A0A3P9NLQ2_POERE Loading...

Actin, alpha, cardiac muscle 2

AlphaFold DB , UniProt , Accession A0A3P9NLQ2, Species POERE (Poecilia reticulata, Guppy), Gene n/a, Length 377 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	38.3	Very low	67.5	Low	240 Å²	240	103.9 Å²	103.9	100%	1.182	56%	0.555	S	S	*	*				0	72.4	0	-76.7	177.1	168.6	0	0	107.7
2	C	34.2	Very low	70.1	Confident	118 Å²	118	95.3 Å²	95.3	80%	0.797	51%	0.509	S	S	*	.			trans	-107.3	118.5	140.9	-67.5	0	0	0	0	101.5	D4	C2-D4 PolarHBondContact O-N 2.98Å
3	D	38.3	Very low	72.2	Confident	152 Å²	152	88.3 Å²	88.3	81%	0.813	47%	0.472	S	S	*	.			trans	-64.3	113.8	166.3	-70.5	-33.4	0	0	0	104.9	E5	D3-E5 VanDerWaalsContact C-N 3.31Å; D3-E5 PolarHBondContact O-N 3.45Å
4	D	47.7	Very low	73.9	Confident	156 Å²	156	82.6 Å²	82.6	83%	0.834	44%	0.441	S	S	*	.			trans	-57.6	105.7	160.1	-71.9	-40.3	0	0	0	104.4	C2 E6	C2-D4 PolarHBondContact O-N 2.98Å; D4-E6 VanDerWaalsContact C-N 3.32Å; D4-E6 PolarHBondContact O-N 2.88Å
5	E	48.1	Very low	75.3	Confident	180 Å²	180	77.8 Å²	77.8	84%	0.841	42%	0.419	S	S	*	.			trans	-57.7	103.1	172.5	-78	-174.6	161	0	0	106.4	D3 T7	D3-E5 VanDerWaalsContact C-N 3.31Å; D3-E5 PolarHBondContact O-N 3.45Å; E5-T7 PolarHBondContact O-N 2.84Å
6	E	66.3	Low	76.5	Confident	141 Å²	141	73.5 Å²	73.5	66%	0.659	40%	0.397	S	S	*	.			trans	-60.4	100.9	-179.1	-163.4	176.1	-170.7	0	0	107.2	D4 T8 Q355	D4-E6 VanDerWaalsContact C-N 3.32Å; D4-E6 PolarHBondContact O-N 2.88Å; E6-T8 PolarHBondContact O-N 3.45Å; E6-T8 VanDerWaalsContact O-N 3.13Å; E6-Q355 PolarHBondContact OE1-NE2 3.46Å
7	T	82.3	Confident	77.6	Confident	77 Å²	77	69.9 Å²	69.9	47%	0.472	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-62	120.9	-176	42.2	0	0	0	0	108.8	E5 A9 E102	E5-T7 PolarHBondContact O-N 2.84Å; T7-A9 PolarHBondContact O-N 2.83Å; T7-E102 WeakPolarHBondContact CB-O 3.35Å; T7-E102 PolarHBondContact OG1-O 3.1Å
8	T	93.1	Very high	78.6	Confident	69 Å²	69	70.4 Å²	70.4	42%	0.423	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-66.7	127.1	-172.3	-50.8	0	0	0	0	110.3	E6 F23 A24 H103	E6-T8 PolarHBondContact O-N 3.45Å; E6-T8 VanDerWaalsContact O-N 3.13Å; T8-F23 HydrophobicContact CG2-CB 3.95Å; T8-F23 HydrophobicContact CG2-CD1 4.26Å; T8-A24 WeakPolarHBondContact CG2-O 3.28Å; T8-H103 PolarHBondContact O-ND1 2.9Å
9	A	97.2	Very high	79.7	Confident	9 Å²	9	66.7 Å²	66.7	7%	0.074	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-64.9	146.3	-180	0	0	0	0	0	112.1	T7 A24 P104 A349 W358	T7-A9 PolarHBondContact O-N 2.83Å; A9-A24 HydrophobicContact CB-CB 4.06Å; A9-A24 WeakPolarHBondContact O-CB 3.47Å; A9-A24 PolarHBondContact O-N 2.86Å; A9-P104 CarbonylContact C-O 3.51Å; A9-P104 VanDerWaalsContact CA-O 3.23Å; A9-P104 WeakPolarHBondContact CA-O 3.33Å; A9-P104 HydrophobicContact CB-CB 4.12Å; A9-A349 HydrophobicContact CB-CB 4.17Å; A9-W358 HydrophobicContact CB-CH2 3.93Å; A9-W358 HydrophobicContact CB-CZ2 3.7Å
10	L	98.4	Very high	80.6	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	145.8	169.4	-53.5	-178.5	0	0	0	109.9	G22 F23 F92 L96 V98 H103 P104 T105 L106	L10-G22 WeakPolarHBondContact CA-O 2.94Å; L10-F23 HydrophobicContact CD2-CD1 3.64Å; L10-F23 HydrophobicContact CD2-CE1 3.5Å; L10-F23 HydrophobicContact CD2-CG 4.37Å; L10-F23 HydrophobicContact CD2-CZ 4.13Å; L10-F92 HydrophobicContact CD1-CD1 3.68Å; L10-F92 HydrophobicContact CD1-CE1 3.77Å; L10-L96 HydrophobicContact CD2-CD1 4.17Å; L10-V98 HydrophobicContact CD1-CG2 3.82Å; L10-V98 HydrophobicContact CD2-CG2 4.27Å; L10-H103 HydrophobicContact CD1-CB 3.95Å; L10-H103 HydrophobicContact CD2-CB 4.26Å; L10-H103 HydrophobicContact CG-CB 3.7Å; L10-P104 PolarHBondContact N-O 2.89Å; L10-T105 HydrophobicContact CB-CG2 4.41Å; L10-L106 PolarHBondContact O-N 3.14Å
11	V	98.6	Very high	81.5	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118.4	172.9	180	0	0	0	0	108.4	A21 G22 A24 L106 W342 A349	V11-A21 VanDerWaalsContact O-CA 3.3Å; V11-A21 WeakPolarHBondContact O-CA 3.23Å; V11-G22 PolarHBondContact N-O 3.2Å; V11-G22 PolarHBondContact O-N 3.48Å; V11-G22 VanDerWaalsContact O-N 3.11Å; V11-A24 HydrophobicContact CG2-CB 4.24Å; V11-L106 HydrophobicContact CG1-CD2 4.18Å; V11-L106 HydrophobicContact CG2-CB 4.43Å; V11-W342 HydrophobicContact CB-CZ2 4.31Å; V11-W342 HydrophobicContact CG1-CG 4.27Å; V11-W342 PolarHBondContact O-NE1 3.38Å; V11-A349 HydrophobicContact CG2-CB 4.15Å
12	C	98.3	Very high	84.3	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.007	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	105.3	-179.3	-172.4	0	0	0	0	110.7	L106 L107 T108	C12-L106 PolarHBondContact N-O 2.93Å; C12-L107 HydrophobicContact CB-CD2 3.77Å; C12-L107 WeakPolarHBondContact O-CA 3.49Å; C12-T108 PolarHBondContact O-N 2.87Å; C12-T108 VanDerWaalsContact O-N 3.14Å
13	D	98.2	Very high	87.4	Confident	4 Å²	4	45.5 Å²	45.5	2%	0.021	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	108.9	173.8	176.2	35.7	0	0	0	111.1	G15 V19 K20 T108 V341 W342	D13-G15 PolarHBondContact O-N 3.28Å; D13-G15 VanDerWaalsContact O-N 3.13Å; D13-V19 WeakPolarHBondContact O-CA 3.4Å; D13-K20 HydrophobicContact CB-CB 4.27Å; D13-K20 HydrophobicContact CB-CD 4.34Å; D13-K20 PolarHBondContact N-O 3.2Å; D13-K20 PolarHBondContact O-N 3.19Å; D13-K20 VanDerWaalsContact O-N 3.09Å; D13-K20 WeakPolarHBondContact OD2-CD 3.18Å; D13-K20 IonicContact OD2-NZ 3.92Å; D13-K20 PolarHBondContact OD2-NZ 3.43Å; D13-T108 VanDerWaalsContact CA-OG1 3.3Å; D13-T108 WeakPolarHBondContact CA-OG1 3.34Å; D13-T108 HydrophobicContact CB-CG2 4.08Å; D13-T108 PolarHBondContact OD1-OG1 2.88Å; D13-V341 HydrophobicContact CB-CG1 4.32Å; D13-V341 WeakPolarHBondContact OD1-CG1 3.25Å; D13-W342 HydrophobicContact CB-CB 4.22Å
14	N	96.2	Very high	90.2	Very high	9 Å²	9	38.8 Å²	38.8	5%	0.048	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	78.1	-175.6	-59	-56.2	0	0	0	111.2	I73 M84 W88 L107 T108 Q139	N14-I73 HydrophobicContact CB-CD1 4.27Å; N14-M84 HydrophobicContact CB-CE 4.38Å; N14-M84 WeakPolarHBondContact OD1-CE 3.21Å; N14-W88 PolarHBondContact OD1-NE1 3.3Å; N14-L107 WeakPolarHBondContact ND2-CD2 3.27Å; N14-T108 PolarHBondContact N-OG1 2.8Å; N14-T108 PolarHBondContact ND2-O 2.98Å; N14-Q139 PolarHBondContact O-NE2 2.72Å
15	G	94.8	Very high	92.4	Very high	10 Å²	10	33.8 Å²	33.8	10%	0.103	19%	0.194	C	C	.	.			trans	-83	148.1	177.6	0	0	0	0	0	113.2	D13 G17 L18 S35	D13-G15 PolarHBondContact O-N 3.28Å; D13-G15 VanDerWaalsContact O-N 3.13Å; G15-G17 VanDerWaalsContact C-N 3.26Å; G15-G17 PolarHBondContact O-N 3.31Å; G15-L18 WeakPolarHBondContact CA-O 3.34Å; G15-L18 PolarHBondContact N-O 2.89Å; G15-S35 WeakPolarHBondContact O-CB 3.47Å; G15-S35 PolarHBondContact O-OG 3.26Å
16	S	94.2	Very high	94.7	Very high	9 Å²	9	27.4 Å²	27.4	6%	0.063	17%	0.166	C	C	.	.	S	Bend	trans	-66.1	-24.1	178.8	64.5	0	0	0	0	114.9	G160 R185	S16-G160 WeakPolarHBondContact OG-CA 3.14Å; S16-G160 PolarHBondContact OG-N 3.43Å; S16-R185 PolarHBondContact O-NH2 3.26Å
17	G	94.4	Very high	96.1	Very high	13 Å²	13	28 Å²	28	13%	0.134	17%	0.174	C	C	.	.	S	Bend	trans	-108.3	-39.8	175.5	0	0	0	0	0	113.4	G15 P34 S35 D159	G15-G17 VanDerWaalsContact C-N 3.26Å; G15-G17 PolarHBondContact O-N 3.31Å; G17-P34 WeakPolarHBondContact O-CA 3.31Å; G17-S35 PolarHBondContact O-N 3.1Å; G17-D159 WeakPolarHBondContact CA-OD2 3.48Å
18	L	96.9	Very high	96.7	Very high	78 Å²	78	26.7 Å²	26.7	41%	0.408	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.8	-177.8	-63.5	172.3	0	0	0	110.6	G15 K20 V32 F33 P34 S35	G15-L18 WeakPolarHBondContact CA-O 3.34Å; G15-L18 PolarHBondContact N-O 2.89Å; L18-K20 HydrophobicContact CB-CD 4.43Å; L18-K20 PolarHBondContact O-NZ 3.38Å; L18-V32 HydrophobicContact CB-CG1 4.36Å; L18-V32 HydrophobicContact CD1-CG1 4.07Å; L18-V32 HydrophobicContact CD2-CG1 4.45Å; L18-F33 WeakPolarHBondContact CA-O 3.3Å; L18-P34 HydrophobicContact CD2-CG 4.42Å; L18-S35 VanDerWaalsContact C-OG 3.24Å; L18-S35 WeakPolarHBondContact CA-OG 3.42Å; L18-S35 PolarHBondContact N-OG 3.01Å
19	V	98	Very high	96.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	141	162	179.2	0	0	0	0	108.8	D13 V32 F33 S35 I87	D13-V19 WeakPolarHBondContact O-CA 3.4Å; V19-V32 WeakPolarHBondContact O-CA 3.35Å; V19-F33 HydrophobicContact CB-CD1 4.46Å; V19-F33 HydrophobicContact CB-CD2 4.43Å; V19-F33 HydrophobicContact CB-CE1 3.95Å; V19-F33 HydrophobicContact CB-CE2 3.91Å; V19-F33 HydrophobicContact CB-CZ 3.65Å; V19-F33 HydrophobicContact CG1-CE1 3.91Å; V19-F33 HydrophobicContact CG1-CE2 4.48Å; V19-F33 HydrophobicContact CG1-CZ 3.74Å; V19-F33 HydrophobicContact CG2-CE2 4.04Å; V19-F33 HydrophobicContact CG2-CZ 4.09Å; V19-F33 PolarHBondContact N-O 3.32Å; V19-F33 PolarHBondContact O-N 2.89Å; V19-F33 VanDerWaalsContact O-N 3.16Å; V19-S35 WeakPolarHBondContact CG2-OG 3.43Å; V19-S35 PolarHBondContact N-OG 3.43Å; V19-I87 HydrophobicContact CG2-CG2 3.62Å
20	K	98.6	Very high	97	Very high	26 Å²	26	31.2 Å²	31.2	11%	0.113	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125.9	170	-53.7	75.8	157.2	-164.3	0	108	D13 L18 P29 A31 V32 Y339 W342	D13-K20 HydrophobicContact CB-CB 4.27Å; D13-K20 HydrophobicContact CB-CD 4.34Å; D13-K20 PolarHBondContact N-O 3.2Å; D13-K20 PolarHBondContact O-N 3.19Å; D13-K20 VanDerWaalsContact O-N 3.09Å; D13-K20 WeakPolarHBondContact OD2-CD 3.18Å; D13-K20 IonicContact OD2-NZ 3.92Å; D13-K20 PolarHBondContact OD2-NZ 3.43Å; L18-K20 HydrophobicContact CB-CD 4.43Å; L18-K20 PolarHBondContact O-NZ 3.38Å; K20-P29 HydrophobicContact CB-CB 3.76Å; K20-P29 HydrophobicContact CB-CG 4.02Å; K20-P29 HydrophobicContact CG-CG 4.3Å; K20-A31 CarbonylContact C-O 3.6Å; K20-A31 WeakPolarHBondContact CA-O 3.28Å; K20-V32 HydrophobicContact CB-CG2 4.35Å; K20-V32 HydrophobicContact CG-CG1 4.21Å; K20-V32 HydrophobicContact CG-CG2 3.96Å; K20-Y339 HydrophobicContact CG-CD1 4.19Å; K20-Y339 HydrophobicContact CG-CE1 4.38Å; K20-W342 HydrophobicContact CB-CB 4.33Å; K20-W342 HydrophobicContact CB-CG 4.18Å; K20-W342 VanDerWaalsContact O-CD1 3.32Å
21	A	98.6	Very high	96.9	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	148.2	-175.4	0	0	0	0	0	110.7	V11 P29 R30 A31 A91 L96	V11-A21 VanDerWaalsContact O-CA 3.3Å; V11-A21 WeakPolarHBondContact O-CA 3.23Å; A21-P29 CarbonylContact O-C 3.16Å; A21-R30 PolarHBondContact O-N 3.12Å; A21-A31 HydrophobicContact CB-CB 4.44Å; A21-A31 PolarHBondContact N-O 3.39Å; A21-A31 PolarHBondContact O-N 3.39Å; A21-A91 HydrophobicContact CB-CB 4.39Å; A21-L96 HydrophobicContact CB-CD1 4.06Å; A21-L96 HydrophobicContact CB-CD2 4.46Å; A21-L96 HydrophobicContact CB-CG 4.35Å
22	G	98.4	Very high	96.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	-166.1	178.5	0	0	0	0	0	111.3	L10 V11	L10-G22 WeakPolarHBondContact CA-O 2.94Å; V11-G22 PolarHBondContact N-O 3.2Å; V11-G22 PolarHBondContact O-N 3.48Å; V11-G22 VanDerWaalsContact O-N 3.11Å
23	F	98.1	Very high	96.9	Very high	21 Å²	21	33.6 Å²	33.6	9%	0.092	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	145.5	-177.6	-62.9	-96.9	0	0	0	110.1	T8 L10 D26 R30 L96 V98	T8-F23 HydrophobicContact CG2-CB 3.95Å; T8-F23 HydrophobicContact CG2-CD1 4.26Å; L10-F23 HydrophobicContact CD2-CD1 3.64Å; L10-F23 HydrophobicContact CD2-CE1 3.5Å; L10-F23 HydrophobicContact CD2-CG 4.37Å; L10-F23 HydrophobicContact CD2-CZ 4.13Å; F23-D26 WeakPolarHBondContact O-CB 3.42Å; F23-D26 PolarHBondContact O-N 3.43Å; F23-R30 HydrophobicContact CD2-CG 4.37Å; F23-L96 HydrophobicContact CE2-CD2 4.14Å; F23-V98 HydrophobicContact CE1-CG1 3.94Å; F23-V98 HydrophobicContact CZ-CG1 3.58Å
24	A	97.3	Very high	96.8	Very high	10 Å²	10	34.4 Å²	34.4	8%	0.083	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	138.8	171.2	0	0	0	0	0	110.3	T8 A9 V11 A349	T8-A24 WeakPolarHBondContact CG2-O 3.28Å; A9-A24 HydrophobicContact CB-CB 4.06Å; A9-A24 WeakPolarHBondContact O-CB 3.47Å; A9-A24 PolarHBondContact O-N 2.86Å; V11-A24 HydrophobicContact CG2-CB 4.24Å; A24-A349 HydrophobicContact CB-CB 3.67Å
25	G	95	Very high	96.9	Very high	51 Å²	51	34 Å²	34	53%	0.526	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.4	-15.1	-175	0	0	0	0	0	114.8	S346	G25-S346 PolarHBondContact N-O 2.72Å; G25-S346 PolarHBondContact N-OG 3.29Å
26	D	96.3	Very high	96.9	Very high	47 Å²	47	33.6 Å²	33.6	25%	0.251	19%	0.194	S	C	.	.			trans	-75.3	146.1	170.7	-71.3	-19.6	0	0	0	110.4	F23 A28 R30 W342 S346	F23-D26 WeakPolarHBondContact O-CB 3.42Å; F23-D26 PolarHBondContact O-N 3.43Å; D26-A28 VanDerWaalsContact C-N 3.33Å; D26-A28 PolarHBondContact O-N 2.62Å; D26-R30 IonicContact OD1-NH2 2.95Å; D26-R30 PolarHBondContact OD1-NH2 3.24Å; D26-R30 WeakPolarHBondContact OD2-CG 3.27Å; D26-R30 IonicContact OD2-CZ 3.41Å; D26-R30 IonicContact OD2-NE 3.69Å; D26-R30 PolarHBondContact OD2-NE 3.05Å; D26-R30 IonicContact OD2-NH2 3.4Å; D26-R30 PolarHBondContact OD2-NH2 3.18Å; D26-R30 VanDerWaalsContact OD2-NH2 3.16Å; D26-W342 HydrophobicContact CB-CH2 3.91Å; D26-W342 WeakPolarHBondContact O-CH2 3.4Å; D26-W342 WeakPolarHBondContact O-CZ3 3.44Å; D26-S346 PolarHBondContact N-OG 3.47Å; D26-S346 PolarHBondContact O-OG 3.41Å
27	D	94.5	Very high	97.1	Very high	153 Å²	153	33.2 Å²	33.2	82%	0.818	19%	0.191	S	C	*	.	S	Bend	trans	-77.8	-14.5	-179	-68.7	-39.7	0	0	0	114
28	A	96.1	Very high	97.2	Very high	50 Å²	50	32.6 Å²	32.6	41%	0.413	19%	0.185	S	C	.	.	S	Bend	trans	-151.8	153.4	-179.1	0	0	0	0	0	110.8	D26 R30 W342	D26-A28 VanDerWaalsContact C-N 3.33Å; D26-A28 PolarHBondContact O-N 2.62Å; A28-R30 PolarHBondContact O-N 3.12Å; A28-W342 WeakPolarHBondContact O-CH2 3.37Å; A28-W342 WeakPolarHBondContact O-CZ3 3.5Å
29	P	97.8	Very high	97	Very high	16 Å²	16	32.5 Å²	32.5	10%	0.104	18%	0.179	C	C	.	.			trans	-62.3	135.6	177.4	26	-34.3	0	0	0	110.9	K20 A21 A31 V32 Y339 W342	K20-P29 HydrophobicContact CB-CB 3.76Å; K20-P29 HydrophobicContact CB-CG 4.02Å; K20-P29 HydrophobicContact CG-CG 4.3Å; A21-P29 CarbonylContact O-C 3.16Å; P29-A31 VanDerWaalsContact C-N 3.33Å; P29-V32 HydrophobicContact CB-CG2 4.08Å; P29-V32 HydrophobicContact CG-CG2 3.63Å; P29-Y339 HydrophobicContact CG-CD1 4.04Å; P29-Y339 HydrophobicContact CG-CD2 4.4Å; P29-Y339 HydrophobicContact CG-CE1 4.29Å; P29-Y339 HydrophobicContact CG-CG 4.12Å; P29-W342 HydrophobicContact CB-CD2 3.7Å; P29-W342 HydrophobicContact CB-CE3 4.17Å; P29-W342 HydrophobicContact CB-CG 3.98Å; P29-W342 HydrophobicContact CB-CZ2 4.37Å; P29-W342 HydrophobicContact CG-CD2 4.27Å; P29-W342 HydrophobicContact CG-CE3 4.4Å; P29-W342 HydrophobicContact CG-CG 4.45Å
30	R	97.8	Very high	96.7	Very high	156 Å²	156	34.9 Å²	34.9	59%	0.589	19%	0.194	S	C	*	.	S	Bend	trans	-69.7	-32.8	175.8	-67.9	-160	-177	174.4	2.9	112.6	A21 F23 D26 A28 L96	A21-R30 PolarHBondContact O-N 3.12Å; F23-R30 HydrophobicContact CD2-CG 4.37Å; D26-R30 IonicContact OD1-NH2 2.95Å; D26-R30 PolarHBondContact OD1-NH2 3.24Å; D26-R30 WeakPolarHBondContact OD2-CG 3.27Å; D26-R30 IonicContact OD2-CZ 3.41Å; D26-R30 IonicContact OD2-NE 3.69Å; D26-R30 PolarHBondContact OD2-NE 3.05Å; D26-R30 IonicContact OD2-NH2 3.4Å; D26-R30 PolarHBondContact OD2-NH2 3.18Å; D26-R30 VanDerWaalsContact OD2-NH2 3.16Å; A28-R30 PolarHBondContact O-N 3.12Å; R30-L96 HydrophobicContact CB-CD2 4.02Å
31	A	98.1	Very high	96.1	Very high	5 Å²	5	40 Å²	40	4%	0.041	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.2	-179.1	0	0	0	0	0	110.5	K20 A21 P29 F33 E95 L96	K20-A31 CarbonylContact C-O 3.6Å; K20-A31 WeakPolarHBondContact CA-O 3.28Å; A21-A31 HydrophobicContact CB-CB 4.44Å; A21-A31 PolarHBondContact N-O 3.39Å; A21-A31 PolarHBondContact O-N 3.39Å; P29-A31 VanDerWaalsContact C-N 3.33Å; A31-F33 HydrophobicContact CB-CD1 4.47Å; A31-E95 HydrophobicContact CB-CB 3.68Å; A31-E95 HydrophobicContact CB-CG 4.13Å; A31-L96 HydrophobicContact CB-CD2 4.48Å
32	V	98.2	Very high	95.3	Very high	48 Å²	48	46.5 Å²	46.5	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	113.9	173.1	-179.2	0	0	0	0	107.5	L18 V19 K20 P29 Y339	L18-V32 HydrophobicContact CB-CG1 4.36Å; L18-V32 HydrophobicContact CD1-CG1 4.07Å; L18-V32 HydrophobicContact CD2-CG1 4.45Å; V19-V32 WeakPolarHBondContact O-CA 3.35Å; K20-V32 HydrophobicContact CB-CG2 4.35Å; K20-V32 HydrophobicContact CG-CG1 4.21Å; K20-V32 HydrophobicContact CG-CG2 3.96Å; P29-V32 HydrophobicContact CB-CG2 4.08Å; P29-V32 HydrophobicContact CG-CG2 3.63Å; V32-Y339 HydrophobicContact CG2-CE1 4.07Å
33	F	98	Very high	93.9	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.8	-175.6	62.9	-91	0	0	0	112	L18 V19 A31 S35 V56 I87 H90 A91 E95	L18-F33 WeakPolarHBondContact CA-O 3.3Å; V19-F33 HydrophobicContact CB-CD1 4.46Å; V19-F33 HydrophobicContact CB-CD2 4.43Å; V19-F33 HydrophobicContact CB-CE1 3.95Å; V19-F33 HydrophobicContact CB-CE2 3.91Å; V19-F33 HydrophobicContact CB-CZ 3.65Å; V19-F33 HydrophobicContact CG1-CE1 3.91Å; V19-F33 HydrophobicContact CG1-CE2 4.48Å; V19-F33 HydrophobicContact CG1-CZ 3.74Å; V19-F33 HydrophobicContact CG2-CE2 4.04Å; V19-F33 HydrophobicContact CG2-CZ 4.09Å; V19-F33 PolarHBondContact N-O 3.32Å; V19-F33 PolarHBondContact O-N 2.89Å; V19-F33 VanDerWaalsContact O-N 3.16Å; A31-F33 HydrophobicContact CB-CD1 4.47Å; F33-S35 PolarHBondContact O-N 3.4Å; F33-V56 HydrophobicContact CE2-CG1 4.26Å; F33-I87 HydrophobicContact CE2-CG2 4.11Å; F33-I87 HydrophobicContact CZ-CG2 4.26Å; F33-H90 AromaticContact CD2-CD2 3.98Å; F33-H90 AromaticContact CE2-CD2 3.75Å; F33-H90 AromaticContact CZ-CD2 3.92Å; F33-A91 HydrophobicContact CE1-CB 4.16Å; F33-A91 HydrophobicContact CZ-CB 4.02Å; F33-E95 HydrophobicContact CD1-CG 3.86Å; F33-E95 HydrophobicContact CE1-CG 3.89Å
34	P	96.8	Very high	92.4	Very high	21 Å²	21	56.9 Å²	56.9	14%	0.136	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	133.6	177.8	-25.9	35.7	0	0	0	114.1	G17 L18 I36 G57 D58	G17-P34 WeakPolarHBondContact O-CA 3.31Å; L18-P34 HydrophobicContact CD2-CG 4.42Å; P34-I36 HydrophobicContact CB-CD1 3.97Å; P34-I36 HydrophobicContact CB-CG1 3.94Å; P34-I36 HydrophobicContact CB-CG2 4.38Å; P34-I36 PolarHBondContact O-N 2.79Å; P34-G57 WeakPolarHBondContact O-CA 3.44Å; P34-D58 VanDerWaalsContact CD-OD1 3.25Å; P34-D58 WeakPolarHBondContact CD-OD1 3.35Å
35	S	96.8	Very high	90.7	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.007	33%	0.325	C	S	.	.	S	Bend	trans	-75.9	62.6	176.5	-52.2	0	0	0	0	111.7	G15 G17 L18 V19 F33 P72	G15-S35 WeakPolarHBondContact O-CB 3.47Å; G15-S35 PolarHBondContact O-OG 3.26Å; G17-S35 PolarHBondContact O-N 3.1Å; L18-S35 VanDerWaalsContact C-OG 3.24Å; L18-S35 WeakPolarHBondContact CA-OG 3.42Å; L18-S35 PolarHBondContact N-OG 3.01Å; V19-S35 WeakPolarHBondContact CG2-OG 3.43Å; V19-S35 PolarHBondContact N-OG 3.43Å; F33-S35 PolarHBondContact O-N 3.4Å; S35-P72 WeakPolarHBondContact O-CD 3.41Å
36	I	96.3	Very high	89.1	Confident	1 Å²	1	60 Å²	60	1%	0.005	31%	0.31	C	S	.	.			trans	-133.3	147	-174.9	66	-179	0	0	0	112.4	P34 V56 G57 A60 Q61 L69 K70 Y71	P34-I36 HydrophobicContact CB-CD1 3.97Å; P34-I36 HydrophobicContact CB-CG1 3.94Å; P34-I36 HydrophobicContact CB-CG2 4.38Å; P34-I36 PolarHBondContact O-N 2.79Å; I36-V56 WeakPolarHBondContact O-CA 3.19Å; I36-G57 PolarHBondContact O-N 3.03Å; I36-A60 HydrophobicContact CD1-CB 3.9Å; I36-A60 HydrophobicContact CG1-CB 3.92Å; I36-Q61 HydrophobicContact CD1-CB 3.9Å; I36-Q61 VanDerWaalsContact CD1-OE1 3.25Å; I36-L69 HydrophobicContact CD1-CD1 4.25Å; I36-L69 HydrophobicContact CD1-CD2 4.41Å; I36-K70 WeakPolarHBondContact CA-O 3.43Å; I36-Y71 HydrophobicContact CG2-CD1 3.54Å; I36-Y71 HydrophobicContact CG2-CE1 3.2Å; I36-Y71 HydrophobicContact CG2-CE2 4.23Å; I36-Y71 HydrophobicContact CG2-CG 4.2Å
37	V	97.4	Very high	87.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.6	169.1	-176.5	0	0	0	0	108.9	Y55 V56 K70 D83 K86 I87	V37-Y55 CarbonylContact C-O 3.56Å; V37-Y55 WeakPolarHBondContact CA-O 3.47Å; V37-V56 HydrophobicContact CG2-CG2 4.39Å; V37-K70 PolarHBondContact N-O 3.4Å; V37-K70 PolarHBondContact O-N 2.89Å; V37-D83 HydrophobicContact CB-CB 4.24Å; V37-D83 HydrophobicContact CG2-CB 3.76Å; V37-K86 HydrophobicContact CG1-CD 4.09Å; V37-K86 HydrophobicContact CG2-CB 4.46Å; V37-I87 HydrophobicContact CG2-CD1 4.42Å; V37-I87 HydrophobicContact CG2-CG1 4.03Å
38	G	95.6	Very high	85.8	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	133.1	178.2	0	0	0	0	0	112.1	S54 Y55 T68	G38-S54 CarbonylContact O-C 3.58Å; G38-S54 WeakPolarHBondContact O-CA 3.45Å; G38-Y55 PolarHBondContact N-O 3.24Å; G38-Y55 PolarHBondContact O-N 3.39Å; G38-T68 WeakPolarHBondContact CA-O 3.45Å
39	R	93.7	Very high	84.1	Confident	76 Å²	76	64 Å²	64	29%	0.287	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.2	174.7	-68.6	176.3	174.9	84	-9.4	111.1	R41 L67 T68 D83	R39-R41 PolarHBondContact O-N 3.11Å; R39-L67 CarbonylContact O-C 3.56Å; R39-L67 WeakPolarHBondContact O-CA 3.49Å; R39-T68 PolarHBondContact N-O 2.67Å; R39-T68 PolarHBondContact O-N 2.65Å; R39-D83 IonicContact CZ-OD1 2.95Å; R39-D83 IonicContact CZ-OD2 2.74Å; R39-D83 VanDerWaalsContact NH1-CG 3.35Å; R39-D83 IonicContact NH1-OD1 3.16Å; R39-D83 PolarHBondContact NH1-OD1 3.08Å; R39-D83 IonicContact NH1-OD2 2.72Å; R39-D83 PolarHBondContact NH1-OD2 3.45Å; R39-D83 IonicContact NH2-OD1 3.35Å; R39-D83 PolarHBondContact NH2-OD1 2.81Å; R39-D83 IonicContact NH2-OD2 3.06Å
40	P	90.8	Very high	82.5	Confident	50 Å²	50	66.3 Å²	66.3	33%	0.325	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	132.9	179.5	-26	35.1	0	0	0	113.2	Y55 L67	P40-Y55 HydrophobicContact CG-CE2 4.03Å; P40-L67 HydrophobicContact CB-CD2 4.32Å; P40-L67 HydrophobicContact CG-CD2 4.02Å
41	R	86.9	Confident	81	Confident	134 Å²	134	66.3 Å²	66.3	51%	0.506	38%	0.381	S	S	.	.	S	Bend	trans	-71.7	-32.6	175.2	-68.1	-177.7	-169.7	-172	5.9	112.8	R39 I66 L67 T68	R39-R41 PolarHBondContact O-N 3.11Å; R41-I66 PolarHBondContact N-O 3.3Å; R41-L67 PolarHBondContact NE-O 3.4Å; R41-L67 PolarHBondContact NH2-O 3.44Å; R41-T68 WeakPolarHBondContact CG-OG1 3.43Å
42	H	80.9	Confident	80.2	Confident	136 Å²	136	71 Å²	71	63%	0.63	40%	0.4	S	S	*	.	S	Bend	trans	-134.2	133.8	-177.5	-57.2	-63.4	0	0	0	109.3	V45	H42-V45 HydrophobicContact CB-CG2 3.74Å
43	Q	70.1	Confident	79.7	Confident	190 Å²	190	75.5 Å²	75.5	89%	0.888	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	137.6	175.4	-71.4	-176	-12.7	0	0	110.3
44	G	66.8	Low	79.4	Confident	49 Å²	49	77 Å²	77	51%	0.505	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.5	6.8	170.4	0	0	0	0	0	117.5	M46	G44-M46 VanDerWaalsContact C-N 3.34Å; G44-M46 PolarHBondContact O-N 2.95Å
45	V	60.3	Low	79.4	Confident	84 Å²	84	76.2 Å²	76.2	51%	0.509	43%	0.428	S	S	.	.			trans	-73.3	-22.1	-178.2	-177.9	0	0	0	0	113.4	H42 I66	H42-V45 HydrophobicContact CB-CG2 3.74Å; V45-I66 HydrophobicContact CG1-CG2 4.38Å
46	M	62.8	Low	79.4	Confident	43 Å²	43	76.8 Å²	76.8	21%	0.212	43%	0.431	C	S	.	.			trans	-96.8	99.5	-179.9	-73.4	-170.5	-112.1	0	0	111.3	G44 M49 Y55 K63 I66 L67	G44-M46 VanDerWaalsContact C-N 3.34Å; G44-M46 PolarHBondContact O-N 2.95Å; M46-M49 HydrophobicContact CB-CB 4.42Å; M46-M49 HydrophobicContact SD-SD 4.3Å; M46-Y55 HydrophobicContact CE-CE1 4.35Å; M46-Y55 HydrophobicContact CE-CE2 3.5Å; M46-Y55 VanDerWaalsContact CE-CE2 3.5Å; M46-Y55 WeakPolarHBondContact CE-OH 3.1Å; M46-Y55 PolarHBondContact SD-OH 3.33Å; M46-Y55 VanDerWaalsContact SD-OH 3.35Å; M46-K63 HydrophobicContact CE-CD 4.27Å; M46-K63 HydrophobicContact SD-CD 4.13Å; M46-I66 HydrophobicContact CE-CD1 3.72Å; M46-I66 HydrophobicContact CG-CD1 4.09Å; M46-I66 HydrophobicContact SD-CD1 4.21Å; M46-L67 HydrophobicContact CE-CD2 4.42Å
47	V	58.5	Low	79.4	Confident	147 Å²	147	76.8 Å²	76.8	89%	0.891	43%	0.431	S	S	*	.	S	Bend	trans	-77.6	123.9	172.3	-178.3	0	0	0	0	109.2	M49	V47-M49 PolarHBondContact O-N 3.16Å
48	G	62.4	Low	79.3	Confident	85 Å²	85	81 Å²	81	88%	0.876	45%	0.453	S	S	*	.	S	Bend	trans	88.6	-11	172.1	0	0	0	0	0	116.5
49	M	60	Low	79.2	Confident	103 Å²	103	83.7 Å²	83.7	51%	0.507	47%	0.466	S	S	.	.	S	Bend	trans	-98.9	128.6	163	-75.5	-179.5	136.7	0	0	107.6	M46 V47 Q51 K63	M46-M49 HydrophobicContact CB-CB 4.42Å; M46-M49 HydrophobicContact SD-SD 4.3Å; V47-M49 PolarHBondContact O-N 3.16Å; M49-Q51 PolarHBondContact O-N 3.08Å; M49-K63 PolarHBondContact SD-NZ 3.08Å
50	G	63.5	Low	79.2	Confident	63 Å²	63	80.1 Å²	80.1	65%	0.649	45%	0.452	S	S	*	.			trans	-47.9	141	174.8	0	0	0	0	0	111	K52	G50-K52 PolarHBondContact O-N 3.15Å
51	Q	67.7	Low	79.2	Confident	156 Å²	156	79.2 Å²	79.2	73%	0.729	44%	0.444	S	S	*	.			trans	-62.4	97	177.7	-72.6	-172.3	-4.9	0	0	108.8	M49	M49-Q51 PolarHBondContact O-N 3.08Å
52	K	81.3	Confident	79.3	Confident	103 Å²	103	77.3 Å²	77.3	45%	0.448	45%	0.451	S	S	.	.			trans	-85.4	135.4	169	-67.2	-173	-176.4	175.9	0	108.5	G50 S54 Y55 E59	G50-K52 PolarHBondContact O-N 3.15Å; K52-S54 VanDerWaalsContact C-N 3.29Å; K52-S54 PolarHBondContact O-N 3.16Å; K52-Y55 HydrophobicContact CB-CE1 4.15Å; K52-Y55 HydrophobicContact CB-CE2 4.22Å; K52-Y55 HydrophobicContact CD-CD1 4.29Å; K52-Y55 HydrophobicContact CD-CE1 3.81Å; K52-Y55 HydrophobicContact CG-CE1 4.43Å; K52-E59 IonicContact NZ-OE1 2.72Å; K52-E59 IonicContact NZ-OE2 3.7Å; K52-E59 PolarHBondContact NZ-OE2 3.38Å
53	D	86.4	Confident	79.8	Confident	144 Å²	144	72.5 Å²	72.5	77%	0.77	43%	0.429	S	S	*	.	S	Bend	trans	-72.6	-25.4	178.1	-62.6	-37.3	0	0	0	112.7
54	S	93.2	Very high	80.6	Confident	31 Å²	31	64.8 Å²	64.8	22%	0.217	39%	0.391	C	S	.	.			trans	-150.3	154.6	179	57	0	0	0	0	112.9	G38 K52	G38-S54 CarbonylContact O-C 3.58Å; G38-S54 WeakPolarHBondContact O-CA 3.45Å; K52-S54 VanDerWaalsContact C-N 3.29Å; K52-S54 PolarHBondContact O-N 3.16Å
55	Y	95.2	Very high	81.5	Confident	5 Å²	5	65.5 Å²	65.5	2%	0.02	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	148	175.2	-62.1	-87.2	0	0	0	108.8	V37 G38 P40 M46 K52 E59 K63 L67	V37-Y55 CarbonylContact C-O 3.56Å; V37-Y55 WeakPolarHBondContact CA-O 3.47Å; G38-Y55 PolarHBondContact N-O 3.24Å; G38-Y55 PolarHBondContact O-N 3.39Å; P40-Y55 HydrophobicContact CG-CE2 4.03Å; M46-Y55 HydrophobicContact CE-CE1 4.35Å; M46-Y55 HydrophobicContact CE-CE2 3.5Å; M46-Y55 VanDerWaalsContact CE-CE2 3.5Å; M46-Y55 WeakPolarHBondContact CE-OH 3.1Å; M46-Y55 PolarHBondContact SD-OH 3.33Å; M46-Y55 VanDerWaalsContact SD-OH 3.35Å; K52-Y55 HydrophobicContact CB-CE1 4.15Å; K52-Y55 HydrophobicContact CB-CE2 4.22Å; K52-Y55 HydrophobicContact CD-CD1 4.29Å; K52-Y55 HydrophobicContact CD-CE1 3.81Å; K52-Y55 HydrophobicContact CG-CE1 4.43Å; Y55-E59 HydrophobicContact CD1-CG 3.7Å; Y55-E59 VanDerWaalsContact CD1-OE1 3.3Å; Y55-E59 WeakPolarHBondContact CD1-OE1 3.42Å; Y55-E59 HydrophobicContact CE1-CG 4.36Å; Y55-E59 WeakPolarHBondContact CE1-OE1 3.33Å; Y55-K63 HydrophobicContact CD1-CD 4.2Å; Y55-K63 HydrophobicContact CE1-CD 4.12Å; Y55-L67 HydrophobicContact CD2-CD1 3.76Å; Y55-L67 HydrophobicContact CD2-CD2 3.67Å; Y55-L67 HydrophobicContact CD2-CG 4.4Å; Y55-L67 HydrophobicContact CE2-CD2 3.99Å; Y55-L67 HydrophobicContact CG-CD1 3.95Å
56	V	97.4	Very high	82.8	Confident	13 Å²	13	64.6 Å²	64.6	8%	0.079	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	152.1	-178.5	-177.5	0	0	0	0	109.4	F33 I36 V37 E59 A60 K86 I87 H90	F33-V56 HydrophobicContact CE2-CG1 4.26Å; I36-V56 WeakPolarHBondContact O-CA 3.19Å; V37-V56 HydrophobicContact CG2-CG2 4.39Å; V56-E59 PolarHBondContact O-N 3.49Å; V56-A60 PolarHBondContact O-N 2.95Å; V56-K86 HydrophobicContact CG2-CB 4.2Å; V56-I87 HydrophobicContact CG1-CG1 3.95Å; V56-H90 HydrophobicContact CB-CB 3.96Å; V56-H90 HydrophobicContact CG1-CB 3.7Å; V56-H90 HydrophobicContact CG2-CB 4.32Å
57	G	96.6	Very high	84.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	63	-137.9	170.5	0	0	0	0	0	113.8	P34 I36 E59 A60 Q61	P34-G57 WeakPolarHBondContact O-CA 3.44Å; I36-G57 PolarHBondContact O-N 3.03Å; G57-E59 VanDerWaalsContact C-N 3.26Å; G57-E59 PolarHBondContact O-N 3.1Å; G57-A60 WeakPolarHBondContact O-CB 3.32Å; G57-A60 PolarHBondContact O-N 2.9Å; G57-A60 VanDerWaalsContact O-N 3.1Å; G57-Q61 PolarHBondContact O-N 3.37Å
58	D	94.8	Very high	85.7	Confident	89 Å²	89	58.8 Å²	58.8	48%	0.476	36%	0.358	S	S	.	.	H	α-helix	trans	-64.9	-28.3	-176.6	-63.4	-55.4	0	0	0	113.1	P34 A60 Q61 S62	P34-D58 VanDerWaalsContact CD-OD1 3.25Å; P34-D58 WeakPolarHBondContact CD-OD1 3.35Å; D58-A60 VanDerWaalsContact C-N 3.34Å; D58-Q61 PolarHBondContact O-N 3.09Å; D58-S62 WeakPolarHBondContact O-CB 3.28Å; D58-S62 PolarHBondContact O-N 3.33Å; D58-S62 PolarHBondContact O-OG 3.27Å
59	E	93.4	Very high	87.1	Confident	57 Å²	57	56.5 Å²	56.5	27%	0.266	33%	0.325	S	S	.	.	H	α-helix	trans	-66.2	-39.1	174.3	-163.2	-178.1	178.9	0	0	110.8	K52 Y55 V56 G57 S62 K63	K52-E59 IonicContact NZ-OE1 2.72Å; K52-E59 IonicContact NZ-OE2 3.7Å; K52-E59 PolarHBondContact NZ-OE2 3.38Å; Y55-E59 HydrophobicContact CD1-CG 3.7Å; Y55-E59 VanDerWaalsContact CD1-OE1 3.3Å; Y55-E59 WeakPolarHBondContact CD1-OE1 3.42Å; Y55-E59 HydrophobicContact CE1-CG 4.36Å; Y55-E59 WeakPolarHBondContact CE1-OE1 3.33Å; V56-E59 PolarHBondContact O-N 3.49Å; G57-E59 VanDerWaalsContact C-N 3.26Å; G57-E59 PolarHBondContact O-N 3.1Å; E59-S62 PolarHBondContact O-OG 3.04Å; E59-S62 VanDerWaalsContact O-OG 3.08Å; E59-K63 HydrophobicContact CG-CD 4.27Å; E59-K63 WeakPolarHBondContact O-CB 3.48Å; E59-K63 WeakPolarHBondContact O-CG 3.38Å; E59-K63 PolarHBondContact O-N 3.43Å; E59-K63 IonicContact OE1-NZ 2.89Å; E59-K63 PolarHBondContact OE1-NZ 2.89Å
60	A	93.6	Very high	88.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-41.5	173.5	0	0	0	0	0	111.6	I36 V56 G57 D58 K63 R64 L67 L69	I36-A60 HydrophobicContact CD1-CB 3.9Å; I36-A60 HydrophobicContact CG1-CB 3.92Å; V56-A60 PolarHBondContact O-N 2.95Å; G57-A60 WeakPolarHBondContact O-CB 3.32Å; G57-A60 PolarHBondContact O-N 2.9Å; G57-A60 VanDerWaalsContact O-N 3.1Å; D58-A60 VanDerWaalsContact C-N 3.34Å; A60-K63 CarbonylContact O-C 3.6Å; A60-K63 PolarHBondContact O-N 2.87Å; A60-R64 PolarHBondContact O-N 3.35Å; A60-L67 HydrophobicContact CB-CD1 4.33Å; A60-L69 HydrophobicContact CB-CD2 4.02Å
61	Q	90.9	Very high	90.3	Very high	31 Å²	31	56.5 Å²	56.5	15%	0.145	30%	0.303	C	S	.	.	H	α-helix	trans	-64.1	-46.3	-178.7	-168.8	69.5	-14.1	0	0	112.1	I36 G57 D58 K63 R64 E209	I36-Q61 HydrophobicContact CD1-CB 3.9Å; I36-Q61 VanDerWaalsContact CD1-OE1 3.25Å; G57-Q61 PolarHBondContact O-N 3.37Å; D58-Q61 PolarHBondContact O-N 3.09Å; Q61-K63 VanDerWaalsContact C-N 3.25Å; Q61-K63 PolarHBondContact O-N 2.98Å; Q61-R64 WeakPolarHBondContact O-CB 3.43Å; Q61-R64 PolarHBondContact O-N 3.1Å; Q61-E209 PolarHBondContact NE2-OE2 3.31Å
62	S	90.4	Very high	91.7	Very high	95 Å²	95	49 Å²	49	66%	0.664	27%	0.268	S	S	*	.	H	α-helix	trans	-64.5	-29.2	178.4	57.6	0	0	0	0	112.9	D58 E59	D58-S62 WeakPolarHBondContact O-CB 3.28Å; D58-S62 PolarHBondContact O-N 3.33Å; D58-S62 PolarHBondContact O-OG 3.27Å; E59-S62 PolarHBondContact O-OG 3.04Å; E59-S62 VanDerWaalsContact O-OG 3.08Å
63	K	89.7	Confident	92.3	Very high	34 Å²	34	44.2 Å²	44.2	15%	0.148	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	13.3	-179.6	-65.6	175.1	-179.4	176.6	0	113.6	M46 M49 Y55 E59 A60 Q61 G65 I66 L67	M46-K63 HydrophobicContact CE-CD 4.27Å; M46-K63 HydrophobicContact SD-CD 4.13Å; M49-K63 PolarHBondContact SD-NZ 3.08Å; Y55-K63 HydrophobicContact CD1-CD 4.2Å; Y55-K63 HydrophobicContact CE1-CD 4.12Å; E59-K63 HydrophobicContact CG-CD 4.27Å; E59-K63 WeakPolarHBondContact O-CB 3.48Å; E59-K63 WeakPolarHBondContact O-CG 3.38Å; E59-K63 PolarHBondContact O-N 3.43Å; E59-K63 IonicContact OE1-NZ 2.89Å; E59-K63 PolarHBondContact OE1-NZ 2.89Å; A60-K63 CarbonylContact O-C 3.6Å; A60-K63 PolarHBondContact O-N 2.87Å; Q61-K63 VanDerWaalsContact C-N 3.25Å; Q61-K63 PolarHBondContact O-N 2.98Å; K63-G65 PolarHBondContact O-N 3.44Å; K63-I66 HydrophobicContact CB-CG1 4.25Å; K63-I66 VanDerWaalsContact O-CG1 3.24Å; K63-I66 WeakPolarHBondContact O-CG1 3.36Å; K63-I66 PolarHBondContact O-N 3.14Å; K63-L67 HydrophobicContact CB-CD1 3.61Å; K63-L67 HydrophobicContact CB-CG 3.93Å; K63-L67 WeakPolarHBondContact O-CG 3.41Å; K63-L67 PolarHBondContact O-N 3.31Å
64	R	87.2	Confident	92.6	Very high	29 Å²	29	42.2 Å²	42.2	11%	0.109	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-27	-175	73.4	-173.3	-51.4	151.8	18	116.1	A60 Q61 I66 L67 L69 T205	A60-R64 PolarHBondContact O-N 3.35Å; Q61-R64 WeakPolarHBondContact O-CB 3.43Å; Q61-R64 PolarHBondContact O-N 3.1Å; R64-I66 PolarHBondContact O-N 3.15Å; R64-L67 VanDerWaalsContact O-O 3.11Å; R64-L69 HydrophobicContact CB-CD1 3.78Å; R64-L69 HydrophobicContact CB-CG 4.4Å; R64-T205 PolarHBondContact NE-OG1 3.25Å; R64-T205 VanDerWaalsContact NE-OG1 3.15Å; R64-T205 PolarHBondContact NH1-O 2.93Å; R64-T205 VanDerWaalsContact NH1-O 3.07Å; R64-T205 VanDerWaalsContact NH2-C 3.3Å; R64-T205 VanDerWaalsContact NH2-CB 3.27Å; R64-T205 PolarHBondContact NH2-O 3.06Å; R64-T205 PolarHBondContact NH2-OG1 3.19Å
65	G	85.4	Confident	92.5	Very high	63 Å²	63	43.9 Å²	43.9	65%	0.649	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27	179.3	0	0	0	0	0	113.3	K63	K63-G65 PolarHBondContact O-N 3.44Å
66	I	88.6	Confident	92.1	Very high	65 Å²	65	44.3 Å²	44.3	33%	0.333	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-3	-178.6	60.9	173.6	0	0	0	113.1	R41 V45 M46 K63 R64	R41-I66 PolarHBondContact N-O 3.3Å; V45-I66 HydrophobicContact CG1-CG2 4.38Å; M46-I66 HydrophobicContact CE-CD1 3.72Å; M46-I66 HydrophobicContact CG-CD1 4.09Å; M46-I66 HydrophobicContact SD-CD1 4.21Å; K63-I66 HydrophobicContact CB-CG1 4.25Å; K63-I66 VanDerWaalsContact O-CG1 3.24Å; K63-I66 WeakPolarHBondContact O-CG1 3.36Å; K63-I66 PolarHBondContact O-N 3.14Å; R64-I66 PolarHBondContact O-N 3.15Å
67	L	90.7	Very high	91.9	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	151.5	-180	-57	-177.5	0	0	0	111.7	R39 P40 R41 M46 Y55 A60 K63 R64 L69	R39-L67 CarbonylContact O-C 3.56Å; R39-L67 WeakPolarHBondContact O-CA 3.49Å; P40-L67 HydrophobicContact CB-CD2 4.32Å; P40-L67 HydrophobicContact CG-CD2 4.02Å; R41-L67 PolarHBondContact NE-O 3.4Å; R41-L67 PolarHBondContact NH2-O 3.44Å; M46-L67 HydrophobicContact CE-CD2 4.42Å; Y55-L67 HydrophobicContact CD2-CD1 3.76Å; Y55-L67 HydrophobicContact CD2-CD2 3.67Å; Y55-L67 HydrophobicContact CD2-CG 4.4Å; Y55-L67 HydrophobicContact CE2-CD2 3.99Å; Y55-L67 HydrophobicContact CG-CD1 3.95Å; A60-L67 HydrophobicContact CB-CD1 4.33Å; K63-L67 HydrophobicContact CB-CD1 3.61Å; K63-L67 HydrophobicContact CB-CG 3.93Å; K63-L67 WeakPolarHBondContact O-CG 3.41Å; K63-L67 PolarHBondContact O-N 3.31Å; R64-L67 VanDerWaalsContact O-O 3.11Å; L67-L69 HydrophobicContact CB-CD2 4.04Å; L67-L69 HydrophobicContact CD1-CD2 4.49Å
68	T	91.3	Very high	91.9	Very high	68 Å²	68	45.7 Å²	45.7	42%	0.417	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113.3	160.1	-60.3	0	0	0	0	107.3	G38 R39 R41	G38-T68 WeakPolarHBondContact CA-O 3.45Å; R39-T68 PolarHBondContact N-O 2.67Å; R39-T68 PolarHBondContact O-N 2.65Å; R41-T68 WeakPolarHBondContact CG-OG1 3.43Å
69	L	92.6	Very high	91.9	Very high	37 Å²	37	45.1 Å²	45.1	19%	0.194	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	137.7	-179.6	-56.6	-176.6	0	0	0	110.5	I36 A60 R64 L67	I36-L69 HydrophobicContact CD1-CD1 4.25Å; I36-L69 HydrophobicContact CD1-CD2 4.41Å; A60-L69 HydrophobicContact CB-CD2 4.02Å; R64-L69 HydrophobicContact CB-CD1 3.78Å; R64-L69 HydrophobicContact CB-CG 4.4Å; L67-L69 HydrophobicContact CB-CD2 4.04Å; L67-L69 HydrophobicContact CD1-CD2 4.49Å
70	K	95.3	Very high	92.1	Very high	103 Å²	103	44.7 Å²	44.7	45%	0.448	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	146.8	172	-68.9	-169.7	175.1	-173.1	0	110.5	I36 V37	I36-K70 WeakPolarHBondContact CA-O 3.43Å; V37-K70 PolarHBondContact N-O 3.4Å; V37-K70 PolarHBondContact O-N 2.89Å
71	Y	94.8	Very high	92.3	Very high	62 Å²	62	47 Å²	47	24%	0.243	26%	0.258	C	S	.	.			trans	-108.2	111.9	176	-65.3	-98.1	0	0	0	107.9	I36 I73	I36-Y71 HydrophobicContact CG2-CD1 3.54Å; I36-Y71 HydrophobicContact CG2-CE1 3.2Å; I36-Y71 HydrophobicContact CG2-CE2 4.23Å; I36-Y71 HydrophobicContact CG2-CG 4.2Å; Y71-I73 PolarHBondContact O-N 2.98Å
72	P	96.4	Very high	92.6	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-77.5	-8.2	-177.9	28.1	-30.8	0	0	0	113.9	S35 I78 T79 N80 D83 M84 I87	S35-P72 WeakPolarHBondContact O-CD 3.41Å; P72-I78 CarbonylContact O-C 3.53Å; P72-I78 WeakPolarHBondContact O-CA 3.3Å; P72-T79 PolarHBondContact O-N 3.35Å; P72-T79 PolarHBondContact O-OG1 2.87Å; P72-N80 HydrophobicContact CB-CB 4.26Å; P72-N80 PolarHBondContact O-N 3.06Å; P72-D83 HydrophobicContact CB-CB 3.74Å; P72-D83 HydrophobicContact CG-CB 4.21Å; P72-M84 HydrophobicContact CB-CB 4.46Å; P72-M84 HydrophobicContact CG-SD 4.4Å; P72-I87 HydrophobicContact CG-CD1 3.28Å; P72-I87 HydrophobicContact CG-CG1 4.37Å
73	I	95.4	Very high	93	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	113.6	177.8	-55.4	170.7	0	0	0	108.4	N14 Y71 I77 I78 M84	N14-I73 HydrophobicContact CB-CD1 4.27Å; Y71-I73 PolarHBondContact O-N 2.98Å; I73-I77 WeakPolarHBondContact CA-O 3.4Å; I73-I78 HydrophobicContact CG1-CG1 4.02Å; I73-M84 HydrophobicContact CD1-CE 4.17Å; I73-M84 HydrophobicContact CD1-SD 3.77Å; I73-M84 HydrophobicContact CG1-SD 3.9Å
74	E	91.5	Very high	93.4	Very high	101 Å²	101	44.5 Å²	44.5	47%	0.472	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126.9	176.5	-66.2	-177.9	173.5	0	0	109	G76 I77 T79	E74-G76 PolarHBondContact O-N 2.92Å; E74-G76 VanDerWaalsContact O-N 3.1Å; E74-I77 PolarHBondContact N-O 2.97Å; E74-I77 PolarHBondContact O-N 3.18Å; E74-T79 HydrophobicContact CB-CG2 3.97Å; E74-T79 HydrophobicContact CG-CG2 4.32Å
75	H	90.4	Very high	93.9	Very high	67 Å²	67	46.6 Å²	46.6	31%	0.31	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	41.1	-177.3	-53.1	-69.5	0	0	0	114.1	I77 G160 R179	H75-I77 VanDerWaalsContact C-N 3.28Å; H75-I77 PolarHBondContact O-N 3.44Å; H75-G160 PolarHBondContact ND1-O 3.48Å; H75-R179 VanDerWaalsContact CB-NH2 3.26Å; H75-R179 PolarHBondContact O-NH2 3.44Å
76	G	88.6	Confident	94.5	Very high	14 Å²	14	46.6 Å²	46.6	14%	0.144	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	1.3	179	0	0	0	0	0	115.6	E74 A110	E74-G76 PolarHBondContact O-N 2.92Å; E74-G76 VanDerWaalsContact O-N 3.1Å; G76-A110 WeakPolarHBondContact O-CB 3.41Å
77	I	93.4	Very high	95	Very high	28 Å²	28	43.5 Å²	43.5	14%	0.144	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.2	-178.8	-54.2	-59.2	0	0	0	109.5	I73 E74 H75 T79 N117	I73-I77 WeakPolarHBondContact CA-O 3.4Å; E74-I77 PolarHBondContact N-O 2.97Å; E74-I77 PolarHBondContact O-N 3.18Å; H75-I77 VanDerWaalsContact C-N 3.28Å; H75-I77 PolarHBondContact O-N 3.44Å; I77-T79 PolarHBondContact O-N 3.33Å; I77-N117 VanDerWaalsContact CG2-ND2 3.29Å; I77-N117 WeakPolarHBondContact CG2-ND2 3.38Å
78	I	96	Very high	95.3	Very high	14 Å²	14	43.4 Å²	43.4	7%	0.072	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	121.2	174.4	-62.4	161.5	0	0	0	108.8	P72 I73 W81 M84 W88 M121	P72-I78 CarbonylContact O-C 3.53Å; P72-I78 WeakPolarHBondContact O-CA 3.3Å; I73-I78 HydrophobicContact CG1-CG1 4.02Å; I78-W81 HydrophobicContact CB-CH2 4.14Å; I78-W81 HydrophobicContact CB-CZ2 4.1Å; I78-W81 HydrophobicContact CB-CZ3 4.46Å; I78-W81 HydrophobicContact CD1-CE3 4.47Å; I78-W81 HydrophobicContact CD1-CH2 3.68Å; I78-W81 HydrophobicContact CD1-CZ2 4.48Å; I78-W81 HydrophobicContact CD1-CZ3 3.69Å; I78-W81 HydrophobicContact CG2-CD2 3.81Å; I78-W81 HydrophobicContact CG2-CE3 3.88Å; I78-W81 HydrophobicContact CG2-CG 4.37Å; I78-W81 HydrophobicContact CG2-CH2 4.17Å; I78-W81 HydrophobicContact CG2-CZ2 4.07Å; I78-W81 HydrophobicContact CG2-CZ3 4.1Å; I78-M84 HydrophobicContact CD1-CG 3.96Å; I78-M84 HydrophobicContact CD1-SD 4.41Å; I78-M84 HydrophobicContact CG1-CG 4.23Å; I78-M84 HydrophobicContact CG1-SD 4.28Å; I78-M84 HydrophobicContact CG2-CB 3.94Å; I78-M84 HydrophobicContact CG2-CG 4.19Å; I78-W88 HydrophobicContact CD1-CH2 4.09Å; I78-W88 HydrophobicContact CD1-CZ2 4.28Å; I78-M121 HydrophobicContact CD1-CE 3.73Å
79	T	95.2	Very high	95.7	Very high	77 Å²	77	44.6 Å²	44.6	47%	0.472	22%	0.217	S	C	.	.			trans	-108.5	-20.5	179.9	58.6	0	0	0	0	112.9	P72 E74 I77	P72-T79 PolarHBondContact O-N 3.35Å; P72-T79 PolarHBondContact O-OG1 2.87Å; E74-T79 HydrophobicContact CB-CG2 3.97Å; E74-T79 HydrophobicContact CG-CG2 4.32Å; I77-T79 PolarHBondContact O-N 3.33Å
80	N	97.4	Very high	96	Very high	47 Å²	47	43.9 Å²	43.9	25%	0.251	21%	0.213	S	C	.	.			trans	-133.4	103.8	177	-169.7	-53.8	0	0	0	111.2	P72 D82 D83 M84	P72-N80 HydrophobicContact CB-CB 4.26Å; P72-N80 PolarHBondContact O-N 3.06Å; N80-D82 PolarHBondContact OD1-N 2.9Å; N80-D83 HydrophobicContact CB-CB 4.18Å; N80-D83 PolarHBondContact O-N 3.03Å; N80-D83 WeakPolarHBondContact OD1-CB 3.34Å; N80-D83 PolarHBondContact OD1-N 2.84Å; N80-M84 PolarHBondContact O-N 2.84Å
81	W	97.6	Very high	96.1	Very high	49 Å²	49	39 Å²	39	19%	0.186	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-35.5	-177.4	-68.3	101.6	0	0	0	113.3	I78 D83 M84 E85 W88 N117 K120 M121 I124	I78-W81 HydrophobicContact CB-CH2 4.14Å; I78-W81 HydrophobicContact CB-CZ2 4.1Å; I78-W81 HydrophobicContact CB-CZ3 4.46Å; I78-W81 HydrophobicContact CD1-CE3 4.47Å; I78-W81 HydrophobicContact CD1-CH2 3.68Å; I78-W81 HydrophobicContact CD1-CZ2 4.48Å; I78-W81 HydrophobicContact CD1-CZ3 3.69Å; I78-W81 HydrophobicContact CG2-CD2 3.81Å; I78-W81 HydrophobicContact CG2-CE3 3.88Å; I78-W81 HydrophobicContact CG2-CG 4.37Å; I78-W81 HydrophobicContact CG2-CH2 4.17Å; I78-W81 HydrophobicContact CG2-CZ2 4.07Å; I78-W81 HydrophobicContact CG2-CZ3 4.1Å; W81-D83 VanDerWaalsContact C-N 3.27Å; W81-D83 PolarHBondContact O-N 2.75Å; W81-M84 PolarHBondContact O-N 2.82Å; W81-E85 WeakPolarHBondContact O-CB 3.48Å; W81-E85 PolarHBondContact O-N 2.77Å; W81-W88 HydrophobicContact CE3-CH2 4.49Å; W81-W88 HydrophobicContact CE3-CZ3 4.48Å; W81-W88 AromaticContact CZ3-CH2 3.96Å; W81-W88 HydrophobicContact CZ3-CH2 3.96Å; W81-W88 HydrophobicContact CZ3-CZ3 4.33Å; W81-N117 HydrophobicContact CH2-CB 4.22Å; W81-N117 WeakPolarHBondContact CH2-O 3.25Å; W81-N117 HydrophobicContact CZ2-CB 3.84Å; W81-K120 HydrophobicContact CD2-CB 4.36Å; W81-K120 HydrophobicContact CD2-CG 3.52Å; W81-K120 HydrophobicContact CE3-CG 3.8Å; W81-K120 HydrophobicContact CG-CG 4.04Å; W81-K120 HydrophobicContact CH2-CB 3.87Å; W81-K120 HydrophobicContact CH2-CG 4.06Å; W81-K120 HydrophobicContact CZ2-CB 3.72Å; W81-K120 HydrophobicContact CZ2-CG 3.82Å; W81-K120 HydrophobicContact CZ3-CB 4.24Å; W81-K120 HydrophobicContact CZ3-CG 4.03Å; W81-M121 HydrophobicContact CH2-CB 4.11Å; W81-M121 HydrophobicContact CZ3-CB 4.05Å; W81-I124 HydrophobicContact CB-CD1 4.39Å; W81-I124 HydrophobicContact CD2-CD1 4.21Å; W81-I124 HydrophobicContact CE3-CD1 3.42Å; W81-I124 VanDerWaalsContact CE3-CD1 3.42Å; W81-I124 HydrophobicContact CZ3-CD1 4.05Å
82	D	97.5	Very high	96.3	Very high	107 Å²	107	36.1 Å²	36.1	57%	0.572	18%	0.18	S	C	*	.	H	α-helix	trans	-63.9	-35.2	177.7	-58	-25.2	0	0	0	111.9	N80 K86	N80-D82 PolarHBondContact OD1-N 2.9Å; D82-K86 WeakPolarHBondContact O-CG 3.28Å; D82-K86 PolarHBondContact O-N 3.47Å; D82-K86 PolarHBondContact O-NZ 3.3Å
83	D	97.9	Very high	96.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-80.1	-34.4	177.1	-77.9	-7.8	0	0	0	111.3	V37 R39 P72 N80 W81 K86 I87	V37-D83 HydrophobicContact CB-CB 4.24Å; V37-D83 HydrophobicContact CG2-CB 3.76Å; R39-D83 IonicContact CZ-OD1 2.95Å; R39-D83 IonicContact CZ-OD2 2.74Å; R39-D83 VanDerWaalsContact NH1-CG 3.35Å; R39-D83 IonicContact NH1-OD1 3.16Å; R39-D83 PolarHBondContact NH1-OD1 3.08Å; R39-D83 IonicContact NH1-OD2 2.72Å; R39-D83 PolarHBondContact NH1-OD2 3.45Å; R39-D83 IonicContact NH2-OD1 3.35Å; R39-D83 PolarHBondContact NH2-OD1 2.81Å; R39-D83 IonicContact NH2-OD2 3.06Å; P72-D83 HydrophobicContact CB-CB 3.74Å; P72-D83 HydrophobicContact CG-CB 4.21Å; N80-D83 HydrophobicContact CB-CB 4.18Å; N80-D83 PolarHBondContact O-N 3.03Å; N80-D83 WeakPolarHBondContact OD1-CB 3.34Å; N80-D83 PolarHBondContact OD1-N 2.84Å; W81-D83 VanDerWaalsContact C-N 3.27Å; W81-D83 PolarHBondContact O-N 2.75Å; D83-K86 PolarHBondContact O-N 3.02Å; D83-K86 IonicContact OD1-NZ 3.31Å; D83-I87 PolarHBondContact O-N 3.31Å; D83-I87 VanDerWaalsContact O-N 3.09Å
84	M	98.1	Very high	96.4	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.4	-40	173.3	-165.1	65.2	-148.9	0	0	112.2	N14 P72 I73 I78 N80 W81 K86 I87 W88	N14-M84 HydrophobicContact CB-CE 4.38Å; N14-M84 WeakPolarHBondContact OD1-CE 3.21Å; P72-M84 HydrophobicContact CB-CB 4.46Å; P72-M84 HydrophobicContact CG-SD 4.4Å; I73-M84 HydrophobicContact CD1-CE 4.17Å; I73-M84 HydrophobicContact CD1-SD 3.77Å; I73-M84 HydrophobicContact CG1-SD 3.9Å; I78-M84 HydrophobicContact CD1-CG 3.96Å; I78-M84 HydrophobicContact CD1-SD 4.41Å; I78-M84 HydrophobicContact CG1-CG 4.23Å; I78-M84 HydrophobicContact CG1-SD 4.28Å; I78-M84 HydrophobicContact CG2-CB 3.94Å; I78-M84 HydrophobicContact CG2-CG 4.19Å; N80-M84 PolarHBondContact O-N 2.84Å; W81-M84 PolarHBondContact O-N 2.82Å; M84-K86 VanDerWaalsContact C-N 3.31Å; M84-K86 PolarHBondContact O-N 3.41Å; M84-I87 HydrophobicContact CE-CB 4.36Å; M84-I87 HydrophobicContact CE-CG2 3.85Å; M84-I87 WeakPolarHBondContact O-CA 3.41Å; M84-I87 WeakPolarHBondContact O-CB 3.45Å; M84-I87 PolarHBondContact O-N 3.07Å; M84-I87 VanDerWaalsContact O-N 3.08Å; M84-I87 HydrophobicContact SD-CB 4.49Å; M84-I87 HydrophobicContact SD-CD1 4.46Å; M84-I87 HydrophobicContact SD-CG2 4.49Å; M84-W88 HydrophobicContact CB-CZ3 4.33Å; M84-W88 HydrophobicContact CE-CD2 3.98Å; M84-W88 HydrophobicContact CE-CG 4.3Å; M84-W88 HydrophobicContact CE-CH2 4.46Å; M84-W88 HydrophobicContact CE-CZ2 3.62Å; M84-W88 HydrophobicContact CG-CD2 4.06Å; M84-W88 HydrophobicContact CG-CE3 3.94Å; M84-W88 HydrophobicContact CG-CH2 3.53Å; M84-W88 HydrophobicContact CG-CZ2 3.66Å; M84-W88 HydrophobicContact CG-CZ3 3.68Å; M84-W88 PolarHBondContact O-N 2.86Å; M84-W88 HydrophobicContact SD-CZ2 4.44Å
85	E	98.1	Very high	96.7	Very high	72 Å²	72	42.7 Å²	42.7	34%	0.336	21%	0.21	S	C	.	.	H	α-helix	trans	-59.7	-41.1	174.4	-170.7	-179.2	125.4	0	0	111.6	W81 I87 W88 H89 I124 T128 F129	W81-E85 WeakPolarHBondContact O-CB 3.48Å; W81-E85 PolarHBondContact O-N 2.77Å; E85-I87 VanDerWaalsContact C-N 3.3Å; E85-I87 PolarHBondContact O-N 3.35Å; E85-W88 PolarHBondContact O-N 2.94Å; E85-H89 WeakPolarHBondContact O-CB 3.45Å; E85-H89 PolarHBondContact O-N 3.15Å; E85-I124 HydrophobicContact CG-CG2 4.36Å; E85-T128 HydrophobicContact CG-CG2 4.35Å; E85-F129 HydrophobicContact CG-CE2 4.06Å; E85-F129 HydrophobicContact CG-CZ 3.94Å
86	K	98.1	Very high	97	Very high	63 Å²	63	40.4 Å²	40.4	27%	0.274	20%	0.2	S	C	.	.	H	α-helix	trans	-63.3	-36.4	174	-69.4	175.5	-168.6	73.4	0	112.5	V37 V56 D82 D83 M84 H90	V37-K86 HydrophobicContact CG1-CD 4.09Å; V37-K86 HydrophobicContact CG2-CB 4.46Å; V56-K86 HydrophobicContact CG2-CB 4.2Å; D82-K86 WeakPolarHBondContact O-CG 3.28Å; D82-K86 PolarHBondContact O-N 3.47Å; D82-K86 PolarHBondContact O-NZ 3.3Å; D83-K86 PolarHBondContact O-N 3.02Å; D83-K86 IonicContact OD1-NZ 3.31Å; M84-K86 VanDerWaalsContact C-N 3.31Å; M84-K86 PolarHBondContact O-N 3.41Å; K86-H90 WeakPolarHBondContact O-CB 3.45Å; K86-H90 PolarHBondContact O-N 3.13Å
87	I	98.4	Very high	97.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.7	-46.5	175.1	-74.9	-177.9	0	0	0	111.1	V19 F33 V37 V56 P72 D83 M84 E85 H90 A91	V19-I87 HydrophobicContact CG2-CG2 3.62Å; F33-I87 HydrophobicContact CE2-CG2 4.11Å; F33-I87 HydrophobicContact CZ-CG2 4.26Å; V37-I87 HydrophobicContact CG2-CD1 4.42Å; V37-I87 HydrophobicContact CG2-CG1 4.03Å; V56-I87 HydrophobicContact CG1-CG1 3.95Å; P72-I87 HydrophobicContact CG-CD1 3.28Å; P72-I87 HydrophobicContact CG-CG1 4.37Å; D83-I87 PolarHBondContact O-N 3.31Å; D83-I87 VanDerWaalsContact O-N 3.09Å; M84-I87 HydrophobicContact CE-CB 4.36Å; M84-I87 HydrophobicContact CE-CG2 3.85Å; M84-I87 WeakPolarHBondContact O-CA 3.41Å; M84-I87 WeakPolarHBondContact O-CB 3.45Å; M84-I87 PolarHBondContact O-N 3.07Å; M84-I87 VanDerWaalsContact O-N 3.08Å; M84-I87 HydrophobicContact SD-CB 4.49Å; M84-I87 HydrophobicContact SD-CD1 4.46Å; M84-I87 HydrophobicContact SD-CG2 4.49Å; E85-I87 VanDerWaalsContact C-N 3.3Å; E85-I87 PolarHBondContact O-N 3.35Å; I87-H90 WeakPolarHBondContact O-CB 3.38Å; I87-H90 PolarHBondContact O-N 3.13Å; I87-A91 PolarHBondContact O-N 2.89Å
88	W	98.5	Very high	97.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.2	-42	177.1	-71.4	-43.4	0	0	0	112.5	N14 I78 W81 M84 E85 H90 A91 F92 L107 M121 I124 M125 F129	N14-W88 PolarHBondContact OD1-NE1 3.3Å; I78-W88 HydrophobicContact CD1-CH2 4.09Å; I78-W88 HydrophobicContact CD1-CZ2 4.28Å; W81-W88 HydrophobicContact CE3-CH2 4.49Å; W81-W88 HydrophobicContact CE3-CZ3 4.48Å; W81-W88 AromaticContact CZ3-CH2 3.96Å; W81-W88 HydrophobicContact CZ3-CH2 3.96Å; W81-W88 HydrophobicContact CZ3-CZ3 4.33Å; M84-W88 HydrophobicContact CB-CZ3 4.33Å; M84-W88 HydrophobicContact CE-CD2 3.98Å; M84-W88 HydrophobicContact CE-CG 4.3Å; M84-W88 HydrophobicContact CE-CH2 4.46Å; M84-W88 HydrophobicContact CE-CZ2 3.62Å; M84-W88 HydrophobicContact CG-CD2 4.06Å; M84-W88 HydrophobicContact CG-CE3 3.94Å; M84-W88 HydrophobicContact CG-CH2 3.53Å; M84-W88 HydrophobicContact CG-CZ2 3.66Å; M84-W88 HydrophobicContact CG-CZ3 3.68Å; M84-W88 PolarHBondContact O-N 2.86Å; M84-W88 HydrophobicContact SD-CZ2 4.44Å; E85-W88 PolarHBondContact O-N 2.94Å; W88-H90 VanDerWaalsContact C-N 3.26Å; W88-H90 PolarHBondContact O-N 2.92Å; W88-A91 WeakPolarHBondContact O-CB 3.38Å; W88-A91 PolarHBondContact O-N 3Å; W88-A91 VanDerWaalsContact O-N 3.12Å; W88-F92 HydrophobicContact CB-CD2 4.41Å; W88-F92 HydrophobicContact CB-CE2 3.98Å; W88-F92 VanDerWaalsContact O-CD2 3.22Å; W88-F92 WeakPolarHBondContact O-CD2 3.39Å; W88-F92 WeakPolarHBondContact O-CG 3.13Å; W88-F92 PolarHBondContact O-N 3.36Å; W88-L107 HydrophobicContact CZ2-CD2 4.42Å; W88-M121 HydrophobicContact CH2-CB 4.31Å; W88-M121 HydrophobicContact CH2-CE 4.44Å; W88-M121 HydrophobicContact CH2-CG 3.76Å; W88-M121 HydrophobicContact CZ2-CE 4.24Å; W88-M121 HydrophobicContact CZ2-CG 4.02Å; W88-M121 HydrophobicContact CZ2-SD 4.44Å; W88-I124 HydrophobicContact CE3-CG2 4.09Å; W88-I124 HydrophobicContact CZ3-CB 4.42Å; W88-I124 HydrophobicContact CZ3-CD1 4.19Å; W88-I124 HydrophobicContact CZ3-CG2 4.01Å; W88-M125 HydrophobicContact CB-CE 4.21Å; W88-M125 HydrophobicContact CD2-CE 3.29Å; W88-M125 VanDerWaalsContact CE2-CE 3.48Å; W88-M125 HydrophobicContact CE3-CE 3.65Å; W88-M125 HydrophobicContact CG-CE 3.56Å; W88-M125 HydrophobicContact CH2-CE 4.31Å; W88-M125 HydrophobicContact CZ2-CE 4.01Å; W88-M125 HydrophobicContact CZ3-CE 4.14Å; W88-F129 HydrophobicContact CB-CE2 3.76Å; W88-F129 HydrophobicContact CB-CZ 3.69Å; W88-F129 HydrophobicContact CE3-CE2 4.18Å
89	H	98.4	Very high	97.7	Very high	92 Å²	92	50.1 Å²	50.1	43%	0.426	24%	0.238	S	C	.	.	H	α-helix	trans	-56	-44.9	172.6	-178.5	-63.3	0	0	0	111	E85 Y93 F129	E85-H89 WeakPolarHBondContact O-CB 3.45Å; E85-H89 PolarHBondContact O-N 3.15Å; H89-Y93 HydrophobicContact CB-CD2 4.45Å; H89-Y93 AromaticContact CD2-CD2 3.63Å; H89-Y93 AromaticContact CD2-CE2 3.84Å; H89-Y93 AromaticContact CE1-CD2 3.64Å; H89-Y93 AromaticContact CG-CD2 3.72Å; H89-Y93 AromaticContact ND1-CD2 3.74Å; H89-Y93 AromaticContact NE2-CD2 3.61Å; H89-Y93 WeakPolarHBondContact O-CB 3.38Å; H89-Y93 WeakPolarHBondContact O-CD2 3.47Å; H89-Y93 PolarHBondContact O-N 3.38Å; H89-F129 HydrophobicContact CB-CE1 4.1Å; H89-F129 HydrophobicContact CB-CZ 4.24Å
90	H	98.2	Very high	97.8	Very high	23 Å²	23	46.4 Å²	46.4	11%	0.106	22%	0.215	C	C	.	.	I	π-helix	trans	-62.8	-44.4	176.2	-176.5	68.1	0	0	0	112	F33 V56 K86 I87 W88 F92 N94 E95	F33-H90 AromaticContact CD2-CD2 3.98Å; F33-H90 AromaticContact CE2-CD2 3.75Å; F33-H90 AromaticContact CZ-CD2 3.92Å; V56-H90 HydrophobicContact CB-CB 3.96Å; V56-H90 HydrophobicContact CG1-CB 3.7Å; V56-H90 HydrophobicContact CG2-CB 4.32Å; K86-H90 WeakPolarHBondContact O-CB 3.45Å; K86-H90 PolarHBondContact O-N 3.13Å; I87-H90 WeakPolarHBondContact O-CB 3.38Å; I87-H90 PolarHBondContact O-N 3.13Å; W88-H90 VanDerWaalsContact C-N 3.26Å; W88-H90 PolarHBondContact O-N 2.92Å; H90-F92 PolarHBondContact O-N 3.01Å; H90-N94 WeakPolarHBondContact ND1-CB 3.43Å; H90-N94 WeakPolarHBondContact O-CA 3.28Å; H90-N94 VanDerWaalsContact O-CB 3.28Å; H90-N94 WeakPolarHBondContact O-CB 3.42Å; H90-N94 PolarHBondContact O-N 3.39Å; H90-E95 IonicContact CE1-OE1 2.74Å; H90-E95 IonicContact NE2-OE1 3.22Å; H90-E95 PolarHBondContact NE2-OE1 3.13Å; H90-E95 PolarHBondContact O-N 2.94Å
91	A	98.3	Very high	97.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	22%	0.224	C	C	.	.	I	π-helix	trans	-58.3	-48.9	177.2	0	0	0	0	0	112	A21 F33 I87 W88 E95 L96	A21-A91 HydrophobicContact CB-CB 4.39Å; F33-A91 HydrophobicContact CE1-CB 4.16Å; F33-A91 HydrophobicContact CZ-CB 4.02Å; I87-A91 PolarHBondContact O-N 2.89Å; W88-A91 WeakPolarHBondContact O-CB 3.38Å; W88-A91 PolarHBondContact O-N 3Å; W88-A91 VanDerWaalsContact O-N 3.12Å; A91-E95 WeakPolarHBondContact O-CB 3.45Å; A91-L96 WeakPolarHBondContact O-CB 3.27Å; A91-L96 WeakPolarHBondContact O-CG 3.36Å; A91-L96 PolarHBondContact O-N 3Å
92	F	98.3	Very high	97.8	Very high	1 Å²	1	52 Å²	52	0%	0.004	24%	0.242	C	C	.	.	I	π-helix	trans	-74.5	-53.3	-176	-58	-40.7	0	0	0	112.5	L10 W88 H90 L96 R97 V98 P100 T105 M125 F129	L10-F92 HydrophobicContact CD1-CD1 3.68Å; L10-F92 HydrophobicContact CD1-CE1 3.77Å; W88-F92 HydrophobicContact CB-CD2 4.41Å; W88-F92 HydrophobicContact CB-CE2 3.98Å; W88-F92 VanDerWaalsContact O-CD2 3.22Å; W88-F92 WeakPolarHBondContact O-CD2 3.39Å; W88-F92 WeakPolarHBondContact O-CG 3.13Å; W88-F92 PolarHBondContact O-N 3.36Å; H90-F92 PolarHBondContact O-N 3.01Å; F92-L96 CarbonylContact O-C 3.37Å; F92-R97 WeakPolarHBondContact O-CA 3.43Å; F92-R97 PolarHBondContact O-N 3.48Å; F92-V98 PolarHBondContact O-N 3.32Å; F92-P100 HydrophobicContact CB-CB 4.43Å; F92-P100 HydrophobicContact CB-CG 4.38Å; F92-P100 HydrophobicContact CD2-CB 3.87Å; F92-P100 HydrophobicContact CD2-CG 4.14Å; F92-P100 HydrophobicContact CE2-CB 4.28Å; F92-P100 HydrophobicContact CG-CB 4.11Å; F92-P100 HydrophobicContact CG-CG 4.46Å; F92-T105 HydrophobicContact CE1-CG2 4.24Å; F92-T105 HydrophobicContact CZ-CG2 3.99Å; F92-M125 HydrophobicContact CE2-CE 4.2Å; F92-M125 HydrophobicContact CE2-SD 4.17Å; F92-M125 HydrophobicContact CZ-CE 4.19Å; F92-M125 HydrophobicContact CZ-SD 4.24Å; F92-F129 AromaticContact CD2-CD1 3.96Å; F92-F129 HydrophobicContact CD2-CD1 3.96Å; F92-F129 HydrophobicContact CD2-CE1 4.07Å; F92-F129 HydrophobicContact CD2-CG 4.38Å; F92-F129 HydrophobicContact CE2-CD1 4.23Å; F92-F129 HydrophobicContact CE2-CD2 4.39Å; F92-F129 HydrophobicContact CE2-CE1 4.45Å; F92-F129 HydrophobicContact CE2-CG 4.2Å
93	Y	98.1	Very high	97.8	Very high	89 Å²	89	48.1 Å²	48.1	35%	0.349	22%	0.22	S	C	.	.	I	π-helix	trans	-88.9	-29.3	-169.1	-64.2	-73.5	0	0	0	114.2	H89 P100 F129	H89-Y93 HydrophobicContact CB-CD2 4.45Å; H89-Y93 AromaticContact CD2-CD2 3.63Å; H89-Y93 AromaticContact CD2-CE2 3.84Å; H89-Y93 AromaticContact CE1-CD2 3.64Å; H89-Y93 AromaticContact CG-CD2 3.72Å; H89-Y93 AromaticContact ND1-CD2 3.74Å; H89-Y93 AromaticContact NE2-CD2 3.61Å; H89-Y93 WeakPolarHBondContact O-CB 3.38Å; H89-Y93 WeakPolarHBondContact O-CD2 3.47Å; H89-Y93 PolarHBondContact O-N 3.38Å; Y93-P100 HydrophobicContact CE1-CG 4.42Å; Y93-P100 HydrophobicContact CE2-CG 4.13Å; Y93-P100 VanDerWaalsContact OH-CD 3.3Å; Y93-P100 WeakPolarHBondContact OH-CD 3.3Å; Y93-P100 WeakPolarHBondContact OH-CG 3.29Å; Y93-F129 HydrophobicContact CE2-CD1 4.41Å; Y93-F129 HydrophobicContact CE2-CE1 4.34Å
94	N	96.7	Very high	97.7	Very high	77 Å²	77	48.9 Å²	48.9	41%	0.412	23%	0.225	S	C	.	.	I	π-helix	trans	-98.8	-50.3	-176.6	-63.9	85.2	0	0	0	112.4	H90 R97	H90-N94 WeakPolarHBondContact ND1-CB 3.43Å; H90-N94 WeakPolarHBondContact O-CA 3.28Å; H90-N94 VanDerWaalsContact O-CB 3.28Å; H90-N94 WeakPolarHBondContact O-CB 3.42Å; H90-N94 PolarHBondContact O-N 3.39Å; N94-R97 WeakPolarHBondContact O-CG 3.36Å
95	E	97.9	Very high	97.8	Very high	76 Å²	76	48.9 Å²	48.9	36%	0.355	23%	0.225	S	C	.	.	I	π-helix	trans	-78.8	-58.5	-176.2	-67.2	-62.4	126.1	0	0	111.2	A31 F33 H90 A91	A31-E95 HydrophobicContact CB-CB 3.68Å; A31-E95 HydrophobicContact CB-CG 4.13Å; F33-E95 HydrophobicContact CD1-CG 3.86Å; F33-E95 HydrophobicContact CE1-CG 3.89Å; H90-E95 IonicContact CE1-OE1 2.74Å; H90-E95 IonicContact NE2-OE1 3.22Å; H90-E95 PolarHBondContact NE2-OE1 3.13Å; H90-E95 PolarHBondContact O-N 2.94Å; A91-E95 WeakPolarHBondContact O-CB 3.45Å
96	L	97.5	Very high	97.8	Very high	19 Å²	19	45.4 Å²	45.4	10%	0.099	21%	0.209	C	C	.	.	I	π-helix	trans	-82.8	-23.6	-178.7	-61.3	-176.5	0	0	0	113.4	L10 A21 F23 R30 A31 A91 F92 V98	L10-L96 HydrophobicContact CD2-CD1 4.17Å; A21-L96 HydrophobicContact CB-CD1 4.06Å; A21-L96 HydrophobicContact CB-CD2 4.46Å; A21-L96 HydrophobicContact CB-CG 4.35Å; F23-L96 HydrophobicContact CE2-CD2 4.14Å; R30-L96 HydrophobicContact CB-CD2 4.02Å; A31-L96 HydrophobicContact CB-CD2 4.48Å; A91-L96 WeakPolarHBondContact O-CB 3.27Å; A91-L96 WeakPolarHBondContact O-CG 3.36Å; A91-L96 PolarHBondContact O-N 3Å; F92-L96 CarbonylContact O-C 3.37Å; L96-V98 HydrophobicContact CB-CG2 3.97Å
97	R	97.8	Very high	97.8	Very high	211 Å²	211	42.4 Å²	42.4	80%	0.796	20%	0.196	S	C	*	.			trans	56.4	45.7	-179.8	-54.3	-178.9	-178.7	-179.2	1.4	113.1	F92 N94	F92-R97 WeakPolarHBondContact O-CA 3.43Å; F92-R97 PolarHBondContact O-N 3.48Å; N94-R97 WeakPolarHBondContact O-CG 3.36Å
98	V	97.2	Very high	97.7	Very high	22 Å²	22	42.4 Å²	42.4	13%	0.133	20%	0.196	C	C	.	.			trans	-120.2	159	179.1	-64.4	0	0	0	0	111.5	L10 F23 F92 L96 P100	L10-V98 HydrophobicContact CD1-CG2 3.82Å; L10-V98 HydrophobicContact CD2-CG2 4.27Å; F23-V98 HydrophobicContact CE1-CG1 3.94Å; F23-V98 HydrophobicContact CZ-CG1 3.58Å; F92-V98 PolarHBondContact O-N 3.32Å; L96-V98 HydrophobicContact CB-CG2 3.97Å; V98-P100 WeakPolarHBondContact O-CD 3.4Å
99	A	97.3	Very high	97.6	Very high	26 Å²	26	42.8 Å²	42.8	22%	0.215	20%	0.198	C	C	.	.			trans	-87.3	108.7	167.9	0	0	0	0	0	108.6	E101 E102 H103	A99-E101 HydrophobicContact CB-CG 4.22Å; A99-E101 PolarHBondContact O-N 3.17Å; A99-E101 VanDerWaalsContact O-N 3.12Å; A99-E102 HydrophobicContact CB-CG 4.18Å; A99-E102 PolarHBondContact O-N 2.94Å; A99-H103 PolarHBondContact O-CD2 3.22Å
100	P	97.2	Very high	97.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-58.3	-25.6	-177.2	23.8	-33.7	0	0	0	113.5	F92 Y93 V98 E102 H103 F129 V131 P132	F92-P100 HydrophobicContact CB-CB 4.43Å; F92-P100 HydrophobicContact CB-CG 4.38Å; F92-P100 HydrophobicContact CD2-CB 3.87Å; F92-P100 HydrophobicContact CD2-CG 4.14Å; F92-P100 HydrophobicContact CE2-CB 4.28Å; F92-P100 HydrophobicContact CG-CB 4.11Å; F92-P100 HydrophobicContact CG-CG 4.46Å; Y93-P100 HydrophobicContact CE1-CG 4.42Å; Y93-P100 HydrophobicContact CE2-CG 4.13Å; Y93-P100 VanDerWaalsContact OH-CD 3.3Å; Y93-P100 WeakPolarHBondContact OH-CD 3.3Å; Y93-P100 WeakPolarHBondContact OH-CG 3.29Å; V98-P100 WeakPolarHBondContact O-CD 3.4Å; P100-E102 PolarHBondContact O-N 3.24Å; P100-H103 PolarHBondContact O-N 3.18Å; P100-F129 HydrophobicContact CB-CB 4.26Å; P100-F129 HydrophobicContact CG-CB 4.2Å; P100-F129 HydrophobicContact CG-CD1 4.03Å; P100-V131 HydrophobicContact CB-CG1 4.19Å; P100-P132 WeakPolarHBondContact O-CD 3.46Å
101	E	97.3	Very high	96.9	Very high	93 Å²	93	37.4 Å²	37.4	44%	0.435	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-64.8	-13.7	175.2	61.8	-94.1	-138.2	0	0	114.6	A99 N130 P132	A99-E101 HydrophobicContact CB-CG 4.22Å; A99-E101 PolarHBondContact O-N 3.17Å; A99-E101 VanDerWaalsContact O-N 3.12Å; E101-N130 WeakPolarHBondContact CA-O 3.48Å; E101-N130 HydrophobicContact CB-CB 4.21Å; E101-P132 WeakPolarHBondContact O-CD 3.39Å
102	E	96.7	Very high	96.4	Very high	121 Å²	121	42.2 Å²	42.2	57%	0.565	20%	0.198	S	C	*	.	G	3₁₀ helix	trans	-99	-7.9	177.9	-62.5	-178.3	171.3	0	0	113	T7 A99 P100	T7-E102 WeakPolarHBondContact CB-O 3.35Å; T7-E102 PolarHBondContact OG1-O 3.1Å; A99-E102 HydrophobicContact CB-CG 4.18Å; A99-E102 PolarHBondContact O-N 2.94Å; P100-E102 PolarHBondContact O-N 3.24Å
103	H	97.3	Very high	96	Very high	24 Å²	24	42.9 Å²	42.9	11%	0.111	20%	0.202	C	C	.	.	S	Bend	trans	-128.7	127.3	-169.4	-66.6	-89.6	0	0	0	114.2	T8 L10 A99 P100 T105 P132	T8-H103 PolarHBondContact O-ND1 2.9Å; L10-H103 HydrophobicContact CD1-CB 3.95Å; L10-H103 HydrophobicContact CD2-CB 4.26Å; L10-H103 HydrophobicContact CG-CB 3.7Å; A99-H103 PolarHBondContact O-CD2 3.22Å; P100-H103 PolarHBondContact O-N 3.18Å; H103-T105 PolarHBondContact O-N 2.96Å; H103-T105 PolarHBondContact O-OG1 2.99Å; H103-P132 WeakPolarHBondContact O-CD 3.45Å
104	P	97.6	Very high	95.8	Very high	17 Å²	17	41.6 Å²	41.6	11%	0.11	21%	0.205	C	C	.	.			trans	-56.1	139.7	164.8	-22.7	33.8	0	0	0	110.8	A9 L10 A133 W358	A9-P104 CarbonylContact C-O 3.51Å; A9-P104 VanDerWaalsContact CA-O 3.23Å; A9-P104 WeakPolarHBondContact CA-O 3.33Å; A9-P104 HydrophobicContact CB-CB 4.12Å; L10-P104 PolarHBondContact N-O 2.89Å; P104-A133 CarbonylContact C-O 3.58Å; P104-A133 VanDerWaalsContact CA-O 3.29Å; P104-A133 WeakPolarHBondContact CA-O 3.49Å; P104-A133 HydrophobicContact CB-CB 4.27Å; P104-W358 HydrophobicContact CB-CD2 4.34Å; P104-W358 HydrophobicContact CB-CE3 4.33Å; P104-W358 HydrophobicContact CB-CH2 4Å; P104-W358 HydrophobicContact CB-CZ2 3.99Å; P104-W358 HydrophobicContact CB-CZ3 4.18Å
105	T	98.3	Very high	95.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	114.8	-173.4	-62.3	0	0	0	0	112.5	L10 F92 H103 L107 A133 M134 Y135	L10-T105 HydrophobicContact CB-CG2 4.41Å; F92-T105 HydrophobicContact CE1-CG2 4.24Å; F92-T105 HydrophobicContact CZ-CG2 3.99Å; H103-T105 PolarHBondContact O-N 2.96Å; H103-T105 PolarHBondContact O-OG1 2.99Å; T105-L107 HydrophobicContact CG2-CD1 4.44Å; T105-L107 HydrophobicContact CG2-CD2 4.49Å; T105-L107 HydrophobicContact CG2-CG 4.12Å; T105-A133 PolarHBondContact N-O 2.84Å; T105-M134 WeakPolarHBondContact O-CA 3.45Å; T105-M134 VanDerWaalsContact O-CB 3.28Å; T105-M134 WeakPolarHBondContact O-CB 3.44Å; T105-Y135 PolarHBondContact O-N 3.12Å; T105-Y135 VanDerWaalsContact O-N 3.12Å
106	L	98.5	Very high	95.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	123.9	169.6	-171.4	152.1	0	0	0	109.7	L10 V11 C12 T108 Y135 A137 L142 L348 A349 F354 W358	L10-L106 PolarHBondContact O-N 3.14Å; V11-L106 HydrophobicContact CG1-CD2 4.18Å; V11-L106 HydrophobicContact CG2-CB 4.43Å; C12-L106 PolarHBondContact N-O 2.93Å; L106-T108 HydrophobicContact CD2-CG2 4.34Å; L106-Y135 WeakPolarHBondContact CA-O 3.4Å; L106-Y135 HydrophobicContact CD1-CD1 4.42Å; L106-A137 HydrophobicContact CD2-CB 4.22Å; L106-L142 HydrophobicContact CD2-CD1 4.16Å; L106-L348 HydrophobicContact CD1-CD2 4.23Å; L106-A349 HydrophobicContact CB-CB 4.47Å; L106-A349 HydrophobicContact CD1-CB 4.06Å; L106-F354 HydrophobicContact CD1-CE1 4.15Å; L106-F354 HydrophobicContact CD1-CZ 4.05Å; L106-W358 HydrophobicContact CB-CH2 3.9Å; L106-W358 HydrophobicContact CB-CZ3 4.28Å
107	L	98.3	Very high	95.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.3	175.9	-71.6	154.2	0	0	0	110.6	C12 N14 W88 T105 M121 M125 M134 Y135 V136 A137	C12-L107 HydrophobicContact CB-CD2 3.77Å; C12-L107 WeakPolarHBondContact O-CA 3.49Å; N14-L107 WeakPolarHBondContact ND2-CD2 3.27Å; W88-L107 HydrophobicContact CZ2-CD2 4.42Å; T105-L107 HydrophobicContact CG2-CD1 4.44Å; T105-L107 HydrophobicContact CG2-CD2 4.49Å; T105-L107 HydrophobicContact CG2-CG 4.12Å; L107-M121 HydrophobicContact CB-SD 3.85Å; L107-M121 HydrophobicContact CD1-CG 3.95Å; L107-M121 HydrophobicContact CD1-SD 3.88Å; L107-M121 HydrophobicContact CG-SD 4.33Å; L107-M125 HydrophobicContact CD1-CE 3.59Å; L107-M125 HydrophobicContact CD1-CG 3.5Å; L107-M125 VanDerWaalsContact CD1-CG 3.5Å; L107-M125 HydrophobicContact CD1-SD 3.87Å; L107-M125 HydrophobicContact CD2-CE 3.85Å; L107-M125 HydrophobicContact CG-CE 4.32Å; L107-M134 HydrophobicContact CD1-CE 3.92Å; L107-Y135 PolarHBondContact N-O 3.26Å; L107-V136 CarbonylContact O-C 3.55Å; L107-V136 WeakPolarHBondContact O-CA 3.4Å; L107-A137 PolarHBondContact O-N 3.31Å
108	T	97.3	Very high	95.4	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.5	173.1	77.4	0	0	0	0	111.6	C12 D13 N14 L106 A137 Q139 L142 V341	C12-T108 PolarHBondContact O-N 2.87Å; C12-T108 VanDerWaalsContact O-N 3.14Å; D13-T108 VanDerWaalsContact CA-OG1 3.3Å; D13-T108 WeakPolarHBondContact CA-OG1 3.34Å; D13-T108 HydrophobicContact CB-CG2 4.08Å; D13-T108 PolarHBondContact OD1-OG1 2.88Å; N14-T108 PolarHBondContact N-OG1 2.8Å; N14-T108 PolarHBondContact ND2-O 2.98Å; L106-T108 HydrophobicContact CD2-CG2 4.34Å; T108-A137 VanDerWaalsContact CA-O 3.3Å; T108-A137 WeakPolarHBondContact CA-O 3.4Å; T108-Q139 PolarHBondContact OG1-NE2 2.95Å; T108-L142 HydrophobicContact CG2-CD1 3.67Å; T108-V341 HydrophobicContact CG2-CG1 3.85Å
109	E	95	Very high	95.4	Very high	8 Å²	8	38 Å²	38	4%	0.037	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.6	169.6	65.7	167.8	-147	0	0	112.1	N113 R118 V136 A137 Q139	E109-N113 HydrophobicContact CB-CB 4.39Å; E109-N113 HydrophobicContact CG-CB 4.44Å; E109-N113 PolarHBondContact OE2-ND2 3.14Å; E109-R118 VanDerWaalsContact CD-NE 3.27Å; E109-R118 IonicContact OE1-CZ 3.89Å; E109-R118 IonicContact OE1-NE 3.45Å; E109-R118 PolarHBondContact OE1-NE 2.84Å; E109-R118 IonicContact OE1-NH2 3.39Å; E109-R118 PolarHBondContact OE1-NH2 2.84Å; E109-R118 WeakPolarHBondContact OE2-CG 3.4Å; E109-R118 IonicContact OE2-CZ 3.78Å; E109-R118 IonicContact OE2-NE 3.06Å; E109-R118 PolarHBondContact OE2-NE 2.81Å; E109-V136 HydrophobicContact CB-CG1 4.07Å; E109-V136 HydrophobicContact CG-CG1 3.6Å; E109-A137 PolarHBondContact N-O 3.46Å; E109-Q139 VanDerWaalsContact O-CG 3.29Å; E109-Q139 WeakPolarHBondContact O-CG 3.32Å; E109-Q139 PolarHBondContact O-N 2.83Å; E109-Q139 VanDerWaalsContact O-N 3.16Å
110	A	92.6	Very high	95.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.008	21%	0.205	C	C	.	.			trans	-68.2	150.5	173.9	0	0	0	0	0	111.3	G76 N113	G76-A110 WeakPolarHBondContact O-CB 3.41Å; A110-N113 WeakPolarHBondContact O-CB 3.28Å; A110-N113 PolarHBondContact O-N 2.92Å
111	P	90.2	Very high	95.5	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	144.5	170	-20.8	31.3	0	0	0	111.9	N113 I138 H163 V165 I177	P111-N113 PolarHBondContact O-N 2.75Å; P111-I138 HydrophobicContact CB-CG2 4.44Å; P111-I138 HydrophobicContact CG-CG2 4.05Å; P111-H163 HydrophobicContact CG-CB 4.12Å; P111-V165 HydrophobicContact CB-CG2 3.97Å; P111-V165 HydrophobicContact CG-CG2 3.46Å; P111-V165 VanDerWaalsContact CG-CG2 3.46Å; P111-I177 HydrophobicContact CB-CD1 4.13Å; P111-I177 HydrophobicContact CB-CG2 4.08Å
112	L	87.8	Confident	95.5	Very high	100 Å²	100	36 Å²	36	52%	0.524	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	26.8	-179.3	-52.4	175.1	0	0	0	114.4	P174 I177	L112-P174 HydrophobicContact CD2-CB 4.49Å; L112-I177 HydrophobicContact CD1-CB 4.18Å; L112-I177 HydrophobicContact CD1-CG2 3.9Å; L112-I177 HydrophobicContact CD2-CD1 4.09Å; L112-I177 HydrophobicContact CG-CB 4.43Å; L112-I177 HydrophobicContact CG-CD1 4.18Å; L112-I177 HydrophobicContact CG-CG2 4.14Å
113	N	90	Very high	95.6	Very high	15 Å²	15	33 Å²	33	8%	0.08	17%	0.171	C	C	.	.			trans	-56.9	135.9	172.4	-169.8	32.1	0	0	0	110.7	E109 A110 P111 K115	E109-N113 HydrophobicContact CB-CB 4.39Å; E109-N113 HydrophobicContact CG-CB 4.44Å; E109-N113 PolarHBondContact OE2-ND2 3.14Å; A110-N113 WeakPolarHBondContact O-CB 3.28Å; A110-N113 PolarHBondContact O-N 2.92Å; P111-N113 PolarHBondContact O-N 2.75Å; N113-K115 PolarHBondContact O-N 2.91Å
114	P	93.1	Very high	95.6	Very high	63 Å²	63	32.1 Å²	32.1	41%	0.409	17%	0.167	S	C	.	.			trans	-54.3	135.3	175.4	-29.1	36.3	0	0	0	112	A116 N117 R118	P114-A116 PolarHBondContact O-N 2.97Å; P114-N117 HydrophobicContact CB-CB 4.46Å; P114-N117 WeakPolarHBondContact O-CB 3.31Å; P114-N117 PolarHBondContact O-N 3Å; P114-R118 PolarHBondContact O-N 2.93Å
115	K	94.3	Very high	95.7	Very high	147 Å²	147	31.3 Å²	31.3	64%	0.639	16%	0.162	S	C	*	.	H	α-helix	trans	-52.5	-44	-179.9	-73.2	-170.6	177.8	-174.6	0	112.6	N113 N117 R118 E119	N113-K115 PolarHBondContact O-N 2.91Å; K115-N117 PolarHBondContact O-N 3.46Å; K115-R118 WeakPolarHBondContact O-CB 3.36Å; K115-R118 PolarHBondContact O-N 2.88Å; K115-E119 PolarHBondContact O-N 3.48Å
116	A	96.2	Very high	95.7	Very high	61 Å²	61	31.3 Å²	31.3	50%	0.504	16%	0.162	S	C	.	.	H	α-helix	trans	-58.5	-33	177.1	0	0	0	0	0	113.3	P114 K120	P114-A116 PolarHBondContact O-N 2.97Å; A116-K120 VanDerWaalsContact O-CB 3.3Å; A116-K120 WeakPolarHBondContact O-CB 3.44Å; A116-K120 PolarHBondContact O-N 2.93Å
117	N	96	Very high	95.7	Very high	26 Å²	26	36.1 Å²	36.1	14%	0.139	18%	0.184	C	C	.	.	H	α-helix	trans	-71.2	-40.7	176.3	-73.8	5.3	0	0	0	111.2	I77 W81 P114 K115 E119 K120 M121	I77-N117 VanDerWaalsContact CG2-ND2 3.29Å; I77-N117 WeakPolarHBondContact CG2-ND2 3.38Å; W81-N117 HydrophobicContact CH2-CB 4.22Å; W81-N117 WeakPolarHBondContact CH2-O 3.25Å; W81-N117 HydrophobicContact CZ2-CB 3.84Å; P114-N117 HydrophobicContact CB-CB 4.46Å; P114-N117 WeakPolarHBondContact O-CB 3.31Å; P114-N117 PolarHBondContact O-N 3Å; K115-N117 PolarHBondContact O-N 3.46Å; N117-E119 VanDerWaalsContact C-N 3.33Å; N117-K120 PolarHBondContact O-N 3.06Å; N117-M121 WeakPolarHBondContact O-CB 3.45Å; N117-M121 PolarHBondContact O-N 3.3Å
118	R	95.9	Very high	95.7	Very high	32 Å²	32	39.2 Å²	39.2	12%	0.121	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-42.8	175.5	-163.6	-175.7	-62.2	168.7	0.3	111.3	E109 P114 K115 T122 V136 V372 C376	E109-R118 VanDerWaalsContact CD-NE 3.27Å; E109-R118 IonicContact OE1-CZ 3.89Å; E109-R118 IonicContact OE1-NE 3.45Å; E109-R118 PolarHBondContact OE1-NE 2.84Å; E109-R118 IonicContact OE1-NH2 3.39Å; E109-R118 PolarHBondContact OE1-NH2 2.84Å; E109-R118 WeakPolarHBondContact OE2-CG 3.4Å; E109-R118 IonicContact OE2-CZ 3.78Å; E109-R118 IonicContact OE2-NE 3.06Å; E109-R118 PolarHBondContact OE2-NE 2.81Å; P114-R118 PolarHBondContact O-N 2.93Å; K115-R118 WeakPolarHBondContact O-CB 3.36Å; K115-R118 PolarHBondContact O-N 2.88Å; R118-T122 WeakPolarHBondContact O-CB 3.17Å; R118-T122 PolarHBondContact O-N 3.34Å; R118-T122 PolarHBondContact O-OG1 3.45Å; R118-V136 HydrophobicContact CG-CB 4.43Å; R118-V136 HydrophobicContact CG-CG1 4.21Å; R118-V136 HydrophobicContact CG-CG2 4.41Å; R118-V372 HydrophobicContact CB-CG1 4.4Å; R118-V372 HydrophobicContact CG-CB 4.48Å; R118-V372 HydrophobicContact CG-CG1 3.83Å; R118-V372 HydrophobicContact CG-CG2 3.79Å; R118-C376 PolarHBondContact NH1-O 3.45Å
119	E	97.7	Very high	95.7	Very high	63 Å²	63	39.6 Å²	39.6	29%	0.294	21%	0.205	S	C	.	.	H	α-helix	trans	-62.2	-43.7	172.9	-70.3	178.5	162.5	0	0	111.7	K115 N117 M121 T122 Q123 P369 V372 H373	K115-E119 PolarHBondContact O-N 3.48Å; N117-E119 VanDerWaalsContact C-N 3.33Å; E119-M121 PolarHBondContact O-N 2.79Å; E119-T122 WeakPolarHBondContact O-CB 3.34Å; E119-T122 PolarHBondContact O-N 2.92Å; E119-Q123 WeakPolarHBondContact O-CB 3.5Å; E119-Q123 PolarHBondContact O-N 3.19Å; E119-P369 HydrophobicContact CB-CB 3.77Å; E119-P369 HydrophobicContact CG-CB 4.09Å; E119-V372 HydrophobicContact CG-CG1 4.39Å; E119-H373 WeakPolarHBondContact CG-NE2 3.42Å; E119-H373 IonicContact OE1-CD2 2.79Å; E119-H373 PolarHBondContact OE1-CD2 3.33Å; E119-H373 IonicContact OE1-NE2 2.9Å; E119-H373 PolarHBondContact OE1-NE2 3.35Å
120	K	98	Very high	95.9	Very high	75 Å²	75	43.6 Å²	43.6	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-66.2	-39.3	179.9	-173.9	59.8	-178.3	174.3	0	112.9	W81 A116 N117 T122 Q123 I124	W81-K120 HydrophobicContact CD2-CB 4.36Å; W81-K120 HydrophobicContact CD2-CG 3.52Å; W81-K120 HydrophobicContact CE3-CG 3.8Å; W81-K120 HydrophobicContact CG-CG 4.04Å; W81-K120 HydrophobicContact CH2-CB 3.87Å; W81-K120 HydrophobicContact CH2-CG 4.06Å; W81-K120 HydrophobicContact CZ2-CB 3.72Å; W81-K120 HydrophobicContact CZ2-CG 3.82Å; W81-K120 HydrophobicContact CZ3-CB 4.24Å; W81-K120 HydrophobicContact CZ3-CG 4.03Å; A116-K120 VanDerWaalsContact O-CB 3.3Å; A116-K120 WeakPolarHBondContact O-CB 3.44Å; A116-K120 PolarHBondContact O-N 2.93Å; N117-K120 PolarHBondContact O-N 3.06Å; K120-T122 VanDerWaalsContact C-N 3.33Å; K120-Q123 WeakPolarHBondContact O-CB 3.44Å; K120-Q123 PolarHBondContact O-N 3.36Å; K120-I124 HydrophobicContact CD-CD1 4.48Å; K120-I124 HydrophobicContact CG-CD1 4.22Å; K120-I124 WeakPolarHBondContact O-CG1 3.48Å; K120-I124 PolarHBondContact O-N 2.9Å
121	M	97.1	Very high	96.1	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.015	23%	0.226	C	C	.	.	H	α-helix	trans	-60.2	-45.4	171.7	-179.8	-175.6	-58.6	0	0	110.9	I78 W81 W88 L107 N117 E119 Q123 I124 M125 V136	I78-M121 HydrophobicContact CD1-CE 3.73Å; W81-M121 HydrophobicContact CH2-CB 4.11Å; W81-M121 HydrophobicContact CZ3-CB 4.05Å; W88-M121 HydrophobicContact CH2-CB 4.31Å; W88-M121 HydrophobicContact CH2-CE 4.44Å; W88-M121 HydrophobicContact CH2-CG 3.76Å; W88-M121 HydrophobicContact CZ2-CE 4.24Å; W88-M121 HydrophobicContact CZ2-CG 4.02Å; W88-M121 HydrophobicContact CZ2-SD 4.44Å; L107-M121 HydrophobicContact CB-SD 3.85Å; L107-M121 HydrophobicContact CD1-CG 3.95Å; L107-M121 HydrophobicContact CD1-SD 3.88Å; L107-M121 HydrophobicContact CG-SD 4.33Å; N117-M121 WeakPolarHBondContact O-CB 3.45Å; N117-M121 PolarHBondContact O-N 3.3Å; E119-M121 PolarHBondContact O-N 2.79Å; M121-Q123 PolarHBondContact O-N 2.62Å; M121-I124 PolarHBondContact O-N 2.69Å; M121-M125 WeakPolarHBondContact O-CG 3.09Å; M121-M125 PolarHBondContact O-N 2.88Å; M121-M125 VanDerWaalsContact O-N 3.08Å; M121-V136 HydrophobicContact SD-CG1 4.48Å; M121-V136 HydrophobicContact SD-CG2 4.14Å
122	T	97.9	Very high	96.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-45.5	177.5	-55.5	0	0	0	0	111.3	R118 E119 K120 I124 M125 F126 M134 Y364 V372	R118-T122 WeakPolarHBondContact O-CB 3.17Å; R118-T122 PolarHBondContact O-N 3.34Å; R118-T122 PolarHBondContact O-OG1 3.45Å; E119-T122 WeakPolarHBondContact O-CB 3.34Å; E119-T122 PolarHBondContact O-N 2.92Å; K120-T122 VanDerWaalsContact C-N 3.33Å; T122-I124 PolarHBondContact O-N 2.7Å; T122-M125 PolarHBondContact O-N 3.1Å; T122-F126 HydrophobicContact CG2-CD2 3.76Å; T122-F126 HydrophobicContact CG2-CE2 3.81Å; T122-F126 WeakPolarHBondContact O-CD2 3.49Å; T122-F126 PolarHBondContact O-N 3.22Å; T122-F126 VanDerWaalsContact O-N 3.13Å; T122-M134 HydrophobicContact CG2-CE 4.38Å; T122-M134 HydrophobicContact CG2-SD 3.9Å; T122-Y364 HydrophobicContact CG2-CD2 3.88Å; T122-Y364 HydrophobicContact CG2-CE2 3.97Å; T122-V372 HydrophobicContact CG2-CB 4.46Å
123	Q	98.3	Very high	97	Very high	57 Å²	57	41.7 Å²	41.7	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-56.8	-51.3	176.3	-171.7	-167.9	5.8	0	0	111.5	E119 K120 M121 M125 F126 E127 P369	E119-Q123 WeakPolarHBondContact O-CB 3.5Å; E119-Q123 PolarHBondContact O-N 3.19Å; K120-Q123 WeakPolarHBondContact O-CB 3.44Å; K120-Q123 PolarHBondContact O-N 3.36Å; M121-Q123 PolarHBondContact O-N 2.62Å; Q123-M125 VanDerWaalsContact C-N 3.32Å; Q123-M125 PolarHBondContact O-N 3.09Å; Q123-F126 PolarHBondContact O-N 3.28Å; Q123-E127 HydrophobicContact CG-CG 4.13Å; Q123-E127 WeakPolarHBondContact CG-OE1 3.4Å; Q123-E127 VanDerWaalsContact CG-OE2 3.23Å; Q123-E127 WeakPolarHBondContact CG-OE2 3.29Å; Q123-E127 PolarHBondContact NE2-OE2 3.14Å; Q123-E127 VanDerWaalsContact O-CB 3.24Å; Q123-E127 WeakPolarHBondContact O-CB 3.08Å; Q123-E127 WeakPolarHBondContact O-CG 3.33Å; Q123-E127 PolarHBondContact O-N 3.21Å; Q123-P369 HydrophobicContact CB-CG 4.4Å
124	I	98.4	Very high	97.3	Very high	6 Å²	6	41 Å²	41	3%	0.031	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-41.5	-177.6	-69.4	165.4	0	0	0	111.1	W81 E85 W88 K120 M121 T122 T128 F129	W81-I124 HydrophobicContact CB-CD1 4.39Å; W81-I124 HydrophobicContact CD2-CD1 4.21Å; W81-I124 HydrophobicContact CE3-CD1 3.42Å; W81-I124 VanDerWaalsContact CE3-CD1 3.42Å; W81-I124 HydrophobicContact CZ3-CD1 4.05Å; E85-I124 HydrophobicContact CG-CG2 4.36Å; W88-I124 HydrophobicContact CE3-CG2 4.09Å; W88-I124 HydrophobicContact CZ3-CB 4.42Å; W88-I124 HydrophobicContact CZ3-CD1 4.19Å; W88-I124 HydrophobicContact CZ3-CG2 4.01Å; K120-I124 HydrophobicContact CD-CD1 4.48Å; K120-I124 HydrophobicContact CG-CD1 4.22Å; K120-I124 WeakPolarHBondContact O-CG1 3.48Å; K120-I124 PolarHBondContact O-N 2.9Å; M121-I124 PolarHBondContact O-N 2.69Å; T122-I124 PolarHBondContact O-N 2.7Å; I124-T128 WeakPolarHBondContact O-CA 3.43Å; I124-T128 WeakPolarHBondContact O-CB 3.49Å; I124-T128 PolarHBondContact O-N 3.48Å; I124-F129 HydrophobicContact CG2-CD2 3.88Å; I124-F129 HydrophobicContact CG2-CE2 3.7Å; I124-F129 PolarHBondContact O-N 3.05Å; I124-F129 VanDerWaalsContact O-N 3.11Å
125	M	98.5	Very high	97.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-43.2	-179.9	-72.4	-64.2	161.6	0	0	112.5	W88 F92 L107 M121 T122 Q123 F129 N130 V131 M134	W88-M125 HydrophobicContact CB-CE 4.21Å; W88-M125 HydrophobicContact CD2-CE 3.29Å; W88-M125 VanDerWaalsContact CE2-CE 3.48Å; W88-M125 HydrophobicContact CE3-CE 3.65Å; W88-M125 HydrophobicContact CG-CE 3.56Å; W88-M125 HydrophobicContact CH2-CE 4.31Å; W88-M125 HydrophobicContact CZ2-CE 4.01Å; W88-M125 HydrophobicContact CZ3-CE 4.14Å; F92-M125 HydrophobicContact CE2-CE 4.2Å; F92-M125 HydrophobicContact CE2-SD 4.17Å; F92-M125 HydrophobicContact CZ-CE 4.19Å; F92-M125 HydrophobicContact CZ-SD 4.24Å; L107-M125 HydrophobicContact CD1-CE 3.59Å; L107-M125 HydrophobicContact CD1-CG 3.5Å; L107-M125 VanDerWaalsContact CD1-CG 3.5Å; L107-M125 HydrophobicContact CD1-SD 3.87Å; L107-M125 HydrophobicContact CD2-CE 3.85Å; L107-M125 HydrophobicContact CG-CE 4.32Å; M121-M125 WeakPolarHBondContact O-CG 3.09Å; M121-M125 PolarHBondContact O-N 2.88Å; M121-M125 VanDerWaalsContact O-N 3.08Å; T122-M125 PolarHBondContact O-N 3.1Å; Q123-M125 VanDerWaalsContact C-N 3.32Å; Q123-M125 PolarHBondContact O-N 3.09Å; M125-F129 HydrophobicContact CE-CD2 4.37Å; M125-F129 CarbonylContact O-C 3.49Å; M125-F129 WeakPolarHBondContact O-CB 3.34Å; M125-F129 HydrophobicContact SD-CD2 3.99Å; M125-N130 PolarHBondContact O-N 2.99Å; M125-V131 HydrophobicContact CB-CG2 3.94Å; M125-V131 PolarHBondContact O-N 2.93Å; M125-V131 VanDerWaalsContact O-N 3.13Å; M125-V131 HydrophobicContact SD-CG1 4.4Å; M125-M134 HydrophobicContact CB-CE 4.36Å; M125-M134 HydrophobicContact CB-SD 3.49Å; M125-M134 WeakPolarHBondContact CB-SD 3.38Å; M125-M134 HydrophobicContact CG-CE 4.3Å; M125-M134 HydrophobicContact CG-SD 4.06Å
126	F	98.6	Very high	97.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-83	-34.5	-179.6	-75.4	-58.6	0	0	0	114.6	T122 Q123 N130 V131 M134 I359 K361 Y364	T122-F126 HydrophobicContact CG2-CD2 3.76Å; T122-F126 HydrophobicContact CG2-CE2 3.81Å; T122-F126 WeakPolarHBondContact O-CD2 3.49Å; T122-F126 PolarHBondContact O-N 3.22Å; T122-F126 VanDerWaalsContact O-N 3.13Å; Q123-F126 PolarHBondContact O-N 3.28Å; F126-N130 WeakPolarHBondContact O-CA 3.43Å; F126-N130 PolarHBondContact O-OD1 2.92Å; F126-V131 HydrophobicContact CD1-CG2 3.86Å; F126-V131 VanDerWaalsContact CD1-O 3.3Å; F126-V131 WeakPolarHBondContact CD1-O 3.22Å; F126-V131 HydrophobicContact CE1-CG2 4Å; F126-V131 WeakPolarHBondContact CE1-O 3.15Å; F126-M134 HydrophobicContact CD2-CG 4.3Å; F126-M134 HydrophobicContact CD2-SD 3.91Å; F126-M134 HydrophobicContact CE1-CG 4.32Å; F126-M134 HydrophobicContact CE2-CG 3.52Å; F126-M134 HydrophobicContact CE2-SD 3.67Å; F126-M134 HydrophobicContact CZ-CG 3.56Å; F126-M134 HydrophobicContact CZ-SD 4.25Å; F126-I359 HydrophobicContact CE2-CG2 3.89Å; F126-I359 HydrophobicContact CZ-CB 4.29Å; F126-I359 HydrophobicContact CZ-CG2 3.86Å; F126-I359 WeakPolarHBondContact CZ-O 3.36Å; F126-K361 HydrophobicContact CB-CD 4.07Å; F126-K361 HydrophobicContact CD1-CB 4.3Å; F126-K361 HydrophobicContact CD1-CD 3.46Å; F126-K361 VanDerWaalsContact CD1-CD 3.46Å; F126-K361 HydrophobicContact CD1-CG 4.5Å; F126-K361 HydrophobicContact CE1-CB 4.2Å; F126-K361 HydrophobicContact CE1-CD 4.19Å; F126-K361 HydrophobicContact CG-CD 4.1Å; F126-K361 WeakPolarHBondContact O-CE 3.36Å; F126-Y364 HydrophobicContact CB-CD1 3.79Å; F126-Y364 HydrophobicContact CB-CD2 4.34Å; F126-Y364 HydrophobicContact CB-CE1 3.85Å; F126-Y364 HydrophobicContact CB-CE2 4.37Å; F126-Y364 HydrophobicContact CB-CG 4.04Å; F126-Y364 HydrophobicContact CD2-CD1 4.04Å; F126-Y364 AromaticContact CD2-CD2 3.29Å; F126-Y364 HydrophobicContact CD2-CD2 3.29Å; F126-Y364 AromaticContact CD2-CE2 3.86Å; F126-Y364 HydrophobicContact CD2-CE2 3.86Å; F126-Y364 AromaticContact CD2-CG 3.38Å; F126-Y364 HydrophobicContact CD2-CG 3.38Å; F126-Y364 AromaticContact CE2-CD2 3.78Å; F126-Y364 HydrophobicContact CE2-CD2 3.78Å; F126-Y364 AromaticContact CE2-CG 3.84Å; F126-Y364 HydrophobicContact CE2-CG 3.84Å; F126-Y364 HydrophobicContact CG-CD1 4.01Å; F126-Y364 HydrophobicContact CG-CD2 4.09Å; F126-Y364 HydrophobicContact CG-CE1 4.5Å; F126-Y364 AromaticContact CG-CG 3.79Å; F126-Y364 HydrophobicContact CG-CG 3.79Å
127	E	98.4	Very high	97.7	Very high	100 Å²	100	29.6 Å²	29.6	47%	0.467	15%	0.151	S	C	.	.	H	α-helix	trans	-94.6	-33.4	-174	-63.1	-179	-173.7	0	0	113.2	Q123 Y364	Q123-E127 HydrophobicContact CG-CG 4.13Å; Q123-E127 WeakPolarHBondContact CG-OE1 3.4Å; Q123-E127 VanDerWaalsContact CG-OE2 3.23Å; Q123-E127 WeakPolarHBondContact CG-OE2 3.29Å; Q123-E127 PolarHBondContact NE2-OE2 3.14Å; Q123-E127 VanDerWaalsContact O-CB 3.24Å; Q123-E127 WeakPolarHBondContact O-CB 3.08Å; Q123-E127 WeakPolarHBondContact O-CG 3.33Å; Q123-E127 PolarHBondContact O-N 3.21Å; E127-Y364 HydrophobicContact CG-CE1 4.12Å; E127-Y364 PolarHBondContact OE1-OH 2.96Å
128	T	98.2	Very high	97.7	Very high	66 Å²	66	29 Å²	29	41%	0.405	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-49.3	179.3	-52.8	0	0	0	0	111.3	E85 I124	E85-T128 HydrophobicContact CG-CG2 4.35Å; I124-T128 WeakPolarHBondContact O-CA 3.43Å; I124-T128 WeakPolarHBondContact O-CB 3.49Å; I124-T128 PolarHBondContact O-N 3.48Å
129	F	98.2	Very high	97.7	Very high	7 Å²	7	28.3 Å²	28.3	3%	0.031	15%	0.146	C	C	.	.	S	Bend	trans	-91.7	-7.2	-176.9	-66.9	-69.8	0	0	0	114.1	E85 W88 H89 F92 Y93 P100 I124 M125 V131	E85-F129 HydrophobicContact CG-CE2 4.06Å; E85-F129 HydrophobicContact CG-CZ 3.94Å; W88-F129 HydrophobicContact CB-CE2 3.76Å; W88-F129 HydrophobicContact CB-CZ 3.69Å; W88-F129 HydrophobicContact CE3-CE2 4.18Å; H89-F129 HydrophobicContact CB-CE1 4.1Å; H89-F129 HydrophobicContact CB-CZ 4.24Å; F92-F129 AromaticContact CD2-CD1 3.96Å; F92-F129 HydrophobicContact CD2-CD1 3.96Å; F92-F129 HydrophobicContact CD2-CE1 4.07Å; F92-F129 HydrophobicContact CD2-CG 4.38Å; F92-F129 HydrophobicContact CE2-CD1 4.23Å; F92-F129 HydrophobicContact CE2-CD2 4.39Å; F92-F129 HydrophobicContact CE2-CE1 4.45Å; F92-F129 HydrophobicContact CE2-CG 4.2Å; Y93-F129 HydrophobicContact CE2-CD1 4.41Å; Y93-F129 HydrophobicContact CE2-CE1 4.34Å; P100-F129 HydrophobicContact CB-CB 4.26Å; P100-F129 HydrophobicContact CG-CB 4.2Å; P100-F129 HydrophobicContact CG-CD1 4.03Å; I124-F129 HydrophobicContact CG2-CD2 3.88Å; I124-F129 HydrophobicContact CG2-CE2 3.7Å; I124-F129 PolarHBondContact O-N 3.05Å; I124-F129 VanDerWaalsContact O-N 3.11Å; M125-F129 HydrophobicContact CE-CD2 4.37Å; M125-F129 CarbonylContact O-C 3.49Å; M125-F129 WeakPolarHBondContact O-CB 3.34Å; M125-F129 HydrophobicContact SD-CD2 3.99Å; F129-V131 HydrophobicContact CB-CG1 4.12Å; F129-V131 PolarHBondContact O-N 3.34Å; F129-V131 VanDerWaalsContact O-N 3.12Å
130	N	98.1	Very high	97.6	Very high	93 Å²	93	25.3 Å²	25.3	50%	0.497	13%	0.132	S	C	.	.			trans	50.3	35.3	178.2	-64	-41	0	0	0	114.2	E101 M125 F126	E101-N130 WeakPolarHBondContact CA-O 3.48Å; E101-N130 HydrophobicContact CB-CB 4.21Å; M125-N130 PolarHBondContact O-N 2.99Å; F126-N130 WeakPolarHBondContact O-CA 3.43Å; F126-N130 PolarHBondContact O-OD1 2.92Å
131	V	98.2	Very high	97.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.121	C	C	.	.			trans	-60.2	141	179.9	-57.4	0	0	0	0	110.4	P100 M125 F126 F129 A133 M134	P100-V131 HydrophobicContact CB-CG1 4.19Å; M125-V131 HydrophobicContact CB-CG2 3.94Å; M125-V131 PolarHBondContact O-N 2.93Å; M125-V131 VanDerWaalsContact O-N 3.13Å; M125-V131 HydrophobicContact SD-CG1 4.4Å; F126-V131 HydrophobicContact CD1-CG2 3.86Å; F126-V131 VanDerWaalsContact CD1-O 3.3Å; F126-V131 WeakPolarHBondContact CD1-O 3.22Å; F126-V131 HydrophobicContact CE1-CG2 4Å; F126-V131 WeakPolarHBondContact CE1-O 3.15Å; F129-V131 HydrophobicContact CB-CG1 4.12Å; F129-V131 PolarHBondContact O-N 3.34Å; F129-V131 VanDerWaalsContact O-N 3.12Å; V131-A133 VanDerWaalsContact C-N 3.3Å; V131-A133 PolarHBondContact O-N 3.08Å; V131-M134 HydrophobicContact CG2-CB 4.11Å
132	P	97.4	Very high	97.5	Very high	49 Å²	49	22.4 Å²	22.4	32%	0.318	12%	0.121	S	C	.	.	S	Bend	trans	-69.6	-32.2	-178.2	27.2	-33.9	0	0	0	111.7	P100 E101 H103 K361	P100-P132 WeakPolarHBondContact O-CD 3.46Å; E101-P132 WeakPolarHBondContact O-CD 3.39Å; H103-P132 WeakPolarHBondContact O-CD 3.45Å; P132-K361 PolarHBondContact O-N 2.82Å
133	A	97.6	Very high	97.4	Very high	13 Å²	13	22.4 Å²	22.4	11%	0.107	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	156.8	176	0	0	0	0	0	111.3	P104 T105 V131 W358 I359	P104-A133 CarbonylContact C-O 3.58Å; P104-A133 VanDerWaalsContact CA-O 3.29Å; P104-A133 WeakPolarHBondContact CA-O 3.49Å; P104-A133 HydrophobicContact CB-CB 4.27Å; T105-A133 PolarHBondContact N-O 2.84Å; V131-A133 VanDerWaalsContact C-N 3.3Å; V131-A133 PolarHBondContact O-N 3.08Å; A133-W358 HydrophobicContact CB-CB 4.11Å; A133-W358 HydrophobicContact CB-CE3 4.49Å; A133-W358 HydrophobicContact CB-CG 4.46Å; A133-I359 CarbonylContact C-O 3.6Å; A133-I359 WeakPolarHBondContact CA-O 3.44Å; A133-I359 WeakPolarHBondContact CB-O 3.36Å
134	M	97.9	Very high	97.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	163.6	174.5	67.1	172.6	-76.9	0	0	113.5	T105 L107 T122 M125 F126 V131 V136 I359	T105-M134 WeakPolarHBondContact O-CA 3.45Å; T105-M134 VanDerWaalsContact O-CB 3.28Å; T105-M134 WeakPolarHBondContact O-CB 3.44Å; L107-M134 HydrophobicContact CD1-CE 3.92Å; T122-M134 HydrophobicContact CG2-CE 4.38Å; T122-M134 HydrophobicContact CG2-SD 3.9Å; M125-M134 HydrophobicContact CB-CE 4.36Å; M125-M134 HydrophobicContact CB-SD 3.49Å; M125-M134 WeakPolarHBondContact CB-SD 3.38Å; M125-M134 HydrophobicContact CG-CE 4.3Å; M125-M134 HydrophobicContact CG-SD 4.06Å; F126-M134 HydrophobicContact CD2-CG 4.3Å; F126-M134 HydrophobicContact CD2-SD 3.91Å; F126-M134 HydrophobicContact CE1-CG 4.32Å; F126-M134 HydrophobicContact CE2-CG 3.52Å; F126-M134 HydrophobicContact CE2-SD 3.67Å; F126-M134 HydrophobicContact CZ-CG 3.56Å; F126-M134 HydrophobicContact CZ-SD 4.25Å; V131-M134 HydrophobicContact CG2-CB 4.11Å; M134-V136 HydrophobicContact CE-CG2 3.56Å; M134-I359 PolarHBondContact N-O 3.32Å; M134-I359 WeakPolarHBondContact O-CB 3.33Å; M134-I359 PolarHBondContact O-N 2.88Å
135	Y	97.9	Very high	97	Very high	21 Å²	21	23.2 Å²	23.2	8%	0.082	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	144.1	172.5	-172.9	-93.3	0	0	0	109.7	T105 L106 L107 A137 F354 M357 C376	T105-Y135 PolarHBondContact O-N 3.12Å; T105-Y135 VanDerWaalsContact O-N 3.12Å; L106-Y135 WeakPolarHBondContact CA-O 3.4Å; L106-Y135 HydrophobicContact CD1-CD1 4.42Å; L107-Y135 PolarHBondContact N-O 3.26Å; Y135-A137 HydrophobicContact CD1-CB 4.08Å; Y135-A137 HydrophobicContact CE1-CB 3.87Å; Y135-F354 HydrophobicContact CD1-CE2 4.11Å; Y135-F354 AromaticContact CD1-CZ 3.53Å; Y135-F354 HydrophobicContact CD1-CZ 3.53Å; Y135-F354 HydrophobicContact CD2-CE2 4.27Å; Y135-F354 AromaticContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CE1-CE2 4.09Å; Y135-F354 AromaticContact CE1-CZ 3.99Å; Y135-F354 HydrophobicContact CE1-CZ 3.99Å; Y135-F354 HydrophobicContact CE2-CE2 4.26Å; Y135-F354 HydrophobicContact CE2-CZ 4.33Å; Y135-F354 HydrophobicContact CG-CE1 4.37Å; Y135-F354 HydrophobicContact CG-CE2 4.19Å; Y135-F354 AromaticContact CG-CZ 3.47Å; Y135-F354 HydrophobicContact CG-CZ 3.47Å; Y135-F354 VanDerWaalsContact CG-CZ 3.47Å; Y135-M357 HydrophobicContact CD2-CB 4.36Å; Y135-M357 WeakPolarHBondContact CD2-O 3.47Å; Y135-M357 HydrophobicContact CE2-CB 4.17Å; Y135-M357 HydrophobicContact CE2-CE 4.28Å; Y135-C376 WeakPolarHBondContact CD2-SG 3.47Å; Y135-C376 HydrophobicContact CE2-CB 4.22Å; Y135-C376 WeakPolarHBondContact CE2-SG 3.44Å
136	V	97.5	Very high	96.9	Very high	4 Å²	4	24.5 Å²	24.5	2%	0.024	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	120.3	175.2	-177.4	0	0	0	0	109.3	L107 E109 R118 M121 M134 V372 C376	L107-V136 CarbonylContact O-C 3.55Å; L107-V136 WeakPolarHBondContact O-CA 3.4Å; E109-V136 HydrophobicContact CB-CG1 4.07Å; E109-V136 HydrophobicContact CG-CG1 3.6Å; R118-V136 HydrophobicContact CG-CB 4.43Å; R118-V136 HydrophobicContact CG-CG1 4.21Å; R118-V136 HydrophobicContact CG-CG2 4.41Å; M121-V136 HydrophobicContact SD-CG1 4.48Å; M121-V136 HydrophobicContact SD-CG2 4.14Å; M134-V136 HydrophobicContact CE-CG2 3.56Å; V136-V372 HydrophobicContact CB-CG2 4.3Å; V136-V372 HydrophobicContact CG2-CG2 4.02Å; V136-C376 HydrophobicContact CB-CB 4.48Å; V136-C376 PolarHBondContact N-SG 3.46Å; V136-C376 VanDerWaalsContact N-SG 3.38Å; V136-C376 VanDerWaalsContact O-CB 3.28Å; V136-C376 WeakPolarHBondContact O-CB 3.28Å
137	A	96.3	Very high	96.6	Very high	6 Å²	6	25.7 Å²	25.7	5%	0.05	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.2	-178.8	0	0	0	0	0	112.2	L106 L107 T108 E109 Y135 L142	L106-A137 HydrophobicContact CD2-CB 4.22Å; L107-A137 PolarHBondContact O-N 3.31Å; T108-A137 VanDerWaalsContact CA-O 3.3Å; T108-A137 WeakPolarHBondContact CA-O 3.4Å; E109-A137 PolarHBondContact N-O 3.46Å; Y135-A137 HydrophobicContact CD1-CB 4.08Å; Y135-A137 HydrophobicContact CE1-CB 3.87Å; A137-L142 HydrophobicContact CB-CD1 3.74Å; A137-L142 HydrophobicContact CB-CD2 3.8Å; A137-L142 HydrophobicContact CB-CG 3.83Å
138	I	95	Very high	96.4	Very high	15 Å²	15	24.3 Å²	24.3	8%	0.077	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127.7	173.2	-61.1	173.3	0	0	0	109.2	P111 A140 V141 L142 A172 F377	P111-I138 HydrophobicContact CB-CG2 4.44Å; P111-I138 HydrophobicContact CG-CG2 4.05Å; I138-A140 VanDerWaalsContact C-N 3.34Å; I138-A140 PolarHBondContact O-N 3.03Å; I138-V141 HydrophobicContact CB-CB 4.41Å; I138-V141 HydrophobicContact CB-CG2 4.04Å; I138-V141 HydrophobicContact CG2-CG2 4.28Å; I138-V141 PolarHBondContact O-N 3.47Å; I138-V141 VanDerWaalsContact O-N 3.09Å; I138-L142 PolarHBondContact O-N 3.24Å; I138-A172 HydrophobicContact CD1-CB 4.3Å; I138-F377 WeakPolarHBondContact CD1-OXT 3.05Å
139	Q	95.9	Very high	96.2	Very high	17 Å²	17	24.1 Å²	24.1	8%	0.079	15%	0.145	C	C	.	.	H	α-helix	trans	-50.5	-48.9	-176.2	-70.9	167.6	-15.6	0	0	113.4	N14 T108 E109 V141 L142 S143 V341	N14-Q139 PolarHBondContact O-NE2 2.72Å; T108-Q139 PolarHBondContact OG1-NE2 2.95Å; E109-Q139 VanDerWaalsContact O-CG 3.29Å; E109-Q139 WeakPolarHBondContact O-CG 3.32Å; E109-Q139 PolarHBondContact O-N 2.83Å; E109-Q139 VanDerWaalsContact O-N 3.16Å; Q139-V141 VanDerWaalsContact C-N 3.35Å; Q139-V141 PolarHBondContact O-N 2.92Å; Q139-L142 WeakPolarHBondContact O-CB 3.37Å; Q139-L142 PolarHBondContact O-N 3.09Å; Q139-S143 PolarHBondContact O-N 3.39Å; Q139-V341 HydrophobicContact CB-CG1 3.95Å; Q139-V341 HydrophobicContact CB-CG2 4Å; Q139-V341 HydrophobicContact CG-CG1 3.87Å
140	A	95.3	Very high	96	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.7	-36.6	-178.7	0	0	0	0	0	113.7	I138 L142 S143 L144 V154 V165	I138-A140 VanDerWaalsContact C-N 3.34Å; I138-A140 PolarHBondContact O-N 3.03Å; A140-L142 VanDerWaalsContact C-N 3.34Å; A140-S143 PolarHBondContact O-N 3.15Å; A140-L144 PolarHBondContact O-N 2.76Å; A140-V154 HydrophobicContact CB-CB 3.99Å; A140-V154 HydrophobicContact CB-CG1 4.15Å; A140-V154 HydrophobicContact CB-CG2 4.47Å; A140-V154 WeakPolarHBondContact O-CG2 3.43Å; A140-V165 HydrophobicContact CB-CB 3.5Å; A140-V165 VanDerWaalsContact CB-CB 3.5Å; A140-V165 HydrophobicContact CB-CG1 3.91Å; A140-V165 HydrophobicContact CB-CG2 3.53Å
141	V	95.8	Very high	96	Very high	16 Å²	16	24 Å²	24	10%	0.097	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-42.9	178	175.3	0	0	0	0	109.8	I138 Q139 L144 Y145 V167 A172	I138-V141 HydrophobicContact CB-CB 4.41Å; I138-V141 HydrophobicContact CB-CG2 4.04Å; I138-V141 HydrophobicContact CG2-CG2 4.28Å; I138-V141 PolarHBondContact O-N 3.47Å; I138-V141 VanDerWaalsContact O-N 3.09Å; Q139-V141 VanDerWaalsContact C-N 3.35Å; Q139-V141 PolarHBondContact O-N 2.92Å; V141-L144 PolarHBondContact O-N 3.32Å; V141-Y145 HydrophobicContact CG1-CD2 3.83Å; V141-Y145 HydrophobicContact CG1-CE2 3.39Å; V141-Y145 VanDerWaalsContact O-CD2 3.28Å; V141-Y145 WeakPolarHBondContact O-CD2 3.08Å; V141-Y145 PolarHBondContact O-N 3.39Å; V141-Y145 VanDerWaalsContact O-N 3.07Å; V141-V167 HydrophobicContact CG2-CG2 4.09Å; V141-A172 HydrophobicContact CG2-CB 3.99Å
142	L	97	Very high	96	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-44.3	174.6	-61.4	-177.5	0	0	0	112.1	L106 T108 A137 I138 Q139 A140 L144 Y145 A146 V341 G344 L348	L106-L142 HydrophobicContact CD2-CD1 4.16Å; T108-L142 HydrophobicContact CG2-CD1 3.67Å; A137-L142 HydrophobicContact CB-CD1 3.74Å; A137-L142 HydrophobicContact CB-CD2 3.8Å; A137-L142 HydrophobicContact CB-CG 3.83Å; I138-L142 PolarHBondContact O-N 3.24Å; Q139-L142 WeakPolarHBondContact O-CB 3.37Å; Q139-L142 PolarHBondContact O-N 3.09Å; A140-L142 VanDerWaalsContact C-N 3.34Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.05Å; L142-Y145 PolarHBondContact O-N 3.45Å; L142-Y145 VanDerWaalsContact O-N 3.16Å; L142-A146 PolarHBondContact O-N 2.89Å; L142-V341 WeakPolarHBondContact CB-O 3.39Å; L142-V341 HydrophobicContact CD1-CG1 4.19Å; L142-V341 WeakPolarHBondContact CD1-O 3.23Å; L142-G344 WeakPolarHBondContact O-CA 3.44Å; L142-L348 HydrophobicContact CD2-CB 4.33Å; L142-L348 HydrophobicContact CD2-CD2 3.64Å
143	S	96.9	Very high	96	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.6	-35.1	177	-72	0	0	0	0	113.2	Q139 A140 S147 S302 V341	Q139-S143 PolarHBondContact O-N 3.39Å; A140-S143 PolarHBondContact O-N 3.15Å; S143-S147 PolarHBondContact O-N 3.03Å; S143-S302 WeakPolarHBondContact OG-CB 3.12Å; S143-S302 PolarHBondContact OG-OG 3.15Å; S143-V341 WeakPolarHBondContact OG-CG2 3.2Å; S143-V341 PolarHBondContact OG-N 2.94Å
144	L	95.7	Very high	96.1	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-67.6	-44.9	174.8	-167.1	63.2	0	0	0	111.5	A140 V141 L142 A146 S147 R149 V154 V167 V300	A140-L144 PolarHBondContact O-N 2.76Å; V141-L144 PolarHBondContact O-N 3.32Å; L142-L144 VanDerWaalsContact C-N 3.26Å; L142-L144 PolarHBondContact O-N 3.05Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.31Å; L144-S147 WeakPolarHBondContact O-CB 3.39Å; L144-S147 PolarHBondContact O-N 3.27Å; L144-S147 PolarHBondContact O-OG 2.84Å; L144-R149 CarbonylContact C-O 3.56Å; L144-R149 HydrophobicContact CD1-CB 3.8Å; L144-R149 HydrophobicContact CG-CB 3.95Å; L144-R149 PolarHBondContact O-N 2.93Å; L144-V154 HydrophobicContact CB-CG2 3.87Å; L144-V154 HydrophobicContact CD1-CG2 4.11Å; L144-V154 HydrophobicContact CG-CG2 4.47Å; L144-V167 HydrophobicContact CD2-CB 3.57Å; L144-V167 HydrophobicContact CD2-CG1 3.68Å; L144-V167 HydrophobicContact CD2-CG2 4.16Å; L144-V300 HydrophobicContact CD1-CB 4.37Å; L144-V300 HydrophobicContact CD1-CG2 3.66Å
145	Y	92.8	Very high	96.1	Very high	79 Å²	79	21.3 Å²	21.3	31%	0.31	13%	0.13	S	C	.	.	H	α-helix	trans	-60.6	-41.2	176.3	-76.2	-48	0	0	0	112.5	V141 L142 S147 G148 T150 G170	V141-Y145 HydrophobicContact CG1-CD2 3.83Å; V141-Y145 HydrophobicContact CG1-CE2 3.39Å; V141-Y145 VanDerWaalsContact O-CD2 3.28Å; V141-Y145 WeakPolarHBondContact O-CD2 3.08Å; V141-Y145 PolarHBondContact O-N 3.39Å; V141-Y145 VanDerWaalsContact O-N 3.07Å; L142-Y145 PolarHBondContact O-N 3.45Å; L142-Y145 VanDerWaalsContact O-N 3.16Å; Y145-S147 PolarHBondContact O-N 2.59Å; Y145-S147 VanDerWaalsContact O-N 3.13Å; Y145-G148 WeakPolarHBondContact O-CA 3.36Å; Y145-G148 PolarHBondContact O-N 2.88Å; Y145-T150 HydrophobicContact CE1-CG2 4.17Å; Y145-G170 WeakPolarHBondContact OH-CA 3.39Å
146	A	95.2	Very high	96.1	Very high	26 Å²	26	20.9 Å²	20.9	22%	0.215	13%	0.129	C	C	.	.	H	α-helix	trans	-57.6	-28.1	174.6	0	0	0	0	0	112.6	L142 L144 G148 S340 I343	L142-A146 PolarHBondContact O-N 2.89Å; L144-A146 VanDerWaalsContact C-N 3.34Å; L144-A146 PolarHBondContact O-N 3.31Å; A146-G148 VanDerWaalsContact C-N 3.3Å; A146-S340 VanDerWaalsContact CB-O 3.3Å; A146-S340 WeakPolarHBondContact CB-O 3.35Å; A146-I343 HydrophobicContact CB-CB 4.27Å; A146-I343 HydrophobicContact CB-CG2 4.06Å
147	S	93.6	Very high	96.2	Very high	25 Å²	25	20.9 Å²	20.9	18%	0.175	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-0.6	176.2	86.6	0	0	0	0	114.1	S143 L144 Y145 R149	S143-S147 PolarHBondContact O-N 3.03Å; L144-S147 WeakPolarHBondContact O-CB 3.39Å; L144-S147 PolarHBondContact O-N 3.27Å; L144-S147 PolarHBondContact O-OG 2.84Å; Y145-S147 PolarHBondContact O-N 2.59Å; Y145-S147 VanDerWaalsContact O-N 3.13Å; S147-R149 PolarHBondContact O-NH1 3.21Å; S147-R149 PolarHBondContact OG-NH1 2.96Å; S147-R149 VanDerWaalsContact OG-NH1 3.15Å
148	G	93.5	Very high	96.2	Very high	72 Å²	72	21.7 Å²	21.7	74%	0.742	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.1	32.6	-176.4	0	0	0	0	0	113.6	Y145 A146	Y145-G148 WeakPolarHBondContact O-CA 3.36Å; Y145-G148 PolarHBondContact O-N 2.88Å; A146-G148 VanDerWaalsContact C-N 3.3Å
149	R	94.9	Very high	96.3	Very high	62 Å²	62	22.7 Å²	22.7	23%	0.234	14%	0.143	C	C	.	.			trans	-128.2	150.2	-177.7	-68.7	174.7	-178.5	67.1	18.2	111.4	L144 S147 N298	L144-R149 CarbonylContact C-O 3.56Å; L144-R149 HydrophobicContact CD1-CB 3.8Å; L144-R149 HydrophobicContact CG-CB 3.95Å; L144-R149 PolarHBondContact O-N 2.93Å; S147-R149 PolarHBondContact O-NH1 3.21Å; S147-R149 PolarHBondContact OG-NH1 2.96Å; S147-R149 VanDerWaalsContact OG-NH1 3.15Å; R149-N298 VanDerWaalsContact CD-OD1 3.3Å; R149-N298 WeakPolarHBondContact CD-OD1 3.21Å; R149-N298 PolarHBondContact NE-OD1 3.12Å
150	T	93.7	Very high	96.2	Very high	78 Å²	78	21.9 Å²	21.9	48%	0.479	14%	0.14	S	C	.	.	S	Bend	trans	-110.7	-20.6	174.1	52	0	0	0	0	112.3	Y145 E169 G170	Y145-T150 HydrophobicContact CE1-CG2 4.17Å; T150-E169 PolarHBondContact O-N 2.83Å; T150-G170 PolarHBondContact O-N 3.06Å
151	T	97.4	Very high	96.2	Very high	19 Å²	19	22.3 Å²	22.3	12%	0.117	14%	0.142	C	C	.	.	S	Bend	trans	-127.4	133.1	179.3	-62.1	0	0	0	0	110.2	V167 Y168 E169 D294	T151-V167 WeakPolarHBondContact CA-O 3.26Å; T151-Y168 HydrophobicContact CG2-CD2 3.58Å; T151-Y168 HydrophobicContact CG2-CE2 4.12Å; T151-E169 PolarHBondContact OG1-N 3.1Å; T151-D294 HydrophobicContact CG2-CB 3.81Å
152	G	98.2	Very high	96.3	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.8	-179.4	179.4	0	0	0	0	0	111.7	V167 L295 N298	G152-V167 PolarHBondContact N-O 3.31Å; G152-V167 PolarHBondContact O-N 3.4Å; G152-L295 VanDerWaalsContact C-CD2 3.46Å; G152-L295 WeakPolarHBondContact O-CD2 3.27Å; G152-N298 CarbonylContact C-O 3.51Å; G152-N298 VanDerWaalsContact CA-O 3.29Å; G152-N298 WeakPolarHBondContact CA-O 3.42Å
153	I	98.6	Very high	96.4	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.8	172.2	-176.4	168.8	0	0	0	108.9	N164 P166 T280 I284 L295 N298 N299 V300	I153-N164 HydrophobicContact CD1-CB 4.29Å; I153-P166 HydrophobicContact CG1-CB 4.44Å; I153-T280 HydrophobicContact CD1-CG2 3.96Å; I153-T280 HydrophobicContact CG2-CG2 4.44Å; I153-I284 HydrophobicContact CD1-CD1 4.36Å; I153-I284 HydrophobicContact CD1-CG1 3.69Å; I153-I284 HydrophobicContact CG2-CD1 4.14Å; I153-I284 HydrophobicContact CG2-CG1 4.32Å; I153-L295 HydrophobicContact CB-CD2 4.49Å; I153-N298 PolarHBondContact N-O 3.24Å; I153-N299 HydrophobicContact CG2-CB 4.18Å; I153-N299 WeakPolarHBondContact CG2-OD1 3.19Å; I153-N299 CarbonylContact O-C 3.53Å; I153-N299 WeakPolarHBondContact O-CA 3.32Å; I153-V300 PolarHBondContact O-N 3.37Å
154	V	98.6	Very high	96.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.3	177.5	-175.8	0	0	0	0	109.2	A140 L144 D156 N164 V165 V300	A140-V154 HydrophobicContact CB-CB 3.99Å; A140-V154 HydrophobicContact CB-CG1 4.15Å; A140-V154 HydrophobicContact CB-CG2 4.47Å; A140-V154 WeakPolarHBondContact O-CG2 3.43Å; L144-V154 HydrophobicContact CB-CG2 3.87Å; L144-V154 HydrophobicContact CD1-CG2 4.11Å; L144-V154 HydrophobicContact CG-CG2 4.47Å; V154-D156 HydrophobicContact CG1-CB 4.2Å; V154-N164 WeakPolarHBondContact O-CA 3.38Å; V154-V165 PolarHBondContact N-O 3.4Å; V154-V165 PolarHBondContact O-N 3.49Å; V154-V300 CarbonylContact C-O 3.5Å; V154-V300 WeakPolarHBondContact CA-O 3.49Å; V154-V300 HydrophobicContact CG2-CB 4.33Å
155	L	98.6	Very high	96.5	Very high	5 Å²	5	21.5 Å²	21.5	3%	0.026	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	100.9	163.1	173	63.7	0	0	0	107.3	T162 H163 N164 I276 V300 L301 S302 M315	L155-T162 HydrophobicContact CD1-CG2 3.54Å; L155-H163 WeakPolarHBondContact CA-O 3.4Å; L155-N164 WeakPolarHBondContact CD1-OD1 3.18Å; L155-I276 HydrophobicContact CD1-CB 4.27Å; L155-I276 HydrophobicContact CD1-CG2 4.41Å; L155-I276 HydrophobicContact CD2-CB 4.13Å; L155-I276 HydrophobicContact CD2-CD1 4.08Å; L155-V300 PolarHBondContact N-O 3.28Å; L155-L301 HydrophobicContact CB-CD2 3.91Å; L155-L301 HydrophobicContact CD2-CD2 3.85Å; L155-L301 HydrophobicContact CG-CD2 4.26Å; L155-S302 PolarHBondContact O-N 3.43Å; L155-M315 HydrophobicContact CD2-CE 3.65Å; L155-M315 HydrophobicContact CD2-SD 4.23Å
156	D	98	Very high	96.8	Very high	12 Å²	12	17.8 Å²	17.8	6%	0.064	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	114.7	178.6	-166.8	14.9	0	0	0	109.7	V154 T162 H163 S302 G303	V154-D156 HydrophobicContact CG1-CB 4.2Å; D156-T162 CarbonylContact O-C 3.57Å; D156-T162 VanDerWaalsContact O-CA 3.25Å; D156-T162 WeakPolarHBondContact O-CA 3.38Å; D156-H163 PolarHBondContact N-O 2.9Å; D156-H163 PolarHBondContact O-N 2.97Å; D156-S302 WeakPolarHBondContact CA-O 3.1Å; D156-S302 WeakPolarHBondContact OD1-CB 3.4Å; D156-S302 PolarHBondContact OD1-OG 2.88Å; D156-G303 PolarHBondContact OD1-N 3.26Å
157	S	98.3	Very high	96.9	Very high	3 Å²	3	16.6 Å²	16.6	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	104.4	179.5	-168.1	0	0	0	0	110.6	T162 S302 G303 G304 T305	S157-T162 WeakPolarHBondContact CB-OG1 3.29Å; S157-T162 PolarHBondContact OG-OG1 3.36Å; S157-S302 PolarHBondContact N-O 3.25Å; S157-G303 CarbonylContact O-C 3.55Å; S157-G303 WeakPolarHBondContact O-CA 3.41Å; S157-G304 PolarHBondContact O-N 3.34Å; S157-T305 WeakPolarHBondContact O-CB 3.46Å; S157-T305 PolarHBondContact O-N 3.05Å; S157-T305 WeakPolarHBondContact OG-CB 3.19Å; S157-T305 WeakPolarHBondContact OG-CG2 3.46Å
158	G	96.8	Very high	97.1	Very high	24 Å²	24	19.1 Å²	19.1	25%	0.247	12%	0.119	C	C	.	.			trans	-93	-146.1	-177.7	0	0	0	0	0	113.1	V161 A183 G184 T305	G158-V161 PolarHBondContact N-O 2.95Å; G158-A183 WeakPolarHBondContact O-CB 3.4Å; G158-G184 PolarHBondContact O-N 3.21Å; G158-G184 VanDerWaalsContact O-N 3.12Å; G158-T305 WeakPolarHBondContact O-CB 3.29Å; G158-T305 PolarHBondContact O-OG1 2.93Å
159	D	96.6	Very high	97.1	Very high	35 Å²	35	21.8 Å²	21.8	19%	0.187	11%	0.112	C	C	.	.	S	Bend	trans	-85.5	-40.2	175.9	-177.3	60.5	0	0	0	112.1	G17 A183 G184 R185	G17-D159 WeakPolarHBondContact CA-OD2 3.48Å; D159-A183 CarbonylContact O-C 3.4Å; D159-A183 WeakPolarHBondContact O-CB 3.34Å; D159-G184 PolarHBondContact O-N 2.98Å; D159-G184 VanDerWaalsContact O-N 3.17Å; D159-R185 WeakPolarHBondContact O-CB 3.38Å; D159-R185 PolarHBondContact O-N 3.25Å; D159-R185 PolarHBondContact OD1-N 2.78Å; D159-R185 IonicContact OD2-CZ 3.96Å; D159-R185 VanDerWaalsContact OD2-CZ 3.31Å; D159-R185 IonicContact OD2-NE 2.89Å; D159-R185 PolarHBondContact OD2-NE 2.89Å; D159-R185 IonicContact OD2-NH2 2.59Å; D159-R185 PolarHBondContact OD2-NH2 3.08Å
160	G	95	Very high	96.8	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.01	11%	0.107	C	C	.	.	S	Bend	trans	-111.7	-12.9	-173.6	0	0	0	0	0	115.5	S16 H75	S16-G160 WeakPolarHBondContact OG-CA 3.14Å; S16-G160 PolarHBondContact OG-N 3.43Å; H75-G160 PolarHBondContact ND1-O 3.48Å
161	V	96.1	Very high	96.7	Very high	8 Å²	8	23.2 Å²	23.2	5%	0.048	11%	0.114	C	C	.	.			trans	-154.3	150	-174.7	65	0	0	0	0	111.5	G158 H163 R179	G158-V161 PolarHBondContact N-O 2.95Å; V161-H163 WeakPolarHBondContact CG1-CE1 3.35Å; V161-H163 WeakPolarHBondContact CG2-CE1 3.48Å; V161-R179 HydrophobicContact CG2-CG 3.94Å
162	T	97.9	Very high	96.6	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	134.2	170.8	-61.3	0	0	0	0	110	L155 D156 S157 L180 L182 I276	L155-T162 HydrophobicContact CD1-CG2 3.54Å; D156-T162 CarbonylContact O-C 3.57Å; D156-T162 VanDerWaalsContact O-CA 3.25Å; D156-T162 WeakPolarHBondContact O-CA 3.38Å; S157-T162 WeakPolarHBondContact CB-OG1 3.29Å; S157-T162 PolarHBondContact OG-OG1 3.36Å; T162-L180 PolarHBondContact N-O 3.12Å; T162-L180 PolarHBondContact O-N 3.07Å; T162-L182 WeakPolarHBondContact CB-O 3.38Å; T162-L182 PolarHBondContact OG1-O 3.3Å; T162-I276 HydrophobicContact CG2-CG2 4.01Å
163	H	97.3	Very high	96.5	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.009	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.2	177.8	-63.3	102.5	0	0	0	111.6	P111 L155 D156 V161 V165 M178	P111-H163 HydrophobicContact CG-CB 4.12Å; L155-H163 WeakPolarHBondContact CA-O 3.4Å; D156-H163 PolarHBondContact N-O 2.9Å; D156-H163 PolarHBondContact O-N 2.97Å; V161-H163 WeakPolarHBondContact CG1-CE1 3.35Å; V161-H163 WeakPolarHBondContact CG2-CE1 3.48Å; H163-V165 HydrophobicContact CB-CG2 4.03Å; H163-M178 CarbonylContact C-O 3.22Å; H163-M178 WeakPolarHBondContact CA-O 3.35Å
164	N	98.2	Very high	96.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.5	161.9	-65.7	-79.6	0	0	0	108.2	I153 V154 L155 I177 M178 T279 T280	I153-N164 HydrophobicContact CD1-CB 4.29Å; V154-N164 WeakPolarHBondContact O-CA 3.38Å; L155-N164 WeakPolarHBondContact CD1-OD1 3.18Å; N164-I177 WeakPolarHBondContact O-CA 3.18Å; N164-M178 HydrophobicContact CB-CB 4.16Å; N164-M178 PolarHBondContact N-O 3.13Å; N164-M178 PolarHBondContact O-N 3.3Å; N164-T279 WeakPolarHBondContact ND2-CB 3.43Å; N164-T279 PolarHBondContact ND2-OG1 3.2Å; N164-T280 WeakPolarHBondContact OD1-CA 3.41Å; N164-T280 PolarHBondContact OD1-OG1 3.13Å
165	V	98.3	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	105	-177	-174.7	0	0	0	0	108.7	P111 A140 V154 H163 V167 A172 I177	P111-V165 HydrophobicContact CB-CG2 3.97Å; P111-V165 HydrophobicContact CG-CG2 3.46Å; P111-V165 VanDerWaalsContact CG-CG2 3.46Å; A140-V165 HydrophobicContact CB-CB 3.5Å; A140-V165 VanDerWaalsContact CB-CB 3.5Å; A140-V165 HydrophobicContact CB-CG1 3.91Å; A140-V165 HydrophobicContact CB-CG2 3.53Å; V154-V165 PolarHBondContact N-O 3.4Å; V154-V165 PolarHBondContact O-N 3.49Å; H163-V165 HydrophobicContact CB-CG2 4.03Å; V165-V167 HydrophobicContact CG1-CG2 4.08Å; V165-A172 HydrophobicContact CG1-CB 3.86Å; V165-I177 HydrophobicContact CG1-CD1 4.3Å; V165-I177 HydrophobicContact CG1-CG1 4.19Å; V165-I177 HydrophobicContact CG2-CG2 4.33Å
166	P	98.3	Very high	96.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	132.7	170.5	27.1	-24.1	0	0	0	109.1	I153 L173 A176 S283 L295	I153-P166 HydrophobicContact CG1-CB 4.44Å; P166-L173 HydrophobicContact CB-CD1 4.32Å; P166-L173 HydrophobicContact CG-CB 4.21Å; P166-L173 PolarHBondContact O-N 3.12Å; P166-A176 HydrophobicContact CG-CB 3.5Å; P166-A176 VanDerWaalsContact CG-CB 3.5Å; P166-S283 WeakPolarHBondContact CD-OG 3.09Å; P166-S283 WeakPolarHBondContact CG-OG 3.1Å; P166-L295 HydrophobicContact CB-CD1 4.07Å; P166-L295 HydrophobicContact CB-CD2 4.21Å
167	V	97.8	Very high	96.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.7	-178	-179.4	0	0	0	0	107.8	V141 L144 T151 G152 V165 Y171 A172	V141-V167 HydrophobicContact CG2-CG2 4.09Å; L144-V167 HydrophobicContact CD2-CB 3.57Å; L144-V167 HydrophobicContact CD2-CG1 3.68Å; L144-V167 HydrophobicContact CD2-CG2 4.16Å; T151-V167 WeakPolarHBondContact CA-O 3.26Å; G152-V167 PolarHBondContact N-O 3.31Å; G152-V167 PolarHBondContact O-N 3.4Å; V165-V167 HydrophobicContact CG1-CG2 4.08Å; V167-Y171 CarbonylContact C-O 3.32Å; V167-Y171 VanDerWaalsContact CA-O 3.27Å; V167-Y171 WeakPolarHBondContact CA-O 3.32Å; V167-A172 HydrophobicContact CG2-CB 4.44Å
168	Y	96.6	Very high	96.1	Very high	79 Å²	79	35.4 Å²	35.4	31%	0.31	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.6	178	-173	-101.2	0	0	0	109.3	T151 G170 Y171 I291	T151-Y168 HydrophobicContact CG2-CD2 3.58Å; T151-Y168 HydrophobicContact CG2-CE2 4.12Å; Y168-G170 PolarHBondContact O-N 3.47Å; Y168-G170 VanDerWaalsContact O-N 3.14Å; Y168-Y171 PolarHBondContact N-O 3.13Å; Y168-Y171 PolarHBondContact O-N 3.38Å; Y168-I291 HydrophobicContact CD2-CB 3.94Å; Y168-I291 HydrophobicContact CD2-CD1 4.36Å; Y168-I291 HydrophobicContact CD2-CG2 3.61Å; Y168-I291 HydrophobicContact CE1-CG2 4.42Å; Y168-I291 HydrophobicContact CE2-CB 4Å; Y168-I291 HydrophobicContact CE2-CG2 3.34Å; Y168-I291 HydrophobicContact CG-CG2 4.28Å
169	E	93.7	Very high	96	Very high	127 Å²	127	38.6 Å²	38.6	59%	0.593	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	38.6	-179	-61.1	-169.6	152.8	0	0	113.8	T150 T151 Y171	T150-E169 PolarHBondContact O-N 2.83Å; T151-E169 PolarHBondContact OG1-N 3.1Å; E169-Y171 WeakPolarHBondContact O-CD2 3.3Å
170	G	89	Confident	96	Very high	12 Å²	12	37.3 Å²	37.3	12%	0.124	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	-5.7	179.1	0	0	0	0	0	115.2	Y145 T150 Y168	Y145-G170 WeakPolarHBondContact OH-CA 3.39Å; T150-G170 PolarHBondContact O-N 3.06Å; Y168-G170 PolarHBondContact O-N 3.47Å; Y168-G170 VanDerWaalsContact O-N 3.14Å
171	Y	90.9	Very high	96	Very high	158 Å²	158	40.5 Å²	40.5	62%	0.62	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	125.7	179.6	-62.1	-84.3	0	0	0	111.6	V167 Y168 E169	V167-Y171 CarbonylContact C-O 3.32Å; V167-Y171 VanDerWaalsContact CA-O 3.27Å; V167-Y171 WeakPolarHBondContact CA-O 3.32Å; Y168-Y171 PolarHBondContact N-O 3.13Å; Y168-Y171 PolarHBondContact O-N 3.38Å; E169-Y171 WeakPolarHBondContact O-CD2 3.3Å
172	A	95.3	Very high	96	Very high	14 Å²	14	40.1 Å²	40.1	12%	0.116	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	139.6	170.1	0	0	0	0	0	110.2	I138 V141 V165 V167 P174	I138-A172 HydrophobicContact CD1-CB 4.3Å; V141-A172 HydrophobicContact CG2-CB 3.99Å; V165-A172 HydrophobicContact CG1-CB 3.86Å; V167-A172 HydrophobicContact CG2-CB 4.44Å; A172-P174 WeakPolarHBondContact O-CD 3.29Å
173	L	96.2	Very high	96	Very high	31 Å²	31	40.1 Å²	40.1	16%	0.162	19%	0.192	C	C	.	.			trans	-96.3	96.3	-179.9	-57.8	177.2	0	0	0	110.4	P166 H175 A176 I177 I291	P166-L173 HydrophobicContact CB-CD1 4.32Å; P166-L173 HydrophobicContact CG-CB 4.21Å; P166-L173 PolarHBondContact O-N 3.12Å; L173-H175 VanDerWaalsContact C-N 3.31Å; L173-H175 PolarHBondContact O-N 3.17Å; L173-A176 HydrophobicContact CB-CB 4.42Å; L173-A176 PolarHBondContact O-N 3.12Å; L173-I177 PolarHBondContact O-N 2.76Å; L173-I291 HydrophobicContact CD1-CD1 3.49Å; L173-I291 VanDerWaalsContact CD1-CD1 3.49Å
174	P	94.5	Very high	96	Very high	83 Å²	83	40 Å²	40	54%	0.539	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-65.9	-32.1	-163.6	-22.5	36.6	0	0	0	113.8	L112 A172 A176 I177	L112-P174 HydrophobicContact CD2-CB 4.49Å; A172-P174 WeakPolarHBondContact O-CD 3.29Å; P174-A176 PolarHBondContact O-N 3.06Å; P174-I177 HydrophobicContact CB-CD1 4.48Å; P174-I177 PolarHBondContact O-N 2.85Å
175	H	96.2	Very high	95.9	Very high	114 Å²	114	42 Å²	42	53%	0.528	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-68	-20.4	179.5	62.9	-88	0	0	0	113.3	L173	L173-H175 VanDerWaalsContact C-N 3.31Å; L173-H175 PolarHBondContact O-N 3.17Å
176	A	97.8	Very high	95.8	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-106.8	1.2	-177.8	0	0	0	0	0	113.3	P166 L173 P174 M178 S283 K286 C287	P166-A176 HydrophobicContact CG-CB 3.5Å; P166-A176 VanDerWaalsContact CG-CB 3.5Å; L173-A176 HydrophobicContact CB-CB 4.42Å; L173-A176 PolarHBondContact O-N 3.12Å; P174-A176 PolarHBondContact O-N 3.06Å; A176-M178 PolarHBondContact O-N 3.5Å; A176-S283 WeakPolarHBondContact O-CB 3.1Å; A176-S283 PolarHBondContact O-OG 3.15Å; A176-K286 HydrophobicContact CB-CB 3.77Å; A176-C287 WeakPolarHBondContact CB-SG 3.32Å
177	I	97.8	Very high	95.8	Very high	16 Å²	16	43.9 Å²	43.9	8%	0.082	21%	0.209	C	C	.	.			trans	-66	131.2	174.3	-63	174.6	0	0	0	109.5	P111 L112 N164 V165 L173 P174	P111-I177 HydrophobicContact CB-CD1 4.13Å; P111-I177 HydrophobicContact CB-CG2 4.08Å; L112-I177 HydrophobicContact CD1-CB 4.18Å; L112-I177 HydrophobicContact CD1-CG2 3.9Å; L112-I177 HydrophobicContact CD2-CD1 4.09Å; L112-I177 HydrophobicContact CG-CB 4.43Å; L112-I177 HydrophobicContact CG-CD1 4.18Å; L112-I177 HydrophobicContact CG-CG2 4.14Å; N164-I177 WeakPolarHBondContact O-CA 3.18Å; V165-I177 HydrophobicContact CG1-CD1 4.3Å; V165-I177 HydrophobicContact CG1-CG1 4.19Å; V165-I177 HydrophobicContact CG2-CG2 4.33Å; L173-I177 PolarHBondContact O-N 2.76Å; P174-I177 HydrophobicContact CB-CD1 4.48Å; P174-I177 PolarHBondContact O-N 2.85Å
178	M	97.6	Very high	95.9	Very high	38 Å²	38	43.8 Å²	43.8	19%	0.187	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.6	171.6	-57.2	-69.5	-69.3	0	0	108.8	H163 N164 A176 N282 K286	H163-M178 CarbonylContact C-O 3.22Å; H163-M178 WeakPolarHBondContact CA-O 3.35Å; N164-M178 HydrophobicContact CB-CB 4.16Å; N164-M178 PolarHBondContact N-O 3.13Å; N164-M178 PolarHBondContact O-N 3.3Å; A176-M178 PolarHBondContact O-N 3.5Å; M178-N282 HydrophobicContact CE-CB 4.32Å; M178-K286 HydrophobicContact SD-CD 4.05Å; M178-K286 PolarHBondContact SD-NZ 3.38Å
179	R	95.4	Very high	95.9	Very high	92 Å²	92	43.1 Å²	43.1	35%	0.347	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	137.8	176.1	175.2	173.5	166.5	158.1	0.1	109.4	H75 V161 D181	H75-R179 VanDerWaalsContact CB-NH2 3.26Å; H75-R179 PolarHBondContact O-NH2 3.44Å; V161-R179 HydrophobicContact CG2-CG 3.94Å; R179-D181 IonicContact CZ-OD1 2.86Å; R179-D181 VanDerWaalsContact CZ-OD1 3.29Å; R179-D181 IonicContact NE-OD1 3.01Å; R179-D181 PolarHBondContact NE-OD1 3.28Å; R179-D181 IonicContact NE-OD2 3.29Å; R179-D181 IonicContact NH2-OD1 3.5Å; R179-D181 PolarHBondContact NH2-OD1 3.19Å; R179-D181 IonicContact NH2-OD2 2.77Å
180	L	95.8	Very high	96.1	Very high	8 Å²	8	37.9 Å²	37.9	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	115.5	175.9	175.4	65	0	0	0	108.2	T162 L182 M271 S273 I276	T162-L180 PolarHBondContact N-O 3.12Å; T162-L180 PolarHBondContact O-N 3.07Å; L180-L182 HydrophobicContact CD1-CB 4.18Å; L180-L182 HydrophobicContact CD2-CB 4.16Å; L180-L182 HydrophobicContact CD2-CD2 4.37Å; L180-L182 HydrophobicContact CG-CB 3.87Å; L180-L182 PolarHBondContact O-N 3.3Å; L180-M271 HydrophobicContact CD1-CE 4.27Å; L180-S273 WeakPolarHBondContact CD1-OG 3.47Å; L180-I276 HydrophobicContact CD2-CG2 4.2Å
181	D	94.8	Very high	96.5	Very high	68 Å²	68	37.3 Å²	37.3	36%	0.364	18%	0.179	S	C	.	.	S	Bend	trans	-80.5	54.8	176.1	-67	-23.6	0	0	0	110.4	R179	R179-D181 IonicContact CZ-OD1 2.86Å; R179-D181 VanDerWaalsContact CZ-OD1 3.29Å; R179-D181 IonicContact NE-OD1 3.01Å; R179-D181 PolarHBondContact NE-OD1 3.28Å; R179-D181 IonicContact NE-OD2 3.29Å; R179-D181 IonicContact NH2-OD1 3.5Å; R179-D181 PolarHBondContact NH2-OD1 3.19Å; R179-D181 IonicContact NH2-OD2 2.77Å
182	L	96.6	Very high	96.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.			trans	-140.1	119.3	172.9	162.8	60.1	0	0	0	107.8	T162 L180 D186 L187 T262 L263 P266 I269 M271	T162-L182 WeakPolarHBondContact CB-O 3.38Å; T162-L182 PolarHBondContact OG1-O 3.3Å; L180-L182 HydrophobicContact CD1-CB 4.18Å; L180-L182 HydrophobicContact CD2-CB 4.16Å; L180-L182 HydrophobicContact CD2-CD2 4.37Å; L180-L182 HydrophobicContact CG-CB 3.87Å; L180-L182 PolarHBondContact O-N 3.3Å; L182-D186 WeakPolarHBondContact CA-OD2 3.34Å; L182-D186 HydrophobicContact CD1-CB 3.63Å; L182-L187 HydrophobicContact CD1-CD2 4.27Å; L182-T262 HydrophobicContact CD1-CG2 4.23Å; L182-T262 HydrophobicContact CD2-CG2 4.19Å; L182-T262 WeakPolarHBondContact CD2-O 3.48Å; L182-L263 HydrophobicContact CG-CD2 4.47Å; L182-P266 HydrophobicContact CD2-CB 3.92Å; L182-P266 HydrophobicContact CD2-CG 3.89Å; L182-I269 HydrophobicContact CD1-CD1 3.55Å; L182-I269 HydrophobicContact CD2-CD1 4.32Å; L182-I269 HydrophobicContact CG-CD1 4.44Å; L182-M271 HydrophobicContact CB-CE 4.17Å; L182-M271 HydrophobicContact CB-SD 4.04Å
183	A	97.5	Very high	96.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-156	-160.3	-177.6	0	0	0	0	0	112.2	G158 D159 R185 D186 L187	G158-A183 WeakPolarHBondContact O-CB 3.4Å; D159-A183 CarbonylContact O-C 3.4Å; D159-A183 WeakPolarHBondContact O-CB 3.34Å; A183-R185 PolarHBondContact O-N 3.24Å; A183-R185 VanDerWaalsContact O-N 3.12Å; A183-D186 PolarHBondContact N-OD2 3.4Å; A183-D186 PolarHBondContact O-N 2.84Å; A183-L187 WeakPolarHBondContact O-CG 3.4Å; A183-L187 PolarHBondContact O-N 3.32Å; A183-L187 VanDerWaalsContact O-N 3.13Å
184	G	97.7	Very high	96.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.8	-31.9	-170	0	0	0	0	0	115.2	G158 D159 T188 K215 T305	G158-G184 PolarHBondContact O-N 3.21Å; G158-G184 VanDerWaalsContact O-N 3.12Å; D159-G184 PolarHBondContact O-N 2.98Å; D159-G184 VanDerWaalsContact O-N 3.17Å; G184-T188 PolarHBondContact O-N 2.9Å; G184-T188 PolarHBondContact O-OG1 3.02Å; G184-T188 VanDerWaalsContact O-OG1 3.11Å; G184-K215 PolarHBondContact O-NZ 3.26Å; G184-T305 WeakPolarHBondContact CA-OG1 3.49Å; G184-T305 PolarHBondContact N-OG1 2.72Å; G184-T305 VanDerWaalsContact N-OG1 3.13Å
185	R	96.1	Very high	97	Very high	40 Å²	40	31.5 Å²	31.5	15%	0.151	15%	0.146	C	C	.	.	H	α-helix	trans	-67.6	-48.5	179.5	-170.6	175.4	-63.4	174.3	0.6	111	S16 D159 A183 L187 T188 D189 R208	S16-R185 PolarHBondContact O-NH2 3.26Å; D159-R185 WeakPolarHBondContact O-CB 3.38Å; D159-R185 PolarHBondContact O-N 3.25Å; D159-R185 PolarHBondContact OD1-N 2.78Å; D159-R185 IonicContact OD2-CZ 3.96Å; D159-R185 VanDerWaalsContact OD2-CZ 3.31Å; D159-R185 IonicContact OD2-NE 2.89Å; D159-R185 PolarHBondContact OD2-NE 2.89Å; D159-R185 IonicContact OD2-NH2 2.59Å; D159-R185 PolarHBondContact OD2-NH2 3.08Å; A183-R185 PolarHBondContact O-N 3.24Å; A183-R185 VanDerWaalsContact O-N 3.12Å; R185-L187 VanDerWaalsContact C-N 3.29Å; R185-L187 PolarHBondContact O-N 2.98Å; R185-T188 WeakPolarHBondContact O-CB 3.39Å; R185-T188 PolarHBondContact O-N 3.37Å; R185-T188 VanDerWaalsContact O-N 3.15Å; R185-D189 PolarHBondContact O-N 3.05Å; R185-D189 VanDerWaalsContact O-N 3.08Å; R185-R208 PolarHBondContact O-NH2 3.13Å; R185-R208 VanDerWaalsContact O-NH2 3.07Å
186	D	97.3	Very high	97	Very high	40 Å²	40	29.3 Å²	29.3	21%	0.214	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-37.8	178.1	-46	-74.6	0	0	0	110.9	L182 A183 T188 D189 Y190 I269	L182-D186 WeakPolarHBondContact CA-OD2 3.34Å; L182-D186 HydrophobicContact CD1-CB 3.63Å; A183-D186 PolarHBondContact N-OD2 3.4Å; A183-D186 PolarHBondContact O-N 2.84Å; D186-T188 PolarHBondContact O-N 3.17Å; D186-D189 PolarHBondContact O-N 2.92Å; D186-Y190 WeakPolarHBondContact O-CB 3.2Å; D186-Y190 PolarHBondContact O-N 3.07Å; D186-I269 HydrophobicContact CB-CD1 4.49Å
187	L	98.3	Very high	96.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.8	-37.9	174.6	-62.1	-174.8	0	0	0	112.4	L182 A183 R185 L191 K215 C259 T262 L263 T305 Y308	L182-L187 HydrophobicContact CD1-CD2 4.27Å; A183-L187 WeakPolarHBondContact O-CG 3.4Å; A183-L187 PolarHBondContact O-N 3.32Å; A183-L187 VanDerWaalsContact O-N 3.13Å; R185-L187 VanDerWaalsContact C-N 3.29Å; R185-L187 PolarHBondContact O-N 2.98Å; L187-L191 WeakPolarHBondContact O-CB 3.24Å; L187-L191 PolarHBondContact O-N 2.79Å; L187-K215 HydrophobicContact CB-CD 4.06Å; L187-C259 PolarHBondContact O-SG 2.86Å; L187-T262 HydrophobicContact CD2-CG2 4.21Å; L187-L263 HydrophobicContact CD1-CD1 4.06Å; L187-L263 HydrophobicContact CD1-CD2 4.03Å; L187-L263 HydrophobicContact CD1-CG 3.94Å; L187-L263 HydrophobicContact CD2-CD2 4.44Å; L187-L263 HydrophobicContact CD2-CG 4.33Å; L187-T305 HydrophobicContact CD1-CG2 3.63Å; L187-Y308 HydrophobicContact CD1-CE2 3.69Å; L187-Y308 WeakPolarHBondContact CD1-OH 3.3Å
188	T	97.9	Very high	96.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.2	-44	173.4	-61.4	0	0	0	0	110.8	G184 R185 D186 L191 M192 R208 V211 R212 K215	G184-T188 PolarHBondContact O-N 2.9Å; G184-T188 PolarHBondContact O-OG1 3.02Å; G184-T188 VanDerWaalsContact O-OG1 3.11Å; R185-T188 WeakPolarHBondContact O-CB 3.39Å; R185-T188 PolarHBondContact O-N 3.37Å; R185-T188 VanDerWaalsContact O-N 3.15Å; D186-T188 PolarHBondContact O-N 3.17Å; T188-L191 PolarHBondContact O-N 2.85Å; T188-M192 PolarHBondContact O-N 3.28Å; T188-R208 HydrophobicContact CG2-CG 4.07Å; T188-V211 HydrophobicContact CG2-CB 4.34Å; T188-V211 HydrophobicContact CG2-CG1 4.16Å; T188-R212 HydrophobicContact CG2-CB 3.95Å; T188-K215 PolarHBondContact OG1-NZ 2.88Å
189	D	96.6	Very high	96.3	Very high	65 Å²	65	39.5 Å²	39.5	35%	0.348	20%	0.201	S	C	.	.	H	α-helix	trans	-67.9	-38.9	-180	-66.3	-35.4	0	0	0	111.9	R185 D186 M192 K193 R208	R185-D189 PolarHBondContact O-N 3.05Å; R185-D189 VanDerWaalsContact O-N 3.08Å; D186-D189 PolarHBondContact O-N 2.92Å; D189-M192 WeakPolarHBondContact O-CB 3.34Å; D189-M192 PolarHBondContact O-N 2.96Å; D189-K193 PolarHBondContact O-N 3.37Å; D189-R208 IonicContact OD1-CZ 3.03Å; D189-R208 IonicContact OD1-NE 2.89Å; D189-R208 PolarHBondContact OD1-NE 3.2Å; D189-R208 IonicContact OD1-NH2 3.85Å; D189-R208 PolarHBondContact OD1-NH2 3.09Å; D189-R208 IonicContact OD2-CZ 3.75Å; D189-R208 IonicContact OD2-NE 3.27Å; D189-R208 IonicContact OD2-NH2 2.72Å; D189-R208 PolarHBondContact OD2-NH2 3.4Å
190	Y	97.9	Very high	96.2	Very high	16 Å²	16	38 Å²	38	6%	0.063	20%	0.195	C	C	.	.	H	α-helix	trans	-65.7	-42.2	173.7	179.7	-121.7	0	0	0	112.2	D186 M192 K193 I194 T262 F268 I269	D186-Y190 WeakPolarHBondContact O-CB 3.2Å; D186-Y190 PolarHBondContact O-N 3.07Å; Y190-M192 VanDerWaalsContact C-N 3.28Å; Y190-M192 PolarHBondContact O-N 3.23Å; Y190-K193 WeakPolarHBondContact O-CB 3.29Å; Y190-K193 PolarHBondContact O-N 2.8Å; Y190-I194 HydrophobicContact CD1-CD1 4.5Å; Y190-I194 HydrophobicContact CD2-CG2 4.17Å; Y190-I194 HydrophobicContact CE1-CD1 4.15Å; Y190-I194 HydrophobicContact CE1-CG2 4.32Å; Y190-I194 HydrophobicContact CE2-CG2 3.57Å; Y190-I194 PolarHBondContact O-N 3.08Å; Y190-T262 WeakPolarHBondContact CD1-OG1 3.14Å; Y190-T262 WeakPolarHBondContact CE1-OG1 3.49Å; Y190-F268 HydrophobicContact CE1-CB 4.44Å; Y190-F268 HydrophobicContact CE1-CD2 4.33Å; Y190-F268 HydrophobicContact CE2-CB 4.41Å; Y190-F268 WeakPolarHBondContact OH-CD2 3.23Å; Y190-I269 HydrophobicContact CD1-CG2 4.43Å; Y190-I269 HydrophobicContact CD2-CG2 3.52Å; Y190-I269 HydrophobicContact CE2-CG2 4.24Å; Y190-I269 HydrophobicContact CG-CG2 3.64Å
191	L	98.2	Very high	96	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-42.3	174.1	-176.6	59.5	0	0	0	111	L187 T188 K193 I194 L195 V211 I214 K215 E255 C259	L187-L191 WeakPolarHBondContact O-CB 3.24Å; L187-L191 PolarHBondContact O-N 2.79Å; T188-L191 PolarHBondContact O-N 2.85Å; L191-K193 VanDerWaalsContact C-N 3.3Å; L191-K193 PolarHBondContact O-N 2.82Å; L191-I194 HydrophobicContact CD1-CD1 4.07Å; L191-I194 HydrophobicContact CD1-CG1 4.13Å; L191-I194 WeakPolarHBondContact O-CG1 3.49Å; L191-I194 PolarHBondContact O-N 3.05Å; L191-L195 HydrophobicContact CD1-CD1 4.11Å; L191-L195 HydrophobicContact CD1-CG 4.04Å; L191-L195 HydrophobicContact CD2-CD1 4.46Å; L191-L195 HydrophobicContact CG-CD1 3.83Å; L191-L195 HydrophobicContact CG-CG 4.22Å; L191-L195 WeakPolarHBondContact O-CB 3.43Å; L191-L195 WeakPolarHBondContact O-CG 3.31Å; L191-L195 PolarHBondContact O-N 3.09Å; L191-V211 HydrophobicContact CB-CG1 3.87Å; L191-V211 HydrophobicContact CD2-CG1 3.81Å; L191-V211 HydrophobicContact CG-CG1 3.77Å; L191-I214 HydrophobicContact CD2-CB 4.49Å; L191-I214 HydrophobicContact CD2-CG2 4.12Å; L191-K215 HydrophobicContact CD2-CB 3.67Å; L191-K215 HydrophobicContact CD2-CG 4.37Å; L191-E255 HydrophobicContact CD1-CB 4Å; L191-C259 HydrophobicContact CB-CB 4.28Å; L191-C259 HydrophobicContact CD1-CB 4.02Å
192	M	97.1	Very high	95.8	Very high	47 Å²	47	38.9 Å²	38.9	23%	0.232	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-43.3	176.4	-161.9	173.6	90.2	0	0	111.6	T188 D189 Y190 T196 F202 R208 V211	T188-M192 PolarHBondContact O-N 3.28Å; D189-M192 WeakPolarHBondContact O-CB 3.34Å; D189-M192 PolarHBondContact O-N 2.96Å; Y190-M192 VanDerWaalsContact C-N 3.28Å; Y190-M192 PolarHBondContact O-N 3.23Å; M192-T196 PolarHBondContact O-N 3.16Å; M192-T196 PolarHBondContact O-OG1 3.4Å; M192-F202 WeakPolarHBondContact CE-O 3.49Å; M192-F202 HydrophobicContact CG-CB 3.85Å; M192-F202 HydrophobicContact SD-CB 4.15Å; M192-F202 VanDerWaalsContact SD-O 3.4Å; M192-R208 HydrophobicContact SD-CB 4.47Å; M192-R208 HydrophobicContact SD-CG 4.46Å; M192-V211 HydrophobicContact CB-CG1 4.14Å; M192-V211 HydrophobicContact CB-CG2 4.44Å; M192-V211 HydrophobicContact CG-CG2 4.19Å
193	K	96.3	Very high	95.4	Very high	117 Å²	117	44.3 Å²	44.3	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-60.7	-53	176.1	-179.3	-174.5	171.4	-172	0	112	D189 Y190 L191 L195 T196 E197	D189-K193 PolarHBondContact O-N 3.37Å; Y190-K193 WeakPolarHBondContact O-CB 3.29Å; Y190-K193 PolarHBondContact O-N 2.8Å; L191-K193 VanDerWaalsContact C-N 3.3Å; L191-K193 PolarHBondContact O-N 2.82Å; K193-L195 VanDerWaalsContact C-N 3.31Å; K193-L195 PolarHBondContact O-N 3.32Å; K193-T196 WeakPolarHBondContact O-CA 3.49Å; K193-T196 VanDerWaalsContact O-CB 3.31Å; K193-T196 WeakPolarHBondContact O-CB 3.18Å; K193-T196 PolarHBondContact O-N 2.87Å; K193-T196 VanDerWaalsContact O-N 3.09Å; K193-E197 PolarHBondContact O-N 3.47Å
194	I	97.2	Very high	94.9	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-71.9	-24.5	-176.9	65.1	-177.6	0	0	0	112.9	Y190 L191 E197 R198 E255 R258 C259	Y190-I194 HydrophobicContact CD1-CD1 4.5Å; Y190-I194 HydrophobicContact CD2-CG2 4.17Å; Y190-I194 HydrophobicContact CE1-CD1 4.15Å; Y190-I194 HydrophobicContact CE1-CG2 4.32Å; Y190-I194 HydrophobicContact CE2-CG2 3.57Å; Y190-I194 PolarHBondContact O-N 3.08Å; L191-I194 HydrophobicContact CD1-CD1 4.07Å; L191-I194 HydrophobicContact CD1-CG1 4.13Å; L191-I194 WeakPolarHBondContact O-CG1 3.49Å; L191-I194 PolarHBondContact O-N 3.05Å; I194-E197 WeakPolarHBondContact O-CB 3.4Å; I194-E197 PolarHBondContact O-N 3.25Å; I194-R198 PolarHBondContact O-N 3.06Å; I194-E255 HydrophobicContact CB-CG 4.31Å; I194-E255 HydrophobicContact CD1-CB 3.66Å; I194-E255 HydrophobicContact CD1-CG 3.96Å; I194-E255 HydrophobicContact CG1-CB 3.97Å; I194-E255 HydrophobicContact CG1-CG 3.85Å; I194-R258 HydrophobicContact CD1-CB 4.28Å; I194-C259 HydrophobicContact CD1-CB 4.28Å
195	L	96.9	Very high	94.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-69.8	-35.3	168.7	-72.2	175.3	0	0	0	112	L191 K193 E197 R198 G199 Y200 F202 V211 I252 E255	L191-L195 HydrophobicContact CD1-CD1 4.11Å; L191-L195 HydrophobicContact CD1-CG 4.04Å; L191-L195 HydrophobicContact CD2-CD1 4.46Å; L191-L195 HydrophobicContact CG-CD1 3.83Å; L191-L195 HydrophobicContact CG-CG 4.22Å; L191-L195 WeakPolarHBondContact O-CB 3.43Å; L191-L195 WeakPolarHBondContact O-CG 3.31Å; L191-L195 PolarHBondContact O-N 3.09Å; K193-L195 VanDerWaalsContact C-N 3.31Å; K193-L195 PolarHBondContact O-N 3.32Å; L195-E197 VanDerWaalsContact C-N 3.34Å; L195-R198 WeakPolarHBondContact O-CB 3.45Å; L195-R198 PolarHBondContact O-N 3.49Å; L195-R198 VanDerWaalsContact O-N 3.16Å; L195-G199 PolarHBondContact O-N 2.96Å; L195-Y200 CarbonylContact C-O 3.58Å; L195-Y200 HydrophobicContact CD2-CD2 4.42Å; L195-Y200 PolarHBondContact O-N 3.49Å; L195-F202 HydrophobicContact CB-CD2 4.38Å; L195-F202 HydrophobicContact CB-CE2 4.15Å; L195-F202 HydrophobicContact CD1-CD2 4.39Å; L195-F202 HydrophobicContact CD1-CE2 3.85Å; L195-V211 HydrophobicContact CD1-CG1 4.26Å; L195-V211 HydrophobicContact CD1-CG2 4.41Å; L195-I252 HydrophobicContact CD2-CD1 3.7Å; L195-I252 HydrophobicContact CD2-CG2 4.24Å; L195-E255 HydrophobicContact CD2-CB 4.44Å; L195-E255 HydrophobicContact CD2-CG 4.31Å
196	T	95.5	Very high	93.7	Very high	67 Å²	67	51.7 Å²	51.7	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-64.9	-39.6	173.2	-54.5	0	0	0	0	111	M192 K193 R198 G199 Y200	M192-T196 PolarHBondContact O-N 3.16Å; M192-T196 PolarHBondContact O-OG1 3.4Å; K193-T196 WeakPolarHBondContact O-CA 3.49Å; K193-T196 VanDerWaalsContact O-CB 3.31Å; K193-T196 WeakPolarHBondContact O-CB 3.18Å; K193-T196 PolarHBondContact O-N 2.87Å; K193-T196 VanDerWaalsContact O-N 3.09Å; T196-R198 PolarHBondContact O-N 3.07Å; T196-G199 WeakPolarHBondContact O-CA 3.28Å; T196-G199 PolarHBondContact O-N 3.13Å; T196-Y200 WeakPolarHBondContact CA-O 3.44Å; T196-Y200 PolarHBondContact N-O 2.89Å; T196-Y200 PolarHBondContact OG1-O 3.16Å
197	E	93.8	Very high	93.3	Very high	118 Å²	118	52.6 Å²	52.6	55%	0.551	30%	0.296	S	S	*	.	H	α-helix	trans	-59.6	-32.9	172.7	-66.3	167.7	-169.1	0	0	112.3	K193 I194 L195 G199 R258	K193-E197 PolarHBondContact O-N 3.47Å; I194-E197 WeakPolarHBondContact O-CB 3.4Å; I194-E197 PolarHBondContact O-N 3.25Å; L195-E197 VanDerWaalsContact C-N 3.34Å; E197-G199 VanDerWaalsContact C-N 3.27Å; E197-G199 PolarHBondContact O-N 3.45Å; E197-R258 IonicContact OE2-NH2 3.67Å
198	R	91.9	Very high	93	Very high	88 Å²	88	54.5 Å²	54.5	33%	0.332	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-10.6	174.5	-155.7	-172.2	-179.1	91	1.5	113.4	I194 L195 T196 E239 T251 E255	I194-R198 PolarHBondContact O-N 3.06Å; L195-R198 WeakPolarHBondContact O-CB 3.45Å; L195-R198 PolarHBondContact O-N 3.49Å; L195-R198 VanDerWaalsContact O-N 3.16Å; T196-R198 PolarHBondContact O-N 3.07Å; R198-E239 IonicContact NH2-OE1 2.71Å; R198-E239 PolarHBondContact NH2-OE1 3.21Å; R198-T251 PolarHBondContact NE-O 3.37Å; R198-E255 VanDerWaalsContact CD-OE1 3.24Å; R198-E255 WeakPolarHBondContact CD-OE1 3.4Å; R198-E255 IonicContact CZ-OE1 3.28Å; R198-E255 IonicContact CZ-OE2 2.78Å; R198-E255 IonicContact NE-OE1 2.6Å; R198-E255 VanDerWaalsContact NH1-CD 3.34Å; R198-E255 IonicContact NH1-OE1 2.86Å; R198-E255 PolarHBondContact NH1-OE1 3.08Å; R198-E255 IonicContact NH1-OE2 3.9Å; R198-E255 PolarHBondContact NH1-OE2 3.33Å; R198-E255 VanDerWaalsContact NH1-OE2 3.08Å
199	G	93.8	Very high	92.7	Very high	63 Å²	63	56 Å²	56	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	5.2	179.3	0	0	0	0	0	115.5	L195 T196 E197	L195-G199 PolarHBondContact O-N 2.96Å; T196-G199 WeakPolarHBondContact O-CA 3.28Å; T196-G199 PolarHBondContact O-N 3.13Å; E197-G199 VanDerWaalsContact C-N 3.27Å; E197-G199 PolarHBondContact O-N 3.45Å
200	Y	93.1	Very high	92.6	Very high	59 Å²	59	54.4 Å²	54.4	23%	0.231	30%	0.302	C	S	.	.			trans	-96.7	110.8	174	-60.3	-58.8	0	0	0	110.7	L195 T196 I250 T251	L195-Y200 CarbonylContact C-O 3.58Å; L195-Y200 HydrophobicContact CD2-CD2 4.42Å; L195-Y200 PolarHBondContact O-N 3.49Å; T196-Y200 WeakPolarHBondContact CA-O 3.44Å; T196-Y200 PolarHBondContact N-O 2.89Å; T196-Y200 PolarHBondContact OG1-O 3.16Å; Y200-I250 HydrophobicContact CD1-CB 4.33Å; Y200-I250 HydrophobicContact CD1-CG2 3.85Å; Y200-I250 HydrophobicContact CE1-CB 3.8Å; Y200-I250 HydrophobicContact CE1-CG2 3.5Å; Y200-I250 HydrophobicContact CE2-CB 4.08Å; Y200-T251 WeakPolarHBondContact CE2-O 3.45Å; Y200-T251 PolarHBondContact OH-N 2.89Å; Y200-T251 VanDerWaalsContact OH-N 3.11Å
201	S	91.4	Very high	92.6	Very high	81 Å²	81	53.6 Å²	53.6	57%	0.566	30%	0.299	S	S	*	.			trans	-93.2	118.3	-178.6	-169.5	0	0	0	0	111.3	V203	S201-V203 WeakPolarHBondContact OG-CG2 3.24Å
202	F	91.6	Very high	92.5	Very high	14 Å²	14	57 Å²	57	6%	0.061	31%	0.311	C	S	.	.			trans	-118.6	113.1	172.1	-60.9	-74.3	0	0	0	107.5	M192 L195 E207 V211 I214 L244 I250	M192-F202 WeakPolarHBondContact CE-O 3.49Å; M192-F202 HydrophobicContact CG-CB 3.85Å; M192-F202 HydrophobicContact SD-CB 4.15Å; M192-F202 VanDerWaalsContact SD-O 3.4Å; L195-F202 HydrophobicContact CB-CD2 4.38Å; L195-F202 HydrophobicContact CB-CE2 4.15Å; L195-F202 HydrophobicContact CD1-CD2 4.39Å; L195-F202 HydrophobicContact CD1-CE2 3.85Å; F202-E207 HydrophobicContact CB-CB 3.89Å; F202-E207 HydrophobicContact CD1-CB 3.86Å; F202-E207 HydrophobicContact CD1-CG 4.16Å; F202-E207 HydrophobicContact CG-CB 4.35Å; F202-V211 HydrophobicContact CB-CG2 4.01Å; F202-V211 HydrophobicContact CD1-CG2 4.17Å; F202-V211 HydrophobicContact CD2-CG2 3.59Å; F202-V211 HydrophobicContact CE2-CG2 4.04Å; F202-V211 HydrophobicContact CG-CG2 3.65Å; F202-V211 HydrophobicContact CZ-CG2 4.48Å; F202-I214 HydrophobicContact CZ-CD1 4.48Å; F202-L244 HydrophobicContact CE1-CD2 4.14Å; F202-L244 HydrophobicContact CZ-CD2 4.4Å; F202-I250 HydrophobicContact CZ-CD1 3.96Å
203	V	87.2	Confident	92.5	Very high	114 Å²	114	56.5 Å²	56.5	69%	0.691	31%	0.31	S	S	*	.			trans	-117	-34.2	-169	-173	0	0	0	0	111.6	S201 E207	S201-V203 WeakPolarHBondContact OG-CG2 3.24Å; V203-E207 PolarHBondContact N-OE2 3.14Å
204	T	87.3	Confident	92.6	Very high	71 Å²	71	51 Å²	51	44%	0.436	29%	0.285	S	S	.	.	S	Bend	trans	-85.5	157.6	-174.3	69.7	0	0	0	0	111.6	A206 E207 R208	T204-A206 PolarHBondContact O-N 3.28Å; T204-E207 WeakPolarHBondContact CB-OE2 3.5Å; T204-E207 WeakPolarHBondContact CG2-OE2 3.48Å; T204-E207 PolarHBondContact N-OE2 3.14Å; T204-E207 PolarHBondContact O-N 2.97Å; T204-E207 WeakPolarHBondContact OG1-CB 3.28Å; T204-E207 VanDerWaalsContact OG1-CD 3.22Å; T204-E207 VanDerWaalsContact OG1-CG 3.27Å; T204-E207 WeakPolarHBondContact OG1-CG 3.45Å; T204-E207 PolarHBondContact OG1-N 3.03Å; T204-E207 PolarHBondContact OG1-OE2 3.26Å; T204-R208 PolarHBondContact O-N 3.38Å
205	T	83.5	Confident	92.6	Very high	78 Å²	78	51.3 Å²	51.3	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-61.7	-29.7	174.4	66.5	0	0	0	0	112.3	R64 R208	R64-T205 PolarHBondContact NE-OG1 3.25Å; R64-T205 VanDerWaalsContact NE-OG1 3.15Å; R64-T205 PolarHBondContact NH1-O 2.93Å; R64-T205 VanDerWaalsContact NH1-O 3.07Å; R64-T205 VanDerWaalsContact NH2-C 3.3Å; R64-T205 VanDerWaalsContact NH2-CB 3.27Å; R64-T205 PolarHBondContact NH2-O 3.06Å; R64-T205 PolarHBondContact NH2-OG1 3.19Å; T205-R208 WeakPolarHBondContact O-CB 3.35Å; T205-R208 PolarHBondContact O-N 3.25Å
206	A	84.3	Confident	92.6	Very high	46 Å²	46	56.7 Å²	56.7	38%	0.38	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-47.1	175.8	0	0	0	0	0	111.5	T204 R208 E209	T204-A206 PolarHBondContact O-N 3.28Å; A206-R208 VanDerWaalsContact C-N 3.28Å; A206-R208 PolarHBondContact O-N 3.11Å; A206-E209 WeakPolarHBondContact O-CB 3.5Å; A206-E209 PolarHBondContact O-N 3.17Å; A206-E209 VanDerWaalsContact O-N 3.12Å
207	E	90.1	Very high	92.8	Very high	59 Å²	59	60 Å²	60	28%	0.276	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-34	176.4	-74.7	161.8	164.3	0	0	112.5	F202 V203 T204 E209 I210 V211	F202-E207 HydrophobicContact CB-CB 3.89Å; F202-E207 HydrophobicContact CD1-CB 3.86Å; F202-E207 HydrophobicContact CD1-CG 4.16Å; F202-E207 HydrophobicContact CG-CB 4.35Å; V203-E207 PolarHBondContact N-OE2 3.14Å; T204-E207 WeakPolarHBondContact CB-OE2 3.5Å; T204-E207 WeakPolarHBondContact CG2-OE2 3.48Å; T204-E207 PolarHBondContact N-OE2 3.14Å; T204-E207 PolarHBondContact O-N 2.97Å; T204-E207 WeakPolarHBondContact OG1-CB 3.28Å; T204-E207 VanDerWaalsContact OG1-CD 3.22Å; T204-E207 VanDerWaalsContact OG1-CG 3.27Å; T204-E207 WeakPolarHBondContact OG1-CG 3.45Å; T204-E207 PolarHBondContact OG1-N 3.03Å; T204-E207 PolarHBondContact OG1-OE2 3.26Å; E207-E209 PolarHBondContact O-N 3.01Å; E207-I210 WeakPolarHBondContact O-CA 3.3Å; E207-I210 VanDerWaalsContact O-CB 3.32Å; E207-I210 WeakPolarHBondContact O-CB 3.35Å; E207-I210 PolarHBondContact O-N 3Å; E207-V211 PolarHBondContact O-N 2.84Å
208	R	92.3	Very high	93	Very high	40 Å²	40	55.6 Å²	55.6	15%	0.151	30%	0.301	C	S	.	.	H	α-helix	trans	-55.9	-34	173.3	-169.5	-175.2	-178	-77.8	-5.6	113	R185 T188 D189 M192 T204 T205 A206 V211 R212	R185-R208 PolarHBondContact O-NH2 3.13Å; R185-R208 VanDerWaalsContact O-NH2 3.07Å; T188-R208 HydrophobicContact CG2-CG 4.07Å; D189-R208 IonicContact OD1-CZ 3.03Å; D189-R208 IonicContact OD1-NE 2.89Å; D189-R208 PolarHBondContact OD1-NE 3.2Å; D189-R208 IonicContact OD1-NH2 3.85Å; D189-R208 PolarHBondContact OD1-NH2 3.09Å; D189-R208 IonicContact OD2-CZ 3.75Å; D189-R208 IonicContact OD2-NE 3.27Å; D189-R208 IonicContact OD2-NH2 2.72Å; D189-R208 PolarHBondContact OD2-NH2 3.4Å; M192-R208 HydrophobicContact SD-CB 4.47Å; M192-R208 HydrophobicContact SD-CG 4.46Å; T204-R208 PolarHBondContact O-N 3.38Å; T205-R208 WeakPolarHBondContact O-CB 3.35Å; T205-R208 PolarHBondContact O-N 3.25Å; A206-R208 VanDerWaalsContact C-N 3.28Å; A206-R208 PolarHBondContact O-N 3.11Å; R208-V211 PolarHBondContact O-N 3.16Å; R208-R212 PolarHBondContact O-N 3.2Å
209	E	90.8	Very high	93.3	Very high	31 Å²	31	51.6 Å²	51.6	15%	0.145	29%	0.286	C	S	.	.	H	α-helix	trans	-74	-31.5	175.8	-70.2	-65.4	127.1	0	0	113.2	Q61 A206 E207 V211 R212 D213	Q61-E209 PolarHBondContact NE2-OE2 3.31Å; A206-E209 WeakPolarHBondContact O-CB 3.5Å; A206-E209 PolarHBondContact O-N 3.17Å; A206-E209 VanDerWaalsContact O-N 3.12Å; E207-E209 PolarHBondContact O-N 3.01Å; E209-V211 VanDerWaalsContact C-N 3.27Å; E209-R212 WeakPolarHBondContact O-CB 3.32Å; E209-R212 PolarHBondContact O-N 3.15Å; E209-R212 IonicContact OE1-NE 3.71Å; E209-R212 IonicContact OE2-CZ 3.83Å; E209-R212 VanDerWaalsContact OE2-CZ 3.27Å; E209-R212 IonicContact OE2-NE 3.08Å; E209-R212 PolarHBondContact OE2-NE 2.86Å; E209-R212 IonicContact OE2-NH2 3.85Å; E209-R212 PolarHBondContact OE2-NH2 2.97Å; E209-D213 PolarHBondContact O-N 3.48Å
210	I	94.4	Very high	93.5	Very high	32 Å²	32	50.2 Å²	50.2	16%	0.164	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-44.1	171.9	-54.5	173.9	0	0	0	108.5	E207 R212 D213 I214 Y242 L244 P245	E207-I210 WeakPolarHBondContact O-CA 3.3Å; E207-I210 VanDerWaalsContact O-CB 3.32Å; E207-I210 WeakPolarHBondContact O-CB 3.35Å; E207-I210 PolarHBondContact O-N 3Å; I210-R212 VanDerWaalsContact C-N 3.31Å; I210-R212 PolarHBondContact O-N 2.79Å; I210-D213 PolarHBondContact O-N 3.28Å; I210-D213 VanDerWaalsContact O-N 3.12Å; I210-I214 HydrophobicContact CG2-CD1 4.18Å; I210-I214 VanDerWaalsContact O-CG1 3.31Å; I210-I214 WeakPolarHBondContact O-CG1 3.38Å; I210-I214 PolarHBondContact O-N 3.17Å; I210-Y242 HydrophobicContact CG2-CE1 3.81Å; I210-L244 HydrophobicContact CG2-CD2 3.62Å; I210-P245 HydrophobicContact CD1-CG 3.82Å; I210-P245 HydrophobicContact CG1-CG 4.23Å
211	V	97.3	Very high	93.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-38.6	174.6	-179.4	0	0	0	0	111.8	T188 L191 M192 L195 F202 E207 R208 E209 I214 K215	T188-V211 HydrophobicContact CG2-CB 4.34Å; T188-V211 HydrophobicContact CG2-CG1 4.16Å; L191-V211 HydrophobicContact CB-CG1 3.87Å; L191-V211 HydrophobicContact CD2-CG1 3.81Å; L191-V211 HydrophobicContact CG-CG1 3.77Å; M192-V211 HydrophobicContact CB-CG1 4.14Å; M192-V211 HydrophobicContact CB-CG2 4.44Å; M192-V211 HydrophobicContact CG-CG2 4.19Å; L195-V211 HydrophobicContact CD1-CG1 4.26Å; L195-V211 HydrophobicContact CD1-CG2 4.41Å; F202-V211 HydrophobicContact CB-CG2 4.01Å; F202-V211 HydrophobicContact CD1-CG2 4.17Å; F202-V211 HydrophobicContact CD2-CG2 3.59Å; F202-V211 HydrophobicContact CE2-CG2 4.04Å; F202-V211 HydrophobicContact CG-CG2 3.65Å; F202-V211 HydrophobicContact CZ-CG2 4.48Å; E207-V211 PolarHBondContact O-N 2.84Å; R208-V211 PolarHBondContact O-N 3.16Å; E209-V211 VanDerWaalsContact C-N 3.27Å; V211-I214 PolarHBondContact O-N 3.4Å; V211-K215 WeakPolarHBondContact O-CB 3.4Å; V211-K215 PolarHBondContact O-N 3.01Å
212	R	96.7	Very high	94.1	Very high	72 Å²	72	43.9 Å²	43.9	27%	0.272	23%	0.226	S	C	.	.	H	α-helix	trans	-61.5	-42.8	172.7	-173.6	-174.7	60.9	72.1	4.2	111.8	T188 R208 E209 I210 K215 E216	T188-R212 HydrophobicContact CG2-CB 3.95Å; R208-R212 PolarHBondContact O-N 3.2Å; E209-R212 WeakPolarHBondContact O-CB 3.32Å; E209-R212 PolarHBondContact O-N 3.15Å; E209-R212 IonicContact OE1-NE 3.71Å; E209-R212 IonicContact OE2-CZ 3.83Å; E209-R212 VanDerWaalsContact OE2-CZ 3.27Å; E209-R212 IonicContact OE2-NE 3.08Å; E209-R212 PolarHBondContact OE2-NE 2.86Å; E209-R212 IonicContact OE2-NH2 3.85Å; E209-R212 PolarHBondContact OE2-NH2 2.97Å; I210-R212 VanDerWaalsContact C-N 3.31Å; I210-R212 PolarHBondContact O-N 2.79Å; R212-K215 VanDerWaalsContact O-CB 3.32Å; R212-K215 WeakPolarHBondContact O-CB 3.3Å; R212-K215 PolarHBondContact O-N 2.83Å; R212-E216 WeakPolarHBondContact CG-OE1 3.13Å; R212-E216 IonicContact CZ-OE1 2.61Å; R212-E216 IonicContact NH1-OE1 2.94Å; R212-E216 PolarHBondContact NH1-OE1 2.95Å; R212-E216 IonicContact NH1-OE2 3.18Å; R212-E216 PolarHBondContact NH1-OE2 3.43Å; R212-E216 WeakPolarHBondContact O-CG 3.36Å; R212-E216 PolarHBondContact O-N 3.04Å
213	D	96.8	Very high	94.4	Very high	36 Å²	36	47.6 Å²	47.6	19%	0.193	25%	0.246	C	C	.	.	H	α-helix	trans	-66.8	-39.9	177.5	-175.7	73.3	0	0	0	112	E209 I210 K215 E216 K217 Y242	E209-D213 PolarHBondContact O-N 3.48Å; I210-D213 PolarHBondContact O-N 3.28Å; I210-D213 VanDerWaalsContact O-N 3.12Å; D213-K215 VanDerWaalsContact C-N 3.32Å; D213-K215 PolarHBondContact O-N 2.85Å; D213-E216 PolarHBondContact O-N 2.9Å; D213-K217 VanDerWaalsContact CG-NZ 3.27Å; D213-K217 WeakPolarHBondContact O-CB 3.19Å; D213-K217 WeakPolarHBondContact O-CG 3.28Å; D213-K217 PolarHBondContact O-N 3.24Å; D213-K217 WeakPolarHBondContact OD1-CE 3.13Å; D213-K217 IonicContact OD1-NZ 2.85Å; D213-K217 PolarHBondContact OD1-NZ 2.93Å; D213-K217 WeakPolarHBondContact OD2-CD 3.48Å; D213-K217 VanDerWaalsContact OD2-CE 3.31Å; D213-K217 WeakPolarHBondContact OD2-CE 3.42Å; D213-K217 IonicContact OD2-NZ 2.79Å; D213-K217 PolarHBondContact OD2-NZ 2.85Å; D213-Y242 VanDerWaalsContact OD2-CE2 3.28Å; D213-Y242 WeakPolarHBondContact OD2-CE2 3.32Å; D213-Y242 VanDerWaalsContact OD2-CZ 3.31Å; D213-Y242 PolarHBondContact OD2-OH 3.36Å
214	I	98.1	Very high	94.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-47.6	171.1	-68	166.2	0	0	0	110.1	L191 F202 I210 V211 E216 K217 L218 Y242 I250 I252	L191-I214 HydrophobicContact CD2-CB 4.49Å; L191-I214 HydrophobicContact CD2-CG2 4.12Å; F202-I214 HydrophobicContact CZ-CD1 4.48Å; I210-I214 HydrophobicContact CG2-CD1 4.18Å; I210-I214 VanDerWaalsContact O-CG1 3.31Å; I210-I214 WeakPolarHBondContact O-CG1 3.38Å; I210-I214 PolarHBondContact O-N 3.17Å; V211-I214 PolarHBondContact O-N 3.4Å; I214-E216 VanDerWaalsContact C-N 3.35Å; I214-E216 PolarHBondContact O-N 2.84Å; I214-K217 PolarHBondContact O-N 3.11Å; I214-L218 HydrophobicContact CG2-CD1 4.1Å; I214-L218 WeakPolarHBondContact O-CB 3.28Å; I214-L218 PolarHBondContact O-N 2.65Å; I214-Y242 HydrophobicContact CD1-CD1 4.05Å; I214-Y242 HydrophobicContact CD1-CE1 4.18Å; I214-Y242 HydrophobicContact CD1-CG 4.38Å; I214-Y242 HydrophobicContact CG1-CD1 3.79Å; I214-Y242 HydrophobicContact CG1-CD2 3.77Å; I214-Y242 HydrophobicContact CG1-CE1 3.79Å; I214-Y242 HydrophobicContact CG1-CE2 3.74Å; I214-Y242 HydrophobicContact CG1-CG 3.78Å; I214-I250 HydrophobicContact CD1-CD1 3.85Å; I214-I252 HydrophobicContact CG2-CD1 4.43Å; I214-I252 HydrophobicContact CG2-CG1 3.97Å
215	K	98.4	Very high	95.4	Very high	9 Å²	9	43 Å²	43	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-56.7	-47.8	177.5	-176.2	-165.1	76.4	-178.2	0	111.3	G184 L187 T188 L191 V211 R212 D213 C219 Y308	G184-K215 PolarHBondContact O-NZ 3.26Å; L187-K215 HydrophobicContact CB-CD 4.06Å; T188-K215 PolarHBondContact OG1-NZ 2.88Å; L191-K215 HydrophobicContact CD2-CB 3.67Å; L191-K215 HydrophobicContact CD2-CG 4.37Å; V211-K215 WeakPolarHBondContact O-CB 3.4Å; V211-K215 PolarHBondContact O-N 3.01Å; R212-K215 VanDerWaalsContact O-CB 3.32Å; R212-K215 WeakPolarHBondContact O-CB 3.3Å; R212-K215 PolarHBondContact O-N 2.83Å; D213-K215 VanDerWaalsContact C-N 3.32Å; D213-K215 PolarHBondContact O-N 2.85Å; K215-C219 VanDerWaalsContact O-CB 3.23Å; K215-C219 WeakPolarHBondContact O-CB 3.29Å; K215-C219 PolarHBondContact O-N 2.9Å; K215-Y308 WeakPolarHBondContact CD-OH 3.3Å; K215-Y308 HydrophobicContact CG-CE1 4.15Å; K215-Y308 WeakPolarHBondContact CG-OH 3.28Å
216	E	97.6	Very high	96.1	Very high	113 Å²	113	45.2 Å²	45.2	53%	0.528	22%	0.219	S	C	.	.	H	α-helix	trans	-70.9	-35.2	-177	-73.1	170.9	-160.5	0	0	112.9	R212 D213 I214	R212-E216 WeakPolarHBondContact CG-OE1 3.13Å; R212-E216 IonicContact CZ-OE1 2.61Å; R212-E216 IonicContact NH1-OE1 2.94Å; R212-E216 PolarHBondContact NH1-OE1 2.95Å; R212-E216 IonicContact NH1-OE2 3.18Å; R212-E216 PolarHBondContact NH1-OE2 3.43Å; R212-E216 WeakPolarHBondContact O-CG 3.36Å; R212-E216 PolarHBondContact O-N 3.04Å; D213-E216 PolarHBondContact O-N 2.9Å; I214-E216 VanDerWaalsContact C-N 3.35Å; I214-E216 PolarHBondContact O-N 2.84Å
217	K	98	Very high	96.7	Very high	136 Å²	136	47.8 Å²	47.8	59%	0.591	23%	0.226	S	C	*	.	H	α-helix	trans	-86	-36.6	-176.7	-73	176.7	179.6	160	0	114.3	D213 I214 Y242	D213-K217 VanDerWaalsContact CG-NZ 3.27Å; D213-K217 WeakPolarHBondContact O-CB 3.19Å; D213-K217 WeakPolarHBondContact O-CG 3.28Å; D213-K217 PolarHBondContact O-N 3.24Å; D213-K217 WeakPolarHBondContact OD1-CE 3.13Å; D213-K217 IonicContact OD1-NZ 2.85Å; D213-K217 PolarHBondContact OD1-NZ 2.93Å; D213-K217 WeakPolarHBondContact OD2-CD 3.48Å; D213-K217 VanDerWaalsContact OD2-CE 3.31Å; D213-K217 WeakPolarHBondContact OD2-CE 3.42Å; D213-K217 IonicContact OD2-NZ 2.79Å; D213-K217 PolarHBondContact OD2-NZ 2.85Å; I214-K217 PolarHBondContact O-N 3.11Å; K217-Y242 HydrophobicContact CD-CE2 4.25Å
218	L	98.3	Very high	97	Very high	26 Å²	26	46.8 Å²	46.8	14%	0.136	22%	0.222	C	C	.	.	H	α-helix	trans	-113.8	-25	-165.3	-54.5	-174.8	0	0	0	114.4	I214 K240 Y242 I252 R256	I214-L218 HydrophobicContact CG2-CD1 4.1Å; I214-L218 WeakPolarHBondContact O-CB 3.28Å; I214-L218 PolarHBondContact O-N 2.65Å; L218-K240 HydrophobicContact CD1-CB 4.42Å; L218-K240 HydrophobicContact CD2-CB 4.34Å; L218-Y242 HydrophobicContact CD1-CD2 4.11Å; L218-Y242 HydrophobicContact CD1-CG 4.46Å; L218-I252 HydrophobicContact CD1-CB 4.26Å; L218-I252 HydrophobicContact CD1-CG1 3.82Å; L218-R256 HydrophobicContact CB-CG 4.39Å; L218-R256 VanDerWaalsContact O-CZ 3.28Å; L218-R256 PolarHBondContact O-NE 3.37Å; L218-R256 PolarHBondContact O-NH2 2.93Å
219	C	98.6	Very high	97.2	Very high	4 Å²	4	47.5 Å²	47.5	3%	0.027	23%	0.227	C	C	.	.			trans	-75.3	152.9	-176.8	-70	0	0	0	0	112.4	K215 R256 P260 Y308	K215-C219 VanDerWaalsContact O-CB 3.23Å; K215-C219 WeakPolarHBondContact O-CB 3.29Å; K215-C219 PolarHBondContact O-N 2.9Å; C219-R256 WeakPolarHBondContact CA-O 3.44Å; C219-R256 WeakPolarHBondContact CB-O 3.08Å; C219-R256 PolarHBondContact SG-O 3.31Å; C219-P260 HydrophobicContact CB-CG 4.38Å; C219-Y308 HydrophobicContact CB-CD1 3.93Å; C219-Y308 HydrophobicContact CB-CE1 3.56Å
220	Y	98.8	Very high	97.5	Very high	34 Å²	34	48.8 Å²	48.8	13%	0.133	24%	0.243	C	C	.	.			trans	-153.7	155.8	179.1	65.6	-81.2	0	0	0	110	E228 R256 F257 P260	Y220-E228 WeakPolarHBondContact CE2-OE1 3.3Å; Y220-E228 PolarHBondContact OH-OE1 2.96Å; Y220-R256 HydrophobicContact CD1-CB 4.08Å; Y220-R256 HydrophobicContact CE1-CB 3.82Å; Y220-R256 PolarHBondContact N-O 2.88Å; Y220-R256 VanDerWaalsContact N-O 3.12Å; Y220-F257 HydrophobicContact CD1-CB 4.49Å; Y220-F257 HydrophobicContact CD2-CB 4.29Å; Y220-F257 HydrophobicContact CE1-CB 4.14Å; Y220-F257 HydrophobicContact CE1-CD1 4.19Å; Y220-F257 HydrophobicContact CE2-CB 3.94Å; Y220-F257 HydrophobicContact CE2-CD1 4.45Å; Y220-F257 HydrophobicContact CE2-CG 4.49Å; Y220-F257 AromaticContact CZ-CD1 3.74Å; Y220-F257 VanDerWaalsContact O-CA 3.26Å; Y220-F257 WeakPolarHBondContact O-CA 3.18Å; Y220-F257 WeakPolarHBondContact O-CB 3.38Å; Y220-F257 VanDerWaalsContact OH-CD1 3.3Å; Y220-F257 WeakPolarHBondContact OH-CD1 3.22Å; Y220-P260 WeakPolarHBondContact O-CG 3.24Å
221	V	98.8	Very high	97.6	Very high	4 Å²	4	49.5 Å²	49.5	2%	0.024	25%	0.249	C	C	.	.			trans	-91.9	122.5	174.9	172.8	0	0	0	0	108.8	P260 F264 Y308 P309 I311 R314	V221-P260 HydrophobicContact CG2-CB 3.81Å; V221-P260 HydrophobicContact CG2-CG 4.22Å; V221-F264 HydrophobicContact CG1-CE2 3.64Å; V221-F264 HydrophobicContact CG1-CZ 4.07Å; V221-F264 HydrophobicContact CG2-CE2 4.16Å; V221-Y308 HydrophobicContact CG2-CD2 4.45Å; V221-Y308 HydrophobicContact CG2-CG 4.33Å; V221-P309 PolarHBondContact N-O 3.28Å; V221-I311 HydrophobicContact CB-CB 4.35Å; V221-I311 HydrophobicContact CG2-CB 4.03Å; V221-I311 HydrophobicContact CG2-CG1 4.22Å; V221-R314 HydrophobicContact CG1-CB 3.52Å; V221-R314 HydrophobicContact CG1-CG 3.71Å
222	A	98.3	Very high	97.5	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	26%	0.259	C	S	.	.			trans	-75.7	141.6	173.3	0	0	0	0	0	111.1	E228 F257 R314	A222-E228 HydrophobicContact CB-CB 3.78Å; A222-E228 HydrophobicContact CB-CG 3.8Å; A222-F257 HydrophobicContact CB-CB 4.36Å; A222-F257 HydrophobicContact CB-CD2 4.45Å; A222-R314 WeakPolarHBondContact O-CD 3.2Å; A222-R314 PolarHBondContact O-NH1 2.82Å
223	L	98.1	Very high	97.4	Very high	91 Å²	91	51.5 Å²	51.5	48%	0.476	28%	0.282	S	S	.	.	S	Bend	trans	-70.6	-34.2	175.7	-176.1	65.6	0	0	0	112.1	D313 R314 K317	L223-D313 HydrophobicContact CD1-CB 4.21Å; L223-R314 WeakPolarHBondContact O-CD 3.36Å; L223-K317 HydrophobicContact CD1-CB 4.03Å; L223-K317 HydrophobicContact CD1-CD 3.81Å; L223-K317 HydrophobicContact CG-CD 4.09Å; L223-K317 PolarHBondContact O-NZ 3.08Å
224	D	97.8	Very high	97.3	Very high	73 Å²	73	54.6 Å²	54.6	39%	0.39	31%	0.306	S	S	.	.	S	Bend	trans	-133.6	100.4	174.8	-166.7	-53	0	0	0	108.5	E226 N227 E228 K317	D224-E226 PolarHBondContact O-N 2.74Å; D224-E226 PolarHBondContact OD1-N 3.34Å; D224-N227 HydrophobicContact CB-CB 4.1Å; D224-N227 PolarHBondContact OD1-N 3.33Å; D224-N227 VanDerWaalsContact OD1-N 3.09Å; D224-E228 WeakPolarHBondContact O-CB 3.18Å; D224-E228 PolarHBondContact O-N 2.82Å; D224-K317 IonicContact OD2-NZ 3.49Å; D224-K317 PolarHBondContact OD2-NZ 3.3Å
225	F	97.3	Very high	97	Very high	15 Å²	15	56.9 Å²	56.9	7%	0.066	32%	0.322	C	S	.	.	H	α-helix	trans	-62.4	-41.9	-173.1	177.3	-101.9	0	0	0	112.7	E228 M229 F257 R258 E261 F268	F225-E228 PolarHBondContact O-N 2.78Å; F225-M229 HydrophobicContact CD1-CG 4.29Å; F225-M229 HydrophobicContact CE1-CG 3.79Å; F225-M229 HydrophobicContact CE2-CG 4.11Å; F225-M229 HydrophobicContact CE2-SD 4.36Å; F225-M229 HydrophobicContact CZ-CG 3.68Å; F225-M229 HydrophobicContact CZ-SD 4.02Å; F225-M229 WeakPolarHBondContact O-CG 3.38Å; F225-M229 PolarHBondContact O-N 2.94Å; F225-F257 AromaticContact CD2-CD2 3.82Å; F225-F257 HydrophobicContact CD2-CD2 3.82Å; F225-F257 HydrophobicContact CD2-CE2 4.11Å; F225-F257 AromaticContact CE2-CD2 3.72Å; F225-F257 HydrophobicContact CE2-CD2 3.72Å; F225-F257 AromaticContact CE2-CE2 3.84Å; F225-F257 HydrophobicContact CE2-CE2 3.84Å; F225-R258 HydrophobicContact CE2-CG 3.95Å; F225-R258 HydrophobicContact CZ-CG 4.03Å; F225-E261 HydrophobicContact CB-CG 4.45Å; F225-E261 HydrophobicContact CD1-CG 4.21Å; F225-E261 HydrophobicContact CD2-CB 3.79Å; F225-E261 HydrophobicContact CD2-CG 3.48Å; F225-E261 VanDerWaalsContact CD2-CG 3.48Å; F225-E261 HydrophobicContact CE1-CG 4.36Å; F225-E261 HydrophobicContact CE2-CB 3.74Å; F225-E261 HydrophobicContact CE2-CG 3.68Å; F225-E261 HydrophobicContact CG-CG 3.78Å; F225-E261 HydrophobicContact CZ-CB 4.46Å; F225-E261 HydrophobicContact CZ-CG 4.12Å; F225-F268 HydrophobicContact CE1-CE2 4.37Å; F225-F268 AromaticContact CE1-CZ 3.95Å; F225-F268 HydrophobicContact CE1-CZ 3.95Å; F225-F268 HydrophobicContact CE2-CE2 4.46Å; F225-F268 AromaticContact CZ-CE2 3.89Å; F225-F268 HydrophobicContact CZ-CE2 3.89Å; F225-F268 AromaticContact CZ-CZ 3.91Å; F225-F268 HydrophobicContact CZ-CZ 3.91Å
226	E	97.1	Very high	96.7	Very high	126 Å²	126	60.4 Å²	60.4	59%	0.589	35%	0.348	S	S	*	.	H	α-helix	trans	-67.7	-42.6	-177.6	-64	-57.1	145.1	0	0	111.6	D224 E228 M229 A230	D224-E226 PolarHBondContact O-N 2.74Å; D224-E226 PolarHBondContact OD1-N 3.34Å; E226-E228 VanDerWaalsContact C-N 3.34Å; E226-M229 PolarHBondContact O-N 2.75Å; E226-A230 PolarHBondContact O-N 2.98Å
227	N	96.6	Very high	96.4	Very high	99 Å²	99	59 Å²	59	53%	0.529	35%	0.351	S	S	.	.	H	α-helix	trans	-66.9	-36.8	175.2	-173.7	42.2	0	0	0	112.1	D224 A230 T231	D224-N227 HydrophobicContact CB-CB 4.1Å; D224-N227 PolarHBondContact OD1-N 3.33Å; D224-N227 VanDerWaalsContact OD1-N 3.09Å; N227-A230 PolarHBondContact O-N 2.95Å; N227-T231 PolarHBondContact O-N 3.06Å; N227-T231 PolarHBondContact O-OG1 3.45Å
228	E	97.4	Very high	96.2	Very high	39 Å²	39	54 Å²	54	18%	0.182	33%	0.33	C	S	.	.	H	α-helix	trans	-64.9	-41.2	175.9	-160.8	78.5	-172.3	0	0	111.1	Y220 A222 D224 F225 E226 T231 A232 L238 F257	Y220-E228 WeakPolarHBondContact CE2-OE1 3.3Å; Y220-E228 PolarHBondContact OH-OE1 2.96Å; A222-E228 HydrophobicContact CB-CB 3.78Å; A222-E228 HydrophobicContact CB-CG 3.8Å; D224-E228 WeakPolarHBondContact O-CB 3.18Å; D224-E228 PolarHBondContact O-N 2.82Å; F225-E228 PolarHBondContact O-N 2.78Å; E226-E228 VanDerWaalsContact C-N 3.34Å; E228-T231 PolarHBondContact O-N 2.9Å; E228-A232 WeakPolarHBondContact O-CB 3.45Å; E228-A232 PolarHBondContact O-N 2.72Å; E228-L238 HydrophobicContact CG-CD1 4.24Å; E228-F257 HydrophobicContact CB-CD2 4.19Å; E228-F257 HydrophobicContact CB-CE2 3.87Å; E228-F257 HydrophobicContact CB-CZ 4.07Å; E228-F257 HydrophobicContact CG-CD1 3.79Å; E228-F257 HydrophobicContact CG-CD2 3.87Å; E228-F257 HydrophobicContact CG-CE1 3.66Å; E228-F257 HydrophobicContact CG-CE2 3.76Å; E228-F257 HydrophobicContact CG-CG 3.88Å; E228-F257 HydrophobicContact CG-CZ 3.66Å
229	M	97.4	Very high	96.1	Very high	54 Å²	54	56.7 Å²	56.7	27%	0.266	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-45.2	172.6	-79.7	-58.8	-63.1	0	0	112.2	F225 E226 T231 A232 A233 N254 F257 R258	F225-M229 HydrophobicContact CD1-CG 4.29Å; F225-M229 HydrophobicContact CE1-CG 3.79Å; F225-M229 HydrophobicContact CE2-CG 4.11Å; F225-M229 HydrophobicContact CE2-SD 4.36Å; F225-M229 HydrophobicContact CZ-CG 3.68Å; F225-M229 HydrophobicContact CZ-SD 4.02Å; F225-M229 WeakPolarHBondContact O-CG 3.38Å; F225-M229 PolarHBondContact O-N 2.94Å; E226-M229 PolarHBondContact O-N 2.75Å; M229-T231 VanDerWaalsContact C-N 3.34Å; M229-T231 PolarHBondContact O-N 3.11Å; M229-A232 PolarHBondContact O-N 3.45Å; M229-A233 PolarHBondContact O-N 3.28Å; M229-N254 HydrophobicContact SD-CB 4.33Å; M229-F257 HydrophobicContact CG-CE2 3.8Å; M229-F257 HydrophobicContact CG-CZ 4.3Å; M229-F257 HydrophobicContact SD-CE2 3.5Å; M229-F257 VanDerWaalsContact SD-CE2 3.5Å; M229-F257 HydrophobicContact SD-CZ 3.71Å; M229-R258 HydrophobicContact SD-CG 3.81Å
230	A	97.1	Very high	96	Very high	58 Å²	58	61.7 Å²	61.7	48%	0.479	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-42.7	176.4	0	0	0	0	0	111.8	E226 N227 A233 S234	E226-A230 PolarHBondContact O-N 2.98Å; N227-A230 PolarHBondContact O-N 2.95Å; A230-A233 PolarHBondContact O-N 3.46Å; A230-S234 PolarHBondContact O-N 3.28Å; A230-S234 VanDerWaalsContact O-N 3.17Å; A230-S234 PolarHBondContact O-OG 2.81Å
231	T	95.9	Very high	95.9	Very high	47 Å²	47	63.9 Å²	63.9	29%	0.288	38%	0.384	S	S	.	.	H	α-helix	trans	-61.8	-46.6	177.1	-59.2	0	0	0	0	110.9	N227 E228 M229 A233 S234 S235 L238	N227-T231 PolarHBondContact O-N 3.06Å; N227-T231 PolarHBondContact O-OG1 3.45Å; E228-T231 PolarHBondContact O-N 2.9Å; M229-T231 VanDerWaalsContact C-N 3.34Å; M229-T231 PolarHBondContact O-N 3.11Å; T231-A233 VanDerWaalsContact C-N 3.27Å; T231-A233 PolarHBondContact O-N 2.9Å; T231-S234 PolarHBondContact O-N 2.89Å; T231-S234 VanDerWaalsContact O-N 3.08Å; T231-S234 PolarHBondContact O-OG 3.28Å; T231-S235 WeakPolarHBondContact O-CB 3.14Å; T231-S235 PolarHBondContact O-N 3.11Å; T231-L238 HydrophobicContact CG2-CD1 4Å; T231-L238 HydrophobicContact CG2-CG 4.45Å
232	A	95.2	Very high	95.9	Very high	24 Å²	24	65.1 Å²	65.1	20%	0.198	39%	0.388	C	S	.	.	H	α-helix	trans	-63	-30.7	177.6	0	0	0	0	0	113.2	E228 M229 L238 N254 F257	E228-A232 WeakPolarHBondContact O-CB 3.45Å; E228-A232 PolarHBondContact O-N 2.72Å; M229-A232 PolarHBondContact O-N 3.45Å; A232-L238 HydrophobicContact CB-CD1 3.98Å; A232-N254 HydrophobicContact CB-CB 3.9Å; A232-F257 HydrophobicContact CB-CE1 4.12Å; A232-F257 HydrophobicContact CB-CZ 4.01Å
233	A	95.1	Very high	95.8	Very high	91 Å²	91	71.4 Å²	71.4	75%	0.752	42%	0.417	S	S	*	.	H	α-helix	trans	-72.3	-29.6	174.7	0	0	0	0	0	112.6	M229 A230 T231	M229-A233 PolarHBondContact O-N 3.28Å; A230-A233 PolarHBondContact O-N 3.46Å; T231-A233 VanDerWaalsContact C-N 3.27Å; T231-A233 PolarHBondContact O-N 2.9Å
234	S	93.9	Very high	95.6	Very high	101 Å²	101	68 Å²	68	71%	0.706	40%	0.399	S	S	*	.	H	α-helix	trans	-95.9	-13.9	-178.9	67.4	0	0	0	0	115.4	A230 T231	A230-S234 PolarHBondContact O-N 3.28Å; A230-S234 VanDerWaalsContact O-N 3.17Å; A230-S234 PolarHBondContact O-OG 2.81Å; T231-S234 PolarHBondContact O-N 2.89Å; T231-S234 VanDerWaalsContact O-N 3.08Å; T231-S234 PolarHBondContact O-OG 3.28Å
235	S	92.2	Very high	95.3	Very high	48 Å²	48	69.7 Å²	69.7	34%	0.336	41%	0.414	S	S	.	.			trans	-149.4	143.2	-169.7	-174.1	0	0	0	0	112.5	T231 S237	T231-S235 WeakPolarHBondContact O-CB 3.14Å; T231-S235 PolarHBondContact O-N 3.11Å; S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 WeakPolarHBondContact OG-CB 3.09Å; S235-S237 PolarHBondContact OG-N 3.44Å; S235-S237 VanDerWaalsContact OG-N 3.12Å; S235-S237 PolarHBondContact OG-OG 3.03Å
236	S	91.5	Very high	95	Very high	83 Å²	83	74.6 Å²	74.6	58%	0.58	44%	0.441	S	S	*	.	S	Bend	trans	-87.6	4.6	169.6	57.1	0	0	0	0	113.6	L238 E239	S236-L238 PolarHBondContact O-N 3.32Å; S236-L238 VanDerWaalsContact O-N 3.13Å; S236-E239 WeakPolarHBondContact O-CB 3.23Å; S236-E239 PolarHBondContact O-N 3.36Å
237	S	91.8	Very high	94.8	Very high	84 Å²	84	70.6 Å²	70.6	59%	0.587	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.9	-178.2	56.3	0	0	0	0	114.2	S235	S235-S237 VanDerWaalsContact C-N 3.32Å; S235-S237 WeakPolarHBondContact OG-CB 3.09Å; S235-S237 PolarHBondContact OG-N 3.44Å; S235-S237 VanDerWaalsContact OG-N 3.12Å; S235-S237 PolarHBondContact OG-OG 3.03Å
238	L	93.3	Very high	94.7	Very high	31 Å²	31	70.8 Å²	70.8	16%	0.162	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-8.2	177.5	-58	179.1	0	0	0	113	E228 T231 A232 S236 R256 F257	E228-L238 HydrophobicContact CG-CD1 4.24Å; T231-L238 HydrophobicContact CG2-CD1 4Å; T231-L238 HydrophobicContact CG2-CG 4.45Å; A232-L238 HydrophobicContact CB-CD1 3.98Å; S236-L238 PolarHBondContact O-N 3.32Å; S236-L238 VanDerWaalsContact O-N 3.13Å; L238-R256 PolarHBondContact O-NH1 2.9Å; L238-F257 HydrophobicContact CD1-CE1 4.27Å
239	E	95.8	Very high	94.6	Very high	81 Å²	81	73 Å²	73	38%	0.379	45%	0.447	S	S	.	.			trans	-71.9	143.4	179.1	-61.4	-167.5	144.5	0	0	111.5	R198 S236 T251 I252	R198-E239 IonicContact NH2-OE1 2.71Å; R198-E239 PolarHBondContact NH2-OE1 3.21Å; S236-E239 WeakPolarHBondContact O-CB 3.23Å; S236-E239 PolarHBondContact O-N 3.36Å; E239-T251 HydrophobicContact CB-CG2 3.78Å; E239-T251 HydrophobicContact CG-CG2 4.18Å; E239-I252 WeakPolarHBondContact CA-O 3.37Å
240	K	97.3	Very high	94.6	Very high	109 Å²	109	70.5 Å²	70.5	47%	0.474	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	140.5	173	-71.4	-67.7	-177.8	-178.3	0	110.3	L218 I252 R256	L218-K240 HydrophobicContact CD1-CB 4.42Å; L218-K240 HydrophobicContact CD2-CB 4.34Å; K240-I252 PolarHBondContact N-O 3.04Å; K240-I252 PolarHBondContact O-N 2.91Å; K240-R256 VanDerWaalsContact CG-CZ 3.42Å; K240-R256 VanDerWaalsContact CG-NH1 3.33Å
241	S	96.8	Very high	94.6	Very high	81 Å²	81	69.8 Å²	69.8	57%	0.566	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	147.4	173.8	-58.3	0	0	0	0	111.1	I250	S241-I250 CarbonylContact C-O 3.59Å; S241-I250 VanDerWaalsContact CA-O 3.27Å; S241-I250 WeakPolarHBondContact CA-O 3.48Å
242	Y	97.4	Very high	94.6	Very high	29 Å²	29	67.5 Å²	67.5	11%	0.114	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	133.4	175	-176.3	-88.3	0	0	0	109.3	I210 D213 I214 K217 L218 L244 V249 I250	I210-Y242 HydrophobicContact CG2-CE1 3.81Å; D213-Y242 VanDerWaalsContact OD2-CE2 3.28Å; D213-Y242 WeakPolarHBondContact OD2-CE2 3.32Å; D213-Y242 VanDerWaalsContact OD2-CZ 3.31Å; D213-Y242 PolarHBondContact OD2-OH 3.36Å; I214-Y242 HydrophobicContact CD1-CD1 4.05Å; I214-Y242 HydrophobicContact CD1-CE1 4.18Å; I214-Y242 HydrophobicContact CD1-CG 4.38Å; I214-Y242 HydrophobicContact CG1-CD1 3.79Å; I214-Y242 HydrophobicContact CG1-CD2 3.77Å; I214-Y242 HydrophobicContact CG1-CE1 3.79Å; I214-Y242 HydrophobicContact CG1-CE2 3.74Å; I214-Y242 HydrophobicContact CG1-CG 3.78Å; K217-Y242 HydrophobicContact CD-CE2 4.25Å; L218-Y242 HydrophobicContact CD1-CD2 4.11Å; L218-Y242 HydrophobicContact CD1-CG 4.46Å; Y242-L244 HydrophobicContact CD1-CD2 4.1Å; Y242-L244 HydrophobicContact CE1-CD2 4.05Å; Y242-V249 CarbonylContact O-C 3.58Å; Y242-V249 WeakPolarHBondContact O-CA 3.15Å; Y242-I250 HydrophobicContact CD1-CD1 4.44Å; Y242-I250 HydrophobicContact CD1-CG1 4.34Å; Y242-I250 PolarHBondContact N-O 2.85Å; Y242-I250 PolarHBondContact O-N 2.69Å
243	E	96.8	Very high	94.7	Very high	135 Å²	135	66.5 Å²	66.5	63%	0.631	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	118.8	177.4	-170.9	178.2	162.8	0	0	109.8	V249	E243-V249 HydrophobicContact CB-CG2 4.45Å; E243-V249 HydrophobicContact CG-CG2 4.38Å
244	L	94.3	Very high	94.8	Very high	19 Å²	19	64 Å²	64	10%	0.099	38%	0.377	C	S	.	.			trans	-71.8	161.2	175.4	-65.9	178.7	0	0	0	110.9	F202 I210 Y242 D246 G247 Q248 I250	F202-L244 HydrophobicContact CE1-CD2 4.14Å; F202-L244 HydrophobicContact CZ-CD2 4.4Å; I210-L244 HydrophobicContact CG2-CD2 3.62Å; Y242-L244 HydrophobicContact CD1-CD2 4.1Å; Y242-L244 HydrophobicContact CE1-CD2 4.05Å; L244-D246 WeakPolarHBondContact CB-OD1 3.4Å; L244-D246 PolarHBondContact O-N 2.87Å; L244-G247 PolarHBondContact O-N 2.87Å; L244-Q248 HydrophobicContact CB-CB 4.42Å; L244-Q248 VanDerWaalsContact CB-O 3.32Å; L244-Q248 WeakPolarHBondContact CB-O 3.4Å; L244-Q248 HydrophobicContact CD1-CB 4.13Å; L244-Q248 HydrophobicContact CD1-CG 4.31Å; L244-Q248 WeakPolarHBondContact CG-O 3.47Å; L244-Q248 PolarHBondContact N-O 2.87Å; L244-I250 HydrophobicContact CD1-CG2 3.77Å; L244-I250 HydrophobicContact CD2-CD1 4.01Å; L244-I250 HydrophobicContact CG-CD1 4.41Å; L244-I250 HydrophobicContact CG-CG1 4.49Å; L244-I250 HydrophobicContact CG-CG2 4.17Å
245	P	91	Very high	95	Very high	110 Å²	110	59.5 Å²	59.5	71%	0.714	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.4	179.9	-26.2	36	0	0	0	115.5	I210 G247	I210-P245 HydrophobicContact CD1-CG 3.82Å; I210-P245 HydrophobicContact CG1-CG 4.23Å; P245-G247 VanDerWaalsContact C-N 3.33Å
246	D	90.8	Very high	95.3	Very high	118 Å²	118	58.7 Å²	58.7	63%	0.631	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	1.9	175.3	62.8	0.4	0	0	0	113.3	L244 Q248	L244-D246 WeakPolarHBondContact CB-OD1 3.4Å; L244-D246 PolarHBondContact O-N 2.87Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 VanDerWaalsContact OD1-CB 3.25Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.4Å; D246-Q248 PolarHBondContact OD1-N 3.4Å
247	G	93.3	Very high	95.6	Very high	41 Å²	41	54.7 Å²	54.7	42%	0.423	31%	0.306	S	S	.	.	S	Bend	trans	85.2	-1.8	-177.2	0	0	0	0	0	114.3	L244 P245 V249	L244-G247 PolarHBondContact O-N 2.87Å; P245-G247 VanDerWaalsContact C-N 3.33Å; G247-V249 PolarHBondContact O-N 3.34Å
248	Q	94.5	Very high	95.9	Very high	104 Å²	104	53.1 Å²	53.1	49%	0.486	29%	0.287	S	S	.	.			trans	-70.4	129.3	175.8	179.1	179.3	-7.1	0	0	110.4	L244 D246 I250	L244-Q248 HydrophobicContact CB-CB 4.42Å; L244-Q248 VanDerWaalsContact CB-O 3.32Å; L244-Q248 WeakPolarHBondContact CB-O 3.4Å; L244-Q248 HydrophobicContact CD1-CB 4.13Å; L244-Q248 HydrophobicContact CD1-CG 4.31Å; L244-Q248 WeakPolarHBondContact CG-O 3.47Å; L244-Q248 PolarHBondContact N-O 2.87Å; D246-Q248 VanDerWaalsContact C-N 3.33Å; D246-Q248 VanDerWaalsContact OD1-CB 3.25Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.4Å; D246-Q248 PolarHBondContact OD1-N 3.4Å; Q248-I250 HydrophobicContact CG-CG2 4.45Å
249	V	96.3	Very high	96.2	Very high	85 Å²	85	51.6 Å²	51.6	52%	0.515	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	124	176	-177.2	0	0	0	0	110.2	Y242 E243 G247	Y242-V249 CarbonylContact O-C 3.58Å; Y242-V249 WeakPolarHBondContact O-CA 3.15Å; E243-V249 HydrophobicContact CB-CG2 4.45Å; E243-V249 HydrophobicContact CG-CG2 4.38Å; G247-V249 PolarHBondContact O-N 3.34Å
250	I	95.9	Very high	96.3	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	154.1	174.8	65	172.3	0	0	0	110.8	Y200 F202 I214 S241 Y242 L244 Q248 I252	Y200-I250 HydrophobicContact CD1-CB 4.33Å; Y200-I250 HydrophobicContact CD1-CG2 3.85Å; Y200-I250 HydrophobicContact CE1-CB 3.8Å; Y200-I250 HydrophobicContact CE1-CG2 3.5Å; Y200-I250 HydrophobicContact CE2-CB 4.08Å; F202-I250 HydrophobicContact CZ-CD1 3.96Å; I214-I250 HydrophobicContact CD1-CD1 3.85Å; S241-I250 CarbonylContact C-O 3.59Å; S241-I250 VanDerWaalsContact CA-O 3.27Å; S241-I250 WeakPolarHBondContact CA-O 3.48Å; Y242-I250 HydrophobicContact CD1-CD1 4.44Å; Y242-I250 HydrophobicContact CD1-CG1 4.34Å; Y242-I250 PolarHBondContact N-O 2.85Å; Y242-I250 PolarHBondContact O-N 2.69Å; L244-I250 HydrophobicContact CD1-CG2 3.77Å; L244-I250 HydrophobicContact CD2-CD1 4.01Å; L244-I250 HydrophobicContact CG-CD1 4.41Å; L244-I250 HydrophobicContact CG-CG1 4.49Å; L244-I250 HydrophobicContact CG-CG2 4.17Å; Q248-I250 HydrophobicContact CG-CG2 4.45Å; I250-I252 HydrophobicContact CD1-CD1 3.63Å; I250-I252 HydrophobicContact CG1-CD1 3.88Å
251	T	96.8	Very high	96.3	Very high	43 Å²	43	42.6 Å²	42.6	26%	0.264	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.1	179.1	-62.1	0	0	0	0	110.3	R198 Y200 E239	R198-T251 PolarHBondContact NE-O 3.37Å; Y200-T251 WeakPolarHBondContact CE2-O 3.45Å; Y200-T251 PolarHBondContact OH-N 2.89Å; Y200-T251 VanDerWaalsContact OH-N 3.11Å; E239-T251 HydrophobicContact CB-CG2 3.78Å; E239-T251 HydrophobicContact CG-CG2 4.18Å
252	I	97.3	Very high	96.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	122	175.8	-41.9	-48.3	0	0	0	108.3	L195 I214 L218 E239 K240 I250 E255 R256	L195-I252 HydrophobicContact CD2-CD1 3.7Å; L195-I252 HydrophobicContact CD2-CG2 4.24Å; I214-I252 HydrophobicContact CG2-CD1 4.43Å; I214-I252 HydrophobicContact CG2-CG1 3.97Å; L218-I252 HydrophobicContact CD1-CB 4.26Å; L218-I252 HydrophobicContact CD1-CG1 3.82Å; E239-I252 WeakPolarHBondContact CA-O 3.37Å; K240-I252 PolarHBondContact N-O 3.04Å; K240-I252 PolarHBondContact O-N 2.91Å; I250-I252 HydrophobicContact CD1-CD1 3.63Å; I250-I252 HydrophobicContact CG1-CD1 3.88Å; I252-E255 HydrophobicContact CG2-CB 4.13Å; I252-R256 HydrophobicContact CB-CG 4.05Å; I252-R256 HydrophobicContact CG2-CG 3.53Å; I252-R256 WeakPolarHBondContact O-CD 3.42Å
253	G	96.6	Very high	96.5	Very high	3 Å²	3	37.4 Å²	37.4	3%	0.031	21%	0.207	C	C	.	.			trans	-106.6	-117.2	-176	0	0	0	0	0	112	E255 R256	G253-E255 VanDerWaalsContact C-OE2 3.22Å; G253-E255 VanDerWaalsContact CA-OE2 3.29Å; G253-E255 WeakPolarHBondContact CA-OE2 3.4Å; G253-E255 PolarHBondContact N-OE2 3.3Å; G253-E255 PolarHBondContact O-N 3.18Å; G253-R256 WeakPolarHBondContact O-CB 3.47Å; G253-R256 WeakPolarHBondContact O-CD 3.38Å; G253-R256 WeakPolarHBondContact O-CG 3.44Å; G253-R256 PolarHBondContact O-N 3.04Å
254	N	97.2	Very high	96.5	Very high	38 Å²	38	31.2 Å²	31.2	20%	0.203	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-15.2	-177.3	67	26.7	0	0	0	114	M229 A232 R256 F257 R258	M229-N254 HydrophobicContact SD-CB 4.33Å; A232-N254 HydrophobicContact CB-CB 3.9Å; N254-R256 PolarHBondContact O-N 2.91Å; N254-R256 VanDerWaalsContact O-N 3.14Å; N254-F257 VanDerWaalsContact CA-CE1 3.49Å; N254-F257 HydrophobicContact CB-CE1 3.68Å; N254-F257 HydrophobicContact CB-CZ 3.66Å; N254-F257 PolarHBondContact O-N 3.04Å; N254-R258 WeakPolarHBondContact O-CB 3.21Å; N254-R258 VanDerWaalsContact O-CG 3.29Å; N254-R258 WeakPolarHBondContact O-CG 3.23Å; N254-R258 PolarHBondContact O-N 3.12Å; N254-R258 VanDerWaalsContact OD1-CD 3.22Å; N254-R258 WeakPolarHBondContact OD1-CD 3.35Å; N254-R258 PolarHBondContact OD1-NH1 3.09Å
255	E	97.9	Very high	96.7	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.028	19%	0.186	C	C	.	.	H	α-helix	trans	-58.9	-27.7	174.9	-56	79.1	-169.5	0	0	111.3	L191 I194 L195 R198 I252 G253 F257 C259	L191-E255 HydrophobicContact CD1-CB 4Å; I194-E255 HydrophobicContact CB-CG 4.31Å; I194-E255 HydrophobicContact CD1-CB 3.66Å; I194-E255 HydrophobicContact CD1-CG 3.96Å; I194-E255 HydrophobicContact CG1-CB 3.97Å; I194-E255 HydrophobicContact CG1-CG 3.85Å; L195-E255 HydrophobicContact CD2-CB 4.44Å; L195-E255 HydrophobicContact CD2-CG 4.31Å; R198-E255 VanDerWaalsContact CD-OE1 3.24Å; R198-E255 WeakPolarHBondContact CD-OE1 3.4Å; R198-E255 IonicContact CZ-OE1 3.28Å; R198-E255 IonicContact CZ-OE2 2.78Å; R198-E255 IonicContact NE-OE1 2.6Å; R198-E255 VanDerWaalsContact NH1-CD 3.34Å; R198-E255 IonicContact NH1-OE1 2.86Å; R198-E255 PolarHBondContact NH1-OE1 3.08Å; R198-E255 IonicContact NH1-OE2 3.9Å; R198-E255 PolarHBondContact NH1-OE2 3.33Å; R198-E255 VanDerWaalsContact NH1-OE2 3.08Å; I252-E255 HydrophobicContact CG2-CB 4.13Å; G253-E255 VanDerWaalsContact C-OE2 3.22Å; G253-E255 VanDerWaalsContact CA-OE2 3.29Å; G253-E255 WeakPolarHBondContact CA-OE2 3.4Å; G253-E255 PolarHBondContact N-OE2 3.3Å; G253-E255 PolarHBondContact O-N 3.18Å; E255-F257 VanDerWaalsContact C-N 3.28Å; E255-F257 PolarHBondContact O-N 3.48Å; E255-C259 VanDerWaalsContact O-CB 3.29Å; E255-C259 WeakPolarHBondContact O-CB 3.47Å; E255-C259 PolarHBondContact O-N 3.05Å
256	R	98.3	Very high	97	Very high	31 Å²	31	28.1 Å²	28.1	12%	0.117	15%	0.154	C	C	.	.	H	α-helix	trans	-56.2	-39.2	178.5	-65	176.6	64.2	-137.9	-10.4	112.7	L218 C219 Y220 L238 K240 I252 G253 N254 P260	L218-R256 HydrophobicContact CB-CG 4.39Å; L218-R256 VanDerWaalsContact O-CZ 3.28Å; L218-R256 PolarHBondContact O-NE 3.37Å; L218-R256 PolarHBondContact O-NH2 2.93Å; C219-R256 WeakPolarHBondContact CA-O 3.44Å; C219-R256 WeakPolarHBondContact CB-O 3.08Å; C219-R256 PolarHBondContact SG-O 3.31Å; Y220-R256 HydrophobicContact CD1-CB 4.08Å; Y220-R256 HydrophobicContact CE1-CB 3.82Å; Y220-R256 PolarHBondContact N-O 2.88Å; Y220-R256 VanDerWaalsContact N-O 3.12Å; L238-R256 PolarHBondContact O-NH1 2.9Å; K240-R256 VanDerWaalsContact CG-CZ 3.42Å; K240-R256 VanDerWaalsContact CG-NH1 3.33Å; I252-R256 HydrophobicContact CB-CG 4.05Å; I252-R256 HydrophobicContact CG2-CG 3.53Å; I252-R256 WeakPolarHBondContact O-CD 3.42Å; G253-R256 WeakPolarHBondContact O-CB 3.47Å; G253-R256 WeakPolarHBondContact O-CD 3.38Å; G253-R256 WeakPolarHBondContact O-CG 3.44Å; G253-R256 PolarHBondContact O-N 3.04Å; N254-R256 PolarHBondContact O-N 2.91Å; N254-R256 VanDerWaalsContact O-N 3.14Å; R256-P260 VanDerWaalsContact O-CD 3.32Å; R256-P260 WeakPolarHBondContact O-CD 3.44Å
257	F	98.4	Very high	97.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-108.8	-22.1	179.9	64.2	-94.4	0	0	0	113.5	Y220 A222 F225 E228 M229 A232 L238 N254 E255 C259 P260 E261	Y220-F257 HydrophobicContact CD1-CB 4.49Å; Y220-F257 HydrophobicContact CD2-CB 4.29Å; Y220-F257 HydrophobicContact CE1-CB 4.14Å; Y220-F257 HydrophobicContact CE1-CD1 4.19Å; Y220-F257 HydrophobicContact CE2-CB 3.94Å; Y220-F257 HydrophobicContact CE2-CD1 4.45Å; Y220-F257 HydrophobicContact CE2-CG 4.49Å; Y220-F257 AromaticContact CZ-CD1 3.74Å; Y220-F257 VanDerWaalsContact O-CA 3.26Å; Y220-F257 WeakPolarHBondContact O-CA 3.18Å; Y220-F257 WeakPolarHBondContact O-CB 3.38Å; Y220-F257 VanDerWaalsContact OH-CD1 3.3Å; Y220-F257 WeakPolarHBondContact OH-CD1 3.22Å; A222-F257 HydrophobicContact CB-CB 4.36Å; A222-F257 HydrophobicContact CB-CD2 4.45Å; F225-F257 AromaticContact CD2-CD2 3.82Å; F225-F257 HydrophobicContact CD2-CD2 3.82Å; F225-F257 HydrophobicContact CD2-CE2 4.11Å; F225-F257 AromaticContact CE2-CD2 3.72Å; F225-F257 HydrophobicContact CE2-CD2 3.72Å; F225-F257 AromaticContact CE2-CE2 3.84Å; F225-F257 HydrophobicContact CE2-CE2 3.84Å; E228-F257 HydrophobicContact CB-CD2 4.19Å; E228-F257 HydrophobicContact CB-CE2 3.87Å; E228-F257 HydrophobicContact CB-CZ 4.07Å; E228-F257 HydrophobicContact CG-CD1 3.79Å; E228-F257 HydrophobicContact CG-CD2 3.87Å; E228-F257 HydrophobicContact CG-CE1 3.66Å; E228-F257 HydrophobicContact CG-CE2 3.76Å; E228-F257 HydrophobicContact CG-CG 3.88Å; E228-F257 HydrophobicContact CG-CZ 3.66Å; M229-F257 HydrophobicContact CG-CE2 3.8Å; M229-F257 HydrophobicContact CG-CZ 4.3Å; M229-F257 HydrophobicContact SD-CE2 3.5Å; M229-F257 VanDerWaalsContact SD-CE2 3.5Å; M229-F257 HydrophobicContact SD-CZ 3.71Å; A232-F257 HydrophobicContact CB-CE1 4.12Å; A232-F257 HydrophobicContact CB-CZ 4.01Å; L238-F257 HydrophobicContact CD1-CE1 4.27Å; N254-F257 VanDerWaalsContact CA-CE1 3.49Å; N254-F257 HydrophobicContact CB-CE1 3.68Å; N254-F257 HydrophobicContact CB-CZ 3.66Å; N254-F257 PolarHBondContact O-N 3.04Å; E255-F257 VanDerWaalsContact C-N 3.28Å; E255-F257 PolarHBondContact O-N 3.48Å; F257-C259 VanDerWaalsContact C-N 3.33Å; F257-C259 PolarHBondContact O-N 3.4Å; F257-P260 WeakPolarHBondContact O-CD 3.33Å; F257-E261 WeakPolarHBondContact O-CB 3.46Å; F257-E261 PolarHBondContact O-N 3.39Å
258	R	98.3	Very high	97.4	Very high	50 Å²	50	26.9 Å²	26.9	19%	0.189	14%	0.141	C	C	.	.	H	α-helix	trans	-62.6	-37.9	169.8	-72.4	172.1	63.9	-154	-3.1	112.8	I194 E197 F225 M229 N254 E261	I194-R258 HydrophobicContact CD1-CB 4.28Å; E197-R258 IonicContact OE2-NH2 3.67Å; F225-R258 HydrophobicContact CE2-CG 3.95Å; F225-R258 HydrophobicContact CZ-CG 4.03Å; M229-R258 HydrophobicContact SD-CG 3.81Å; N254-R258 WeakPolarHBondContact O-CB 3.21Å; N254-R258 VanDerWaalsContact O-CG 3.29Å; N254-R258 WeakPolarHBondContact O-CG 3.23Å; N254-R258 PolarHBondContact O-N 3.12Å; N254-R258 VanDerWaalsContact OD1-CD 3.22Å; N254-R258 WeakPolarHBondContact OD1-CD 3.35Å; N254-R258 PolarHBondContact OD1-NH1 3.09Å; R258-E261 PolarHBondContact O-N 2.88Å
259	C	98.5	Very high	97.5	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-58.8	179	168.9	0	0	0	0	112.6	L187 L191 I194 E255 F257 E261 T262	L187-C259 PolarHBondContact O-SG 2.86Å; L191-C259 HydrophobicContact CB-CB 4.28Å; L191-C259 HydrophobicContact CD1-CB 4.02Å; I194-C259 HydrophobicContact CD1-CB 4.28Å; E255-C259 VanDerWaalsContact O-CB 3.29Å; E255-C259 WeakPolarHBondContact O-CB 3.47Å; E255-C259 PolarHBondContact O-N 3.05Å; F257-C259 VanDerWaalsContact C-N 3.33Å; F257-C259 PolarHBondContact O-N 3.4Å; C259-E261 VanDerWaalsContact C-N 3.27Å; C259-E261 PolarHBondContact O-N 3.19Å; C259-T262 WeakPolarHBondContact O-CB 3.42Å; C259-T262 PolarHBondContact O-N 2.89Å; C259-T262 PolarHBondContact O-OG1 3.49Å; C259-T262 VanDerWaalsContact O-OG1 3.09Å
260	P	98.4	Very high	97.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-73.5	-14.1	-180	30.1	-37.1	0	0	0	114	C219 Y220 V221 R256 F257 T262 L263 Y308	C219-P260 HydrophobicContact CB-CG 4.38Å; Y220-P260 WeakPolarHBondContact O-CG 3.24Å; V221-P260 HydrophobicContact CG2-CB 3.81Å; V221-P260 HydrophobicContact CG2-CG 4.22Å; R256-P260 VanDerWaalsContact O-CD 3.32Å; R256-P260 WeakPolarHBondContact O-CD 3.44Å; F257-P260 WeakPolarHBondContact O-CD 3.33Å; P260-T262 PolarHBondContact O-N 3.42Å; P260-L263 WeakPolarHBondContact O-CB 3.39Å; P260-L263 PolarHBondContact O-N 3.33Å; P260-L263 VanDerWaalsContact O-N 3.1Å; P260-Y308 HydrophobicContact CB-CD1 4.26Å; P260-Y308 HydrophobicContact CB-CD2 3.79Å; P260-Y308 HydrophobicContact CB-CE1 4.24Å; P260-Y308 HydrophobicContact CB-CE2 3.76Å; P260-Y308 HydrophobicContact CB-CG 4.04Å; P260-Y308 HydrophobicContact CG-CD1 4.5Å
261	E	98.6	Very high	97.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58.6	-27.9	170.3	-172	64.7	-161.4	0	0	111.6	F225 F257 R258 C259 L263 F264 Q265 F268 R314	F225-E261 HydrophobicContact CB-CG 4.45Å; F225-E261 HydrophobicContact CD1-CG 4.21Å; F225-E261 HydrophobicContact CD2-CB 3.79Å; F225-E261 HydrophobicContact CD2-CG 3.48Å; F225-E261 VanDerWaalsContact CD2-CG 3.48Å; F225-E261 HydrophobicContact CE1-CG 4.36Å; F225-E261 HydrophobicContact CE2-CB 3.74Å; F225-E261 HydrophobicContact CE2-CG 3.68Å; F225-E261 HydrophobicContact CG-CG 3.78Å; F225-E261 HydrophobicContact CZ-CB 4.46Å; F225-E261 HydrophobicContact CZ-CG 4.12Å; F257-E261 WeakPolarHBondContact O-CB 3.46Å; F257-E261 PolarHBondContact O-N 3.39Å; R258-E261 PolarHBondContact O-N 2.88Å; C259-E261 VanDerWaalsContact C-N 3.27Å; C259-E261 PolarHBondContact O-N 3.19Å; E261-L263 PolarHBondContact O-N 3.45Å; E261-L263 VanDerWaalsContact O-N 3.07Å; E261-F264 CarbonylContact O-C 3.59Å; E261-F264 WeakPolarHBondContact O-CA 3.46Å; E261-F264 PolarHBondContact O-N 2.75Å; E261-Q265 HydrophobicContact CG-CG 4.3Å; E261-Q265 PolarHBondContact O-N 2.83Å; E261-Q265 PolarHBondContact OE1-NE2 2.66Å; E261-F268 HydrophobicContact CB-CE2 4Å; E261-F268 HydrophobicContact CG-CE2 3.82Å; E261-F268 HydrophobicContact CG-CZ 4.22Å; E261-R314 IonicContact OE1-CZ 2.75Å; E261-R314 IonicContact OE1-NH1 3.62Å; E261-R314 IonicContact OE1-NH2 3.62Å; E261-R314 PolarHBondContact OE1-NH2 3.4Å; E261-R314 IonicContact OE2-CZ 3.35Å; E261-R314 IonicContact OE2-NH1 3.63Å; E261-R314 PolarHBondContact OE2-NH1 3.37Å; E261-R314 IonicContact OE2-NH2 3.08Å
262	T	98.1	Very high	97.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-27.4	175.3	-54.9	0	0	0	0	113	L182 L187 Y190 C259 P260 F264 Q265 P266 F268 I269	L182-T262 HydrophobicContact CD1-CG2 4.23Å; L182-T262 HydrophobicContact CD2-CG2 4.19Å; L182-T262 WeakPolarHBondContact CD2-O 3.48Å; L187-T262 HydrophobicContact CD2-CG2 4.21Å; Y190-T262 WeakPolarHBondContact CD1-OG1 3.14Å; Y190-T262 WeakPolarHBondContact CE1-OG1 3.49Å; C259-T262 WeakPolarHBondContact O-CB 3.42Å; C259-T262 PolarHBondContact O-N 2.89Å; C259-T262 PolarHBondContact O-OG1 3.49Å; C259-T262 VanDerWaalsContact O-OG1 3.09Å; P260-T262 PolarHBondContact O-N 3.42Å; T262-F264 VanDerWaalsContact C-N 3.27Å; T262-F264 PolarHBondContact O-N 2.76Å; T262-Q265 CarbonylContact O-C 3.58Å; T262-Q265 PolarHBondContact O-N 3.14Å; T262-P266 WeakPolarHBondContact O-CA 3.46Å; T262-P266 VanDerWaalsContact O-N 3.15Å; T262-F268 HydrophobicContact CG2-CB 4.37Å; T262-I269 HydrophobicContact CG2-CB 4.33Å; T262-I269 HydrophobicContact CG2-CD1 3.77Å; T262-I269 HydrophobicContact CG2-CG1 3.71Å; T262-I269 HydrophobicContact CG2-CG2 3.77Å
263	L	98.5	Very high	97.2	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-33.1	173	-66.8	172.7	0	0	0	112.4	L182 L187 P260 E261 G275 I276 T305 Y308 I311	L182-L263 HydrophobicContact CG-CD2 4.47Å; L187-L263 HydrophobicContact CD1-CD1 4.06Å; L187-L263 HydrophobicContact CD1-CD2 4.03Å; L187-L263 HydrophobicContact CD1-CG 3.94Å; L187-L263 HydrophobicContact CD2-CD2 4.44Å; L187-L263 HydrophobicContact CD2-CG 4.33Å; P260-L263 WeakPolarHBondContact O-CB 3.39Å; P260-L263 PolarHBondContact O-N 3.33Å; P260-L263 VanDerWaalsContact O-N 3.1Å; E261-L263 PolarHBondContact O-N 3.45Å; E261-L263 VanDerWaalsContact O-N 3.07Å; L263-G275 CarbonylContact O-C 3.56Å; L263-G275 VanDerWaalsContact O-CA 3.28Å; L263-G275 WeakPolarHBondContact O-CA 3.36Å; L263-I276 HydrophobicContact CB-CD1 3.9Å; L263-I276 HydrophobicContact CB-CG1 4.14Å; L263-I276 HydrophobicContact CB-CG2 4.2Å; L263-I276 HydrophobicContact CD1-CD1 4.39Å; L263-I276 HydrophobicContact CD2-CG2 4.34Å; L263-I276 PolarHBondContact O-N 3.4Å; L263-T305 HydrophobicContact CD1-CG2 3.9Å; L263-T305 HydrophobicContact CD2-CG2 4.04Å; L263-Y308 HydrophobicContact CD1-CD2 4.26Å; L263-Y308 HydrophobicContact CD1-CE2 4.19Å; L263-I311 HydrophobicContact CD1-CD1 4.44Å
264	F	98.6	Very high	97.2	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.022	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-32.5	177.4	-61	-91.7	0	0	0	111.2	V221 E261 T262 I276 H277 I311 R314 M315 E318	V221-F264 HydrophobicContact CG1-CE2 3.64Å; V221-F264 HydrophobicContact CG1-CZ 4.07Å; V221-F264 HydrophobicContact CG2-CE2 4.16Å; E261-F264 CarbonylContact O-C 3.59Å; E261-F264 WeakPolarHBondContact O-CA 3.46Å; E261-F264 PolarHBondContact O-N 2.75Å; T262-F264 VanDerWaalsContact C-N 3.27Å; T262-F264 PolarHBondContact O-N 2.76Å; F264-I276 HydrophobicContact CD1-CG1 4.22Å; F264-I276 HydrophobicContact CE1-CD1 4.08Å; F264-I276 HydrophobicContact CE1-CG1 4.02Å; F264-I276 HydrophobicContact CE2-CD1 4.1Å; F264-I276 HydrophobicContact CZ-CD1 3.78Å; F264-I276 HydrophobicContact CZ-CG1 4.21Å; F264-H277 HydrophobicContact CD1-CB 4.24Å; F264-H277 AromaticContact CD1-CG 3.98Å; F264-H277 AromaticContact CD1-ND1 3.48Å; F264-H277 WeakPolarHBondContact CD1-ND1 3.33Å; F264-H277 HydrophobicContact CE1-CB 4.34Å; F264-H277 PolarHBondContact O-CE1 3.13Å; F264-I311 HydrophobicContact CZ-CG1 4.3Å; F264-R314 HydrophobicContact CD1-CG 4.12Å; F264-R314 HydrophobicContact CE1-CB 4.38Å; F264-R314 HydrophobicContact CE1-CG 3.51Å; F264-R314 HydrophobicContact CE2-CG 4Å; F264-R314 HydrophobicContact CZ-CB 4.01Å; F264-R314 HydrophobicContact CZ-CG 3.44Å; F264-R314 VanDerWaalsContact CZ-CG 3.44Å; F264-M315 HydrophobicContact CE1-CG 4.3Å; F264-M315 HydrophobicContact CE1-SD 3.8Å; F264-M315 HydrophobicContact CZ-CG 4.28Å; F264-M315 HydrophobicContact CZ-SD 4.25Å; F264-E318 HydrophobicContact CD1-CG 4.21Å; F264-E318 HydrophobicContact CE1-CG 4.24Å
265	Q	97.9	Very high	97.3	Very high	60 Å²	60	35.4 Å²	35.4	28%	0.28	20%	0.199	S	C	.	.			trans	-125.9	79.1	-179.5	-56.9	-174.9	30.8	0	0	111.2	E261 T262 S267 F268	E261-Q265 HydrophobicContact CG-CG 4.3Å; E261-Q265 PolarHBondContact O-N 2.83Å; E261-Q265 PolarHBondContact OE1-NE2 2.66Å; T262-Q265 CarbonylContact O-C 3.58Å; T262-Q265 PolarHBondContact O-N 3.14Å; Q265-S267 PolarHBondContact O-N 3.42Å; Q265-F268 HydrophobicContact CB-CD1 4.22Å; Q265-F268 HydrophobicContact CB-CE1 4.19Å; Q265-F268 PolarHBondContact O-N 3Å; Q265-F268 VanDerWaalsContact O-N 3.13Å
266	P	97.9	Very high	97.3	Very high	4 Å²	4	35.2 Å²	35.2	3%	0.026	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-59.3	-17.7	179.9	-27.3	37.8	0	0	0	114.3	L182 T262 F268 I269 M271 S273	L182-P266 HydrophobicContact CD2-CB 3.92Å; L182-P266 HydrophobicContact CD2-CG 3.89Å; T262-P266 WeakPolarHBondContact O-CA 3.46Å; T262-P266 VanDerWaalsContact O-N 3.15Å; P266-F268 PolarHBondContact O-N 3.42Å; P266-F268 VanDerWaalsContact O-N 3.13Å; P266-I269 WeakPolarHBondContact O-CG1 3.3Å; P266-I269 PolarHBondContact O-N 2.81Å; P266-I269 VanDerWaalsContact O-N 3.13Å; P266-M271 CarbonylContact C-O 3.39Å; P266-M271 HydrophobicContact CB-CB 3.78Å; P266-M271 PolarHBondContact O-N 2.96Å; P266-M271 VanDerWaalsContact O-N 3.15Å; P266-S273 WeakPolarHBondContact CB-OG 3.35Å; P266-S273 WeakPolarHBondContact CG-O 3.47Å
267	S	97.2	Very high	97.3	Very high	77 Å²	77	34.5 Å²	34.5	54%	0.538	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-57.7	-23.6	174.5	59.4	0	0	0	0	113.7	Q265 I269 G270 M271	Q265-S267 PolarHBondContact O-N 3.42Å; S267-I269 PolarHBondContact O-N 2.8Å; S267-G270 PolarHBondContact O-N 2.96Å; S267-M271 WeakPolarHBondContact CA-O 3.49Å; S267-M271 PolarHBondContact N-O 2.62Å
268	F	94.4	Very high	97.3	Very high	56 Å²	56	38.5 Å²	38.5	25%	0.246	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-61	-25.1	176.7	-79	14.4	0	0	0	113.5	Y190 F225 E261 T262 Q265 P266	Y190-F268 HydrophobicContact CE1-CB 4.44Å; Y190-F268 HydrophobicContact CE1-CD2 4.33Å; Y190-F268 HydrophobicContact CE2-CB 4.41Å; Y190-F268 WeakPolarHBondContact OH-CD2 3.23Å; F225-F268 HydrophobicContact CE1-CE2 4.37Å; F225-F268 AromaticContact CE1-CZ 3.95Å; F225-F268 HydrophobicContact CE1-CZ 3.95Å; F225-F268 HydrophobicContact CE2-CE2 4.46Å; F225-F268 AromaticContact CZ-CE2 3.89Å; F225-F268 HydrophobicContact CZ-CE2 3.89Å; F225-F268 AromaticContact CZ-CZ 3.91Å; F225-F268 HydrophobicContact CZ-CZ 3.91Å; E261-F268 HydrophobicContact CB-CE2 4Å; E261-F268 HydrophobicContact CG-CE2 3.82Å; E261-F268 HydrophobicContact CG-CZ 4.22Å; T262-F268 HydrophobicContact CG2-CB 4.37Å; Q265-F268 HydrophobicContact CB-CD1 4.22Å; Q265-F268 HydrophobicContact CB-CE1 4.19Å; Q265-F268 PolarHBondContact O-N 3Å; Q265-F268 VanDerWaalsContact O-N 3.13Å; P266-F268 PolarHBondContact O-N 3.42Å; P266-F268 VanDerWaalsContact O-N 3.13Å
269	I	96.1	Very high	97.3	Very high	53 Å²	53	36.5 Å²	36.5	27%	0.272	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-109.6	14.1	174.8	57.4	171.2	0	0	0	112.3	L182 D186 Y190 T262 P266 S267 M271	L182-I269 HydrophobicContact CD1-CD1 3.55Å; L182-I269 HydrophobicContact CD2-CD1 4.32Å; L182-I269 HydrophobicContact CG-CD1 4.44Å; D186-I269 HydrophobicContact CB-CD1 4.49Å; Y190-I269 HydrophobicContact CD1-CG2 4.43Å; Y190-I269 HydrophobicContact CD2-CG2 3.52Å; Y190-I269 HydrophobicContact CE2-CG2 4.24Å; Y190-I269 HydrophobicContact CG-CG2 3.64Å; T262-I269 HydrophobicContact CG2-CB 4.33Å; T262-I269 HydrophobicContact CG2-CD1 3.77Å; T262-I269 HydrophobicContact CG2-CG1 3.71Å; T262-I269 HydrophobicContact CG2-CG2 3.77Å; P266-I269 WeakPolarHBondContact O-CG1 3.3Å; P266-I269 PolarHBondContact O-N 2.81Å; P266-I269 VanDerWaalsContact O-N 3.13Å; S267-I269 PolarHBondContact O-N 2.8Å; I269-M271 HydrophobicContact CD1-CG 4.04Å; I269-M271 HydrophobicContact CD1-SD 3.43Å; I269-M271 WeakPolarHBondContact CD1-SD 3.49Å; I269-M271 HydrophobicContact CG1-CB 4.44Å; I269-M271 HydrophobicContact CG1-CG 3.97Å; I269-M271 HydrophobicContact CG1-SD 4.03Å
270	G	95.4	Very high	97.3	Very high	66 Å²	66	36.6 Å²	36.6	68%	0.68	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.3	18.5	178.9	0	0	0	0	0	114.5	S267	S267-G270 PolarHBondContact O-N 2.96Å
271	M	95.3	Very high	97.4	Very high	55 Å²	55	39.2 Å²	39.2	27%	0.271	22%	0.219	S	C	.	.			trans	-90	129.8	174.7	-67.5	178.8	74.5	0	0	111	L180 L182 P266 S267 I269 S273	L180-M271 HydrophobicContact CD1-CE 4.27Å; L182-M271 HydrophobicContact CB-CE 4.17Å; L182-M271 HydrophobicContact CB-SD 4.04Å; P266-M271 CarbonylContact C-O 3.39Å; P266-M271 HydrophobicContact CB-CB 3.78Å; P266-M271 PolarHBondContact O-N 2.96Å; P266-M271 VanDerWaalsContact O-N 3.15Å; S267-M271 WeakPolarHBondContact CA-O 3.49Å; S267-M271 PolarHBondContact N-O 2.62Å; I269-M271 HydrophobicContact CD1-CG 4.04Å; I269-M271 HydrophobicContact CD1-SD 3.43Å; I269-M271 WeakPolarHBondContact CD1-SD 3.49Å; I269-M271 HydrophobicContact CG1-CB 4.44Å; I269-M271 HydrophobicContact CG1-CG 3.97Å; I269-M271 HydrophobicContact CG1-SD 4.03Å; M271-S273 PolarHBondContact O-N 3.49Å
272	E	94.6	Very high	97.4	Very high	207 Å²	207	42 Å²	42	97%	0.967	24%	0.235	S	C	*	.			trans	-88.9	28.1	174.9	-60.7	-173.3	166.3	0	0	112.6
273	S	95.1	Very high	97.4	Very high	41 Å²	41	42 Å²	42	29%	0.287	24%	0.235	S	C	.	.	S	Bend	trans	-95.5	152.6	177.1	57.8	0	0	0	0	111.6	L180 P266 M271	L180-S273 WeakPolarHBondContact CD1-OG 3.47Å; P266-S273 WeakPolarHBondContact CB-OG 3.35Å; P266-S273 WeakPolarHBondContact CG-O 3.47Å; M271-S273 PolarHBondContact O-N 3.49Å
274	A	97.6	Very high	97.4	Very high	30 Å²	30	42 Å²	42	25%	0.248	23%	0.234	C	C	.	.			trans	-63.9	148.3	169.7	0	0	0	0	0	112	E278 T279	A274-E278 HydrophobicContact CB-CB 3.88Å; A274-E278 VanDerWaalsContact CB-OE2 3.27Å; A274-E278 WeakPolarHBondContact CB-OE2 3.47Å; A274-T279 HydrophobicContact CB-CG2 3.94Å
275	G	98.2	Very high	97.3	Very high	1 Å²	1	44 Å²	44	1%	0.01	24%	0.244	C	C	.	.			trans	-72	176.2	176.7	0	0	0	0	0	114	L263 H277 E278 T279	L263-G275 CarbonylContact O-C 3.56Å; L263-G275 VanDerWaalsContact O-CA 3.28Å; L263-G275 WeakPolarHBondContact O-CA 3.36Å; G275-H277 VanDerWaalsContact C-N 3.3Å; G275-H277 PolarHBondContact O-N 2.83Å; G275-E278 PolarHBondContact O-N 3.37Å; G275-T279 WeakPolarHBondContact O-CB 3.37Å; G275-T279 WeakPolarHBondContact O-CG2 3.39Å; G275-T279 PolarHBondContact O-N 3.48Å; G275-T279 PolarHBondContact O-OG1 3.08Å
276	I	98.5	Very high	97.4	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-36.1	-177.1	58.7	169.2	0	0	0	113.5	L155 T162 L180 L263 F264 T279 T280 I311 M315	L155-I276 HydrophobicContact CD1-CB 4.27Å; L155-I276 HydrophobicContact CD1-CG2 4.41Å; L155-I276 HydrophobicContact CD2-CB 4.13Å; L155-I276 HydrophobicContact CD2-CD1 4.08Å; T162-I276 HydrophobicContact CG2-CG2 4.01Å; L180-I276 HydrophobicContact CD2-CG2 4.2Å; L263-I276 HydrophobicContact CB-CD1 3.9Å; L263-I276 HydrophobicContact CB-CG1 4.14Å; L263-I276 HydrophobicContact CB-CG2 4.2Å; L263-I276 HydrophobicContact CD1-CD1 4.39Å; L263-I276 HydrophobicContact CD2-CG2 4.34Å; L263-I276 PolarHBondContact O-N 3.4Å; F264-I276 HydrophobicContact CD1-CG1 4.22Å; F264-I276 HydrophobicContact CE1-CD1 4.08Å; F264-I276 HydrophobicContact CE1-CG1 4.02Å; F264-I276 HydrophobicContact CE2-CD1 4.1Å; F264-I276 HydrophobicContact CZ-CD1 3.78Å; F264-I276 HydrophobicContact CZ-CG1 4.21Å; I276-T279 VanDerWaalsContact CA-OG1 3.28Å; I276-T279 WeakPolarHBondContact CA-OG1 3.49Å; I276-T279 PolarHBondContact O-OG1 3.35Å; I276-T280 WeakPolarHBondContact O-CB 3.17Å; I276-T280 PolarHBondContact O-N 3.5Å; I276-T280 PolarHBondContact O-OG1 3.28Å; I276-I311 HydrophobicContact CD1-CD1 4.23Å; I276-M315 HydrophobicContact CD1-SD 3.83Å; I276-M315 HydrophobicContact CG1-SD 3.88Å
277	H	98.6	Very high	97.4	Very high	16 Å²	16	46 Å²	46	7%	0.074	25%	0.252	C	S	.	.	H	α-helix	trans	-69.5	-47.7	179.6	61.4	-66.9	0	0	0	112.1	F264 G275 T280 Y281 M315 E318	F264-H277 HydrophobicContact CD1-CB 4.24Å; F264-H277 AromaticContact CD1-CG 3.98Å; F264-H277 AromaticContact CD1-ND1 3.48Å; F264-H277 WeakPolarHBondContact CD1-ND1 3.33Å; F264-H277 HydrophobicContact CE1-CB 4.34Å; F264-H277 PolarHBondContact O-CE1 3.13Å; G275-H277 VanDerWaalsContact C-N 3.3Å; G275-H277 PolarHBondContact O-N 2.83Å; H277-T280 PolarHBondContact O-N 3.04Å; H277-Y281 PolarHBondContact O-N 3.09Å; H277-M315 HydrophobicContact CB-SD 3.93Å; H277-E318 HydrophobicContact CB-CB 3.59Å; H277-E318 HydrophobicContact CB-CG 4.09Å; H277-E318 IonicContact CD2-OE2 3.75Å
278	E	98.4	Very high	97.4	Very high	83 Å²	83	47.8 Å²	47.8	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-43	174.7	-76.7	178.2	-148.7	0	0	112	A274 G275 T280 Y281 N282 L322	A274-E278 HydrophobicContact CB-CB 3.88Å; A274-E278 VanDerWaalsContact CB-OE2 3.27Å; A274-E278 WeakPolarHBondContact CB-OE2 3.47Å; G275-E278 PolarHBondContact O-N 3.37Å; E278-T280 VanDerWaalsContact C-N 3.32Å; E278-T280 PolarHBondContact O-N 2.92Å; E278-Y281 PolarHBondContact O-N 2.88Å; E278-N282 VanDerWaalsContact O-CB 3.28Å; E278-N282 WeakPolarHBondContact O-CB 3.43Å; E278-N282 PolarHBondContact O-N 3.32Å; E278-N282 PolarHBondContact O-ND2 3.19Å; E278-N282 VanDerWaalsContact O-ND2 3.16Å; E278-L322 HydrophobicContact CG-CD1 4.32Å
279	T	98.4	Very high	97.5	Very high	9 Å²	9	51.1 Å²	51.1	6%	0.055	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-34.9	178.1	51.5	0	0	0	0	112.2	N164 A274 G275 I276 S283	N164-T279 WeakPolarHBondContact ND2-CB 3.43Å; N164-T279 PolarHBondContact ND2-OG1 3.2Å; A274-T279 HydrophobicContact CB-CG2 3.94Å; G275-T279 WeakPolarHBondContact O-CB 3.37Å; G275-T279 WeakPolarHBondContact O-CG2 3.39Å; G275-T279 PolarHBondContact O-N 3.48Å; G275-T279 PolarHBondContact O-OG1 3.08Å; I276-T279 VanDerWaalsContact CA-OG1 3.28Å; I276-T279 WeakPolarHBondContact CA-OG1 3.49Å; I276-T279 PolarHBondContact O-OG1 3.35Å; T279-S283 WeakPolarHBondContact O-CB 3.35Å; T279-S283 PolarHBondContact O-N 3.36Å
280	T	98.7	Very high	97.5	Very high	1 Å²	1	55.6 Å²	55.6	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-51.8	170.3	-53.7	0	0	0	0	110.5	I153 N164 I276 H277 E278 N282 S283 I284 N299 M315 I319	I153-T280 HydrophobicContact CD1-CG2 3.96Å; I153-T280 HydrophobicContact CG2-CG2 4.44Å; N164-T280 WeakPolarHBondContact OD1-CA 3.41Å; N164-T280 PolarHBondContact OD1-OG1 3.13Å; I276-T280 WeakPolarHBondContact O-CB 3.17Å; I276-T280 PolarHBondContact O-N 3.5Å; I276-T280 PolarHBondContact O-OG1 3.28Å; H277-T280 PolarHBondContact O-N 3.04Å; E278-T280 VanDerWaalsContact C-N 3.32Å; E278-T280 PolarHBondContact O-N 2.92Å; T280-N282 PolarHBondContact O-N 2.67Å; T280-S283 WeakPolarHBondContact O-CB 3.44Å; T280-S283 PolarHBondContact O-N 3.3Å; T280-I284 HydrophobicContact CG2-CD1 4.41Å; T280-I284 WeakPolarHBondContact O-CG1 3.47Å; T280-I284 PolarHBondContact O-N 3.01Å; T280-I284 VanDerWaalsContact O-N 3.12Å; T280-N299 WeakPolarHBondContact CG2-OD1 3.5Å; T280-M315 WeakPolarHBondContact OG1-CE 3.36Å; T280-I319 HydrophobicContact CG2-CD1 3.78Å
281	Y	98.6	Very high	97.6	Very high	55 Å²	55	53.2 Å²	53.2	22%	0.216	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-47	178.3	171.6	-94.8	0	0	0	112.3	H277 E278 S283 I284 M285 Y296 L322	H277-Y281 PolarHBondContact O-N 3.09Å; E278-Y281 PolarHBondContact O-N 2.88Å; Y281-S283 VanDerWaalsContact C-N 3.31Å; Y281-S283 PolarHBondContact O-N 2.95Å; Y281-I284 PolarHBondContact O-N 2.72Å; Y281-M285 HydrophobicContact CD1-CG 4.11Å; Y281-M285 HydrophobicContact CD2-CE 4.45Å; Y281-M285 HydrophobicContact CD2-CG 4.42Å; Y281-M285 HydrophobicContact CE1-CG 3.61Å; Y281-M285 HydrophobicContact CE2-CE 3.66Å; Y281-M285 HydrophobicContact CE2-CG 3.95Å; Y281-M285 HydrophobicContact CE2-SD 4.39Å; Y281-M285 HydrophobicContact CG-CG 4.48Å; Y281-M285 WeakPolarHBondContact O-CG 3.4Å; Y281-M285 PolarHBondContact O-N 3.4Å; Y281-Y296 VanDerWaalsContact CD2-OH 3.3Å; Y281-Y296 WeakPolarHBondContact CD2-OH 3.47Å; Y281-Y296 VanDerWaalsContact CE2-OH 3.28Å; Y281-Y296 WeakPolarHBondContact CE2-OH 3.46Å; Y281-L322 HydrophobicContact CD2-CB 3.71Å; Y281-L322 HydrophobicContact CE2-CB 4.1Å; Y281-L322 VanDerWaalsContact CE2-O 3.27Å; Y281-L322 WeakPolarHBondContact CE2-O 3.43Å; Y281-L322 HydrophobicContact CG-CB 4.03Å; Y281-L322 HydrophobicContact CG-CD1 4.2Å
282	N	98.6	Very high	97.7	Very high	60 Å²	60	53 Å²	53	32%	0.321	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-37.4	179.8	-71.5	-26.1	0	0	0	111.9	M178 E278 T280 M285 K286	M178-N282 HydrophobicContact CE-CB 4.32Å; E278-N282 VanDerWaalsContact O-CB 3.28Å; E278-N282 WeakPolarHBondContact O-CB 3.43Å; E278-N282 PolarHBondContact O-N 3.32Å; E278-N282 PolarHBondContact O-ND2 3.19Å; E278-N282 VanDerWaalsContact O-ND2 3.16Å; T280-N282 PolarHBondContact O-N 2.67Å; N282-M285 PolarHBondContact O-N 3.21Å; N282-K286 WeakPolarHBondContact O-CG 3.42Å; N282-K286 PolarHBondContact O-N 3.46Å
283	S	98.6	Very high	97.9	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.2	-45.5	173.7	-177.4	0	0	0	0	111.6	P166 A176 T279 T280 Y281 M285 K286 C287	P166-S283 WeakPolarHBondContact CD-OG 3.09Å; P166-S283 WeakPolarHBondContact CG-OG 3.1Å; A176-S283 WeakPolarHBondContact O-CB 3.1Å; A176-S283 PolarHBondContact O-OG 3.15Å; T279-S283 WeakPolarHBondContact O-CB 3.35Å; T279-S283 PolarHBondContact O-N 3.36Å; T280-S283 WeakPolarHBondContact O-CB 3.44Å; T280-S283 PolarHBondContact O-N 3.3Å; Y281-S283 VanDerWaalsContact C-N 3.31Å; Y281-S283 PolarHBondContact O-N 2.95Å; S283-M285 VanDerWaalsContact C-N 3.32Å; S283-M285 PolarHBondContact O-N 3Å; S283-K286 PolarHBondContact O-N 3.46Å; S283-C287 PolarHBondContact O-SG 2.9Å
284	I	98.4	Very high	98	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-39.3	175.1	-61.4	171.7	0	0	0	111	I153 T280 Y281 K286 C287 R292 L295 Y296	I153-I284 HydrophobicContact CD1-CD1 4.36Å; I153-I284 HydrophobicContact CD1-CG1 3.69Å; I153-I284 HydrophobicContact CG2-CD1 4.14Å; I153-I284 HydrophobicContact CG2-CG1 4.32Å; T280-I284 HydrophobicContact CG2-CD1 4.41Å; T280-I284 WeakPolarHBondContact O-CG1 3.47Å; T280-I284 PolarHBondContact O-N 3.01Å; T280-I284 VanDerWaalsContact O-N 3.12Å; Y281-I284 PolarHBondContact O-N 2.72Å; I284-K286 VanDerWaalsContact C-N 3.28Å; I284-K286 PolarHBondContact O-N 2.94Å; I284-C287 VanDerWaalsContact O-CB 3.31Å; I284-C287 WeakPolarHBondContact O-CB 3.28Å; I284-C287 PolarHBondContact O-N 2.78Å; I284-C287 VanDerWaalsContact O-N 3.1Å; I284-R292 HydrophobicContact CG2-CB 3.89Å; I284-R292 HydrophobicContact CG2-CG 3.94Å; I284-R292 PolarHBondContact O-NE 3.04Å; I284-L295 HydrophobicContact CD1-CB 4.42Å; I284-L295 HydrophobicContact CG1-CB 4.11Å; I284-L295 HydrophobicContact CG1-CD1 4.46Å; I284-L295 HydrophobicContact CG2-CB 4.26Å; I284-L295 HydrophobicContact CG2-CD1 4.33Å; I284-Y296 HydrophobicContact CB-CE1 4.46Å; I284-Y296 HydrophobicContact CD1-CD1 3.47Å; I284-Y296 VanDerWaalsContact CD1-CD1 3.47Å; I284-Y296 HydrophobicContact CD1-CE1 3.46Å; I284-Y296 VanDerWaalsContact CD1-CE1 3.46Å; I284-Y296 HydrophobicContact CD1-CG 4.21Å; I284-Y296 HydrophobicContact CG2-CD1 4.48Å; I284-Y296 HydrophobicContact CG2-CD2 4.16Å; I284-Y296 HydrophobicContact CG2-CE1 4.11Å; I284-Y296 HydrophobicContact CG2-CE2 3.75Å
285	M	98	Very high	98	Very high	46 Å²	46	49.7 Å²	49.7	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-70.2	-20.9	179.2	-74	-65.8	138.5	0	0	114.1	Y281 N282 S283 C287 R292 Y296	Y281-M285 HydrophobicContact CD1-CG 4.11Å; Y281-M285 HydrophobicContact CD2-CE 4.45Å; Y281-M285 HydrophobicContact CD2-CG 4.42Å; Y281-M285 HydrophobicContact CE1-CG 3.61Å; Y281-M285 HydrophobicContact CE2-CE 3.66Å; Y281-M285 HydrophobicContact CE2-CG 3.95Å; Y281-M285 HydrophobicContact CE2-SD 4.39Å; Y281-M285 HydrophobicContact CG-CG 4.48Å; Y281-M285 WeakPolarHBondContact O-CG 3.4Å; Y281-M285 PolarHBondContact O-N 3.4Å; N282-M285 PolarHBondContact O-N 3.21Å; S283-M285 VanDerWaalsContact C-N 3.32Å; S283-M285 PolarHBondContact O-N 3Å; M285-C287 VanDerWaalsContact C-N 3.31Å; M285-R292 PolarHBondContact O-NH2 3.2Å; M285-R292 PolarHBondContact SD-NH1 3.12Å; M285-Y296 HydrophobicContact CE-CE2 4.21Å; M285-Y296 WeakPolarHBondContact CE-OH 3.35Å
286	K	98.3	Very high	98	Very high	105 Å²	105	49.6 Å²	49.6	46%	0.457	24%	0.241	S	C	.	.	H	α-helix	trans	-77	-17.2	170.4	-75.7	179.7	174.3	-173.3	0	113.4	A176 M178 N282 S283 I284	A176-K286 HydrophobicContact CB-CB 3.77Å; M178-K286 HydrophobicContact SD-CD 4.05Å; M178-K286 PolarHBondContact SD-NZ 3.38Å; N282-K286 WeakPolarHBondContact O-CG 3.42Å; N282-K286 PolarHBondContact O-N 3.46Å; S283-K286 PolarHBondContact O-N 3.46Å; I284-K286 VanDerWaalsContact C-N 3.28Å; I284-K286 PolarHBondContact O-N 2.94Å
287	C	98.1	Very high	98	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.014	25%	0.25	C	S	.	.	S	Bend	trans	-82.9	159.9	178.9	-62.5	0	0	0	0	111.8	A176 S283 I284 M285 I291 R292 L295	A176-C287 WeakPolarHBondContact CB-SG 3.32Å; S283-C287 PolarHBondContact O-SG 2.9Å; I284-C287 VanDerWaalsContact O-CB 3.31Å; I284-C287 WeakPolarHBondContact O-CB 3.28Å; I284-C287 PolarHBondContact O-N 2.78Å; I284-C287 VanDerWaalsContact O-N 3.1Å; M285-C287 VanDerWaalsContact C-N 3.31Å; C287-I291 HydrophobicContact CB-CD1 3.87Å; C287-I291 HydrophobicContact CB-CG1 4.04Å; C287-R292 VanDerWaalsContact O-CZ 3.3Å; C287-R292 PolarHBondContact O-NE 3Å; C287-R292 PolarHBondContact O-NH2 2.85Å; C287-L295 HydrophobicContact CB-CD1 3.76Å; C287-L295 VanDerWaalsContact SG-CD1 3.59Å
288	D	97.3	Very high	98	Very high	114 Å²	114	51.5 Å²	51.5	61%	0.61	26%	0.255	S	S	*	.			trans	-59.2	143.7	175.6	-66.6	-33.5	0	0	0	111.8	D290 I291 R292	D288-D290 PolarHBondContact O-N 3.4Å; D288-I291 HydrophobicContact CB-CG1 4.37Å; D288-I291 WeakPolarHBondContact O-CG1 3.31Å; D288-I291 PolarHBondContact O-N 3.12Å; D288-R292 WeakPolarHBondContact O-CG 3.49Å; D288-R292 PolarHBondContact O-N 2.87Å
289	I	96.4	Very high	98	Very high	126 Å²	126	47.8 Å²	47.8	65%	0.646	24%	0.238	S	C	*	.	H	α-helix	trans	-56.5	-39.2	-172.8	-65.9	170.9	0	0	0	111.6	I291 R292	I289-I291 VanDerWaalsContact C-N 3.26Å; I289-I291 PolarHBondContact O-N 2.94Å; I289-R292 PolarHBondContact O-N 3.2Å
290	D	96.8	Very high	98	Very high	147 Å²	147	47.4 Å²	47.4	79%	0.786	24%	0.235	S	C	*	.	H	α-helix	trans	-65	-28.5	-174.2	-63.6	-27.6	0	0	0	113	D288	D288-D290 PolarHBondContact O-N 3.4Å
291	I	97.5	Very high	98	Very high	16 Å²	16	47.4 Å²	47.4	8%	0.082	24%	0.235	C	C	.	.	H	α-helix	trans	-94.7	-14.6	-177.8	67.3	166.3	0	0	0	113.2	Y168 L173 C287 D288 I289 K293 D294 L295	Y168-I291 HydrophobicContact CD2-CB 3.94Å; Y168-I291 HydrophobicContact CD2-CD1 4.36Å; Y168-I291 HydrophobicContact CD2-CG2 3.61Å; Y168-I291 HydrophobicContact CE1-CG2 4.42Å; Y168-I291 HydrophobicContact CE2-CB 4Å; Y168-I291 HydrophobicContact CE2-CG2 3.34Å; Y168-I291 HydrophobicContact CG-CG2 4.28Å; L173-I291 HydrophobicContact CD1-CD1 3.49Å; L173-I291 VanDerWaalsContact CD1-CD1 3.49Å; C287-I291 HydrophobicContact CB-CD1 3.87Å; C287-I291 HydrophobicContact CB-CG1 4.04Å; D288-I291 HydrophobicContact CB-CG1 4.37Å; D288-I291 WeakPolarHBondContact O-CG1 3.31Å; D288-I291 PolarHBondContact O-N 3.12Å; I289-I291 VanDerWaalsContact C-N 3.26Å; I289-I291 PolarHBondContact O-N 2.94Å; I291-K293 PolarHBondContact O-N 2.84Å; I291-D294 PolarHBondContact O-N 3.44Å; I291-L295 HydrophobicContact CD1-CD1 4.28Å; I291-L295 HydrophobicContact CG1-CD1 4.32Å; I291-L295 WeakPolarHBondContact O-CG 3.39Å; I291-L295 PolarHBondContact O-N 3.22Å; I291-L295 VanDerWaalsContact O-N 3.1Å
292	R	97.9	Very high	97.9	Very high	51 Å²	51	44.8 Å²	44.8	19%	0.192	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-35.8	-175.3	-62.2	-174.6	-171.2	179.9	0	113	I284 M285 C287 D288 I289 D294 L295 Y296	I284-R292 HydrophobicContact CG2-CB 3.89Å; I284-R292 HydrophobicContact CG2-CG 3.94Å; I284-R292 PolarHBondContact O-NE 3.04Å; M285-R292 PolarHBondContact O-NH2 3.2Å; M285-R292 PolarHBondContact SD-NH1 3.12Å; C287-R292 VanDerWaalsContact O-CZ 3.3Å; C287-R292 PolarHBondContact O-NE 3Å; C287-R292 PolarHBondContact O-NH2 2.85Å; D288-R292 WeakPolarHBondContact O-CG 3.49Å; D288-R292 PolarHBondContact O-N 2.87Å; I289-R292 PolarHBondContact O-N 3.2Å; R292-D294 VanDerWaalsContact C-N 3.29Å; R292-D294 PolarHBondContact O-N 2.99Å; R292-L295 PolarHBondContact O-N 3.4Å; R292-Y296 HydrophobicContact CB-CD2 4.39Å; R292-Y296 HydrophobicContact CB-CE2 4.33Å; R292-Y296 WeakPolarHBondContact O-CB 3.36Å; R292-Y296 WeakPolarHBondContact O-CD2 3.49Å; R292-Y296 PolarHBondContact O-N 3.39Å
293	K	97.6	Very high	97.9	Very high	141 Å²	141	42.3 Å²	42.3	61%	0.613	21%	0.214	S	C	*	.	H	α-helix	trans	-59	-43.3	177.6	-178.7	-176.9	174	-172.8	0	111.2	I291 A297 M327	I291-K293 PolarHBondContact O-N 2.84Å; K293-A297 WeakPolarHBondContact O-CB 3.46Å; K293-A297 PolarHBondContact O-N 2.85Å; K293-A297 VanDerWaalsContact O-N 3.1Å; K293-M327 HydrophobicContact CB-SD 4.22Å; K293-M327 HydrophobicContact CG-SD 4.48Å
294	D	97.6	Very high	97.8	Very high	67 Å²	67	44.4 Å²	44.4	36%	0.358	24%	0.235	S	C	.	.	H	α-helix	trans	-72.5	-37.2	-179.9	-64.7	-26.7	0	0	0	111.4	T151 I291 R292 A297 N298	T151-D294 HydrophobicContact CG2-CB 3.81Å; I291-D294 PolarHBondContact O-N 3.44Å; R292-D294 VanDerWaalsContact C-N 3.29Å; R292-D294 PolarHBondContact O-N 2.99Å; D294-A297 PolarHBondContact O-N 3.26Å; D294-N298 WeakPolarHBondContact O-CB 3.27Å; D294-N298 PolarHBondContact O-N 3.25Å; D294-N298 VanDerWaalsContact O-N 3.15Å; D294-N298 PolarHBondContact O-ND2 3.07Å
295	L	98.1	Very high	97.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.3	-46.6	173.8	-60.3	179.9	0	0	0	111.4	G152 I153 P166 I284 C287 I291 R292 A297 N298 N299	G152-L295 VanDerWaalsContact C-CD2 3.46Å; G152-L295 WeakPolarHBondContact O-CD2 3.27Å; I153-L295 HydrophobicContact CB-CD2 4.49Å; P166-L295 HydrophobicContact CB-CD1 4.07Å; P166-L295 HydrophobicContact CB-CD2 4.21Å; I284-L295 HydrophobicContact CD1-CB 4.42Å; I284-L295 HydrophobicContact CG1-CB 4.11Å; I284-L295 HydrophobicContact CG1-CD1 4.46Å; I284-L295 HydrophobicContact CG2-CB 4.26Å; I284-L295 HydrophobicContact CG2-CD1 4.33Å; C287-L295 HydrophobicContact CB-CD1 3.76Å; C287-L295 VanDerWaalsContact SG-CD1 3.59Å; I291-L295 HydrophobicContact CD1-CD1 4.28Å; I291-L295 HydrophobicContact CG1-CD1 4.32Å; I291-L295 WeakPolarHBondContact O-CG 3.39Å; I291-L295 PolarHBondContact O-N 3.22Å; I291-L295 VanDerWaalsContact O-N 3.1Å; R292-L295 PolarHBondContact O-N 3.4Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 3.43Å; L295-N298 CarbonylContact O-C 3.59Å; L295-N298 PolarHBondContact O-N 3.39Å; L295-N298 VanDerWaalsContact O-N 3.14Å; L295-N299 PolarHBondContact O-ND2 3.2Å; L295-N299 VanDerWaalsContact O-ND2 3.08Å
296	Y	98.3	Very high	97.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-35.9	176.2	-80.1	-52.5	0	0	0	113.6	Y281 I284 M285 R292 N298 N299 I319 A323 M327 K328 I329 K330	Y281-Y296 VanDerWaalsContact CD2-OH 3.3Å; Y281-Y296 WeakPolarHBondContact CD2-OH 3.47Å; Y281-Y296 VanDerWaalsContact CE2-OH 3.28Å; Y281-Y296 WeakPolarHBondContact CE2-OH 3.46Å; I284-Y296 HydrophobicContact CB-CE1 4.46Å; I284-Y296 HydrophobicContact CD1-CD1 3.47Å; I284-Y296 VanDerWaalsContact CD1-CD1 3.47Å; I284-Y296 HydrophobicContact CD1-CE1 3.46Å; I284-Y296 VanDerWaalsContact CD1-CE1 3.46Å; I284-Y296 HydrophobicContact CD1-CG 4.21Å; I284-Y296 HydrophobicContact CG2-CD1 4.48Å; I284-Y296 HydrophobicContact CG2-CD2 4.16Å; I284-Y296 HydrophobicContact CG2-CE1 4.11Å; I284-Y296 HydrophobicContact CG2-CE2 3.75Å; M285-Y296 HydrophobicContact CE-CE2 4.21Å; M285-Y296 WeakPolarHBondContact CE-OH 3.35Å; R292-Y296 HydrophobicContact CB-CD2 4.39Å; R292-Y296 HydrophobicContact CB-CE2 4.33Å; R292-Y296 WeakPolarHBondContact O-CB 3.36Å; R292-Y296 WeakPolarHBondContact O-CD2 3.49Å; R292-Y296 PolarHBondContact O-N 3.39Å; Y296-N298 PolarHBondContact O-N 2.92Å; Y296-N299 WeakPolarHBondContact CA-ND2 3.46Å; Y296-N299 PolarHBondContact O-ND2 2.76Å; Y296-I319 HydrophobicContact CD1-CG2 3.99Å; Y296-I319 HydrophobicContact CE1-CG2 3.93Å; Y296-A323 HydrophobicContact CD1-CB 4.34Å; Y296-A323 HydrophobicContact CE1-CB 3.74Å; Y296-A323 HydrophobicContact CE2-CB 4.35Å; Y296-M327 HydrophobicContact CD2-CB 4.02Å; Y296-M327 HydrophobicContact CD2-CG 3.76Å; Y296-M327 HydrophobicContact CD2-SD 4.06Å; Y296-M327 HydrophobicContact CE2-CB 4.5Å; Y296-M327 HydrophobicContact CE2-CG 3.99Å; Y296-M327 HydrophobicContact CG-CB 4.42Å; Y296-K328 CarbonylContact C-O 3.58Å; Y296-I329 HydrophobicContact CD1-CD1 3.37Å; Y296-I329 HydrophobicContact CD2-CD1 4.42Å; Y296-I329 HydrophobicContact CE1-CD1 4.07Å; Y296-I329 HydrophobicContact CG-CD1 3.59Å; Y296-K330 PolarHBondContact O-N 2.78Å
297	A	97.8	Very high	97.8	Very high	26 Å²	26	40.9 Å²	40.9	22%	0.215	22%	0.221	C	C	.	.	H	α-helix	trans	-77.6	-9.5	178.3	0	0	0	0	0	113.5	K293 D294 L295 K330	K293-A297 WeakPolarHBondContact O-CB 3.46Å; K293-A297 PolarHBondContact O-N 2.85Å; K293-A297 VanDerWaalsContact O-N 3.1Å; D294-A297 PolarHBondContact O-N 3.26Å; L295-A297 VanDerWaalsContact C-N 3.31Å; L295-A297 PolarHBondContact O-N 3.43Å; A297-K330 WeakPolarHBondContact O-CB 3.25Å
298	N	98	Very high	97.9	Very high	33 Å²	33	41.4 Å²	41.4	18%	0.176	22%	0.223	C	C	.	.			trans	-138.7	63	-175.4	-61.4	-70.7	0	0	0	111.4	R149 G152 I153 D294 L295 Y296 I332	R149-N298 VanDerWaalsContact CD-OD1 3.3Å; R149-N298 WeakPolarHBondContact CD-OD1 3.21Å; R149-N298 PolarHBondContact NE-OD1 3.12Å; G152-N298 CarbonylContact C-O 3.51Å; G152-N298 VanDerWaalsContact CA-O 3.29Å; G152-N298 WeakPolarHBondContact CA-O 3.42Å; I153-N298 PolarHBondContact N-O 3.24Å; D294-N298 WeakPolarHBondContact O-CB 3.27Å; D294-N298 PolarHBondContact O-N 3.25Å; D294-N298 VanDerWaalsContact O-N 3.15Å; D294-N298 PolarHBondContact O-ND2 3.07Å; L295-N298 CarbonylContact O-C 3.59Å; L295-N298 PolarHBondContact O-N 3.39Å; L295-N298 VanDerWaalsContact O-N 3.14Å; Y296-N298 PolarHBondContact O-N 2.92Å; N298-I332 HydrophobicContact CB-CD1 4.48Å
299	N	98.3	Very high	97.9	Very high	5 Å²	5	40 Å²	40	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	105.4	170.9	-71.3	-101.2	0	0	0	109.2	I153 T280 L295 Y296 K330 I331 I332	I153-N299 HydrophobicContact CG2-CB 4.18Å; I153-N299 WeakPolarHBondContact CG2-OD1 3.19Å; I153-N299 CarbonylContact O-C 3.53Å; I153-N299 WeakPolarHBondContact O-CA 3.32Å; T280-N299 WeakPolarHBondContact CG2-OD1 3.5Å; L295-N299 PolarHBondContact O-ND2 3.2Å; L295-N299 VanDerWaalsContact O-ND2 3.08Å; Y296-N299 WeakPolarHBondContact CA-ND2 3.46Å; Y296-N299 PolarHBondContact O-ND2 2.76Å; N299-K330 WeakPolarHBondContact CB-O 3.41Å; N299-K330 PolarHBondContact N-O 3.46Å; N299-K330 VanDerWaalsContact N-O 3.14Å; N299-I331 HydrophobicContact CB-CD1 3.61Å; N299-I331 CarbonylContact O-C 3.54Å; N299-I332 PolarHBondContact O-N 2.87Å
300	V	98.6	Very high	98	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.3	-178	-178.2	0	0	0	0	110.2	L144 I153 V154 L155 I332	L144-V300 HydrophobicContact CD1-CB 4.37Å; L144-V300 HydrophobicContact CD1-CG2 3.66Å; I153-V300 PolarHBondContact O-N 3.37Å; V154-V300 CarbonylContact C-O 3.5Å; V154-V300 WeakPolarHBondContact CA-O 3.49Å; V154-V300 HydrophobicContact CG2-CB 4.33Å; L155-V300 PolarHBondContact N-O 3.28Å; V300-I332 WeakPolarHBondContact CA-O 3.46Å; V300-I332 HydrophobicContact CG2-CB 4.26Å; V300-I332 HydrophobicContact CG2-CD1 4.04Å
301	L	98.6	Very high	98.1	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132	174	-55.6	-168.7	0	0	0	110.4	L155 T306 I311 A312 I331 I332 A333 R337	L155-L301 HydrophobicContact CB-CD2 3.91Å; L155-L301 HydrophobicContact CD2-CD2 3.85Å; L155-L301 HydrophobicContact CG-CD2 4.26Å; L301-T306 HydrophobicContact CB-CG2 4.4Å; L301-I311 HydrophobicContact CD1-CG2 4.03Å; L301-A312 HydrophobicContact CD1-CB 4.3Å; L301-I331 HydrophobicContact CD1-CG2 3.87Å; L301-I331 HydrophobicContact CD2-CG2 4.14Å; L301-I331 HydrophobicContact CG-CG2 3.84Å; L301-I332 PolarHBondContact N-O 3.28Å; L301-A333 HydrophobicContact CB-CB 4.33Å; L301-A333 HydrophobicContact CD1-CB 3.98Å; L301-A333 HydrophobicContact CG-CB 4.33Å; L301-R337 WeakPolarHBondContact O-CB 3.37Å
302	S	98.2	Very high	98.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	154.2	179	171.6	0	0	0	0	110.9	S143 L155 D156 S157 T306	S143-S302 WeakPolarHBondContact OG-CB 3.12Å; S143-S302 PolarHBondContact OG-OG 3.15Å; L155-S302 PolarHBondContact O-N 3.43Å; D156-S302 WeakPolarHBondContact CA-O 3.1Å; D156-S302 WeakPolarHBondContact OD1-CB 3.4Å; D156-S302 PolarHBondContact OD1-OG 2.88Å; S157-S302 PolarHBondContact N-O 3.25Å; S302-T306 WeakPolarHBondContact O-CG2 3.33Å; S302-T306 PolarHBondContact O-OG1 2.8Å
303	G	97	Very high	98.2	Very high	8 Å²	8	31.7 Å²	31.7	8%	0.082	19%	0.191	C	C	.	.	S	Bend	trans	91.8	154.5	171.3	0	0	0	0	0	113.9	D156 S157 T305 T306 R337	D156-G303 PolarHBondContact OD1-N 3.26Å; S157-G303 CarbonylContact O-C 3.55Å; S157-G303 WeakPolarHBondContact O-CA 3.41Å; G303-T305 VanDerWaalsContact C-N 3.28Å; G303-T305 PolarHBondContact O-N 3.33Å; G303-T306 PolarHBondContact O-N 3.44Å; G303-T306 VanDerWaalsContact O-N 3.07Å; G303-T306 PolarHBondContact O-OG1 2.79Å; G303-R337 PolarHBondContact N-O 2.88Å
304	G	97.2	Very high	98.2	Very high	44 Å²	44	25.6 Å²	25.6	45%	0.454	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-60.8	-31.8	-170.4	0	0	0	0	0	114.4	S157 T306 M307	S157-G304 PolarHBondContact O-N 3.34Å; G304-T306 PolarHBondContact O-N 2.93Å; G304-M307 WeakPolarHBondContact O-CB 3.48Å; G304-M307 VanDerWaalsContact O-CG 3.22Å; G304-M307 WeakPolarHBondContact O-CG 3.4Å; G304-M307 PolarHBondContact O-N 3.49Å; G304-M307 VanDerWaalsContact O-N 3.11Å
305	T	98.5	Very high	98.3	Very high	8 Å²	8	22.5 Å²	22.5	5%	0.049	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-75.3	-15.5	-179.5	-62.8	0	0	0	0	112.2	S157 G158 G184 L187 L263 G303 M307 Y308	S157-T305 WeakPolarHBondContact O-CB 3.46Å; S157-T305 PolarHBondContact O-N 3.05Å; S157-T305 WeakPolarHBondContact OG-CB 3.19Å; S157-T305 WeakPolarHBondContact OG-CG2 3.46Å; G158-T305 WeakPolarHBondContact O-CB 3.29Å; G158-T305 PolarHBondContact O-OG1 2.93Å; G184-T305 WeakPolarHBondContact CA-OG1 3.49Å; G184-T305 PolarHBondContact N-OG1 2.72Å; G184-T305 VanDerWaalsContact N-OG1 3.13Å; L187-T305 HydrophobicContact CD1-CG2 3.63Å; L263-T305 HydrophobicContact CD1-CG2 3.9Å; L263-T305 HydrophobicContact CD2-CG2 4.04Å; G303-T305 VanDerWaalsContact C-N 3.28Å; G303-T305 PolarHBondContact O-N 3.33Å; T305-M307 PolarHBondContact O-N 2.98Å; T305-Y308 HydrophobicContact CG2-CE2 4.07Å; T305-Y308 WeakPolarHBondContact O-CD2 3.43Å; T305-Y308 WeakPolarHBondContact O-CE2 3.34Å
306	T	98.6	Very high	98.3	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.006	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-83.6	6.7	169.8	73.9	0	0	0	0	113.3	L301 S302 G303 G304 Y308 I311 R337	L301-T306 HydrophobicContact CB-CG2 4.4Å; S302-T306 WeakPolarHBondContact O-CG2 3.33Å; S302-T306 PolarHBondContact O-OG1 2.8Å; G303-T306 PolarHBondContact O-N 3.44Å; G303-T306 VanDerWaalsContact O-N 3.07Å; G303-T306 PolarHBondContact O-OG1 2.79Å; G304-T306 PolarHBondContact O-N 2.93Å; T306-Y308 VanDerWaalsContact C-N 3.31Å; T306-Y308 PolarHBondContact O-N 3.48Å; T306-I311 VanDerWaalsContact O-CG2 3.32Å; T306-I311 WeakPolarHBondContact O-CG2 3.24Å; T306-R337 PolarHBondContact O-NE 2.81Å; T306-R337 PolarHBondContact O-NH2 2.8Å; T306-R337 WeakPolarHBondContact OG1-CD 3.5Å
307	M	98.4	Very high	98.3	Very high	68 Å²	68	29.7 Å²	29.7	34%	0.335	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-80	-9.3	-179.9	-66.4	-63.4	-64.8	0	0	114	G304 T305 R337 K338	G304-M307 WeakPolarHBondContact O-CB 3.48Å; G304-M307 VanDerWaalsContact O-CG 3.22Å; G304-M307 WeakPolarHBondContact O-CG 3.4Å; G304-M307 PolarHBondContact O-N 3.49Å; G304-M307 VanDerWaalsContact O-N 3.11Å; T305-M307 PolarHBondContact O-N 2.98Å; M307-R337 HydrophobicContact SD-CG 3.42Å; M307-R337 WeakPolarHBondContact SD-CG 3.38Å; M307-K338 HydrophobicContact CG-CB 4.23Å; M307-K338 HydrophobicContact SD-CB 4.17Å
308	Y	98.6	Very high	98.4	Very high	14 Å²	14	30.3 Å²	30.3	6%	0.055	18%	0.178	C	C	.	.	S	Bend	trans	-56.1	130.3	179.4	-67.8	-62.6	0	0	0	111.9	L187 K215 C219 V221 P260 L263 T305 T306 G310 I311	L187-Y308 HydrophobicContact CD1-CE2 3.69Å; L187-Y308 WeakPolarHBondContact CD1-OH 3.3Å; K215-Y308 WeakPolarHBondContact CD-OH 3.3Å; K215-Y308 HydrophobicContact CG-CE1 4.15Å; K215-Y308 WeakPolarHBondContact CG-OH 3.28Å; C219-Y308 HydrophobicContact CB-CD1 3.93Å; C219-Y308 HydrophobicContact CB-CE1 3.56Å; V221-Y308 HydrophobicContact CG2-CD2 4.45Å; V221-Y308 HydrophobicContact CG2-CG 4.33Å; P260-Y308 HydrophobicContact CB-CD1 4.26Å; P260-Y308 HydrophobicContact CB-CD2 3.79Å; P260-Y308 HydrophobicContact CB-CE1 4.24Å; P260-Y308 HydrophobicContact CB-CE2 3.76Å; P260-Y308 HydrophobicContact CB-CG 4.04Å; P260-Y308 HydrophobicContact CG-CD1 4.5Å; L263-Y308 HydrophobicContact CD1-CD2 4.26Å; L263-Y308 HydrophobicContact CD1-CE2 4.19Å; T305-Y308 HydrophobicContact CG2-CE2 4.07Å; T305-Y308 WeakPolarHBondContact O-CD2 3.43Å; T305-Y308 WeakPolarHBondContact O-CE2 3.34Å; T306-Y308 VanDerWaalsContact C-N 3.31Å; T306-Y308 PolarHBondContact O-N 3.48Å; Y308-G310 PolarHBondContact O-N 2.6Å; Y308-I311 WeakPolarHBondContact O-CB 3.44Å; Y308-I311 WeakPolarHBondContact O-CG2 3.48Å; Y308-I311 PolarHBondContact O-N 2.84Å
309	P	98.6	Very high	98.4	Very high	85 Å²	85	28.7 Å²	28.7	55%	0.552	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	139.5	169.1	-24.7	34.5	0	0	0	110.9	V221 I311	V221-P309 PolarHBondContact N-O 3.28Å; P309-I311 VanDerWaalsContact C-N 3.31Å; P309-I311 PolarHBondContact O-N 2.87Å
310	G	98.4	Very high	98.4	Very high	27 Å²	27	32 Å²	32	28%	0.278	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	-9.1	179.3	0	0	0	0	0	116	Y308 A312 D313 R314	Y308-G310 PolarHBondContact O-N 2.6Å; G310-A312 VanDerWaalsContact C-N 3.33Å; G310-A312 PolarHBondContact O-N 2.96Å; G310-D313 PolarHBondContact O-N 3.11Å; G310-R314 PolarHBondContact O-N 2.8Å
311	I	98.7	Very high	98.3	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-62.8	-38.4	-177.4	-164.8	175.7	0	0	0	113	V221 L263 F264 I276 L301 T306 Y308 P309 R314 M315	V221-I311 HydrophobicContact CB-CB 4.35Å; V221-I311 HydrophobicContact CG2-CB 4.03Å; V221-I311 HydrophobicContact CG2-CG1 4.22Å; L263-I311 HydrophobicContact CD1-CD1 4.44Å; F264-I311 HydrophobicContact CZ-CG1 4.3Å; I276-I311 HydrophobicContact CD1-CD1 4.23Å; L301-I311 HydrophobicContact CD1-CG2 4.03Å; T306-I311 VanDerWaalsContact O-CG2 3.32Å; T306-I311 WeakPolarHBondContact O-CG2 3.24Å; Y308-I311 WeakPolarHBondContact O-CB 3.44Å; Y308-I311 WeakPolarHBondContact O-CG2 3.48Å; Y308-I311 PolarHBondContact O-N 2.84Å; P309-I311 VanDerWaalsContact C-N 3.31Å; P309-I311 PolarHBondContact O-N 2.87Å; I311-R314 PolarHBondContact O-N 2.82Å; I311-M315 HydrophobicContact CG1-CG 4.37Å; I311-M315 VanDerWaalsContact O-CB 3.31Å; I311-M315 WeakPolarHBondContact O-CB 3.33Å; I311-M315 VanDerWaalsContact O-CG 3.28Å; I311-M315 WeakPolarHBondContact O-CG 3.46Å; I311-M315 PolarHBondContact O-N 3.06Å
312	A	98.6	Very high	98.3	Very high	26 Å²	26	39 Å²	39	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-42.5	179.8	0	0	0	0	0	111.4	L301 G310 M315 Q316 I331 A333	L301-A312 HydrophobicContact CD1-CB 4.3Å; G310-A312 VanDerWaalsContact C-N 3.33Å; G310-A312 PolarHBondContact O-N 2.96Å; A312-M315 PolarHBondContact O-N 3.11Å; A312-Q316 VanDerWaalsContact O-CB 3.28Å; A312-Q316 WeakPolarHBondContact O-CB 3.38Å; A312-Q316 PolarHBondContact O-N 2.88Å; A312-I331 HydrophobicContact CB-CG2 4.13Å; A312-A333 HydrophobicContact CB-CB 3.96Å
313	D	98.6	Very high	98.2	Very high	110 Å²	110	39.6 Å²	39.6	59%	0.588	24%	0.243	S	C	*	.	H	α-helix	trans	-67.7	-41.5	178.3	-59.5	-41.7	0	0	0	111.4	L223 G310 Q316 K317	L223-D313 HydrophobicContact CD1-CB 4.21Å; G310-D313 PolarHBondContact O-N 3.11Å; D313-Q316 WeakPolarHBondContact O-CB 3.5Å; D313-Q316 PolarHBondContact O-N 3.16Å; D313-K317 PolarHBondContact O-N 3.4Å
314	R	98.7	Very high	98.1	Very high	13 Å²	13	42.1 Å²	42.1	5%	0.049	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-48.8	174.3	-177.8	62.9	177.4	-75.8	-8	111.2	V221 A222 L223 E261 F264 G310 I311 Q316 K317 E318	V221-R314 HydrophobicContact CG1-CB 3.52Å; V221-R314 HydrophobicContact CG1-CG 3.71Å; A222-R314 WeakPolarHBondContact O-CD 3.2Å; A222-R314 PolarHBondContact O-NH1 2.82Å; L223-R314 WeakPolarHBondContact O-CD 3.36Å; E261-R314 IonicContact OE1-CZ 2.75Å; E261-R314 IonicContact OE1-NH1 3.62Å; E261-R314 IonicContact OE1-NH2 3.62Å; E261-R314 PolarHBondContact OE1-NH2 3.4Å; E261-R314 IonicContact OE2-CZ 3.35Å; E261-R314 IonicContact OE2-NH1 3.63Å; E261-R314 PolarHBondContact OE2-NH1 3.37Å; E261-R314 IonicContact OE2-NH2 3.08Å; F264-R314 HydrophobicContact CD1-CG 4.12Å; F264-R314 HydrophobicContact CE1-CB 4.38Å; F264-R314 HydrophobicContact CE1-CG 3.51Å; F264-R314 HydrophobicContact CE2-CG 4Å; F264-R314 HydrophobicContact CZ-CB 4.01Å; F264-R314 HydrophobicContact CZ-CG 3.44Å; F264-R314 VanDerWaalsContact CZ-CG 3.44Å; G310-R314 PolarHBondContact O-N 2.8Å; I311-R314 PolarHBondContact O-N 2.82Å; R314-Q316 VanDerWaalsContact C-N 3.28Å; R314-Q316 PolarHBondContact O-N 2.87Å; R314-K317 PolarHBondContact O-N 2.95Å; R314-E318 HydrophobicContact CG-CG 4.3Å; R314-E318 IonicContact CZ-OE1 2.85Å; R314-E318 IonicContact NE-OE1 2.69Å; R314-E318 PolarHBondContact NE-OE1 2.94Å; R314-E318 IonicContact NH2-OE1 2.88Å; R314-E318 PolarHBondContact NH2-OE1 3.5Å; R314-E318 VanDerWaalsContact NH2-OE1 3.08Å; R314-E318 VanDerWaalsContact O-CG 3.3Å; R314-E318 WeakPolarHBondContact O-CG 3.4Å; R314-E318 PolarHBondContact O-N 3.09Å
315	M	98.5	Very high	97.9	Very high	2 Å²	2	46 Å²	46	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-58.6	-39.5	175.2	-77.7	-65.5	-67.6	0	0	112.4	L155 F264 I276 H277 T280 I311 A312 E318 I319 I331	L155-M315 HydrophobicContact CD2-CE 3.65Å; L155-M315 HydrophobicContact CD2-SD 4.23Å; F264-M315 HydrophobicContact CE1-CG 4.3Å; F264-M315 HydrophobicContact CE1-SD 3.8Å; F264-M315 HydrophobicContact CZ-CG 4.28Å; F264-M315 HydrophobicContact CZ-SD 4.25Å; I276-M315 HydrophobicContact CD1-SD 3.83Å; I276-M315 HydrophobicContact CG1-SD 3.88Å; H277-M315 HydrophobicContact CB-SD 3.93Å; T280-M315 WeakPolarHBondContact OG1-CE 3.36Å; I311-M315 HydrophobicContact CG1-CG 4.37Å; I311-M315 VanDerWaalsContact O-CB 3.31Å; I311-M315 WeakPolarHBondContact O-CB 3.33Å; I311-M315 VanDerWaalsContact O-CG 3.28Å; I311-M315 WeakPolarHBondContact O-CG 3.46Å; I311-M315 PolarHBondContact O-N 3.06Å; A312-M315 PolarHBondContact O-N 3.11Å; M315-E318 PolarHBondContact O-N 2.93Å; M315-I319 HydrophobicContact CE-CD1 3.57Å; M315-I319 HydrophobicContact CE-CG1 4.32Å; M315-I319 WeakPolarHBondContact O-CB 3.42Å; M315-I319 WeakPolarHBondContact O-CG1 3.44Å; M315-I319 PolarHBondContact O-N 3.49Å; M315-I331 HydrophobicContact CB-CD1 4.33Å; M315-I331 HydrophobicContact CB-CG1 4.13Å; M315-I331 HydrophobicContact CB-CG2 4.38Å
316	Q	98.6	Very high	97.7	Very high	59 Å²	59	51.5 Å²	51.5	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-46	176.6	-177.8	70.9	58.6	0	0	110.8	A312 D313 R314 T320 I329 I331	A312-Q316 VanDerWaalsContact O-CB 3.28Å; A312-Q316 WeakPolarHBondContact O-CB 3.38Å; A312-Q316 PolarHBondContact O-N 2.88Å; D313-Q316 WeakPolarHBondContact O-CB 3.5Å; D313-Q316 PolarHBondContact O-N 3.16Å; R314-Q316 VanDerWaalsContact C-N 3.28Å; R314-Q316 PolarHBondContact O-N 2.87Å; Q316-T320 PolarHBondContact NE2-OG1 2.82Å; Q316-T320 VanDerWaalsContact O-CB 3.23Å; Q316-T320 WeakPolarHBondContact O-CB 3.44Å; Q316-T320 PolarHBondContact O-N 3.36Å; Q316-T320 VanDerWaalsContact O-N 3.12Å; Q316-T320 PolarHBondContact O-OG1 3.25Å; Q316-I329 PolarHBondContact NE2-O 2.94Å; Q316-I331 HydrophobicContact CB-CG1 3.78Å; Q316-I331 VanDerWaalsContact OE1-N 3.12Å
317	K	98.4	Very high	97.6	Very high	91 Å²	91	54 Å²	54	40%	0.396	33%	0.325	S	S	.	.	H	α-helix	trans	-61.2	-51.3	175.8	178.6	-177.7	170	-173.8	0	111.5	L223 D224 D313 R314 T320 A321	L223-K317 HydrophobicContact CD1-CB 4.03Å; L223-K317 HydrophobicContact CD1-CD 3.81Å; L223-K317 HydrophobicContact CG-CD 4.09Å; L223-K317 PolarHBondContact O-NZ 3.08Å; D224-K317 IonicContact OD2-NZ 3.49Å; D224-K317 PolarHBondContact OD2-NZ 3.3Å; D313-K317 PolarHBondContact O-N 3.4Å; R314-K317 PolarHBondContact O-N 2.95Å; K317-T320 PolarHBondContact O-N 2.92Å; K317-A321 PolarHBondContact O-N 2.86Å; K317-A321 VanDerWaalsContact O-N 3.08Å
318	E	98.5	Very high	97.5	Very high	39 Å²	39	58.6 Å²	58.6	18%	0.182	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-49	-176	-65.9	-67.3	178.5	0	0	112.1	F264 H277 R314 M315 T320 A321 L322	F264-E318 HydrophobicContact CD1-CG 4.21Å; F264-E318 HydrophobicContact CE1-CG 4.24Å; H277-E318 HydrophobicContact CB-CB 3.59Å; H277-E318 HydrophobicContact CB-CG 4.09Å; H277-E318 IonicContact CD2-OE2 3.75Å; R314-E318 HydrophobicContact CG-CG 4.3Å; R314-E318 IonicContact CZ-OE1 2.85Å; R314-E318 IonicContact NE-OE1 2.69Å; R314-E318 PolarHBondContact NE-OE1 2.94Å; R314-E318 IonicContact NH2-OE1 2.88Å; R314-E318 PolarHBondContact NH2-OE1 3.5Å; R314-E318 VanDerWaalsContact NH2-OE1 3.08Å; R314-E318 VanDerWaalsContact O-CG 3.3Å; R314-E318 WeakPolarHBondContact O-CG 3.4Å; R314-E318 PolarHBondContact O-N 3.09Å; M315-E318 PolarHBondContact O-N 2.93Å; E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.79Å; E318-A321 PolarHBondContact O-N 3.41Å; E318-A321 VanDerWaalsContact O-N 3.16Å; E318-L322 WeakPolarHBondContact O-CG 3.37Å; E318-L322 PolarHBondContact O-N 3.21Å; E318-L322 VanDerWaalsContact O-N 3.11Å
319	I	98.1	Very high	97.4	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-66.9	-35.4	-179.8	-66.4	173.8	0	0	0	111	T280 Y296 M315 A321 L322 A323 I329 I331	T280-I319 HydrophobicContact CG2-CD1 3.78Å; Y296-I319 HydrophobicContact CD1-CG2 3.99Å; Y296-I319 HydrophobicContact CE1-CG2 3.93Å; M315-I319 HydrophobicContact CE-CD1 3.57Å; M315-I319 HydrophobicContact CE-CG1 4.32Å; M315-I319 WeakPolarHBondContact O-CB 3.42Å; M315-I319 WeakPolarHBondContact O-CG1 3.44Å; M315-I319 PolarHBondContact O-N 3.49Å; I319-A321 VanDerWaalsContact C-N 3.28Å; I319-A321 PolarHBondContact O-N 3.33Å; I319-L322 PolarHBondContact O-N 3.25Å; I319-A323 WeakPolarHBondContact O-CB 3.39Å; I319-A323 PolarHBondContact O-N 2.71Å; I319-I329 HydrophobicContact CB-CG2 3.96Å; I319-I329 HydrophobicContact CG2-CD1 4.02Å; I319-I329 HydrophobicContact CG2-CG1 4.14Å; I319-I329 HydrophobicContact CG2-CG2 3.57Å; I319-I331 HydrophobicContact CD1-CD1 3.82Å
320	T	98.2	Very high	97.4	Very high	74 Å²	74	59.1 Å²	59.1	45%	0.454	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-34.3	175.4	-57.3	0	0	0	0	111.9	Q316 K317 E318	Q316-T320 PolarHBondContact NE2-OG1 2.82Å; Q316-T320 VanDerWaalsContact O-CB 3.23Å; Q316-T320 WeakPolarHBondContact O-CB 3.44Å; Q316-T320 PolarHBondContact O-N 3.36Å; Q316-T320 VanDerWaalsContact O-N 3.12Å; Q316-T320 PolarHBondContact O-OG1 3.25Å; K317-T320 PolarHBondContact O-N 2.92Å; E318-T320 VanDerWaalsContact C-N 3.31Å; E318-T320 PolarHBondContact O-N 2.79Å
321	A	97.8	Very high	97.4	Very high	82 Å²	82	58.9 Å²	58.9	68%	0.678	33%	0.329	S	S	*	.	H	α-helix	trans	-72.2	-33.1	176.4	0	0	0	0	0	112.9	K317 E318 I319	K317-A321 PolarHBondContact O-N 2.86Å; K317-A321 VanDerWaalsContact O-N 3.08Å; E318-A321 PolarHBondContact O-N 3.41Å; E318-A321 VanDerWaalsContact O-N 3.16Å; I319-A321 VanDerWaalsContact C-N 3.28Å; I319-A321 PolarHBondContact O-N 3.33Å
322	L	97.5	Very high	97.4	Very high	67 Å²	67	59.8 Å²	59.8	35%	0.351	33%	0.334	S	S	.	.	H	α-helix	trans	-83.6	-35	179.8	-66.7	174.7	0	0	0	113.5	E278 Y281 E318 I319	E278-L322 HydrophobicContact CG-CD1 4.32Å; Y281-L322 HydrophobicContact CD2-CB 3.71Å; Y281-L322 HydrophobicContact CE2-CB 4.1Å; Y281-L322 VanDerWaalsContact CE2-O 3.27Å; Y281-L322 WeakPolarHBondContact CE2-O 3.43Å; Y281-L322 HydrophobicContact CG-CB 4.03Å; Y281-L322 HydrophobicContact CG-CD1 4.2Å; E318-L322 WeakPolarHBondContact O-CG 3.37Å; E318-L322 PolarHBondContact O-N 3.21Å; E318-L322 VanDerWaalsContact O-N 3.11Å; I319-L322 PolarHBondContact O-N 3.25Å
323	A	96.3	Very high	97.4	Very high	11 Å²	11	60.2 Å²	60.2	9%	0.091	34%	0.337	C	S	.	.	S	Bend	trans	-78	155.2	-174.4	0	0	0	0	0	112.9	Y296 I319 S325 I329	Y296-A323 HydrophobicContact CD1-CB 4.34Å; Y296-A323 HydrophobicContact CE1-CB 3.74Å; Y296-A323 HydrophobicContact CE2-CB 4.35Å; I319-A323 WeakPolarHBondContact O-CB 3.39Å; I319-A323 PolarHBondContact O-N 2.71Å; A323-S325 PolarHBondContact O-N 2.54Å; A323-I329 HydrophobicContact CB-CD1 3.66Å; A323-I329 HydrophobicContact CB-CG1 4.27Å
324	P	94.9	Very high	97.3	Very high	61 Å²	61	55.7 Å²	55.7	40%	0.396	31%	0.314	S	S	.	.			trans	-56.7	137.8	171.2	-22.8	33	0	0	0	111.5	T326 M327	P324-T326 PolarHBondContact O-N 2.61Å; P324-M327 HydrophobicContact CB-CG 4.24Å; P324-M327 HydrophobicContact CG-CG 4.37Å; P324-M327 WeakPolarHBondContact O-CB 3.25Å; P324-M327 PolarHBondContact O-N 3.02Å
325	S	93.6	Very high	97.2	Very high	127 Å²	127	59.9 Å²	59.9	89%	0.888	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-16.7	-175.1	57.4	0	0	0	0	115	A323 M327	A323-S325 PolarHBondContact O-N 2.54Å; S325-M327 VanDerWaalsContact C-N 3.32Å
326	T	94.3	Very high	97	Very high	123 Å²	123	64.2 Å²	64.2	76%	0.755	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-14.4	174.5	56.7	0	0	0	0	113.5	P324	P324-T326 PolarHBondContact O-N 2.61Å
327	M	95.3	Very high	96.9	Very high	53 Å²	53	62.7 Å²	62.7	26%	0.261	36%	0.355	S	S	.	.	S	Bend	trans	-83.8	135.6	-178.5	-64.8	-61.7	-177.6	0	0	110.8	K293 Y296 P324 S325 I329	K293-M327 HydrophobicContact CB-SD 4.22Å; K293-M327 HydrophobicContact CG-SD 4.48Å; Y296-M327 HydrophobicContact CD2-CB 4.02Å; Y296-M327 HydrophobicContact CD2-CG 3.76Å; Y296-M327 HydrophobicContact CD2-SD 4.06Å; Y296-M327 HydrophobicContact CE2-CB 4.5Å; Y296-M327 HydrophobicContact CE2-CG 3.99Å; Y296-M327 HydrophobicContact CG-CB 4.42Å; P324-M327 HydrophobicContact CB-CG 4.24Å; P324-M327 HydrophobicContact CG-CG 4.37Å; P324-M327 WeakPolarHBondContact O-CB 3.25Å; P324-M327 PolarHBondContact O-N 3.02Å; S325-M327 VanDerWaalsContact C-N 3.32Å; M327-I329 HydrophobicContact CB-CD1 3.99Å
328	K	96.4	Very high	96.8	Very high	164 Å²	164	62.8 Å²	62.8	71%	0.713	36%	0.356	S	S	*	.			trans	-89	109.8	170.9	-176.3	179.1	-179.9	178.3	0	109	Y296	Y296-K328 CarbonylContact C-O 3.58Å
329	I	98.1	Very high	96.8	Very high	17 Å²	17	63.5 Å²	63.5	9%	0.087	36%	0.357	C	S	.	.			trans	-87.1	132.7	178	-49.8	-47.5	0	0	0	109.5	Y296 Q316 I319 A323 M327 I331	Y296-I329 HydrophobicContact CD1-CD1 3.37Å; Y296-I329 HydrophobicContact CD2-CD1 4.42Å; Y296-I329 HydrophobicContact CE1-CD1 4.07Å; Y296-I329 HydrophobicContact CG-CD1 3.59Å; Q316-I329 PolarHBondContact NE2-O 2.94Å; I319-I329 HydrophobicContact CB-CG2 3.96Å; I319-I329 HydrophobicContact CG2-CD1 4.02Å; I319-I329 HydrophobicContact CG2-CG1 4.14Å; I319-I329 HydrophobicContact CG2-CG2 3.57Å; A323-I329 HydrophobicContact CB-CD1 3.66Å; A323-I329 HydrophobicContact CB-CG1 4.27Å; M327-I329 HydrophobicContact CB-CD1 3.99Å; I329-I331 HydrophobicContact CG2-CD1 4.18Å
330	K	98.3	Very high	96.8	Very high	93 Å²	93	63.6 Å²	63.6	40%	0.404	36%	0.358	S	S	.	.			trans	-139.7	116.7	173.5	-179.4	-174.4	179.7	-173.8	0	110.5	Y296 A297 N299 I332	Y296-K330 PolarHBondContact O-N 2.78Å; A297-K330 WeakPolarHBondContact O-CB 3.25Å; N299-K330 WeakPolarHBondContact CB-O 3.41Å; N299-K330 PolarHBondContact N-O 3.46Å; N299-K330 VanDerWaalsContact N-O 3.14Å; K330-I332 HydrophobicContact CD-CG1 4.29Å; K330-I332 HydrophobicContact CG-CG1 4.18Å
331	I	98.5	Very high	96.8	Very high	22 Å²	22	60.6 Å²	60.6	11%	0.113	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	132.6	170.3	-47.6	-50.8	0	0	0	109.6	N299 L301 A312 M315 Q316 I319 I329	N299-I331 HydrophobicContact CB-CD1 3.61Å; N299-I331 CarbonylContact O-C 3.54Å; L301-I331 HydrophobicContact CD1-CG2 3.87Å; L301-I331 HydrophobicContact CD2-CG2 4.14Å; L301-I331 HydrophobicContact CG-CG2 3.84Å; A312-I331 HydrophobicContact CB-CG2 4.13Å; M315-I331 HydrophobicContact CB-CD1 4.33Å; M315-I331 HydrophobicContact CB-CG1 4.13Å; M315-I331 HydrophobicContact CB-CG2 4.38Å; Q316-I331 HydrophobicContact CB-CG1 3.78Å; Q316-I331 VanDerWaalsContact OE1-N 3.12Å; I319-I331 HydrophobicContact CD1-CD1 3.82Å; I329-I331 HydrophobicContact CG2-CD1 4.18Å
332	I	98.4	Very high	96.8	Very high	22 Å²	22	56.7 Å²	56.7	11%	0.113	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	113.2	-177.9	-59.1	156	0	0	0	106.9	N298 N299 V300 L301 K330 P334	N298-I332 HydrophobicContact CB-CD1 4.48Å; N299-I332 PolarHBondContact O-N 2.87Å; V300-I332 WeakPolarHBondContact CA-O 3.46Å; V300-I332 HydrophobicContact CG2-CB 4.26Å; V300-I332 HydrophobicContact CG2-CD1 4.04Å; L301-I332 PolarHBondContact N-O 3.28Å; K330-I332 HydrophobicContact CD-CG1 4.29Å; K330-I332 HydrophobicContact CG-CG1 4.18Å; I332-P334 HydrophobicContact CG2-CG 4.37Å; I332-P334 WeakPolarHBondContact O-CD 3.31Å
333	A	98	Very high	96.8	Very high	34 Å²	34	54.7 Å²	54.7	28%	0.281	30%	0.296	S	S	.	.			trans	-122.5	85.6	-179.8	0	0	0	0	0	109.7	L301 A312	L301-A333 HydrophobicContact CB-CB 4.33Å; L301-A333 HydrophobicContact CD1-CB 3.98Å; L301-A333 HydrophobicContact CG-CB 4.33Å; A312-A333 HydrophobicContact CB-CB 3.96Å
334	P	96.9	Very high	96.9	Very high	16 Å²	16	54.1 Å²	54.1	10%	0.104	29%	0.292	C	S	.	.			trans	-55.9	141.8	177.3	-23.3	34.2	0	0	0	111.1	I332 E336 R337	I332-P334 HydrophobicContact CG2-CG 4.37Å; I332-P334 WeakPolarHBondContact O-CD 3.31Å; P334-E336 VanDerWaalsContact C-N 3.25Å; P334-E336 PolarHBondContact O-N 2.95Å; P334-R337 HydrophobicContact CB-CB 4.34Å; P334-R337 WeakPolarHBondContact O-CB 3.09Å; P334-R337 VanDerWaalsContact O-CD 3.28Å; P334-R337 WeakPolarHBondContact O-CD 3.45Å; P334-R337 WeakPolarHBondContact O-CG 3.39Å; P334-R337 PolarHBondContact O-N 2.88Å; P334-R337 PolarHBondContact O-NH1 2.99Å
335	P	96.4	Very high	97	Very high	101 Å²	101	51.2 Å²	51.2	66%	0.656	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-38.4	178.3	-25.2	34.1	0	0	0	113.2	R337	P335-R337 VanDerWaalsContact C-N 3.26Å; P335-R337 PolarHBondContact O-N 2.78Å
336	E	94.8	Very high	97.2	Very high	92 Å²	92	45.4 Å²	45.4	43%	0.43	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	13.6	-180	61.1	-74	164.1	0	0	113.8	P334 K338 Y339 S340 I343	P334-E336 VanDerWaalsContact C-N 3.25Å; P334-E336 PolarHBondContact O-N 2.95Å; E336-K338 PolarHBondContact O-N 3.06Å; E336-Y339 PolarHBondContact O-N 3.18Å; E336-S340 PolarHBondContact O-N 3.15Å; E336-I343 HydrophobicContact CB-CD1 4.06Å; E336-I343 HydrophobicContact CG-CD1 3.64Å
337	R	96.9	Very high	97.3	Very high	28 Å²	28	43.1 Å²	43.1	11%	0.106	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-16.4	-173.7	66.9	-170.7	173.3	-79.2	1.5	116.8	L301 G303 T306 M307 P334 P335 Y339 S340	L301-R337 WeakPolarHBondContact O-CB 3.37Å; G303-R337 PolarHBondContact N-O 2.88Å; T306-R337 PolarHBondContact O-NE 2.81Å; T306-R337 PolarHBondContact O-NH2 2.8Å; T306-R337 WeakPolarHBondContact OG1-CD 3.5Å; M307-R337 HydrophobicContact SD-CG 3.42Å; M307-R337 WeakPolarHBondContact SD-CG 3.38Å; P334-R337 HydrophobicContact CB-CB 4.34Å; P334-R337 WeakPolarHBondContact O-CB 3.09Å; P334-R337 VanDerWaalsContact O-CD 3.28Å; P334-R337 WeakPolarHBondContact O-CD 3.45Å; P334-R337 WeakPolarHBondContact O-CG 3.39Å; P334-R337 PolarHBondContact O-N 2.88Å; P334-R337 PolarHBondContact O-NH1 2.99Å; P335-R337 VanDerWaalsContact C-N 3.26Å; P335-R337 PolarHBondContact O-N 2.78Å; R337-Y339 PolarHBondContact O-N 3.4Å; R337-S340 WeakPolarHBondContact CA-OG 3.32Å; R337-S340 PolarHBondContact O-N 3.07Å
338	K	96	Very high	97.2	Very high	93 Å²	93	41.8 Å²	41.8	40%	0.404	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.8	167.5	59.8	167.3	174.4	163.1	0	113.5	M307 E336	M307-K338 HydrophobicContact CG-CB 4.23Å; M307-K338 HydrophobicContact SD-CB 4.17Å; E336-K338 PolarHBondContact O-N 3.06Å
339	Y	97.6	Very high	97.1	Very high	53 Å²	53	34.2 Å²	34.2	21%	0.208	18%	0.176	C	C	.	.	S	Bend	trans	-122	5.7	-179.1	-53.8	-40.6	0	0	0	113.2	K20 P29 V32 E336 R337 V341 W342 I343	K20-Y339 HydrophobicContact CG-CD1 4.19Å; K20-Y339 HydrophobicContact CG-CE1 4.38Å; P29-Y339 HydrophobicContact CG-CD1 4.04Å; P29-Y339 HydrophobicContact CG-CD2 4.4Å; P29-Y339 HydrophobicContact CG-CE1 4.29Å; P29-Y339 HydrophobicContact CG-CG 4.12Å; V32-Y339 HydrophobicContact CG2-CE1 4.07Å; E336-Y339 PolarHBondContact O-N 3.18Å; R337-Y339 PolarHBondContact O-N 3.4Å; Y339-V341 PolarHBondContact O-N 2.89Å; Y339-V341 VanDerWaalsContact O-N 3.15Å; Y339-W342 PolarHBondContact O-N 3.45Å; Y339-I343 WeakPolarHBondContact O-CG1 3.23Å; Y339-I343 PolarHBondContact O-N 3.28Å
340	S	97.8	Very high	96.9	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-52.7	-40.3	-176.8	-80.2	0	0	0	0	113.6	A146 E336 R337 W342 I343 G344	A146-S340 VanDerWaalsContact CB-O 3.3Å; A146-S340 WeakPolarHBondContact CB-O 3.35Å; E336-S340 PolarHBondContact O-N 3.15Å; R337-S340 WeakPolarHBondContact CA-OG 3.32Å; R337-S340 PolarHBondContact O-N 3.07Å; S340-W342 PolarHBondContact O-N 3.35Å; S340-I343 PolarHBondContact O-N 2.77Å; S340-G344 PolarHBondContact O-N 2.81Å
341	V	98	Very high	96.5	Very high	10 Å²	10	35.8 Å²	35.8	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-57.1	-51.5	175.6	176.1	0	0	0	0	110.8	D13 T108 Q139 L142 S143 Y339 G344 G345	D13-V341 HydrophobicContact CB-CG1 4.32Å; D13-V341 WeakPolarHBondContact OD1-CG1 3.25Å; T108-V341 HydrophobicContact CG2-CG1 3.85Å; Q139-V341 HydrophobicContact CB-CG1 3.95Å; Q139-V341 HydrophobicContact CB-CG2 4Å; Q139-V341 HydrophobicContact CG-CG1 3.87Å; L142-V341 WeakPolarHBondContact CB-O 3.39Å; L142-V341 HydrophobicContact CD1-CG1 4.19Å; L142-V341 WeakPolarHBondContact CD1-O 3.23Å; S143-V341 WeakPolarHBondContact OG-CG2 3.2Å; S143-V341 PolarHBondContact OG-N 2.94Å; Y339-V341 PolarHBondContact O-N 2.89Å; Y339-V341 VanDerWaalsContact O-N 3.15Å; V341-G344 PolarHBondContact O-N 3.06Å; V341-G345 PolarHBondContact O-N 2.78Å
342	W	98.5	Very high	96	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.9	-42.8	-177.9	-174.4	91.3	0	0	0	111.5	V11 D13 K20 D26 A28 P29 Y339 S340 G344 G345 S346	V11-W342 HydrophobicContact CB-CZ2 4.31Å; V11-W342 HydrophobicContact CG1-CG 4.27Å; V11-W342 PolarHBondContact O-NE1 3.38Å; D13-W342 HydrophobicContact CB-CB 4.22Å; K20-W342 HydrophobicContact CB-CB 4.33Å; K20-W342 HydrophobicContact CB-CG 4.18Å; K20-W342 VanDerWaalsContact O-CD1 3.32Å; D26-W342 HydrophobicContact CB-CH2 3.91Å; D26-W342 WeakPolarHBondContact O-CH2 3.4Å; D26-W342 WeakPolarHBondContact O-CZ3 3.44Å; A28-W342 WeakPolarHBondContact O-CH2 3.37Å; A28-W342 WeakPolarHBondContact O-CZ3 3.5Å; P29-W342 HydrophobicContact CB-CD2 3.7Å; P29-W342 HydrophobicContact CB-CE3 4.17Å; P29-W342 HydrophobicContact CB-CG 3.98Å; P29-W342 HydrophobicContact CB-CZ2 4.37Å; P29-W342 HydrophobicContact CG-CD2 4.27Å; P29-W342 HydrophobicContact CG-CE3 4.4Å; P29-W342 HydrophobicContact CG-CG 4.45Å; Y339-W342 PolarHBondContact O-N 3.45Å; S340-W342 PolarHBondContact O-N 3.35Å; W342-G344 VanDerWaalsContact C-N 3.31Å; W342-G344 PolarHBondContact O-N 3.32Å; W342-G345 CarbonylContact O-C 3.47Å; W342-G345 WeakPolarHBondContact O-CA 3.48Å; W342-G345 PolarHBondContact O-N 3.42Å; W342-G345 VanDerWaalsContact O-N 3.09Å; W342-S346 PolarHBondContact O-N 2.89Å
343	I	98.3	Very high	95.4	Very high	25 Å²	25	43.5 Å²	43.5	13%	0.128	25%	0.248	C	C	.	.	H	α-helix	trans	-60.1	-43.7	176.7	-66.4	168.6	0	0	0	110.3	A146 E336 Y339 S340 G345 S346 I347	A146-I343 HydrophobicContact CB-CB 4.27Å; A146-I343 HydrophobicContact CB-CG2 4.06Å; E336-I343 HydrophobicContact CB-CD1 4.06Å; E336-I343 HydrophobicContact CG-CD1 3.64Å; Y339-I343 WeakPolarHBondContact O-CG1 3.23Å; Y339-I343 PolarHBondContact O-N 3.28Å; S340-I343 PolarHBondContact O-N 2.77Å; I343-G345 VanDerWaalsContact C-N 3.29Å; I343-G345 PolarHBondContact O-N 3.16Å; I343-S346 WeakPolarHBondContact O-CB 3.36Å; I343-S346 PolarHBondContact O-N 3.27Å; I343-I347 HydrophobicContact CG2-CD1 3.9Å; I343-I347 WeakPolarHBondContact O-CG1 3.49Å; I343-I347 PolarHBondContact O-N 3.12Å
344	G	97.4	Very high	94.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.2	-38.3	175.3	0	0	0	0	0	112.6	L142 S340 V341 W342 L348	L142-G344 WeakPolarHBondContact O-CA 3.44Å; S340-G344 PolarHBondContact O-N 2.81Å; V341-G344 PolarHBondContact O-N 3.06Å; W342-G344 VanDerWaalsContact C-N 3.31Å; W342-G344 PolarHBondContact O-N 3.32Å; G344-L348 VanDerWaalsContact O-CB 3.23Å; G344-L348 WeakPolarHBondContact O-CB 3.47Å; G344-L348 PolarHBondContact O-N 2.9Å
345	G	97.4	Very high	94.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.2	-42	172.6	0	0	0	0	0	113	V341 W342 I343 L348 A349	V341-G345 PolarHBondContact O-N 2.78Å; W342-G345 CarbonylContact O-C 3.47Å; W342-G345 WeakPolarHBondContact O-CA 3.48Å; W342-G345 PolarHBondContact O-N 3.42Å; W342-G345 VanDerWaalsContact O-N 3.09Å; I343-G345 VanDerWaalsContact C-N 3.29Å; I343-G345 PolarHBondContact O-N 3.16Å; G345-L348 PolarHBondContact O-N 2.94Å; G345-A349 WeakPolarHBondContact O-CB 3.37Å; G345-A349 PolarHBondContact O-N 2.91Å
346	S	97.7	Very high	93.8	Very high	4 Å²	4	48.5 Å²	48.5	3%	0.028	26%	0.255	C	S	.	.	H	α-helix	trans	-62.1	-43.2	176.3	-178.4	0	0	0	0	112.2	G25 D26 W342 I343 S350	G25-S346 PolarHBondContact N-O 2.72Å; G25-S346 PolarHBondContact N-OG 3.29Å; D26-S346 PolarHBondContact N-OG 3.47Å; D26-S346 PolarHBondContact O-OG 3.41Å; W342-S346 PolarHBondContact O-N 2.89Å; I343-S346 WeakPolarHBondContact O-CB 3.36Å; I343-S346 PolarHBondContact O-N 3.27Å; S346-S350 WeakPolarHBondContact O-CB 3.36Å; S346-S350 PolarHBondContact O-N 2.93Å; S346-S350 PolarHBondContact O-OG 3.12Å
347	I	95.5	Very high	93.7	Very high	75 Å²	75	47.5 Å²	47.5	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-65.2	-52.2	174.2	-65.9	165.7	0	0	0	109.6	I343 A349 S350 L351	I343-I347 HydrophobicContact CG2-CD1 3.9Å; I343-I347 WeakPolarHBondContact O-CG1 3.49Å; I343-I347 PolarHBondContact O-N 3.12Å; I347-A349 PolarHBondContact O-N 3.47Å; I347-S350 PolarHBondContact O-N 3.13Å; I347-S350 PolarHBondContact O-OG 3.2Å; I347-L351 WeakPolarHBondContact O-CG 3.32Å; I347-L351 PolarHBondContact O-N 3.34Å
348	L	94.4	Very high	93.7	Very high	25 Å²	25	46.9 Å²	46.9	13%	0.131	25%	0.249	C	C	.	.	H	α-helix	trans	-60.1	-46.2	-175.5	-177.1	64.5	0	0	0	112	L106 L142 G344 G345 S350 L351 F354	L106-L348 HydrophobicContact CD1-CD2 4.23Å; L142-L348 HydrophobicContact CD2-CB 4.33Å; L142-L348 HydrophobicContact CD2-CD2 3.64Å; G344-L348 VanDerWaalsContact O-CB 3.23Å; G344-L348 WeakPolarHBondContact O-CB 3.47Å; G344-L348 PolarHBondContact O-N 2.9Å; G345-L348 PolarHBondContact O-N 2.94Å; L348-S350 VanDerWaalsContact C-N 3.25Å; L348-S350 PolarHBondContact O-N 3.24Å; L348-L351 HydrophobicContact CD1-CD1 4.4Å; L348-L351 PolarHBondContact O-N 2.86Å; L348-F354 HydrophobicContact CD1-CD2 3.63Å; L348-F354 HydrophobicContact CD1-CE2 3.96Å; L348-F354 HydrophobicContact CD1-CG 4.29Å; L348-F354 HydrophobicContact CD2-CD2 4.2Å; L348-F354 HydrophobicContact CD2-CE2 3.66Å; L348-F354 HydrophobicContact CD2-CZ 4.04Å; L348-F354 HydrophobicContact CG-CD2 3.65Å; L348-F354 HydrophobicContact CG-CE2 3.6Å; L348-F354 HydrophobicContact CG-CG 4.15Å; L348-F354 HydrophobicContact CG-CZ 4.05Å; L348-F354 WeakPolarHBondContact O-CB 3.22Å; L348-F354 WeakPolarHBondContact O-CG 3.4Å
349	A	95.2	Very high	93.7	Very high	5 Å²	5	42.4 Å²	42.4	4%	0.041	23%	0.229	C	C	.	.	H	α-helix	trans	-71.1	-16.2	-178.7	0	0	0	0	0	113.9	A9 V11 A24 L106 G345 I347 W358	A9-A349 HydrophobicContact CB-CB 4.17Å; V11-A349 HydrophobicContact CG2-CB 4.15Å; A24-A349 HydrophobicContact CB-CB 3.67Å; L106-A349 HydrophobicContact CB-CB 4.47Å; L106-A349 HydrophobicContact CD1-CB 4.06Å; G345-A349 WeakPolarHBondContact O-CB 3.37Å; G345-A349 PolarHBondContact O-N 2.91Å; I347-A349 PolarHBondContact O-N 3.47Å; A349-W358 HydrophobicContact CB-CH2 4.44Å; A349-W358 HydrophobicContact CB-CZ2 4.17Å
350	S	93.1	Very high	93.7	Very high	67 Å²	67	41.7 Å²	41.7	47%	0.469	23%	0.232	S	C	.	.	H	α-helix	trans	-92.7	-3.8	175	58.2	0	0	0	0	113.8	S346 I347 L348	S346-S350 WeakPolarHBondContact O-CB 3.36Å; S346-S350 PolarHBondContact O-N 2.93Å; S346-S350 PolarHBondContact O-OG 3.12Å; I347-S350 PolarHBondContact O-N 3.13Å; I347-S350 PolarHBondContact O-OG 3.2Å; L348-S350 VanDerWaalsContact C-N 3.25Å; L348-S350 PolarHBondContact O-N 3.24Å
351	L	90.8	Very high	93.7	Very high	76 Å²	76	44.2 Å²	44.2	40%	0.398	24%	0.242	S	C	.	.			trans	-76.8	128.7	176.3	-60.9	179.1	0	0	0	111.3	I347 L348 T353 F354	I347-L351 WeakPolarHBondContact O-CG 3.32Å; I347-L351 PolarHBondContact O-N 3.34Å; L348-L351 HydrophobicContact CD1-CD1 4.4Å; L348-L351 PolarHBondContact O-N 2.86Å; L351-T353 PolarHBondContact O-N 2.88Å; L351-F354 HydrophobicContact CB-CB 4.11Å; L351-F354 VanDerWaalsContact O-CB 3.25Å; L351-F354 WeakPolarHBondContact O-CB 3.47Å; L351-F354 PolarHBondContact O-N 3.27Å
352	S	86.7	Confident	93.6	Very high	99 Å²	99	50.2 Å²	50.2	69%	0.692	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-58.9	-32.4	174.4	57.6	0	0	0	0	113	F354 Q355	S352-F354 PolarHBondContact O-N 2.95Å; S352-Q355 WeakPolarHBondContact O-CB 3.48Å; S352-Q355 WeakPolarHBondContact O-CG 3.47Å; S352-Q355 PolarHBondContact O-N 3.4Å
353	T	86.9	Confident	93.6	Very high	107 Å²	107	52.9 Å²	52.9	66%	0.656	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-68.3	-21.6	174.9	52.5	0	0	0	0	113.2	L351 Q355	L351-T353 PolarHBondContact O-N 2.88Å; T353-Q355 VanDerWaalsContact C-N 3.29Å
354	F	87.3	Confident	93.6	Very high	9 Å²	9	52 Å²	52	4%	0.039	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-77.3	-17	178.6	-171.1	-108.6	0	0	0	112.5	L106 Y135 L348 L351 S352 Q356 M357 W358	L106-F354 HydrophobicContact CD1-CE1 4.15Å; L106-F354 HydrophobicContact CD1-CZ 4.05Å; Y135-F354 HydrophobicContact CD1-CE2 4.11Å; Y135-F354 AromaticContact CD1-CZ 3.53Å; Y135-F354 HydrophobicContact CD1-CZ 3.53Å; Y135-F354 HydrophobicContact CD2-CE2 4.27Å; Y135-F354 AromaticContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CD2-CZ 3.9Å; Y135-F354 HydrophobicContact CE1-CE2 4.09Å; Y135-F354 AromaticContact CE1-CZ 3.99Å; Y135-F354 HydrophobicContact CE1-CZ 3.99Å; Y135-F354 HydrophobicContact CE2-CE2 4.26Å; Y135-F354 HydrophobicContact CE2-CZ 4.33Å; Y135-F354 HydrophobicContact CG-CE1 4.37Å; Y135-F354 HydrophobicContact CG-CE2 4.19Å; Y135-F354 AromaticContact CG-CZ 3.47Å; Y135-F354 HydrophobicContact CG-CZ 3.47Å; Y135-F354 VanDerWaalsContact CG-CZ 3.47Å; L348-F354 HydrophobicContact CD1-CD2 3.63Å; L348-F354 HydrophobicContact CD1-CE2 3.96Å; L348-F354 HydrophobicContact CD1-CG 4.29Å; L348-F354 HydrophobicContact CD2-CD2 4.2Å; L348-F354 HydrophobicContact CD2-CE2 3.66Å; L348-F354 HydrophobicContact CD2-CZ 4.04Å; L348-F354 HydrophobicContact CG-CD2 3.65Å; L348-F354 HydrophobicContact CG-CE2 3.6Å; L348-F354 HydrophobicContact CG-CG 4.15Å; L348-F354 HydrophobicContact CG-CZ 4.05Å; L348-F354 WeakPolarHBondContact O-CB 3.22Å; L348-F354 WeakPolarHBondContact O-CG 3.4Å; L351-F354 HydrophobicContact CB-CB 4.11Å; L351-F354 VanDerWaalsContact O-CB 3.25Å; L351-F354 WeakPolarHBondContact O-CB 3.47Å; L351-F354 PolarHBondContact O-N 3.27Å; S352-F354 PolarHBondContact O-N 2.95Å; F354-Q356 PolarHBondContact O-N 3.44Å; F354-M357 HydrophobicContact CD2-CB 3.82Å; F354-M357 HydrophobicContact CD2-CG 4.04Å; F354-M357 HydrophobicContact CE2-CB 3.8Å; F354-M357 HydrophobicContact CE2-CG 4.34Å; F354-M357 HydrophobicContact CG-CB 4.46Å; F354-M357 HydrophobicContact CZ-CB 4.43Å; F354-M357 WeakPolarHBondContact O-CB 3.38Å; F354-M357 PolarHBondContact O-N 2.9Å; F354-W358 HydrophobicContact CD1-CD2 4.47Å; F354-W358 AromaticContact CD1-CE2 3.81Å; F354-W358 AromaticContact CD1-CZ2 3.99Å; F354-W358 HydrophobicContact CD1-CZ2 3.99Å; F354-W358 AromaticContact CD1-NE1 3.83Å; F354-W358 HydrophobicContact CE1-CD2 4.05Å; F354-W358 AromaticContact CE1-CE2 3.65Å; F354-W358 HydrophobicContact CE1-CE3 4.41Å; F354-W358 HydrophobicContact CE1-CH2 4.07Å; F354-W358 AromaticContact CE1-CZ2 3.67Å; F354-W358 HydrophobicContact CE1-CZ2 3.67Å; F354-W358 HydrophobicContact CE1-CZ3 4.41Å
355	Q	84.1	Confident	93.6	Very high	82 Å²	82	57 Å²	57	38%	0.383	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-57.2	-28.2	-178.3	-65.3	-65.5	6.5	0	0	113.3	E6 S352 T353 M357	E6-Q355 PolarHBondContact OE1-NE2 3.46Å; S352-Q355 WeakPolarHBondContact O-CB 3.48Å; S352-Q355 WeakPolarHBondContact O-CG 3.47Å; S352-Q355 PolarHBondContact O-N 3.4Å; T353-Q355 VanDerWaalsContact C-N 3.29Å; Q355-M357 VanDerWaalsContact C-N 3.34Å
356	Q	86.6	Confident	93.6	Very high	165 Å²	165	64.5 Å²	64.5	77%	0.771	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-77.8	-17.6	178.1	-61.4	179.6	-0.9	0	0	113.8	F354 K375	F354-Q356 PolarHBondContact O-N 3.44Å; Q356-K375 PolarHBondContact O-NZ 3.31Å
357	M	91.9	Very high	93.5	Very high	72 Å²	72	65.9 Å²	65.9	36%	0.355	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-20.1	-176.5	-63.7	-60.7	-64.4	0	0	112.9	Y135 F354 Q355 K375	Y135-M357 HydrophobicContact CD2-CB 4.36Å; Y135-M357 WeakPolarHBondContact CD2-O 3.47Å; Y135-M357 HydrophobicContact CE2-CB 4.17Å; Y135-M357 HydrophobicContact CE2-CE 4.28Å; F354-M357 HydrophobicContact CD2-CB 3.82Å; F354-M357 HydrophobicContact CD2-CG 4.04Å; F354-M357 HydrophobicContact CE2-CB 3.8Å; F354-M357 HydrophobicContact CE2-CG 4.34Å; F354-M357 HydrophobicContact CG-CB 4.46Å; F354-M357 HydrophobicContact CZ-CB 4.43Å; F354-M357 WeakPolarHBondContact O-CB 3.38Å; F354-M357 PolarHBondContact O-N 2.9Å; Q355-M357 VanDerWaalsContact C-N 3.34Å; M357-K375 WeakPolarHBondContact CE-O 3.41Å; M357-K375 WeakPolarHBondContact O-CD 3.46Å
358	W	95.8	Very high	93.6	Very high	14 Å²	14	63.3 Å²	63.3	5%	0.053	34%	0.343	C	S	.	.	S	Bend	trans	-55.2	141.8	174.6	-69	118.1	0	0	0	111.3	A9 P104 L106 A133 A349 F354 K375	A9-W358 HydrophobicContact CB-CH2 3.93Å; A9-W358 HydrophobicContact CB-CZ2 3.7Å; P104-W358 HydrophobicContact CB-CD2 4.34Å; P104-W358 HydrophobicContact CB-CE3 4.33Å; P104-W358 HydrophobicContact CB-CH2 4Å; P104-W358 HydrophobicContact CB-CZ2 3.99Å; P104-W358 HydrophobicContact CB-CZ3 4.18Å; L106-W358 HydrophobicContact CB-CH2 3.9Å; L106-W358 HydrophobicContact CB-CZ3 4.28Å; A133-W358 HydrophobicContact CB-CB 4.11Å; A133-W358 HydrophobicContact CB-CE3 4.49Å; A133-W358 HydrophobicContact CB-CG 4.46Å; A349-W358 HydrophobicContact CB-CH2 4.44Å; A349-W358 HydrophobicContact CB-CZ2 4.17Å; F354-W358 HydrophobicContact CD1-CD2 4.47Å; F354-W358 AromaticContact CD1-CE2 3.81Å; F354-W358 AromaticContact CD1-CZ2 3.99Å; F354-W358 HydrophobicContact CD1-CZ2 3.99Å; F354-W358 AromaticContact CD1-NE1 3.83Å; F354-W358 HydrophobicContact CE1-CD2 4.05Å; F354-W358 AromaticContact CE1-CE2 3.65Å; F354-W358 HydrophobicContact CE1-CE3 4.41Å; F354-W358 HydrophobicContact CE1-CH2 4.07Å; F354-W358 AromaticContact CE1-CZ2 3.67Å; F354-W358 HydrophobicContact CE1-CZ2 3.67Å; F354-W358 HydrophobicContact CE1-CZ3 4.41Å; W358-K375 PolarHBondContact O-NZ 2.83Å
359	I	97.6	Very high	93.6	Very high	0 Å²	0	64 Å²	64	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	117.5	165.9	-58.4	163	0	0	0	105.5	F126 A133 M134 E363 I371 V372 K375	F126-I359 HydrophobicContact CE2-CG2 3.89Å; F126-I359 HydrophobicContact CZ-CB 4.29Å; F126-I359 HydrophobicContact CZ-CG2 3.86Å; F126-I359 WeakPolarHBondContact CZ-O 3.36Å; A133-I359 CarbonylContact C-O 3.6Å; A133-I359 WeakPolarHBondContact CA-O 3.44Å; A133-I359 WeakPolarHBondContact CB-O 3.36Å; M134-I359 PolarHBondContact N-O 3.32Å; M134-I359 WeakPolarHBondContact O-CB 3.33Å; M134-I359 PolarHBondContact O-N 2.88Å; I359-E363 WeakPolarHBondContact CA-OE2 3.33Å; I359-E363 HydrophobicContact CG2-CB 4.45Å; I359-I371 HydrophobicContact CD1-CG2 4.42Å; I359-I371 HydrophobicContact CG2-CB 4.47Å; I359-I371 HydrophobicContact CG2-CG1 4.03Å; I359-I371 HydrophobicContact CG2-CG2 3.54Å; I359-V372 HydrophobicContact CD1-CB 3.98Å; I359-V372 HydrophobicContact CD1-CG2 3.88Å; I359-K375 HydrophobicContact CD1-CB 4.33Å; I359-K375 HydrophobicContact CG1-CB 3.9Å; I359-K375 HydrophobicContact CG1-CD 4.07Å; I359-K375 HydrophobicContact CG1-CG 4.24Å
360	S	97.4	Very high	93.7	Very high	37 Å²	37	65.9 Å²	65.9	26%	0.259	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	161	175.4	74.6	0	0	0	0	111.4	E362 E363 Y364	S360-E362 PolarHBondContact O-N 3.34Å; S360-E362 PolarHBondContact OG-N 3Å; S360-E363 PolarHBondContact N-OE2 3.3Å; S360-E363 PolarHBondContact O-N 3.32Å; S360-E363 WeakPolarHBondContact OG-CG 3.44Å; S360-E363 PolarHBondContact OG-N 3.1Å; S360-E363 VanDerWaalsContact OG-N 3.12Å; S360-Y364 PolarHBondContact O-N 3.08Å
361	K	96.8	Very high	93.9	Very high	56 Å²	56	63.3 Å²	63.3	24%	0.243	34%	0.343	C	S	.	.	H	α-helix	trans	-55.8	-38.5	171.1	-174	72.1	178.3	90.4	0	112.2	F126 P132 Y364 D365	F126-K361 HydrophobicContact CB-CD 4.07Å; F126-K361 HydrophobicContact CD1-CB 4.3Å; F126-K361 HydrophobicContact CD1-CD 3.46Å; F126-K361 VanDerWaalsContact CD1-CD 3.46Å; F126-K361 HydrophobicContact CD1-CG 4.5Å; F126-K361 HydrophobicContact CE1-CB 4.2Å; F126-K361 HydrophobicContact CE1-CD 4.19Å; F126-K361 HydrophobicContact CG-CD 4.1Å; F126-K361 WeakPolarHBondContact O-CE 3.36Å; P132-K361 PolarHBondContact O-N 2.82Å; K361-Y364 WeakPolarHBondContact O-CB 3.42Å; K361-Y364 PolarHBondContact O-N 3.24Å; K361-D365 VanDerWaalsContact NZ-CG 3.31Å; K361-D365 IonicContact NZ-OD1 3.79Å; K361-D365 PolarHBondContact NZ-OD1 2.83Å; K361-D365 IonicContact NZ-OD2 3.84Å; K361-D365 PolarHBondContact NZ-OD2 3.39Å; K361-D365 VanDerWaalsContact O-CG 3.28Å; K361-D365 PolarHBondContact O-N 3.01Å
362	E	97.1	Very high	94.1	Very high	137 Å²	137	59.7 Å²	59.7	64%	0.64	32%	0.324	S	S	*	.	H	α-helix	trans	-62.4	-48.4	177.2	-176.6	177.6	-164.6	0	0	111.6	S360 Y364 D365 E366	S360-E362 PolarHBondContact O-N 3.34Å; S360-E362 PolarHBondContact OG-N 3Å; E362-Y364 VanDerWaalsContact C-N 3.25Å; E362-Y364 PolarHBondContact O-N 3.44Å; E362-D365 PolarHBondContact O-N 3Å; E362-D365 VanDerWaalsContact O-N 3.15Å; E362-E366 WeakPolarHBondContact O-CG 3.24Å; E362-E366 PolarHBondContact O-N 2.84Å; E362-E366 VanDerWaalsContact O-N 3.08Å
363	E	97.1	Very high	94.4	Very high	56 Å²	56	57 Å²	57	26%	0.262	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-36.2	176.5	-70.3	178.2	131.5	0	0	112	I359 S360 A367 I371 K375	I359-E363 WeakPolarHBondContact CA-OE2 3.33Å; I359-E363 HydrophobicContact CG2-CB 4.45Å; S360-E363 PolarHBondContact N-OE2 3.3Å; S360-E363 PolarHBondContact O-N 3.32Å; S360-E363 WeakPolarHBondContact OG-CG 3.44Å; S360-E363 PolarHBondContact OG-N 3.1Å; S360-E363 VanDerWaalsContact OG-N 3.12Å; E363-A367 WeakPolarHBondContact O-CB 3.38Å; E363-A367 PolarHBondContact O-N 3.4Å; E363-I371 HydrophobicContact CB-CG1 4.36Å; E363-K375 WeakPolarHBondContact OE1-CE 3.44Å; E363-K375 IonicContact OE1-NZ 3.76Å; E363-K375 PolarHBondContact OE1-NZ 3.36Å; E363-K375 WeakPolarHBondContact OE2-CE 3.32Å; E363-K375 IonicContact OE2-NZ 3.02Å; E363-K375 PolarHBondContact OE2-NZ 3.19Å
364	Y	98.1	Very high	94.6	Very high	7 Å²	7	59.9 Å²	59.9	3%	0.027	30%	0.299	C	S	.	.	H	α-helix	trans	-66.5	-44.3	173.9	175.7	-91.9	0	0	0	112.3	T122 F126 E127 S360 K361 E362 E366 A367 G368 P369 I371	T122-Y364 HydrophobicContact CG2-CD2 3.88Å; T122-Y364 HydrophobicContact CG2-CE2 3.97Å; F126-Y364 HydrophobicContact CB-CD1 3.79Å; F126-Y364 HydrophobicContact CB-CD2 4.34Å; F126-Y364 HydrophobicContact CB-CE1 3.85Å; F126-Y364 HydrophobicContact CB-CE2 4.37Å; F126-Y364 HydrophobicContact CB-CG 4.04Å; F126-Y364 HydrophobicContact CD2-CD1 4.04Å; F126-Y364 AromaticContact CD2-CD2 3.29Å; F126-Y364 HydrophobicContact CD2-CD2 3.29Å; F126-Y364 AromaticContact CD2-CE2 3.86Å; F126-Y364 HydrophobicContact CD2-CE2 3.86Å; F126-Y364 AromaticContact CD2-CG 3.38Å; F126-Y364 HydrophobicContact CD2-CG 3.38Å; F126-Y364 AromaticContact CE2-CD2 3.78Å; F126-Y364 HydrophobicContact CE2-CD2 3.78Å; F126-Y364 AromaticContact CE2-CG 3.84Å; F126-Y364 HydrophobicContact CE2-CG 3.84Å; F126-Y364 HydrophobicContact CG-CD1 4.01Å; F126-Y364 HydrophobicContact CG-CD2 4.09Å; F126-Y364 HydrophobicContact CG-CE1 4.5Å; F126-Y364 AromaticContact CG-CG 3.79Å; F126-Y364 HydrophobicContact CG-CG 3.79Å; E127-Y364 HydrophobicContact CG-CE1 4.12Å; E127-Y364 PolarHBondContact OE1-OH 2.96Å; S360-Y364 PolarHBondContact O-N 3.08Å; K361-Y364 WeakPolarHBondContact O-CB 3.42Å; K361-Y364 PolarHBondContact O-N 3.24Å; E362-Y364 VanDerWaalsContact C-N 3.25Å; E362-Y364 PolarHBondContact O-N 3.44Å; Y364-E366 PolarHBondContact O-N 3.13Å; Y364-A367 PolarHBondContact O-N 3.21Å; Y364-G368 WeakPolarHBondContact O-CA 3.38Å; Y364-G368 PolarHBondContact O-N 3.12Å; Y364-P369 HydrophobicContact CE2-CB 4.2Å; Y364-P369 HydrophobicContact CE2-CG 3.83Å; Y364-I371 HydrophobicContact CD2-CG2 4.5Å
365	D	97.4	Very high	94.7	Very high	105 Å²	105	61.3 Å²	61.3	56%	0.561	31%	0.305	S	S	*	.	H	α-helix	trans	-65.3	-29.4	-179.3	-72.2	-24.7	0	0	0	112.1	K361 E362	K361-D365 VanDerWaalsContact NZ-CG 3.31Å; K361-D365 IonicContact NZ-OD1 3.79Å; K361-D365 PolarHBondContact NZ-OD1 2.83Å; K361-D365 IonicContact NZ-OD2 3.84Å; K361-D365 PolarHBondContact NZ-OD2 3.39Å; K361-D365 VanDerWaalsContact O-CG 3.28Å; K361-D365 PolarHBondContact O-N 3.01Å; E362-D365 PolarHBondContact O-N 3Å; E362-D365 VanDerWaalsContact O-N 3.15Å
366	E	97.3	Very high	94.9	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	29%	0.288	S	S	*	.	H	α-helix	trans	-80.5	-44.1	176	-68.7	-174.2	167.7	0	0	113.9	E362 Y364	E362-E366 WeakPolarHBondContact O-CG 3.24Å; E362-E366 PolarHBondContact O-N 2.84Å; E362-E366 VanDerWaalsContact O-N 3.08Å; Y364-E366 PolarHBondContact O-N 3.13Å
367	A	96.6	Very high	94.3	Very high	32 Å²	32	56.9 Å²	56.9	26%	0.264	28%	0.283	S	S	.	.	H	α-helix	trans	-106.8	-7.7	-170	0	0	0	0	0	114.5	E363 Y364 S370 I371	E363-A367 WeakPolarHBondContact O-CB 3.38Å; E363-A367 PolarHBondContact O-N 3.4Å; Y364-A367 PolarHBondContact O-N 3.21Å; A367-S370 PolarHBondContact O-OG 3.01Å; A367-S370 VanDerWaalsContact O-OG 3.14Å; A367-I371 HydrophobicContact CB-CB 4.04Å; A367-I371 HydrophobicContact CB-CD1 4.2Å; A367-I371 HydrophobicContact CB-CG1 4.46Å
368	G	96.8	Very high	94.5	Very high	21 Å²	21	56.2 Å²	56.2	22%	0.216	28%	0.279	C	S	.	.			trans	64.6	-168.4	-173.1	0	0	0	0	0	113.5	Y364 S370 I371	Y364-G368 WeakPolarHBondContact O-CA 3.38Å; Y364-G368 PolarHBondContact O-N 3.12Å; G368-S370 PolarHBondContact O-N 2.95Å; G368-I371 VanDerWaalsContact O-CG2 3.24Å; G368-I371 WeakPolarHBondContact O-CG2 3.47Å; G368-I371 PolarHBondContact O-N 3.04Å
369	P	96.1	Very high	94.4	Very high	40 Å²	40	58.4 Å²	58.4	26%	0.26	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-55.9	-26.4	-177.2	-26.4	33	0	0	0	115.2	E119 Q123 Y364 I371 V372	E119-P369 HydrophobicContact CB-CB 3.77Å; E119-P369 HydrophobicContact CG-CB 4.09Å; Q123-P369 HydrophobicContact CB-CG 4.4Å; Y364-P369 HydrophobicContact CE2-CB 4.2Å; Y364-P369 HydrophobicContact CE2-CG 3.83Å; P369-I371 PolarHBondContact O-N 2.95Å; P369-I371 VanDerWaalsContact O-N 3.11Å; P369-V372 VanDerWaalsContact O-CG1 3.28Å; P369-V372 WeakPolarHBondContact O-CG1 3.3Å; P369-V372 PolarHBondContact O-N 3.03Å
370	S	96.4	Very high	94.2	Very high	45 Å²	45	61.6 Å²	61.6	32%	0.315	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-63.9	-16.7	-177.2	75.6	0	0	0	0	114.1	A367 G368 V372 H373	A367-S370 PolarHBondContact O-OG 3.01Å; A367-S370 VanDerWaalsContact O-OG 3.14Å; G368-S370 PolarHBondContact O-N 2.95Å; S370-V372 PolarHBondContact O-N 2.95Å; S370-H373 PolarHBondContact O-N 2.86Å; S370-H373 VanDerWaalsContact O-N 3.09Å
371	I	96.3	Very high	94	Very high	13 Å²	13	63.1 Å²	63.1	7%	0.067	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-55.7	-31.6	176.6	-170.9	57.6	0	0	0	112.5	I359 E363 Y364 A367 G368 P369 H373 R374 K375	I359-I371 HydrophobicContact CD1-CG2 4.42Å; I359-I371 HydrophobicContact CG2-CB 4.47Å; I359-I371 HydrophobicContact CG2-CG1 4.03Å; I359-I371 HydrophobicContact CG2-CG2 3.54Å; E363-I371 HydrophobicContact CB-CG1 4.36Å; Y364-I371 HydrophobicContact CD2-CG2 4.5Å; A367-I371 HydrophobicContact CB-CB 4.04Å; A367-I371 HydrophobicContact CB-CD1 4.2Å; A367-I371 HydrophobicContact CB-CG1 4.46Å; G368-I371 VanDerWaalsContact O-CG2 3.24Å; G368-I371 WeakPolarHBondContact O-CG2 3.47Å; G368-I371 PolarHBondContact O-N 3.04Å; P369-I371 PolarHBondContact O-N 2.95Å; P369-I371 VanDerWaalsContact O-N 3.11Å; I371-H373 PolarHBondContact O-N 3.48Å; I371-H373 VanDerWaalsContact O-N 3.14Å; I371-R374 HydrophobicContact CD1-CB 4.42Å; I371-R374 WeakPolarHBondContact O-CB 3.38Å; I371-R374 PolarHBondContact O-N 3.17Å; I371-K375 PolarHBondContact O-N 2.74Å
372	V	95.6	Very high	93.9	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.1	-28.4	179.9	76.5	0	0	0	0	112.6	R118 E119 T122 V136 I359 P369 S370 R374 C376	R118-V372 HydrophobicContact CB-CG1 4.4Å; R118-V372 HydrophobicContact CG-CB 4.48Å; R118-V372 HydrophobicContact CG-CG1 3.83Å; R118-V372 HydrophobicContact CG-CG2 3.79Å; E119-V372 HydrophobicContact CG-CG1 4.39Å; T122-V372 HydrophobicContact CG2-CB 4.46Å; V136-V372 HydrophobicContact CB-CG2 4.3Å; V136-V372 HydrophobicContact CG2-CG2 4.02Å; I359-V372 HydrophobicContact CD1-CB 3.98Å; I359-V372 HydrophobicContact CD1-CG2 3.88Å; P369-V372 VanDerWaalsContact O-CG1 3.28Å; P369-V372 WeakPolarHBondContact O-CG1 3.3Å; P369-V372 PolarHBondContact O-N 3.03Å; S370-V372 PolarHBondContact O-N 2.95Å; V372-R374 VanDerWaalsContact C-N 3.3Å; V372-R374 PolarHBondContact O-N 2.98Å; V372-C376 HydrophobicContact CG2-CB 4.09Å; V372-C376 VanDerWaalsContact O-CB 3.24Å; V372-C376 WeakPolarHBondContact O-CB 3.34Å; V372-C376 PolarHBondContact O-N 3.43Å
373	H	93.7	Very high	93.6	Very high	41 Å²	41	58.6 Å²	58.6	19%	0.19	29%	0.292	C	S	.	.	H	α-helix	trans	-79.1	-12.7	177.3	-62.1	-45.6	0	0	0	114	E119 S370 I371	E119-H373 WeakPolarHBondContact CG-NE2 3.42Å; E119-H373 IonicContact OE1-CD2 2.79Å; E119-H373 PolarHBondContact OE1-CD2 3.33Å; E119-H373 IonicContact OE1-NE2 2.9Å; E119-H373 PolarHBondContact OE1-NE2 3.35Å; S370-H373 PolarHBondContact O-N 2.86Å; S370-H373 VanDerWaalsContact O-N 3.09Å; I371-H373 PolarHBondContact O-N 3.48Å; I371-H373 VanDerWaalsContact O-N 3.14Å
374	R	90.8	Very high	93.4	Very high	168 Å²	168	58.8 Å²	58.8	63%	0.634	30%	0.295	S	S	*	.	H	α-helix	trans	-94.9	-27.2	177.1	-57.8	-176.1	-170.7	168.8	4.8	112.4	I371 V372 F377	I371-R374 HydrophobicContact CD1-CB 4.42Å; I371-R374 WeakPolarHBondContact O-CB 3.38Å; I371-R374 PolarHBondContact O-N 3.17Å; V372-R374 VanDerWaalsContact C-N 3.3Å; V372-R374 PolarHBondContact O-N 2.98Å; R374-F377 WeakPolarHBondContact O-CE2 3.19Å; R374-F377 WeakPolarHBondContact O-CZ 3.3Å
375	K	90.3	Very high	93	Very high	40 Å²	40	62.8 Å²	62.8	17%	0.174	32%	0.315	C	S	.	.	H	α-helix	trans	-105.5	-31.8	-178.1	-71.7	-142.1	179.7	176.3	0	114.5	Q356 M357 W358 I359 E363 I371	Q356-K375 PolarHBondContact O-NZ 3.31Å; M357-K375 WeakPolarHBondContact CE-O 3.41Å; M357-K375 WeakPolarHBondContact O-CD 3.46Å; W358-K375 PolarHBondContact O-NZ 2.83Å; I359-K375 HydrophobicContact CD1-CB 4.33Å; I359-K375 HydrophobicContact CG1-CB 3.9Å; I359-K375 HydrophobicContact CG1-CD 4.07Å; I359-K375 HydrophobicContact CG1-CG 4.24Å; E363-K375 WeakPolarHBondContact OE1-CE 3.44Å; E363-K375 IonicContact OE1-NZ 3.76Å; E363-K375 PolarHBondContact OE1-NZ 3.36Å; E363-K375 WeakPolarHBondContact OE2-CE 3.32Å; E363-K375 IonicContact OE2-NZ 3.02Å; E363-K375 PolarHBondContact OE2-NZ 3.19Å; I371-K375 PolarHBondContact O-N 2.74Å
376	C	87.3	Confident	92.7	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.02	30%	0.295	C	S	.	.			trans	-104	108.7	-176.6	-56.2	0	0	0	0	111	R118 Y135 V136 V372	R118-C376 PolarHBondContact NH1-O 3.45Å; Y135-C376 WeakPolarHBondContact CD2-SG 3.47Å; Y135-C376 HydrophobicContact CE2-CB 4.22Å; Y135-C376 WeakPolarHBondContact CE2-SG 3.44Å; V136-C376 HydrophobicContact CB-CB 4.48Å; V136-C376 PolarHBondContact N-SG 3.46Å; V136-C376 VanDerWaalsContact N-SG 3.38Å; V136-C376 VanDerWaalsContact O-CB 3.28Å; V136-C376 WeakPolarHBondContact O-CB 3.28Å; V372-C376 HydrophobicContact CG2-CB 4.09Å; V372-C376 VanDerWaalsContact O-CB 3.24Å; V372-C376 WeakPolarHBondContact O-CB 3.34Å; V372-C376 PolarHBondContact O-N 3.43Å
377	F	75.1	Confident	92.3	Very high	151 Å²	151	50.4 Å²	50.4	66%	0.662	26%	0.255	S	S	*	.			trans	-109	0	-178.6	-64.4	-74.9	0	0	0	113.3	I138 R374	I138-F377 WeakPolarHBondContact CD1-OXT 3.05Å; R374-F377 WeakPolarHBondContact O-CE2 3.19Å; R374-F377 WeakPolarHBondContact O-CZ 3.3Å

Retrieved 377 of 377 residues in 72.9 ms (Link to these results)

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