-H312 VanDerWaalsContact O-N 3.1Å; H312-K314 PolarHBondContact O-N 3.37Å; H312-I315 WeakPolarHBondContact O-CB 3.45Å; H312-I315 WeakPolarHBondContact O-CG1 3.47Å; H312-I315 PolarHBondContact O-N 3.02Å; H312-H316 AromaticContact CE1-NE2 3.63Å; H312-H316 AromaticContact NE2-CD2 3.65Å; H312-H316 AromaticContact NE2-NE2 3.36Å; H312-H316 PolarHBondContact NE2-NE2 2.79Å
313	L	85.8	Confident	84	Confident	31 Å²	31	57 Å²	57	16%	0.162	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-25.9	177.2	-70.5	177	0	0	0	112.9	I189 L309 K310 E311 I315 H316 T317	I189-L313 HydrophobicContact CD1-CD2 4.15Å; I189-L313 HydrophobicContact CG1-CD1 4.47Å; I189-L313 HydrophobicContact CG2-CB 3.84Å; I189-L313 HydrophobicContact CG2-CD1 4.18Å; I189-L313 HydrophobicContact CG2-CG 4.46Å; L309-L313 HydrophobicContact CD1-CD1 4.45Å; L309-L313 HydrophobicContact CD1-CD2 4.33Å; L309-L313 HydrophobicContact CD1-CG 4.12Å; L309-L313 HydrophobicContact CG-CD1 4.31Å; L309-L313 HydrophobicContact CG-CG 4.41Å; L309-L313 WeakPolarHBondContact O-CG 3.4Å; L309-L313 PolarHBondContact O-N 3.15Å; K310-L313 PolarHBondContact O-N 2.96Å; E311-L313 PolarHBondContact O-N 3.37Å; L313-I315 PolarHBondContact O-N 3.44Å; L313-H316 PolarHBondContact O-N 3.39Å; L313-T317 PolarHBondContact O-N 2.76Å; L313-T317 VanDerWaalsContact O-N 3.16Å; L313-T317 PolarHBondContact O-OG1 3.24Å
314	K	87.1	Confident	84.4	Confident	20 Å²	20	55.1 Å²	55.1	9%	0.087	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-23.1	171.6	-60.3	-179.7	177.3	-178.4	0	112.7	L193 E196 E311 H312 G318 F319 I332	L193-K314 HydrophobicContact CD1-CG 3.96Å; L193-K314 HydrophobicContact CD2-CD 4.41Å; L193-K314 HydrophobicContact CD2-CG 3.79Å; E196-K314 IonicContact OE2-NZ 3.27Å; E196-K314 PolarHBondContact OE2-NZ 2.91Å; E311-K314 VanDerWaalsContact O-CB 3.28Å; E311-K314 WeakPolarHBondContact O-CB 3.26Å; E311-K314 PolarHBondContact O-N 3.35Å; H312-K314 PolarHBondContact O-N 3.37Å; K314-G318 CarbonylContact O-C 3.34Å; K314-G318 PolarHBondContact O-N 3.49Å; K314-G318 VanDerWaalsContact O-N 3.16Å; K314-F319 HydrophobicContact CD-CD1 4.18Å; K314-F319 HydrophobicContact CG-CD1 4.16Å; K314-F319 PolarHBondContact O-N 3.35Å; K314-I332 HydrophobicContact CB-CD1 4.49Å; K314-I332 HydrophobicContact CB-CG2 3.63Å; K314-I332 HydrophobicContact CD-CG2 3.93Å; K314-I332 HydrophobicContact CG-CG2 4.33Å
315	I	87.1	Confident	84.9	Confident	103 Å²	103	60 Å²	60	53%	0.528	31%	0.306	S	S	.	.	H	α-helix	trans	-70.3	-43.5	173.2	-56.4	172	0	0	0	110.5	H312 L313 G318 I332	H312-I315 WeakPolarHBondContact O-CB 3.45Å; H312-I315 WeakPolarHBondContact O-CG1 3.47Å; H312-I315 PolarHBondContact O-N 3.02Å; L313-I315 PolarHBondContact O-N 3.44Å; I315-G318 PolarHBondContact O-N 2.79Å; I315-I332 HydrophobicContact CB-CD1 4.28Å; I315-I332 HydrophobicContact CG1-CD1 3.52Å
316	H	84.4	Confident	85.2	Confident	50 Å²	50	62.2 Å²	62.2	23%	0.231	32%	0.32	C	S	.	.	H	α-helix	trans	-74.9	-28.2	-177.3	-73.7	-63.4	0	0	0	114	Q186 I298 C299 H312 L313	Q186-H316 PolarHBondContact NE2-O 2.77Å; I298-H316 HydrophobicContact CD1-CB 3.61Å; I298-H316 WeakPolarHBondContact CG2-ND1 3.24Å; C299-H316 PolarHBondContact SG-NE2 3.43Å; H312-H316 AromaticContact CE1-NE2 3.63Å; H312-H316 AromaticContact NE2-CD2 3.65Å; H312-H316 AromaticContact NE2-NE2 3.36Å; H312-H316 PolarHBondContact NE2-NE2 2.79Å; L313-H316 PolarHBondContact O-N 3.39Å
317	T	82.3	Confident	85.7	Confident	27 Å²	27	59.1 Å²	59.1	17%	0.166	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-9.5	173	56.7	0	0	0	0	113.2	I189 L190 L193 L313 F319	I189-T317 HydrophobicContact CB-CG2 3.99Å; I189-T317 HydrophobicContact CG2-CG2 3.5Å; L190-T317 HydrophobicContact CD2-CG2 4.21Å; L190-T317 HydrophobicContact CG-CG2 3.97Å; L193-T317 HydrophobicContact CD1-CG2 4.19Å; L313-T317 PolarHBondContact O-N 2.76Å; L313-T317 VanDerWaalsContact O-N 3.16Å; L313-T317 PolarHBondContact O-OG1 3.24Å; T317-F319 PolarHBondContact O-N 3.09Å; T317-F319 WeakPolarHBondContact OG1-CB 3.25Å; T317-F319 PolarHBondContact OG1-N 3.47Å
318	G	83.6	Confident	86	Confident	45 Å²	45	57 Å²	57	46%	0.464	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	13.3	-171.4	0	0	0	0	0	113.9	K314 I315 K320	K314-G318 CarbonylContact O-C 3.34Å; K314-G318 PolarHBondContact O-N 3.49Å; K314-G318 VanDerWaalsContact O-N 3.16Å; I315-G318 PolarHBondContact O-N 2.79Å; G318-K320 WeakPolarHBondContact O-CG 3.46Å; G318-K320 PolarHBondContact O-N 3.31Å
319	F	84.4	Confident	86.2	Confident	43 Å²	43	58.1 Å²	58.1	19%	0.189	30%	0.298	C	S	.	.			trans	-70.3	110.4	-177	-176.4	-109.3	0	0	0	111.2	L190 L193 K314 T317 P321	L190-F319 HydrophobicContact CD2-CB 4.38Å; L190-F319 HydrophobicContact CD2-CD2 4.48Å; L193-F319 HydrophobicContact CB-CD1 4.46Å; L193-F319 HydrophobicContact CD1-CB 4.44Å; K314-F319 HydrophobicContact CD-CD1 4.18Å; K314-F319 HydrophobicContact CG-CD1 4.16Å; K314-F319 PolarHBondContact O-N 3.35Å; T317-F319 PolarHBondContact O-N 3.09Å; T317-F319 WeakPolarHBondContact OG1-CB 3.25Å; T317-F319 PolarHBondContact OG1-N 3.47Å; F319-P321 HydrophobicContact CD1-CG 4.23Å; F319-P321 HydrophobicContact CE1-CB 3.89Å; F319-P321 HydrophobicContact CE1-CG 3.77Å; F319-P321 HydrophobicContact CZ-CB 3.95Å; F319-P321 HydrophobicContact CZ-CG 4.35Å; F319-P321 WeakPolarHBondContact O-CD 3.41Å
320	K	88	Confident	86.6	Confident	109 Å²	109	59.3 Å²	59.3	47%	0.474	31%	0.308	S	S	.	.			trans	-124.4	82.6	-175.2	-66.5	179.3	-170.3	-176.3	0	110	G318 Y322 S330 F331 I332	G318-K320 WeakPolarHBondContact O-CG 3.46Å; G318-K320 PolarHBondContact O-N 3.31Å; K320-Y322 VanDerWaalsContact C-N 3.27Å; K320-Y322 PolarHBondContact O-N 2.82Å; K320-S330 WeakPolarHBondContact CD-O 3.3Å; K320-S330 WeakPolarHBondContact O-CB 3.2Å; K320-F331 CarbonylContact C-O 3.54Å; K320-F331 VanDerWaalsContact C-O 3.29Å; K320-F331 VanDerWaalsContact CA-O 3.31Å; K320-F331 WeakPolarHBondContact CA-O 3.21Å; K320-I332 HydrophobicContact CG-CG1 3.82Å
321	P	85.5	Confident	86.8	Confident	22 Å²	22	58.7 Å²	58.7	14%	0.143	31%	0.306	C	S	.	.			trans	-69.8	-21.5	-170.7	25.1	-32	0	0	0	113.8	F319	F319-P321 HydrophobicContact CD1-CG 4.23Å; F319-P321 HydrophobicContact CE1-CB 3.89Å; F319-P321 HydrophobicContact CE1-CG 3.77Å; F319-P321 HydrophobicContact CZ-CB 3.95Å; F319-P321 HydrophobicContact CZ-CG 4.35Å; F319-P321 WeakPolarHBondContact O-CD 3.41Å
322	Y	87.8	Confident	86.9	Confident	48 Å²	48	56.9 Å²	56.9	19%	0.188	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	103.9	-176.4	-57.6	-76.5	0	0	0	110.7	H199 K320 S330 F331 I332 A334	H199-Y322 HydrophobicContact CB-CE1 4.37Å; K320-Y322 VanDerWaalsContact C-N 3.27Å; K320-Y322 PolarHBondContact O-N 2.82Å; Y322-S330 CarbonylContact O-C 3.48Å; Y322-S330 VanDerWaalsContact O-CA 3.29Å; Y322-S330 WeakPolarHBondContact O-CA 3.37Å; Y322-F331 PolarHBondContact N-O 2.75Å; Y322-F331 PolarHBondContact O-N 3.36Å; Y322-I332 WeakPolarHBondContact CD2-O 3.5Å; Y322-I332 WeakPolarHBondContact CE2-O 3.37Å; Y322-A334 HydrophobicContact CD1-CB 3.89Å; Y322-A334 HydrophobicContact CE1-CB 3.61Å; Y322-A334 HydrophobicContact CE2-CB 4.32Å; Y322-A334 VanDerWaalsContact CE2-N 3.27Å; Y322-A334 HydrophobicContact CG-CB 4.35Å
323	R	89.1	Confident	86.9	Confident	152 Å²	152	59 Å²	59	57%	0.574	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	136.2	178.8	-173.4	179	176.2	109.9	-3.5	110.8
324	C	90.1	Very high	86.9	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.007	31%	0.312	C	S	.	.			trans	-78.9	122.8	168.3	-176.5	0	0	0	0	109.9	V326 G328 K329 F331 L337 H344	C324-V326 VanDerWaalsContact C-N 3.32Å; C324-V326 PolarHBondContact O-N 2.75Å; C324-G328 WeakPolarHBondContact O-CA 3.37Å; C324-G328 PolarHBondContact O-N 3.22Å; C324-K329 WeakPolarHBondContact CB-O 3.25Å; C324-K329 PolarHBondContact N-O 3.34Å; C324-F331 HydrophobicContact CB-CE2 4.35Å; C324-L337 HydrophobicContact CB-CD1 3.5Å; C324-L337 VanDerWaalsContact CB-CD1 3.5Å; C324-H344 PolarHBondContact SG-NE2 3.06Å
325	D	87.5	Confident	86.8	Confident	125 Å²	125	62 Å²	62	67%	0.668	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-27.7	-178.5	-67.9	-34.8	0	0	0	112.9
326	V	86.1	Confident	86.8	Confident	97 Å²	97	58.3 Å²	58.3	59%	0.588	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-42.7	-178.2	-176.9	0	0	0	0	112.7	C324 H344	C324-V326 VanDerWaalsContact C-N 3.32Å; C324-V326 PolarHBondContact O-N 2.75Å; V326-H344 HydrophobicContact CG1-CB 4.17Å; V326-H344 HydrophobicContact CG2-CB 4.5Å
327	C	88.1	Confident	87	Confident	47 Å²	47	56.4 Å²	56.4	32%	0.318	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	1.1	-173.2	70.5	0	0	0	0	114.5	K329 H340 H344	C327-K329 PolarHBondContact O-N 2.67Å; C327-K329 VanDerWaalsContact O-N 3.1Å; C327-K329 VanDerWaalsContact SG-CG 3.58Å; C327-H340 PolarHBondContact SG-NE2 3.08Å; C327-H344 WeakPolarHBondContact CB-CE1 3.49Å; C327-H344 WeakPolarHBondContact CB-NE2 3.36Å; C327-H344 PolarHBondContact SG-CE1 3.48Å; C327-H344 PolarHBondContact SG-NE2 2.72Å
328	G	86.3	Confident	87.1	Confident	21 Å²	21	61.4 Å²	61.4	22%	0.216	32%	0.324	C	S	.	.			trans	69.3	-0.5	-179	0	0	0	0	0	116	C324 S330	C324-G328 WeakPolarHBondContact O-CA 3.37Å; C324-G328 PolarHBondContact O-N 3.22Å; G328-S330 PolarHBondContact O-N 2.8Å
329	K	88.4	Confident	87.1	Confident	114 Å²	114	63.5 Å²	63.5	50%	0.496	32%	0.32	S	S	.	.			trans	-66.5	129.8	178	-69.8	178.9	179.6	178.3	0	110.3	C324 C327 F331	C324-K329 WeakPolarHBondContact CB-O 3.25Å; C324-K329 PolarHBondContact N-O 3.34Å; C327-K329 PolarHBondContact O-N 2.67Å; C327-K329 VanDerWaalsContact O-N 3.1Å; C327-K329 VanDerWaalsContact SG-CG 3.58Å; K329-F331 HydrophobicContact CB-CE2 3.94Å; K329-F331 HydrophobicContact CB-CZ 4.1Å; K329-F331 WeakPolarHBondContact O-CE2 3.39Å
330	S	90.8	Very high	87.2	Confident	43 Å²	43	61.6 Å²	61.6	30%	0.301	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	151.1	176.4	-57.2	0	0	0	0	113	K320 Y322 G328	K320-S330 WeakPolarHBondContact CD-O 3.3Å; K320-S330 WeakPolarHBondContact O-CB 3.2Å; Y322-S330 CarbonylContact O-C 3.48Å; Y322-S330 VanDerWaalsContact O-CA 3.29Å; Y322-S330 WeakPolarHBondContact O-CA 3.37Å; G328-S330 PolarHBondContact O-N 2.8Å
331	F	88.9	Confident	87	Confident	38 Å²	38	58.9 Å²	58.9	17%	0.167	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.7	-175.9	-60.3	-88.7	0	0	0	110.9	K320 Y322 C324 K329 D336 L337 H340	K320-F331 CarbonylContact C-O 3.54Å; K320-F331 VanDerWaalsContact C-O 3.29Å; K320-F331 VanDerWaalsContact CA-O 3.31Å; K320-F331 WeakPolarHBondContact CA-O 3.21Å; Y322-F331 PolarHBondContact N-O 2.75Å; Y322-F331 PolarHBondContact O-N 3.36Å; C324-F331 HydrophobicContact CB-CE2 4.35Å; K329-F331 HydrophobicContact CB-CE2 3.94Å; K329-F331 HydrophobicContact CB-CZ 4.1Å; K329-F331 WeakPolarHBondContact O-CE2 3.39Å; F331-D336 HydrophobicContact CB-CB 4.47Å; F331-D336 HydrophobicContact CD1-CB 4.17Å; F331-L337 HydrophobicContact CB-CB 4.37Å; F331-L337 HydrophobicContact CD2-CB 3.99Å; F331-L337 HydrophobicContact CD2-CD1 3.93Å; F331-L337 HydrophobicContact CE2-CD1 4.11Å; F331-L337 HydrophobicContact CG-CB 4.32Å; F331-H340 HydrophobicContact CE1-CB 3.93Å; F331-H340 HydrophobicContact CE2-CB 3.92Å; F331-H340 AromaticContact CE2-CD2 3.43Å; F331-H340 VanDerWaalsContact CE2-CD2 3.43Å; F331-H340 WeakPolarHBondContact CE2-CD2 3.31Å; F331-H340 AromaticContact CE2-CG 3.74Å; F331-H340 HydrophobicContact CZ-CB 3.46Å; F331-H340 VanDerWaalsContact CZ-CB 3.46Å; F331-H340 AromaticContact CZ-CD2 3.36Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.4Å; F331-H340 AromaticContact CZ-CG 3.24Å; F331-H340 AromaticContact CZ-ND1 3.93Å
332	I	87.7	Confident	86.9	Confident	36 Å²	36	61.3 Å²	61.3	19%	0.185	31%	0.307	C	S	.	.	S	Bend	trans	-75.2	-28.7	178	-62.7	178.4	0	0	0	111.4	K314 I315 K320 Y322	K314-I332 HydrophobicContact CB-CD1 4.49Å; K314-I332 HydrophobicContact CB-CG2 3.63Å; K314-I332 HydrophobicContact CD-CG2 3.93Å; K314-I332 HydrophobicContact CG-CG2 4.33Å; I315-I332 HydrophobicContact CB-CD1 4.28Å; I315-I332 HydrophobicContact CG1-CD1 3.52Å; K320-I332 HydrophobicContact CG-CG1 3.82Å; Y322-I332 WeakPolarHBondContact CD2-O 3.5Å; Y322-I332 WeakPolarHBondContact CE2-O 3.37Å
333	R	86.3	Confident	86.7	Confident	66 Å²	66	60.1 Å²	60.1	25%	0.249	31%	0.305	C	S	.	.	S	Bend	trans	-130.1	137.7	-172.3	-52.7	-174.2	-64	-163	-11.1	112.3	D165 E311 P335 D336 L337	D165-R333 IonicContact OD2-NH2 3.68Å; E311-R333 WeakPolarHBondContact OE1-CD 3.19Å; E311-R333 VanDerWaalsContact OE1-CG 3.25Å; E311-R333 WeakPolarHBondContact OE1-CG 3.42Å; R333-P335 HydrophobicContact CB-CG 4.07Å; R333-D336 IonicContact CZ-OD2 2.66Å; R333-D336 IonicContact NE-OD1 3.67Å; R333-D336 IonicContact NE-OD2 4Å; R333-D336 PolarHBondContact NE-OD2 3.39Å; R333-D336 IonicContact NH2-OD1 3.27Å; R333-D336 PolarHBondContact NH2-OD1 2.79Å; R333-D336 IonicContact NH2-OD2 3.92Å; R333-D336 PolarHBondContact NH2-OD2 3.16Å; R333-D336 PolarHBondContact O-N 3.47Å; R333-L337 PolarHBondContact O-N 3.26Å
334	A	85.1	Confident	86.3	Confident	39 Å²	39	56.5 Å²	56.5	32%	0.322	29%	0.294	S	S	.	.	H	α-helix	trans	-51	-46.9	172	0	0	0	0	0	114.5	Y322 D336 L337 K338	Y322-A334 HydrophobicContact CD1-CB 3.89Å; Y322-A334 HydrophobicContact CE1-CB 3.61Å; Y322-A334 HydrophobicContact CE2-CB 4.32Å; Y322-A334 VanDerWaalsContact CE2-N 3.27Å; Y322-A334 HydrophobicContact CG-CB 4.35Å; A334-D336 PolarHBondContact O-N 2.89Å; A334-L337 PolarHBondContact O-N 2.95Å; A334-K338 PolarHBondContact O-N 3.11Å
335	P	84.8	Confident	85.6	Confident	77 Å²	77	57 Å²	57	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-63.9	-21.7	177.8	24	-36.5	0	0	0	114.1	R333 K339	R333-P335 HydrophobicContact CB-CG 4.07Å; P335-K339 WeakPolarHBondContact O-CD 3.36Å; P335-K339 WeakPolarHBondContact O-CG 3.39Å; P335-K339 PolarHBondContact O-N 3.26Å; P335-K339 VanDerWaalsContact O-N 3.12Å
336	D	86.7	Confident	85	Confident	24 Å²	24	58.2 Å²	58.2	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-82.2	-37	176.1	-65.4	-25.5	0	0	0	111.5	F331 R333 A334 K339 H340	F331-D336 HydrophobicContact CB-CB 4.47Å; F331-D336 HydrophobicContact CD1-CB 4.17Å; R333-D336 IonicContact CZ-OD2 2.66Å; R333-D336 IonicContact NE-OD1 3.67Å; R333-D336 IonicContact NE-OD2 4Å; R333-D336 PolarHBondContact NE-OD2 3.39Å; R333-D336 IonicContact NH2-OD1 3.27Å; R333-D336 PolarHBondContact NH2-OD1 2.79Å; R333-D336 IonicContact NH2-OD2 3.92Å; R333-D336 PolarHBondContact NH2-OD2 3.16Å; R333-D336 PolarHBondContact O-N 3.47Å; A334-D336 PolarHBondContact O-N 2.89Å; D336-K339 PolarHBondContact O-N 3.05Å; D336-K339 IonicContact OD1-NZ 2.72Å; D336-K339 PolarHBondContact OD1-NZ 3.21Å; D336-H340 WeakPolarHBondContact O-CB 3.46Å; D336-H340 PolarHBondContact O-N 3.42Å
337	L	88.7	Confident	84.5	Confident	10 Å²	10	59.6 Å²	59.6	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-56.8	-50.2	165.8	172.4	59.2	0	0	0	110.7	C324 F331 R333 A334 K339 H340 E341	C324-L337 HydrophobicContact CB-CD1 3.5Å; C324-L337 VanDerWaalsContact CB-CD1 3.5Å; F331-L337 HydrophobicContact CB-CB 4.37Å; F331-L337 HydrophobicContact CD2-CB 3.99Å; F331-L337 HydrophobicContact CD2-CD1 3.93Å; F331-L337 HydrophobicContact CE2-CD1 4.11Å; F331-L337 HydrophobicContact CG-CB 4.32Å; R333-L337 PolarHBondContact O-N 3.26Å; A334-L337 PolarHBondContact O-N 2.95Å; L337-K339 VanDerWaalsContact C-N 3.27Å; L337-K339 PolarHBondContact O-N 3.18Å; L337-H340 CarbonylContact O-C 3.54Å; L337-H340 WeakPolarHBondContact O-CA 3.46Å; L337-H340 WeakPolarHBondContact O-CB 3.37Å; L337-H340 PolarHBondContact O-N 2.89Å; L337-E341 HydrophobicContact CD1-CG 4Å; L337-E341 HydrophobicContact CG-CG 4.41Å; L337-E341 WeakPolarHBondContact O-CG 3.45Å; L337-E341 PolarHBondContact O-N 3.22Å
338	K	84.9	Confident	84.2	Confident	132 Å²	132	64.7 Å²	64.7	57%	0.574	32%	0.317	S	S	*	.	H	α-helix	trans	-65.2	-24.2	179.7	-170.4	165	-173.6	164.2	0	114.6	A334 E341	A334-K338 PolarHBondContact O-N 3.11Å; K338-E341 WeakPolarHBondContact CA-OE2 3.44Å
339	K	83.9	Confident	84.1	Confident	89 Å²	89	67.2 Å²	67.2	39%	0.387	33%	0.33	S	S	.	.	H	α-helix	trans	-74.6	-42	167.4	-72.6	164.8	-158.6	162.1	0	110.9	P335 D336 L337 R342	P335-K339 WeakPolarHBondContact O-CD 3.36Å; P335-K339 WeakPolarHBondContact O-CG 3.39Å; P335-K339 PolarHBondContact O-N 3.26Å; P335-K339 VanDerWaalsContact O-N 3.12Å; D336-K339 PolarHBondContact O-N 3.05Å; D336-K339 IonicContact OD1-NZ 2.72Å; D336-K339 PolarHBondContact OD1-NZ 3.21Å; L337-K339 VanDerWaalsContact C-N 3.27Å; L337-K339 PolarHBondContact O-N 3.18Å; K339-R342 WeakPolarHBondContact O-CB 3.39Å; K339-R342 PolarHBondContact O-N 2.79Å
340	H	86.7	Confident	84	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.019	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-36.3	-179.6	176.4	58.6	0	0	0	113	C327 F331 D336 L337 R342 V343 H344	C327-H340 PolarHBondContact SG-NE2 3.08Å; F331-H340 HydrophobicContact CE1-CB 3.93Å; F331-H340 HydrophobicContact CE2-CB 3.92Å; F331-H340 AromaticContact CE2-CD2 3.43Å; F331-H340 VanDerWaalsContact CE2-CD2 3.43Å; F331-H340 WeakPolarHBondContact CE2-CD2 3.31Å; F331-H340 AromaticContact CE2-CG 3.74Å; F331-H340 HydrophobicContact CZ-CB 3.46Å; F331-H340 VanDerWaalsContact CZ-CB 3.46Å; F331-H340 AromaticContact CZ-CD2 3.36Å; F331-H340 WeakPolarHBondContact CZ-CD2 3.4Å; F331-H340 AromaticContact CZ-CG 3.24Å; F331-H340 AromaticContact CZ-ND1 3.93Å; D336-H340 WeakPolarHBondContact O-CB 3.46Å; D336-H340 PolarHBondContact O-N 3.42Å; L337-H340 CarbonylContact O-C 3.54Å; L337-H340 WeakPolarHBondContact O-CA 3.46Å; L337-H340 WeakPolarHBondContact O-CB 3.37Å; L337-H340 PolarHBondContact O-N 2.89Å; H340-R342 PolarHBondContact O-N 3.02Å; H340-R342 VanDerWaalsContact O-N 3.12Å; H340-V343 WeakPolarHBondContact O-CA 3.44Å; H340-V343 WeakPolarHBondContact O-CB 3.39Å; H340-V343 WeakPolarHBondContact O-CG2 3.4Å; H340-V343 PolarHBondContact O-N 2.82Å; H340-H344 AromaticContact CD2-NE2 3.13Å; H340-H344 PolarHBondContact CD2-NE2 3.02Å; H340-H344 AromaticContact CE1-NE2 3.24Å; H340-H344 PolarHBondContact CE1-NE2 3.44Å; H340-H344 AromaticContact NE2-NE2 2.39Å; H340-H344 PolarHBondContact NE2-NE2 2.67Å
341	E	84.5	Confident	83.8	Confident	52 Å²	52	64.8 Å²	64.8	24%	0.243	32%	0.323	C	S	.	.	H	α-helix	trans	-57.7	-28.2	176.8	-73.8	164.1	164	0	0	112.7	L337 K338 V343 H344 S345	L337-E341 HydrophobicContact CD1-CG 4Å; L337-E341 HydrophobicContact CG-CG 4.41Å; L337-E341 WeakPolarHBondContact O-CG 3.45Å; L337-E341 PolarHBondContact O-N 3.22Å; K338-E341 WeakPolarHBondContact CA-OE2 3.44Å; E341-V343 PolarHBondContact O-N 3.09Å; E341-H344 PolarHBondContact O-N 3.46Å; E341-S345 PolarHBondContact O-N 3.04Å; E341-S345 VanDerWaalsContact O-N 3.1Å
342	R	83.1	Confident	83.9	Confident	73 Å²	73	63.4 Å²	63.4	28%	0.275	32%	0.319	S	S	.	.	H	α-helix	trans	-66.6	-14.6	172.4	-53.1	179.5	-172.3	-160.5	-5.6	113.8	K339 H340 S345 K360	K339-R342 WeakPolarHBondContact O-CB 3.39Å; K339-R342 PolarHBondContact O-N 2.79Å; H340-R342 PolarHBondContact O-N 3.02Å; H340-R342 VanDerWaalsContact O-N 3.12Å; R342-S345 WeakPolarHBondContact CA-OG 3.45Å; R342-K360 VanDerWaalsContact O-CD 3.23Å; R342-K360 WeakPolarHBondContact O-CD 3.25Å; R342-K360 VanDerWaalsContact O-CE 3.23Å; R342-K360 WeakPolarHBondContact O-CE 3.33Å; R342-K360 PolarHBondContact O-NZ 2.83Å
343	V	82.2	Confident	84	Confident	22 Å²	22	69.8 Å²	69.8	13%	0.133	35%	0.348	C	S	.	.	H	α-helix	trans	-67	-42.3	168.5	173.9	0	0	0	0	109.6	D159 H340 E341 K360	D159-V343 HydrophobicContact CB-CG1 3.55Å; D159-V343 HydrophobicContact CB-CG2 4.23Å; H340-V343 WeakPolarHBondContact O-CA 3.44Å; H340-V343 WeakPolarHBondContact O-CB 3.39Å; H340-V343 WeakPolarHBondContact O-CG2 3.4Å; H340-V343 PolarHBondContact O-N 2.82Å; E341-V343 PolarHBondContact O-N 3.09Å; V343-K360 PolarHBondContact O-NZ 3.08Å
344	H	81.8	Confident	84	Confident	76 Å²	76	73.1 Å²	73.1	35%	0.352	37%	0.368	S	S	.	.	H	α-helix	trans	-76.2	-31.3	178.9	-55.5	-53.5	0	0	0	112.6	C324 V326 C327 H340 E341	C324-H344 PolarHBondContact SG-NE2 3.06Å; V326-H344 HydrophobicContact CG1-CB 4.17Å; V326-H344 HydrophobicContact CG2-CB 4.5Å; C327-H344 WeakPolarHBondContact CB-CE1 3.49Å; C327-H344 WeakPolarHBondContact CB-NE2 3.36Å; C327-H344 PolarHBondContact SG-CE1 3.48Å; C327-H344 PolarHBondContact SG-NE2 2.72Å; H340-H344 AromaticContact CD2-NE2 3.13Å; H340-H344 PolarHBondContact CD2-NE2 3.02Å; H340-H344 AromaticContact CE1-NE2 3.24Å; H340-H344 PolarHBondContact CE1-NE2 3.44Å; H340-H344 AromaticContact NE2-NE2 2.39Å; H340-H344 PolarHBondContact NE2-NE2 2.67Å; E341-H344 PolarHBondContact O-N 3.46Å
345	S	75.3	Confident	84.3	Confident	13 Å²	13	72.9 Å²	72.9	9%	0.091	36%	0.363	C	S	.	.	S	Bend	trans	-75.4	148.7	169.5	85.6	0	0	0	0	111.9	E341 R342 E347 K360	E341-S345 PolarHBondContact O-N 3.04Å; E341-S345 VanDerWaalsContact O-N 3.1Å; R342-S345 WeakPolarHBondContact CA-OG 3.45Å; S345-E347 PolarHBondContact O-N 2.85Å; S345-E347 WeakPolarHBondContact OG-CB 3.46Å; S345-E347 PolarHBondContact OG-N 2.99Å; S345-K360 WeakPolarHBondContact O-CE 3.44Å; S345-K360 PolarHBondContact O-NZ 3.5Å
346	N	74.5	Confident	84.4	Confident	149 Å²	149	77.4 Å²	77.4	80%	0.797	38%	0.383	S	S	*	.			trans	-84.1	7.6	168.3	-80.4	-40.1	0	0	0	112.7	R348	N346-R348 PolarHBondContact O-N 2.93Å
347	E	76.8	Confident	84.4	Confident	127 Å²	127	82 Å²	82	59%	0.593	40%	0.402	S	S	*	.			trans	-68.3	127.2	-177.3	-62.5	-179.2	171.5	0	0	111.9	S345 P349	S345-E347 PolarHBondContact O-N 2.85Å; S345-E347 WeakPolarHBondContact OG-CB 3.46Å; S345-E347 PolarHBondContact OG-N 2.99Å; E347-P349 VanDerWaalsContact C-CD 3.44Å; E347-P349 WeakPolarHBondContact O-CD 3.34Å
348	R	81.3	Confident	84.4	Confident	153 Å²	153	82.8 Å²	82.8	58%	0.577	41%	0.41	S	S	*	.			trans	-122.7	70.4	176.9	-67.6	170.7	177.7	-135.4	10.6	109.3	N346 F350 A358 F359 K360	N346-R348 PolarHBondContact O-N 2.93Å; R348-F350 PolarHBondContact O-N 3.31Å; R348-A358 HydrophobicContact CB-CB 3.63Å; R348-A358 WeakPolarHBondContact CD-O 3.41Å; R348-A358 PolarHBondContact NH1-O 3.21Å; R348-F359 CarbonylContact C-O 3.48Å; R348-F359 WeakPolarHBondContact CA-O 3.26Å; R348-K360 HydrophobicContact CG-CG 4.2Å
349	P	83.1	Confident	84.5	Confident	75 Å²	75	78.5 Å²	78.5	49%	0.487	39%	0.391	S	S	.	.			trans	-68.7	-7.2	-170.5	28	-36.1	0	0	0	114.3	E347	E347-P349 VanDerWaalsContact C-CD 3.44Å; E347-P349 WeakPolarHBondContact O-CD 3.34Å
350	F	86.2	Confident	84.4	Confident	54 Å²	54	75.7 Å²	75.7	24%	0.237	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	85	-179	-54.3	-67.8	0	0	0	110.6	R348 A358 F359 K360 H361 K362 L365	R348-F350 PolarHBondContact O-N 3.31Å; F350-A358 WeakPolarHBondContact O-CA 3.36Å; F350-F359 HydrophobicContact CB-CB 4.46Å; F350-F359 PolarHBondContact N-O 3.43Å; F350-F359 PolarHBondContact O-N 2.74Å; F350-K360 WeakPolarHBondContact CE2-O 3.4Å; F350-H361 VanDerWaalsContact CD2-C 3.42Å; F350-K362 HydrophobicContact CD1-CB 4.14Å; F350-K362 HydrophobicContact CD1-CG 4.5Å; F350-K362 HydrophobicContact CD2-CB 4.44Å; F350-K362 HydrophobicContact CE1-CB 4Å; F350-K362 HydrophobicContact CE2-CB 4.29Å; F350-K362 HydrophobicContact CG-CB 4.36Å; F350-K362 HydrophobicContact CZ-CB 4.07Å; F350-L365 HydrophobicContact CB-CB 4.13Å; F350-L365 HydrophobicContact CB-CD2 3.85Å
351	A	88.3	Confident	84.3	Confident	51 Å²	51	76.8 Å²	76.8	42%	0.421	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	142.4	173.6	0	0	0	0	0	112.1	A358	A351-A358 HydrophobicContact CB-CB 4.26Å
352	C	90.9	Very high	84.3	Confident	10 Å²	10	81.6 Å²	81.6	7%	0.068	40%	0.404	C	S	.	.			trans	-77.2	139.1	168.8	-172.2	0	0	0	0	110.5	M354 C355 K357 L365 H372	C352-M354 VanDerWaalsContact C-N 3.31Å; C352-M354 PolarHBondContact SG-N 3.34Å; C352-M354 VanDerWaalsContact SG-N 3.44Å; C352-C355 WeakPolarHBondContact CB-O 3.33Å; C352-K357 WeakPolarHBondContact CB-O 3.4Å; C352-K357 PolarHBondContact N-O 3.29Å; C352-L365 HydrophobicContact CB-CD1 3.73Å; C352-H372 PolarHBondContact SG-NE2 3.06Å
353	Q	89	Confident	84.4	Confident	170 Å²	170	80.3 Å²	80.3	79%	0.794	41%	0.406	S	S	*	.	S	Bend	trans	-81.7	-11	176.6	-59.8	-61.7	-44.8	0	0	113
354	M	86.4	Confident	84.7	Confident	136 Å²	136	82.9 Å²	82.9	67%	0.67	42%	0.417	S	S	*	.	S	Bend	trans	-103.7	-9	-176.8	-56.6	-59.4	-63.2	0	0	113.7	C352 H372	C352-M354 VanDerWaalsContact C-N 3.31Å; C352-M354 PolarHBondContact SG-N 3.34Å; C352-M354 VanDerWaalsContact SG-N 3.44Å; M354-H372 PolarHBondContact O-CE1 3.22Å; M354-H372 VanDerWaalsContact O-CE1 3.31Å
355	C	90.3	Very high	85.1	Confident	33 Å²	33	80.2 Å²	80.2	22%	0.223	41%	0.405	C	S	.	.	S	Bend	trans	-168.1	163.1	174	67.5	0	0	0	0	110.6	C352 K357 H368 H372	C352-C355 WeakPolarHBondContact CB-O 3.33Å; C355-K357 PolarHBondContact O-N 2.88Å; C355-H368 PolarHBondContact SG-NE2 3.45Å; C355-H372 WeakPolarHBondContact CB-CE1 3.32Å; C355-H372 PolarHBondContact SG-CE1 2.85Å; C355-H372 PolarHBondContact SG-NE2 3.23Å
356	D	87.6	Confident	85.7	Confident	173 Å²	173	85.2 Å²	85.2	93%	0.925	43%	0.425	S	S	*	.	S	Bend	trans	-69.5	16.7	-173.3	-45.5	-62.4	0	0	0	115.7
357	K	87.1	Confident	86.2	Confident	121 Å²	121	79.9 Å²	79.9	53%	0.526	40%	0.396	S	S	.	.			trans	-86.9	121.2	-179.8	-63.7	-159.7	177.7	-160.5	0	111.3	C352 C355 F359	C352-K357 WeakPolarHBondContact CB-O 3.4Å; C352-K357 PolarHBondContact N-O 3.29Å; C355-K357 PolarHBondContact O-N 2.88Å; K357-F359 HydrophobicContact CB-CE2 4Å; K357-F359 HydrophobicContact CB-CZ 4.01Å; K357-F359 WeakPolarHBondContact O-CE2 3.42Å
358	A	88.6	Confident	86.8	Confident	25 Å²	25	74.7 Å²	74.7	21%	0.207	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	148.4	174.7	0	0	0	0	0	112.8	R348 F350 A351	R348-A358 HydrophobicContact CB-CB 3.63Å; R348-A358 WeakPolarHBondContact CD-O 3.41Å; R348-A358 PolarHBondContact NH1-O 3.21Å; F350-A358 WeakPolarHBondContact O-CA 3.36Å; A351-A358 HydrophobicContact CB-CB 4.26Å
359	F	86.2	Confident	87.1	Confident	43 Å²	43	69.8 Å²	69.8	19%	0.189	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150	-170.6	-58.6	-87.8	0	0	0	112.3	R348 F350 K357 H361 H364 L365 H368	R348-F359 CarbonylContact C-O 3.48Å; R348-F359 WeakPolarHBondContact CA-O 3.26Å; F350-F359 HydrophobicContact CB-CB 4.46Å; F350-F359 PolarHBondContact N-O 3.43Å; F350-F359 PolarHBondContact O-N 2.74Å; K357-F359 HydrophobicContact CB-CE2 4Å; K357-F359 HydrophobicContact CB-CZ 4.01Å; K357-F359 WeakPolarHBondContact O-CE2 3.42Å; F359-H361 VanDerWaalsContact C-N 3.34Å; F359-H364 HydrophobicContact CB-CB 4.27Å; F359-H364 HydrophobicContact CD1-CB 3.92Å; F359-H364 HydrophobicContact CG-CB 4.31Å; F359-L365 HydrophobicContact CB-CB 4.43Å; F359-L365 HydrophobicContact CD2-CB 3.95Å; F359-L365 HydrophobicContact CD2-CD1 3.96Å; F359-L365 HydrophobicContact CE2-CD1 4.14Å; F359-L365 HydrophobicContact CG-CB 4.39Å; F359-H368 HydrophobicContact CE1-CB 4.16Å; F359-H368 HydrophobicContact CE2-CB 3.87Å; F359-H368 AromaticContact CE2-CD2 3.62Å; F359-H368 AromaticContact CE2-CG 3.63Å; F359-H368 HydrophobicContact CZ-CB 3.52Å; F359-H368 AromaticContact CZ-CD2 3.78Å; F359-H368 AromaticContact CZ-CG 3.33Å; F359-H368 AromaticContact CZ-ND1 3.56Å
360	K	82.6	Confident	87.3	Confident	29 Å²	29	68 Å²	68	13%	0.126	34%	0.339	C	S	.	.	S	Bend	trans	-73.8	-22.8	175.2	-62.5	-174.3	164	-161.7	0	113.3	R342 V343 S345 R348 F350	R342-K360 VanDerWaalsContact O-CD 3.23Å; R342-K360 WeakPolarHBondContact O-CD 3.25Å; R342-K360 VanDerWaalsContact O-CE 3.23Å; R342-K360 WeakPolarHBondContact O-CE 3.33Å; R342-K360 PolarHBondContact O-NZ 2.83Å; V343-K360 PolarHBondContact O-NZ 3.08Å; S345-K360 WeakPolarHBondContact O-CE 3.44Å; S345-K360 PolarHBondContact O-NZ 3.5Å; R348-K360 HydrophobicContact CG-CG 4.2Å; F350-K360 WeakPolarHBondContact CE2-O 3.4Å
361	H	84	Confident	87.2	Confident	28 Å²	28	72.8 Å²	72.8	13%	0.13	36%	0.356	C	S	.	.	S	Bend	trans	-133.8	141.8	-175.2	-58.5	-31.9	0	0	0	112.8	F350 F359 S363 H364 L365	F350-H361 VanDerWaalsContact CD2-C 3.42Å; F359-H361 VanDerWaalsContact C-N 3.34Å; H361-S363 VanDerWaalsContact C-N 3.34Å; H361-S363 PolarHBondContact O-N 2.84Å; H361-H364 AromaticContact CD2-CE1 3.84Å; H361-H364 PolarHBondContact O-N 2.78Å; H361-L365 PolarHBondContact O-N 2.95Å
362	K	86.1	Confident	87	Confident	153 Å²	153	74.2 Å²	74.2	67%	0.665	35%	0.353	S	S	*	.	H	α-helix	trans	-67	-30.3	-178.9	-172.3	173.4	-178.5	174	0	113.4	F350 L365 K366	F350-K362 HydrophobicContact CD1-CB 4.14Å; F350-K362 HydrophobicContact CD1-CG 4.5Å; F350-K362 HydrophobicContact CD2-CB 4.44Å; F350-K362 HydrophobicContact CE1-CB 4Å; F350-K362 HydrophobicContact CE2-CB 4.29Å; F350-K362 HydrophobicContact CG-CB 4.36Å; F350-K362 HydrophobicContact CZ-CB 4.07Å; K362-L365 PolarHBondContact O-N 2.93Å; K362-K366 PolarHBondContact O-N 3.14Å
363	S	85	Confident	86.8	Confident	46 Å²	46	79.9 Å²	79.9	32%	0.322	37%	0.373	S	S	.	.	H	α-helix	trans	-60.1	-48.1	172.1	45.6	0	0	0	0	111.2	H361 L365 K366 D367	H361-S363 VanDerWaalsContact C-N 3.34Å; H361-S363 PolarHBondContact O-N 2.84Å; S363-L365 PolarHBondContact O-N 2.73Å; S363-K366 PolarHBondContact O-N 3.32Å; S363-K366 VanDerWaalsContact O-N 3.14Å; S363-D367 PolarHBondContact O-N 3.41Å
364	H	87.3	Confident	86.5	Confident	76 Å²	76	74.3 Å²	74.3	35%	0.352	36%	0.362	S	S	.	.	H	α-helix	trans	-64.3	-38.5	179.8	-62	-176.6	0	0	0	112.1	F359 H361 H368	F359-H364 HydrophobicContact CB-CB 4.27Å; F359-H364 HydrophobicContact CD1-CB 3.92Å; F359-H364 HydrophobicContact CG-CB 4.31Å; H361-H364 AromaticContact CD2-CE1 3.84Å; H361-H364 PolarHBondContact O-N 2.78Å; H364-H368 VanDerWaalsContact O-CB 3.25Å; H364-H368 WeakPolarHBondContact O-CB 3.49Å; H364-H368 PolarHBondContact O-N 2.74Å
365	L	90.1	Very high	86.5	Confident	19 Å²	19	71.5 Å²	71.5	10%	0.099	35%	0.347	C	S	.	.	H	α-helix	trans	-60.7	-49.2	170.8	172.2	60.6	0	0	0	111.2	F350 C352 F359 H361 K362 S363 D367 H368 E369	F350-L365 HydrophobicContact CB-CB 4.13Å; F350-L365 HydrophobicContact CB-CD2 3.85Å; C352-L365 HydrophobicContact CB-CD1 3.73Å; F359-L365 HydrophobicContact CB-CB 4.43Å; F359-L365 HydrophobicContact CD2-CB 3.95Å; F359-L365 HydrophobicContact CD2-CD1 3.96Å; F359-L365 HydrophobicContact CE2-CD1 4.14Å; F359-L365 HydrophobicContact CG-CB 4.39Å; H361-L365 PolarHBondContact O-N 2.95Å; K362-L365 PolarHBondContact O-N 2.93Å; S363-L365 PolarHBondContact O-N 2.73Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 2.96Å; L365-H368 WeakPolarHBondContact O-CB 3.45Å; L365-H368 PolarHBondContact O-N 3.11Å; L365-H368 VanDerWaalsContact O-N 3.12Å; L365-E369 HydrophobicContact CD1-CG 4.04Å; L365-E369 HydrophobicContact CG-CG 4.45Å; L365-E369 WeakPolarHBondContact O-CG 3.46Å; L365-E369 PolarHBondContact O-N 2.93Å
366	K	87.6	Confident	86.3	Confident	119 Å²	119	76 Å²	76	52%	0.517	36%	0.363	S	S	.	.	H	α-helix	trans	-60.4	-42.6	-179.4	-172.3	178.1	-178.2	-179.6	0	112.4	K362 S363 H368 E369 R370	K362-K366 PolarHBondContact O-N 3.14Å; S363-K366 PolarHBondContact O-N 3.32Å; S363-K366 VanDerWaalsContact O-N 3.14Å; K366-H368 VanDerWaalsContact C-N 3.35Å; K366-E369 PolarHBondContact O-N 3.42Å; K366-R370 WeakPolarHBondContact O-CG 3.45Å; K366-R370 PolarHBondContact O-N 3.39Å; K366-R370 VanDerWaalsContact O-N 3.15Å
367	D	86.3	Confident	86.2	Confident	36 Å²	36	71.4 Å²	71.4	19%	0.193	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-37.7	174.9	-79.5	-0.2	0	0	0	112.3	S363 L365 R370 K389	S363-D367 PolarHBondContact O-N 3.41Å; L365-D367 VanDerWaalsContact C-N 3.35Å; L365-D367 PolarHBondContact O-N 2.96Å; D367-R370 PolarHBondContact O-N 3.14Å; D367-R370 IonicContact OD1-CZ 2.79Å; D367-R370 IonicContact OD1-NH1 3.83Å; D367-R370 PolarHBondContact OD1-NH1 3.05Å; D367-R370 IonicContact OD1-NH2 3.87Å; D367-K389 HydrophobicContact CB-CG 4.43Å
368	H	88.5	Confident	86.3	Confident	19 Å²	19	68.5 Å²	68.5	9%	0.088	33%	0.33	C	S	.	.	H	α-helix	trans	-66.2	-40.5	174.5	168.9	82.9	0	0	0	112	C355 F359 H364 L365 K366 R370 R371 H372	C355-H368 PolarHBondContact SG-NE2 3.45Å; F359-H368 HydrophobicContact CE1-CB 4.16Å; F359-H368 HydrophobicContact CE2-CB 3.87Å; F359-H368 AromaticContact CE2-CD2 3.62Å; F359-H368 AromaticContact CE2-CG 3.63Å; F359-H368 HydrophobicContact CZ-CB 3.52Å; F359-H368 AromaticContact CZ-CD2 3.78Å; F359-H368 AromaticContact CZ-CG 3.33Å; F359-H368 AromaticContact CZ-ND1 3.56Å; H364-H368 VanDerWaalsContact O-CB 3.25Å; H364-H368 WeakPolarHBondContact O-CB 3.49Å; H364-H368 PolarHBondContact O-N 2.74Å; L365-H368 WeakPolarHBondContact O-CB 3.45Å; L365-H368 PolarHBondContact O-N 3.11Å; L365-H368 VanDerWaalsContact O-N 3.12Å; K366-H368 VanDerWaalsContact C-N 3.35Å; H368-R370 VanDerWaalsContact C-N 3.33Å; H368-R370 PolarHBondContact O-N 3.17Å; H368-R371 PolarHBondContact CE1-NH2 3.45Å; H368-R371 VanDerWaalsContact O-CB 3.24Å; H368-R371 WeakPolarHBondContact O-CB 3.46Å; H368-R371 PolarHBondContact O-N 3.38Å; H368-R371 VanDerWaalsContact O-N 3.14Å; H368-H372 AromaticContact CD2-CD2 3.96Å; H368-H372 AromaticContact CD2-NE2 3.29Å; H368-H372 PolarHBondContact CD2-NE2 2.96Å; H368-H372 VanDerWaalsContact CD2-NE2 3.29Å; H368-H372 AromaticContact CE1-NE2 2.97Å; H368-H372 PolarHBondContact CE1-NE2 3.4Å; H368-H372 AromaticContact NE2-CD2 3.59Å; H368-H372 AromaticContact NE2-NE2 2.28Å; H368-H372 PolarHBondContact NE2-NE2 3.48Å
369	E	87.4	Confident	86.3	Confident	49 Å²	49	71.2 Å²	71.2	23%	0.229	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-34.6	175.7	-74.2	177.7	-174.7	0	0	113.2	L365 K366 R371 H372 R373	L365-E369 HydrophobicContact CD1-CG 4.04Å; L365-E369 HydrophobicContact CG-CG 4.45Å; L365-E369 WeakPolarHBondContact O-CG 3.46Å; L365-E369 PolarHBondContact O-N 2.93Å; K366-E369 PolarHBondContact O-N 3.42Å; E369-R371 PolarHBondContact O-N 3.21Å; E369-H372 WeakPolarHBondContact O-CB 3.4Å; E369-H372 PolarHBondContact O-N 3.34Å; E369-R373 PolarHBondContact O-N 3.42Å; E369-R373 VanDerWaalsContact O-N 3.12Å; E369-R373 IonicContact OE2-NH1 2.67Å; E369-R373 PolarHBondContact OE2-NH1 2.97Å
370	R	87.9	Confident	86.5	Confident	37 Å²	37	69.4 Å²	69.4	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-54.3	-35.7	172.8	-68.3	-165	-171.1	114.7	10.6	111.9	K366 D367 H368 H372 R373 G374 E375 A388	K366-R370 WeakPolarHBondContact O-CG 3.45Å; K366-R370 PolarHBondContact O-N 3.39Å; K366-R370 VanDerWaalsContact O-N 3.15Å; D367-R370 PolarHBondContact O-N 3.14Å; D367-R370 IonicContact OD1-CZ 2.79Å; D367-R370 IonicContact OD1-NH1 3.83Å; D367-R370 PolarHBondContact OD1-NH1 3.05Å; D367-R370 IonicContact OD1-NH2 3.87Å; H368-R370 VanDerWaalsContact C-N 3.33Å; H368-R370 PolarHBondContact O-N 3.17Å; R370-H372 VanDerWaalsContact C-N 3.34Å; R370-H372 PolarHBondContact O-N 2.78Å; R370-R373 CarbonylContact O-C 3.29Å; R370-R373 PolarHBondContact O-N 3.43Å; R370-G374 CarbonylContact O-C 3.52Å; R370-G374 PolarHBondContact O-N 3.28Å; R370-E375 HydrophobicContact CB-CB 3.98Å; R370-E375 HydrophobicContact CG-CB 4.16Å; R370-E375 PolarHBondContact O-N 3.32Å; R370-A388 WeakPolarHBondContact CD-O 3.49Å; R370-A388 PolarHBondContact NH1-O 3.19Å
371	R	83.3	Confident	86.7	Confident	155 Å²	155	73.4 Å²	73.4	59%	0.585	37%	0.366	S	S	*	.	H	α-helix	trans	-65.9	-34.4	177.5	-168.8	-177.5	63.9	136.2	14.6	112.6	H368 E369	H368-R371 PolarHBondContact CE1-NH2 3.45Å; H368-R371 VanDerWaalsContact O-CB 3.24Å; H368-R371 WeakPolarHBondContact O-CB 3.46Å; H368-R371 PolarHBondContact O-N 3.38Å; H368-R371 VanDerWaalsContact O-N 3.14Å; E369-R371 PolarHBondContact O-N 3.21Å
372	H	85.1	Confident	86.8	Confident	81 Å²	81	75.8 Å²	75.8	38%	0.375	39%	0.385	S	S	.	.	H	α-helix	trans	-70.7	-37.1	173.8	-72.6	-79.6	0	0	0	112	C352 M354 C355 H368 E369 R370 G374	C352-H372 PolarHBondContact SG-NE2 3.06Å; M354-H372 PolarHBondContact O-CE1 3.22Å; M354-H372 VanDerWaalsContact O-CE1 3.31Å; C355-H372 WeakPolarHBondContact CB-CE1 3.32Å; C355-H372 PolarHBondContact SG-CE1 2.85Å; C355-H372 PolarHBondContact SG-NE2 3.23Å; H368-H372 AromaticContact CD2-CD2 3.96Å; H368-H372 AromaticContact CD2-NE2 3.29Å; H368-H372 PolarHBondContact CD2-NE2 2.96Å; H368-H372 VanDerWaalsContact CD2-NE2 3.29Å; H368-H372 AromaticContact CE1-NE2 2.97Å; H368-H372 PolarHBondContact CE1-NE2 3.4Å; H368-H372 AromaticContact NE2-CD2 3.59Å; H368-H372 AromaticContact NE2-NE2 2.28Å; H368-H372 PolarHBondContact NE2-NE2 3.48Å; E369-H372 WeakPolarHBondContact O-CB 3.4Å; E369-H372 PolarHBondContact O-N 3.34Å; R370-H372 VanDerWaalsContact C-N 3.34Å; R370-H372 PolarHBondContact O-N 2.78Å; H372-G374 VanDerWaalsContact C-N 3.34Å
373	R	85.9	Confident	86.8	Confident	129 Å²	129	70.2 Å²	70.2	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-84.9	-2.6	177.9	-61.1	-168.8	-60.9	-89.1	-11.8	114.3	E369 R370 E375	E369-R373 PolarHBondContact O-N 3.42Å; E369-R373 VanDerWaalsContact O-N 3.12Å; E369-R373 IonicContact OE2-NH1 2.67Å; E369-R373 PolarHBondContact OE2-NH1 2.97Å; R370-R373 CarbonylContact O-C 3.29Å; R370-R373 PolarHBondContact O-N 3.43Å; R373-E375 HydrophobicContact CB-CG 3.89Å; R373-E375 IonicContact CZ-OE1 2.75Å; R373-E375 IonicContact CZ-OE2 3.36Å; R373-E375 VanDerWaalsContact NE-CD 3.26Å; R373-E375 IonicContact NE-OE1 3.47Å; R373-E375 PolarHBondContact NE-OE1 3.35Å; R373-E375 IonicContact NE-OE2 3.56Å; R373-E375 PolarHBondContact NE-OE2 2.84Å; R373-E375 IonicContact NH2-OE1 4Å; R373-E375 IonicContact NH2-OE2 3.59Å; R373-E375 PolarHBondContact NH2-OE2 3.12Å; R373-E375 PolarHBondContact O-N 3.44Å
374	G	82.3	Confident	86.8	Confident	54 Å²	54	74.8 Å²	74.8	56%	0.557	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	11.1	-174.2	0	0	0	0	0	114.7	R370 H372 K376	R370-G374 CarbonylContact O-C 3.52Å; R370-G374 PolarHBondContact O-N 3.28Å; H372-G374 VanDerWaalsContact C-N 3.34Å; G374-K376 PolarHBondContact O-N 3.47Å
375	E	87.7	Confident	86.8	Confident	76 Å²	76	77 Å²	77	36%	0.355	40%	0.4	S	S	.	.			trans	-66.1	121.9	-175	-74.5	169.8	-176.7	0	0	111.1	R370 R373	R370-E375 HydrophobicContact CB-CB 3.98Å; R370-E375 HydrophobicContact CG-CB 4.16Å; R370-E375 PolarHBondContact O-N 3.32Å; R373-E375 HydrophobicContact CB-CG 3.89Å; R373-E375 IonicContact CZ-OE1 2.75Å; R373-E375 IonicContact CZ-OE2 3.36Å; R373-E375 VanDerWaalsContact NE-CD 3.26Å; R373-E375 IonicContact NE-OE1 3.47Å; R373-E375 PolarHBondContact NE-OE1 3.35Å; R373-E375 IonicContact NE-OE2 3.56Å; R373-E375 PolarHBondContact NE-OE2 2.84Å; R373-E375 IonicContact NH2-OE1 4Å; R373-E375 IonicContact NH2-OE2 3.59Å; R373-E375 PolarHBondContact NH2-OE2 3.12Å; R373-E375 PolarHBondContact O-N 3.44Å
376	K	85.7	Confident	86.7	Confident	127 Å²	127	77.7 Å²	77.7	55%	0.552	41%	0.409	S	S	*	.			trans	-125.7	75.3	176.4	-68.5	173	170.3	-167.9	0	111	G374 F378 A386 F387	G374-K376 PolarHBondContact O-N 3.47Å; K376-F378 PolarHBondContact O-N 3.31Å; K376-A386 HydrophobicContact CB-CB 3.71Å; K376-A386 HydrophobicContact CD-CB 4.22Å; K376-A386 WeakPolarHBondContact CD-O 3.38Å; K376-F387 CarbonylContact C-O 3.29Å; K376-F387 VanDerWaalsContact C-O 3.29Å; K376-F387 VanDerWaalsContact CA-O 3.25Å; K376-F387 WeakPolarHBondContact CA-O 3.12Å
377	P	86.6	Confident	86.6	Confident	78 Å²	78	74.1 Å²	74.1	51%	0.506	39%	0.393	S	S	.	.			trans	-70.5	-18	-173.2	-17.9	32.9	0	0	0	114.1
378	F	88.1	Confident	86.6	Confident	59 Å²	59	73.7 Å²	73.7	26%	0.259	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	95.7	-171.5	-55.4	-77.6	0	0	0	109.6	K376 A386 F387 A390 L393	K376-F378 PolarHBondContact O-N 3.31Å; F378-A386 CarbonylContact O-C 3.48Å; F378-A386 WeakPolarHBondContact O-CA 3.2Å; F378-F387 HydrophobicContact CB-CB 4.35Å; F378-F387 PolarHBondContact N-O 3.2Å; F378-F387 PolarHBondContact O-N 3.33Å; F378-A390 HydrophobicContact CD1-CB 3.98Å; F378-A390 HydrophobicContact CE1-CB 3.78Å; F378-A390 HydrophobicContact CG-CB 4.45Å; F378-A390 HydrophobicContact CZ-CB 4.06Å; F378-L393 HydrophobicContact CB-CB 4.15Å; F378-L393 HydrophobicContact CB-CD2 3.91Å
379	V	89.2	Confident	86.5	Confident	82 Å²	82	76.7 Å²	76.7	50%	0.497	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.1	175.9	-170.2	0	0	0	0	108.9	A386	V379-A386 HydrophobicContact CG2-CB 4.04Å
380	C	90.3	Very high	86.5	Confident	5 Å²	5	76.9 Å²	76.9	3%	0.034	42%	0.417	C	S	.	.			trans	-70.5	134.5	173.2	-178.5	0	0	0	0	110.2	S382 C383 K385 F387 L393 H401	C380-S382 VanDerWaalsContact C-N 3.3Å; C380-S382 PolarHBondContact SG-N 3.43Å; C380-C383 CarbonylContact C-O 3.56Å; C380-C383 VanDerWaalsContact CB-O 3.27Å; C380-C383 WeakPolarHBondContact CB-O 3.07Å; C380-K385 PolarHBondContact N-O 2.89Å; C380-F387 HydrophobicContact CB-CE2 4.36Å; C380-L393 VanDerWaalsContact CA-CD1 3.47Å; C380-L393 HydrophobicContact CB-CD1 3.43Å; C380-L393 VanDerWaalsContact CB-CD1 3.43Å; C380-H401 VanDerWaalsContact SG-CD2 3.6Å
381	P	86.4	Confident	86.5	Confident	114 Å²	114	78.8 Å²	78.8	74%	0.74	44%	0.436	S	S	*	.	S	Bend	trans	-71.8	-27.8	176	29.1	-33.6	0	0	0	111.9	E397	P381-E397 WeakPolarHBondContact CD-OE1 3.44Å
382	S	85.8	Confident	86.7	Confident	77 Å²	77	73.6 Å²	73.6	54%	0.538	42%	0.42	S	S	.	.	S	Bend	trans	-88.6	-18.1	-177.1	-52.8	0	0	0	0	114.1	C380	C380-S382 VanDerWaalsContact C-N 3.3Å; C380-S382 PolarHBondContact SG-N 3.43Å
383	C	85.9	Confident	87	Confident	36 Å²	36	70.7 Å²	70.7	24%	0.243	41%	0.407	C	S	.	.	S	Bend	trans	-151.8	152.6	166.3	78	0	0	0	0	111.4	C380 K385 H396 H401	C380-C383 CarbonylContact C-O 3.56Å; C380-C383 VanDerWaalsContact CB-O 3.27Å; C380-C383 WeakPolarHBondContact CB-O 3.07Å; C383-K385 PolarHBondContact O-N 2.78Å; C383-H396 PolarHBondContact SG-NE2 3.23Å; C383-H401 PolarHBondContact SG-NE2 3.33Å
384	T	85.4	Confident	87.1	Confident	142 Å²	142	70.9 Å²	70.9	87%	0.871	41%	0.412	S	S	*	.	S	Bend	trans	-68.2	15.3	-172.7	53.7	0	0	0	0	115.9
385	K	86.5	Confident	87.4	Confident	123 Å²	123	75.5 Å²	75.5	54%	0.535	41%	0.412	S	S	.	.			trans	-75.6	133.9	177.6	-68.6	-179.1	-179.2	175.8	0	110.9	C380 C383 F387	C380-K385 PolarHBondContact N-O 2.89Å; C383-K385 PolarHBondContact O-N 2.78Å; K385-F387 HydrophobicContact CB-CE2 3.84Å; K385-F387 HydrophobicContact CB-CZ 3.92Å; K385-F387 WeakPolarHBondContact O-CE2 3.07Å
386	A	88.8	Confident	87.5	Confident	34 Å²	34	73 Å²	73	28%	0.281	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	142.4	179.3	0	0	0	0	0	112.2	K376 F378 V379	K376-A386 HydrophobicContact CB-CB 3.71Å; K376-A386 HydrophobicContact CD-CB 4.22Å; K376-A386 WeakPolarHBondContact CD-O 3.38Å; F378-A386 CarbonylContact O-C 3.48Å; F378-A386 WeakPolarHBondContact O-CA 3.2Å; V379-A386 HydrophobicContact CG2-CB 4.04Å
387	F	86.6	Confident	87.6	Confident	43 Å²	43	69.5 Å²	69.5	19%	0.189	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	151	-172.4	-57.6	-88.9	0	0	0	111.2	K376 F378 C380 K385 D392 L393 H396	K376-F387 CarbonylContact C-O 3.29Å; K376-F387 VanDerWaalsContact C-O 3.29Å; K376-F387 VanDerWaalsContact CA-O 3.25Å; K376-F387 WeakPolarHBondContact CA-O 3.12Å; F378-F387 HydrophobicContact CB-CB 4.35Å; F378-F387 PolarHBondContact N-O 3.2Å; F378-F387 PolarHBondContact O-N 3.33Å; C380-F387 HydrophobicContact CB-CE2 4.36Å; K385-F387 HydrophobicContact CB-CE2 3.84Å; K385-F387 HydrophobicContact CB-CZ 3.92Å; K385-F387 WeakPolarHBondContact O-CE2 3.07Å; F387-D392 HydrophobicContact CB-CB 4.26Å; F387-D392 HydrophobicContact CD1-CB 4Å; F387-D392 HydrophobicContact CG-CB 4.43Å; F387-L393 HydrophobicContact CB-CB 4.32Å; F387-L393 HydrophobicContact CD2-CB 3.94Å; F387-L393 HydrophobicContact CD2-CD1 3.82Å; F387-L393 HydrophobicContact CD2-CG 4.48Å; F387-L393 HydrophobicContact CE2-CD1 3.94Å; F387-L393 HydrophobicContact CG-CB 4.26Å; F387-H396 HydrophobicContact CE1-CB 3.92Å; F387-H396 HydrophobicContact CE2-CB 4.09Å; F387-H396 AromaticContact CE2-CD2 3.45Å; F387-H396 VanDerWaalsContact CE2-CD2 3.45Å; F387-H396 WeakPolarHBondContact CE2-CD2 3.27Å; F387-H396 AromaticContact CE2-CG 3.84Å; F387-H396 HydrophobicContact CZ-CB 3.52Å; F387-H396 AromaticContact CZ-CD2 3.37Å; F387-H396 WeakPolarHBondContact CZ-CD2 3.49Å; F387-H396 AromaticContact CZ-CG 3.29Å; F387-H396 AromaticContact CZ-ND1 3.94Å
388	A	85.7	Confident	87.6	Confident	28 Å²	28	70.1 Å²	70.1	23%	0.231	39%	0.385	C	S	.	.	S	Bend	trans	-83.5	-16.5	179.5	0	0	0	0	0	113.6	R370	R370-A388 WeakPolarHBondContact CD-O 3.49Å; R370-A388 PolarHBondContact NH1-O 3.19Å
389	K	86.4	Confident	87.6	Confident	82 Å²	82	72.6 Å²	72.6	36%	0.357	40%	0.401	S	S	.	.	S	Bend	trans	-133.2	147.3	-179.7	-61	-179.3	172.3	-179	0	111.2	D367 S391 D392 L393	D367-K389 HydrophobicContact CB-CG 4.43Å; K389-S391 VanDerWaalsContact C-N 3.34Å; K389-S391 PolarHBondContact O-N 3Å; K389-D392 HydrophobicContact CB-CB 4.42Å; K389-D392 PolarHBondContact O-N 2.77Å; K389-L393 PolarHBondContact O-N 2.78Å
390	A	87.1	Confident	87.1	Confident	52 Å²	52	74.8 Å²	74.8	43%	0.43	41%	0.407	S	S	.	.	H	α-helix	trans	-66.4	-33.7	175.4	0	0	0	0	0	112.8	F378 D392 L393 K394	F378-A390 HydrophobicContact CD1-CB 3.98Å; F378-A390 HydrophobicContact CE1-CB 3.78Å; F378-A390 HydrophobicContact CG-CB 4.45Å; F378-A390 HydrophobicContact CZ-CB 4.06Å; A390-D392 VanDerWaalsContact C-N 3.34Å; A390-D392 PolarHBondContact O-N 3.05Å; A390-L393 PolarHBondContact O-N 2.82Å; A390-K394 WeakPolarHBondContact O-CB 3.44Å; A390-K394 PolarHBondContact O-N 3.37Å
391	S	87.9	Confident	86.7	Confident	77 Å²	77	77.9 Å²	77.9	54%	0.538	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-37.3	176.4	53	0	0	0	0	112.8	K389 R395	K389-S391 VanDerWaalsContact C-N 3.34Å; K389-S391 PolarHBondContact O-N 3Å; S391-R395 VanDerWaalsContact O-CB 3.28Å; S391-R395 WeakPolarHBondContact O-CB 3.39Å; S391-R395 PolarHBondContact O-N 2.99Å
392	D	88.4	Confident	85.9	Confident	46 Å²	46	75.2 Å²	75.2	25%	0.246	41%	0.406	C	S	.	.	H	α-helix	trans	-68.6	-40	175.7	-70.2	-43.5	0	0	0	111.7	F387 K389 A390 R395 H396	F387-D392 HydrophobicContact CB-CB 4.26Å; F387-D392 HydrophobicContact CD1-CB 4Å; F387-D392 HydrophobicContact CG-CB 4.43Å; K389-D392 HydrophobicContact CB-CB 4.42Å; K389-D392 PolarHBondContact O-N 2.77Å; A390-D392 VanDerWaalsContact C-N 3.34Å; A390-D392 PolarHBondContact O-N 3.05Å; D392-R395 IonicContact OD1-CZ 3.18Å; D392-R395 IonicContact OD1-NE 2.8Å; D392-R395 IonicContact OD1-NH2 3.91Å; D392-R395 PolarHBondContact OD1-NH2 3.1Å; D392-H396 VanDerWaalsContact O-CB 3.31Å; D392-H396 WeakPolarHBondContact O-CB 3.4Å; D392-H396 PolarHBondContact O-N 2.94Å
393	L	90.6	Very high	84.7	Confident	21 Å²	21	80.3 Å²	80.3	11%	0.11	42%	0.421	C	S	.	.	H	α-helix	trans	-60.8	-52.6	171.7	171.7	59.1	0	0	0	111.2	F378 C380 F387 K389 A390 R395 H396 E397	F378-L393 HydrophobicContact CB-CB 4.15Å; F378-L393 HydrophobicContact CB-CD2 3.91Å; C380-L393 VanDerWaalsContact CA-CD1 3.47Å; C380-L393 HydrophobicContact CB-CD1 3.43Å; C380-L393 VanDerWaalsContact CB-CD1 3.43Å; F387-L393 HydrophobicContact CB-CB 4.32Å; F387-L393 HydrophobicContact CD2-CB 3.94Å; F387-L393 HydrophobicContact CD2-CD1 3.82Å; F387-L393 HydrophobicContact CD2-CG 4.48Å; F387-L393 HydrophobicContact CE2-CD1 3.94Å; F387-L393 HydrophobicContact CG-CB 4.26Å; K389-L393 PolarHBondContact O-N 2.78Å; A390-L393 PolarHBondContact O-N 2.82Å; L393-R395 VanDerWaalsContact C-N 3.29Å; L393-R395 PolarHBondContact O-N 3Å; L393-H396 CarbonylContact O-C 3.58Å; L393-H396 WeakPolarHBondContact O-CA 3.49Å; L393-H396 WeakPolarHBondContact O-CB 3.28Å; L393-H396 PolarHBondContact O-N 3.31Å; L393-E397 HydrophobicContact CD1-CG 3.87Å; L393-E397 WeakPolarHBondContact CD1-OE1 3.38Å; L393-E397 HydrophobicContact CG-CG 4.38Å; L393-E397 WeakPolarHBondContact O-CG 3.42Å; L393-E397 PolarHBondContact O-N 3.22Å
394	K	88.3	Confident	83.3	Confident	133 Å²	133	89.7 Å²	89.7	58%	0.578	45%	0.451	S	S	*	.	H	α-helix	trans	-61.1	-37.6	-179.1	-173	170.8	-176.3	171.7	0	112.4	A390 N398	A390-K394 WeakPolarHBondContact O-CB 3.44Å; A390-K394 PolarHBondContact O-N 3.37Å; K394-N398 VanDerWaalsContact O-CB 3.26Å; K394-N398 WeakPolarHBondContact O-CB 3.43Å; K394-N398 PolarHBondContact O-N 3.44Å; K394-N398 PolarHBondContact O-ND2 3.47Å
395	R	88.9	Confident	81.6	Confident	151 Å²	151	92.7 Å²	92.7	57%	0.57	45%	0.452	S	S	*	.	H	α-helix	trans	-65.2	-40.3	172.1	176.5	167.4	58.4	166.9	-3.1	111.8	S391 D392 L393 N399	S391-R395 VanDerWaalsContact O-CB 3.28Å; S391-R395 WeakPolarHBondContact O-CB 3.39Å; S391-R395 PolarHBondContact O-N 2.99Å; D392-R395 IonicContact OD1-CZ 3.18Å; D392-R395 IonicContact OD1-NE 2.8Å; D392-R395 IonicContact OD1-NH2 3.91Å; D392-R395 PolarHBondContact OD1-NH2 3.1Å; L393-R395 VanDerWaalsContact C-N 3.29Å; L393-R395 PolarHBondContact O-N 3Å; R395-N399 VanDerWaalsContact O-CB 3.24Å; R395-N399 WeakPolarHBondContact O-CB 3.49Å; R395-N399 PolarHBondContact O-N 3.06Å; R395-N399 VanDerWaalsContact O-N 3.08Å; R395-N399 PolarHBondContact O-ND2 3.15Å; R395-N399 PolarHBondContact O-OD1 3.39Å
396	H	88.9	Confident	79.9	Confident	23 Å²	23	95.7 Å²	95.7	11%	0.106	47%	0.468	C	S	.	.	H	α-helix	trans	-64.5	-48.4	175.6	167.4	63.2	0	0	0	112	C383 F387 D392 L393 N399 M400 H401	C383-H396 PolarHBondContact SG-NE2 3.23Å; F387-H396 HydrophobicContact CE1-CB 3.92Å; F387-H396 HydrophobicContact CE2-CB 4.09Å; F387-H396 AromaticContact CE2-CD2 3.45Å; F387-H396 VanDerWaalsContact CE2-CD2 3.45Å; F387-H396 WeakPolarHBondContact CE2-CD2 3.27Å; F387-H396 AromaticContact CE2-CG 3.84Å; F387-H396 HydrophobicContact CZ-CB 3.52Å; F387-H396 AromaticContact CZ-CD2 3.37Å; F387-H396 WeakPolarHBondContact CZ-CD2 3.49Å; F387-H396 AromaticContact CZ-CG 3.29Å; F387-H396 AromaticContact CZ-ND1 3.94Å; D392-H396 VanDerWaalsContact O-CB 3.31Å; D392-H396 WeakPolarHBondContact O-CB 3.4Å; D392-H396 PolarHBondContact O-N 2.94Å; L393-H396 CarbonylContact O-C 3.58Å; L393-H396 WeakPolarHBondContact O-CA 3.49Å; L393-H396 WeakPolarHBondContact O-CB 3.28Å; L393-H396 PolarHBondContact O-N 3.31Å; H396-N399 PolarHBondContact O-N 3.06Å; H396-M400 WeakPolarHBondContact ND1-CG 3.07Å; H396-M400 VanDerWaalsContact O-CB 3.3Å; H396-M400 WeakPolarHBondContact O-CB 3.48Å; H396-M400 WeakPolarHBondContact O-CG 3.41Å; H396-M400 PolarHBondContact O-N 3.08Å; H396-H401 AromaticContact CE1-NE2 3.95Å; H396-H401 AromaticContact NE2-CD2 3.82Å; H396-H401 AromaticContact NE2-NE2 3.52Å
397	E	88.3	Confident	77.9	Confident	54 Å²	54	101.4 Å²	101.4	25%	0.252	49%	0.493	S	S	.	.	H	α-helix	trans	-57.5	-51.3	175.2	-70.7	168.9	160.2	0	0	111.2	P381 L393 N399 M400 H401 S402	P381-E397 WeakPolarHBondContact CD-OE1 3.44Å; L393-E397 HydrophobicContact CD1-CG 3.87Å; L393-E397 WeakPolarHBondContact CD1-OE1 3.38Å; L393-E397 HydrophobicContact CG-CG 4.38Å; L393-E397 WeakPolarHBondContact O-CG 3.42Å; L393-E397 PolarHBondContact O-N 3.22Å; E397-N399 PolarHBondContact O-N 3.45Å; E397-M400 PolarHBondContact O-N 2.84Å; E397-H401 CarbonylContact O-C 3.29Å; E397-H401 VanDerWaalsContact O-CA 3.3Å; E397-H401 WeakPolarHBondContact O-CA 3.45Å; E397-H401 WeakPolarHBondContact O-CB 3.22Å; E397-H401 PolarHBondContact O-N 3.12Å; E397-S402 PolarHBondContact O-N 3.14Å
398	N	87.2	Confident	75.5	Confident	90 Å²	90	105.2 Å²	105.2	48%	0.481	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-31.9	178.2	-73.7	-10.3	0	0	0	113.1	K394 S402	K394-N398 VanDerWaalsContact O-CB 3.26Å; K394-N398 WeakPolarHBondContact O-CB 3.43Å; K394-N398 PolarHBondContact O-N 3.44Å; K394-N398 PolarHBondContact O-ND2 3.47Å; N398-S402 VanDerWaalsContact O-CB 3.22Å; N398-S402 WeakPolarHBondContact O-CB 3.46Å; N398-S402 PolarHBondContact O-OG 2.95Å
399	N	86.4	Confident	73.6	Confident	112 Å²	112	108.2 Å²	108.2	60%	0.599	53%	0.532	S	S	*	.	H	α-helix	trans	-94.1	-25.6	-174.7	-69.4	-2.4	0	0	0	114.1	R395 H396 E397	R395-N399 VanDerWaalsContact O-CB 3.24Å; R395-N399 WeakPolarHBondContact O-CB 3.49Å; R395-N399 PolarHBondContact O-N 3.06Å; R395-N399 VanDerWaalsContact O-N 3.08Å; R395-N399 PolarHBondContact O-ND2 3.15Å; R395-N399 PolarHBondContact O-OD1 3.39Å; H396-N399 PolarHBondContact O-N 3.06Å; E397-N399 PolarHBondContact O-N 3.45Å
400	M	79.8	Confident	71.7	Confident	127 Å²	127	111.1 Å²	111.1	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-117.1	-20.5	-172.7	-60	-72.1	131.3	0	0	113.5	H396 E397	H396-M400 WeakPolarHBondContact ND1-CG 3.07Å; H396-M400 VanDerWaalsContact O-CB 3.3Å; H396-M400 WeakPolarHBondContact O-CB 3.48Å; H396-M400 WeakPolarHBondContact O-CG 3.41Å; H396-M400 PolarHBondContact O-N 3.08Å; E397-M400 PolarHBondContact O-N 2.84Å
401	H	80.5	Confident	69.9	Low	70 Å²	70	115.1 Å²	115.1	32%	0.324	56%	0.561	S	S	.	*	S	Bend	trans	-129.4	10.2	-173.7	-59.6	-58.2	0	0	0	113.3	C380 C383 H396 E397	C380-H401 VanDerWaalsContact SG-CD2 3.6Å; C383-H401 PolarHBondContact SG-NE2 3.33Å; H396-H401 AromaticContact CE1-NE2 3.95Å; H396-H401 AromaticContact NE2-CD2 3.82Å; H396-H401 AromaticContact NE2-NE2 3.52Å; E397-H401 CarbonylContact O-C 3.29Å; E397-H401 VanDerWaalsContact O-CA 3.3Å; E397-H401 WeakPolarHBondContact O-CA 3.45Å; E397-H401 WeakPolarHBondContact O-CB 3.22Å; E397-H401 PolarHBondContact O-N 3.12Å
402	S	70.9	Confident	67.8	Low	59 Å²	59	114.8 Å²	114.8	41%	0.413	56%	0.558	S	S	.	*			trans	-83.5	132.6	168.8	70.3	0	0	0	0	111.4	E397 N398 R404	E397-S402 PolarHBondContact O-N 3.14Å; N398-S402 VanDerWaalsContact O-CB 3.22Å; N398-S402 WeakPolarHBondContact O-CB 3.46Å; N398-S402 PolarHBondContact O-OG 2.95Å; S402-R404 PolarHBondContact O-N 3.01Å
403	E	59.5	Low	65.9	Low	183 Å²	183	117.2 Å²	117.2	86%	0.855	57%	0.572	S	S	*	*	S	Bend	trans	-73.2	17.6	179.3	-60.2	-179.7	144.3	0	0	113.5	K405	E403-K405 PolarHBondContact O-N 2.79Å
404	R	56.4	Low	64.2	Low	234 Å²	234	120.2 Å²	120.2	88%	0.883	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	16.2	-176.1	-85.8	-170.1	-167.1	-147.4	2.6	115.5	S402	S402-R404 PolarHBondContact O-N 3.01Å
405	K	49.5	Very low	62.6	Low	205 Å²	205	120.9 Å²	120.9	89%	0.891	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	11.9	174.5	-78.6	-168.2	174.9	-176.5	0	115.3	E403	E403-K405 PolarHBondContact O-N 2.79Å
406	Q	51.5	Low	61.1	Low	186 Å²	186	118.2 Å²	118.2	87%	0.869	60%	0.596	S	S	*	*	S	Bend	trans	-122.3	24.6	172.7	-68.7	-158.4	11.6	0	0	114.6
407	L	46.3	Very low	59.6	Low	153 Å²	153	123.1 Å²	123.1	80%	0.801	62%	0.623	S	S	*	*			trans	-120.6	99.6	160.4	-76.6	169.8	0	0	0	109.2	P409	L407-P409 VanDerWaalsContact C-CD 3.43Å; L407-P409 WeakPolarHBondContact O-CD 3.3Å
408	N	36.9	Very low	58.2	Low	123 Å²	123	126.8 Å²	126.8	66%	0.658	64%	0.64	S	S	*	*			trans	-117.1	73.6	165.5	-163.9	33.1	0	0	0	107.8	L410	N408-L410 PolarHBondContact O-N 3.31Å
409	P	45.8	Very low	56.9	Low	91 Å²	91	125.4 Å²	125.4	59%	0.591	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	55.3	-165.5	36.6	-37.9	0	0	0	112.3	L407	L407-P409 VanDerWaalsContact C-CD 3.43Å; L407-P409 WeakPolarHBondContact O-CD 3.3Å
410	L	45.6	Very low	55.8	Low	143 Å²	143	122.9 Å²	122.9	75%	0.749	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.3	14.1	-177.4	-95.1	172.8	0	0	0	114.8	N408	N408-L410 PolarHBondContact O-N 3.31Å
411	Q	49.2	Very low	54.9	Low	137 Å²	137	119.5 Å²	119.5	64%	0.64	63%	0.628	S	S	*	*	S	Bend	trans	-130.8	-14.2	177.5	-63	-170.1	-82.2	0	0	115.4
412	S	44.5	Very low	54.2	Low	69 Å²	69	122 Å²	122	48%	0.483	64%	0.641	S	S	.	*	H	α-helix	trans	-77.7	-31.6	175.6	45.3	0	0	0	0	113.9	T416	S412-T416 PolarHBondContact O-N 3.28Å; S412-T416 PolarHBondContact O-OG1 2.97Å
413	D	48.7	Very low	53.8	Low	98 Å²	98	121.4 Å²	121.4	52%	0.524	64%	0.64	S	S	.	*	H	α-helix	trans	-90	-22.2	-163.2	-60	9.2	0	0	0	111.4	T416 L417	D413-T416 WeakPolarHBondContact CA-OG1 3.26Å; D413-T416 PolarHBondContact O-OG1 3.38Å; D413-L417 WeakPolarHBondContact O-CB 3.48Å; D413-L417 WeakPolarHBondContact O-CD1 3.5Å; D413-L417 VanDerWaalsContact O-CG 3.23Å; D413-L417 WeakPolarHBondContact O-CG 3.33Å; D413-L417 PolarHBondContact O-N 2.86Å
414	T	55	Low	53.9	Low	83 Å²	83	115.6 Å²	115.6	51%	0.509	62%	0.623	S	S	.	*	H	α-helix	trans	-74.5	-42.8	173.8	47.2	0	0	0	0	112	Q418	T414-Q418 WeakPolarHBondContact O-CB 3.45Å; T414-Q418 PolarHBondContact O-N 3.46Å
415	E	54.2	Low	54.1	Low	148 Å²	148	111 Å²	111	69%	0.692	61%	0.612	S	S	*	*	H	α-helix	trans	-70	-36.7	-178.7	-64.2	-173.2	162.8	0	0	111.8	A419	E415-A419 VanDerWaalsContact O-CB 3.28Å; E415-A419 WeakPolarHBondContact O-CB 3.39Å; E415-A419 PolarHBondContact O-N 3Å
416	T	57.6	Low	54.6	Low	94 Å²	94	107.7 Å²	107.7	58%	0.577	60%	0.599	S	S	*	*	H	α-helix	trans	-71.4	-40	176.7	44.6	0	0	0	0	113	S412 D413 A420	S412-T416 PolarHBondContact O-N 3.28Å; S412-T416 PolarHBondContact O-OG1 2.97Å; D413-T416 WeakPolarHBondContact CA-OG1 3.26Å; D413-T416 PolarHBondContact O-OG1 3.38Å; T416-A420 WeakPolarHBondContact O-CB 3.48Å; T416-A420 PolarHBondContact O-N 3.16Å; T416-A420 VanDerWaalsContact O-N 3.09Å
417	L	57.6	Low	55	Low	126 Å²	126	105 Å²	105	66%	0.66	59%	0.587	S	S	*	*	H	α-helix	trans	-69.1	-37	173.7	-72.6	171.9	0	0	0	112.6	D413 A420 A421	D413-L417 WeakPolarHBondContact O-CB 3.48Å; D413-L417 WeakPolarHBondContact O-CD1 3.5Å; D413-L417 VanDerWaalsContact O-CG 3.23Å; D413-L417 WeakPolarHBondContact O-CG 3.33Å; D413-L417 PolarHBondContact O-N 2.86Å; L417-A420 PolarHBondContact O-N 3.49Å; L417-A421 WeakPolarHBondContact O-CB 3.37Å; L417-A421 PolarHBondContact O-N 3.16Å
418	Q	59.9	Low	55.5	Low	131 Å²	131	103.7 Å²	103.7	61%	0.612	58%	0.576	S	S	*	*	H	α-helix	trans	-73.7	-35.4	179.9	-165.4	161.2	-8.5	0	0	112.1	T414 A421 M422	T414-Q418 WeakPolarHBondContact O-CB 3.45Å; T414-Q418 PolarHBondContact O-N 3.46Å; Q418-A421 PolarHBondContact O-N 3.12Å; Q418-M422 WeakPolarHBondContact O-CG 3.44Å; Q418-M422 PolarHBondContact O-N 3.15Å; Q418-M422 VanDerWaalsContact O-N 3.12Å
419	A	59.9	Low	56.3	Low	61 Å²	61	103.6 Å²	103.6	50%	0.504	58%	0.575	S	S	.	*	H	α-helix	trans	-65.1	-39.9	169.6	0	0	0	0	0	112.5	E415 M422 A423	E415-A419 VanDerWaalsContact O-CB 3.28Å; E415-A419 WeakPolarHBondContact O-CB 3.39Å; E415-A419 PolarHBondContact O-N 3Å; A419-M422 PolarHBondContact O-N 2.9Å; A419-A423 PolarHBondContact O-N 3.24Å; A419-A423 VanDerWaalsContact O-N 3.1Å
420	A	61.9	Low	56.6	Low	59 Å²	59	106 Å²	106	49%	0.488	58%	0.579	S	S	.	*	H	α-helix	trans	-66.4	-36.9	176.1	0	0	0	0	0	112.7	T416 L417 A424	T416-A420 WeakPolarHBondContact O-CB 3.48Å; T416-A420 PolarHBondContact O-N 3.16Å; T416-A420 VanDerWaalsContact O-N 3.09Å; L417-A420 PolarHBondContact O-N 3.49Å; A420-A424 PolarHBondContact O-N 3.12Å
421	A	62.4	Low	56.9	Low	56 Å²	56	104.8 Å²	104.8	46%	0.463	57%	0.573	S	S	.	*	H	α-helix	trans	-65.3	-45.6	175.2	0	0	0	0	0	112.1	L417 Q418 A423 A424 E425	L417-A421 WeakPolarHBondContact O-CB 3.37Å; L417-A421 PolarHBondContact O-N 3.16Å; Q418-A421 PolarHBondContact O-N 3.12Å; A421-A423 PolarHBondContact O-N 3.12Å; A421-A424 PolarHBondContact O-N 3.37Å; A421-E425 PolarHBondContact O-N 3.3Å
422	M	64	Low	57.2	Low	123 Å²	123	103.3 Å²	103.3	61%	0.606	57%	0.568	S	S	*	*	H	α-helix	trans	-62.8	-41.6	177.8	-72.8	174	55.4	0	0	112.5	Q418 A419 A424 E425 E426	Q418-M422 WeakPolarHBondContact O-CG 3.44Å; Q418-M422 PolarHBondContact O-N 3.15Å; Q418-M422 VanDerWaalsContact O-N 3.12Å; A419-M422 PolarHBondContact O-N 2.9Å; M422-A424 VanDerWaalsContact C-N 3.26Å; M422-A424 PolarHBondContact O-N 2.98Å; M422-E425 PolarHBondContact O-N 3.46Å; M422-E426 PolarHBondContact O-N 3.47Å
423	A	63.5	Low	57.2	Low	46 Å²	46	105.1 Å²	105.1	38%	0.38	58%	0.581	S	S	.	*	H	α-helix	trans	-65.2	-28.5	176.9	0	0	0	0	0	113.2	A419 A421 Q427	A419-A423 PolarHBondContact O-N 3.24Å; A419-A423 VanDerWaalsContact O-N 3.1Å; A421-A423 PolarHBondContact O-N 3.12Å; A423-Q427 WeakPolarHBondContact O-CG 3.45Å; A423-Q427 PolarHBondContact O-N 2.95Å
424	A	61.6	Low	57.2	Low	61 Å²	61	106.2 Å²	106.2	50%	0.504	60%	0.595	S	S	.	*	H	α-helix	trans	-76	-35.2	176.2	0	0	0	0	0	112.8	A420 A421 M422 H428	A420-A424 PolarHBondContact O-N 3.12Å; A421-A424 PolarHBondContact O-N 3.37Å; M422-A424 VanDerWaalsContact C-N 3.26Å; M422-A424 PolarHBondContact O-N 2.98Å; A424-H428 PolarHBondContact O-N 3.38Å
425	E	61.3	Low	56.5	Low	138 Å²	138	110.1 Å²	110.1	65%	0.645	63%	0.625	S	S	*	*	H	α-helix	trans	-68.5	-38.9	174	-75.2	-171.2	132.3	0	0	112.1	A421 M422 Q427 H428 L429	A421-E425 PolarHBondContact O-N 3.3Å; M422-E425 PolarHBondContact O-N 3.46Å; E425-Q427 PolarHBondContact O-N 3.08Å; E425-H428 PolarHBondContact O-N 2.92Å; E425-H428 VanDerWaalsContact O-N 3.13Å; E425-L429 PolarHBondContact O-N 2.73Å
426	E	60.2	Low	56.6	Low	135 Å²	135	108.2 Å²	108.2	63%	0.631	62%	0.622	S	S	*	*	H	α-helix	trans	-62.7	-44.1	178.6	-161	164.1	-147.2	0	0	111.5	M422 H428 L429 E430	M422-E426 PolarHBondContact O-N 3.47Å; E426-H428 VanDerWaalsContact C-N 3.28Å; E426-H428 PolarHBondContact O-N 3.27Å; E426-L429 PolarHBondContact O-N 3.3Å; E426-E430 PolarHBondContact O-N 2.97Å; E426-E430 VanDerWaalsContact O-N 3.12Å
427	Q	59	Low	56.5	Low	129 Å²	129	108.9 Å²	108.9	60%	0.603	62%	0.624	S	S	*	*	H	α-helix	trans	-65.8	-26.4	173.6	-69.7	-179.3	5.2	0	0	113.8	A423 E425 N431	A423-Q427 WeakPolarHBondContact O-CG 3.45Å; A423-Q427 PolarHBondContact O-N 2.95Å; E425-Q427 PolarHBondContact O-N 3.08Å; Q427-N431 PolarHBondContact O-N 3.24Å; Q427-N431 PolarHBondContact O-ND2 3.13Å
428	H	56	Low	56.5	Low	126 Å²	126	108 Å²	108	58%	0.583	62%	0.623	S	S	*	*	H	α-helix	trans	-78.6	-30.4	176.2	-161.8	-66.6	0	0	0	111.9	A424 E425 E426 I432	A424-H428 PolarHBondContact O-N 3.38Å; E425-H428 PolarHBondContact O-N 2.92Å; E425-H428 VanDerWaalsContact O-N 3.13Å; E426-H428 VanDerWaalsContact C-N 3.28Å; E426-H428 PolarHBondContact O-N 3.27Å; H428-I432 WeakPolarHBondContact ND1-CD1 3.4Å; H428-I432 WeakPolarHBondContact O-CD1 3.1Å; H428-I432 WeakPolarHBondContact O-CG1 3.01Å; H428-I432 PolarHBondContact O-N 3.2Å
429	L	54	Low	56.3	Low	122 Å²	122	106.6 Å²	106.6	64%	0.639	62%	0.623	S	S	*	*	H	α-helix	trans	-74.6	-40.3	175.7	-80.6	157.6	0	0	0	112.4	E425 E426 N431 I432 S433	E425-L429 PolarHBondContact O-N 2.73Å; E426-L429 PolarHBondContact O-N 3.3Å; L429-N431 VanDerWaalsContact C-N 3.35Å; L429-N431 PolarHBondContact O-N 2.67Å; L429-I432 PolarHBondContact O-N 3.28Å; L429-S433 PolarHBondContact O-N 3.16Å
430	E	53	Low	56.1	Low	141 Å²	141	109.5 Å²	109.5	66%	0.659	63%	0.631	S	S	*	*	H	α-helix	trans	-63.3	-38.5	175.9	-70.5	-168.4	144.9	0	0	112.6	E426 I432 S433	E426-E430 PolarHBondContact O-N 2.97Å; E426-E430 VanDerWaalsContact O-N 3.12Å; E430-I432 VanDerWaalsContact C-N 3.34Å; E430-I432 PolarHBondContact O-N 3.46Å; E430-S433 PolarHBondContact O-N 3.07Å
431	N	51.7	Low	55.7	Low	118 Å²	118	112.9 Å²	112.9	63%	0.631	64%	0.64	S	S	*	*	H	α-helix	trans	-67.8	-30.2	177	-81.7	-56.7	0	0	0	113.6	Q427 L429 S433 S435	Q427-N431 PolarHBondContact O-N 3.24Å; Q427-N431 PolarHBondContact O-ND2 3.13Å; L429-N431 VanDerWaalsContact C-N 3.35Å; L429-N431 PolarHBondContact O-N 2.67Å; N431-S433 VanDerWaalsContact C-N 3.32Å; N431-S435 PolarHBondContact O-OG 3.31Å
432	I	54.3	Low	55.2	Low	105 Å²	105	116.9 Å²	116.9	54%	0.538	65%	0.653	S	S	.	*	H	α-helix	trans	-73.4	-26.6	174.1	-68.4	168.2	0	0	0	111.3	H428 L429 E430 C434	H428-I432 WeakPolarHBondContact ND1-CD1 3.4Å; H428-I432 WeakPolarHBondContact O-CD1 3.1Å; H428-I432 WeakPolarHBondContact O-CG1 3.01Å; H428-I432 PolarHBondContact O-N 3.2Å; L429-I432 PolarHBondContact O-N 3.28Å; E430-I432 VanDerWaalsContact C-N 3.34Å; E430-I432 PolarHBondContact O-N 3.46Å; I432-C434 VanDerWaalsContact C-N 3.3Å; I432-C434 PolarHBondContact O-N 3.43Å
433	S	45.8	Very low	54.5	Low	107 Å²	107	116.5 Å²	116.5	75%	0.748	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-5	-179.6	-169.6	0	0	0	0	114.9	L429 E430 N431	L429-S433 PolarHBondContact O-N 3.16Å; E430-S433 PolarHBondContact O-N 3.07Å; N431-S433 VanDerWaalsContact C-N 3.32Å
434	C	48.3	Very low	53.8	Low	122 Å²	122	122.3 Å²	122.3	82%	0.824	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.7	16	-175.8	-150.9	0	0	0	0	113.4	I432	I432-C434 VanDerWaalsContact C-N 3.3Å; I432-C434 PolarHBondContact O-N 3.43Å
435	S	40.1	Very low	53.1	Low	164 Å²	164	127.9 Å²	127.9	100%	1.147	70%	0.695	S	S	*	*			trans	-109.7	0	174.6	-58.6	0	0	0	0	111.1	N431	N431-S435 PolarHBondContact O-OG 3.31Å

Retrieved 435 of 435 residues in 62.4 ms (Link to these results)

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