A0A096MJY2_RAT Loading...

Stomatin like 3

AlphaFold DB , UniProt , Accession A0A096MJY2, Species RAT (Rattus norvegicus, Rat), Gene Stoml3, Length 287 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	41.3	Very low	46.5	Very low	242 Å²	242	132.6 Å²	132.6	100%	1.192	68%	0.682	S	S	*	*				0	99.2	0	-72.3	-177.7	168.7	0	0	106
2	D	42.9	Very low	46.9	Very low	125 Å²	125	130.7 Å²	130.7	67%	0.668	67%	0.672	S	S	*	*			trans	-72.5	127.7	175.3	-111.7	-37.8	0	0	0	108	K6	D2-K6 WeakPolarHBondContact OD1-CD 3.24Å; D2-K6 IonicContact OD1-NZ 2.74Å; D2-K6 PolarHBondContact OD1-NZ 2.97Å
3	S	49.5	Very low	47	Very low	78 Å²	78	125.1 Å²	125.1	55%	0.545	65%	0.648	S	S	.	*			trans	-57.5	143	-178.9	-73.1	0	0	0	0	111.5	E5 K6	S3-E5 PolarHBondContact O-N 3.47Å; S3-K6 PolarHBondContact O-N 3.43Å; S3-K6 VanDerWaalsContact O-N 3.14Å
4	P	53.2	Low	46.5	Very low	106 Å²	106	121.1 Å²	121.1	69%	0.688	65%	0.653	S	S	*	*	H	α-helix	trans	-55.6	-24.7	-173.9	20.1	-32.6	0	0	0	114.7	K6 L7 E8	P4-K6 VanDerWaalsContact C-N 3.32Å; P4-K6 PolarHBondContact O-N 3.17Å; P4-L7 WeakPolarHBondContact O-CB 3.48Å; P4-L7 PolarHBondContact O-N 3.04Å; P4-E8 PolarHBondContact O-N 2.91Å
5	E	53.9	Low	46.5	Very low	148 Å²	148	119.3 Å²	119.3	69%	0.692	65%	0.648	S	S	*	*	H	α-helix	trans	-62.3	-32.9	178.5	-71.1	-179.3	156.4	0	0	114	S3 L7 E8 K9	S3-E5 PolarHBondContact O-N 3.47Å; E5-L7 VanDerWaalsContact C-N 3.26Å; E5-L7 PolarHBondContact O-N 2.96Å; E5-E8 PolarHBondContact O-N 3.38Å; E5-K9 PolarHBondContact O-N 3.12Å
6	K	48.8	Very low	46.4	Very low	127 Å²	127	120.9 Å²	120.9	55%	0.552	66%	0.656	S	S	*	*	H	α-helix	trans	-71.6	-24.9	176	-71.7	-174.4	-170.9	166.4	0	112.2	D2 S3 P4	D2-K6 WeakPolarHBondContact OD1-CD 3.24Å; D2-K6 IonicContact OD1-NZ 2.74Å; D2-K6 PolarHBondContact OD1-NZ 2.97Å; S3-K6 PolarHBondContact O-N 3.43Å; S3-K6 VanDerWaalsContact O-N 3.14Å; P4-K6 VanDerWaalsContact C-N 3.32Å; P4-K6 PolarHBondContact O-N 3.17Å
7	L	46.5	Very low	46.5	Very low	125 Å²	125	126.1 Å²	126.1	65%	0.654	67%	0.67	S	S	*	*	H	α-helix	trans	-72.9	-34.9	179.1	-141	98.4	0	0	0	111.1	P4 E5 N11	P4-L7 WeakPolarHBondContact O-CB 3.48Å; P4-L7 PolarHBondContact O-N 3.04Å; E5-L7 VanDerWaalsContact C-N 3.26Å; E5-L7 PolarHBondContact O-N 2.96Å; L7-N11 PolarHBondContact O-ND2 3.45Å
8	E	48.3	Very low	47	Very low	148 Å²	148	121.8 Å²	121.8	69%	0.692	65%	0.653	S	S	*	*	H	α-helix	trans	-70.8	-36.9	174.5	-86.9	-168.3	143.1	0	0	113.1	P4 E5 N10 N11	P4-E8 PolarHBondContact O-N 2.91Å; E5-E8 PolarHBondContact O-N 3.38Å; E8-N10 PolarHBondContact O-N 3.13Å; E8-N11 PolarHBondContact O-N 2.83Å; E8-N11 VanDerWaalsContact O-N 3.09Å
9	K	44.5	Very low	47.6	Very low	110 Å²	110	128 Å²	128	48%	0.478	67%	0.666	S	S	.	*	H	α-helix	trans	-59.6	-28.8	177.1	-70.3	-169.5	-179	-170	0	112.7	E5 E176 L177	E5-K9 PolarHBondContact O-N 3.12Å; K9-E176 IonicContact NZ-OE2 3.51Å; K9-E176 PolarHBondContact NZ-OE2 3.4Å; K9-L177 HydrophobicContact CG-CD2 4.25Å
10	N	42.8	Very low	48.3	Very low	129 Å²	129	125.3 Å²	125.3	69%	0.69	65%	0.652	S	S	*	*	H	α-helix	trans	-82.3	-17.9	178.7	-75.1	-18	0	0	0	114.4	E8	E8-N10 PolarHBondContact O-N 3.13Å
11	N	39.7	Very low	49.6	Very low	121 Å²	121	121.5 Å²	121.5	65%	0.647	64%	0.643	S	S	*	*	H	α-helix	trans	-87.4	-15.4	-173.8	-75.6	-30.2	0	0	0	114.2	L7 E8 V13	L7-N11 PolarHBondContact O-ND2 3.45Å; E8-N11 PolarHBondContact O-N 2.83Å; E8-N11 VanDerWaalsContact O-N 3.09Å; N11-V13 PolarHBondContact O-N 3.32Å
12	L	51.4	Low	51.6	Low	109 Å²	109	115.7 Å²	115.7	57%	0.571	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-20.9	-175.6	-79.2	161	0	0	0	114
13	V	47.7	Very low	53.4	Low	58 Å²	58	113.9 Å²	113.9	35%	0.352	62%	0.617	S	S	.	*	T	Hydrogen-bonded Turn	trans	-129.7	68.7	176	-163.5	0	0	0	0	110.2	N11 T15	N11-V13 PolarHBondContact O-N 3.32Å; V13-T15 HydrophobicContact CG1-CG2 3.77Å; V13-T15 PolarHBondContact O-N 3.16Å
14	G	40.7	Very low	54.9	Low	70 Å²	70	110.6 Å²	110.6	72%	0.722	60%	0.596	S	S	*	*			trans	-63.1	84.3	165	0	0	0	0	0	110.6	N16	G14-N16 PolarHBondContact O-N 3.25Å
15	T	46.4	Very low	56.4	Low	93 Å²	93	112.4 Å²	112.4	57%	0.571	59%	0.589	S	S	*	*			trans	-72.9	59.1	171.8	52.6	0	0	0	0	110.4	V13 K17	V13-T15 HydrophobicContact CG1-CG2 3.77Å; V13-T15 PolarHBondContact O-N 3.16Å; T15-K17 VanDerWaalsContact C-N 3.32Å; T15-K17 PolarHBondContact O-N 3.13Å
16	N	44.1	Very low	58	Low	145 Å²	145	110.3 Å²	110.3	78%	0.775	58%	0.582	S	S	*	*			trans	-67.2	102.3	165.6	-133.5	-8	0	0	0	105.8	G14 S18	G14-N16 PolarHBondContact O-N 3.25Å; N16-S18 PolarHBondContact O-N 3.47Å; N16-S18 PolarHBondContact O-OG 2.91Å
17	K	49.3	Very low	59.7	Low	209 Å²	209	107.8 Å²	107.8	91%	0.909	57%	0.574	S	S	*	*			trans	-65.7	55.4	170.4	-166.5	-179	-175.4	179	0	108.6	T15 R19	T15-K17 VanDerWaalsContact C-N 3.32Å; T15-K17 PolarHBondContact O-N 3.13Å; K17-R19 PolarHBondContact O-N 3.02Å
18	S	54.3	Low	61.5	Low	50 Å²	50	104.9 Å²	104.9	35%	0.35	56%	0.556	S	S	.	*			trans	-64.6	119.5	178.7	52	0	0	0	0	105.9	N16 L20 R63	N16-S18 PolarHBondContact O-N 3.47Å; N16-S18 PolarHBondContact O-OG 2.91Å; S18-L20 PolarHBondContact O-N 3.42Å; S18-R63 PolarHBondContact O-NH1 3.4Å; S18-R63 PolarHBondContact OG-NH1 3.31Å; S18-R63 PolarHBondContact OG-NH2 2.87Å; S18-R63 VanDerWaalsContact OG-NH2 3.13Å
19	R	58.6	Low	63.4	Low	239 Å²	239	103.8 Å²	103.8	90%	0.902	55%	0.549	S	S	*	.			trans	-37.6	129.1	172.8	-81.5	177.5	157.7	175.5	-5.4	109	K17 G21	K17-R19 PolarHBondContact O-N 3.02Å; R19-G21 PolarHBondContact O-N 3.42Å; R19-G21 VanDerWaalsContact O-N 3.15Å
20	L	63	Low	65.4	Low	73 Å²	73	102.8 Å²	102.8	38%	0.382	55%	0.549	S	S	.	.			trans	-50.4	126.2	170.8	-79.9	85.9	0	0	0	107.4	S18 L61	S18-L20 PolarHBondContact O-N 3.42Å; L20-L61 HydrophobicContact CD2-CD1 4.32Å
21	G	75.5	Confident	67.3	Low	46 Å²	46	97 Å²	97	47%	0.474	52%	0.518	S	S	.	.			trans	-58.9	163.5	174.2	0	0	0	0	0	110.8	R19 C23 G24 W25	R19-G21 PolarHBondContact O-N 3.42Å; R19-G21 VanDerWaalsContact O-N 3.15Å; G21-C23 PolarHBondContact O-N 3.27Å; G21-C23 VanDerWaalsContact O-N 3.15Å; G21-G24 WeakPolarHBondContact O-CA 3.35Å; G21-G24 PolarHBondContact O-N 2.89Å; G21-W25 PolarHBondContact O-N 3.36Å
22	V	81.9	Confident	69.4	Low	120 Å²	120	96.4 Å²	96.4	73%	0.727	51%	0.51	S	S	*	.	H	α-helix	trans	-51.9	-40	-179.7	-178.6	0	0	0	0	111.7	G24 W25 I26	V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 2.94Å; V22-W25 WeakPolarHBondContact O-CB 3.5Å; V22-W25 PolarHBondContact O-N 3.33Å; V22-I26 HydrophobicContact CG1-CD1 4.17Å; V22-I26 WeakPolarHBondContact O-CG1 3.37Å; V22-I26 PolarHBondContact O-N 2.7Å
23	C	80.5	Confident	71.2	Confident	88 Å²	88	95.9 Å²	95.9	60%	0.595	51%	0.507	S	S	*	.	H	α-helix	trans	-60.3	-40.1	174.4	-174.6	0	0	0	0	112.9	G21 W25 I26 L27	G21-C23 PolarHBondContact O-N 3.27Å; G21-C23 VanDerWaalsContact O-N 3.15Å; C23-W25 VanDerWaalsContact C-N 3.31Å; C23-W25 PolarHBondContact O-N 3.26Å; C23-I26 PolarHBondContact O-N 2.92Å; C23-L27 WeakPolarHBondContact O-CG 3.41Å; C23-L27 PolarHBondContact O-N 3.49Å
24	G	80.8	Confident	72.9	Confident	9 Å²	9	97.3 Å²	97.3	9%	0.093	51%	0.512	C	S	.	.	H	α-helix	trans	-63.2	-37.3	175.5	0	0	0	0	0	112.5	G21 V22 F28	G21-G24 WeakPolarHBondContact O-CA 3.35Å; G21-G24 PolarHBondContact O-N 2.89Å; V22-G24 VanDerWaalsContact C-N 3.34Å; V22-G24 PolarHBondContact O-N 2.94Å; G24-F28 WeakPolarHBondContact O-CB 3.42Å; G24-F28 PolarHBondContact O-N 2.96Å
25	W	85.1	Confident	74.9	Confident	143 Å²	143	95.8 Å²	95.8	54%	0.542	49%	0.487	S	S	.	.	H	α-helix	trans	-67.5	-41.4	173.1	-91.3	86.4	0	0	0	112.6	G21 V22 C23 F28 F29	G21-W25 PolarHBondContact O-N 3.36Å; V22-W25 WeakPolarHBondContact O-CB 3.5Å; V22-W25 PolarHBondContact O-N 3.33Å; C23-W25 VanDerWaalsContact C-N 3.31Å; C23-W25 PolarHBondContact O-N 3.26Å; W25-F28 WeakPolarHBondContact O-CB 3.34Å; W25-F28 PolarHBondContact O-N 3.23Å; W25-F29 HydrophobicContact CE3-CD2 4.17Å; W25-F29 AromaticContact CE3-CE2 3.41Å; W25-F29 HydrophobicContact CE3-CE2 3.41Å; W25-F29 VanDerWaalsContact CE3-CE2 3.41Å; W25-F29 AromaticContact CE3-CZ 3.79Å; W25-F29 HydrophobicContact CE3-CZ 3.79Å; W25-F29 AromaticContact CZ3-CE2 3.89Å; W25-F29 HydrophobicContact CZ3-CE2 3.89Å; W25-F29 AromaticContact CZ3-CZ 3.76Å; W25-F29 HydrophobicContact CZ3-CZ 3.76Å; W25-F29 WeakPolarHBondContact O-CD2 3.34Å; W25-F29 PolarHBondContact O-N 3.02Å
26	I	88.1	Confident	76.8	Confident	105 Å²	105	96.2 Å²	96.2	54%	0.538	49%	0.485	S	S	.	.	H	α-helix	trans	-61	-47.5	176.7	-67.6	164.1	0	0	0	110.8	V22 C23 F28 F29 L30	V22-I26 HydrophobicContact CG1-CD1 4.17Å; V22-I26 WeakPolarHBondContact O-CG1 3.37Å; V22-I26 PolarHBondContact O-N 2.7Å; C23-I26 PolarHBondContact O-N 2.92Å; I26-F28 VanDerWaalsContact C-N 3.27Å; I26-F28 PolarHBondContact O-N 3.04Å; I26-F29 PolarHBondContact O-N 3.3Å; I26-L30 WeakPolarHBondContact O-CB 3.44Å; I26-L30 PolarHBondContact O-N 3.27Å
27	L	84.1	Confident	78.8	Confident	74 Å²	74	95.2 Å²	95.2	39%	0.387	48%	0.479	S	S	.	.	H	α-helix	trans	-61.9	-38	176.4	-70.3	176.6	0	0	0	111.8	C23 L30 S31 L61	C23-L27 WeakPolarHBondContact O-CG 3.41Å; C23-L27 PolarHBondContact O-N 3.49Å; L27-L30 PolarHBondContact O-N 3Å; L27-S31 WeakPolarHBondContact O-CB 3.4Å; L27-S31 PolarHBondContact O-N 2.9Å; L27-L61 HydrophobicContact CD1-CD2 4.14Å
28	F	83.7	Confident	80.5	Confident	63 Å²	63	88.1 Å²	88.1	28%	0.276	45%	0.453	S	S	.	.	H	α-helix	trans	-61.9	-47.1	175.7	-158	-94.9	0	0	0	112	G24 W25 I26 S31 F32 L78 I81	G24-F28 WeakPolarHBondContact O-CB 3.42Å; G24-F28 PolarHBondContact O-N 2.96Å; W25-F28 WeakPolarHBondContact O-CB 3.34Å; W25-F28 PolarHBondContact O-N 3.23Å; I26-F28 VanDerWaalsContact C-N 3.27Å; I26-F28 PolarHBondContact O-N 3.04Å; F28-S31 PolarHBondContact O-N 3.39Å; F28-F32 WeakPolarHBondContact O-CB 3.34Å; F28-F32 PolarHBondContact O-N 2.89Å; F28-L78 HydrophobicContact CE2-CD2 3.84Å; F28-L78 HydrophobicContact CZ-CD2 4Å; F28-I81 HydrophobicContact CB-CD1 4.38Å; F28-I81 HydrophobicContact CD2-CD1 3.93Å; F28-I81 HydrophobicContact CG-CD1 4.48Å
29	F	88.5	Confident	81.3	Confident	125 Å²	125	92.3 Å²	92.3	55%	0.548	47%	0.465	S	S	.	.	H	α-helix	trans	-63.4	-40.7	174.7	-79.6	-62.1	0	0	0	112.6	W25 I26 F32 L33	W25-F29 HydrophobicContact CE3-CD2 4.17Å; W25-F29 AromaticContact CE3-CE2 3.41Å; W25-F29 HydrophobicContact CE3-CE2 3.41Å; W25-F29 VanDerWaalsContact CE3-CE2 3.41Å; W25-F29 AromaticContact CE3-CZ 3.79Å; W25-F29 HydrophobicContact CE3-CZ 3.79Å; W25-F29 AromaticContact CZ3-CE2 3.89Å; W25-F29 HydrophobicContact CZ3-CE2 3.89Å; W25-F29 AromaticContact CZ3-CZ 3.76Å; W25-F29 HydrophobicContact CZ3-CZ 3.76Å; W25-F29 WeakPolarHBondContact O-CD2 3.34Å; W25-F29 PolarHBondContact O-N 3.02Å; I26-F29 PolarHBondContact O-N 3.3Å; F29-F32 PolarHBondContact O-N 2.98Å; F29-L33 WeakPolarHBondContact O-CB 3.49Å; F29-L33 PolarHBondContact O-N 3.1Å
30	L	87.6	Confident	82.4	Confident	90 Å²	90	85.6 Å²	85.6	47%	0.471	45%	0.453	S	S	.	.	H	α-helix	trans	-64.7	-44.6	178.5	-179.2	63.1	0	0	0	111.9	I26 L27 F32 L33 L34	I26-L30 WeakPolarHBondContact O-CB 3.44Å; I26-L30 PolarHBondContact O-N 3.27Å; L27-L30 PolarHBondContact O-N 3Å; L30-F32 VanDerWaalsContact C-N 3.32Å; L30-L33 PolarHBondContact O-N 2.84Å; L30-L34 HydrophobicContact CG-CD1 4.43Å; L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 PolarHBondContact O-N 3.15Å
31	S	82	Confident	83.4	Confident	8 Å²	8	86.9 Å²	86.9	6%	0.056	46%	0.463	C	S	.	.	H	α-helix	trans	-61.9	-42	174.3	177.3	0	0	0	0	111.1	L27 F28 L34 M35 P79	L27-S31 WeakPolarHBondContact O-CB 3.4Å; L27-S31 PolarHBondContact O-N 2.9Å; F28-S31 PolarHBondContact O-N 3.39Å; S31-L34 PolarHBondContact O-N 3.36Å; S31-M35 WeakPolarHBondContact O-CB 3.44Å; S31-M35 PolarHBondContact O-N 3.18Å; S31-P79 PolarHBondContact OG-O 3.11Å; S31-P79 VanDerWaalsContact OG-O 3.1Å
32	F	84.7	Confident	83.8	Confident	107 Å²	107	85.1 Å²	85.1	47%	0.469	44%	0.444	S	S	.	.	H	α-helix	trans	-63.1	-42.7	175.6	-173.6	-101.1	0	0	0	112.4	F28 F29 L30 M35 L36	F28-F32 WeakPolarHBondContact O-CB 3.34Å; F28-F32 PolarHBondContact O-N 2.89Å; F29-F32 PolarHBondContact O-N 2.98Å; L30-F32 VanDerWaalsContact C-N 3.32Å; F32-M35 WeakPolarHBondContact O-CB 3.42Å; F32-M35 PolarHBondContact O-N 2.91Å; F32-L36 HydrophobicContact CD1-CD1 4.43Å; F32-L36 HydrophobicContact CE1-CD1 3.77Å; F32-L36 HydrophobicContact CZ-CD1 4.18Å; F32-L36 PolarHBondContact O-N 2.8Å
33	L	87.9	Confident	83.9	Confident	98 Å²	98	83.1 Å²	83.1	51%	0.513	43%	0.428	S	S	.	.	H	α-helix	trans	-61.8	-45.9	175.2	-178.2	66.9	0	0	0	111.4	F29 L30 M35 L36 I37	F29-L33 WeakPolarHBondContact O-CB 3.49Å; F29-L33 PolarHBondContact O-N 3.1Å; L30-L33 PolarHBondContact O-N 2.84Å; L33-M35 VanDerWaalsContact C-N 3.31Å; L33-M35 PolarHBondContact O-N 3.06Å; L33-L36 PolarHBondContact O-N 3.43Å; L33-I37 HydrophobicContact CD1-CD1 4.43Å; L33-I37 HydrophobicContact CG-CD1 4.03Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 2.99Å
34	L	84.3	Confident	84.1	Confident	88 Å²	88	89.2 Å²	89.2	46%	0.461	44%	0.439	S	S	.	.	H	α-helix	trans	-60.1	-39.9	174.9	-85.6	164.7	0	0	0	112.2	L30 S31 L36 I37 T38	L30-L34 HydrophobicContact CG-CD1 4.43Å; L30-L34 WeakPolarHBondContact O-CB 3.2Å; L30-L34 PolarHBondContact O-N 3.15Å; S31-L34 PolarHBondContact O-N 3.36Å; L34-L36 VanDerWaalsContact C-N 3.3Å; L34-L36 PolarHBondContact O-N 3.17Å; L34-I37 PolarHBondContact O-N 3.24Å; L34-T38 PolarHBondContact O-N 3Å; L34-T38 VanDerWaalsContact O-N 3.13Å; L34-T38 PolarHBondContact O-OG1 3.22Å
35	M	82.7	Confident	84.2	Confident	38 Å²	38	95 Å²	95	19%	0.187	47%	0.465	C	S	.	.	H	α-helix	trans	-60.8	-40.4	175.5	-173.4	-168.4	-167.2	0	0	111.6	S31 F32 L33 T38 S42	S31-M35 WeakPolarHBondContact O-CB 3.44Å; S31-M35 PolarHBondContact O-N 3.18Å; F32-M35 WeakPolarHBondContact O-CB 3.42Å; F32-M35 PolarHBondContact O-N 2.91Å; L33-M35 VanDerWaalsContact C-N 3.31Å; L33-M35 PolarHBondContact O-N 3.06Å; M35-T38 PolarHBondContact O-N 2.88Å; M35-T38 PolarHBondContact O-OG1 2.87Å; M35-S42 PolarHBondContact O-OG 3.41Å
36	L	85.2	Confident	84.1	Confident	102 Å²	102	88.3 Å²	88.3	53%	0.534	44%	0.44	S	S	.	.	H	α-helix	trans	-73.2	-33.5	-179.7	-137.4	153.3	0	0	0	112.3	F32 L33 L34 T38 F39	F32-L36 HydrophobicContact CD1-CD1 4.43Å; F32-L36 HydrophobicContact CE1-CD1 3.77Å; F32-L36 HydrophobicContact CZ-CD1 4.18Å; F32-L36 PolarHBondContact O-N 2.8Å; L33-L36 PolarHBondContact O-N 3.43Å; L34-L36 VanDerWaalsContact C-N 3.3Å; L34-L36 PolarHBondContact O-N 3.17Å; L36-T38 VanDerWaalsContact C-N 3.33Å; L36-F39 VanDerWaalsContact O-CB 3.24Å; L36-F39 WeakPolarHBondContact O-CB 3.34Å
37	I	87.4	Confident	84.1	Confident	124 Å²	124	87.2 Å²	87.2	64%	0.636	44%	0.435	S	S	*	.	H	α-helix	trans	-69.4	-32.7	174	-68.4	166.2	0	0	0	111.2	L33 L34	L33-I37 HydrophobicContact CD1-CD1 4.43Å; L33-I37 HydrophobicContact CG-CD1 4.03Å; L33-I37 WeakPolarHBondContact O-CG1 3.44Å; L33-I37 PolarHBondContact O-N 2.99Å; L34-I37 PolarHBondContact O-N 3.24Å
38	T	83.9	Confident	84.3	Confident	61 Å²	61	87.7 Å²	87.7	37%	0.374	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	28.9	-173.8	54.6	0	0	0	0	113.7	L34 M35 L36 P40 V41 S42	L34-T38 PolarHBondContact O-N 3Å; L34-T38 VanDerWaalsContact O-N 3.13Å; L34-T38 PolarHBondContact O-OG1 3.22Å; M35-T38 PolarHBondContact O-N 2.88Å; M35-T38 PolarHBondContact O-OG1 2.87Å; L36-T38 VanDerWaalsContact C-N 3.33Å; T38-P40 VanDerWaalsContact C-N 3.34Å; T38-P40 WeakPolarHBondContact O-CD 3.44Å; T38-V41 PolarHBondContact O-N 3.19Å; T38-S42 PolarHBondContact O-N 3.42Å; T38-S42 VanDerWaalsContact O-N 3.12Å; T38-S42 PolarHBondContact O-OG 2.82Å; T38-S42 WeakPolarHBondContact OG1-CB 3.4Å
39	F	71.8	Confident	84.6	Confident	138 Å²	138	90.5 Å²	90.5	61%	0.605	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	30.1	-155.9	-171.9	-106.1	0	0	0	119.3	L36	L36-F39 VanDerWaalsContact O-CB 3.24Å; L36-F39 WeakPolarHBondContact O-CB 3.34Å
40	P	81.8	Confident	84.8	Confident	98 Å²	98	84.8 Å²	84.8	64%	0.636	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.4	-17.5	137.4	33.4	-28.8	0	0	0	113.9	T38 I43	T38-P40 VanDerWaalsContact C-N 3.34Å; T38-P40 WeakPolarHBondContact O-CD 3.44Å; P40-I43 WeakPolarHBondContact O-CG2 3.38Å
41	V	85.2	Confident	85.1	Confident	99 Å²	99	85.6 Å²	85.6	60%	0.6	43%	0.425	S	S	*	.	H	α-helix	trans	-78	-39.3	-177.3	-178.1	0	0	0	0	110.7	T38 M45	T38-V41 PolarHBondContact O-N 3.19Å; V41-M45 PolarHBondContact O-N 3.24Å
42	S	83	Confident	85.5	Confident	10 Å²	10	93 Å²	93	7%	0.07	46%	0.459	C	S	.	.	H	α-helix	trans	-63.1	-45.1	-179.1	57.1	0	0	0	0	112.3	M35 T38 W44 M45 C46	M35-S42 PolarHBondContact O-OG 3.41Å; T38-S42 PolarHBondContact O-N 3.42Å; T38-S42 VanDerWaalsContact O-N 3.12Å; T38-S42 PolarHBondContact O-OG 2.82Å; T38-S42 WeakPolarHBondContact OG1-CB 3.4Å; S42-W44 VanDerWaalsContact C-N 3.35Å; S42-W44 PolarHBondContact O-N 3.26Å; S42-M45 PolarHBondContact O-N 3.15Å; S42-M45 VanDerWaalsContact O-N 3.13Å; S42-C46 PolarHBondContact O-N 2.83Å; S42-C46 PolarHBondContact O-SG 2.96Å
43	I	84.6	Confident	85.9	Confident	78 Å²	78	91 Å²	91	40%	0.4	45%	0.449	S	S	.	.	H	α-helix	trans	-64.9	-38.7	-175.6	-158.7	160.3	0	0	0	112.3	P40 M45 C46 L47	P40-I43 WeakPolarHBondContact O-CG2 3.38Å; I43-M45 VanDerWaalsContact C-N 3.32Å; I43-M45 PolarHBondContact O-N 2.75Å; I43-C46 PolarHBondContact O-N 3.27Å; I43-L47 WeakPolarHBondContact O-CG 3.47Å; I43-L47 PolarHBondContact O-N 2.97Å; I43-L47 VanDerWaalsContact O-N 3.16Å
44	W	84.6	Confident	86.2	Confident	215 Å²	215	87.7 Å²	87.7	81%	0.814	43%	0.431	S	S	*	.	H	α-helix	trans	-64.6	-38	175.1	-168.7	-88.4	0	0	0	111.7	S42	S42-W44 VanDerWaalsContact C-N 3.35Å; S42-W44 PolarHBondContact O-N 3.26Å
45	M	81.7	Confident	86.7	Confident	132 Å²	132	87.5 Å²	87.5	65%	0.65	42%	0.424	S	S	*	.	H	α-helix	trans	-71.5	-29.2	175.4	-76.7	-69.9	-173.4	0	0	113.4	V41 S42 I43	V41-M45 PolarHBondContact O-N 3.24Å; S42-M45 PolarHBondContact O-N 3.15Å; S42-M45 VanDerWaalsContact O-N 3.13Å; I43-M45 VanDerWaalsContact C-N 3.32Å; I43-M45 PolarHBondContact O-N 2.75Å
46	C	84.2	Confident	87.1	Confident	1 Å²	1	85.7 Å²	85.7	1%	0.007	42%	0.415	C	S	.	.	H	α-helix	trans	-75.4	-33.6	-180	-64.8	0	0	0	0	112.7	S42 I43 K48 L76 V77 P79	S42-C46 PolarHBondContact O-N 2.83Å; S42-C46 PolarHBondContact O-SG 2.96Å; I43-C46 PolarHBondContact O-N 3.27Å; C46-K48 PolarHBondContact O-N 3.18Å; C46-L76 HydrophobicContact CB-CD1 3.51Å; C46-L76 HydrophobicContact CB-CG 4.44Å; C46-V77 WeakPolarHBondContact CA-O 3.29Å; C46-V77 WeakPolarHBondContact CB-O 3.29Å; C46-V77 PolarHBondContact O-N 2.99Å; C46-P79 WeakPolarHBondContact SG-CD 3.17Å
47	L	87.8	Confident	87.4	Confident	82 Å²	82	81 Å²	81	43%	0.429	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	107	179.9	-68.2	174.9	0	0	0	109.7	I43 L76	I43-L47 WeakPolarHBondContact O-CG 3.47Å; I43-L47 PolarHBondContact O-N 2.97Å; I43-L47 VanDerWaalsContact O-N 3.16Å; L47-L76 HydrophobicContact CD2-CD1 4.12Å
48	K	88	Confident	87.6	Confident	85 Å²	85	75.8 Å²	75.8	37%	0.37	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	137.2	172.4	-75.7	-170.2	172.8	166.7	0	110.9	C46 I75 F84	C46-K48 PolarHBondContact O-N 3.18Å; K48-I75 HydrophobicContact CB-CG1 4.21Å; K48-I75 PolarHBondContact N-O 2.84Å; K48-I75 WeakPolarHBondContact O-CG1 3Å; K48-I75 PolarHBondContact O-N 3.33Å; K48-F84 HydrophobicContact CD-CE1 3.74Å; K48-F84 HydrophobicContact CD-CE2 4.25Å; K48-F84 HydrophobicContact CD-CZ 3.5Å; K48-F84 VanDerWaalsContact NZ-CE1 3.3Å; K48-F84 VanDerWaalsContact NZ-CZ 3.35Å
49	I	90.7	Very high	87.9	Confident	122 Å²	122	74.7 Å²	74.7	63%	0.626	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	128.5	177.5	-59.5	163.5	0	0	0	108.3	L74	I49-L74 HydrophobicContact CD1-CD2 4.34Å; I49-L74 HydrophobicContact CG1-CD2 3.5Å; I49-L74 VanDerWaalsContact CG1-CD2 3.5Å; I49-L74 HydrophobicContact CG1-CG 4.34Å
50	I	92.1	Very high	88.5	Confident	5 Å²	5	70.8 Å²	70.8	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	134.9	171.4	-57	165.2	0	0	0	108.4	E54 A56 G73 I75	I50-E54 HydrophobicContact CG2-CB 3.71Å; I50-E54 WeakPolarHBondContact CG2-O 3.49Å; I50-A56 HydrophobicContact CD1-CB 3.3Å; I50-A56 HydrophobicContact CG1-CB 4.16Å; I50-G73 PolarHBondContact N-O 2.87Å; I50-G73 PolarHBondContact O-N 2.8Å; I50-I75 HydrophobicContact CD1-CB 4.24Å; I50-I75 HydrophobicContact CD1-CD1 3.6Å; I50-I75 HydrophobicContact CD1-CG1 3.71Å; I50-I75 HydrophobicContact CD1-CG2 3.5Å; I50-I75 VanDerWaalsContact CD1-CG2 3.5Å; I50-I75 HydrophobicContact CG1-CD1 4.03Å; I50-I75 HydrophobicContact CG1-CG1 3.96Å; I50-I75 HydrophobicContact CG1-CG2 4.43Å
51	K	93.1	Very high	88.6	Confident	107 Å²	107	69.7 Å²	69.7	47%	0.465	32%	0.324	S	S	.	.			trans	-77	158	177.4	-60.1	178	-177.2	168.2	0	111.1	Y53 E54	K51-Y53 VanDerWaalsContact C-N 3.25Å; K51-Y53 HydrophobicContact CB-CD1 4.04Å; K51-Y53 HydrophobicContact CB-CE1 3.7Å; K51-Y53 HydrophobicContact CB-CE2 4.49Å; K51-Y53 HydrophobicContact CD-CE1 3.63Å; K51-Y53 HydrophobicContact CD-CE2 4.22Å; K51-Y53 WeakPolarHBondContact CD-OH 3.36Å; K51-Y53 HydrophobicContact CG-CE1 4.29Å; K51-Y53 PolarHBondContact NZ-OH 2.66Å; K51-Y53 PolarHBondContact O-N 3.05Å; K51-E54 HydrophobicContact CB-CG 4.37Å; K51-E54 PolarHBondContact O-N 2.87Å
52	E	91.6	Very high	88.5	Confident	162 Å²	162	68.3 Å²	68.3	76%	0.757	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-36.8	-176	-169.2	173.6	-177.4	0	0	114.7	E54	E52-E54 VanDerWaalsContact C-N 3.31Å
53	Y	93.3	Very high	88.6	Confident	66 Å²	66	73.8 Å²	73.8	26%	0.259	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-1.7	-179.1	58.9	-94.2	0	0	0	113.8	K51 L89 R90	K51-Y53 VanDerWaalsContact C-N 3.25Å; K51-Y53 HydrophobicContact CB-CD1 4.04Å; K51-Y53 HydrophobicContact CB-CE1 3.7Å; K51-Y53 HydrophobicContact CB-CE2 4.49Å; K51-Y53 HydrophobicContact CD-CE1 3.63Å; K51-Y53 HydrophobicContact CD-CE2 4.22Å; K51-Y53 WeakPolarHBondContact CD-OH 3.36Å; K51-Y53 HydrophobicContact CG-CE1 4.29Å; K51-Y53 PolarHBondContact NZ-OH 2.66Å; K51-Y53 PolarHBondContact O-N 3.05Å; Y53-L89 PolarHBondContact O-N 3.39Å; Y53-R90 VanDerWaalsContact CD2-CZ 3.48Å; Y53-R90 VanDerWaalsContact CD2-NE 3.34Å; Y53-R90 VanDerWaalsContact CG-CZ 3.49Å; Y53-R90 VanDerWaalsContact CG-NE 3.28Å
54	E	94.6	Very high	88.4	Confident	29 Å²	29	72.5 Å²	72.5	14%	0.136	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	151.6	178.1	-66.8	172.9	-172.8	0	0	110.1	I50 K51 E52 K86 V87	I50-E54 HydrophobicContact CG2-CB 3.71Å; I50-E54 WeakPolarHBondContact CG2-O 3.49Å; K51-E54 HydrophobicContact CB-CG 4.37Å; K51-E54 PolarHBondContact O-N 2.87Å; E52-E54 VanDerWaalsContact C-N 3.31Å; E54-K86 IonicContact OE2-NZ 2.87Å; E54-V87 CarbonylContact C-O 3.54Å; E54-V87 WeakPolarHBondContact CA-O 3.29Å
55	R	93.7	Very high	87.7	Confident	84 Å²	84	66.8 Å²	66.8	32%	0.317	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143.9	167.5	-65.1	-67	172.9	148.9	-5.7	110	A69 K70 G71 K86 V87 L89 A122	R55-A69 HydrophobicContact CB-CB 4.05Å; R55-K70 WeakPolarHBondContact CD-O 3.38Å; R55-G71 VanDerWaalsContact NH1-CA 3.25Å; R55-K86 WeakPolarHBondContact O-CA 3.49Å; R55-V87 PolarHBondContact N-O 3.49Å; R55-V87 PolarHBondContact O-N 3.25Å; R55-L89 HydrophobicContact CG-CD1 3.45Å; R55-L89 VanDerWaalsContact CG-CD1 3.45Å; R55-L89 HydrophobicContact CG-CD2 4.08Å; R55-L89 HydrophobicContact CG-CG 3.88Å; R55-A122 HydrophobicContact CB-CB 3.95Å
56	A	92.2	Very high	87.1	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129.7	174.7	0	0	0	0	0	111.3	I50 K70 I75 V85	I50-A56 HydrophobicContact CD1-CB 3.3Å; I50-A56 HydrophobicContact CG1-CB 4.16Å; A56-K70 PolarHBondContact O-N 2.81Å; A56-I75 HydrophobicContact CB-CD1 3.98Å; A56-V85 WeakPolarHBondContact CA-O 3.35Å
57	V	91.4	Very high	86.5	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.018	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.6	167.1	-175.2	0	0	0	0	107.3	F59 A69 F84 V85 A122 V123 V126	V57-F59 HydrophobicContact CB-CE2 4.24Å; V57-F59 HydrophobicContact CB-CZ 4.49Å; V57-F59 HydrophobicContact CG1-CD2 4.48Å; V57-F59 HydrophobicContact CG1-CE1 4.27Å; V57-F59 HydrophobicContact CG1-CE2 3.74Å; V57-F59 HydrophobicContact CG1-CZ 3.61Å; V57-A69 HydrophobicContact CG2-CB 4.43Å; V57-F84 CarbonylContact O-C 3.49Å; V57-F84 VanDerWaalsContact O-CA 3.26Å; V57-F84 WeakPolarHBondContact O-CA 3.49Å; V57-V85 PolarHBondContact N-O 2.91Å; V57-V85 PolarHBondContact O-N 3.4Å; V57-A122 HydrophobicContact CG2-CB 3.92Å; V57-A122 WeakPolarHBondContact CG2-O 3.43Å; V57-V123 HydrophobicContact CG2-CG2 4.36Å; V57-V126 HydrophobicContact CG2-CG2 4.27Å
58	V	90.5	Very high	86.1	Confident	15 Å²	15	71.6 Å²	71.6	9%	0.091	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.7	-177.7	-175.2	0	0	0	0	109.6	Q65 K70 D82 F84	V58-Q65 PolarHBondContact O-N 2.95Å; V58-K70 HydrophobicContact CG2-CG 4.29Å; V58-D82 HydrophobicContact CG1-CB 4.04Å; V58-F84 HydrophobicContact CG2-CB 4.12Å
59	F	89.5	Confident	85.9	Confident	37 Å²	37	68.8 Å²	68.8	16%	0.162	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	120.4	174.1	-58.9	-84.5	0	0	0	109.3	V57 R63 I64 D82 V83 V85 V126	V57-F59 HydrophobicContact CB-CE2 4.24Å; V57-F59 HydrophobicContact CB-CZ 4.49Å; V57-F59 HydrophobicContact CG1-CD2 4.48Å; V57-F59 HydrophobicContact CG1-CE1 4.27Å; V57-F59 HydrophobicContact CG1-CE2 3.74Å; V57-F59 HydrophobicContact CG1-CZ 3.61Å; F59-R63 CarbonylContact C-O 3.58Å; F59-R63 WeakPolarHBondContact CA-O 3.34Å; F59-I64 HydrophobicContact CD1-CG1 3.93Å; F59-I64 HydrophobicContact CE1-CD1 4.31Å; F59-I64 HydrophobicContact CE1-CG1 3.63Å; F59-D82 CarbonylContact O-C 3.55Å; F59-D82 WeakPolarHBondContact O-CA 3.45Å; F59-V83 HydrophobicContact CB-CB 4.46Å; F59-V83 PolarHBondContact N-O 3.46Å; F59-V83 PolarHBondContact O-N 3.27Å; F59-V85 HydrophobicContact CD2-CG2 4.38Å; F59-V85 HydrophobicContact CE2-CB 4.43Å; F59-V85 HydrophobicContact CE2-CG2 3.89Å; F59-V126 HydrophobicContact CE2-CG1 3.83Å; F59-V126 HydrophobicContact CZ-CB 4.39Å; F59-V126 HydrophobicContact CZ-CG1 3.57Å
60	R	85.6	Confident	85.7	Confident	56 Å²	56	66.9 Å²	66.9	21%	0.211	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	112.2	174.4	178.6	165.6	-66.5	176.6	1.6	109	G62 R63 I81 D82	R60-G62 PolarHBondContact O-N 3.3Å; R60-R63 PolarHBondContact N-O 3.22Å; R60-R63 PolarHBondContact O-N 3.32Å; R60-I81 HydrophobicContact CG-CG2 3.9Å; R60-D82 VanDerWaalsContact CB-OD1 3.29Å; R60-D82 WeakPolarHBondContact CB-OD1 3.36Å; R60-D82 VanDerWaalsContact CG-OD1 3.29Å; R60-D82 WeakPolarHBondContact CG-OD1 3.37Å; R60-D82 IonicContact CZ-OD1 3.47Å; R60-D82 IonicContact CZ-OD2 3.56Å; R60-D82 IonicContact NE-OD1 3.61Å; R60-D82 PolarHBondContact NE-OD1 3.45Å; R60-D82 IonicContact NE-OD2 3.82Å; R60-D82 IonicContact NH2-OD1 2.75Å; R60-D82 IonicContact NH2-OD2 2.8Å; R60-D82 PolarHBondContact NH2-OD2 2.91Å
61	L	84.4	Confident	85.4	Confident	76 Å²	76	68 Å²	68	40%	0.398	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	43.4	-175.3	-58.4	173	0	0	0	112.3	L20 L27 R63 I81	L20-L61 HydrophobicContact CD2-CD1 4.32Å; L27-L61 HydrophobicContact CD1-CD2 4.14Å; L61-R63 VanDerWaalsContact C-N 3.27Å; L61-R63 PolarHBondContact O-N 2.91Å; L61-I81 HydrophobicContact CD1-CG2 4.43Å; L61-I81 HydrophobicContact CD2-CG2 3.9Å; L61-I81 HydrophobicContact CG-CG2 3.77Å; L61-I81 PolarHBondContact N-O 3.13Å
62	G	82.8	Confident	85.2	Confident	69 Å²	69	65.7 Å²	65.7	71%	0.711	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	0.6	-179.2	0	0	0	0	0	115.7	R60	R60-G62 PolarHBondContact O-N 3.3Å
63	R	84.1	Confident	85.1	Confident	125 Å²	125	59.6 Å²	59.6	47%	0.472	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	139.3	177.9	-61.8	179.1	177.2	-175.2	-6.8	111.4	S18 F59 R60 L61 Q65	S18-R63 PolarHBondContact O-NH1 3.4Å; S18-R63 PolarHBondContact OG-NH1 3.31Å; S18-R63 PolarHBondContact OG-NH2 2.87Å; S18-R63 VanDerWaalsContact OG-NH2 3.13Å; F59-R63 CarbonylContact C-O 3.58Å; F59-R63 WeakPolarHBondContact CA-O 3.34Å; R60-R63 PolarHBondContact N-O 3.22Å; R60-R63 PolarHBondContact O-N 3.32Å; L61-R63 VanDerWaalsContact C-N 3.27Å; L61-R63 PolarHBondContact O-N 2.91Å; R63-Q65 PolarHBondContact O-N 2.84Å
64	I	81.8	Confident	84.9	Confident	51 Å²	51	62.3 Å²	62.3	26%	0.262	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	119.8	174	-61.4	168.8	0	0	0	108.4	F59 A66 V123 A127	F59-I64 HydrophobicContact CD1-CG1 3.93Å; F59-I64 HydrophobicContact CE1-CD1 4.31Å; F59-I64 HydrophobicContact CE1-CG1 3.63Å; I64-A66 WeakPolarHBondContact CG2-O 3.26Å; I64-V123 HydrophobicContact CD1-CG1 4.14Å; I64-V123 HydrophobicContact CG2-CG1 4.4Å; I64-A127 HydrophobicContact CD1-CB 4.16Å
65	Q	69.4	Low	84.5	Confident	95 Å²	95	61.7 Å²	61.7	44%	0.444	33%	0.334	S	S	.	.	S	Bend	trans	-75.6	-30.4	-174.4	-158	-137.3	-2.3	0	0	112.9	V58 R63	V58-Q65 PolarHBondContact O-N 2.95Å; R63-Q65 PolarHBondContact O-N 2.84Å
66	A	67.9	Low	84.2	Confident	32 Å²	32	62.5 Å²	62.5	26%	0.264	34%	0.344	S	S	.	.			trans	-138.2	134.9	-174.5	0	0	0	0	0	110.3	I64 K68	I64-A66 WeakPolarHBondContact CG2-O 3.26Å; A66-K68 WeakPolarHBondContact CB-O 3.36Å; A66-K68 PolarHBondContact O-N 2.91Å
67	D	72.6	Confident	84	Confident	116 Å²	116	63.1 Å²	63.1	62%	0.62	35%	0.348	S	S	*	.	S	Bend	trans	-57.7	-29.9	174.8	-176.3	51.9	0	0	0	112.2
68	K	79.3	Confident	83.7	Confident	169 Å²	169	64.1 Å²	64.1	74%	0.735	35%	0.353	S	S	*	.	S	Bend	trans	-108.7	139.9	175.2	-64.5	-174.3	179.6	-176	0	111.4	A66	A66-K68 WeakPolarHBondContact CB-O 3.36Å; A66-K68 PolarHBondContact O-N 2.91Å
69	A	84.5	Confident	83.2	Confident	26 Å²	26	65.9 Å²	65.9	22%	0.215	37%	0.365	C	S	.	.			trans	-58	143	172.7	0	0	0	0	0	111.2	R55 V57 G71 A122 V123	R55-A69 HydrophobicContact CB-CB 4.05Å; V57-A69 HydrophobicContact CG2-CB 4.43Å; A69-G71 PolarHBondContact O-N 2.89Å; A69-A122 HydrophobicContact CB-CB 3.99Å; A69-V123 HydrophobicContact CB-CG2 4.04Å
70	K	85.4	Confident	82.8	Confident	81 Å²	81	70.2 Å²	70.2	35%	0.352	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-67.1	134.3	179.4	-64.6	-69	-175.7	175.3	0	109.3	R55 A56 V58 I75	R55-K70 WeakPolarHBondContact CD-O 3.38Å; A56-K70 PolarHBondContact O-N 2.81Å; V58-K70 HydrophobicContact CG2-CG 4.29Å; K70-I75 HydrophobicContact CB-CG2 4.07Å
71	G	85.4	Confident	82.8	Confident	28 Å²	28	68 Å²	68	29%	0.289	39%	0.391	S	S	.	.			trans	-71.6	175.9	-179.5	0	0	0	0	0	114	R55 A69	R55-G71 VanDerWaalsContact NH1-CA 3.25Å; A69-G71 PolarHBondContact O-N 2.89Å
72	P	88.3	Confident	83	Confident	60 Å²	60	65 Å²	65	39%	0.39	38%	0.375	S	S	.	.	S	Bend	trans	-66.4	157.6	178.2	31.2	-36.6	0	0	0	111.4
73	G	91.1	Very high	83.3	Confident	33 Å²	33	66.2 Å²	66.2	34%	0.34	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	112.5	-159.2	-175.4	0	0	0	0	0	113.1	I50	I50-G73 PolarHBondContact N-O 2.87Å; I50-G73 PolarHBondContact O-N 2.8Å
74	L	87.8	Confident	83.6	Confident	123 Å²	123	62.7 Å²	62.7	64%	0.644	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	121.9	-178.2	-74.8	161.6	0	0	0	110.4	I49	I49-L74 HydrophobicContact CD1-CD2 4.34Å; I49-L74 HydrophobicContact CG1-CD2 3.5Å; I49-L74 VanDerWaalsContact CG1-CD2 3.5Å; I49-L74 HydrophobicContact CG1-CG 4.34Å
75	I	87.9	Confident	84.1	Confident	16 Å²	16	62.8 Å²	62.8	8%	0.082	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.2	169.1	58.4	155.1	0	0	0	110	K48 I50 A56 K70 V77	K48-I75 HydrophobicContact CB-CG1 4.21Å; K48-I75 PolarHBondContact N-O 2.84Å; K48-I75 WeakPolarHBondContact O-CG1 3Å; K48-I75 PolarHBondContact O-N 3.33Å; I50-I75 HydrophobicContact CD1-CB 4.24Å; I50-I75 HydrophobicContact CD1-CD1 3.6Å; I50-I75 HydrophobicContact CD1-CG1 3.71Å; I50-I75 HydrophobicContact CD1-CG2 3.5Å; I50-I75 VanDerWaalsContact CD1-CG2 3.5Å; I50-I75 HydrophobicContact CG1-CD1 4.03Å; I50-I75 HydrophobicContact CG1-CG1 3.96Å; I50-I75 HydrophobicContact CG1-CG2 4.43Å; A56-I75 HydrophobicContact CB-CD1 3.98Å; K70-I75 HydrophobicContact CB-CG2 4.07Å; I75-V77 HydrophobicContact CD1-CG2 3.64Å; I75-V77 HydrophobicContact CG1-CG2 4.24Å
76	L	86	Confident	85.2	Confident	102 Å²	102	63 Å²	63	53%	0.534	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	115.6	172.1	-172.5	75	0	0	0	108.7	C46 L47	C46-L76 HydrophobicContact CB-CD1 3.51Å; C46-L76 HydrophobicContact CB-CG 4.44Å; L47-L76 HydrophobicContact CD2-CD1 4.12Å
77	V	88.1	Confident	86.4	Confident	13 Å²	13	62.1 Å²	62.1	8%	0.079	35%	0.35	C	S	.	.			trans	-113	122.4	175.8	-177.1	0	0	0	0	108.2	C46 I75 D82 F84	C46-V77 WeakPolarHBondContact CA-O 3.29Å; C46-V77 WeakPolarHBondContact CB-O 3.29Å; C46-V77 PolarHBondContact O-N 2.99Å; I75-V77 HydrophobicContact CD1-CG2 3.64Å; I75-V77 HydrophobicContact CG1-CG2 4.24Å; V77-D82 HydrophobicContact CG1-CB 3.64Å; V77-F84 HydrophobicContact CG1-CD1 3.98Å; V77-F84 HydrophobicContact CG2-CD1 4.16Å; V77-F84 HydrophobicContact CG2-CG 4.41Å
78	L	84.8	Confident	87.5	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.12	34%	0.337	C	S	.	.			trans	-75.2	130.6	177	-83.4	73.9	0	0	0	110.4	F28 D82	F28-L78 HydrophobicContact CE2-CD2 3.84Å; F28-L78 HydrophobicContact CZ-CD2 4Å; L78-D82 PolarHBondContact N-OD2 3.34Å; L78-D82 PolarHBondContact O-N 3.41Å
79	P	80.7	Confident	88.2	Confident	53 Å²	53	53.7 Å²	53.7	34%	0.344	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	147.8	175.5	27.4	-34.7	0	0	0	110.4	S31 C46 I81	S31-P79 PolarHBondContact OG-O 3.11Å; S31-P79 VanDerWaalsContact OG-O 3.1Å; C46-P79 WeakPolarHBondContact SG-CD 3.17Å; P79-I81 PolarHBondContact O-N 3.47Å
80	C	80.2	Confident	88.8	Confident	127 Å²	127	58.7 Å²	58.7	86%	0.858	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	-28.2	178.7	-50.2	0	0	0	0	117
81	I	85.8	Confident	89.4	Confident	11 Å²	11	58.6 Å²	58.6	6%	0.056	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-43.7	-175.8	-57.9	-178.3	0	0	0	112.1	F28 R60 L61 P79	F28-I81 HydrophobicContact CB-CD1 4.38Å; F28-I81 HydrophobicContact CD2-CD1 3.93Å; F28-I81 HydrophobicContact CG-CD1 4.48Å; R60-I81 HydrophobicContact CG-CG2 3.9Å; L61-I81 HydrophobicContact CD1-CG2 4.43Å; L61-I81 HydrophobicContact CD2-CG2 3.9Å; L61-I81 HydrophobicContact CG-CG2 3.77Å; L61-I81 PolarHBondContact N-O 3.13Å; P79-I81 PolarHBondContact O-N 3.47Å
82	D	89.2	Confident	89.9	Confident	13 Å²	13	59.9 Å²	59.9	7%	0.07	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.8	-173.9	-68.1	-19.2	0	0	0	109.6	V58 F59 R60 V77 L78	V58-D82 HydrophobicContact CG1-CB 4.04Å; F59-D82 CarbonylContact O-C 3.55Å; F59-D82 WeakPolarHBondContact O-CA 3.45Å; R60-D82 VanDerWaalsContact CB-OD1 3.29Å; R60-D82 WeakPolarHBondContact CB-OD1 3.36Å; R60-D82 VanDerWaalsContact CG-OD1 3.29Å; R60-D82 WeakPolarHBondContact CG-OD1 3.37Å; R60-D82 IonicContact CZ-OD1 3.47Å; R60-D82 IonicContact CZ-OD2 3.56Å; R60-D82 IonicContact NE-OD1 3.61Å; R60-D82 PolarHBondContact NE-OD1 3.45Å; R60-D82 IonicContact NE-OD2 3.82Å; R60-D82 IonicContact NH2-OD1 2.75Å; R60-D82 IonicContact NH2-OD2 2.8Å; R60-D82 PolarHBondContact NH2-OD2 2.91Å; V77-D82 HydrophobicContact CG1-CB 3.64Å; L78-D82 PolarHBondContact N-OD2 3.34Å; L78-D82 PolarHBondContact O-N 3.41Å
83	V	89.4	Confident	90.2	Very high	94 Å²	94	60.7 Å²	60.7	57%	0.57	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	134.1	168.9	179.4	0	0	0	0	107.3	F59	F59-V83 HydrophobicContact CB-CB 4.46Å; F59-V83 PolarHBondContact N-O 3.46Å; F59-V83 PolarHBondContact O-N 3.27Å
84	F	89.8	Confident	90.4	Very high	50 Å²	50	59.7 Å²	59.7	22%	0.219	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	141.3	177.1	72.8	-78.6	0	0	0	110.6	K48 V57 V58 V77 K86	K48-F84 HydrophobicContact CD-CE1 3.74Å; K48-F84 HydrophobicContact CD-CE2 4.25Å; K48-F84 HydrophobicContact CD-CZ 3.5Å; K48-F84 VanDerWaalsContact NZ-CE1 3.3Å; K48-F84 VanDerWaalsContact NZ-CZ 3.35Å; V57-F84 CarbonylContact O-C 3.49Å; V57-F84 VanDerWaalsContact O-CA 3.26Å; V57-F84 WeakPolarHBondContact O-CA 3.49Å; V58-F84 HydrophobicContact CG2-CB 4.12Å; V77-F84 HydrophobicContact CG1-CD1 3.98Å; V77-F84 HydrophobicContact CG2-CD1 4.16Å; V77-F84 HydrophobicContact CG2-CG 4.41Å; F84-K86 HydrophobicContact CD2-CG 4.06Å; F84-K86 HydrophobicContact CE2-CD 4.28Å; F84-K86 HydrophobicContact CE2-CG 3.89Å
85	V	92	Very high	90.8	Very high	54 Å²	54	59.4 Å²	59.4	33%	0.327	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.2	174.2	179.5	0	0	0	0	107.8	A56 V57 F59 V87 V126	A56-V85 WeakPolarHBondContact CA-O 3.35Å; V57-V85 PolarHBondContact N-O 2.91Å; V57-V85 PolarHBondContact O-N 3.4Å; F59-V85 HydrophobicContact CD2-CG2 4.38Å; F59-V85 HydrophobicContact CE2-CB 4.43Å; F59-V85 HydrophobicContact CE2-CG2 3.89Å; V85-V87 HydrophobicContact CG1-CG2 4.37Å; V85-V126 HydrophobicContact CB-CG1 4.35Å; V85-V126 HydrophobicContact CB-CG2 4.43Å; V85-V126 HydrophobicContact CG1-CG1 4.32Å; V85-V126 HydrophobicContact CG1-CG2 3.94Å; V85-V126 HydrophobicContact CG2-CG1 4.27Å
86	K	92.9	Very high	91.2	Very high	99 Å²	99	58.9 Å²	58.9	43%	0.43	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.8	174.2	-64.8	-175.8	174.5	-163.9	0	109.2	E54 R55 F84	E54-K86 IonicContact OE2-NZ 2.87Å; R55-K86 WeakPolarHBondContact O-CA 3.49Å; F84-K86 HydrophobicContact CD2-CG 4.06Å; F84-K86 HydrophobicContact CE2-CD 4.28Å; F84-K86 HydrophobicContact CE2-CG 3.89Å
87	V	94	Very high	91.7	Very high	13 Å²	13	56.6 Å²	56.6	8%	0.079	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	128.1	178.3	-176.5	0	0	0	0	108.4	E54 R55 V85 I119 A122 V126	E54-V87 CarbonylContact C-O 3.54Å; E54-V87 WeakPolarHBondContact CA-O 3.29Å; R55-V87 PolarHBondContact N-O 3.49Å; R55-V87 PolarHBondContact O-N 3.25Å; V85-V87 HydrophobicContact CG1-CG2 4.37Å; V87-I119 HydrophobicContact CG1-CB 4.28Å; V87-I119 HydrophobicContact CG1-CD1 3.52Å; V87-I119 HydrophobicContact CG1-CG1 4.49Å; V87-I119 HydrophobicContact CG1-CG2 3.97Å; V87-A122 HydrophobicContact CB-CB 3.84Å; V87-A122 HydrophobicContact CG1-CB 4.12Å; V87-A122 HydrophobicContact CG2-CB 3.98Å; V87-V126 HydrophobicContact CG2-CG2 3.59Å
88	D	95.3	Very high	92.1	Very high	66 Å²	66	58.8 Å²	58.8	35%	0.353	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	131.3	173.6	-163.9	-21.9	0	0	0	109.7	R90	D88-R90 VanDerWaalsContact OD1-CB 3.29Å; D88-R90 WeakPolarHBondContact OD1-CB 3.17Å; D88-R90 WeakPolarHBondContact OD1-CD 3.46Å; D88-R90 WeakPolarHBondContact OD1-CG 3.36Å; D88-R90 PolarHBondContact OD1-N 2.8Å
89	L	94.7	Very high	92.5	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.225	33%	0.328	C	S	.	.			trans	-93.7	-1.7	179.2	-60.1	-178.1	0	0	0	113.4	Y53 R55 I119	Y53-L89 PolarHBondContact O-N 3.39Å; R55-L89 HydrophobicContact CG-CD1 3.45Å; R55-L89 VanDerWaalsContact CG-CD1 3.45Å; R55-L89 HydrophobicContact CG-CD2 4.08Å; R55-L89 HydrophobicContact CG-CG 3.88Å; L89-I119 HydrophobicContact CD2-CG2 4.46Å; L89-I119 VanDerWaalsContact CD2-O 3.29Å; L89-I119 WeakPolarHBondContact CD2-O 3.37Å
90	R	96.9	Very high	93.2	Very high	130 Å²	130	62.5 Å²	62.5	49%	0.491	34%	0.341	S	S	.	.	S	Bend	trans	-68.4	158.7	179.7	-69.2	168.4	174.7	-177.1	-3.7	111.9	Y53 D88 V92	Y53-R90 VanDerWaalsContact CD2-CZ 3.48Å; Y53-R90 VanDerWaalsContact CD2-NE 3.34Å; Y53-R90 VanDerWaalsContact CG-CZ 3.49Å; Y53-R90 VanDerWaalsContact CG-NE 3.28Å; D88-R90 VanDerWaalsContact OD1-CB 3.29Å; D88-R90 WeakPolarHBondContact OD1-CB 3.17Å; D88-R90 WeakPolarHBondContact OD1-CD 3.46Å; D88-R90 WeakPolarHBondContact OD1-CG 3.36Å; D88-R90 PolarHBondContact OD1-N 2.8Å; R90-V92 PolarHBondContact O-N 3.38Å
91	T	96.4	Very high	93.9	Very high	79 Å²	79	56.8 Å²	56.8	49%	0.485	30%	0.302	S	S	.	.			trans	-68	125.7	172.9	-54.3	0	0	0	0	110	Y117	T91-Y117 CarbonylContact C-O 3.59Å; T91-Y117 WeakPolarHBondContact CA-O 3.34Å
92	V	95.9	Very high	94.4	Very high	56 Å²	56	61.3 Å²	61.3	34%	0.339	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	141.7	175	-179.6	0	0	0	0	108.7	R90 Y117	R90-V92 PolarHBondContact O-N 3.38Å; V92-Y117 HydrophobicContact CB-CE2 4.4Å; V92-Y117 PolarHBondContact N-O 3.22Å; V92-Y117 PolarHBondContact O-N 2.95Å; V92-Y117 VanDerWaalsContact O-N 3.11Å
93	T	96.1	Very high	94.7	Very high	77 Å²	77	60.9 Å²	60.9	47%	0.472	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.3	175.1	56.3	0	0	0	0	110.2	Y116	T93-Y116 HydrophobicContact CG2-CD1 3.56Å; T93-Y116 HydrophobicContact CG2-CE1 3.5Å
94	C	94.9	Very high	95	Very high	12 Å²	12	64.4 Å²	64.4	8%	0.081	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	106.5	178.6	-176	0	0	0	0	109.4	I96 V114 V115 Y117 F137	C94-I96 PolarHBondContact O-N 3.09Å; C94-V114 WeakPolarHBondContact O-CA 3.34Å; C94-V115 HydrophobicContact CB-CB 4.33Å; C94-V115 PolarHBondContact N-O 2.7Å; C94-V115 PolarHBondContact O-N 2.84Å; C94-Y117 HydrophobicContact CB-CD1 4.24Å; C94-Y117 HydrophobicContact CB-CE1 3.64Å; C94-F137 VanDerWaalsContact SG-CD2 3.52Å
95	N	96.6	Very high	95.2	Very high	116 Å²	116	65.3 Å²	65.3	62%	0.62	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	110.6	-178.1	-64.2	-39.2	0	0	0	109.3	F137	N95-F137 WeakPolarHBondContact O-CE2 3.4Å
96	I	96	Very high	95.2	Very high	6 Å²	6	67.2 Å²	67.2	3%	0.031	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.9	176.6	-57.8	167.8	0	0	0	108	C94 Q99 G113 V115 A140 Q141 L144	C94-I96 PolarHBondContact O-N 3.09Å; I96-Q99 HydrophobicContact CG2-CG 4.26Å; I96-G113 WeakPolarHBondContact CB-O 3.32Å; I96-G113 PolarHBondContact N-O 2.94Å; I96-V115 HydrophobicContact CD1-CG2 3.83Å; I96-V115 HydrophobicContact CG1-CG2 4.5Å; I96-A140 HydrophobicContact CD1-CB 3.85Å; I96-A140 HydrophobicContact CG1-CB 4.21Å; I96-Q141 HydrophobicContact CG2-CG 3.83Å; I96-L144 HydrophobicContact CB-CD2 4.39Å; I96-L144 HydrophobicContact CD1-CB 4.46Å; I96-L144 HydrophobicContact CD1-CD2 3.99Å; I96-L144 HydrophobicContact CG2-CD2 3.78Å
97	P	95.7	Very high	95.3	Very high	54 Å²	54	63.5 Å²	63.5	35%	0.351	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	156.8	176.7	28.3	-35	0	0	0	110.8	Q99 F137	P97-Q99 PolarHBondContact O-N 2.98Å; P97-Q99 PolarHBondContact O-NE2 2.76Å; P97-F137 VanDerWaalsContact CD-CE2 3.49Å; P97-F137 HydrophobicContact CG-CE2 4.5Å; P97-F137 HydrophobicContact CG-CZ 4.08Å
98	P	96.2	Very high	95.2	Very high	59 Å²	59	66 Å²	66	38%	0.383	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	124.3	179.8	-25.1	32.2	0	0	0	112.4	D112	P98-D112 HydrophobicContact CB-CB 4.34Å; P98-D112 HydrophobicContact CG-CB 4.03Å
99	Q	94.3	Very high	95.1	Very high	20 Å²	20	62.9 Å²	62.9	9%	0.093	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	126.6	177.7	-61.1	-55.6	-49.9	0	0	109.9	I96 P97 I101 Q110 V111 L144	I96-Q99 HydrophobicContact CG2-CG 4.26Å; P97-Q99 PolarHBondContact O-N 2.98Å; P97-Q99 PolarHBondContact O-NE2 2.76Å; Q99-I101 HydrophobicContact CB-CG2 4.44Å; Q99-I101 PolarHBondContact O-N 3.09Å; Q99-Q110 VanDerWaalsContact O-CA 3.27Å; Q99-Q110 WeakPolarHBondContact O-CA 3.06Å; Q99-V111 PolarHBondContact N-O 3.12Å; Q99-V111 PolarHBondContact O-N 3.29Å; Q99-L144 HydrophobicContact CG-CD2 4.35Å
100	E	95.2	Very high	95.2	Very high	134 Å²	134	64.1 Å²	64.1	63%	0.626	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78	117.7	168.8	-171.9	167.3	-170.5	0	0	109.4	Q110	E100-Q110 HydrophobicContact CB-CG 4.36Å
101	I	95.1	Very high	95.1	Very high	7 Å²	7	58 Å²	58	4%	0.036	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	143.6	-177.5	51.8	157	0	0	0	110	Q99 T103 T108 T109 V111 R145 L148 I156	Q99-I101 HydrophobicContact CB-CG2 4.44Å; Q99-I101 PolarHBondContact O-N 3.09Å; I101-T103 HydrophobicContact CD1-CG2 4.15Å; I101-T108 WeakPolarHBondContact O-CA 3.2Å; I101-T109 WeakPolarHBondContact CD1-OG1 3.41Å; I101-T109 VanDerWaalsContact CG1-O 3.23Å; I101-T109 WeakPolarHBondContact CG1-O 3.29Å; I101-T109 WeakPolarHBondContact CG1-OG1 3.11Å; I101-T109 PolarHBondContact N-O 3.39Å; I101-T109 PolarHBondContact O-N 3.42Å; I101-V111 HydrophobicContact CD1-CG2 3.8Å; I101-V111 HydrophobicContact CG1-CG2 4.27Å; I101-R145 HydrophobicContact CG2-CB 4.22Å; I101-R145 HydrophobicContact CG2-CG 3.76Å; I101-L148 HydrophobicContact CD1-CB 3.44Å; I101-L148 VanDerWaalsContact CD1-CB 3.44Å; I101-L148 HydrophobicContact CD1-CD1 3.9Å; I101-L148 HydrophobicContact CD1-CG 4.28Å; I101-I156 HydrophobicContact CD1-CD1 4.4Å
102	L	96	Very high	95.1	Very high	105 Å²	105	55.2 Å²	55.2	55%	0.55	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.4	163.4	-171.6	69.6	0	0	0	107.6	S106 T108	L102-S106 VanDerWaalsContact CD1-C 3.43Å; L102-T108 HydrophobicContact CD1-CG2 3.93Å
103	T	95.1	Very high	95.1	Very high	4 Å²	4	52.8 Å²	52.8	3%	0.025	28%	0.283	C	S	.	.			trans	-73.9	169.3	176.6	56.9	0	0	0	0	111	I101 D105 S106 V107 T109 Q151 I156	I101-T103 HydrophobicContact CD1-CG2 4.15Å; T103-D105 WeakPolarHBondContact CB-OD1 3.44Å; T103-D105 PolarHBondContact O-N 2.84Å; T103-D105 VanDerWaalsContact O-N 3.14Å; T103-D105 PolarHBondContact OG1-OD1 2.96Å; T103-S106 PolarHBondContact O-N 3.34Å; T103-V107 PolarHBondContact N-O 3.09Å; T103-V107 WeakPolarHBondContact OG1-CB 3.49Å; T103-V107 PolarHBondContact OG1-N 3.46Å; T103-V107 PolarHBondContact OG1-O 3.17Å; T103-T109 HydrophobicContact CG2-CG2 4.25Å; T103-Q151 WeakPolarHBondContact CB-O 3.41Å; T103-I156 HydrophobicContact CG2-CD1 3.56Å
104	R	95.4	Very high	95.1	Very high	168 Å²	168	49.7 Å²	49.7	63%	0.634	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-29	-178.2	-169.6	-179.5	72.5	149.4	0.4	113.7	S106 G149 T150 Q151 T152	R104-S106 PolarHBondContact O-N 2.81Å; R104-G149 PolarHBondContact N-O 2.97Å; R104-T150 WeakPolarHBondContact CD-O 3.4Å; R104-Q151 WeakPolarHBondContact CB-O 3.37Å; R104-Q151 PolarHBondContact N-O 3.37Å; R104-T152 HydrophobicContact CB-CG2 4.29Å
105	D	94.5	Very high	95.3	Very high	70 Å²	70	49.2 Å²	49.2	37%	0.374	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	16.8	176.5	51.4	-15.6	0	0	0	113.4	T103 V107 L153	T103-D105 WeakPolarHBondContact CB-OD1 3.44Å; T103-D105 PolarHBondContact O-N 2.84Å; T103-D105 VanDerWaalsContact O-N 3.14Å; T103-D105 PolarHBondContact OG1-OD1 2.96Å; D105-V107 VanDerWaalsContact C-N 3.26Å; D105-V107 PolarHBondContact O-N 3Å; D105-L153 PolarHBondContact OD1-N 2.95Å; D105-L153 WeakPolarHBondContact OD2-CB 3.17Å; D105-L153 PolarHBondContact OD2-N 3.07Å; D105-L153 VanDerWaalsContact OD2-N 3.15Å
106	S	93.2	Very high	95.3	Very high	93 Å²	93	45.7 Å²	45.7	65%	0.65	24%	0.24	S	C	*	.	S	Bend	trans	61.3	31.1	177.8	-56.8	0	0	0	0	113.8	L102 T103 R104	L102-S106 VanDerWaalsContact CD1-C 3.43Å; T103-S106 PolarHBondContact O-N 3.34Å; R104-S106 PolarHBondContact O-N 2.81Å
107	V	93.4	Very high	95.4	Very high	21 Å²	21	45.7 Å²	45.7	13%	0.127	24%	0.239	C	C	.	.			trans	-100.5	128.3	175.3	-175.5	0	0	0	0	109.7	T103 D105 T109 L153 L196	T103-V107 PolarHBondContact N-O 3.09Å; T103-V107 WeakPolarHBondContact OG1-CB 3.49Å; T103-V107 PolarHBondContact OG1-N 3.46Å; T103-V107 PolarHBondContact OG1-O 3.17Å; D105-V107 VanDerWaalsContact C-N 3.26Å; D105-V107 PolarHBondContact O-N 3Å; V107-T109 HydrophobicContact CG1-CG2 3.92Å; V107-L153 HydrophobicContact CB-CD2 4.43Å; V107-L153 HydrophobicContact CG1-CD2 3.98Å; V107-L196 HydrophobicContact CB-CD1 4.45Å; V107-L196 HydrophobicContact CG1-CD1 3.48Å; V107-L196 VanDerWaalsContact CG1-CD1 3.48Å; V107-L196 HydrophobicContact CG2-CD1 4.13Å
108	T	93.4	Very high	95.4	Very high	65 Å²	65	47.2 Å²	47.2	40%	0.399	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	124.2	172.3	54.2	0	0	0	0	109.4	I101 L102 P193	I101-T108 WeakPolarHBondContact O-CA 3.2Å; L102-T108 HydrophobicContact CD1-CG2 3.93Å; T108-P193 WeakPolarHBondContact O-CD 3.45Å
109	T	93.1	Very high	95.4	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.8	177.4	64.2	0	0	0	0	110.1	I101 T103 V107 L153 R191 I192	I101-T109 WeakPolarHBondContact CD1-OG1 3.41Å; I101-T109 VanDerWaalsContact CG1-O 3.23Å; I101-T109 WeakPolarHBondContact CG1-O 3.29Å; I101-T109 WeakPolarHBondContact CG1-OG1 3.11Å; I101-T109 PolarHBondContact N-O 3.39Å; I101-T109 PolarHBondContact O-N 3.42Å; T103-T109 HydrophobicContact CG2-CG2 4.25Å; V107-T109 HydrophobicContact CG1-CG2 3.92Å; T109-L153 HydrophobicContact CG2-CD1 4.01Å; T109-R191 WeakPolarHBondContact CA-O 3.47Å; T109-I192 HydrophobicContact CG2-CG1 4.27Å
110	Q	95.2	Very high	95.4	Very high	69 Å²	69	48.4 Å²	48.4	32%	0.322	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.3	172.2	-67.8	-176.2	-6.9	0	0	109.5	Q99 E100 R191	Q99-Q110 VanDerWaalsContact O-CA 3.27Å; Q99-Q110 WeakPolarHBondContact O-CA 3.06Å; E100-Q110 HydrophobicContact CB-CG 4.36Å; Q110-R191 HydrophobicContact CB-CB 4.24Å; Q110-R191 PolarHBondContact N-O 3.09Å; Q110-R191 PolarHBondContact O-N 3.39Å
111	V	95.5	Very high	95.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.7	-178.7	-174.2	0	0	0	0	109.9	Q99 I101 L148 I187 D189 V190	Q99-V111 PolarHBondContact N-O 3.12Å; Q99-V111 PolarHBondContact O-N 3.29Å; I101-V111 HydrophobicContact CD1-CG2 3.8Å; I101-V111 HydrophobicContact CG1-CG2 4.27Å; V111-L148 HydrophobicContact CB-CD1 3.66Å; V111-L148 HydrophobicContact CG1-CD1 3.56Å; V111-L148 HydrophobicContact CG2-CD1 3.99Å; V111-I187 HydrophobicContact CG1-CG2 3.68Å; V111-D189 WeakPolarHBondContact CA-O 3.44Å; V111-V190 HydrophobicContact CG1-CG2 4.15Å; V111-V190 HydrophobicContact CG2-CB 4.45Å; V111-V190 HydrophobicContact CG2-CG1 4.11Å; V111-V190 HydrophobicContact CG2-CG2 4.12Å
112	D	95.6	Very high	95.2	Very high	21 Å²	21	43.2 Å²	43.2	11%	0.112	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	164.2	168.2	73.5	-8.7	0	0	0	111.2	P98 K188 D189	P98-D112 HydrophobicContact CB-CB 4.34Å; P98-D112 HydrophobicContact CG-CB 4.03Å; D112-K188 PolarHBondContact O-N 2.77Å; D112-K188 WeakPolarHBondContact OD1-CB 3.46Å; D112-K188 IonicContact OD2-NZ 3.62Å; D112-D189 PolarHBondContact N-O 2.82Å; D112-D189 VanDerWaalsContact N-O 3.15Å; D112-D189 WeakPolarHBondContact OD1-CA 3.25Å; D112-D189 WeakPolarHBondContact OD1-CB 3.45Å; D112-D189 PolarHBondContact OD1-N 3.24Å
113	G	96.2	Very high	95	Very high	5 Å²	5	38.8 Å²	38.8	5%	0.052	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	171.9	-175.3	0	0	0	0	0	112.5	I96 E186	I96-G113 WeakPolarHBondContact CB-O 3.32Å; I96-G113 PolarHBondContact N-O 2.94Å; G113-E186 CarbonylContact C-O 3.57Å; G113-E186 WeakPolarHBondContact CA-O 3.29Å
114	V	96.9	Very high	94.9	Very high	13 Å²	13	40 Å²	40	8%	0.079	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	137.7	178.2	58.4	0	0	0	0	110.1	C94 Y116 V185 E186	C94-V114 WeakPolarHBondContact O-CA 3.34Å; V114-Y116 HydrophobicContact CB-CE2 4.36Å; V114-Y116 HydrophobicContact CG1-CD2 4.42Å; V114-Y116 HydrophobicContact CG1-CE2 3.57Å; V114-Y116 HydrophobicContact CG2-CD2 4.31Å; V114-Y116 HydrophobicContact CG2-CE2 3.92Å; V114-V185 WeakPolarHBondContact O-CA 3.45Å; V114-E186 HydrophobicContact CG1-CB 3.75Å; V114-E186 PolarHBondContact N-O 2.84Å; V114-E186 PolarHBondContact O-N 3.37Å
115	V	97.8	Very high	94.8	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.4	175.2	-176.3	0	0	0	0	108.4	C94 I96 Y117 A140 L171 V182 V185	C94-V115 HydrophobicContact CB-CB 4.33Å; C94-V115 PolarHBondContact N-O 2.7Å; C94-V115 PolarHBondContact O-N 2.84Å; I96-V115 HydrophobicContact CD1-CG2 3.83Å; I96-V115 HydrophobicContact CG1-CG2 4.5Å; V115-Y117 HydrophobicContact CG1-CD1 4.17Å; V115-A140 HydrophobicContact CG2-CB 3.96Å; V115-L171 HydrophobicContact CG1-CD1 4.44Å; V115-L171 HydrophobicContact CG2-CD1 4.08Å; V115-V182 HydrophobicContact CG1-CG1 3.8Å; V115-V185 HydrophobicContact CG1-CG2 4.28Å; V115-V185 HydrophobicContact CG2-CG1 4.38Å; V115-V185 HydrophobicContact CG2-CG2 4.24Å
116	Y	97.8	Very high	94.7	Very high	43 Å²	43	30.9 Å²	30.9	17%	0.169	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	115.9	173	-59.2	-102.3	0	0	0	107.4	T93 V114 A183 R184 E186	T93-Y116 HydrophobicContact CG2-CD1 3.56Å; T93-Y116 HydrophobicContact CG2-CE1 3.5Å; V114-Y116 HydrophobicContact CB-CE2 4.36Å; V114-Y116 HydrophobicContact CG1-CD2 4.42Å; V114-Y116 HydrophobicContact CG1-CE2 3.57Å; V114-Y116 HydrophobicContact CG2-CD2 4.31Å; V114-Y116 HydrophobicContact CG2-CE2 3.92Å; Y116-A183 WeakPolarHBondContact O-CA 3.36Å; Y116-A183 WeakPolarHBondContact O-CB 3.23Å; Y116-A183 PolarHBondContact O-N 2.87Å; Y116-R184 HydrophobicContact CD2-CG 3.38Å; Y116-R184 HydrophobicContact CE2-CG 4.07Å; Y116-R184 HydrophobicContact CG-CG 3.78Å; Y116-R184 PolarHBondContact N-O 3.06Å; Y116-R184 PolarHBondContact O-N 2.76Å; Y116-R184 PolarHBondContact OH-NH2 3.1Å; Y116-E186 VanDerWaalsContact CE2-CD 3.47Å; Y116-E186 HydrophobicContact CE2-CG 4.13Å; Y116-E186 WeakPolarHBondContact CE2-OE1 3.28Å; Y116-E186 PolarHBondContact OH-OE2 3.27Å; Y116-E186 VanDerWaalsContact OH-OE2 3.1Å
117	Y	97.5	Very high	94.6	Very high	6 Å²	6	28.6 Å²	28.6	2%	0.024	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	161.7	179.1	68	-98.3	0	0	0	110.9	T91 V92 C94 V115 H133 T136 I180 R181	T91-Y117 CarbonylContact C-O 3.59Å; T91-Y117 WeakPolarHBondContact CA-O 3.34Å; V92-Y117 HydrophobicContact CB-CE2 4.4Å; V92-Y117 PolarHBondContact N-O 3.22Å; V92-Y117 PolarHBondContact O-N 2.95Å; V92-Y117 VanDerWaalsContact O-N 3.11Å; C94-Y117 HydrophobicContact CB-CD1 4.24Å; C94-Y117 HydrophobicContact CB-CE1 3.64Å; V115-Y117 HydrophobicContact CG1-CD1 4.17Å; Y117-H133 AromaticContact CE2-ND1 3.84Å; Y117-H133 AromaticContact CZ-ND1 3.76Å; Y117-H133 PolarHBondContact OH-ND1 3.34Å; Y117-T136 HydrophobicContact CD1-CG2 3.88Å; Y117-T136 HydrophobicContact CE1-CG2 3.71Å; Y117-T136 HydrophobicContact CG-CG2 4.38Å; Y117-I180 HydrophobicContact CD2-CG2 3.66Å; Y117-I180 HydrophobicContact CG-CG2 3.95Å; Y117-R181 WeakPolarHBondContact CA-O 3.44Å
118	R	96.4	Very high	94.5	Very high	86 Å²	86	30 Å²	30	33%	0.325	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150.8	173.7	62.8	-179.8	-177.1	81.3	-1.4	110.3	R181	R118-R181 PolarHBondContact N-O 2.9Å; R118-R181 PolarHBondContact O-N 2.86Å
119	I	96.3	Very high	94.5	Very high	5 Å²	5	28 Å²	28	3%	0.026	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	123.6	173	-60.5	169	0	0	0	107.7	V87 L89 A125 V132 G179	V87-I119 HydrophobicContact CG1-CB 4.28Å; V87-I119 HydrophobicContact CG1-CD1 3.52Å; V87-I119 HydrophobicContact CG1-CG1 4.49Å; V87-I119 HydrophobicContact CG1-CG2 3.97Å; L89-I119 HydrophobicContact CD2-CG2 4.46Å; L89-I119 VanDerWaalsContact CD2-O 3.29Å; L89-I119 WeakPolarHBondContact CD2-O 3.37Å; I119-A125 HydrophobicContact CD1-CB 4.27Å; I119-A125 HydrophobicContact CG2-CB 3.73Å; I119-V132 HydrophobicContact CD1-CG1 3.98Å; I119-G179 CarbonylContact C-O 3.53Å
120	Y	94.1	Very high	94.4	Very high	99 Å²	99	36.3 Å²	36.3	39%	0.388	19%	0.192	S	C	.	.	S	Bend	trans	-97.5	-32.4	173.1	81.4	-95.3	0	0	0	111.8	E176 G179 I180 R181	Y120-E176 PolarHBondContact OH-O 2.75Å; Y120-G179 WeakPolarHBondContact CD1-O 3.39Å; Y120-G179 PolarHBondContact N-O 2.96Å; Y120-I180 WeakPolarHBondContact CE1-O 3.44Å; Y120-R181 HydrophobicContact CD1-CB 4.24Å
121	S	93.2	Very high	94.3	Very high	28 Å²	28	36.8 Å²	36.8	20%	0.196	20%	0.196	C	C	.	.			trans	-119.3	103.4	177.4	176.9	0	0	0	0	110.4	V123 S124 A125 G179	S121-V123 VanDerWaalsContact C-N 3.28Å; S121-V123 PolarHBondContact O-N 3.1Å; S121-S124 PolarHBondContact O-N 3.32Å; S121-S124 WeakPolarHBondContact OG-CB 2.93Å; S121-S124 PolarHBondContact OG-N 3.11Å; S121-S124 PolarHBondContact OG-OG 2.66Å; S121-A125 WeakPolarHBondContact O-CB 3.5Å; S121-A125 PolarHBondContact O-N 2.76Å; S121-A125 VanDerWaalsContact O-N 3.11Å; S121-G179 PolarHBondContact N-O 3.09Å; S121-G179 VanDerWaalsContact N-O 3.09Å
122	A	92.8	Very high	94.2	Very high	4 Å²	4	37.5 Å²	37.5	3%	0.033	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-31.2	177.3	0	0	0	0	0	112.6	R55 V57 A69 V87 V126	R55-A122 HydrophobicContact CB-CB 3.95Å; V57-A122 HydrophobicContact CG2-CB 3.92Å; V57-A122 WeakPolarHBondContact CG2-O 3.43Å; A69-A122 HydrophobicContact CB-CB 3.99Å; V87-A122 HydrophobicContact CB-CB 3.84Å; V87-A122 HydrophobicContact CG1-CB 4.12Å; V87-A122 HydrophobicContact CG2-CB 3.98Å; A122-V126 WeakPolarHBondContact O-CG2 3.38Å; A122-V126 PolarHBondContact O-N 3.42Å
123	V	92.4	Very high	94.2	Very high	12 Å²	12	40.5 Å²	40.5	7%	0.073	21%	0.214	C	C	.	.	H	α-helix	trans	-66.2	-49.3	178.7	-178.5	0	0	0	0	110	V57 I64 A69 S121 A125 V126 A127	V57-V123 HydrophobicContact CG2-CG2 4.36Å; I64-V123 HydrophobicContact CD1-CG1 4.14Å; I64-V123 HydrophobicContact CG2-CG1 4.4Å; A69-V123 HydrophobicContact CB-CG2 4.04Å; S121-V123 VanDerWaalsContact C-N 3.28Å; S121-V123 PolarHBondContact O-N 3.1Å; V123-A125 VanDerWaalsContact C-N 3.34Å; V123-A125 PolarHBondContact O-N 2.84Å; V123-V126 PolarHBondContact O-N 3.32Å; V123-A127 WeakPolarHBondContact O-CB 3.31Å; V123-A127 PolarHBondContact O-N 3Å
124	S	92.1	Very high	94.2	Very high	28 Å²	28	44.6 Å²	44.6	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-63.1	-40.2	178.8	-51.2	0	0	0	0	111.9	S121 V126 A127 N128 W178	S121-S124 PolarHBondContact O-N 3.32Å; S121-S124 WeakPolarHBondContact OG-CB 2.93Å; S121-S124 PolarHBondContact OG-N 3.11Å; S121-S124 PolarHBondContact OG-OG 2.66Å; S124-V126 VanDerWaalsContact C-N 3.28Å; S124-V126 PolarHBondContact O-N 3.48Å; S124-A127 PolarHBondContact O-N 3.14Å; S124-N128 WeakPolarHBondContact O-CB 3.4Å; S124-N128 PolarHBondContact O-N 3Å; S124-W178 CarbonylContact C-O 3.56Å
125	A	93.1	Very high	94.2	Very high	4 Å²	4	45.1 Å²	45.1	3%	0.033	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-30.9	-179.8	0	0	0	0	0	113.7	I119 S121 V123 V129 V132 W178	I119-A125 HydrophobicContact CD1-CB 4.27Å; I119-A125 HydrophobicContact CG2-CB 3.73Å; S121-A125 WeakPolarHBondContact O-CB 3.5Å; S121-A125 PolarHBondContact O-N 2.76Å; S121-A125 VanDerWaalsContact O-N 3.11Å; V123-A125 VanDerWaalsContact C-N 3.34Å; V123-A125 PolarHBondContact O-N 2.84Å; A125-V129 VanDerWaalsContact O-CG1 3.28Å; A125-V129 WeakPolarHBondContact O-CG1 3.42Å; A125-V132 HydrophobicContact CB-CG2 4.18Å; A125-W178 WeakPolarHBondContact CA-O 3.46Å; A125-W178 WeakPolarHBondContact CB-O 3.41Å; A125-W178 PolarHBondContact N-O 3.47Å; A125-W178 VanDerWaalsContact N-O 3.09Å
126	V	92.3	Very high	94.1	Very high	44 Å²	44	45.2 Å²	45.2	27%	0.267	24%	0.238	S	C	.	.	H	α-helix	trans	-93.6	-30.3	178.7	-176	0	0	0	0	111.8	V57 F59 V85 V87 A122 V123 S124	V57-V126 HydrophobicContact CG2-CG2 4.27Å; F59-V126 HydrophobicContact CE2-CG1 3.83Å; F59-V126 HydrophobicContact CZ-CB 4.39Å; F59-V126 HydrophobicContact CZ-CG1 3.57Å; V85-V126 HydrophobicContact CB-CG1 4.35Å; V85-V126 HydrophobicContact CB-CG2 4.43Å; V85-V126 HydrophobicContact CG1-CG1 4.32Å; V85-V126 HydrophobicContact CG1-CG2 3.94Å; V85-V126 HydrophobicContact CG2-CG1 4.27Å; V87-V126 HydrophobicContact CG2-CG2 3.59Å; A122-V126 WeakPolarHBondContact O-CG2 3.38Å; A122-V126 PolarHBondContact O-N 3.42Å; V123-V126 PolarHBondContact O-N 3.32Å; S124-V126 VanDerWaalsContact C-N 3.28Å; S124-V126 PolarHBondContact O-N 3.48Å
127	A	90.6	Very high	94	Very high	45 Å²	45	45.3 Å²	45.3	37%	0.372	24%	0.239	S	C	.	.	H	α-helix	trans	-84.5	-37.7	-175.3	0	0	0	0	0	113.6	I64 V123 S124	I64-A127 HydrophobicContact CD1-CB 4.16Å; V123-A127 WeakPolarHBondContact O-CB 3.31Å; V123-A127 PolarHBondContact O-N 3Å; S124-A127 PolarHBondContact O-N 3.14Å
128	N	91.7	Very high	94	Very high	51 Å²	51	49.1 Å²	49.1	27%	0.273	26%	0.259	S	S	.	.	S	Bend	trans	-96.2	-15.7	-167.8	-64.1	-12.8	0	0	0	113.5	S124 L177	S124-N128 WeakPolarHBondContact O-CB 3.4Å; S124-N128 PolarHBondContact O-N 3Å; N128-L177 PolarHBondContact ND2-O 3.03Å
129	V	93.1	Very high	94	Very high	23 Å²	23	46.8 Å²	46.8	14%	0.139	25%	0.253	C	S	.	.			trans	-143.7	138.6	-177.1	63.8	0	0	0	0	110.1	A125 V132 A135 W178	A125-V129 VanDerWaalsContact O-CG1 3.28Å; A125-V129 WeakPolarHBondContact O-CG1 3.42Å; V129-V132 HydrophobicContact CG1-CB 3.77Å; V129-V132 HydrophobicContact CG1-CG2 4.06Å; V129-A135 HydrophobicContact CG2-CB 3.56Å; V129-W178 HydrophobicContact CB-CG 4.3Å; V129-W178 HydrophobicContact CG1-CB 4.19Å; V129-W178 HydrophobicContact CG1-CG 4.15Å
130	N	91.2	Very high	94	Very high	176 Å²	176	46.6 Å²	46.6	94%	0.941	25%	0.252	S	S	*	.	S	Bend	trans	-68	-46.3	-179.2	-176.6	52.5	0	0	0	112.1
131	D	93.8	Very high	94.1	Very high	79 Å²	79	43.3 Å²	43.3	42%	0.422	24%	0.241	S	C	.	.			trans	-132.5	104.2	173.8	-174.5	-25	0	0	0	109.5	H133 Q134 A135	D131-H133 VanDerWaalsContact C-N 3.32Å; D131-H133 PolarHBondContact O-N 3.01Å; D131-H133 PolarHBondContact OD1-N 3.14Å; D131-Q134 HydrophobicContact CB-CB 4.01Å; D131-Q134 PolarHBondContact OD1-N 2.87Å; D131-A135 WeakPolarHBondContact O-CB 3.34Å; D131-A135 PolarHBondContact O-N 3.43Å
132	V	94.2	Very high	94.2	Very high	15 Å²	15	44.8 Å²	44.8	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-37	-177.8	69.2	0	0	0	0	112.4	I119 A125 V129 T136 I180	I119-V132 HydrophobicContact CD1-CG1 3.98Å; A125-V132 HydrophobicContact CB-CG2 4.18Å; V129-V132 HydrophobicContact CG1-CB 3.77Å; V129-V132 HydrophobicContact CG1-CG2 4.06Å; V132-T136 VanDerWaalsContact O-CB 3.31Å; V132-T136 WeakPolarHBondContact O-CB 3.4Å; V132-T136 PolarHBondContact O-N 3.44Å; V132-T136 VanDerWaalsContact O-N 3.14Å; V132-T136 PolarHBondContact O-OG1 2.74Å; V132-I180 HydrophobicContact CG2-CD1 3.33Å; V132-I180 HydrophobicContact CG2-CG1 3.71Å
133	H	95	Very high	94.4	Very high	83 Å²	83	44.9 Å²	44.9	38%	0.384	25%	0.248	S	C	.	.	H	α-helix	trans	-75.5	-44	-175.7	-63.5	-60	0	0	0	110.6	Y117 D131 F137	Y117-H133 AromaticContact CE2-ND1 3.84Å; Y117-H133 AromaticContact CZ-ND1 3.76Å; Y117-H133 PolarHBondContact OH-ND1 3.34Å; D131-H133 VanDerWaalsContact C-N 3.32Å; D131-H133 PolarHBondContact O-N 3.01Å; D131-H133 PolarHBondContact OD1-N 3.14Å; H133-F137 WeakPolarHBondContact O-CB 3.22Å; H133-F137 PolarHBondContact O-N 3.37Å
134	Q	96.1	Very high	94.5	Very high	92 Å²	92	44.4 Å²	44.4	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-68.6	-42	178.4	-174	61.4	16.5	0	0	112.1	D131 T136 F137 L138	D131-Q134 HydrophobicContact CB-CB 4.01Å; D131-Q134 PolarHBondContact OD1-N 2.87Å; Q134-T136 VanDerWaalsContact C-N 3.34Å; Q134-T136 PolarHBondContact O-N 3.06Å; Q134-F137 PolarHBondContact O-N 3.48Å; Q134-L138 HydrophobicContact CG-CD1 4.32Å; Q134-L138 WeakPolarHBondContact O-CG 3.45Å; Q134-L138 PolarHBondContact O-N 3.48Å
135	A	95.9	Very high	94.7	Very high	23 Å²	23	47.6 Å²	47.6	19%	0.19	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-43.7	176.9	0	0	0	0	0	111.6	V129 D131 L138 L139 W178	V129-A135 HydrophobicContact CG2-CB 3.56Å; D131-A135 WeakPolarHBondContact O-CB 3.34Å; D131-A135 PolarHBondContact O-N 3.43Å; A135-L138 PolarHBondContact O-N 2.86Å; A135-L139 WeakPolarHBondContact O-CB 3.29Å; A135-L139 PolarHBondContact O-N 3.07Å; A135-W178 HydrophobicContact CB-CE3 4.47Å; A135-W178 HydrophobicContact CB-CH2 3.92Å; A135-W178 HydrophobicContact CB-CZ2 4.37Å; A135-W178 HydrophobicContact CB-CZ3 3.97Å
136	T	95.7	Very high	94.8	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	28%	0.279	C	S	.	.	H	α-helix	trans	-63.9	-41.2	176.8	-55.3	0	0	0	0	112	Y117 V132 Q134 L139 A140 T175 I180	Y117-T136 HydrophobicContact CD1-CG2 3.88Å; Y117-T136 HydrophobicContact CE1-CG2 3.71Å; Y117-T136 HydrophobicContact CG-CG2 4.38Å; V132-T136 VanDerWaalsContact O-CB 3.31Å; V132-T136 WeakPolarHBondContact O-CB 3.4Å; V132-T136 PolarHBondContact O-N 3.44Å; V132-T136 VanDerWaalsContact O-N 3.14Å; V132-T136 PolarHBondContact O-OG1 2.74Å; Q134-T136 VanDerWaalsContact C-N 3.34Å; Q134-T136 PolarHBondContact O-N 3.06Å; T136-L139 PolarHBondContact O-N 3.33Å; T136-A140 WeakPolarHBondContact O-CB 3.32Å; T136-A140 PolarHBondContact O-N 3.45Å; T136-T175 HydrophobicContact CG2-CG2 4.4Å; T136-I180 HydrophobicContact CG2-CD1 4.36Å; T136-I180 WeakPolarHBondContact OG1-CD1 3.42Å
137	F	96.5	Very high	94.9	Very high	46 Å²	46	51.1 Å²	51.1	20%	0.202	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-46.7	176.5	173.1	-111.8	0	0	0	112.5	C94 N95 P97 H133 Q134 A140 Q141	C94-F137 VanDerWaalsContact SG-CD2 3.52Å; N95-F137 WeakPolarHBondContact O-CE2 3.4Å; P97-F137 VanDerWaalsContact CD-CE2 3.49Å; P97-F137 HydrophobicContact CG-CE2 4.5Å; P97-F137 HydrophobicContact CG-CZ 4.08Å; H133-F137 WeakPolarHBondContact O-CB 3.22Å; H133-F137 PolarHBondContact O-N 3.37Å; Q134-F137 PolarHBondContact O-N 3.48Å; F137-A140 PolarHBondContact O-N 3.36Å; F137-Q141 WeakPolarHBondContact O-CG 3.41Å; F137-Q141 PolarHBondContact O-N 2.96Å
138	L	96.7	Very high	95.1	Very high	85 Å²	85	49 Å²	49	45%	0.445	25%	0.253	S	S	.	.	H	α-helix	trans	-65.4	-41.8	178.2	-69.8	172	0	0	0	111.9	Q134 A135 Q141 T142	Q134-L138 HydrophobicContact CG-CD1 4.32Å; Q134-L138 WeakPolarHBondContact O-CG 3.45Å; Q134-L138 PolarHBondContact O-N 3.48Å; A135-L138 PolarHBondContact O-N 2.86Å; L138-Q141 WeakPolarHBondContact O-CB 3.21Å; L138-Q141 PolarHBondContact O-N 3.16Å; L138-T142 PolarHBondContact O-N 2.94Å; L138-T142 VanDerWaalsContact O-N 3.09Å; L138-T142 PolarHBondContact O-OG1 3.37Å
139	L	96.5	Very high	95.3	Very high	38 Å²	38	47.8 Å²	47.8	20%	0.199	25%	0.252	C	S	.	.	H	α-helix	trans	-64.4	-41	175.8	-176.5	66.3	0	0	0	111.6	A135 T136 Q141 T142 T143 L171 A174 T175 W178	A135-L139 WeakPolarHBondContact O-CB 3.29Å; A135-L139 PolarHBondContact O-N 3.07Å; T136-L139 PolarHBondContact O-N 3.33Å; L139-Q141 VanDerWaalsContact C-N 3.33Å; L139-Q141 PolarHBondContact O-N 2.9Å; L139-T142 PolarHBondContact O-N 2.84Å; L139-T142 PolarHBondContact O-OG1 3.44Å; L139-T142 VanDerWaalsContact O-OG1 3.07Å; L139-T143 WeakPolarHBondContact O-CB 3.48Å; L139-T143 PolarHBondContact O-N 2.95Å; L139-T143 PolarHBondContact O-OG1 3.4Å; L139-T143 VanDerWaalsContact O-OG1 3.07Å; L139-L171 HydrophobicContact CD2-CD2 4.18Å; L139-L171 HydrophobicContact CG-CD2 3.88Å; L139-A174 HydrophobicContact CD2-CB 3.78Å; L139-T175 HydrophobicContact CD2-CG2 3.6Å; L139-W178 HydrophobicContact CB-CH2 4.2Å; L139-W178 HydrophobicContact CB-CZ3 4.39Å; L139-W178 HydrophobicContact CD2-CH2 3.71Å; L139-W178 HydrophobicContact CD2-CZ3 3.77Å
140	A	96.3	Very high	95.4	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-61.7	-40.8	175.4	0	0	0	0	0	112	I96 V115 T136 F137 L144 L171	I96-A140 HydrophobicContact CD1-CB 3.85Å; I96-A140 HydrophobicContact CG1-CB 4.21Å; V115-A140 HydrophobicContact CG2-CB 3.96Å; T136-A140 WeakPolarHBondContact O-CB 3.32Å; T136-A140 PolarHBondContact O-N 3.45Å; F137-A140 PolarHBondContact O-N 3.36Å; A140-L144 WeakPolarHBondContact O-CB 3.39Å; A140-L144 PolarHBondContact O-N 2.82Å; A140-L171 HydrophobicContact CB-CD1 4.17Å; A140-L171 HydrophobicContact CB-CD2 4.4Å
141	Q	96.5	Very high	95.6	Very high	30 Å²	30	44.6 Å²	44.6	14%	0.14	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-47.8	174.8	-77.6	179.7	-8.1	0	0	112.8	I96 F137 L138 L139 R145	I96-Q141 HydrophobicContact CG2-CG 3.83Å; F137-Q141 WeakPolarHBondContact O-CG 3.41Å; F137-Q141 PolarHBondContact O-N 2.96Å; L138-Q141 WeakPolarHBondContact O-CB 3.21Å; L138-Q141 PolarHBondContact O-N 3.16Å; L139-Q141 VanDerWaalsContact C-N 3.33Å; L139-Q141 PolarHBondContact O-N 2.9Å; Q141-R145 WeakPolarHBondContact O-CB 3.45Å; Q141-R145 PolarHBondContact O-N 2.92Å; Q141-R145 VanDerWaalsContact O-N 3.12Å
142	T	95.8	Very high	95.7	Very high	58 Å²	58	41.9 Å²	41.9	36%	0.356	22%	0.223	S	C	.	.	H	α-helix	trans	-71.3	-41.9	-177.7	54.8	0	0	0	0	111.5	L138 L139 R145 N146	L138-T142 PolarHBondContact O-N 2.94Å; L138-T142 VanDerWaalsContact O-N 3.09Å; L138-T142 PolarHBondContact O-OG1 3.37Å; L139-T142 PolarHBondContact O-N 2.84Å; L139-T142 PolarHBondContact O-OG1 3.44Å; L139-T142 VanDerWaalsContact O-OG1 3.07Å; T142-R145 PolarHBondContact O-N 3.45Å; T142-N146 WeakPolarHBondContact O-CB 3.4Å; T142-N146 PolarHBondContact O-N 3.25Å; T142-N146 PolarHBondContact O-ND2 3.15Å; T142-N146 PolarHBondContact O-OD1 3.22Å
143	T	96.2	Very high	95.7	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.037	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-45.1	175.2	-63.3	0	0	0	0	111.9	L139 R145 N146 V147 I167 L170 L171	L139-T143 WeakPolarHBondContact O-CB 3.48Å; L139-T143 PolarHBondContact O-N 2.95Å; L139-T143 PolarHBondContact O-OG1 3.4Å; L139-T143 VanDerWaalsContact O-OG1 3.07Å; T143-R145 VanDerWaalsContact C-N 3.33Å; T143-R145 PolarHBondContact O-N 2.83Å; T143-N146 PolarHBondContact O-N 3.47Å; T143-V147 HydrophobicContact CG2-CG2 4.11Å; T143-V147 WeakPolarHBondContact O-CG2 3.21Å; T143-V147 PolarHBondContact O-N 3.04Å; T143-I167 HydrophobicContact CG2-CG2 4.08Å; T143-L170 HydrophobicContact CG2-CB 4.22Å; T143-L170 HydrophobicContact CG2-CD2 3.49Å; T143-L170 VanDerWaalsContact CG2-CD2 3.49Å; T143-L170 HydrophobicContact CG2-CG 4.26Å; T143-L170 WeakPolarHBondContact OG1-CD2 3.3Å; T143-L171 HydrophobicContact CG2-CD2 4.16Å; T143-L171 HydrophobicContact CG2-CG 4.05Å
144	L	95.8	Very high	95.6	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-56.7	-48.1	176.5	-177.9	69.9	0	0	0	110.8	I96 Q99 A140 N146 L148 I167	I96-L144 HydrophobicContact CB-CD2 4.39Å; I96-L144 HydrophobicContact CD1-CB 4.46Å; I96-L144 HydrophobicContact CD1-CD2 3.99Å; I96-L144 HydrophobicContact CG2-CD2 3.78Å; Q99-L144 HydrophobicContact CG-CD2 4.35Å; A140-L144 WeakPolarHBondContact O-CB 3.39Å; A140-L144 PolarHBondContact O-N 2.82Å; L144-N146 PolarHBondContact O-N 2.95Å; L144-L148 HydrophobicContact CD1-CD1 3.57Å; L144-L148 HydrophobicContact CD1-CG 4.09Å; L144-L148 HydrophobicContact CG-CD1 3.73Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.35Å; L144-L148 VanDerWaalsContact O-CG 3.24Å; L144-L148 WeakPolarHBondContact O-CG 3.36Å; L144-L148 PolarHBondContact O-N 2.92Å; L144-I167 HydrophobicContact CD1-CD1 3.68Å
145	R	95.1	Very high	95.5	Very high	96 Å²	96	40.5 Å²	40.5	36%	0.362	23%	0.225	S	C	.	.	H	α-helix	trans	-59.8	-46.3	177.4	-174.9	-176.8	-61.4	120.5	1.9	112	I101 Q141 T142 T143 G149	I101-R145 HydrophobicContact CG2-CB 4.22Å; I101-R145 HydrophobicContact CG2-CG 3.76Å; Q141-R145 WeakPolarHBondContact O-CB 3.45Å; Q141-R145 PolarHBondContact O-N 2.92Å; Q141-R145 VanDerWaalsContact O-N 3.12Å; T142-R145 PolarHBondContact O-N 3.45Å; T143-R145 VanDerWaalsContact C-N 3.33Å; T143-R145 PolarHBondContact O-N 2.83Å; R145-G149 PolarHBondContact O-N 2.9Å
146	N	94.7	Very high	95.4	Very high	107 Å²	107	39.4 Å²	39.4	57%	0.572	22%	0.216	S	C	*	.	H	α-helix	trans	-65.8	-49	-176.8	-69.7	-14.5	0	0	0	111.6	T142 T143 L144 G149 T150	T142-N146 WeakPolarHBondContact O-CB 3.4Å; T142-N146 PolarHBondContact O-N 3.25Å; T142-N146 PolarHBondContact O-ND2 3.15Å; T142-N146 PolarHBondContact O-OD1 3.22Å; T143-N146 PolarHBondContact O-N 3.47Å; L144-N146 PolarHBondContact O-N 2.95Å; N146-G149 PolarHBondContact O-N 3.44Å; N146-T150 WeakPolarHBondContact O-CG2 3.38Å; N146-T150 PolarHBondContact O-N 3.41Å
147	V	95.6	Very high	95.2	Very high	14 Å²	14	42.6 Å²	42.6	9%	0.085	23%	0.232	C	C	.	.	H	α-helix	trans	-66.6	-48.1	-178.8	177.7	0	0	0	0	110.5	T143 G149 T150 I163 I167	T143-V147 HydrophobicContact CG2-CG2 4.11Å; T143-V147 WeakPolarHBondContact O-CG2 3.21Å; T143-V147 PolarHBondContact O-N 3.04Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.19Å; V147-T150 PolarHBondContact O-N 3.46Å; V147-T150 VanDerWaalsContact O-N 3.1Å; V147-T150 PolarHBondContact O-OG1 3.44Å; V147-I163 HydrophobicContact CG1-CG2 4.14Å; V147-I167 HydrophobicContact CB-CD1 4.39Å; V147-I167 HydrophobicContact CB-CG1 3.79Å; V147-I167 HydrophobicContact CG1-CD1 4.35Å; V147-I167 HydrophobicContact CG1-CG1 3.79Å; V147-I167 HydrophobicContact CG2-CG1 3.94Å
148	L	95.2	Very high	95	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-33.2	-179.6	-66.8	174.6	0	0	0	112.9	I101 V111 L144 T150 Q151 I156 I163 I187	I101-L148 HydrophobicContact CD1-CB 3.44Å; I101-L148 VanDerWaalsContact CD1-CB 3.44Å; I101-L148 HydrophobicContact CD1-CD1 3.9Å; I101-L148 HydrophobicContact CD1-CG 4.28Å; V111-L148 HydrophobicContact CB-CD1 3.66Å; V111-L148 HydrophobicContact CG1-CD1 3.56Å; V111-L148 HydrophobicContact CG2-CD1 3.99Å; L144-L148 HydrophobicContact CD1-CD1 3.57Å; L144-L148 HydrophobicContact CD1-CG 4.09Å; L144-L148 HydrophobicContact CG-CD1 3.73Å; L144-L148 HydrophobicContact CG-CG 4.46Å; L144-L148 VanDerWaalsContact O-CB 3.3Å; L144-L148 WeakPolarHBondContact O-CB 3.35Å; L144-L148 VanDerWaalsContact O-CG 3.24Å; L144-L148 WeakPolarHBondContact O-CG 3.36Å; L144-L148 PolarHBondContact O-N 2.92Å; L148-T150 PolarHBondContact O-N 3.37Å; L148-Q151 PolarHBondContact O-N 2.87Å; L148-Q151 VanDerWaalsContact O-N 3.12Å; L148-I156 HydrophobicContact CB-CD1 4.36Å; L148-I156 HydrophobicContact CD2-CD1 4.11Å; L148-I156 HydrophobicContact CD2-CG1 3.96Å; L148-I156 HydrophobicContact CD2-CG2 4.3Å; L148-I163 HydrophobicContact CD2-CG2 3.76Å; L148-I187 HydrophobicContact CD2-CD1 4.34Å
149	G	95	Very high	94.7	Very high	26 Å²	26	41.7 Å²	41.7	27%	0.268	24%	0.242	S	C	.	.	H	α-helix	trans	-63.6	-25.7	175.2	0	0	0	0	0	113.7	R104 R145 N146 V147 Q151	R104-G149 PolarHBondContact N-O 2.97Å; R145-G149 PolarHBondContact O-N 2.9Å; N146-G149 PolarHBondContact O-N 3.44Å; V147-G149 VanDerWaalsContact C-N 3.29Å; V147-G149 PolarHBondContact O-N 3.19Å; G149-Q151 VanDerWaalsContact C-N 3.34Å
150	T	95.3	Very high	94.6	Very high	88 Å²	88	43.5 Å²	43.5	54%	0.54	25%	0.246	S	C	.	.	H	α-helix	trans	-82.1	-11.9	175.8	66.2	0	0	0	0	114	R104 N146 V147 L148	R104-T150 WeakPolarHBondContact CD-O 3.4Å; N146-T150 WeakPolarHBondContact O-CG2 3.38Å; N146-T150 PolarHBondContact O-N 3.41Å; V147-T150 PolarHBondContact O-N 3.46Å; V147-T150 VanDerWaalsContact O-N 3.1Å; V147-T150 PolarHBondContact O-OG1 3.44Å; L148-T150 PolarHBondContact O-N 3.37Å
151	Q	95.8	Very high	94.5	Very high	44 Å²	44	51 Å²	51	21%	0.206	28%	0.281	C	S	.	.	S	Bend	trans	-100.1	154.5	-177	-60.4	-68.1	14.3	0	0	111.4	T103 R104 L148 G149 I156 I163	T103-Q151 WeakPolarHBondContact CB-O 3.41Å; R104-Q151 WeakPolarHBondContact CB-O 3.37Å; R104-Q151 PolarHBondContact N-O 3.37Å; L148-Q151 PolarHBondContact O-N 2.87Å; L148-Q151 VanDerWaalsContact O-N 3.12Å; G149-Q151 VanDerWaalsContact C-N 3.34Å; Q151-I156 HydrophobicContact CB-CD1 4.28Å; Q151-I156 HydrophobicContact CB-CG1 3.91Å; Q151-I163 HydrophobicContact CB-CD1 4.24Å; Q151-I163 HydrophobicContact CG-CD1 3.98Å; Q151-I163 HydrophobicContact CG-CG1 4.11Å
152	T	95.8	Very high	94.5	Very high	22 Å²	22	57 Å²	57	14%	0.135	31%	0.309	C	S	.	.			trans	-81.2	155.4	171.6	61.1	0	0	0	0	110.8	R104 S154 Q155 I156	R104-T152 HydrophobicContact CB-CG2 4.29Å; T152-S154 PolarHBondContact O-N 2.93Å; T152-Q155 WeakPolarHBondContact O-CB 3.34Å; T152-Q155 PolarHBondContact O-N 3.12Å; T152-Q155 VanDerWaalsContact O-N 3.09Å; T152-Q155 VanDerWaalsContact OG1-CD 3.27Å; T152-Q155 VanDerWaalsContact OG1-CG 3.29Å; T152-Q155 WeakPolarHBondContact OG1-CG 3.45Å; T152-Q155 PolarHBondContact OG1-N 3Å; T152-Q155 PolarHBondContact OG1-OE1 3.45Å; T152-I156 WeakPolarHBondContact O-CG1 3.18Å; T152-I156 PolarHBondContact O-N 3.33Å
153	L	94.2	Very high	94.5	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.016	29%	0.292	C	S	.	.	H	α-helix	trans	-55.2	-41.8	176.4	171.6	55.9	0	0	0	112.2	D105 V107 T109 Q155 I156 L157 V190 I192 L196 M200	D105-L153 PolarHBondContact OD1-N 2.95Å; D105-L153 WeakPolarHBondContact OD2-CB 3.17Å; D105-L153 PolarHBondContact OD2-N 3.07Å; D105-L153 VanDerWaalsContact OD2-N 3.15Å; V107-L153 HydrophobicContact CB-CD2 4.43Å; V107-L153 HydrophobicContact CG1-CD2 3.98Å; T109-L153 HydrophobicContact CG2-CD1 4.01Å; L153-Q155 VanDerWaalsContact C-N 3.33Å; L153-Q155 PolarHBondContact O-N 2.9Å; L153-I156 PolarHBondContact O-N 2.89Å; L153-L157 HydrophobicContact CD1-CD1 3.86Å; L153-L157 HydrophobicContact CD1-CD2 4.45Å; L153-L157 HydrophobicContact CD1-CG 3.87Å; L153-L157 HydrophobicContact CG-CD1 4.11Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3.07Å; L153-V190 HydrophobicContact CD1-CG1 4.49Å; L153-I192 HydrophobicContact CD1-CD1 3.87Å; L153-I192 HydrophobicContact CD1-CG1 4.15Å; L153-I192 HydrophobicContact CD2-CD1 4.11Å; L153-I192 HydrophobicContact CD2-CG1 4.49Å; L153-L196 HydrophobicContact CD2-CD2 4.25Å; L153-M200 HydrophobicContact CD2-CE 3.42Å; L153-M200 VanDerWaalsContact CD2-CE 3.42Å; L153-M200 HydrophobicContact CG-CE 4.31Å
154	S	92.5	Very high	94.5	Very high	84 Å²	84	54.2 Å²	54.2	59%	0.587	29%	0.292	S	S	*	.	H	α-helix	trans	-59.9	-42.3	177.9	-175.1	0	0	0	0	112.3	T152 L157 S158	T152-S154 PolarHBondContact O-N 2.93Å; S154-L157 PolarHBondContact O-N 3.3Å; S154-S158 WeakPolarHBondContact O-CB 3.13Å; S154-S158 PolarHBondContact O-N 3.09Å; S154-S158 PolarHBondContact O-OG 2.71Å
155	Q	94.1	Very high	94.5	Very high	75 Å²	75	59.8 Å²	59.8	35%	0.35	32%	0.318	S	S	.	.	H	α-helix	trans	-66.3	-39.9	175.1	-72.6	165.1	-48.1	0	0	111.9	T152 L153 L157 S158 G159 I163	T152-Q155 WeakPolarHBondContact O-CB 3.34Å; T152-Q155 PolarHBondContact O-N 3.12Å; T152-Q155 VanDerWaalsContact O-N 3.09Å; T152-Q155 VanDerWaalsContact OG1-CD 3.27Å; T152-Q155 VanDerWaalsContact OG1-CG 3.29Å; T152-Q155 WeakPolarHBondContact OG1-CG 3.45Å; T152-Q155 PolarHBondContact OG1-N 3Å; T152-Q155 PolarHBondContact OG1-OE1 3.45Å; L153-Q155 VanDerWaalsContact C-N 3.33Å; L153-Q155 PolarHBondContact O-N 2.9Å; Q155-L157 VanDerWaalsContact C-N 3.28Å; Q155-L157 PolarHBondContact O-N 3.36Å; Q155-S158 PolarHBondContact O-N 2.8Å; Q155-G159 CarbonylContact O-C 3.56Å; Q155-G159 VanDerWaalsContact O-CA 3.27Å; Q155-G159 WeakPolarHBondContact O-CA 3.48Å; Q155-G159 PolarHBondContact O-N 3.07Å; Q155-I163 HydrophobicContact CB-CD1 4.5Å
156	I	94.1	Very high	94.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.5	-36.6	176.6	-65.2	167.8	0	0	0	111.3	I101 T103 L148 Q151 T152 L153 R160 I163 V190	I101-I156 HydrophobicContact CD1-CD1 4.4Å; T103-I156 HydrophobicContact CG2-CD1 3.56Å; L148-I156 HydrophobicContact CB-CD1 4.36Å; L148-I156 HydrophobicContact CD2-CD1 4.11Å; L148-I156 HydrophobicContact CD2-CG1 3.96Å; L148-I156 HydrophobicContact CD2-CG2 4.3Å; Q151-I156 HydrophobicContact CB-CD1 4.28Å; Q151-I156 HydrophobicContact CB-CG1 3.91Å; T152-I156 WeakPolarHBondContact O-CG1 3.18Å; T152-I156 PolarHBondContact O-N 3.33Å; L153-I156 PolarHBondContact O-N 2.89Å; I156-R160 WeakPolarHBondContact O-CG 3.45Å; I156-I163 HydrophobicContact CB-CD1 4.38Å; I156-I163 HydrophobicContact CG1-CD1 3.96Å; I156-V190 HydrophobicContact CG2-CG1 4.18Å; I156-V190 HydrophobicContact CG2-CG2 3.86Å
157	L	91.8	Very high	94.6	Very high	69 Å²	69	52.6 Å²	52.6	36%	0.361	29%	0.291	S	S	.	.	H	α-helix	trans	-77.9	-40	179.1	-67.6	175.7	0	0	0	113.3	L153 S154 Q155 V190 I192	L153-L157 HydrophobicContact CD1-CD1 3.86Å; L153-L157 HydrophobicContact CD1-CD2 4.45Å; L153-L157 HydrophobicContact CD1-CG 3.87Å; L153-L157 HydrophobicContact CG-CD1 4.11Å; L153-L157 WeakPolarHBondContact O-CG 3.34Å; L153-L157 PolarHBondContact O-N 3.07Å; S154-L157 PolarHBondContact O-N 3.3Å; Q155-L157 VanDerWaalsContact C-N 3.28Å; Q155-L157 PolarHBondContact O-N 3.36Å; L157-V190 HydrophobicContact CD2-CB 4.23Å; L157-V190 HydrophobicContact CD2-CG1 4.04Å; L157-I192 HydrophobicContact CD1-CD1 4.17Å; L157-I192 HydrophobicContact CD2-CD1 4.5Å
158	S	91.9	Very high	94.7	Very high	96 Å²	96	54.3 Å²	54.3	67%	0.671	30%	0.298	S	S	*	.	H	α-helix	trans	-93.6	-36	-173.9	57.9	0	0	0	0	114.4	S154 Q155	S154-S158 WeakPolarHBondContact O-CB 3.13Å; S154-S158 PolarHBondContact O-N 3.09Å; S154-S158 PolarHBondContact O-OG 2.71Å; Q155-S158 PolarHBondContact O-N 2.8Å
159	G	91.8	Very high	94.8	Very high	17 Å²	17	57.3 Å²	57.3	18%	0.175	32%	0.316	C	S	.	.			trans	-108.1	38.7	-173.1	0	0	0	0	0	113.8	Q155 E161 E162 I163	Q155-G159 CarbonylContact O-C 3.56Å; Q155-G159 VanDerWaalsContact O-CA 3.27Å; Q155-G159 WeakPolarHBondContact O-CA 3.48Å; Q155-G159 PolarHBondContact O-N 3.07Å; G159-E161 VanDerWaalsContact C-N 3.29Å; G159-E161 PolarHBondContact O-N 3.39Å; G159-E162 PolarHBondContact O-N 2.91Å; G159-I163 WeakPolarHBondContact O-CG1 3.34Å; G159-I163 PolarHBondContact O-N 3.45Å
160	R	93.6	Very high	94.9	Very high	75 Å²	75	60 Å²	60	28%	0.283	32%	0.324	S	S	.	.	H	α-helix	trans	-54.5	-42.9	-177.3	-71.2	-176.4	-178.5	-143.4	3.9	113.1	I156 I163 A164 I187 K188	I156-R160 WeakPolarHBondContact O-CG 3.45Å; R160-I163 PolarHBondContact O-N 3.28Å; R160-A164 WeakPolarHBondContact O-CB 3.37Å; R160-A164 PolarHBondContact O-N 2.86Å; R160-I187 HydrophobicContact CB-CD1 4.48Å; R160-I187 PolarHBondContact NH1-O 3.4Å; R160-K188 PolarHBondContact NH1-O 3.29Å
161	E	94.3	Very high	94.9	Very high	159 Å²	159	55.9 Å²	55.9	74%	0.743	30%	0.298	S	S	*	.	H	α-helix	trans	-65.7	-41.3	-178.4	-61.9	-55.7	132.8	0	0	112.5	G159 A164 H165	G159-E161 VanDerWaalsContact C-N 3.29Å; G159-E161 PolarHBondContact O-N 3.39Å; E161-A164 PolarHBondContact O-N 3.15Å; E161-H165 WeakPolarHBondContact O-CB 3.37Å; E161-H165 PolarHBondContact O-N 3.48Å
162	E	95.2	Very high	95	Very high	155 Å²	155	56.1 Å²	56.1	72%	0.724	30%	0.301	S	S	*	.	H	α-helix	trans	-66.2	-42.9	179.4	-174.3	179.1	-174.1	0	0	111.2	G159 H165 S166	G159-E162 PolarHBondContact O-N 2.91Å; E162-H165 PolarHBondContact O-N 3.21Å; E162-S166 PolarHBondContact O-N 2.92Å
163	I	96.1	Very high	95	Very high	3 Å²	3	60.6 Å²	60.6	2%	0.015	32%	0.324	C	S	.	.	H	α-helix	trans	-66.7	-44.2	176.6	-63.7	169.5	0	0	0	110.4	V147 L148 Q151 Q155 I156 G159 R160 H165 S166 I167 I187	V147-I163 HydrophobicContact CG1-CG2 4.14Å; L148-I163 HydrophobicContact CD2-CG2 3.76Å; Q151-I163 HydrophobicContact CB-CD1 4.24Å; Q151-I163 HydrophobicContact CG-CD1 3.98Å; Q151-I163 HydrophobicContact CG-CG1 4.11Å; Q155-I163 HydrophobicContact CB-CD1 4.5Å; I156-I163 HydrophobicContact CB-CD1 4.38Å; I156-I163 HydrophobicContact CG1-CD1 3.96Å; G159-I163 WeakPolarHBondContact O-CG1 3.34Å; G159-I163 PolarHBondContact O-N 3.45Å; R160-I163 PolarHBondContact O-N 3.28Å; I163-H165 VanDerWaalsContact C-N 3.32Å; I163-H165 PolarHBondContact O-N 3.17Å; I163-S166 WeakPolarHBondContact O-CB 3.49Å; I163-S166 PolarHBondContact O-N 3.49Å; I163-I167 HydrophobicContact CG2-CD1 3.88Å; I163-I167 WeakPolarHBondContact O-CG1 3.44Å; I163-I167 PolarHBondContact O-N 2.93Å; I163-I187 HydrophobicContact CB-CD1 4.17Å; I163-I187 HydrophobicContact CG2-CD1 3.91Å
164	A	95.9	Very high	95	Very high	4 Å²	4	62.3 Å²	62.3	3%	0.033	34%	0.339	C	S	.	.	H	α-helix	trans	-60.3	-41.7	177.4	0	0	0	0	0	111.8	R160 E161 I167 Q168 V185	R160-A164 WeakPolarHBondContact O-CB 3.37Å; R160-A164 PolarHBondContact O-N 2.86Å; E161-A164 PolarHBondContact O-N 3.15Å; A164-I167 PolarHBondContact O-N 3.41Å; A164-Q168 WeakPolarHBondContact O-CB 3.41Å; A164-Q168 PolarHBondContact O-N 3.35Å; A164-V185 WeakPolarHBondContact CB-O 3.4Å
165	H	96.4	Very high	95.2	Very high	118 Å²	118	58.3 Å²	58.3	55%	0.546	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-43.2	174.8	-175.8	-84.4	0	0	0	112	E161 E162 I163 I167 Q168 T169	E161-H165 WeakPolarHBondContact O-CB 3.37Å; E161-H165 PolarHBondContact O-N 3.48Å; E162-H165 PolarHBondContact O-N 3.21Å; I163-H165 VanDerWaalsContact C-N 3.32Å; I163-H165 PolarHBondContact O-N 3.17Å; H165-I167 PolarHBondContact O-N 3.25Å; H165-Q168 WeakPolarHBondContact O-CB 3.1Å; H165-Q168 PolarHBondContact O-N 3.03Å; H165-T169 PolarHBondContact O-N 2.79Å; H165-T169 PolarHBondContact O-OG1 3.47Å
166	S	96.1	Very high	95.2	Very high	51 Å²	51	58.9 Å²	58.9	36%	0.357	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-42.2	175.9	-177.2	0	0	0	0	112.5	E162 I163 T169 L170	E162-S166 PolarHBondContact O-N 2.92Å; I163-S166 WeakPolarHBondContact O-CB 3.49Å; I163-S166 PolarHBondContact O-N 3.49Å; S166-T169 PolarHBondContact O-N 3.01Å; S166-T169 PolarHBondContact O-OG1 2.76Å; S166-L170 PolarHBondContact O-N 3.24Å; S166-L170 VanDerWaalsContact O-N 3.15Å
167	I	97.1	Very high	95.1	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-42.3	174.2	-65.6	162.4	0	0	0	110.7	T143 L144 V147 I163 A164 H165 L170 L171 V185	T143-I167 HydrophobicContact CG2-CG2 4.08Å; L144-I167 HydrophobicContact CD1-CD1 3.68Å; V147-I167 HydrophobicContact CB-CD1 4.39Å; V147-I167 HydrophobicContact CB-CG1 3.79Å; V147-I167 HydrophobicContact CG1-CD1 4.35Å; V147-I167 HydrophobicContact CG1-CG1 3.79Å; V147-I167 HydrophobicContact CG2-CG1 3.94Å; I163-I167 HydrophobicContact CG2-CD1 3.88Å; I163-I167 WeakPolarHBondContact O-CG1 3.44Å; I163-I167 PolarHBondContact O-N 2.93Å; A164-I167 PolarHBondContact O-N 3.41Å; H165-I167 PolarHBondContact O-N 3.25Å; I167-L170 PolarHBondContact O-N 3.1Å; I167-L171 HydrophobicContact CG2-CD1 3.69Å; I167-L171 HydrophobicContact CG2-CG 4.2Å; I167-L171 WeakPolarHBondContact O-CB 3.4Å; I167-L171 WeakPolarHBondContact O-CG 3.27Å; I167-L171 PolarHBondContact O-N 3.34Å; I167-V185 HydrophobicContact CB-CG1 4.35Å; I167-V185 HydrophobicContact CG2-CB 4.49Å; I167-V185 HydrophobicContact CG2-CG1 3.9Å; I167-V185 HydrophobicContact CG2-CG2 4.2Å
168	Q	97.3	Very high	95.2	Very high	51 Å²	51	62 Å²	62	24%	0.238	33%	0.326	C	S	.	.	H	α-helix	trans	-59	-48.1	178	175.4	176.4	-14.7	0	0	111.4	A164 H165 L170 L171 D172 V182 A183 V185	A164-Q168 WeakPolarHBondContact O-CB 3.41Å; A164-Q168 PolarHBondContact O-N 3.35Å; H165-Q168 WeakPolarHBondContact O-CB 3.1Å; H165-Q168 PolarHBondContact O-N 3.03Å; Q168-L170 PolarHBondContact O-N 3.44Å; Q168-L171 PolarHBondContact O-N 3.33Å; Q168-D172 WeakPolarHBondContact O-CB 3.24Å; Q168-D172 PolarHBondContact O-N 2.86Å; Q168-V182 HydrophobicContact CG-CG1 4.11Å; Q168-A183 PolarHBondContact NE2-O 3.22Å; Q168-A183 VanDerWaalsContact NE2-O 3.12Å; Q168-V185 HydrophobicContact CB-CB 4.41Å; Q168-V185 HydrophobicContact CB-CG2 3.87Å
169	T	96.8	Very high	95.3	Very high	62 Å²	62	57.4 Å²	57.4	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-61.4	-44.7	179.2	46.9	0	0	0	0	111.6	H165 S166 L171 D172 D173	H165-T169 PolarHBondContact O-N 2.79Å; H165-T169 PolarHBondContact O-OG1 3.47Å; S166-T169 PolarHBondContact O-N 3.01Å; S166-T169 PolarHBondContact O-OG1 2.76Å; T169-L171 PolarHBondContact O-N 2.69Å; T169-D172 PolarHBondContact O-N 2.95Å; T169-D173 VanDerWaalsContact O-CG 3.3Å; T169-D173 PolarHBondContact O-N 3.38Å
170	L	96.6	Very high	95.6	Very high	82 Å²	82	56.6 Å²	56.6	43%	0.429	29%	0.286	S	S	.	.	H	α-helix	trans	-66	-39.2	-179.7	-164.1	150.3	0	0	0	112	T143 S166 I167 Q168 A174	T143-L170 HydrophobicContact CG2-CB 4.22Å; T143-L170 HydrophobicContact CG2-CD2 3.49Å; T143-L170 VanDerWaalsContact CG2-CD2 3.49Å; T143-L170 HydrophobicContact CG2-CG 4.26Å; T143-L170 WeakPolarHBondContact OG1-CD2 3.3Å; S166-L170 PolarHBondContact O-N 3.24Å; S166-L170 VanDerWaalsContact O-N 3.15Å; I167-L170 PolarHBondContact O-N 3.1Å; Q168-L170 PolarHBondContact O-N 3.44Å; L170-A174 VanDerWaalsContact O-CB 3.32Å; L170-A174 WeakPolarHBondContact O-CB 3.5Å; L170-A174 PolarHBondContact O-N 2.96Å; L170-A174 VanDerWaalsContact O-N 3.16Å
171	L	96.7	Very high	95.7	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-71.3	-38.6	176.6	-73.4	175.5	0	0	0	112.6	V115 L139 A140 T143 I167 Q168 T169 T175 V182 V185	V115-L171 HydrophobicContact CG1-CD1 4.44Å; V115-L171 HydrophobicContact CG2-CD1 4.08Å; L139-L171 HydrophobicContact CD2-CD2 4.18Å; L139-L171 HydrophobicContact CG-CD2 3.88Å; A140-L171 HydrophobicContact CB-CD1 4.17Å; A140-L171 HydrophobicContact CB-CD2 4.4Å; T143-L171 HydrophobicContact CG2-CD2 4.16Å; T143-L171 HydrophobicContact CG2-CG 4.05Å; I167-L171 HydrophobicContact CG2-CD1 3.69Å; I167-L171 HydrophobicContact CG2-CG 4.2Å; I167-L171 WeakPolarHBondContact O-CB 3.4Å; I167-L171 WeakPolarHBondContact O-CG 3.27Å; I167-L171 PolarHBondContact O-N 3.34Å; Q168-L171 PolarHBondContact O-N 3.33Å; T169-L171 PolarHBondContact O-N 2.69Å; L171-T175 VanDerWaalsContact O-CB 3.29Å; L171-T175 WeakPolarHBondContact O-CB 3.43Å; L171-T175 WeakPolarHBondContact O-CG2 3.27Å; L171-T175 PolarHBondContact O-N 2.67Å; L171-T175 PolarHBondContact O-OG1 3.17Å; L171-V182 HydrophobicContact CB-CG2 3.98Å; L171-V185 HydrophobicContact CD1-CG2 4.22Å
172	D	96.5	Very high	95.9	Very high	49 Å²	49	51.5 Å²	51.5	26%	0.262	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-46.5	178	-158.7	51.5	0	0	0	110.5	Q168 T169 A174 T175 E176 R181 V182	Q168-D172 WeakPolarHBondContact O-CB 3.24Å; Q168-D172 PolarHBondContact O-N 2.86Å; T169-D172 PolarHBondContact O-N 2.95Å; D172-A174 PolarHBondContact O-N 3.47Å; D172-T175 PolarHBondContact O-N 3.35Å; D172-E176 PolarHBondContact O-N 2.99Å; D172-R181 WeakPolarHBondContact OD1-CA 3.4Å; D172-V182 HydrophobicContact CB-CB 4.22Å; D172-V182 HydrophobicContact CB-CG2 4.4Å; D172-V182 PolarHBondContact OD1-N 3.41Å
173	D	96.2	Very high	95.9	Very high	116 Å²	116	46.5 Å²	46.5	62%	0.62	25%	0.246	S	C	*	.	H	α-helix	trans	-61.4	-45.3	178.4	-70	-19.2	0	0	0	112	T169	T169-D173 VanDerWaalsContact O-CG 3.3Å; T169-D173 PolarHBondContact O-N 3.38Å
174	A	94.5	Very high	95.9	Very high	40 Å²	40	52 Å²	52	33%	0.331	27%	0.267	S	S	.	.	H	α-helix	trans	-71.6	-30.6	-179	0	0	0	0	0	113.2	L139 L170 D172	L139-A174 HydrophobicContact CD2-CB 3.78Å; L170-A174 VanDerWaalsContact O-CB 3.32Å; L170-A174 WeakPolarHBondContact O-CB 3.5Å; L170-A174 PolarHBondContact O-N 2.96Å; L170-A174 VanDerWaalsContact O-N 3.16Å; D172-A174 PolarHBondContact O-N 3.47Å
175	T	95.4	Very high	95.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-93.1	-6.6	-178.7	63.9	0	0	0	0	113.9	T136 L139 L171 D172 L177 W178 I180	T136-T175 HydrophobicContact CG2-CG2 4.4Å; L139-T175 HydrophobicContact CD2-CG2 3.6Å; L171-T175 VanDerWaalsContact O-CB 3.29Å; L171-T175 WeakPolarHBondContact O-CB 3.43Å; L171-T175 WeakPolarHBondContact O-CG2 3.27Å; L171-T175 PolarHBondContact O-N 2.67Å; L171-T175 PolarHBondContact O-OG1 3.17Å; D172-T175 PolarHBondContact O-N 3.35Å; T175-L177 PolarHBondContact O-N 3.12Å; T175-W178 HydrophobicContact CG2-CE3 3.8Å; T175-W178 HydrophobicContact CG2-CZ3 3.78Å; T175-W178 PolarHBondContact O-N 3.3Å; T175-I180 PolarHBondContact O-N 2.93Å
176	E	94.8	Very high	95.9	Very high	87 Å²	87	50.3 Å²	50.3	41%	0.407	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-53.9	-41.6	178.3	-168.6	-167.2	-161.6	0	0	111.6	K9 Y120 D172 W178 G179	K9-E176 IonicContact NZ-OE2 3.51Å; K9-E176 PolarHBondContact NZ-OE2 3.4Å; Y120-E176 PolarHBondContact OH-O 2.75Å; D172-E176 PolarHBondContact O-N 2.99Å; E176-W178 PolarHBondContact O-N 3.44Å; E176-G179 PolarHBondContact O-N 3.01Å
177	L	92.1	Very high	95.9	Very high	81 Å²	81	48.7 Å²	48.7	42%	0.424	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-62	-28.1	179	-65.2	174.2	0	0	0	112.7	K9 N128 T175 G179	K9-L177 HydrophobicContact CG-CD2 4.25Å; N128-L177 PolarHBondContact ND2-O 3.03Å; T175-L177 PolarHBondContact O-N 3.12Å; L177-G179 VanDerWaalsContact C-N 3.27Å
178	W	94.9	Very high	95.7	Very high	52 Å²	52	54.4 Å²	54.4	20%	0.197	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-86.8	2.1	176.9	-54	-25.4	0	0	0	112.5	S124 A125 V129 A135 L139 T175 E176 I180	S124-W178 CarbonylContact C-O 3.56Å; A125-W178 WeakPolarHBondContact CA-O 3.46Å; A125-W178 WeakPolarHBondContact CB-O 3.41Å; A125-W178 PolarHBondContact N-O 3.47Å; A125-W178 VanDerWaalsContact N-O 3.09Å; V129-W178 HydrophobicContact CB-CG 4.3Å; V129-W178 HydrophobicContact CG1-CB 4.19Å; V129-W178 HydrophobicContact CG1-CG 4.15Å; A135-W178 HydrophobicContact CB-CE3 4.47Å; A135-W178 HydrophobicContact CB-CH2 3.92Å; A135-W178 HydrophobicContact CB-CZ2 4.37Å; A135-W178 HydrophobicContact CB-CZ3 3.97Å; L139-W178 HydrophobicContact CB-CH2 4.2Å; L139-W178 HydrophobicContact CB-CZ3 4.39Å; L139-W178 HydrophobicContact CD2-CH2 3.71Å; L139-W178 HydrophobicContact CD2-CZ3 3.77Å; T175-W178 HydrophobicContact CG2-CE3 3.8Å; T175-W178 HydrophobicContact CG2-CZ3 3.78Å; T175-W178 PolarHBondContact O-N 3.3Å; E176-W178 PolarHBondContact O-N 3.44Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 HydrophobicContact CB-CD1 4.12Å; W178-I180 HydrophobicContact CB-CG1 4.11Å; W178-I180 HydrophobicContact CE3-CD1 3.99Å
179	G	94.1	Very high	95.5	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	23.1	-177.6	0	0	0	0	0	113.6	I119 Y120 S121 E176 L177	I119-G179 CarbonylContact C-O 3.53Å; Y120-G179 WeakPolarHBondContact CD1-O 3.39Å; Y120-G179 PolarHBondContact N-O 2.96Å; S121-G179 PolarHBondContact N-O 3.09Å; S121-G179 VanDerWaalsContact N-O 3.09Å; E176-G179 PolarHBondContact O-N 3.01Å; L177-G179 VanDerWaalsContact C-N 3.27Å
180	I	96.8	Very high	95.4	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	147.9	177.9	-55.4	176.2	0	0	0	109.2	Y117 Y120 V132 T136 T175 W178	Y117-I180 HydrophobicContact CD2-CG2 3.66Å; Y117-I180 HydrophobicContact CG-CG2 3.95Å; Y120-I180 WeakPolarHBondContact CE1-O 3.44Å; V132-I180 HydrophobicContact CG2-CD1 3.33Å; V132-I180 HydrophobicContact CG2-CG1 3.71Å; T136-I180 HydrophobicContact CG2-CD1 4.36Å; T136-I180 WeakPolarHBondContact OG1-CD1 3.42Å; T175-I180 PolarHBondContact O-N 2.93Å; W178-I180 VanDerWaalsContact C-N 3.31Å; W178-I180 HydrophobicContact CB-CD1 4.12Å; W178-I180 HydrophobicContact CB-CG1 4.11Å; W178-I180 HydrophobicContact CE3-CD1 3.99Å
181	R	96.9	Very high	95.2	Very high	121 Å²	121	56.9 Å²	56.9	46%	0.457	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.2	166.4	-179	167.9	-68.3	177.5	0.9	109.6	Y117 R118 Y120 D172	Y117-R181 WeakPolarHBondContact CA-O 3.44Å; R118-R181 PolarHBondContact N-O 2.9Å; R118-R181 PolarHBondContact O-N 2.86Å; Y120-R181 HydrophobicContact CD1-CB 4.24Å; D172-R181 WeakPolarHBondContact OD1-CA 3.4Å
182	V	97.6	Very high	95	Very high	5 Å²	5	58 Å²	58	3%	0.03	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	116	176.4	-175.4	0	0	0	0	108.6	V115 Q168 L171 D172 V185	V115-V182 HydrophobicContact CG1-CG1 3.8Å; Q168-V182 HydrophobicContact CG-CG1 4.11Å; L171-V182 HydrophobicContact CB-CG2 3.98Å; D172-V182 HydrophobicContact CB-CB 4.22Å; D172-V182 HydrophobicContact CB-CG2 4.4Å; D172-V182 PolarHBondContact OD1-N 3.41Å; V182-V185 HydrophobicContact CG1-CG2 3.99Å
183	A	95.2	Very high	94.8	Very high	51 Å²	51	57.9 Å²	57.9	42%	0.421	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-43.9	-177.7	0	0	0	0	0	112.1	Y116 Q168	Y116-A183 WeakPolarHBondContact O-CA 3.36Å; Y116-A183 WeakPolarHBondContact O-CB 3.23Å; Y116-A183 PolarHBondContact O-N 2.87Å; Q168-A183 PolarHBondContact NE2-O 3.22Å; Q168-A183 VanDerWaalsContact NE2-O 3.12Å
184	R	95.4	Very high	94.6	Very high	118 Å²	118	56.2 Å²	56.2	45%	0.445	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.3	157.5	176	65.9	-176	-170.3	-129	0.8	111.5	Y116 E186	Y116-R184 HydrophobicContact CD2-CG 3.38Å; Y116-R184 HydrophobicContact CE2-CG 4.07Å; Y116-R184 HydrophobicContact CG-CG 3.78Å; Y116-R184 PolarHBondContact N-O 3.06Å; Y116-R184 PolarHBondContact O-N 2.76Å; Y116-R184 PolarHBondContact OH-NH2 3.1Å; R184-E186 WeakPolarHBondContact CD-OE1 3.42Å; R184-E186 IonicContact CZ-OE1 3.69Å; R184-E186 IonicContact NE-OE1 2.87Å; R184-E186 PolarHBondContact NE-OE1 3.49Å; R184-E186 IonicContact NH2-OE1 3.63Å
185	V	97.6	Very high	94.5	Very high	10 Å²	10	61.8 Å²	61.8	6%	0.061	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.2	171.5	-179.9	0	0	0	0	107.6	V114 V115 A164 I167 Q168 L171 V182	V114-V185 WeakPolarHBondContact O-CA 3.45Å; V115-V185 HydrophobicContact CG1-CG2 4.28Å; V115-V185 HydrophobicContact CG2-CG1 4.38Å; V115-V185 HydrophobicContact CG2-CG2 4.24Å; A164-V185 WeakPolarHBondContact CB-O 3.4Å; I167-V185 HydrophobicContact CB-CG1 4.35Å; I167-V185 HydrophobicContact CG2-CB 4.49Å; I167-V185 HydrophobicContact CG2-CG1 3.9Å; I167-V185 HydrophobicContact CG2-CG2 4.2Å; Q168-V185 HydrophobicContact CB-CB 4.41Å; Q168-V185 HydrophobicContact CB-CG2 3.87Å; L171-V185 HydrophobicContact CD1-CG2 4.22Å; V182-V185 HydrophobicContact CG1-CG2 3.99Å
186	E	95.9	Very high	94.2	Very high	77 Å²	77	64.4 Å²	64.4	36%	0.36	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	134.1	176.7	-66.9	166.6	-162.7	0	0	109.6	G113 V114 Y116 R184	G113-E186 CarbonylContact C-O 3.57Å; G113-E186 WeakPolarHBondContact CA-O 3.29Å; V114-E186 HydrophobicContact CG1-CB 3.75Å; V114-E186 PolarHBondContact N-O 2.84Å; V114-E186 PolarHBondContact O-N 3.37Å; Y116-E186 VanDerWaalsContact CE2-CD 3.47Å; Y116-E186 HydrophobicContact CE2-CG 4.13Å; Y116-E186 WeakPolarHBondContact CE2-OE1 3.28Å; Y116-E186 PolarHBondContact OH-OE2 3.27Å; Y116-E186 VanDerWaalsContact OH-OE2 3.1Å; R184-E186 WeakPolarHBondContact CD-OE1 3.42Å; R184-E186 IonicContact CZ-OE1 3.69Å; R184-E186 IonicContact NE-OE1 2.87Å; R184-E186 PolarHBondContact NE-OE1 3.49Å; R184-E186 IonicContact NH2-OE1 3.63Å
187	I	95.6	Very high	94.1	Very high	17 Å²	17	65.5 Å²	65.5	9%	0.087	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	117.3	171.8	-59	170.1	0	0	0	107.3	V111 L148 R160 I163 V190	V111-I187 HydrophobicContact CG1-CG2 3.68Å; L148-I187 HydrophobicContact CD2-CD1 4.34Å; R160-I187 HydrophobicContact CB-CD1 4.48Å; R160-I187 PolarHBondContact NH1-O 3.4Å; I163-I187 HydrophobicContact CB-CD1 4.17Å; I163-I187 HydrophobicContact CG2-CD1 3.91Å; I187-V190 HydrophobicContact CG2-CG2 4.03Å
188	K	93.6	Very high	94.2	Very high	121 Å²	121	70.4 Å²	70.4	53%	0.526	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-80.6	-171.8	179.5	-171.6	167	-150.4	0	110.9	D112 R160	D112-K188 PolarHBondContact O-N 2.77Å; D112-K188 WeakPolarHBondContact OD1-CB 3.46Å; D112-K188 IonicContact OD2-NZ 3.62Å; R160-K188 PolarHBondContact NH1-O 3.29Å
189	D	93.1	Very high	94.1	Very high	84 Å²	84	71.7 Å²	71.7	45%	0.449	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136.2	-176.8	-64.3	-44.1	0	0	0	111	V111 D112	V111-D189 WeakPolarHBondContact CA-O 3.44Å; D112-D189 PolarHBondContact N-O 2.82Å; D112-D189 VanDerWaalsContact N-O 3.15Å; D112-D189 WeakPolarHBondContact OD1-CA 3.25Å; D112-D189 WeakPolarHBondContact OD1-CB 3.45Å; D112-D189 PolarHBondContact OD1-N 3.24Å
190	V	93.7	Very high	94	Very high	22 Å²	22	75 Å²	75	13%	0.133	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	103.1	174.1	178.3	0	0	0	0	106.9	V111 L153 I156 L157 I187 I192	V111-V190 HydrophobicContact CG1-CG2 4.15Å; V111-V190 HydrophobicContact CG2-CB 4.45Å; V111-V190 HydrophobicContact CG2-CG1 4.11Å; V111-V190 HydrophobicContact CG2-CG2 4.12Å; L153-V190 HydrophobicContact CD1-CG1 4.49Å; I156-V190 HydrophobicContact CG2-CG1 4.18Å; I156-V190 HydrophobicContact CG2-CG2 3.86Å; L157-V190 HydrophobicContact CD2-CB 4.23Å; L157-V190 HydrophobicContact CD2-CG1 4.04Å; I187-V190 HydrophobicContact CG2-CG2 4.03Å; V190-I192 HydrophobicContact CG1-CG1 4.46Å
191	R	93.1	Very high	93.8	Very high	140 Å²	140	77.7 Å²	77.7	53%	0.528	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.5	178.8	-58.4	-168.4	-64.9	-147.6	1.2	110	T109 Q110	T109-R191 WeakPolarHBondContact CA-O 3.47Å; Q110-R191 HydrophobicContact CB-CB 4.24Å; Q110-R191 PolarHBondContact N-O 3.09Å; Q110-R191 PolarHBondContact O-N 3.39Å
192	I	92.9	Very high	93.7	Very high	27 Å²	27	74.7 Å²	74.7	14%	0.138	38%	0.383	C	S	.	.			trans	-111.8	147.4	-179.9	-57.4	165.5	0	0	0	107.3	T109 L153 L157 V190 V194 L196 Q197	T109-I192 HydrophobicContact CG2-CG1 4.27Å; L153-I192 HydrophobicContact CD1-CD1 3.87Å; L153-I192 HydrophobicContact CD1-CG1 4.15Å; L153-I192 HydrophobicContact CD2-CD1 4.11Å; L153-I192 HydrophobicContact CD2-CG1 4.49Å; L157-I192 HydrophobicContact CD1-CD1 4.17Å; L157-I192 HydrophobicContact CD2-CD1 4.5Å; V190-I192 HydrophobicContact CG1-CG1 4.46Å; I192-V194 PolarHBondContact O-N 3.26Å; I192-L196 HydrophobicContact CG2-CB 4.09Å; I192-L196 HydrophobicContact CG2-CD2 3.63Å; I192-L196 HydrophobicContact CG2-CG 4.32Å; I192-Q197 HydrophobicContact CG2-CB 4.5Å
193	P	91.1	Very high	93.6	Very high	45 Å²	45	81 Å²	81	29%	0.292	41%	0.413	S	S	.	.			trans	-51.4	135.6	172	-27.8	34.3	0	0	0	112.1	T108 Q195 L196 Q197	T108-P193 WeakPolarHBondContact O-CD 3.45Å; P193-Q195 VanDerWaalsContact C-N 3.25Å; P193-Q195 PolarHBondContact O-N 3.15Å; P193-L196 PolarHBondContact O-N 3.18Å; P193-Q197 PolarHBondContact O-N 2.99Å
194	V	91.8	Very high	93.5	Very high	82 Å²	82	80.3 Å²	80.3	50%	0.497	41%	0.406	S	S	.	.	H	α-helix	trans	-59	-35.5	-173.1	179.6	0	0	0	0	112.3	I192 R198	I192-V194 PolarHBondContact O-N 3.26Å; V194-R198 WeakPolarHBondContact O-CG 3.4Å; V194-R198 PolarHBondContact O-N 2.97Å; V194-R198 VanDerWaalsContact O-N 3.14Å
195	Q	91.9	Very high	93.5	Very high	156 Å²	156	80.4 Å²	80.4	73%	0.729	41%	0.412	S	S	*	.	H	α-helix	trans	-63.4	-47.6	176.7	-64.7	113.7	-20.3	0	0	111.4	P193 R198 S199	P193-Q195 VanDerWaalsContact C-N 3.25Å; P193-Q195 PolarHBondContact O-N 3.15Å; Q195-R198 PolarHBondContact O-N 3.24Å; Q195-S199 PolarHBondContact O-N 3.34Å; Q195-S199 VanDerWaalsContact O-N 3.1Å; Q195-S199 PolarHBondContact O-OG 2.51Å
196	L	91.1	Very high	93.4	Very high	55 Å²	55	82.6 Å²	82.6	29%	0.288	43%	0.431	S	S	.	.	H	α-helix	trans	-66.8	-42.9	-179.7	-167.2	158.1	0	0	0	111	V107 L153 I192 P193 R198 S199 M200	V107-L196 HydrophobicContact CB-CD1 4.45Å; V107-L196 HydrophobicContact CG1-CD1 3.48Å; V107-L196 VanDerWaalsContact CG1-CD1 3.48Å; V107-L196 HydrophobicContact CG2-CD1 4.13Å; L153-L196 HydrophobicContact CD2-CD2 4.25Å; I192-L196 HydrophobicContact CG2-CB 4.09Å; I192-L196 HydrophobicContact CG2-CD2 3.63Å; I192-L196 HydrophobicContact CG2-CG 4.32Å; P193-L196 PolarHBondContact O-N 3.18Å; L196-R198 VanDerWaalsContact C-N 3.28Å; L196-R198 PolarHBondContact O-N 2.91Å; L196-S199 PolarHBondContact O-N 3.29Å; L196-M200 HydrophobicContact CD2-CB 4.35Å; L196-M200 HydrophobicContact CD2-CE 3.35Å; L196-M200 VanDerWaalsContact O-CB 3.3Å; L196-M200 WeakPolarHBondContact O-CB 3.43Å; L196-M200 PolarHBondContact O-N 2.68Å
197	Q	92.3	Very high	93.5	Very high	110 Å²	110	81.9 Å²	81.9	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-56.8	-42.8	177.8	-174.8	-179.6	2.7	0	0	112	I192 P193 A201	I192-Q197 HydrophobicContact CG2-CB 4.5Å; P193-Q197 PolarHBondContact O-N 2.99Å; Q197-A201 VanDerWaalsContact O-CB 3.31Å; Q197-A201 WeakPolarHBondContact O-CB 3.15Å; Q197-A201 PolarHBondContact O-N 3.32Å
198	R	93.7	Very high	93.5	Very high	184 Å²	184	90.1 Å²	90.1	69%	0.694	46%	0.462	S	S	*	.	H	α-helix	trans	-66.3	-47	176.6	-72.2	176.5	-176.8	179.9	1.7	112	V194 Q195 L196 M200 A201 A202	V194-R198 WeakPolarHBondContact O-CG 3.4Å; V194-R198 PolarHBondContact O-N 2.97Å; V194-R198 VanDerWaalsContact O-N 3.14Å; Q195-R198 PolarHBondContact O-N 3.24Å; L196-R198 VanDerWaalsContact C-N 3.28Å; L196-R198 PolarHBondContact O-N 2.91Å; R198-M200 VanDerWaalsContact C-N 3.34Å; R198-M200 PolarHBondContact O-N 2.93Å; R198-A201 PolarHBondContact O-N 2.97Å; R198-A202 WeakPolarHBondContact O-CB 3.31Å; R198-A202 PolarHBondContact O-N 2.82Å
199	S	93	Very high	93.7	Very high	80 Å²	80	90.4 Å²	90.4	56%	0.559	47%	0.465	S	S	*	.	H	α-helix	trans	-60.9	-43.4	178.1	-59.8	0	0	0	0	111.9	Q195 L196 A202 E203	Q195-S199 PolarHBondContact O-N 3.34Å; Q195-S199 VanDerWaalsContact O-N 3.1Å; Q195-S199 PolarHBondContact O-OG 2.51Å; L196-S199 PolarHBondContact O-N 3.29Å; S199-A202 PolarHBondContact O-N 3.22Å; S199-E203 WeakPolarHBondContact O-CB 3.09Å; S199-E203 PolarHBondContact O-N 3.33Å
200	M	91.7	Very high	93.9	Very high	69 Å²	69	89.1 Å²	89.1	34%	0.34	47%	0.466	S	S	.	.	H	α-helix	trans	-65	-41.8	177.3	-175.2	-174.4	-63	0	0	112	L153 L196 R198 E203 A204	L153-M200 HydrophobicContact CD2-CE 3.42Å; L153-M200 VanDerWaalsContact CD2-CE 3.42Å; L153-M200 HydrophobicContact CG-CE 4.31Å; L196-M200 HydrophobicContact CD2-CB 4.35Å; L196-M200 HydrophobicContact CD2-CE 3.35Å; L196-M200 VanDerWaalsContact O-CB 3.3Å; L196-M200 WeakPolarHBondContact O-CB 3.43Å; L196-M200 PolarHBondContact O-N 2.68Å; R198-M200 VanDerWaalsContact C-N 3.34Å; R198-M200 PolarHBondContact O-N 2.93Å; M200-E203 PolarHBondContact O-N 3.14Å; M200-A204 VanDerWaalsContact O-CB 3.23Å; M200-A204 WeakPolarHBondContact O-CB 3.44Å; M200-A204 PolarHBondContact O-N 2.94Å
201	A	92	Very high	94.1	Very high	58 Å²	58	97.1 Å²	97.1	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-44.3	176.5	0	0	0	0	0	111.5	Q197 R198 A204 E205	Q197-A201 VanDerWaalsContact O-CB 3.31Å; Q197-A201 WeakPolarHBondContact O-CB 3.15Å; Q197-A201 PolarHBondContact O-N 3.32Å; R198-A201 PolarHBondContact O-N 2.97Å; A201-A204 PolarHBondContact O-N 3.07Å; A201-E205 WeakPolarHBondContact O-CB 3.39Å; A201-E205 PolarHBondContact O-N 3.45Å
202	A	95.4	Very high	94.3	Very high	58 Å²	58	93.2 Å²	93.2	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-63.9	-42.5	177.1	0	0	0	0	0	112.3	R198 S199 E205 A206	R198-A202 WeakPolarHBondContact O-CB 3.31Å; R198-A202 PolarHBondContact O-N 2.82Å; S199-A202 PolarHBondContact O-N 3.22Å; A202-E205 PolarHBondContact O-N 3.31Å; A202-A206 WeakPolarHBondContact O-CB 3.3Å; A202-A206 PolarHBondContact O-N 2.95Å
203	E	94.6	Very high	94.5	Very high	138 Å²	138	99.9 Å²	99.9	65%	0.645	52%	0.52	S	S	*	.	H	α-helix	trans	-64.9	-41.4	175.3	-173.3	-179.1	175.6	0	0	111.8	S199 M200 T207	S199-E203 WeakPolarHBondContact O-CB 3.09Å; S199-E203 PolarHBondContact O-N 3.33Å; M200-E203 PolarHBondContact O-N 3.14Å; E203-T207 WeakPolarHBondContact O-CB 3.34Å; E203-T207 VanDerWaalsContact O-CG2 3.25Å; E203-T207 WeakPolarHBondContact O-CG2 3.44Å; E203-T207 PolarHBondContact O-N 3.4Å; E203-T207 PolarHBondContact O-OG1 3.41Å
204	A	93	Very high	94.9	Very high	35 Å²	35	102.3 Å²	102.3	29%	0.289	53%	0.534	S	S	.	.	H	α-helix	trans	-65.9	-38.1	177.3	0	0	0	0	0	112.4	M200 A201 T207 R208	M200-A204 VanDerWaalsContact O-CB 3.23Å; M200-A204 WeakPolarHBondContact O-CB 3.44Å; M200-A204 PolarHBondContact O-N 2.94Å; A201-A204 PolarHBondContact O-N 3.07Å; A204-T207 WeakPolarHBondContact CA-OG1 3.35Å; A204-T207 PolarHBondContact O-OG1 3.2Å; A204-T207 VanDerWaalsContact O-OG1 3.07Å; A204-R208 WeakPolarHBondContact O-CB 3.38Å; A204-R208 WeakPolarHBondContact O-CD 3.33Å; A204-R208 WeakPolarHBondContact O-CG 3.16Å; A204-R208 PolarHBondContact O-N 3.08Å
205	E	95.4	Very high	95.1	Very high	121 Å²	121	104.1 Å²	104.1	57%	0.565	54%	0.54	S	S	*	.	H	α-helix	trans	-66.3	-50.9	175.3	-173.5	166.6	-150.2	0	0	111	A201 A202 T207 R208 E209	A201-E205 WeakPolarHBondContact O-CB 3.39Å; A201-E205 PolarHBondContact O-N 3.45Å; A202-E205 PolarHBondContact O-N 3.31Å; E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.02Å; E205-R208 PolarHBondContact O-N 3.44Å; E205-R208 VanDerWaalsContact O-N 3.12Å; E205-E209 WeakPolarHBondContact O-CG 3.39Å; E205-E209 PolarHBondContact O-N 3.4Å
206	A	97	Very high	95.4	Very high	56 Å²	56	99.8 Å²	99.8	46%	0.463	53%	0.531	S	S	.	.	H	α-helix	trans	-59.5	-41.5	178.1	0	0	0	0	0	112.6	A202 A210	A202-A206 WeakPolarHBondContact O-CB 3.3Å; A202-A206 PolarHBondContact O-N 2.95Å; A206-A210 VanDerWaalsContact O-CB 3.3Å; A206-A210 WeakPolarHBondContact O-CB 3.23Å; A206-A210 PolarHBondContact O-N 3.4Å
207	T	96.5	Very high	95.6	Very high	62 Å²	62	99.9 Å²	99.9	38%	0.38	54%	0.54	S	S	.	.	H	α-helix	trans	-69.5	-33.8	177.1	52.8	0	0	0	0	112.6	E203 A204 E205 R211	E203-T207 WeakPolarHBondContact O-CB 3.34Å; E203-T207 VanDerWaalsContact O-CG2 3.25Å; E203-T207 WeakPolarHBondContact O-CG2 3.44Å; E203-T207 PolarHBondContact O-N 3.4Å; E203-T207 PolarHBondContact O-OG1 3.41Å; A204-T207 WeakPolarHBondContact CA-OG1 3.35Å; A204-T207 PolarHBondContact O-OG1 3.2Å; A204-T207 VanDerWaalsContact O-OG1 3.07Å; E205-T207 VanDerWaalsContact C-N 3.33Å; E205-T207 PolarHBondContact O-N 3.02Å; T207-R211 WeakPolarHBondContact O-CB 3.25Å; T207-R211 WeakPolarHBondContact O-CG 3.39Å; T207-R211 PolarHBondContact O-N 2.99Å
208	R	96.9	Very high	95.9	Very high	189 Å²	189	99.9 Å²	99.9	71%	0.713	54%	0.54	S	S	*	.	H	α-helix	trans	-68.4	-44	173.6	-78.1	171.6	-179.1	178.1	1.3	111.9	A204 E205 R211 A212	A204-R208 WeakPolarHBondContact O-CB 3.38Å; A204-R208 WeakPolarHBondContact O-CD 3.33Å; A204-R208 WeakPolarHBondContact O-CG 3.16Å; A204-R208 PolarHBondContact O-N 3.08Å; E205-R208 PolarHBondContact O-N 3.44Å; E205-R208 VanDerWaalsContact O-N 3.12Å; R208-R211 PolarHBondContact O-N 2.97Å; R208-A212 WeakPolarHBondContact O-CB 3.46Å; R208-A212 PolarHBondContact O-N 3.41Å
209	E	97.8	Very high	96	Very high	127 Å²	127	92.9 Å²	92.9	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-46.3	176.2	-71.9	-175.3	169.6	0	0	111.9	E205 R211 A212 K213	E205-E209 WeakPolarHBondContact O-CG 3.39Å; E205-E209 PolarHBondContact O-N 3.4Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 3.22Å; E209-A212 PolarHBondContact O-N 3.41Å; E209-K213 PolarHBondContact O-N 2.94Å
210	A	97.5	Very high	96.2	Very high	57 Å²	57	95.6 Å²	95.6	47%	0.471	53%	0.528	S	S	.	.	H	α-helix	trans	-59.3	-44.4	175.9	0	0	0	0	0	111.5	A206 K213 V214	A206-A210 VanDerWaalsContact O-CB 3.3Å; A206-A210 WeakPolarHBondContact O-CB 3.23Å; A206-A210 PolarHBondContact O-N 3.4Å; A210-K213 PolarHBondContact O-N 3.14Å; A210-V214 WeakPolarHBondContact O-CG2 3.42Å; A210-V214 PolarHBondContact O-N 3.46Å; A210-V214 VanDerWaalsContact O-N 3.11Å
211	R	97.4	Very high	96.4	Very high	190 Å²	190	97.4 Å²	97.4	72%	0.717	54%	0.537	S	S	*	.	H	α-helix	trans	-64	-41.2	175.5	-77.3	176.4	-178.2	-179.2	2.9	112.4	T207 R208 E209 K213 V214 L215	T207-R211 WeakPolarHBondContact O-CB 3.25Å; T207-R211 WeakPolarHBondContact O-CG 3.39Å; T207-R211 PolarHBondContact O-N 2.99Å; R208-R211 PolarHBondContact O-N 2.97Å; E209-R211 VanDerWaalsContact C-N 3.33Å; E209-R211 PolarHBondContact O-N 3.22Å; R211-K213 VanDerWaalsContact C-N 3.31Å; R211-K213 PolarHBondContact O-N 3.02Å; R211-V214 PolarHBondContact O-N 3.32Å; R211-L215 WeakPolarHBondContact O-CB 3.41Å; R211-L215 PolarHBondContact O-N 3.38Å
212	A	97.4	Very high	96.7	Very high	58 Å²	58	98.1 Å²	98.1	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-61.5	-40.5	176.7	0	0	0	0	0	111.5	R208 E209 L215 A216	R208-A212 WeakPolarHBondContact O-CB 3.46Å; R208-A212 PolarHBondContact O-N 3.41Å; E209-A212 PolarHBondContact O-N 3.41Å; A212-L215 PolarHBondContact O-N 3.09Å; A212-A216 WeakPolarHBondContact O-CB 3.41Å; A212-A216 PolarHBondContact O-N 2.9Å
213	K	97.9	Very high	96.7	Very high	167 Å²	167	97.8 Å²	97.8	73%	0.726	53%	0.53	S	S	*	.	H	α-helix	trans	-65.9	-41	177.2	-168.8	171.8	-176.1	174	0	112.8	E209 A210 R211 A217	E209-K213 PolarHBondContact O-N 2.94Å; A210-K213 PolarHBondContact O-N 3.14Å; R211-K213 VanDerWaalsContact C-N 3.31Å; R211-K213 PolarHBondContact O-N 3.02Å; K213-A217 PolarHBondContact O-N 3.37Å; K213-A217 VanDerWaalsContact O-N 3.14Å
214	V	97.9	Very high	96.8	Very high	96 Å²	96	94.2 Å²	94.2	58%	0.582	52%	0.52	S	S	*	.	H	α-helix	trans	-65.7	-45.6	174.9	174.1	0	0	0	0	110.7	A210 R211 A216 A217 E218	A210-V214 WeakPolarHBondContact O-CG2 3.42Å; A210-V214 PolarHBondContact O-N 3.46Å; A210-V214 VanDerWaalsContact O-N 3.11Å; R211-V214 PolarHBondContact O-N 3.32Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 2.85Å; V214-A217 PolarHBondContact O-N 3.04Å; V214-E218 WeakPolarHBondContact O-CB 3.31Å; V214-E218 PolarHBondContact O-N 3.12Å
215	L	97.1	Very high	96.9	Very high	120 Å²	120	98.4 Å²	98.4	63%	0.628	53%	0.532	S	S	*	.	H	α-helix	trans	-63.4	-37	178.7	-173.9	65.8	0	0	0	112.1	R211 A212 G219	R211-L215 WeakPolarHBondContact O-CB 3.41Å; R211-L215 PolarHBondContact O-N 3.38Å; A212-L215 PolarHBondContact O-N 3.09Å; L215-G219 PolarHBondContact O-N 2.93Å
216	A	97.2	Very high	97	Very high	65 Å²	65	96.2 Å²	96.2	54%	0.537	53%	0.53	S	S	.	.	H	α-helix	trans	-64.9	-46.3	175.3	0	0	0	0	0	111.9	A212 V214 G219 E220	A212-A216 WeakPolarHBondContact O-CB 3.41Å; A212-A216 PolarHBondContact O-N 2.9Å; V214-A216 VanDerWaalsContact C-N 3.32Å; V214-A216 PolarHBondContact O-N 2.85Å; A216-G219 PolarHBondContact O-N 2.99Å; A216-E220 WeakPolarHBondContact O-CB 3.46Å; A216-E220 PolarHBondContact O-N 2.92Å
217	A	96.8	Very high	96.8	Very high	58 Å²	58	99.4 Å²	99.4	48%	0.479	54%	0.539	S	S	.	.	H	α-helix	trans	-65.3	-40.1	177.2	0	0	0	0	0	112.3	K213 V214 E220 M221	K213-A217 PolarHBondContact O-N 3.37Å; K213-A217 VanDerWaalsContact O-N 3.14Å; V214-A217 PolarHBondContact O-N 3.04Å; A217-E220 PolarHBondContact O-N 3.34Å; A217-M221 WeakPolarHBondContact O-CB 3.39Å; A217-M221 PolarHBondContact O-N 2.88Å
218	E	96.9	Very high	96.7	Very high	110 Å²	110	103.4 Å²	103.4	51%	0.514	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-40	174.4	-174.5	174	-173.7	0	0	111.7	V214 M221 N222	V214-E218 WeakPolarHBondContact O-CB 3.31Å; V214-E218 PolarHBondContact O-N 3.12Å; E218-M221 PolarHBondContact O-N 3.07Å; E218-N222 WeakPolarHBondContact O-CB 3.36Å; E218-N222 VanDerWaalsContact O-CG 3.32Å; E218-N222 PolarHBondContact O-N 2.82Å; E218-N222 PolarHBondContact O-ND2 2.97Å
219	G	97.4	Very high	96.6	Very high	36 Å²	36	97.7 Å²	97.7	37%	0.371	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-44.9	172.6	0	0	0	0	0	112.2	L215 A216 N222 A223	L215-G219 PolarHBondContact O-N 2.93Å; A216-G219 PolarHBondContact O-N 2.99Å; G219-N222 PolarHBondContact O-N 3.44Å; G219-A223 WeakPolarHBondContact O-CB 3.46Å; G219-A223 PolarHBondContact O-N 3.39Å
220	E	96.4	Very high	96.3	Very high	137 Å²	137	93.9 Å²	93.9	64%	0.64	53%	0.53	S	S	*	.	H	α-helix	trans	-64.8	-41.2	176.2	-173.7	175.4	-173.7	0	0	112.1	A216 A217 A223 S224	A216-E220 WeakPolarHBondContact O-CB 3.46Å; A216-E220 PolarHBondContact O-N 2.92Å; A217-E220 PolarHBondContact O-N 3.34Å; E220-A223 PolarHBondContact O-N 3.46Å; E220-S224 VanDerWaalsContact O-CB 3.31Å; E220-S224 WeakPolarHBondContact O-CB 3.41Å; E220-S224 PolarHBondContact O-N 3.02Å; E220-S224 PolarHBondContact O-OG 3.46Å
221	M	96.9	Very high	96.1	Very high	108 Å²	108	94.1 Å²	94.1	53%	0.532	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-44.6	173.9	177	61.9	68.8	0	0	111.8	A217 E218 S224 K225	A217-M221 WeakPolarHBondContact O-CB 3.39Å; A217-M221 PolarHBondContact O-N 2.88Å; E218-M221 PolarHBondContact O-N 3.07Å; M221-S224 WeakPolarHBondContact O-CB 3.44Å; M221-S224 PolarHBondContact O-N 3.29Å; M221-K225 WeakPolarHBondContact O-CG 3.49Å; M221-K225 PolarHBondContact O-N 3.48Å
222	N	96.9	Very high	95.8	Very high	73 Å²	73	90.9 Å²	90.9	39%	0.39	52%	0.523	S	S	.	.	H	α-helix	trans	-68.6	-39.2	178.8	-73.7	-22.2	0	0	0	112.2	E218 G219 S224 K225 S226	E218-N222 WeakPolarHBondContact O-CB 3.36Å; E218-N222 VanDerWaalsContact O-CG 3.32Å; E218-N222 PolarHBondContact O-N 2.82Å; E218-N222 PolarHBondContact O-ND2 2.97Å; G219-N222 PolarHBondContact O-N 3.44Å; N222-S224 VanDerWaalsContact C-N 3.34Å; N222-K225 PolarHBondContact O-N 3.46Å; N222-S226 PolarHBondContact O-N 2.93Å; N222-S226 PolarHBondContact O-OG 2.95Å
223	A	96	Very high	95.5	Very high	50 Å²	50	92.5 Å²	92.5	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-60.4	-45.2	171	0	0	0	0	0	110.8	G219 E220 K225 S226 L227	G219-A223 WeakPolarHBondContact O-CB 3.46Å; G219-A223 PolarHBondContact O-N 3.39Å; E220-A223 PolarHBondContact O-N 3.46Å; A223-K225 PolarHBondContact O-N 3.15Å; A223-S226 PolarHBondContact O-N 3.1Å; A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.33Å; A223-L227 PolarHBondContact O-N 2.89Å
224	S	95.9	Very high	95.2	Very high	63 Å²	63	87.3 Å²	87.3	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-41.5	177.8	-61.9	0	0	0	0	112.6	E220 M221 N222 L227 K228	E220-S224 VanDerWaalsContact O-CB 3.31Å; E220-S224 WeakPolarHBondContact O-CB 3.41Å; E220-S224 PolarHBondContact O-N 3.02Å; E220-S224 PolarHBondContact O-OG 3.46Å; M221-S224 WeakPolarHBondContact O-CB 3.44Å; M221-S224 PolarHBondContact O-N 3.29Å; N222-S224 VanDerWaalsContact C-N 3.34Å; S224-L227 PolarHBondContact O-N 3.36Å; S224-K228 WeakPolarHBondContact O-CB 3.32Å; S224-K228 PolarHBondContact O-N 3.3Å
225	K	96.7	Very high	94.8	Very high	124 Å²	124	86.2 Å²	86.2	54%	0.539	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-42.7	174.1	-73.3	172.3	-175.2	169.6	0	112.1	M221 N222 A223 K228 S229	M221-K225 WeakPolarHBondContact O-CG 3.49Å; M221-K225 PolarHBondContact O-N 3.48Å; N222-K225 PolarHBondContact O-N 3.46Å; A223-K225 PolarHBondContact O-N 3.15Å; K225-K228 PolarHBondContact O-N 2.92Å; K225-S229 PolarHBondContact O-N 3.3Å
226	S	95.6	Very high	94.6	Very high	74 Å²	74	88.2 Å²	88.2	52%	0.517	51%	0.514	S	S	.	.	H	α-helix	trans	-69.1	-37.5	178.8	-55.4	0	0	0	0	112	N222 A223 K228 S229 A230	N222-S226 PolarHBondContact O-N 2.93Å; N222-S226 PolarHBondContact O-OG 2.95Å; A223-S226 PolarHBondContact O-N 3.1Å; S226-K228 VanDerWaalsContact C-N 3.34Å; S226-S229 PolarHBondContact O-N 2.92Å; S226-S229 PolarHBondContact O-OG 3.2Å; S226-A230 WeakPolarHBondContact O-CB 3.33Å; S226-A230 PolarHBondContact O-N 3.44Å
227	L	93.5	Very high	94.2	Very high	124 Å²	124	87.5 Å²	87.5	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-64.9	-39.2	172.6	-73.2	172.4	0	0	0	111.3	A223 S224 A230 S231	A223-L227 WeakPolarHBondContact O-CB 3.47Å; A223-L227 WeakPolarHBondContact O-CG 3.33Å; A223-L227 PolarHBondContact O-N 2.89Å; S224-L227 PolarHBondContact O-N 3.36Å; L227-A230 PolarHBondContact O-N 2.83Å; L227-S231 WeakPolarHBondContact O-CB 3.33Å; L227-S231 PolarHBondContact O-N 3.05Å; L227-S231 PolarHBondContact O-OG 3.05Å
228	K	95.7	Very high	93.7	Very high	145 Å²	145	90 Å²	90	63%	0.63	52%	0.516	S	S	*	.	H	α-helix	trans	-64.3	-42.5	174.8	-177.1	179.6	178.5	179.2	0	112.4	S224 K225 S226 S231 M232	S224-K228 WeakPolarHBondContact O-CB 3.32Å; S224-K228 PolarHBondContact O-N 3.3Å; K225-K228 PolarHBondContact O-N 2.92Å; S226-K228 VanDerWaalsContact C-N 3.34Å; K228-S231 WeakPolarHBondContact CA-OG 3.3Å; K228-S231 PolarHBondContact O-N 3.41Å; K228-S231 PolarHBondContact O-OG 3.02Å; K228-M232 WeakPolarHBondContact O-CG 3.34Å; K228-M232 PolarHBondContact O-N 3.47Å; K228-M232 VanDerWaalsContact O-N 3.13Å
229	S	93.7	Very high	93.4	Very high	70 Å²	70	90.7 Å²	90.7	49%	0.49	52%	0.522	S	S	.	.	H	α-helix	trans	-66.7	-42.9	176.1	58.7	0	0	0	0	111.4	K225 S226 S231 M232 V233	K225-S229 PolarHBondContact O-N 3.3Å; S226-S229 PolarHBondContact O-N 2.92Å; S226-S229 PolarHBondContact O-OG 3.2Å; S229-S231 VanDerWaalsContact C-N 3.31Å; S229-S231 PolarHBondContact O-N 3.41Å; S229-M232 PolarHBondContact O-N 2.85Å; S229-V233 PolarHBondContact O-N 2.89Å
230	A	91.7	Very high	93.1	Very high	46 Å²	46	90.3 Å²	90.3	38%	0.38	52%	0.515	S	S	.	.	H	α-helix	trans	-60.7	-39.1	174	0	0	0	0	0	112.3	S226 L227 M232 V233 L234	S226-A230 WeakPolarHBondContact O-CB 3.33Å; S226-A230 PolarHBondContact O-N 3.44Å; L227-A230 PolarHBondContact O-N 2.83Å; A230-M232 VanDerWaalsContact C-N 3.34Å; A230-M232 PolarHBondContact O-N 3.42Å; A230-V233 PolarHBondContact O-N 3.35Å; A230-L234 WeakPolarHBondContact O-CG 3.43Å; A230-L234 PolarHBondContact O-N 2.8Å
231	S	92.5	Very high	92.8	Very high	62 Å²	62	88.8 Å²	88.8	43%	0.434	51%	0.511	S	S	.	.	H	α-helix	trans	-65.8	-35.8	177.7	70.4	0	0	0	0	112.6	L227 K228 S229 L234 A235	L227-S231 WeakPolarHBondContact O-CB 3.33Å; L227-S231 PolarHBondContact O-N 3.05Å; L227-S231 PolarHBondContact O-OG 3.05Å; K228-S231 WeakPolarHBondContact CA-OG 3.3Å; K228-S231 PolarHBondContact O-N 3.41Å; K228-S231 PolarHBondContact O-OG 3.02Å; S229-S231 VanDerWaalsContact C-N 3.31Å; S229-S231 PolarHBondContact O-N 3.41Å; S231-L234 PolarHBondContact O-N 2.88Å; S231-A235 WeakPolarHBondContact O-CB 3.2Å; S231-A235 PolarHBondContact O-N 3.32Å
232	M	92.7	Very high	92.5	Very high	122 Å²	122	88.5 Å²	88.5	60%	0.601	51%	0.508	S	S	*	.	H	α-helix	trans	-65	-42.2	175.6	-67.8	-61.4	-63.3	0	0	111.6	K228 S229 A230 A235 E236	K228-M232 WeakPolarHBondContact O-CG 3.34Å; K228-M232 PolarHBondContact O-N 3.47Å; K228-M232 VanDerWaalsContact O-N 3.13Å; S229-M232 PolarHBondContact O-N 2.85Å; A230-M232 VanDerWaalsContact C-N 3.34Å; A230-M232 PolarHBondContact O-N 3.42Å; M232-A235 PolarHBondContact O-N 2.97Å; M232-E236 PolarHBondContact O-N 3.29Å
233	V	91.2	Very high	92.2	Very high	93 Å²	93	89.9 Å²	89.9	56%	0.564	52%	0.515	S	S	*	.	H	α-helix	trans	-65.1	-41.1	175.8	177	0	0	0	0	111.4	S229 A230 A235 E236	S229-V233 PolarHBondContact O-N 2.89Å; A230-V233 PolarHBondContact O-N 3.35Å; V233-A235 VanDerWaalsContact C-N 3.3Å; V233-A235 PolarHBondContact O-N 3.32Å; V233-E236 PolarHBondContact O-N 3.14Å
234	L	90.8	Very high	91.9	Very high	57 Å²	57	94.1 Å²	94.1	30%	0.298	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-31.7	175.9	-70.9	173.6	0	0	0	112.6	A230 S231 E236 S237 A240 R244	A230-L234 WeakPolarHBondContact O-CG 3.43Å; A230-L234 PolarHBondContact O-N 2.8Å; S231-L234 PolarHBondContact O-N 2.88Å; L234-E236 VanDerWaalsContact C-N 3.27Å; L234-E236 PolarHBondContact O-N 3.41Å; L234-S237 CarbonylContact O-C 3.48Å; L234-S237 PolarHBondContact O-N 2.89Å; L234-A240 HydrophobicContact CD2-CB 3.74Å; L234-R244 HydrophobicContact CD1-CG 4.44Å
235	A	89.8	Confident	91.6	Very high	74 Å²	74	95.2 Å²	95.2	61%	0.612	52%	0.516	S	S	*	.	H	α-helix	trans	-68.5	-24	178.4	0	0	0	0	0	113.3	S231 M232 V233 S237	S231-A235 WeakPolarHBondContact O-CB 3.2Å; S231-A235 PolarHBondContact O-N 3.32Å; M232-A235 PolarHBondContact O-N 2.97Å; V233-A235 VanDerWaalsContact C-N 3.3Å; V233-A235 PolarHBondContact O-N 3.32Å; A235-S237 PolarHBondContact O-N 3.42Å
236	E	92.1	Very high	91.2	Very high	162 Å²	162	93.1 Å²	93.1	76%	0.757	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.9	174.9	-65.6	179	175.1	0	0	112.6	M232 V233 L234	M232-E236 PolarHBondContact O-N 3.29Å; V233-E236 PolarHBondContact O-N 3.14Å; L234-E236 VanDerWaalsContact C-N 3.27Å; L234-E236 PolarHBondContact O-N 3.41Å
237	S	89.5	Confident	90.9	Very high	50 Å²	50	94.9 Å²	94.9	35%	0.35	51%	0.51	S	S	.	.			trans	-133.9	106	179.2	-175.8	0	0	0	0	111.8	L234 A235 I239 A240	L234-S237 CarbonylContact O-C 3.48Å; L234-S237 PolarHBondContact O-N 2.89Å; A235-S237 PolarHBondContact O-N 3.42Å; S237-I239 PolarHBondContact O-N 3.35Å; S237-A240 VanDerWaalsContact O-CB 3.31Å; S237-A240 WeakPolarHBondContact O-CB 3.33Å; S237-A240 PolarHBondContact O-N 2.97Å
238	P	85.9	Confident	90.7	Very high	110 Å²	110	92.2 Å²	92.2	71%	0.714	50%	0.499	S	S	*	.	H	α-helix	trans	-55	-29.3	177.6	-27	34.4	0	0	0	114.1	A240 L241 Q242	P238-A240 VanDerWaalsContact C-N 3.34Å; P238-L241 PolarHBondContact O-N 3.02Å; P238-Q242 PolarHBondContact O-N 2.9Å
239	I	91.1	Very high	90.2	Very high	124 Å²	124	87 Å²	87	64%	0.636	48%	0.477	S	S	*	.	H	α-helix	trans	-66.5	-35.5	176.4	-63.1	169.9	0	0	0	111	S237 L241 Q242 L243	S237-I239 PolarHBondContact O-N 3.35Å; I239-L241 VanDerWaalsContact C-N 3.35Å; I239-L241 PolarHBondContact O-N 3.11Å; I239-Q242 PolarHBondContact O-N 3.45Å; I239-L243 HydrophobicContact CG2-CD1 4.27Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 WeakPolarHBondContact O-CG 3.43Å; I239-L243 PolarHBondContact O-N 3.34Å
240	A	90.1	Very high	89.7	Confident	28 Å²	28	87.9 Å²	87.9	23%	0.231	48%	0.48	C	S	.	.	H	α-helix	trans	-65.2	-37	179.6	0	0	0	0	0	112.4	L234 S237 P238 L243 R244	L234-A240 HydrophobicContact CD2-CB 3.74Å; S237-A240 VanDerWaalsContact O-CB 3.31Å; S237-A240 WeakPolarHBondContact O-CB 3.33Å; S237-A240 PolarHBondContact O-N 2.97Å; P238-A240 VanDerWaalsContact C-N 3.34Å; A240-L243 PolarHBondContact O-N 3.22Å; A240-R244 PolarHBondContact O-N 3.42Å
241	L	91.2	Very high	89.3	Confident	106 Å²	106	90 Å²	90	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-64.1	-42.6	175.4	-164	156.1	0	0	0	111.2	P238 I239 R244 Y245	P238-L241 PolarHBondContact O-N 3.02Å; I239-L241 VanDerWaalsContact C-N 3.35Å; I239-L241 PolarHBondContact O-N 3.11Å; L241-R244 PolarHBondContact O-N 2.95Å; L241-Y245 PolarHBondContact O-N 3.46Å
242	Q	89.6	Confident	88.9	Confident	102 Å²	102	89.8 Å²	89.8	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-63.4	-41.2	175.4	-169.4	67.5	13	0	0	112	P238 I239 Y245 L246	P238-Q242 PolarHBondContact O-N 2.9Å; I239-Q242 PolarHBondContact O-N 3.45Å; Q242-Y245 WeakPolarHBondContact O-CB 3.43Å; Q242-Y245 PolarHBondContact O-N 3.35Å; Q242-L246 WeakPolarHBondContact O-CG 3.31Å; Q242-L246 PolarHBondContact O-N 3.34Å
243	L	90.7	Very high	88.3	Confident	101 Å²	101	86.5 Å²	86.5	53%	0.529	48%	0.477	S	S	.	.	H	α-helix	trans	-62.5	-43.8	174.7	-71.1	172.8	0	0	0	111.6	I239 A240 Y245 L246 Q247	I239-L243 HydrophobicContact CG2-CD1 4.27Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 WeakPolarHBondContact O-CG 3.43Å; I239-L243 PolarHBondContact O-N 3.34Å; A240-L243 PolarHBondContact O-N 3.22Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.33Å; L243-L246 PolarHBondContact O-N 3.3Å; L243-Q247 WeakPolarHBondContact O-CG 3.37Å; L243-Q247 PolarHBondContact O-N 3.42Å
244	R	90.1	Very high	87.7	Confident	140 Å²	140	87 Å²	87	53%	0.528	48%	0.48	S	S	.	.	H	α-helix	trans	-62.7	-37.9	175.7	-176.2	58.7	174	176.9	0.8	111.9	L234 A240 L241 Q247 T248	L234-R244 HydrophobicContact CD1-CG 4.44Å; A240-R244 PolarHBondContact O-N 3.42Å; L241-R244 PolarHBondContact O-N 2.95Å; R244-Q247 PolarHBondContact O-N 3.44Å; R244-T248 PolarHBondContact O-N 3.28Å; R244-T248 PolarHBondContact O-OG1 3.44Å; R244-T248 VanDerWaalsContact O-OG1 3.05Å
245	Y	89.3	Confident	87.1	Confident	86 Å²	86	91.2 Å²	91.2	34%	0.337	50%	0.499	S	S	.	.	H	α-helix	trans	-61.7	-48.7	174.4	179.2	-104.3	0	0	0	111.7	L241 Q242 L243 Q247 T248 L249	L241-Y245 PolarHBondContact O-N 3.46Å; Q242-Y245 WeakPolarHBondContact O-CB 3.43Å; Q242-Y245 PolarHBondContact O-N 3.35Å; L243-Y245 VanDerWaalsContact C-N 3.31Å; L243-Y245 PolarHBondContact O-N 3.33Å; Y245-Q247 VanDerWaalsContact C-N 3.32Å; Y245-Q247 PolarHBondContact O-N 3.06Å; Y245-T248 PolarHBondContact O-N 2.99Å; Y245-L249 HydrophobicContact CD1-CD1 4Å; Y245-L249 HydrophobicContact CD1-CG 4.47Å; Y245-L249 HydrophobicContact CE1-CD1 3.48Å; Y245-L249 VanDerWaalsContact CE1-CD1 3.48Å; Y245-L249 HydrophobicContact CE1-CG 4.15Å; Y245-L249 WeakPolarHBondContact O-CG 3.39Å; Y245-L249 PolarHBondContact O-N 3Å
246	L	89.2	Confident	86	Confident	80 Å²	80	97.8 Å²	97.8	42%	0.419	51%	0.513	S	S	.	.	H	α-helix	trans	-61.7	-37.1	176	-67.8	175.3	0	0	0	112.8	Q242 L243 L249 T250	Q242-L246 WeakPolarHBondContact O-CG 3.31Å; Q242-L246 PolarHBondContact O-N 3.34Å; L243-L246 PolarHBondContact O-N 3.3Å; L246-L249 PolarHBondContact O-N 3.35Å; L246-T250 PolarHBondContact O-N 3.25Å; L246-T250 PolarHBondContact O-OG1 3.4Å
247	Q	89	Confident	84.5	Confident	110 Å²	110	97.6 Å²	97.6	51%	0.514	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-47.5	173.3	-74.9	178.8	-19.2	0	0	111.9	L243 R244 Y245 L249 T250 T251	L243-Q247 WeakPolarHBondContact O-CG 3.37Å; L243-Q247 PolarHBondContact O-N 3.42Å; R244-Q247 PolarHBondContact O-N 3.44Å; Y245-Q247 VanDerWaalsContact C-N 3.32Å; Y245-Q247 PolarHBondContact O-N 3.06Å; Q247-L249 VanDerWaalsContact C-N 3.3Å; Q247-L249 PolarHBondContact O-N 3.22Å; Q247-T250 WeakPolarHBondContact O-CB 3.5Å; Q247-T250 PolarHBondContact O-N 3.13Å; Q247-T250 VanDerWaalsContact O-N 3.08Å; Q247-T251 PolarHBondContact O-N 3.48Å; Q247-T251 PolarHBondContact O-OG1 2.9Å
248	T	88.7	Confident	83.2	Confident	69 Å²	69	98.4 Å²	98.4	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-60.4	-41.1	176.9	-57.4	0	0	0	0	111.3	R244 Y245 T250 T251 V252	R244-T248 PolarHBondContact O-N 3.28Å; R244-T248 PolarHBondContact O-OG1 3.44Å; R244-T248 VanDerWaalsContact O-OG1 3.05Å; Y245-T248 PolarHBondContact O-N 2.99Å; T248-T250 VanDerWaalsContact C-N 3.3Å; T248-T250 PolarHBondContact O-N 2.82Å; T248-T251 PolarHBondContact O-N 3.45Å; T248-V252 HydrophobicContact CG2-CG2 4.47Å; T248-V252 WeakPolarHBondContact O-CG2 3.48Å; T248-V252 PolarHBondContact O-N 3.43Å
249	L	84.8	Confident	82.6	Confident	34 Å²	34	99.2 Å²	99.2	18%	0.178	53%	0.526	C	S	.	.	H	α-helix	trans	-60.9	-38.5	174.2	-71.3	-177	0	0	0	112.3	Y245 L246 Q247 V252 A253 I260	Y245-L249 HydrophobicContact CD1-CD1 4Å; Y245-L249 HydrophobicContact CD1-CG 4.47Å; Y245-L249 HydrophobicContact CE1-CD1 3.48Å; Y245-L249 VanDerWaalsContact CE1-CD1 3.48Å; Y245-L249 HydrophobicContact CE1-CG 4.15Å; Y245-L249 WeakPolarHBondContact O-CG 3.39Å; Y245-L249 PolarHBondContact O-N 3Å; L246-L249 PolarHBondContact O-N 3.35Å; Q247-L249 VanDerWaalsContact C-N 3.3Å; Q247-L249 PolarHBondContact O-N 3.22Å; L249-V252 PolarHBondContact O-N 3.48Å; L249-A253 VanDerWaalsContact O-CB 3.25Å; L249-A253 WeakPolarHBondContact O-CB 3.41Å; L249-A253 PolarHBondContact O-N 3Å; L249-I260 HydrophobicContact CD2-CG2 4.01Å
250	T	83.4	Confident	81.3	Confident	90 Å²	90	96.9 Å²	96.9	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-65.5	-40.6	176.5	-52.9	0	0	0	0	111.4	L246 Q247 T248 A253 T254	L246-T250 PolarHBondContact O-N 3.25Å; L246-T250 PolarHBondContact O-OG1 3.4Å; Q247-T250 WeakPolarHBondContact O-CB 3.5Å; Q247-T250 PolarHBondContact O-N 3.13Å; Q247-T250 VanDerWaalsContact O-N 3.08Å; T248-T250 VanDerWaalsContact C-N 3.3Å; T248-T250 PolarHBondContact O-N 2.82Å; T250-A253 PolarHBondContact O-N 2.8Å; T250-T254 PolarHBondContact O-N 3.32Å; T250-T254 PolarHBondContact O-OG1 3.41Å
251	T	84	Confident	80.3	Confident	90 Å²	90	101.4 Å²	101.4	55%	0.552	54%	0.539	S	S	*	.	H	α-helix	trans	-63.1	-47.3	174.4	-50.2	0	0	0	0	111.4	Q247 T248 A253 T254 E255	Q247-T251 PolarHBondContact O-N 3.48Å; Q247-T251 PolarHBondContact O-OG1 2.9Å; T248-T251 PolarHBondContact O-N 3.45Å; T251-A253 VanDerWaalsContact C-N 3.29Å; T251-A253 PolarHBondContact O-N 3.43Å; T251-T254 WeakPolarHBondContact O-CB 3.17Å; T251-T254 PolarHBondContact O-N 2.94Å; T251-T254 VanDerWaalsContact O-N 3.1Å; T251-E255 PolarHBondContact O-N 2.98Å
252	V	84.6	Confident	79	Confident	57 Å²	57	101.9 Å²	101.9	35%	0.345	54%	0.536	S	S	.	.	H	α-helix	trans	-63.5	-34.8	177	173.8	0	0	0	0	111.7	T248 L249 T254 E255	T248-V252 HydrophobicContact CG2-CG2 4.47Å; T248-V252 WeakPolarHBondContact O-CG2 3.48Å; T248-V252 PolarHBondContact O-N 3.43Å; L249-V252 PolarHBondContact O-N 3.48Å; V252-T254 VanDerWaalsContact C-N 3.3Å; V252-T254 PolarHBondContact O-N 3.43Å; V252-E255 VanDerWaalsContact O-O 3.04Å
253	A	78.5	Confident	77.8	Confident	54 Å²	54	101 Å²	101	45%	0.446	54%	0.539	S	S	.	.	H	α-helix	trans	-68.7	-27.8	174.9	0	0	0	0	0	113.2	L249 T250 T251 I260	L249-A253 VanDerWaalsContact O-CB 3.25Å; L249-A253 WeakPolarHBondContact O-CB 3.41Å; L249-A253 PolarHBondContact O-N 3Å; T250-A253 PolarHBondContact O-N 2.8Å; T251-A253 VanDerWaalsContact C-N 3.29Å; T251-A253 PolarHBondContact O-N 3.43Å; A253-I260 HydrophobicContact CB-CD1 3.64Å
254	T	79.3	Confident	76.7	Confident	103 Å²	103	101 Å²	101	63%	0.632	54%	0.54	S	S	*	.	H	α-helix	trans	-76.6	-37.8	-178.7	-55.8	0	0	0	0	111.5	T250 T251 V252 K256	T250-T254 PolarHBondContact O-N 3.32Å; T250-T254 PolarHBondContact O-OG1 3.41Å; T251-T254 WeakPolarHBondContact O-CB 3.17Å; T251-T254 PolarHBondContact O-N 2.94Å; T251-T254 VanDerWaalsContact O-N 3.1Å; V252-T254 VanDerWaalsContact C-N 3.3Å; V252-T254 PolarHBondContact O-N 3.43Å; T254-K256 PolarHBondContact O-N 2.95Å; T254-K256 VanDerWaalsContact O-N 3.09Å
255	E	78.3	Confident	75.2	Confident	146 Å²	146	97.6 Å²	97.6	68%	0.682	54%	0.536	S	S	*	.	S	Bend	trans	-68.6	104	165.5	-71.4	-172.4	177.7	0	0	108.2	T251 V252 N257	T251-E255 PolarHBondContact O-N 2.98Å; V252-E255 VanDerWaalsContact O-O 3.04Å; E255-N257 PolarHBondContact O-N 2.77Å
256	K	67.2	Low	74.3	Confident	211 Å²	211	99.9 Å²	99.9	92%	0.917	55%	0.551	S	S	*	*	S	Bend	trans	-63	33	-169.8	-61.6	179.4	176	177.4	0	116.3	T254	T254-K256 PolarHBondContact O-N 2.95Å; T254-K256 VanDerWaalsContact O-N 3.09Å
257	N	61.1	Low	73.1	Confident	158 Å²	158	102.1 Å²	102.1	85%	0.845	56%	0.563	S	S	*	*	S	Bend	trans	-135.1	22.6	-169.3	-161.6	44.5	0	0	0	115.4	E255	E255-N257 PolarHBondContact O-N 2.77Å
258	S	60.9	Low	71.7	Confident	67 Å²	67	100.8 Å²	100.8	47%	0.469	56%	0.559	S	S	.	*			trans	-144.6	127.1	-176.7	176.3	0	0	0	0	114.1	I260	S258-I260 PolarHBondContact O-N 3.32Å
259	T	73	Confident	70.1	Confident	128 Å²	128	102.6 Å²	102.6	79%	0.785	57%	0.565	S	S	*	*			trans	-73.3	110.4	166.5	-59.7	0	0	0	0	108.8	V261	T259-V261 PolarHBondContact O-N 2.86Å; T259-V261 VanDerWaalsContact O-N 3.09Å
260	I	64.2	Low	68.8	Low	74 Å²	74	108.1 Å²	108.1	38%	0.379	59%	0.59	S	S	.	*			trans	-71.4	104.5	177.2	-55.3	171.9	0	0	0	108.8	L249 A253 S258 F262	L249-I260 HydrophobicContact CD2-CG2 4.01Å; A253-I260 HydrophobicContact CB-CD1 3.64Å; S258-I260 PolarHBondContact O-N 3.32Å; I260-F262 PolarHBondContact O-N 2.99Å
261	V	68.7	Low	67.7	Low	123 Å²	123	107 Å²	107	75%	0.745	60%	0.597	S	S	*	*			trans	-78.5	107.6	169.1	-179.3	0	0	0	0	107.5	T259 P263	T259-V261 PolarHBondContact O-N 2.86Å; T259-V261 VanDerWaalsContact O-N 3.09Å; V261-P263 WeakPolarHBondContact O-CD 3.43Å
262	F	65.3	Low	66.5	Low	116 Å²	116	109.1 Å²	109.1	51%	0.509	60%	0.604	S	S	.	*			trans	-80.5	110.3	173.9	-163.9	-91.6	0	0	0	108.7	I260 L264	I260-F262 PolarHBondContact O-N 2.99Å; F262-L264 HydrophobicContact CD1-CD2 3.77Å; F262-L264 HydrophobicContact CD1-CG 4.29Å; F262-L264 HydrophobicContact CE1-CD2 4.06Å; F262-L264 PolarHBondContact O-N 2.9Å
263	P	64.1	Low	64.7	Low	83 Å²	83	109.2 Å²	109.2	54%	0.539	62%	0.616	S	S	.	*			trans	-69.6	103.3	170.2	28.7	-30.9	0	0	0	107.3	V261	V261-P263 WeakPolarHBondContact O-CD 3.43Å
264	L	66.7	Low	62.9	Low	102 Å²	102	110 Å²	110	53%	0.534	63%	0.63	S	S	.	*			trans	-62	126.8	168.7	-66.7	169.6	0	0	0	107.1	F262 M266 I268	F262-L264 HydrophobicContact CD1-CD2 3.77Å; F262-L264 HydrophobicContact CD1-CG 4.29Å; F262-L264 HydrophobicContact CE1-CD2 4.06Å; F262-L264 PolarHBondContact O-N 2.9Å; L264-M266 PolarHBondContact O-N 3.33Å; L264-I268 HydrophobicContact CD2-CD1 4.47Å
265	P	58.9	Low	61.2	Low	68 Å²	68	112.2 Å²	112.2	44%	0.442	64%	0.636	S	S	.	*			trans	-56.4	132.4	174.7	21.5	-30.5	0	0	0	108.6	N267 I268	P265-N267 PolarHBondContact O-N 2.87Å; P265-I268 HydrophobicContact CG-CD1 3.95Å; P265-I268 HydrophobicContact CG-CG1 4.24Å; P265-I268 PolarHBondContact O-N 3.04Å
266	M	70.4	Confident	59.4	Low	135 Å²	135	110.8 Å²	110.8	67%	0.665	64%	0.642	S	S	*	*	H	α-helix	trans	-49.5	-26.7	-177	-72.3	-92.5	-73.7	0	0	113.1	L264 I268 L269 E270	L264-M266 PolarHBondContact O-N 3.33Å; M266-I268 PolarHBondContact O-N 2.94Å; M266-L269 WeakPolarHBondContact O-CA 3.36Å; M266-L269 WeakPolarHBondContact O-CB 3.47Å; M266-L269 PolarHBondContact O-N 3.15Å; M266-E270 PolarHBondContact O-N 3.19Å
267	N	64.7	Low	58.2	Low	126 Å²	126	111.6 Å²	111.6	67%	0.674	64%	0.641	S	S	*	*	H	α-helix	trans	-57.7	-28.2	175	-57.6	-11.9	0	0	0	113.8	P265	P265-N267 PolarHBondContact O-N 2.87Å
268	I	58.1	Low	57	Low	82 Å²	82	111.4 Å²	111.4	42%	0.421	64%	0.64	S	S	.	*	H	α-helix	trans	-78.7	-34.2	173.9	-61.7	174.6	0	0	0	110.5	L264 P265 M266 E270 G271 I272	L264-I268 HydrophobicContact CD2-CD1 4.47Å; P265-I268 HydrophobicContact CG-CD1 3.95Å; P265-I268 HydrophobicContact CG-CG1 4.24Å; P265-I268 PolarHBondContact O-N 3.04Å; M266-I268 PolarHBondContact O-N 2.94Å; I268-E270 VanDerWaalsContact C-N 3.33Å; I268-G271 PolarHBondContact O-N 2.9Å; I268-G271 VanDerWaalsContact O-N 3.15Å; I268-I272 HydrophobicContact CG2-CD1 4.25Å; I268-I272 PolarHBondContact O-N 3.17Å
269	L	55.2	Low	55.8	Low	107 Å²	107	114.8 Å²	114.8	56%	0.56	65%	0.653	S	S	*	*	H	α-helix	trans	-67.9	-35.5	179.4	-139.9	77.8	0	0	0	111.5	M266 G271 I272 G273	M266-L269 WeakPolarHBondContact O-CA 3.36Å; M266-L269 WeakPolarHBondContact O-CB 3.47Å; M266-L269 PolarHBondContact O-N 3.15Å; L269-G271 PolarHBondContact O-N 3.28Å; L269-I272 PolarHBondContact O-N 2.95Å; L269-I272 VanDerWaalsContact O-N 3.13Å; L269-G273 PolarHBondContact O-N 3.13Å
270	E	57.7	Low	54	Low	150 Å²	150	115 Å²	115	70%	0.701	65%	0.649	S	S	*	*	H	α-helix	trans	-61	-30.6	172.3	-72	179.3	178.1	0	0	112.5	M266 I268	M266-E270 PolarHBondContact O-N 3.19Å; I268-E270 VanDerWaalsContact C-N 3.33Å
271	G	61.7	Low	52.6	Low	68 Å²	68	119.2 Å²	119.2	70%	0.701	67%	0.665	S	S	*	*	H	α-helix	trans	-75.6	-21.5	175.2	0	0	0	0	0	114.8	I268 L269	I268-G271 PolarHBondContact O-N 2.9Å; I268-G271 VanDerWaalsContact O-N 3.15Å; L269-G271 PolarHBondContact O-N 3.28Å
272	I	57.2	Low	51	Low	133 Å²	133	122.4 Å²	122.4	68%	0.682	67%	0.669	S	S	*	*	H	α-helix	trans	-102.8	-25	-176.1	-64.5	173.9	0	0	0	111.9	I268 L269 G274	I268-I272 HydrophobicContact CG2-CD1 4.25Å; I268-I272 PolarHBondContact O-N 3.17Å; L269-I272 PolarHBondContact O-N 2.95Å; L269-I272 VanDerWaalsContact O-N 3.13Å; I272-G274 VanDerWaalsContact C-N 3.27Å; I272-G274 PolarHBondContact O-N 3.34Å
273	G	47.4	Very low	49.9	Very low	59 Å²	59	123.2 Å²	123.2	61%	0.608	68%	0.683	S	S	*	*			trans	-80.8	21.1	-176.4	0	0	0	0	0	116.6	L269 I275	L269-G273 PolarHBondContact O-N 3.13Å; G273-I275 PolarHBondContact O-N 3.42Å
274	G	41.9	Very low	48.6	Very low	71 Å²	71	126.4 Å²	126.4	73%	0.732	70%	0.701	S	S	*	*			trans	-69.8	29.7	177.6	0	0	0	0	0	115.7	I272 S276	I272-G274 VanDerWaalsContact C-N 3.27Å; I272-G274 PolarHBondContact O-N 3.34Å; G274-S276 PolarHBondContact O-N 2.88Å
275	I	43.4	Very low	47.5	Very low	149 Å²	149	125.8 Å²	125.8	76%	0.764	71%	0.711	S	S	*	*			trans	-89.1	93	167.6	-58.7	174.1	0	0	0	106.7	G273 Y277	G273-I275 PolarHBondContact O-N 3.42Å; I275-Y277 PolarHBondContact O-N 3.01Å
276	S	40.5	Very low	46.5	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	73%	0.732	S	S	*	*			trans	-44	108.2	169.6	-74.5	0	0	0	0	111.3	G274 D278	G274-S276 PolarHBondContact O-N 2.88Å; S276-D278 PolarHBondContact O-N 3.24Å
277	Y	40.2	Very low	45.2	Very low	229 Å²	229	134 Å²	134	90%	0.898	77%	0.768	S	S	*	*			trans	-76.5	96.8	155.2	-112.5	-97.4	0	0	0	107	I275	I275-Y277 PolarHBondContact O-N 3.01Å
278	D	37.8	Very low	44.3	Very low	153 Å²	153	134.5 Å²	134.5	82%	0.818	77%	0.772	S	S	*	*			trans	-62.6	139.2	171.7	-176.1	31.4	0	0	0	110.2	S276	S276-D278 PolarHBondContact O-N 3.24Å
279	N	35.7	Very low	43.6	Very low	138 Å²	138	137.2 Å²	137.2	74%	0.738	79%	0.791	S	S	*	*			trans	-115.2	101.2	-156.8	175.2	25	0	0	0	107.1
280	N	33.7	Very low	42.9	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	80%	0.804	S	S	*	*			trans	-164	122.5	156.9	-134.9	-32.1	0	0	0	116
281	K	34.8	Very low	42	Very low	163 Å²	163	138.2 Å²	138.2	71%	0.709	81%	0.81	S	S	*	*			trans	123.1	122.3	132.4	-71.8	-171.2	178.9	168.5	0	115.9
282	K	36.8	Very low	40.8	Very low	190 Å²	190	142.6 Å²	142.6	83%	0.826	82%	0.817	S	S	*	*			trans	86	109.7	162.7	-54.9	160.4	-173.2	-172.8	0	109.8
283	V	41.9	Very low	39.7	Very low	133 Å²	133	143.3 Å²	143.3	81%	0.806	83%	0.826	S	S	*	*				-151.1	106.7	66.6	178.8	0	0	0	0	110.6
284	T	36.6	Very low	39.2	Very low	149 Å²	149	149.3 Å²	149.3	91%	0.914	84%	0.841	S	S	*	*			trans	-142	88.9	153.3	53	0	0	0	0	108.6
285	A	42.4	Very low	39	Very low	90 Å²	90	155.3 Å²	155.3	74%	0.744	85%	0.85	S	S	*	*			trans	-161.2	126	157	0	0	0	0	0	104.2
286	K	38.8	Very low	38.6	Very low	205 Å²	205	155.8 Å²	155.8	89%	0.891	86%	0.857	S	S	*	*			cis	-165.8	164.9	11.1	-153.8	174.1	-177.9	-178.9	0	105.8
287	A	43.8	Very low	38.4	Very low	171 Å²	171	159.5 Å²	159.5	100%	1.413	86%	0.861	S	S	*	*			trans	-35	0	173.5	0	0	0	0	0	116.1

Retrieved 287 of 287 residues in 109.9 ms (Link to these results)

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