A0A096N270_PAPAN Loading...

Lipid droplet-associated hydrolase

AlphaFold DB (H9FY47), UniProt , Accession A0A096N270, Species PAPAN (Papio anubis, Olive baboon), Gene LDAH, Length 325 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	35	Very low	61.2	Low	239 Å²	239	130.4 Å²	130.4	100%	1.177	66%	0.661	S	S	*	*				0	99.3	0	-127.1	174	84.3	0	0	104.8	S3	M1-S3 PolarHBondContact O-N 3.23Å
2	D	37	Very low	63.8	Low	156 Å²	156	125.8 Å²	125.8	83%	0.834	64%	0.635	S	S	*	*			trans	-60.2	118.5	-159.7	-62.1	-48.5	0	0	0	111.1	E4	D2-E4 PolarHBondContact O-N 2.92Å
3	S	40.5	Very low	65.9	Low	108 Å²	108	119.4 Å²	119.4	76%	0.755	60%	0.601	S	S	*	*			trans	-64.7	90.8	156.4	55	0	0	0	0	106.1	M1 L5	M1-S3 PolarHBondContact O-N 3.23Å; S3-L5 VanDerWaalsContact C-N 3.25Å; S3-L5 PolarHBondContact O-N 2.67Å
4	E	44.2	Very low	67.8	Low	176 Å²	176	113 Å²	113	82%	0.822	57%	0.569	S	S	*	*			trans	-50.8	103	158.6	-78.6	-177.7	164.6	0	0	105.8	D2 K6	D2-E4 PolarHBondContact O-N 2.92Å; E4-K6 VanDerWaalsContact C-N 3.29Å; E4-K6 PolarHBondContact O-N 2.7Å
5	L	43.1	Very low	69.3	Low	161 Å²	161	105.7 Å²	105.7	84%	0.843	53%	0.532	S	S	*	.			trans	-50.5	105.7	161	-78.9	152.9	0	0	0	104.1	S3 E7	S3-L5 VanDerWaalsContact C-N 3.25Å; S3-L5 PolarHBondContact O-N 2.67Å; L5-E7 PolarHBondContact O-N 2.85Å
6	K	53	Low	70.7	Confident	205 Å²	205	99.2 Å²	99.2	89%	0.891	50%	0.499	S	S	*	.			trans	-59.6	93.1	172.1	-85	-177	176.2	178.7	0	105.6	E4 E8	E4-K6 VanDerWaalsContact C-N 3.29Å; E4-K6 PolarHBondContact O-N 2.7Å; K6-E8 PolarHBondContact O-N 2.81Å; K6-E8 VanDerWaalsContact O-N 3.08Å
7	E	64.9	Low	71.8	Confident	141 Å²	141	97.6 Å²	97.6	66%	0.659	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-51.1	121.4	172.2	-100.1	-177.2	163.5	0	0	107	L5 I9 R73	L5-E7 PolarHBondContact O-N 2.85Å; E7-I9 PolarHBondContact O-N 3.35Å; E7-R73 PolarHBondContact O-NH2 3.38Å; E7-R73 IonicContact OE2-NH1 3.12Å; E7-R73 PolarHBondContact OE2-NH1 2.94Å; E7-R73 VanDerWaalsContact OE2-NH1 3.12Å
8	E	83	Confident	72.7	Confident	152 Å²	152	92.4 Å²	92.4	71%	0.71	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-56.7	127.3	179.2	-173.1	170.6	-160.7	0	0	109	K6 P10	K6-E8 PolarHBondContact O-N 2.81Å; K6-E8 VanDerWaalsContact O-N 3.08Å; E8-P10 VanDerWaalsContact O-CD 3.31Å; E8-P10 WeakPolarHBondContact O-CD 3.36Å
9	I	88.3	Confident	73.3	Confident	27 Å²	27	88.8 Å²	88.8	14%	0.138	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-75.2	116.4	-179.4	-64.4	167.4	0	0	0	107.6	E7 V11 C28 K65 Y68 S69	E7-I9 PolarHBondContact O-N 3.35Å; I9-V11 PolarHBondContact O-N 3.09Å; I9-C28 WeakPolarHBondContact CG2-SG 3.35Å; I9-K65 HydrophobicContact CB-CD 4.37Å; I9-K65 HydrophobicContact CB-CG 4.21Å; I9-K65 HydrophobicContact CD1-CB 4.06Å; I9-K65 HydrophobicContact CD1-CG 4.49Å; I9-K65 HydrophobicContact CG2-CB 4.4Å; I9-K65 HydrophobicContact CG2-CG 3.94Å; I9-Y68 HydrophobicContact CG1-CD1 4.48Å; I9-Y68 HydrophobicContact CG2-CD1 3.48Å; I9-Y68 VanDerWaalsContact CG2-CD1 3.48Å; I9-Y68 HydrophobicContact CG2-CE1 4.02Å; I9-Y68 HydrophobicContact CG2-CG 4.37Å; I9-S69 WeakPolarHBondContact CD1-OG 3.44Å
10	P	91.1	Very high	73.9	Confident	50 Å²	50	87.6 Å²	87.6	33%	0.325	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-68.1	129.9	-177.3	28	-33.8	0	0	0	109.7	E8 C28 G29	E8-P10 VanDerWaalsContact O-CD 3.31Å; E8-P10 WeakPolarHBondContact O-CD 3.36Å; P10-C28 WeakPolarHBondContact O-CA 3.24Å; P10-G29 PolarHBondContact O-N 3.11Å
11	V	92.8	Very high	74.6	Confident	19 Å²	19	84.2 Å²	84.2	12%	0.115	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	125.6	168.6	-178.4	0	0	0	0	107.5	I9 L26 K27 C28 V61 K65 F223	I9-V11 PolarHBondContact O-N 3.09Å; V11-L26 HydrophobicContact CG1-CB 4.4Å; V11-L26 HydrophobicContact CG1-CD2 4.45Å; V11-K27 CarbonylContact C-O 3.44Å; V11-K27 WeakPolarHBondContact CA-O 3.3Å; V11-C28 HydrophobicContact CG2-CB 4.15Å; V11-V61 HydrophobicContact CG2-CG1 4.34Å; V11-K65 HydrophobicContact CG2-CD 4.19Å; V11-K65 HydrophobicContact CG2-CG 3.81Å; V11-F223 HydrophobicContact CB-CE2 3.74Å; V11-F223 HydrophobicContact CB-CZ 3.82Å; V11-F223 HydrophobicContact CG1-CD2 4.43Å; V11-F223 HydrophobicContact CG1-CE2 3.41Å; V11-F223 VanDerWaalsContact CG1-CE2 3.41Å; V11-F223 HydrophobicContact CG1-CZ 3.63Å; V11-F223 WeakPolarHBondContact O-CZ 3.38Å
12	H	92.3	Very high	77.2	Confident	76 Å²	76	76.3 Å²	76.3	35%	0.352	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	127	-180	-60	-80.6	0	0	0	109.5	L26 K27 T32	H12-L26 WeakPolarHBondContact O-CA 3.33Å; H12-K27 HydrophobicContact CB-CB 4.46Å; H12-K27 PolarHBondContact N-O 2.95Å; H12-K27 PolarHBondContact O-N 2.79Å; H12-T32 HydrophobicContact CB-CG2 3.68Å; H12-T32 WeakPolarHBondContact CD2-CG2 3.38Å; H12-T32 VanDerWaalsContact CG-CG2 3.45Å
13	E	91.7	Very high	79.9	Confident	42 Å²	42	68.9 Å²	68.9	20%	0.196	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	120.6	173.4	177.9	-177.7	-140.7	0	0	110.7	F15 Q24 L26 K92 F223	E13-F15 HydrophobicContact CG-CD2 4.47Å; E13-F15 HydrophobicContact CG-CE2 3.83Å; E13-Q24 HydrophobicContact CG-CG 4.38Å; E13-Q24 PolarHBondContact OE1-NE2 3.22Å; E13-L26 HydrophobicContact CB-CD2 3.63Å; E13-L26 HydrophobicContact CG-CD2 3.87Å; E13-K92 VanDerWaalsContact CD-NZ 3.28Å; E13-K92 IonicContact OE2-NZ 3.77Å; E13-K92 PolarHBondContact OE2-NZ 3.01Å; E13-F223 HydrophobicContact CB-CD1 3.57Å; E13-F223 HydrophobicContact CB-CE1 3.47Å; E13-F223 VanDerWaalsContact CB-CE1 3.47Å; E13-F223 HydrophobicContact CB-CZ 4.45Å; E13-F223 HydrophobicContact CG-CD1 4.18Å
14	E	91.8	Very high	82.4	Confident	30 Å²	30	64 Å²	64	14%	0.14	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	147	177.5	-67.5	178	-155.8	0	0	110.7	I16 Q24 V25 K27 L95	E14-I16 HydrophobicContact CB-CG2 4.38Å; E14-Q24 WeakPolarHBondContact O-CA 3.43Å; E14-V25 PolarHBondContact N-O 3.4Å; E14-V25 PolarHBondContact O-N 3.44Å; E14-K27 WeakPolarHBondContact OE1-CD 3.5Å; E14-K27 IonicContact OE1-NZ 2.85Å; E14-K27 PolarHBondContact OE1-NZ 3.47Å; E14-K27 VanDerWaalsContact OE1-NZ 3.1Å; E14-K27 WeakPolarHBondContact OE2-CE 3.45Å; E14-K27 IonicContact OE2-NZ 4Å; E14-K27 PolarHBondContact OE2-NZ 3.26Å; E14-L95 HydrophobicContact CB-CD1 4.28Å; E14-L95 HydrophobicContact CG-CD1 4.11Å
15	F	91.3	Very high	84.9	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.5	167.2	-71.3	-92.2	0	0	0	107.4	E13 T23 Q24 L87 A88 P89 K92 I94 L95	E13-F15 HydrophobicContact CG-CD2 4.47Å; E13-F15 HydrophobicContact CG-CE2 3.83Å; F15-T23 WeakPolarHBondContact CA-O 3.41Å; F15-Q24 HydrophobicContact CD1-CB 4.13Å; F15-Q24 HydrophobicContact CE1-CB 3.68Å; F15-Q24 HydrophobicContact CE1-CG 3.97Å; F15-Q24 HydrophobicContact CE2-CG 4.49Å; F15-Q24 HydrophobicContact CZ-CB 4.16Å; F15-Q24 HydrophobicContact CZ-CG 3.9Å; F15-L87 VanDerWaalsContact CE1-O 3.29Å; F15-L87 WeakPolarHBondContact CE1-O 3.33Å; F15-A88 HydrophobicContact CB-CB 4.06Å; F15-A88 VanDerWaalsContact CD1-CA 3.47Å; F15-A88 HydrophobicContact CD1-CB 3.62Å; F15-A88 HydrophobicContact CD2-CB 4.46Å; F15-A88 VanDerWaalsContact CE1-CA 3.49Å; F15-A88 HydrophobicContact CE1-CB 4.18Å; F15-A88 HydrophobicContact CG-CB 3.78Å; F15-P89 HydrophobicContact CE2-CG 4.42Å; F15-K92 HydrophobicContact CD2-CB 4.42Å; F15-K92 HydrophobicContact CD2-CD 3.61Å; F15-K92 HydrophobicContact CE2-CD 3.62Å; F15-I94 WeakPolarHBondContact O-CA 3.47Å; F15-L95 PolarHBondContact O-N 3.22Å
16	I	90.8	Very high	87.3	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	151.9	-176	61.8	164.4	0	0	0	109.8	E14 C18 E22 T23 V25 L95 F122 H126	E14-I16 HydrophobicContact CB-CG2 4.38Å; I16-C18 HydrophobicContact CD1-CB 4.04Å; I16-C18 HydrophobicContact CG1-CB 4.37Å; I16-E22 CarbonylContact O-C 3.57Å; I16-E22 WeakPolarHBondContact O-CA 3.32Å; I16-T23 WeakPolarHBondContact CG1-O 3.21Å; I16-T23 PolarHBondContact N-O 3.43Å; I16-T23 PolarHBondContact O-N 3.29Å; I16-V25 HydrophobicContact CD1-CG2 3.69Å; I16-V25 HydrophobicContact CG1-CG2 3.92Å; I16-L95 WeakPolarHBondContact CA-O 3.5Å; I16-L95 HydrophobicContact CG2-CB 4.17Å; I16-L95 HydrophobicContact CG2-CD1 4.41Å; I16-F122 HydrophobicContact CD1-CD2 3.3Å; I16-F122 HydrophobicContact CD1-CE2 3.38Å; I16-H126 VanDerWaalsContact CD1-NE2 3.3Å; I16-H126 WeakPolarHBondContact CD1-NE2 3.38Å
17	L	89.4	Confident	89.4	Confident	73 Å²	73	38.7 Å²	38.7	38%	0.382	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	107.2	168.6	-171.9	67.3	0	0	0	109.1	I94 L95 T96	L17-I94 HydrophobicContact CB-CG2 4.14Å; L17-L95 PolarHBondContact N-O 3.33Å; L17-T96 HydrophobicContact CD2-CG2 4.4Å
18	C	89.1	Confident	90.8	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.02	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	122.5	-179.1	-173.6	0	0	0	0	110.1	I16 G20 V21	I16-C18 HydrophobicContact CD1-CB 4.04Å; I16-C18 HydrophobicContact CG1-CB 4.37Å; C18-G20 PolarHBondContact O-N 3.31Å; C18-V21 PolarHBondContact N-O 3.19Å; C18-V21 PolarHBondContact O-N 2.86Å; C18-V21 VanDerWaalsContact O-N 3.09Å
19	G	83.9	Confident	91.2	Very high	25 Å²	25	24.9 Å²	24.9	26%	0.258	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	26.7	-177.3	0	0	0	0	0	113.9	V21 I109	G19-V21 VanDerWaalsContact C-N 3.34Å; G19-I109 WeakPolarHBondContact O-CD1 3.47Å
20	G	84	Confident	91.2	Very high	63 Å²	63	26.9 Å²	26.9	65%	0.649	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	4.5	-176.6	0	0	0	0	0	115.1	C18	C18-G20 PolarHBondContact O-N 3.31Å
21	V	88.5	Confident	91	Very high	17 Å²	17	25.9 Å²	25.9	10%	0.103	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.5	179.7	171.3	0	0	0	0	111.4	C18 G19 T23 A83 I109 Y110	C18-V21 PolarHBondContact N-O 3.19Å; C18-V21 PolarHBondContact O-N 2.86Å; C18-V21 VanDerWaalsContact O-N 3.09Å; G19-V21 VanDerWaalsContact C-N 3.34Å; V21-T23 PolarHBondContact O-N 3.33Å; V21-T23 PolarHBondContact O-OG1 3.19Å; V21-A83 HydrophobicContact CG1-CB 4.23Å; V21-I109 HydrophobicContact CB-CD1 3.87Å; V21-I109 HydrophobicContact CG2-CD1 3.67Å; V21-I109 HydrophobicContact CG2-CG1 4.33Å; V21-I109 HydrophobicContact CG2-CG2 3.81Å; V21-Y110 HydrophobicContact CG1-CE1 4.03Å; V21-Y110 HydrophobicContact CG2-CE1 4.02Å
22	E	90.8	Very high	90.5	Very high	73 Å²	73	27.2 Å²	27.2	34%	0.341	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	123.6	170.3	-67	172.3	-162.3	0	0	110.4	I16 A88 I94	I16-E22 CarbonylContact O-C 3.57Å; I16-E22 WeakPolarHBondContact O-CA 3.32Å; E22-A88 VanDerWaalsContact OE2-CB 3.32Å; E22-A88 WeakPolarHBondContact OE2-CB 3.23Å; E22-I94 VanDerWaalsContact CD-CD1 3.42Å; E22-I94 HydrophobicContact CG-CD1 3.81Å; E22-I94 HydrophobicContact CG-CG1 4.21Å; E22-I94 HydrophobicContact CG-CG2 4.37Å; E22-I94 WeakPolarHBondContact OE1-CD1 3.33Å
23	T	92.8	Very high	90.1	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	127.1	-173.4	-58.5	0	0	0	0	109.9	F15 I16 V21 V25 I80 H118	F15-T23 WeakPolarHBondContact CA-O 3.41Å; I16-T23 WeakPolarHBondContact CG1-O 3.21Å; I16-T23 PolarHBondContact N-O 3.43Å; I16-T23 PolarHBondContact O-N 3.29Å; V21-T23 PolarHBondContact O-N 3.33Å; V21-T23 PolarHBondContact O-OG1 3.19Å; T23-V25 HydrophobicContact CG2-CG2 4.44Å; T23-I80 HydrophobicContact CG2-CD1 4.09Å; T23-I80 HydrophobicContact CG2-CG1 3.76Å; T23-H118 VanDerWaalsContact CG2-CE1 3.45Å; T23-H118 WeakPolarHBondContact CG2-CE1 3.28Å; T23-H118 PolarHBondContact OG1-NE2 3.2Å
24	Q	94.1	Very high	89.7	Confident	6 Å²	6	24.7 Å²	24.7	3%	0.028	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	130.8	173	-173.2	-173.3	43.5	0	0	110.3	E13 E14 F15 S57 S81 A86	E13-Q24 HydrophobicContact CG-CG 4.38Å; E13-Q24 PolarHBondContact OE1-NE2 3.22Å; E14-Q24 WeakPolarHBondContact O-CA 3.43Å; F15-Q24 HydrophobicContact CD1-CB 4.13Å; F15-Q24 HydrophobicContact CE1-CB 3.68Å; F15-Q24 HydrophobicContact CE1-CG 3.97Å; F15-Q24 HydrophobicContact CE2-CG 4.49Å; F15-Q24 HydrophobicContact CZ-CB 4.16Å; F15-Q24 HydrophobicContact CZ-CG 3.9Å; Q24-S57 PolarHBondContact OE1-OG 3Å; Q24-S57 VanDerWaalsContact OE1-OG 3.06Å; Q24-S81 VanDerWaalsContact O-CB 3.29Å; Q24-S81 WeakPolarHBondContact O-CB 3.38Å; Q24-S81 PolarHBondContact O-N 2.88Å; Q24-A86 HydrophobicContact CB-CB 3.72Å
25	V	95.3	Very high	89.2	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.5	173.2	-175.2	0	0	0	0	108.5	E14 I16 T23 K27 T79 I80 F122	E14-V25 PolarHBondContact N-O 3.4Å; E14-V25 PolarHBondContact O-N 3.44Å; I16-V25 HydrophobicContact CD1-CG2 3.69Å; I16-V25 HydrophobicContact CG1-CG2 3.92Å; T23-V25 HydrophobicContact CG2-CG2 4.44Å; V25-K27 HydrophobicContact CG1-CG 4.02Å; V25-T79 WeakPolarHBondContact CA-O 3.41Å; V25-I80 HydrophobicContact CG2-CG1 4.28Å; V25-F122 HydrophobicContact CG1-CE2 4.29Å; V25-F122 HydrophobicContact CG1-CZ 4.03Å; V25-F122 HydrophobicContact CG2-CD2 4.4Å; V25-F122 HydrophobicContact CG2-CE2 3.78Å; V25-F122 HydrophobicContact CG2-CZ 4.31Å
26	L	94.9	Very high	88.4	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	123.1	175.1	-64.2	167.3	0	0	0	108.7	V11 H12 E13 S57 A58 V61 W78 T79 F223	V11-L26 HydrophobicContact CG1-CB 4.4Å; V11-L26 HydrophobicContact CG1-CD2 4.45Å; H12-L26 WeakPolarHBondContact O-CA 3.33Å; E13-L26 HydrophobicContact CB-CD2 3.63Å; E13-L26 HydrophobicContact CG-CD2 3.87Å; L26-S57 WeakPolarHBondContact CD1-O 3.38Å; L26-S57 WeakPolarHBondContact CD1-OG 3.39Å; L26-A58 VanDerWaalsContact CD1-CA 3.45Å; L26-A58 HydrophobicContact CD1-CB 4.3Å; L26-V61 HydrophobicContact CD1-CG2 3.5Å; L26-W78 CarbonylContact O-C 3.59Å; L26-W78 WeakPolarHBondContact O-CA 3.31Å; L26-T79 PolarHBondContact N-O 3.34Å; L26-T79 PolarHBondContact O-N 3.25Å; L26-F223 HydrophobicContact CD2-CD1 4.12Å; L26-F223 HydrophobicContact CD2-CD2 4.16Å; L26-F223 HydrophobicContact CD2-CE1 4.33Å; L26-F223 HydrophobicContact CD2-CE2 4.37Å; L26-F223 HydrophobicContact CD2-CG 4.03Å; L26-F223 HydrophobicContact CD2-CZ 4.46Å
27	K	95.5	Very high	87.4	Confident	6 Å²	6	35.3 Å²	35.3	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	109.4	-175.6	-60.9	-176.2	179.6	166	0	109.2	V11 H12 E14 V25 T32 W78	V11-K27 CarbonylContact C-O 3.44Å; V11-K27 WeakPolarHBondContact CA-O 3.3Å; H12-K27 HydrophobicContact CB-CB 4.46Å; H12-K27 PolarHBondContact N-O 2.95Å; H12-K27 PolarHBondContact O-N 2.79Å; E14-K27 WeakPolarHBondContact OE1-CD 3.5Å; E14-K27 IonicContact OE1-NZ 2.85Å; E14-K27 PolarHBondContact OE1-NZ 3.47Å; E14-K27 VanDerWaalsContact OE1-NZ 3.1Å; E14-K27 WeakPolarHBondContact OE2-CE 3.45Å; E14-K27 IonicContact OE2-NZ 4Å; E14-K27 PolarHBondContact OE2-NZ 3.26Å; V25-K27 HydrophobicContact CG1-CG 4.02Å; K27-T32 HydrophobicContact CD-CG2 4.48Å; K27-T32 PolarHBondContact NZ-O 3.45Å; K27-W78 HydrophobicContact CB-CG 4.3Å; K27-W78 HydrophobicContact CD-CD2 4.12Å; K27-W78 HydrophobicContact CD-CH2 4.24Å; K27-W78 HydrophobicContact CD-CZ2 3.7Å; K27-W78 HydrophobicContact CG-CD2 3.93Å; K27-W78 HydrophobicContact CG-CG 3.89Å; K27-W78 HydrophobicContact CG-CZ2 4.35Å
28	C	95.4	Very high	86.1	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.6	177.8	-174.9	0	0	0	0	110.4	I9 P10 V11 A64 Y68 P76 V77	I9-C28 WeakPolarHBondContact CG2-SG 3.35Å; P10-C28 WeakPolarHBondContact O-CA 3.24Å; V11-C28 HydrophobicContact CG2-CB 4.15Å; C28-A64 HydrophobicContact CB-CB 4.22Å; C28-Y68 VanDerWaalsContact SG-CB 3.56Å; C28-P76 WeakPolarHBondContact O-CA 3.46Å; C28-V77 HydrophobicContact CB-CB 4.16Å; C28-V77 VanDerWaalsContact CB-O 3.28Å; C28-V77 WeakPolarHBondContact CB-O 3.47Å; C28-V77 PolarHBondContact N-O 3.2Å; C28-V77 PolarHBondContact O-N 2.95Å
29	G	91.6	Very high	85	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	102.8	169.9	-171.4	0	0	0	0	0	112.8	P10 W31	P10-G29 PolarHBondContact O-N 3.11Å; G29-W31 PolarHBondContact O-N 3.37Å
30	P	88.2	Confident	83.9	Confident	70 Å²	70	49.4 Å²	49.4	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-72.7	-12.6	-173.2	29.7	-36.6	0	0	0	113.9	T32 Y68	P30-T32 PolarHBondContact O-N 3.09Å; P30-Y68 WeakPolarHBondContact CD-OH 3.36Å
31	W	87.8	Confident	83.3	Confident	29 Å²	29	54.6 Å²	54.6	11%	0.11	28%	0.284	C	S	.	.			trans	-90.6	101.7	-175.4	-55.9	-76.9	0	0	0	111.3	G29 L34 D37 P43 Y68 P76 W78	G29-W31 PolarHBondContact O-N 3.37Å; W31-L34 HydrophobicContact CB-CD2 4.12Å; W31-D37 VanDerWaalsContact CD1-OD2 3.22Å; W31-P43 HydrophobicContact CB-CG 4.3Å; W31-P43 VanDerWaalsContact CD1-CD 3.48Å; W31-P43 HydrophobicContact CD2-CG 3.9Å; W31-P43 HydrophobicContact CE3-CG 4.37Å; W31-P43 HydrophobicContact CG-CG 3.84Å; W31-Y68 HydrophobicContact CZ3-CE2 4.17Å; W31-P76 HydrophobicContact CB-CB 4.36Å; W31-P76 HydrophobicContact CE3-CB 4.2Å; W31-P76 HydrophobicContact CE3-CG 4.4Å; W31-W78 PolarHBondContact O-NE1 3.09Å
32	T	81.7	Confident	82.9	Confident	46 Å²	46	57.8 Å²	57.8	28%	0.282	29%	0.294	S	S	.	.	S	Bend	trans	-101.9	-30.8	176.7	54.1	0	0	0	0	112.9	H12 K27 P30	H12-T32 HydrophobicContact CB-CG2 3.68Å; H12-T32 WeakPolarHBondContact CD2-CG2 3.38Å; H12-T32 VanDerWaalsContact CG-CG2 3.45Å; K27-T32 HydrophobicContact CD-CG2 4.48Å; K27-T32 PolarHBondContact NZ-O 3.45Å; P30-T32 PolarHBondContact O-N 3.09Å
33	D	84	Confident	82.6	Confident	65 Å²	65	54.8 Å²	54.8	35%	0.348	28%	0.281	S	S	.	.			trans	-118.6	102.9	175.6	-175	-17	0	0	0	110.4	F35 N36 D37	D33-F35 VanDerWaalsContact C-N 3.3Å; D33-F35 PolarHBondContact O-N 3.06Å; D33-F35 PolarHBondContact OD1-N 2.92Å; D33-N36 PolarHBondContact OD1-N 3.07Å; D33-N36 WeakPolarHBondContact OD2-CB 3.16Å; D33-N36 PolarHBondContact OD2-ND2 3.34Å; D33-D37 WeakPolarHBondContact O-CB 3.48Å; D33-D37 PolarHBondContact O-N 3.28Å
34	L	83.8	Confident	82.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.3	-178.9	-67.1	174.1	0	0	0	113.5	W31 R42 P43 L46 P76 W78 P128 M131	W31-L34 HydrophobicContact CB-CD2 4.12Å; L34-R42 VanDerWaalsContact O-CZ 3.26Å; L34-R42 PolarHBondContact O-NE 2.98Å; L34-R42 PolarHBondContact O-NH2 3.37Å; L34-P43 HydrophobicContact CD2-CG 3.69Å; L34-L46 HydrophobicContact CD1-CD2 4.26Å; L34-P76 HydrophobicContact CD2-CG 4.34Å; L34-W78 HydrophobicContact CB-CH2 4.18Å; L34-W78 HydrophobicContact CD1-CE3 4.34Å; L34-W78 HydrophobicContact CD1-CH2 3.27Å; L34-W78 HydrophobicContact CD1-CZ2 3.54Å; L34-W78 HydrophobicContact CD1-CZ3 3.7Å; L34-W78 HydrophobicContact CD2-CZ2 4.25Å; L34-W78 HydrophobicContact CG-CH2 3.4Å; L34-W78 VanDerWaalsContact CG-CH2 3.4Å; L34-W78 HydrophobicContact CG-CZ2 3.49Å; L34-W78 VanDerWaalsContact CG-CZ2 3.49Å; L34-W78 HydrophobicContact CG-CZ3 4.31Å; L34-P128 HydrophobicContact CB-CG 3.92Å; L34-P128 WeakPolarHBondContact O-CG 3.35Å; L34-M131 HydrophobicContact CB-CE 4.45Å; L34-M131 HydrophobicContact CD1-CE 4.1Å; L34-M131 HydrophobicContact CD2-CE 4.06Å; L34-M131 HydrophobicContact CG-CE 4.43Å
35	F	80.2	Confident	82.5	Confident	94 Å²	94	62.1 Å²	62.1	41%	0.412	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-47.5	179.9	-78.1	-74.4	0	0	0	112.1	D33 T125 P128	D33-F35 VanDerWaalsContact C-N 3.3Å; D33-F35 PolarHBondContact O-N 3.06Å; D33-F35 PolarHBondContact OD1-N 2.92Å; F35-T125 VanDerWaalsContact CE2-O 3.26Å; F35-T125 WeakPolarHBondContact CE2-O 3.45Å; F35-P128 HydrophobicContact CD1-CG 4.24Å; F35-P128 HydrophobicContact CE1-CB 4.32Å; F35-P128 HydrophobicContact CE1-CG 4.23Å
36	N	74.1	Confident	82.6	Confident	119 Å²	119	62.1 Å²	62.1	64%	0.636	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-7.8	-171.5	-59.8	-52.4	0	0	0	113.7	D33 Q38	D33-N36 PolarHBondContact OD1-N 3.07Å; D33-N36 WeakPolarHBondContact OD2-CB 3.16Å; D33-N36 PolarHBondContact OD2-ND2 3.34Å; N36-Q38 PolarHBondContact O-N 3.29Å
37	D	69.4	Low	82.8	Confident	45 Å²	45	61.9 Å²	61.9	24%	0.241	31%	0.311	C	S	.	.			trans	-70.6	97.9	174.2	-167.7	-27.9	0	0	0	110.7	W31 D33 S39	W31-D37 VanDerWaalsContact CD1-OD2 3.22Å; D33-D37 WeakPolarHBondContact O-CB 3.48Å; D33-D37 PolarHBondContact O-N 3.28Å; D37-S39 PolarHBondContact O-N 3.02Å; D37-S39 WeakPolarHBondContact OD1-CA 3.45Å; D37-S39 WeakPolarHBondContact OD1-CB 3.24Å; D37-S39 PolarHBondContact OD1-N 3.32Å; D37-S39 PolarHBondContact OD1-OG 3.08Å
38	Q	62.5	Low	82.9	Confident	188 Å²	188	61.6 Å²	61.6	88%	0.879	31%	0.31	S	S	*	.			trans	-85.1	12	176.3	-63	-170.7	-1	0	0	113.1	N36	N36-Q38 PolarHBondContact O-N 3.29Å
39	S	65.9	Low	83.1	Confident	49 Å²	49	61.5 Å²	61.5	34%	0.343	31%	0.31	S	S	.	.			trans	-63.8	142.9	179	70.3	0	0	0	0	110.9	D37 K41 R42	D37-S39 PolarHBondContact O-N 3.02Å; D37-S39 WeakPolarHBondContact OD1-CA 3.45Å; D37-S39 WeakPolarHBondContact OD1-CB 3.24Å; D37-S39 PolarHBondContact OD1-N 3.32Å; D37-S39 PolarHBondContact OD1-OG 3.08Å; S39-K41 PolarHBondContact O-N 3.12Å; S39-R42 WeakPolarHBondContact O-CB 3.42Å; S39-R42 PolarHBondContact O-N 2.74Å; S39-R42 PolarHBondContact OG-N 2.79Å
40	V	61.8	Low	83.4	Confident	159 Å²	159	61.5 Å²	61.5	96%	0.964	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-13.5	171.1	-172.6	0	0	0	0	111.6
41	K	70.5	Confident	83.9	Confident	172 Å²	172	58.2 Å²	58.2	75%	0.748	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	15.6	178.7	-62.8	-176.3	179.3	-179.5	0	113.6	S39	S39-K41 PolarHBondContact O-N 3.12Å
42	R	79.9	Confident	84.4	Confident	85 Å²	85	56.9 Å²	56.9	32%	0.321	28%	0.284	S	S	.	.			trans	-54.1	129.1	176.8	-172.3	-178.8	-176.1	-148	10.5	110.4	L34 S39	L34-R42 VanDerWaalsContact O-CZ 3.26Å; L34-R42 PolarHBondContact O-NE 2.98Å; L34-R42 PolarHBondContact O-NH2 3.37Å; S39-R42 WeakPolarHBondContact O-CB 3.42Å; S39-R42 PolarHBondContact O-N 2.74Å; S39-R42 PolarHBondContact OG-N 2.79Å
43	P	86.3	Confident	85.1	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.058	28%	0.282	C	S	.	.			trans	-68.5	141.4	-179.2	28.5	-34.4	0	0	0	109.7	W31 L34 P76 M131	W31-P43 HydrophobicContact CB-CG 4.3Å; W31-P43 VanDerWaalsContact CD1-CD 3.48Å; W31-P43 HydrophobicContact CD2-CG 3.9Å; W31-P43 HydrophobicContact CE3-CG 4.37Å; W31-P43 HydrophobicContact CG-CG 3.84Å; L34-P43 HydrophobicContact CD2-CG 3.69Å; P43-P76 HydrophobicContact CB-CG 4.07Å; P43-P76 HydrophobicContact CG-CG 3.76Å; P43-M131 VanDerWaalsContact O-CE 3.23Å; P43-M131 WeakPolarHBondContact O-CE 3.45Å
44	K	89.2	Confident	85.5	Confident	161 Å²	161	56.5 Å²	56.5	70%	0.7	28%	0.283	S	S	*	.	S	Bend	trans	-93.8	-3.2	175.8	-63.5	-176.1	-179.9	177.6	0	113.4	K132 M325	K44-K132 WeakPolarHBondContact O-CB 3.28Å; K44-K132 PolarHBondContact O-N 3.47Å; K44-M325 HydrophobicContact CB-CE 4.4Å
45	L	94.8	Very high	86	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	138.6	-176.3	-173	80.2	0	0	0	109.3	I47 F75 P76 M131 K132 V134 I158 L322 M325	L45-I47 HydrophobicContact CD2-CG1 4.49Å; L45-F75 HydrophobicContact CB-CD1 3.57Å; L45-F75 HydrophobicContact CB-CE1 3.87Å; L45-F75 HydrophobicContact CB-CG 4.13Å; L45-F75 HydrophobicContact CD2-CB 4.44Å; L45-F75 HydrophobicContact CD2-CD1 4.08Å; L45-F75 HydrophobicContact CD2-CD2 4.01Å; L45-F75 HydrophobicContact CD2-CE1 4.3Å; L45-F75 HydrophobicContact CD2-CE2 4.27Å; L45-F75 HydrophobicContact CD2-CG 3.9Å; L45-F75 HydrophobicContact CD2-CZ 4.4Å; L45-F75 HydrophobicContact CG-CD1 4.42Å; L45-P76 WeakPolarHBondContact O-CD 3.47Å; L45-M131 VanDerWaalsContact C-SD 3.56Å; L45-M131 PolarHBondContact N-SD 3.22Å; L45-M131 VanDerWaalsContact N-SD 3.39Å; L45-K132 CarbonylContact C-O 3.46Å; L45-K132 WeakPolarHBondContact CA-O 3.31Å; L45-K132 HydrophobicContact CD1-CB 3.53Å; L45-V134 HydrophobicContact CD1-CG2 4.15Å; L45-V134 HydrophobicContact CD2-CG2 4.02Å; L45-V134 HydrophobicContact CG-CG2 4.4Å; L45-I158 HydrophobicContact CD1-CD1 3.42Å; L45-I158 VanDerWaalsContact CD1-CD1 3.42Å; L45-I158 HydrophobicContact CD1-CG1 3.91Å; L45-I158 HydrophobicContact CD2-CD1 4.46Å; L45-L322 HydrophobicContact CD2-CD2 3.46Å; L45-L322 VanDerWaalsContact CD2-CD2 3.46Å; L45-M325 HydrophobicContact CB-CE 4.03Å; L45-M325 HydrophobicContact CD1-CE 4.25Å; L45-M325 HydrophobicContact CD1-SD 4.16Å
46	L	97.4	Very high	86.5	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.9	167.2	171.5	65.4	0	0	0	109.7	L34 F48 P76 W78 V127 M131 K132 L133 V134	L34-L46 HydrophobicContact CD1-CD2 4.26Å; L46-F48 HydrophobicContact CD2-CB 4.4Å; L46-F48 HydrophobicContact CD2-CD2 4.37Å; L46-F48 HydrophobicContact CG-CB 4.33Å; L46-P76 HydrophobicContact CD1-CB 4.09Å; L46-P76 HydrophobicContact CD1-CG 3.87Å; L46-W78 HydrophobicContact CD1-CB 3.9Å; L46-W78 HydrophobicContact CD1-CD2 3.66Å; L46-W78 HydrophobicContact CD1-CE3 4.13Å; L46-W78 HydrophobicContact CD1-CG 3.52Å; L46-W78 HydrophobicContact CD2-CD2 4.28Å; L46-W78 HydrophobicContact CD2-CE3 3.88Å; L46-W78 HydrophobicContact CD2-CZ3 4.42Å; L46-V127 HydrophobicContact CD2-CG1 4.08Å; L46-V127 HydrophobicContact CD2-CG2 3.63Å; L46-M131 HydrophobicContact CB-CG 3.91Å; L46-M131 HydrophobicContact CB-SD 4.29Å; L46-K132 PolarHBondContact N-O 2.95Å; L46-L133 HydrophobicContact CB-CD2 4.04Å; L46-L133 HydrophobicContact CD2-CD2 4.11Å; L46-L133 HydrophobicContact CG-CD2 4.36Å; L46-L133 WeakPolarHBondContact O-CA 3.46Å; L46-V134 PolarHBondContact O-N 3.03Å
47	I	98.3	Very high	87.4	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	114	166.4	-58.5	171.8	0	0	0	106.9	L45 L67 T71 F75 P76 V77 W78 V134 I136	L45-I47 HydrophobicContact CD2-CG1 4.49Å; I47-L67 HydrophobicContact CG2-CD1 4.46Å; I47-T71 HydrophobicContact CD1-CG2 3.89Å; I47-F75 HydrophobicContact CD1-CB 4.33Å; I47-F75 HydrophobicContact CG1-CB 4.49Å; I47-P76 PolarHBondContact N-O 3.02Å; I47-V77 HydrophobicContact CB-CB 4.46Å; I47-V77 HydrophobicContact CB-CG1 4.29Å; I47-V77 HydrophobicContact CB-CG2 4.12Å; I47-V77 HydrophobicContact CD1-CG2 4.12Å; I47-V77 HydrophobicContact CG2-CG1 4.05Å; I47-V77 HydrophobicContact CG2-CG2 4.47Å; I47-V77 CarbonylContact O-C 3.59Å; I47-V77 WeakPolarHBondContact O-CA 3.45Å; I47-W78 PolarHBondContact O-N 3.42Å; I47-V134 WeakPolarHBondContact CA-O 3.35Å; I47-V134 HydrophobicContact CG1-CB 4.18Å; I47-V134 HydrophobicContact CG2-CG1 4.42Å; I47-I136 HydrophobicContact CG2-CD1 3.6Å; I47-I136 HydrophobicContact CG2-CG1 4.3Å
48	F	98.7	Very high	88.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.6	-173.2	-169.6	-119	0	0	0	111.1	L46 I50 W78 I80 F122 L123 V134 L135 I136	L46-F48 HydrophobicContact CD2-CB 4.4Å; L46-F48 HydrophobicContact CD2-CD2 4.37Å; L46-F48 HydrophobicContact CG-CB 4.33Å; F48-I50 HydrophobicContact CD1-CD1 4.27Å; F48-I50 HydrophobicContact CD1-CG1 3.94Å; F48-I50 HydrophobicContact CE1-CD1 4.29Å; F48-I50 HydrophobicContact CE1-CG1 3.9Å; F48-W78 WeakPolarHBondContact CA-O 3.4Å; F48-W78 HydrophobicContact CD2-CB 4.1Å; F48-I80 HydrophobicContact CE1-CG2 3.97Å; F48-I80 HydrophobicContact CE2-CB 4.07Å; F48-I80 HydrophobicContact CE2-CG2 3.93Å; F48-I80 HydrophobicContact CZ-CB 3.83Å; F48-I80 HydrophobicContact CZ-CD1 4.44Å; F48-I80 HydrophobicContact CZ-CG2 3.32Å; F48-F122 HydrophobicContact CD2-CE1 4.32Å; F48-F122 AromaticContact CE2-CD1 3.71Å; F48-F122 HydrophobicContact CE2-CD1 3.71Å; F48-F122 AromaticContact CE2-CE1 3.36Å; F48-F122 HydrophobicContact CE2-CE1 3.36Å; F48-F122 HydrophobicContact CE2-CZ 4.35Å; F48-F122 AromaticContact CZ-CD1 3.5Å; F48-F122 HydrophobicContact CZ-CD1 3.5Å; F48-F122 AromaticContact CZ-CE1 3.71Å; F48-F122 HydrophobicContact CZ-CE1 3.71Å; F48-L123 HydrophobicContact CD1-CD2 4.06Å; F48-L123 HydrophobicContact CE1-CD2 4Å; F48-L123 HydrophobicContact CE1-CG 4.31Å; F48-L123 HydrophobicContact CG-CD2 4.31Å; F48-L123 HydrophobicContact CZ-CD2 4.22Å; F48-V134 PolarHBondContact N-O 2.96Å; F48-L135 HydrophobicContact CB-CD2 4.04Å; F48-L135 HydrophobicContact CD1-CD2 4.04Å; F48-I136 PolarHBondContact O-N 2.9Å
49	I	98.8	Very high	89.7	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	125.8	-178.4	-59.2	167.2	0	0	0	109.1	Y60 F63 A64 L67 V77 W78 T79 I80 I136	I49-Y60 HydrophobicContact CG2-CD1 3.57Å; I49-Y60 HydrophobicContact CG2-CE1 4.03Å; I49-Y60 HydrophobicContact CG2-CG 4.16Å; I49-F63 HydrophobicContact CD1-CD1 3.79Å; I49-F63 HydrophobicContact CD1-CE1 3.95Å; I49-F63 HydrophobicContact CG1-CE1 4.33Å; I49-A64 HydrophobicContact CD1-CB 4.04Å; I49-L67 HydrophobicContact CD1-CD1 4.19Å; I49-V77 HydrophobicContact CD1-CG1 3.5Å; I49-V77 HydrophobicContact CG1-CG1 4.14Å; I49-W78 PolarHBondContact N-O 3.45Å; I49-T79 HydrophobicContact CB-CG2 4.04Å; I49-T79 HydrophobicContact CG2-CG2 3.94Å; I49-I80 PolarHBondContact O-N 3.43Å; I49-I136 WeakPolarHBondContact CA-O 3.49Å; I49-I136 HydrophobicContact CG1-CB 4.27Å; I49-I136 HydrophobicContact CG1-CD1 4.32Å
50	I	98.8	Very high	91.1	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	108.4	173.5	-55.6	170.5	0	0	0	107.1	F48 K119 I136 H138 F144 M148	F48-I50 HydrophobicContact CD1-CD1 4.27Å; F48-I50 HydrophobicContact CD1-CG1 3.94Å; F48-I50 HydrophobicContact CE1-CD1 4.29Å; F48-I50 HydrophobicContact CE1-CG1 3.9Å; I50-K119 HydrophobicContact CG2-CG 4.42Å; I50-I136 PolarHBondContact N-O 3.35Å; I50-H138 PolarHBondContact O-N 2.88Å; I50-F144 HydrophobicContact CG2-CB 4.22Å; I50-F144 HydrophobicContact CG2-CD2 3.87Å; I50-M148 HydrophobicContact CD1-CE 4.18Å; I50-M148 HydrophobicContact CD1-SD 3.57Å; I50-M148 VanDerWaalsContact CD1-SD 3.57Å
51	P	98.3	Very high	92.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.			trans	-58.2	167	-178.3	-30.8	39.2	0	0	0	115	Y60 T79 I80 H82 H138 G141	P51-Y60 WeakPolarHBondContact CA-OH 3.35Å; P51-Y60 HydrophobicContact CB-CD2 4.21Å; P51-Y60 HydrophobicContact CB-CE2 3.52Å; P51-Y60 HydrophobicContact CG-CD2 4.1Å; P51-Y60 HydrophobicContact CG-CE2 3.92Å; P51-T79 HydrophobicContact CG-CG2 3.79Å; P51-I80 WeakPolarHBondContact CD-O 3.45Å; P51-I80 VanDerWaalsContact CG-O 3.24Å; P51-I80 WeakPolarHBondContact CG-O 3.49Å; P51-H82 PolarHBondContact O-CE1 2.77Å; P51-H82 PolarHBondContact O-NE2 2.82Å; P51-H138 CarbonylContact C-O 3.51Å; P51-G141 WeakPolarHBondContact O-CA 3.26Å; P51-G141 PolarHBondContact O-N 2.81Å
52	G	97.8	Very high	93.7	Very high	2 Å²	2	20.6 Å²	20.6	2%	0.021	10%	0.1	C	C	.	.			trans	-87.3	-178.2	163.2	0	0	0	0	0	112	P54 G55 Y60 H82 H138	G52-P54 CarbonylContact O-C 3.42Å; G52-G55 WeakPolarHBondContact O-CA 3.29Å; G52-G55 PolarHBondContact O-N 2.8Å; G52-Y60 PolarHBondContact N-OH 3.36Å; G52-H82 PolarHBondContact O-NE2 3.3Å; G52-H138 WeakPolarHBondContact CA-O 3.49Å; G52-H138 PolarHBondContact N-ND1 3.47Å; G52-H138 PolarHBondContact N-O 2.86Å
53	N	95.9	Very high	94.5	Very high	45 Å²	45	16.5 Å²	16.5	24%	0.241	9%	0.085	C	C	.	.	S	Bend	trans	-89.8	127.5	173.2	-168.5	12.3	0	0	0	110.2	I140 A237 G241 E244	N53-I140 HydrophobicContact CB-CG2 4.11Å; N53-A237 PolarHBondContact ND2-O 3.05Å; N53-A237 PolarHBondContact OD1-O 2.72Å; N53-G241 VanDerWaalsContact ND2-CA 3.26Å; N53-G241 WeakPolarHBondContact ND2-CA 3.3Å; N53-G241 PolarHBondContact ND2-N 2.73Å; N53-G241 VanDerWaalsContact ND2-N 3.2Å; N53-E244 WeakPolarHBondContact CB-OE1 3.44Å; N53-E244 VanDerWaalsContact CG-OE1 3.31Å; N53-E244 PolarHBondContact ND2-OE1 2.96Å
54	P	93.2	Very high	95	Very high	58 Å²	58	16.3 Å²	16.3	38%	0.377	8%	0.083	S	C	.	.	S	Bend	cis	-75.9	132.4	-0.7	34.4	-36.9	0	0	0	114.2	G52 F56 A237	G52-P54 CarbonylContact O-C 3.42Å; P54-F56 HydrophobicContact CB-CD2 3.61Å; P54-F56 HydrophobicContact CB-CE2 3.42Å; P54-F56 VanDerWaalsContact CB-CE2 3.42Å; P54-F56 HydrophobicContact CG-CD2 3.84Å; P54-F56 HydrophobicContact CG-CE2 3.82Å; P54-F56 PolarHBondContact O-N 3.24Å; P54-A237 HydrophobicContact CB-CB 4.09Å
55	G	93.5	Very high	95.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.059	C	C	.	.			trans	-76.7	43.7	-172.1	0	0	0	0	0	117.1	G52 S57 S81 H82 H85	G52-G55 WeakPolarHBondContact O-CA 3.29Å; G52-G55 PolarHBondContact O-N 2.8Å; G55-S57 PolarHBondContact O-N 3.08Å; G55-S81 CarbonylContact O-C 3.56Å; G55-S81 VanDerWaalsContact O-CA 3.24Å; G55-S81 WeakPolarHBondContact O-CA 3.38Å; G55-S81 PolarHBondContact O-OG 2.86Å; G55-H82 PolarHBondContact O-N 3.06Å; G55-H85 PolarHBondContact N-ND1 3.26Å; G55-H85 VanDerWaalsContact N-ND1 3.11Å
56	F	91.8	Very high	95.4	Very high	5 Å²	5	10.8 Å²	10.8	2%	0.022	6%	0.06	C	C	.	.			trans	-78	114.4	174.3	-59.8	-81.7	0	0	0	110.4	P54 A58 F59 H85 V228 C233	P54-F56 HydrophobicContact CB-CD2 3.61Å; P54-F56 HydrophobicContact CB-CE2 3.42Å; P54-F56 VanDerWaalsContact CB-CE2 3.42Å; P54-F56 HydrophobicContact CG-CD2 3.84Å; P54-F56 HydrophobicContact CG-CE2 3.82Å; P54-F56 PolarHBondContact O-N 3.24Å; F56-A58 PolarHBondContact O-N 2.74Å; F56-F59 HydrophobicContact CB-CD2 3.92Å; F56-F59 HydrophobicContact CB-CE2 3.97Å; F56-F59 HydrophobicContact CB-CG 4.39Å; F56-F59 HydrophobicContact CB-CZ 4.47Å; F56-F59 HydrophobicContact CD2-CD2 4.33Å; F56-F59 AromaticContact CD2-CE2 3.66Å; F56-F59 HydrophobicContact CD2-CE2 3.66Å; F56-F59 HydrophobicContact CD2-CZ 4.2Å; F56-F59 HydrophobicContact CG-CE2 4.18Å; F56-F59 PolarHBondContact O-N 2.83Å; F56-H85 WeakPolarHBondContact CD1-O 3.43Å; F56-H85 WeakPolarHBondContact CE1-O 3.23Å; F56-V228 HydrophobicContact CD1-CG2 3.82Å; F56-V228 HydrophobicContact CD2-CG2 3.95Å; F56-V228 HydrophobicContact CE1-CB 4.31Å; F56-V228 HydrophobicContact CE1-CG2 3.71Å; F56-V228 HydrophobicContact CE2-CB 4.39Å; F56-V228 HydrophobicContact CE2-CG1 4.31Å; F56-V228 HydrophobicContact CE2-CG2 3.86Å; F56-V228 HydrophobicContact CG-CG2 3.95Å; F56-V228 HydrophobicContact CZ-CB 4.12Å; F56-V228 HydrophobicContact CZ-CG1 4.41Å; F56-V228 HydrophobicContact CZ-CG2 3.79Å; F56-C233 HydrophobicContact CE1-CB 4.36Å; F56-C233 HydrophobicContact CZ-CB 4.42Å
57	S	92.8	Very high	95.3	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-64	-28.8	-179.1	56.9	0	0	0	0	112.7	Q24 L26 G55 F59 Y60	Q24-S57 PolarHBondContact OE1-OG 3Å; Q24-S57 VanDerWaalsContact OE1-OG 3.06Å; L26-S57 WeakPolarHBondContact CD1-O 3.38Å; L26-S57 WeakPolarHBondContact CD1-OG 3.39Å; G55-S57 PolarHBondContact O-N 3.08Å; S57-F59 PolarHBondContact O-N 3.48Å; S57-F59 VanDerWaalsContact O-N 3.13Å; S57-Y60 WeakPolarHBondContact O-CB 3.3Å; S57-Y60 PolarHBondContact O-N 3.34Å
58	A	90.4	Very high	95.2	Very high	2 Å²	2	11.4 Å²	11.4	2%	0.017	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-57	-29	179.7	0	0	0	0	0	113.8	L26 F56 Y60 V61 N221 F223 P225	L26-A58 VanDerWaalsContact CD1-CA 3.45Å; L26-A58 HydrophobicContact CD1-CB 4.3Å; F56-A58 PolarHBondContact O-N 2.74Å; A58-Y60 PolarHBondContact O-N 3.21Å; A58-V61 WeakPolarHBondContact O-CG2 3.27Å; A58-V61 PolarHBondContact O-N 3.07Å; A58-N221 PolarHBondContact O-ND2 3.16Å; A58-F223 HydrophobicContact CB-CB 4.49Å; A58-P225 HydrophobicContact CB-CB 4.31Å
59	F	90.4	Very high	95.1	Very high	30 Å²	30	13.6 Å²	13.6	13%	0.132	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-68.5	-18.9	176.6	-65	-25	0	0	0	113.6	F56 S57 L214 L219 P225 V228 I303	F56-F59 HydrophobicContact CB-CD2 3.92Å; F56-F59 HydrophobicContact CB-CE2 3.97Å; F56-F59 HydrophobicContact CB-CG 4.39Å; F56-F59 HydrophobicContact CB-CZ 4.47Å; F56-F59 HydrophobicContact CD2-CD2 4.33Å; F56-F59 AromaticContact CD2-CE2 3.66Å; F56-F59 HydrophobicContact CD2-CE2 3.66Å; F56-F59 HydrophobicContact CD2-CZ 4.2Å; F56-F59 HydrophobicContact CG-CE2 4.18Å; F56-F59 PolarHBondContact O-N 2.83Å; S57-F59 PolarHBondContact O-N 3.48Å; S57-F59 VanDerWaalsContact O-N 3.13Å; F59-L214 HydrophobicContact CD1-CD2 4.43Å; F59-L214 HydrophobicContact CE1-CD2 3.97Å; F59-L219 HydrophobicContact CB-CD1 4.32Å; F59-L219 HydrophobicContact CD1-CD1 3.81Å; F59-L219 HydrophobicContact CE1-CD1 4.49Å; F59-L219 HydrophobicContact CG-CD1 4.27Å; F59-P225 HydrophobicContact CE1-CG 4.49Å; F59-V228 HydrophobicContact CE1-CG2 4.31Å; F59-V228 HydrophobicContact CZ-CG2 3.78Å; F59-I303 HydrophobicContact CB-CD1 3.87Å; F59-I303 HydrophobicContact CB-CG1 4.36Å; F59-I303 HydrophobicContact CG-CD1 4.43Å
60	Y	94.5	Very high	95	Very high	6 Å²	6	16.5 Å²	16.5	2%	0.024	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-94.9	-1	-177.3	-68.5	-101.1	0	0	0	113	I49 P51 G52 S57 A58 F63 A64 T79 H138 I303	I49-Y60 HydrophobicContact CG2-CD1 3.57Å; I49-Y60 HydrophobicContact CG2-CE1 4.03Å; I49-Y60 HydrophobicContact CG2-CG 4.16Å; P51-Y60 WeakPolarHBondContact CA-OH 3.35Å; P51-Y60 HydrophobicContact CB-CD2 4.21Å; P51-Y60 HydrophobicContact CB-CE2 3.52Å; P51-Y60 HydrophobicContact CG-CD2 4.1Å; P51-Y60 HydrophobicContact CG-CE2 3.92Å; G52-Y60 PolarHBondContact N-OH 3.36Å; S57-Y60 WeakPolarHBondContact O-CB 3.3Å; S57-Y60 PolarHBondContact O-N 3.34Å; A58-Y60 PolarHBondContact O-N 3.21Å; Y60-F63 HydrophobicContact CD1-CD1 4.05Å; Y60-F63 CarbonylContact O-C 3.6Å; Y60-F63 WeakPolarHBondContact O-CB 3.46Å; Y60-F63 PolarHBondContact O-N 2.9Å; Y60-F63 VanDerWaalsContact O-N 3.16Å; Y60-A64 WeakPolarHBondContact O-CB 3.4Å; Y60-A64 PolarHBondContact O-N 3.39Å; Y60-T79 HydrophobicContact CD2-CG2 4.43Å; Y60-T79 HydrophobicContact CG-CG2 4.21Å; Y60-H138 HydrophobicContact CE1-CB 4.08Å; Y60-H138 AromaticContact CZ-ND1 3.89Å; Y60-H138 WeakPolarHBondContact OH-CB 3.41Å; Y60-H138 VanDerWaalsContact OH-CG 3.3Å; Y60-H138 PolarHBondContact OH-ND1 3.26Å; Y60-I303 HydrophobicContact CD1-CG2 3.71Å; Y60-I303 HydrophobicContact CE1-CG2 3.51Å; Y60-I303 HydrophobicContact CE2-CG2 4.47Å; Y60-I303 HydrophobicContact CG-CG2 4.31Å
61	V	93.7	Very high	94.7	Very high	3 Å²	3	16.7 Å²	16.7	2%	0.018	9%	0.094	C	C	.	.	H	α-helix	trans	-57.9	-47.7	-176.6	171.8	0	0	0	0	112.9	V11 L26 A58 F63 A64 K65 F223	V11-V61 HydrophobicContact CG2-CG1 4.34Å; L26-V61 HydrophobicContact CD1-CG2 3.5Å; A58-V61 WeakPolarHBondContact O-CG2 3.27Å; A58-V61 PolarHBondContact O-N 3.07Å; V61-F63 VanDerWaalsContact C-N 3.28Å; V61-F63 PolarHBondContact O-N 2.9Å; V61-A64 PolarHBondContact O-N 3.46Å; V61-K65 HydrophobicContact CG1-CD 4.24Å; V61-K65 HydrophobicContact CG1-CG 4.38Å; V61-K65 WeakPolarHBondContact O-CB 3.19Å; V61-K65 WeakPolarHBondContact O-CG 3.03Å; V61-K65 PolarHBondContact O-N 2.94Å; V61-F223 HydrophobicContact CG1-CD2 4.33Å; V61-F223 HydrophobicContact CG1-CE2 4.27Å; V61-F223 HydrophobicContact CG2-CD2 3.86Å; V61-F223 HydrophobicContact CG2-CE2 4.29Å
62	P	93.6	Very high	94.4	Very high	26 Å²	26	22.5 Å²	22.5	17%	0.169	13%	0.125	C	C	.	.	H	α-helix	trans	-61.2	-40.4	177.3	-26	37.6	0	0	0	112	K65 A66 L219 N221 N307	P62-K65 PolarHBondContact O-N 2.87Å; P62-A66 WeakPolarHBondContact O-CB 3.49Å; P62-A66 PolarHBondContact O-N 3.32Å; P62-L219 HydrophobicContact CG-CD2 3.86Å; P62-N221 WeakPolarHBondContact CD-ND2 3.27Å; P62-N221 WeakPolarHBondContact CD-OD1 3.33Å; P62-N221 VanDerWaalsContact CG-OD1 3.22Å; P62-N221 WeakPolarHBondContact CG-OD1 3.23Å; P62-N307 HydrophobicContact CB-CB 4.46Å
63	F	96	Very high	94.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.4	-43.9	176.6	178.4	-119.4	0	0	0	112.2	I49 Y60 V61 A66 L67 I136 L163 F302 N307 V310 A311 I314	I49-F63 HydrophobicContact CD1-CD1 3.79Å; I49-F63 HydrophobicContact CD1-CE1 3.95Å; I49-F63 HydrophobicContact CG1-CE1 4.33Å; Y60-F63 HydrophobicContact CD1-CD1 4.05Å; Y60-F63 CarbonylContact O-C 3.6Å; Y60-F63 WeakPolarHBondContact O-CB 3.46Å; Y60-F63 PolarHBondContact O-N 2.9Å; Y60-F63 VanDerWaalsContact O-N 3.16Å; V61-F63 VanDerWaalsContact C-N 3.28Å; V61-F63 PolarHBondContact O-N 2.9Å; F63-A66 PolarHBondContact O-N 2.88Å; F63-L67 HydrophobicContact CD1-CD1 4.08Å; F63-L67 HydrophobicContact CD2-CD1 4.43Å; F63-L67 HydrophobicContact CD2-CG 4.5Å; F63-L67 HydrophobicContact CE1-CD1 3.63Å; F63-L67 HydrophobicContact CE2-CD1 4.02Å; F63-L67 HydrophobicContact CE2-CG 4.2Å; F63-L67 HydrophobicContact CG-CD1 4.47Å; F63-L67 HydrophobicContact CZ-CD1 3.62Å; F63-L67 HydrophobicContact CZ-CG 4.28Å; F63-L67 WeakPolarHBondContact O-CG 3.43Å; F63-L67 PolarHBondContact O-N 2.9Å; F63-I136 HydrophobicContact CE1-CD1 4.47Å; F63-I136 HydrophobicContact CE1-CG2 4.11Å; F63-I136 HydrophobicContact CZ-CD1 4.47Å; F63-I136 HydrophobicContact CZ-CG2 4.25Å; F63-L163 HydrophobicContact CZ-CD1 4.09Å; F63-F302 AromaticContact CD2-CE2 3.89Å; F63-F302 HydrophobicContact CD2-CE2 3.89Å; F63-F302 HydrophobicContact CE1-CZ 4.35Å; F63-F302 AromaticContact CE2-CE2 3.87Å; F63-F302 HydrophobicContact CE2-CE2 3.87Å; F63-F302 HydrophobicContact CE2-CZ 4.36Å; F63-F302 HydrophobicContact CG-CE2 4.2Å; F63-F302 HydrophobicContact CZ-CE2 4.17Å; F63-F302 HydrophobicContact CZ-CZ 4.2Å; F63-N307 HydrophobicContact CB-CB 3.83Å; F63-N307 HydrophobicContact CD2-CB 4.46Å; F63-N307 WeakPolarHBondContact CD2-O 3.25Å; F63-V310 HydrophobicContact CE2-CB 4.3Å; F63-V310 HydrophobicContact CE2-CG1 4Å; F63-V310 HydrophobicContact CZ-CG1 4.43Å; F63-A311 HydrophobicContact CD2-CB 3.88Å; F63-A311 HydrophobicContact CE2-CB 3.92Å; F63-I314 HydrophobicContact CE2-CD1 3.93Å; F63-I314 HydrophobicContact CZ-CD1 3.5Å; F63-I314 VanDerWaalsContact CZ-CD1 3.5Å
64	A	96.7	Very high	93.9	Very high	4 Å²	4	29.6 Å²	29.6	3%	0.033	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-43.6	176.3	0	0	0	0	0	112	C28 I49 Y60 V61 A66 L67 Y68 V77	C28-A64 HydrophobicContact CB-CB 4.22Å; I49-A64 HydrophobicContact CD1-CB 4.04Å; Y60-A64 WeakPolarHBondContact O-CB 3.4Å; Y60-A64 PolarHBondContact O-N 3.39Å; V61-A64 PolarHBondContact O-N 3.46Å; A64-A66 VanDerWaalsContact C-N 3.32Å; A64-A66 PolarHBondContact O-N 2.94Å; A64-L67 PolarHBondContact O-N 2.91Å; A64-Y68 WeakPolarHBondContact O-CB 3.31Å; A64-Y68 PolarHBondContact O-N 3.23Å; A64-V77 HydrophobicContact CB-CB 4.34Å; A64-V77 HydrophobicContact CB-CG1 3.81Å
65	K	95.8	Very high	93.9	Very high	42 Å²	42	27.5 Å²	27.5	18%	0.183	13%	0.133	C	C	.	.	H	α-helix	trans	-60.8	-40.5	174.4	-75.4	-173	175.6	-175.5	0	111.4	I9 V11 V61 P62 S69 E222	I9-K65 HydrophobicContact CB-CD 4.37Å; I9-K65 HydrophobicContact CB-CG 4.21Å; I9-K65 HydrophobicContact CD1-CB 4.06Å; I9-K65 HydrophobicContact CD1-CG 4.49Å; I9-K65 HydrophobicContact CG2-CB 4.4Å; I9-K65 HydrophobicContact CG2-CG 3.94Å; V11-K65 HydrophobicContact CG2-CD 4.19Å; V11-K65 HydrophobicContact CG2-CG 3.81Å; V61-K65 HydrophobicContact CG1-CD 4.24Å; V61-K65 HydrophobicContact CG1-CG 4.38Å; V61-K65 WeakPolarHBondContact O-CB 3.19Å; V61-K65 WeakPolarHBondContact O-CG 3.03Å; V61-K65 PolarHBondContact O-N 2.94Å; P62-K65 PolarHBondContact O-N 2.87Å; K65-S69 PolarHBondContact O-N 3.09Å; K65-S69 PolarHBondContact O-OG 3.2Å; K65-E222 IonicContact NZ-OE1 2.74Å; K65-E222 PolarHBondContact NZ-OE1 3.48Å
66	A	96.1	Very high	94	Very high	3 Å²	3	27.5 Å²	27.5	3%	0.025	13%	0.133	C	C	.	.	H	α-helix	trans	-63.9	-50.5	176	0	0	0	0	0	111.5	P62 F63 A64 Y68 S69 L70 A311	P62-A66 WeakPolarHBondContact O-CB 3.49Å; P62-A66 PolarHBondContact O-N 3.32Å; F63-A66 PolarHBondContact O-N 2.88Å; A64-A66 VanDerWaalsContact C-N 3.32Å; A64-A66 PolarHBondContact O-N 2.94Å; A66-Y68 VanDerWaalsContact C-N 3.33Å; A66-Y68 PolarHBondContact O-N 3.37Å; A66-S69 WeakPolarHBondContact O-CB 3.33Å; A66-S69 PolarHBondContact O-N 3.42Å; A66-L70 WeakPolarHBondContact O-CB 3.32Å; A66-L70 WeakPolarHBondContact O-CD1 3.35Å; A66-L70 WeakPolarHBondContact O-CG 3.2Å; A66-L70 PolarHBondContact O-N 2.76Å; A66-A311 HydrophobicContact CB-CB 3.56Å
67	L	97.1	Very high	94.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-42.6	176.2	-74.3	172.4	0	0	0	112.4	I47 I49 F63 A64 S69 L70 T71 V77 I136 A311 I314	I47-L67 HydrophobicContact CG2-CD1 4.46Å; I49-L67 HydrophobicContact CD1-CD1 4.19Å; F63-L67 HydrophobicContact CD1-CD1 4.08Å; F63-L67 HydrophobicContact CD2-CD1 4.43Å; F63-L67 HydrophobicContact CD2-CG 4.5Å; F63-L67 HydrophobicContact CE1-CD1 3.63Å; F63-L67 HydrophobicContact CE2-CD1 4.02Å; F63-L67 HydrophobicContact CE2-CG 4.2Å; F63-L67 HydrophobicContact CG-CD1 4.47Å; F63-L67 HydrophobicContact CZ-CD1 3.62Å; F63-L67 HydrophobicContact CZ-CG 4.28Å; F63-L67 WeakPolarHBondContact O-CG 3.43Å; F63-L67 PolarHBondContact O-N 2.9Å; A64-L67 PolarHBondContact O-N 2.91Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.02Å; L67-L70 PolarHBondContact O-N 3.46Å; L67-T71 WeakPolarHBondContact O-CB 3.43Å; L67-T71 VanDerWaalsContact O-CG2 3.3Å; L67-T71 WeakPolarHBondContact O-CG2 3.3Å; L67-T71 PolarHBondContact O-N 2.88Å; L67-T71 PolarHBondContact O-OG1 3.03Å; L67-V77 HydrophobicContact CB-CG1 4.5Å; L67-V77 HydrophobicContact CB-CG2 4.14Å; L67-V77 HydrophobicContact CD1-CG1 4.36Å; L67-I136 HydrophobicContact CD1-CD1 3.56Å; L67-A311 HydrophobicContact CD2-CB 4.01Å; L67-A311 HydrophobicContact CG-CB 4.03Å; L67-I314 HydrophobicContact CD2-CB 4.02Å; L67-I314 HydrophobicContact CD2-CG2 3.79Å
68	Y	96.2	Very high	94.5	Very high	13 Å²	13	27.3 Å²	27.3	5%	0.051	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-43.9	177.5	-177.5	-111.2	0	0	0	111.6	I9 C28 P30 W31 A64 A66 T71 R73 F75	I9-Y68 HydrophobicContact CG1-CD1 4.48Å; I9-Y68 HydrophobicContact CG2-CD1 3.48Å; I9-Y68 VanDerWaalsContact CG2-CD1 3.48Å; I9-Y68 HydrophobicContact CG2-CE1 4.02Å; I9-Y68 HydrophobicContact CG2-CG 4.37Å; C28-Y68 VanDerWaalsContact SG-CB 3.56Å; P30-Y68 WeakPolarHBondContact CD-OH 3.36Å; W31-Y68 HydrophobicContact CZ3-CE2 4.17Å; A64-Y68 WeakPolarHBondContact O-CB 3.31Å; A64-Y68 PolarHBondContact O-N 3.23Å; A66-Y68 VanDerWaalsContact C-N 3.33Å; A66-Y68 PolarHBondContact O-N 3.37Å; Y68-T71 PolarHBondContact O-OG1 3.01Å; Y68-R73 HydrophobicContact CD1-CB 4.31Å; Y68-R73 HydrophobicContact CD1-CG 3.93Å; Y68-R73 HydrophobicContact CE1-CB 3.65Å; Y68-R73 HydrophobicContact CE1-CG 3.55Å; Y68-R73 HydrophobicContact CE2-CB 4.08Å; Y68-R73 WeakPolarHBondContact CE2-O 3.22Å; Y68-R73 VanDerWaalsContact O-CA 3.27Å; Y68-R73 WeakPolarHBondContact O-CA 3.42Å; Y68-R73 PolarHBondContact O-N 3.41Å; Y68-R73 PolarHBondContact OH-O 3.46Å; Y68-R73 VanDerWaalsContact OH-O 3.12Å; Y68-F75 VanDerWaalsContact CD2-O 3.23Å; Y68-F75 WeakPolarHBondContact CD2-O 3.31Å
69	S	95.9	Very high	94.9	Very high	47 Å²	47	27.3 Å²	27.3	33%	0.329	13%	0.132	S	C	.	.	H	α-helix	trans	-62.6	-49.8	175.5	-59.8	0	0	0	0	112.1	I9 K65 A66 L67 T71 N72	I9-S69 WeakPolarHBondContact CD1-OG 3.44Å; K65-S69 PolarHBondContact O-N 3.09Å; K65-S69 PolarHBondContact O-OG 3.2Å; A66-S69 WeakPolarHBondContact O-CB 3.33Å; A66-S69 PolarHBondContact O-N 3.42Å; L67-S69 VanDerWaalsContact C-N 3.33Å; L67-S69 PolarHBondContact O-N 3.02Å; S69-T71 PolarHBondContact O-N 3.12Å; S69-N72 PolarHBondContact O-N 3.21Å
70	L	95.8	Very high	95.2	Very high	61 Å²	61	25.9 Å²	25.9	32%	0.319	13%	0.126	S	C	.	.	H	α-helix	trans	-68.6	-21.3	-175.5	-68.2	163.5	0	0	0	113.4	A66 L67 N72 A311 N312 A315	A66-L70 WeakPolarHBondContact O-CB 3.32Å; A66-L70 WeakPolarHBondContact O-CD1 3.35Å; A66-L70 WeakPolarHBondContact O-CG 3.2Å; A66-L70 PolarHBondContact O-N 2.76Å; L67-L70 PolarHBondContact O-N 3.46Å; L70-N72 PolarHBondContact O-N 2.88Å; L70-A311 VanDerWaalsContact CD1-C 3.49Å; L70-A311 HydrophobicContact CD1-CB 3.79Å; L70-N312 VanDerWaalsContact CD1-OD1 3.23Å; L70-N312 WeakPolarHBondContact CD1-OD1 3.38Å; L70-N312 WeakPolarHBondContact CD2-OD1 3.25Å; L70-A315 HydrophobicContact CB-CB 3.51Å; L70-A315 HydrophobicContact CD1-CB 3.93Å; L70-A315 HydrophobicContact CG-CB 4.26Å
71	T	93.4	Very high	95.3	Very high	4 Å²	4	25.6 Å²	25.6	3%	0.025	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	20.3	173.9	56.7	0	0	0	0	112.8	I47 L67 Y68 S69 R73 R74 L322	I47-T71 HydrophobicContact CD1-CG2 3.89Å; L67-T71 WeakPolarHBondContact O-CB 3.43Å; L67-T71 VanDerWaalsContact O-CG2 3.3Å; L67-T71 WeakPolarHBondContact O-CG2 3.3Å; L67-T71 PolarHBondContact O-N 2.88Å; L67-T71 PolarHBondContact O-OG1 3.03Å; Y68-T71 PolarHBondContact O-OG1 3.01Å; S69-T71 PolarHBondContact O-N 3.12Å; T71-R73 PolarHBondContact O-N 2.94Å; T71-R74 PolarHBondContact O-N 3.22Å; T71-L322 HydrophobicContact CG2-CD1 4.16Å
72	N	91.8	Very high	95.5	Very high	122 Å²	122	25.5 Å²	25.5	65%	0.652	12%	0.124	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	31.5	-179	-57.6	-35.1	0	0	0	112.8	S69 L70 R74	S69-N72 PolarHBondContact O-N 3.21Å; L70-N72 PolarHBondContact O-N 2.88Å; N72-R74 HydrophobicContact CB-CG 4.18Å; N72-R74 WeakPolarHBondContact O-CG 3.5Å; N72-R74 PolarHBondContact O-N 3.48Å
73	R	93.1	Very high	95.6	Very high	85 Å²	85	24.2 Å²	24.2	32%	0.321	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	20.5	178.6	-57.4	-178.5	171.9	-167.4	-7.7	114	E7 Y68 T71	E7-R73 PolarHBondContact O-NH2 3.38Å; E7-R73 IonicContact OE2-NH1 3.12Å; E7-R73 PolarHBondContact OE2-NH1 2.94Å; E7-R73 VanDerWaalsContact OE2-NH1 3.12Å; Y68-R73 HydrophobicContact CD1-CB 4.31Å; Y68-R73 HydrophobicContact CD1-CG 3.93Å; Y68-R73 HydrophobicContact CE1-CB 3.65Å; Y68-R73 HydrophobicContact CE1-CG 3.55Å; Y68-R73 HydrophobicContact CE2-CB 4.08Å; Y68-R73 WeakPolarHBondContact CE2-O 3.22Å; Y68-R73 VanDerWaalsContact O-CA 3.27Å; Y68-R73 WeakPolarHBondContact O-CA 3.42Å; Y68-R73 PolarHBondContact O-N 3.41Å; Y68-R73 PolarHBondContact OH-O 3.46Å; Y68-R73 VanDerWaalsContact OH-O 3.12Å; T71-R73 PolarHBondContact O-N 2.94Å
74	R	90.3	Very high	95.5	Very high	110 Å²	110	24.3 Å²	24.3	42%	0.415	12%	0.116	S	C	.	.			trans	-85.3	-26.3	-173.4	-66.3	-169	-65	162.2	-0.9	114.4	T71 N72	T71-R74 PolarHBondContact O-N 3.22Å; N72-R74 HydrophobicContact CB-CG 4.18Å; N72-R74 WeakPolarHBondContact O-CG 3.5Å; N72-R74 PolarHBondContact O-N 3.48Å
75	F	93.1	Very high	95.4	Very high	15 Å²	15	24.1 Å²	24.1	7%	0.066	12%	0.115	C	C	.	.	S	Bend	trans	-126.5	133.3	-171.3	-51	-61.9	0	0	0	110.1	L45 I47 Y68 L322	L45-F75 HydrophobicContact CB-CD1 3.57Å; L45-F75 HydrophobicContact CB-CE1 3.87Å; L45-F75 HydrophobicContact CB-CG 4.13Å; L45-F75 HydrophobicContact CD2-CB 4.44Å; L45-F75 HydrophobicContact CD2-CD1 4.08Å; L45-F75 HydrophobicContact CD2-CD2 4.01Å; L45-F75 HydrophobicContact CD2-CE1 4.3Å; L45-F75 HydrophobicContact CD2-CE2 4.27Å; L45-F75 HydrophobicContact CD2-CG 3.9Å; L45-F75 HydrophobicContact CD2-CZ 4.4Å; L45-F75 HydrophobicContact CG-CD1 4.42Å; I47-F75 HydrophobicContact CD1-CB 4.33Å; I47-F75 HydrophobicContact CG1-CB 4.49Å; Y68-F75 VanDerWaalsContact CD2-O 3.23Å; Y68-F75 WeakPolarHBondContact CD2-O 3.31Å; F75-L322 HydrophobicContact CD2-CD1 4.37Å; F75-L322 HydrophobicContact CD2-CD2 4.17Å; F75-L322 HydrophobicContact CE2-CD1 3.9Å; F75-L322 HydrophobicContact CE2-CD2 3.54Å; F75-L322 HydrophobicContact CE2-CG 4.2Å; F75-L322 HydrophobicContact CZ-CD2 3.95Å
76	P	95.8	Very high	95.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.107	C	C	.	.			trans	-61	143.3	172.4	25.3	-33.5	0	0	0	110.6	C28 W31 L34 P43 L45 L46 I47	C28-P76 WeakPolarHBondContact O-CA 3.46Å; W31-P76 HydrophobicContact CB-CB 4.36Å; W31-P76 HydrophobicContact CE3-CB 4.2Å; W31-P76 HydrophobicContact CE3-CG 4.4Å; L34-P76 HydrophobicContact CD2-CG 4.34Å; P43-P76 HydrophobicContact CB-CG 4.07Å; P43-P76 HydrophobicContact CG-CG 3.76Å; L45-P76 WeakPolarHBondContact O-CD 3.47Å; L46-P76 HydrophobicContact CD1-CB 4.09Å; L46-P76 HydrophobicContact CD1-CG 3.87Å; I47-P76 PolarHBondContact N-O 3.02Å
77	V	97.9	Very high	94.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	108.9	172.5	-172.5	0	0	0	0	108	C28 I47 I49 A64 L67	C28-V77 HydrophobicContact CB-CB 4.16Å; C28-V77 VanDerWaalsContact CB-O 3.28Å; C28-V77 WeakPolarHBondContact CB-O 3.47Å; C28-V77 PolarHBondContact N-O 3.2Å; C28-V77 PolarHBondContact O-N 2.95Å; I47-V77 HydrophobicContact CB-CB 4.46Å; I47-V77 HydrophobicContact CB-CG1 4.29Å; I47-V77 HydrophobicContact CB-CG2 4.12Å; I47-V77 HydrophobicContact CD1-CG2 4.12Å; I47-V77 HydrophobicContact CG2-CG1 4.05Å; I47-V77 HydrophobicContact CG2-CG2 4.47Å; I47-V77 CarbonylContact O-C 3.59Å; I47-V77 WeakPolarHBondContact O-CA 3.45Å; I49-V77 HydrophobicContact CD1-CG1 3.5Å; I49-V77 HydrophobicContact CG1-CG1 4.14Å; A64-V77 HydrophobicContact CB-CB 4.34Å; A64-V77 HydrophobicContact CB-CG1 3.81Å; L67-V77 HydrophobicContact CB-CG1 4.5Å; L67-V77 HydrophobicContact CB-CG2 4.14Å; L67-V77 HydrophobicContact CD1-CG1 4.36Å
78	W	98.1	Very high	94.1	Very high	1 Å²	1	25.6 Å²	25.6	0%	0.004	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	139.3	-177.6	-65.9	3.1	0	0	0	110.6	L26 K27 W31 L34 L46 I47 F48 I49 F122 H126 V127	L26-W78 CarbonylContact O-C 3.59Å; L26-W78 WeakPolarHBondContact O-CA 3.31Å; K27-W78 HydrophobicContact CB-CG 4.3Å; K27-W78 HydrophobicContact CD-CD2 4.12Å; K27-W78 HydrophobicContact CD-CH2 4.24Å; K27-W78 HydrophobicContact CD-CZ2 3.7Å; K27-W78 HydrophobicContact CG-CD2 3.93Å; K27-W78 HydrophobicContact CG-CG 3.89Å; K27-W78 HydrophobicContact CG-CZ2 4.35Å; W31-W78 PolarHBondContact O-NE1 3.09Å; L34-W78 HydrophobicContact CB-CH2 4.18Å; L34-W78 HydrophobicContact CD1-CE3 4.34Å; L34-W78 HydrophobicContact CD1-CH2 3.27Å; L34-W78 HydrophobicContact CD1-CZ2 3.54Å; L34-W78 HydrophobicContact CD1-CZ3 3.7Å; L34-W78 HydrophobicContact CD2-CZ2 4.25Å; L34-W78 HydrophobicContact CG-CH2 3.4Å; L34-W78 VanDerWaalsContact CG-CH2 3.4Å; L34-W78 HydrophobicContact CG-CZ2 3.49Å; L34-W78 VanDerWaalsContact CG-CZ2 3.49Å; L34-W78 HydrophobicContact CG-CZ3 4.31Å; L46-W78 HydrophobicContact CD1-CB 3.9Å; L46-W78 HydrophobicContact CD1-CD2 3.66Å; L46-W78 HydrophobicContact CD1-CE3 4.13Å; L46-W78 HydrophobicContact CD1-CG 3.52Å; L46-W78 HydrophobicContact CD2-CD2 4.28Å; L46-W78 HydrophobicContact CD2-CE3 3.88Å; L46-W78 HydrophobicContact CD2-CZ3 4.42Å; I47-W78 PolarHBondContact O-N 3.42Å; F48-W78 WeakPolarHBondContact CA-O 3.4Å; F48-W78 HydrophobicContact CD2-CB 4.1Å; I49-W78 PolarHBondContact N-O 3.45Å; W78-F122 HydrophobicContact CE3-CE1 4.11Å; W78-F122 AromaticContact CE3-CZ 3.88Å; W78-F122 HydrophobicContact CE3-CZ 3.88Å; W78-F122 HydrophobicContact CZ3-CE1 4.42Å; W78-F122 HydrophobicContact CZ3-CZ 4.04Å; W78-H126 HydrophobicContact CZ3-CB 4.49Å; W78-V127 HydrophobicContact CE3-CG2 4.49Å; W78-V127 HydrophobicContact CZ3-CG2 4.1Å
79	T	97.8	Very high	93.4	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.1	174.6	-50.4	0	0	0	0	109.6	V25 L26 I49 P51 Y60	V25-T79 WeakPolarHBondContact CA-O 3.41Å; L26-T79 PolarHBondContact N-O 3.34Å; L26-T79 PolarHBondContact O-N 3.25Å; I49-T79 HydrophobicContact CB-CG2 4.04Å; I49-T79 HydrophobicContact CG2-CG2 3.94Å; P51-T79 HydrophobicContact CG-CG2 3.79Å; Y60-T79 HydrophobicContact CD2-CG2 4.43Å; Y60-T79 HydrophobicContact CG-CG2 4.21Å
80	I	97.2	Very high	92.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	131.3	175.6	-174.4	162.3	0	0	0	110.6	T23 V25 F48 I49 P51 K119 F122	T23-I80 HydrophobicContact CG2-CD1 4.09Å; T23-I80 HydrophobicContact CG2-CG1 3.76Å; V25-I80 HydrophobicContact CG2-CG1 4.28Å; F48-I80 HydrophobicContact CE1-CG2 3.97Å; F48-I80 HydrophobicContact CE2-CB 4.07Å; F48-I80 HydrophobicContact CE2-CG2 3.93Å; F48-I80 HydrophobicContact CZ-CB 3.83Å; F48-I80 HydrophobicContact CZ-CD1 4.44Å; F48-I80 HydrophobicContact CZ-CG2 3.32Å; I49-I80 PolarHBondContact O-N 3.43Å; P51-I80 WeakPolarHBondContact CD-O 3.45Å; P51-I80 VanDerWaalsContact CG-O 3.24Å; P51-I80 WeakPolarHBondContact CG-O 3.49Å; I80-K119 HydrophobicContact CG2-CD 4.37Å; I80-K119 HydrophobicContact CG2-CG 4.05Å; I80-F122 HydrophobicContact CD1-CB 3.58Å; I80-F122 HydrophobicContact CD1-CD1 3.97Å; I80-F122 HydrophobicContact CD1-CD2 3.79Å; I80-F122 HydrophobicContact CD1-CE2 4.49Å; I80-F122 HydrophobicContact CD1-CG 3.47Å; I80-F122 VanDerWaalsContact CD1-CG 3.47Å
81	S	96.6	Very high	91.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-68.5	150.6	169.4	179.2	0	0	0	0	110.2	Q24 G55	Q24-S81 VanDerWaalsContact O-CB 3.29Å; Q24-S81 WeakPolarHBondContact O-CB 3.38Å; Q24-S81 PolarHBondContact O-N 2.88Å; G55-S81 CarbonylContact O-C 3.56Å; G55-S81 VanDerWaalsContact O-CA 3.24Å; G55-S81 WeakPolarHBondContact O-CA 3.38Å; G55-S81 PolarHBondContact O-OG 2.86Å
82	H	97.4	Very high	90.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-61	142.4	165	-67.5	-1	0	0	0	110	P51 G52 G55 G84 H85 F144 L240	P51-H82 PolarHBondContact O-CE1 2.77Å; P51-H82 PolarHBondContact O-NE2 2.82Å; G52-H82 PolarHBondContact O-NE2 3.3Å; G55-H82 PolarHBondContact O-N 3.06Å; H82-G84 PolarHBondContact O-N 2.8Å; H82-H85 HydrophobicContact CB-CB 4.12Å; H82-H85 AromaticContact CD2-CE1 3.86Å; H82-H85 WeakPolarHBondContact O-CB 3.48Å; H82-H85 PolarHBondContact O-N 2.9Å; H82-H85 VanDerWaalsContact O-N 3.09Å; H82-F144 AromaticContact CE1-CE2 3.63Å; H82-F144 AromaticContact NE2-CE2 3.65Å; H82-L240 VanDerWaalsContact CD2-CD2 3.49Å; H82-L240 WeakPolarHBondContact CD2-CD2 3.28Å
83	A	95.7	Very high	90.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	132.6	178.8	0	0	0	0	0	109.8	V21 H85 I109 Y110 Q115	V21-A83 HydrophobicContact CG1-CB 4.23Å; A83-H85 PolarHBondContact O-CD2 3.34Å; A83-H85 PolarHBondContact O-N 2.85Å; A83-I109 HydrophobicContact CB-CD1 4.28Å; A83-I109 HydrophobicContact CB-CG1 3.79Å; A83-Y110 HydrophobicContact CB-CD1 4.47Å; A83-Y110 WeakPolarHBondContact O-CD1 3.43Å; A83-Q115 PolarHBondContact O-NE2 2.88Å
84	G	93.9	Very high	89.4	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.01	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-0.3	-179.5	0	0	0	0	0	115.9	H82 C233 N236	H82-G84 PolarHBondContact O-N 2.8Å; G84-C233 WeakPolarHBondContact O-CA 3.44Å; G84-N236 PolarHBondContact O-ND2 3.38Å
85	H	93.8	Very high	88.8	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	S	Bend	trans	-90	-9.1	175.7	-69.9	-143.1	0	0	0	112.6	G55 F56 H82 A83 C233 A237	G55-H85 PolarHBondContact N-ND1 3.26Å; G55-H85 VanDerWaalsContact N-ND1 3.11Å; F56-H85 WeakPolarHBondContact CD1-O 3.43Å; F56-H85 WeakPolarHBondContact CE1-O 3.23Å; H82-H85 HydrophobicContact CB-CB 4.12Å; H82-H85 AromaticContact CD2-CE1 3.86Å; H82-H85 WeakPolarHBondContact O-CB 3.48Å; H82-H85 PolarHBondContact O-N 2.9Å; H82-H85 VanDerWaalsContact O-N 3.09Å; A83-H85 PolarHBondContact O-CD2 3.34Å; A83-H85 PolarHBondContact O-N 2.85Å; H85-C233 VanDerWaalsContact C-SG 3.54Å; H85-C233 PolarHBondContact O-SG 3.24Å; H85-A237 WeakPolarHBondContact CE1-CA 3.31Å
86	A	90.5	Very high	87.6	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.017	24%	0.241	C	C	.	.	S	Bend	trans	-137.2	145.4	172.8	0	0	0	0	0	109.5	Q24	Q24-A86 HydrophobicContact CB-CB 3.72Å
87	L	87.1	Confident	85.9	Confident	54 Å²	54	49.6 Å²	49.6	28%	0.283	25%	0.254	S	S	.	.			trans	-109.3	141.4	174.8	-67.4	174.2	0	0	0	110.1	F15 N227 E230 F232	F15-L87 VanDerWaalsContact CE1-O 3.29Å; F15-L87 WeakPolarHBondContact CE1-O 3.33Å; L87-N227 PolarHBondContact N-ND2 2.65Å; L87-N227 PolarHBondContact O-ND2 3.3Å; L87-E230 HydrophobicContact CD1-CB 4.25Å; L87-E230 HydrophobicContact CD1-CG 4.22Å; L87-F232 HydrophobicContact CD2-CD1 3.8Å; L87-F232 HydrophobicContact CD2-CE1 4.01Å; L87-F232 HydrophobicContact CG-CD1 4.37Å
88	A	84.4	Confident	83.7	Confident	20 Å²	20	54.9 Å²	54.9	17%	0.165	29%	0.291	C	S	.	.			trans	-66.2	134.1	170.4	0	0	0	0	0	109.9	F15 E22 I94	F15-A88 HydrophobicContact CB-CB 4.06Å; F15-A88 VanDerWaalsContact CD1-CA 3.47Å; F15-A88 HydrophobicContact CD1-CB 3.62Å; F15-A88 HydrophobicContact CD2-CB 4.46Å; F15-A88 VanDerWaalsContact CE1-CA 3.49Å; F15-A88 HydrophobicContact CE1-CB 4.18Å; F15-A88 HydrophobicContact CG-CB 3.78Å; E22-A88 VanDerWaalsContact OE2-CB 3.32Å; E22-A88 WeakPolarHBondContact OE2-CB 3.23Å; A88-I94 HydrophobicContact CB-CG1 4.37Å
89	P	81.6	Confident	81.3	Confident	57 Å²	57	63.7 Å²	63.7	37%	0.37	33%	0.332	S	S	.	.			trans	-56.9	143.7	164.6	-20.2	30.6	0	0	0	109.8	F15 D91 K92	F15-P89 HydrophobicContact CE2-CG 4.42Å; P89-D91 PolarHBondContact O-N 2.94Å; P89-K92 HydrophobicContact CB-CG 4.13Å; P89-K92 HydrophobicContact CG-CD 4.03Å; P89-K92 HydrophobicContact CG-CG 4.04Å; P89-K92 PolarHBondContact O-N 2.9Å
90	K	75.8	Confident	79.2	Confident	213 Å²	213	66.6 Å²	66.6	93%	0.926	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-28	-174.7	-66.6	-177.2	178.8	-179.9	0	114.5
91	D	75.9	Confident	76.8	Confident	161 Å²	161	72 Å²	72	86%	0.861	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-1.1	-175.1	-49.2	-42.6	0	0	0	112.9	P89	P89-D91 PolarHBondContact O-N 2.94Å
92	K	76.2	Confident	74.6	Confident	75 Å²	75	78.1 Å²	78.1	33%	0.326	42%	0.419	S	S	.	.	S	Bend	trans	-88.8	131.7	179	-77.3	-154	178.8	-159.7	0	111.4	E13 F15 P89 I94	E13-K92 VanDerWaalsContact CD-NZ 3.28Å; E13-K92 IonicContact OE2-NZ 3.77Å; E13-K92 PolarHBondContact OE2-NZ 3.01Å; F15-K92 HydrophobicContact CD2-CB 4.42Å; F15-K92 HydrophobicContact CD2-CD 3.61Å; F15-K92 HydrophobicContact CE2-CD 3.62Å; P89-K92 HydrophobicContact CB-CG 4.13Å; P89-K92 HydrophobicContact CG-CD 4.03Å; P89-K92 HydrophobicContact CG-CG 4.04Å; P89-K92 PolarHBondContact O-N 2.9Å; K92-I94 PolarHBondContact O-N 3.22Å
93	K	79.9	Confident	72.7	Confident	173 Å²	173	81.6 Å²	81.6	75%	0.752	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-66.5	124.4	172.4	-172.8	-179.7	179.3	-176.9	0	109.5
94	I	79.6	Confident	71	Confident	59 Å²	59	89.9 Å²	89.9	30%	0.303	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.8	169	-58.8	156.7	0	0	0	107.3	F15 L17 E22 A88 K92 T96	F15-I94 WeakPolarHBondContact O-CA 3.47Å; L17-I94 HydrophobicContact CB-CG2 4.14Å; E22-I94 VanDerWaalsContact CD-CD1 3.42Å; E22-I94 HydrophobicContact CG-CD1 3.81Å; E22-I94 HydrophobicContact CG-CG1 4.21Å; E22-I94 HydrophobicContact CG-CG2 4.37Å; E22-I94 WeakPolarHBondContact OE1-CD1 3.33Å; A88-I94 HydrophobicContact CB-CG1 4.37Å; K92-I94 PolarHBondContact O-N 3.22Å; I94-T96 PolarHBondContact O-N 3.11Å
95	L	76.2	Confident	70.1	Confident	69 Å²	69	98.7 Å²	98.7	36%	0.361	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	115.9	175.9	-58.9	176.8	0	0	0	108.9	E14 F15 I16 L17	E14-L95 HydrophobicContact CB-CD1 4.28Å; E14-L95 HydrophobicContact CG-CD1 4.11Å; F15-L95 PolarHBondContact O-N 3.22Å; I16-L95 WeakPolarHBondContact CA-O 3.5Å; I16-L95 HydrophobicContact CG2-CB 4.17Å; I16-L95 HydrophobicContact CG2-CD1 4.41Å; L17-L95 PolarHBondContact N-O 3.33Å
96	T	67.5	Low	69.8	Low	108 Å²	108	99.8 Å²	99.8	66%	0.663	53%	0.532	S	S	*	.			trans	-90.1	114.7	167.5	53.9	0	0	0	0	107.7	L17 I94	L17-T96 HydrophobicContact CD2-CG2 4.4Å; I94-T96 PolarHBondContact O-N 3.11Å
97	T	60.8	Low	69.9	Low	47 Å²	47	108.4 Å²	108.4	29%	0.288	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-69.4	158.9	166.3	42.3	0	0	0	0	110.2	E99 H126	T97-E99 PolarHBondContact O-N 2.82Å; T97-E99 VanDerWaalsContact O-N 3.09Å; T97-H126 WeakPolarHBondContact CG2-CE1 3.36Å
98	S	51.3	Low	70.2	Confident	111 Å²	111	108.8 Å²	108.8	78%	0.776	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-46.1	122.7	166.9	54.7	0	0	0	0	108.3	D100	S98-D100 PolarHBondContact O-N 2.82Å
99	E	49.1	Very low	70.7	Confident	185 Å²	185	108.6 Å²	108.6	86%	0.864	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-47.4	117.6	179.7	-65.8	178.8	169	0	0	108.4	T97 S101	T97-E99 PolarHBondContact O-N 2.82Å; T97-E99 VanDerWaalsContact O-N 3.09Å; E99-S101 VanDerWaalsContact C-N 3.32Å; E99-S101 PolarHBondContact O-N 2.8Å
100	D	51.8	Low	71.4	Confident	63 Å²	63	109 Å²	109	34%	0.337	56%	0.562	S	S	.	*			trans	-65	108	159.9	-173	-7	0	0	0	103.9	S98 N102 A103 T125	S98-D100 PolarHBondContact O-N 2.82Å; D100-N102 PolarHBondContact O-N 3.04Å; D100-N102 PolarHBondContact OD1-N 3.46Å; D100-A103 HydrophobicContact CB-CB 4.1Å; D100-A103 VanDerWaalsContact O-CB 3.3Å; D100-A103 WeakPolarHBondContact O-CB 3.35Å; D100-A103 PolarHBondContact O-N 3.09Å; D100-T125 HydrophobicContact CB-CG2 4.12Å
101	S	47.5	Very low	72.4	Confident	114 Å²	114	98.8 Å²	98.8	80%	0.797	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-8.1	-180	51.4	0	0	0	0	112.4	E99	E99-S101 VanDerWaalsContact C-N 3.32Å; E99-S101 PolarHBondContact O-N 2.8Å
102	N	50	Low	73.5	Confident	128 Å²	128	91.2 Å²	91.2	68%	0.684	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	10.3	172.7	-57	-59.8	0	0	0	114.5	D100 Q104	D100-N102 PolarHBondContact O-N 3.04Å; D100-N102 PolarHBondContact OD1-N 3.46Å; N102-Q104 VanDerWaalsContact C-N 3.27Å; N102-Q104 PolarHBondContact O-N 3.1Å
103	A	57.7	Low	74.5	Confident	73 Å²	73	91 Å²	91	60%	0.603	48%	0.48	S	S	*	.			trans	-66.9	85.9	176.3	0	0	0	0	0	110.4	D100	D100-A103 HydrophobicContact CB-CB 4.1Å; D100-A103 VanDerWaalsContact O-CB 3.3Å; D100-A103 WeakPolarHBondContact O-CB 3.35Å; D100-A103 PolarHBondContact O-N 3.09Å
104	Q	60.5	Low	75.3	Confident	174 Å²	174	82.8 Å²	82.8	81%	0.813	44%	0.444	S	S	*	.			trans	-61.6	138.7	166.3	-73.4	-179.4	-9.3	0	0	109.1	N102 I106	N102-Q104 VanDerWaalsContact C-N 3.27Å; N102-Q104 PolarHBondContact O-N 3.1Å; Q104-I106 PolarHBondContact O-N 2.83Å
105	E	75.6	Confident	76.2	Confident	187 Å²	187	80 Å²	80	87%	0.874	43%	0.43	S	S	*	.			trans	-53.4	123.7	171.7	-171.7	-179.6	-173.1	0	0	109.2	K107	E105-K107 PolarHBondContact O-N 2.88Å; E105-K107 VanDerWaalsContact O-N 3.09Å
106	I	87.8	Confident	77.2	Confident	22 Å²	22	76.7 Å²	76.7	11%	0.113	41%	0.413	C	S	.	.			trans	-74.6	107.7	-178.3	-59.1	-177.5	0	0	0	108	Q104 D108 I109 E117 H118 A121	Q104-I106 PolarHBondContact O-N 2.83Å; I106-D108 PolarHBondContact O-N 2.8Å; I106-I109 HydrophobicContact CB-CB 4.22Å; I106-I109 HydrophobicContact CB-CD1 4.2Å; I106-I109 HydrophobicContact CB-CG1 4.31Å; I106-I109 HydrophobicContact CD1-CD1 4.27Å; I106-I109 HydrophobicContact CG2-CB 4.14Å; I106-I109 HydrophobicContact CG2-CG1 4.27Å; I106-I109 PolarHBondContact O-N 3.25Å; I106-E117 HydrophobicContact CD1-CB 4.19Å; I106-E117 HydrophobicContact CG1-CB 4.45Å; I106-E117 HydrophobicContact CG2-CB 3.77Å; I106-H118 HydrophobicContact CD1-CB 4.18Å; I106-A121 HydrophobicContact CD1-CB 4.09Å
107	K	90.9	Very high	78.7	Confident	183 Å²	183	74 Å²	74	80%	0.796	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	129.6	175.8	-174.5	-179.7	178.7	-177.3	0	110.4	E105 I109	E105-K107 PolarHBondContact O-N 2.88Å; E105-K107 VanDerWaalsContact O-N 3.09Å; K107-I109 VanDerWaalsContact C-N 3.35Å; K107-I109 PolarHBondContact O-N 3.23Å
108	D	94.2	Very high	80.4	Confident	63 Å²	63	71.8 Å²	71.8	34%	0.337	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	48.6	-179.8	-167.3	30.8	0	0	0	112.6	I106 Y110 G111 G114 Y239 Q243	I106-D108 PolarHBondContact O-N 2.8Å; D108-Y110 PolarHBondContact O-N 3.47Å; D108-G111 WeakPolarHBondContact O-CA 3.43Å; D108-G111 PolarHBondContact O-N 3.25Å; D108-G114 WeakPolarHBondContact O-CA 3.5Å; D108-Y239 VanDerWaalsContact OD1-CE1 3.28Å; D108-Y239 WeakPolarHBondContact OD1-CE1 3.29Å; D108-Y239 PolarHBondContact OD1-OH 3.11Å; D108-Y239 PolarHBondContact OD2-OH 3.09Å; D108-Q243 PolarHBondContact OD2-NE2 3.49Å
109	I	95.1	Very high	82.6	Confident	15 Å²	15	66.5 Å²	66.5	8%	0.077	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-29.2	-175.9	-170.5	159.9	0	0	0	114.5	G19 V21 A83 I106 K107 G114 Q115 H118	G19-I109 WeakPolarHBondContact O-CD1 3.47Å; V21-I109 HydrophobicContact CB-CD1 3.87Å; V21-I109 HydrophobicContact CG2-CD1 3.67Å; V21-I109 HydrophobicContact CG2-CG1 4.33Å; V21-I109 HydrophobicContact CG2-CG2 3.81Å; A83-I109 HydrophobicContact CB-CD1 4.28Å; A83-I109 HydrophobicContact CB-CG1 3.79Å; I106-I109 HydrophobicContact CB-CB 4.22Å; I106-I109 HydrophobicContact CB-CD1 4.2Å; I106-I109 HydrophobicContact CB-CG1 4.31Å; I106-I109 HydrophobicContact CD1-CD1 4.27Å; I106-I109 HydrophobicContact CG2-CB 4.14Å; I106-I109 HydrophobicContact CG2-CG1 4.27Å; I106-I109 PolarHBondContact O-N 3.25Å; K107-I109 VanDerWaalsContact C-N 3.35Å; K107-I109 PolarHBondContact O-N 3.23Å; I109-G114 CarbonylContact O-C 3.56Å; I109-Q115 PolarHBondContact O-N 3.21Å; I109-Q115 PolarHBondContact O-NE2 3.42Å; I109-H118 HydrophobicContact CG1-CB 4.44Å
110	Y	96.6	Very high	84.8	Confident	65 Å²	65	57.9 Å²	57.9	26%	0.255	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.7	177.9	-53.8	-52.9	0	0	0	113.4	V21 A83 D108 F232	V21-Y110 HydrophobicContact CG1-CE1 4.03Å; V21-Y110 HydrophobicContact CG2-CE1 4.02Å; A83-Y110 HydrophobicContact CB-CD1 4.47Å; A83-Y110 WeakPolarHBondContact O-CD1 3.43Å; D108-Y110 PolarHBondContact O-N 3.47Å; Y110-F232 HydrophobicContact CE1-CZ 4.3Å; Y110-F232 HydrophobicContact CE2-CZ 4.44Å; Y110-F232 AromaticContact CZ-CZ 3.9Å
111	G	97.3	Very high	86.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.294	C	S	.	.	S	Bend	trans	-82.8	168.3	177.3	0	0	0	0	0	113.4	D108 N113 G114 Q115 Q243	D108-G111 WeakPolarHBondContact O-CA 3.43Å; D108-G111 PolarHBondContact O-N 3.25Å; G111-N113 PolarHBondContact O-N 3.35Å; G111-G114 PolarHBondContact O-N 3.48Å; G111-G114 VanDerWaalsContact O-N 3.15Å; G111-Q115 VanDerWaalsContact O-CB 3.28Å; G111-Q115 WeakPolarHBondContact O-CB 3.45Å; G111-Q115 WeakPolarHBondContact O-CG 3.48Å; G111-Q115 PolarHBondContact O-N 3.21Å; G111-Q243 VanDerWaalsContact C-OE1 3.24Å
112	L	97.8	Very high	89.1	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-49	-49.7	-177	-168.8	75.2	0	0	0	112.8	I116 I140 Y143 F144 L240 Q243 E244 E247 V248	L112-I116 WeakPolarHBondContact O-CG1 3.22Å; L112-I116 PolarHBondContact O-N 2.99Å; L112-I140 HydrophobicContact CD1-CD1 3.77Å; L112-I140 HydrophobicContact CD1-CG1 3.89Å; L112-Y143 HydrophobicContact CD1-CD1 4.13Å; L112-Y143 HydrophobicContact CD1-CE1 4.19Å; L112-Y143 HydrophobicContact CD2-CD1 4.42Å; L112-Y143 HydrophobicContact CD2-CE1 3.71Å; L112-Y143 HydrophobicContact CG-CD1 4.37Å; L112-Y143 HydrophobicContact CG-CE1 3.93Å; L112-F144 HydrophobicContact CD1-CE1 3.57Å; L112-F144 HydrophobicContact CD1-CZ 4.15Å; L112-F144 HydrophobicContact CG-CE1 4.24Å; L112-L240 HydrophobicContact CB-CD1 4.15Å; L112-L240 HydrophobicContact CD1-CD1 4.08Å; L112-Q243 HydrophobicContact CB-CB 4.03Å; L112-E244 HydrophobicContact CD1-CG 4.05Å; L112-E247 HydrophobicContact CD2-CB 3.64Å; L112-E247 HydrophobicContact CD2-CG 4.5Å; L112-V248 HydrophobicContact CD1-CG2 4.29Å; L112-V248 HydrophobicContact CD2-CG2 3.93Å
113	N	97.3	Very high	91.3	Very high	71 Å²	71	44.7 Å²	44.7	38%	0.38	23%	0.225	S	C	.	.	H	α-helix	trans	-69.4	-44.5	178.8	-174.1	62.3	0	0	0	112.7	G111 Q115 I116 E117 R151	G111-N113 PolarHBondContact O-N 3.35Å; N113-Q115 VanDerWaalsContact C-N 3.25Å; N113-Q115 PolarHBondContact O-N 3.02Å; N113-I116 WeakPolarHBondContact O-CB 3.23Å; N113-I116 PolarHBondContact O-N 2.88Å; N113-I116 VanDerWaalsContact O-N 3.1Å; N113-E117 PolarHBondContact O-N 3.35Å; N113-R151 PolarHBondContact OD1-NH1 2.87Å; N113-R151 PolarHBondContact OD1-NH2 3.45Å
114	G	97.3	Very high	92.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-32.8	178.9	0	0	0	0	0	112.3	D108 I109 G111 I116 E117 H118	D108-G114 WeakPolarHBondContact O-CA 3.5Å; I109-G114 CarbonylContact O-C 3.56Å; G111-G114 PolarHBondContact O-N 3.48Å; G111-G114 VanDerWaalsContact O-N 3.15Å; G114-I116 VanDerWaalsContact C-N 3.32Å; G114-I116 PolarHBondContact O-N 3.02Å; G114-E117 PolarHBondContact O-N 3.01Å; G114-H118 WeakPolarHBondContact O-CB 3.46Å; G114-H118 PolarHBondContact O-N 3.03Å
115	Q	98.3	Very high	94.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.8	-35.3	172.1	-75.9	-62.7	-16.9	0	0	112.1	A83 I109 G111 N113 K119 F144 L240	A83-Q115 PolarHBondContact O-NE2 2.88Å; I109-Q115 PolarHBondContact O-N 3.21Å; I109-Q115 PolarHBondContact O-NE2 3.42Å; G111-Q115 VanDerWaalsContact O-CB 3.28Å; G111-Q115 WeakPolarHBondContact O-CB 3.45Å; G111-Q115 WeakPolarHBondContact O-CG 3.48Å; G111-Q115 PolarHBondContact O-N 3.21Å; N113-Q115 VanDerWaalsContact C-N 3.25Å; N113-Q115 PolarHBondContact O-N 3.02Å; Q115-K119 VanDerWaalsContact C-NZ 3.34Å; Q115-K119 WeakPolarHBondContact O-CD 3.4Å; Q115-K119 WeakPolarHBondContact O-CE 3.31Å; Q115-K119 PolarHBondContact O-N 3.17Å; Q115-K119 PolarHBondContact O-NZ 2.89Å; Q115-F144 HydrophobicContact CB-CE1 4.01Å; Q115-F144 HydrophobicContact CB-CE2 4.14Å; Q115-F144 HydrophobicContact CB-CZ 3.64Å; Q115-F144 HydrophobicContact CG-CZ 4.34Å; Q115-L240 HydrophobicContact CG-CD1 4.08Å; Q115-L240 HydrophobicContact CG-CD2 4.28Å
116	I	98.1	Very high	95	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-67.3	-50.5	174.4	-65.1	156.8	0	0	0	110.1	L112 N113 G114 H118 K119 L120 Y143 F144 Q147 M148	L112-I116 WeakPolarHBondContact O-CG1 3.22Å; L112-I116 PolarHBondContact O-N 2.99Å; N113-I116 WeakPolarHBondContact O-CB 3.23Å; N113-I116 PolarHBondContact O-N 2.88Å; N113-I116 VanDerWaalsContact O-N 3.1Å; G114-I116 VanDerWaalsContact C-N 3.32Å; G114-I116 PolarHBondContact O-N 3.02Å; I116-H118 PolarHBondContact O-N 3.19Å; I116-K119 PolarHBondContact O-N 2.94Å; I116-L120 HydrophobicContact CG2-CD1 4.25Å; I116-L120 PolarHBondContact O-N 3.45Å; I116-L120 VanDerWaalsContact O-N 3.09Å; I116-Y143 HydrophobicContact CD1-CE1 4.04Å; I116-F144 HydrophobicContact CD1-CD1 4.19Å; I116-F144 HydrophobicContact CG1-CB 4.41Å; I116-F144 HydrophobicContact CG1-CD1 3.47Å; I116-F144 VanDerWaalsContact CG1-CD1 3.47Å; I116-F144 HydrophobicContact CG1-CE1 4.09Å; I116-F144 HydrophobicContact CG1-CG 4.25Å; I116-Q147 HydrophobicContact CD1-CB 3.54Å; I116-Q147 HydrophobicContact CD1-CG 3.67Å; I116-Q147 HydrophobicContact CG1-CB 4.02Å; I116-Q147 HydrophobicContact CG2-CB 3.96Å; I116-M148 HydrophobicContact CG2-CG 4.19Å
117	E	96.9	Very high	95.2	Very high	52 Å²	52	32.1 Å²	32.1	24%	0.243	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-35.4	178.8	-68.3	-53.1	136	0	0	112.1	I106 N113 G114 K119 L120 A121 R151	I106-E117 HydrophobicContact CD1-CB 4.19Å; I106-E117 HydrophobicContact CG1-CB 4.45Å; I106-E117 HydrophobicContact CG2-CB 3.77Å; N113-E117 PolarHBondContact O-N 3.35Å; G114-E117 PolarHBondContact O-N 3.01Å; E117-K119 PolarHBondContact O-N 3.16Å; E117-L120 PolarHBondContact O-N 3.25Å; E117-A121 VanDerWaalsContact O-CB 3.28Å; E117-A121 WeakPolarHBondContact O-CB 3.4Å; E117-A121 PolarHBondContact O-N 3.06Å; E117-R151 WeakPolarHBondContact OE1-CD 3.4Å; E117-R151 IonicContact OE1-CZ 2.68Å; E117-R151 IonicContact OE1-NE 3.74Å; E117-R151 IonicContact OE1-NH1 2.96Å; E117-R151 PolarHBondContact OE1-NH1 2.91Å
118	H	96.7	Very high	95.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.6	-42.6	176	171.7	-103.9	0	0	0	112.3	T23 I106 I109 G114 I116 A121 F122	T23-H118 VanDerWaalsContact CG2-CE1 3.45Å; T23-H118 WeakPolarHBondContact CG2-CE1 3.28Å; T23-H118 PolarHBondContact OG1-NE2 3.2Å; I106-H118 HydrophobicContact CD1-CB 4.18Å; I109-H118 HydrophobicContact CG1-CB 4.44Å; G114-H118 WeakPolarHBondContact O-CB 3.46Å; G114-H118 PolarHBondContact O-N 3.03Å; I116-H118 PolarHBondContact O-N 3.19Å; H118-A121 PolarHBondContact O-N 3.37Å; H118-F122 PolarHBondContact O-N 2.89Å
119	K	97.8	Very high	95.1	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-68	-39.1	176.3	-88.9	70.1	101.3	-170.6	0	111.4	I50 I80 Q115 I116 E117 F122 L123 F144 M148	I50-K119 HydrophobicContact CG2-CG 4.42Å; I80-K119 HydrophobicContact CG2-CD 4.37Å; I80-K119 HydrophobicContact CG2-CG 4.05Å; Q115-K119 VanDerWaalsContact C-NZ 3.34Å; Q115-K119 WeakPolarHBondContact O-CD 3.4Å; Q115-K119 WeakPolarHBondContact O-CE 3.31Å; Q115-K119 PolarHBondContact O-N 3.17Å; Q115-K119 PolarHBondContact O-NZ 2.89Å; I116-K119 PolarHBondContact O-N 2.94Å; E117-K119 PolarHBondContact O-N 3.16Å; K119-F122 PolarHBondContact O-N 2.77Å; K119-L123 WeakPolarHBondContact O-CG 3.28Å; K119-L123 PolarHBondContact O-N 3.41Å; K119-L123 VanDerWaalsContact O-N 3.1Å; K119-F144 VanDerWaalsContact CE-CD2 3.48Å; K119-M148 HydrophobicContact CB-CE 4.18Å; K119-M148 HydrophobicContact CB-SD 3.76Å; K119-M148 HydrophobicContact CG-SD 4.49Å
120	L	96.6	Very high	94.9	Very high	3 Å²	3	35 Å²	35	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-65.7	-43.6	174.8	-69.4	174.9	0	0	0	112	I116 E117 F122 L123 R124 M148 R151 V152 L155	I116-L120 HydrophobicContact CG2-CD1 4.25Å; I116-L120 PolarHBondContact O-N 3.45Å; I116-L120 VanDerWaalsContact O-N 3.09Å; E117-L120 PolarHBondContact O-N 3.25Å; L120-F122 VanDerWaalsContact C-N 3.33Å; L120-F122 PolarHBondContact O-N 3.26Å; L120-L123 PolarHBondContact O-N 3.36Å; L120-R124 VanDerWaalsContact O-CG 3.28Å; L120-R124 WeakPolarHBondContact O-CG 3.49Å; L120-R124 PolarHBondContact O-N 2.8Å; L120-M148 HydrophobicContact CD2-CB 3.88Å; L120-M148 HydrophobicContact CD2-CE 4.13Å; L120-M148 HydrophobicContact CD2-CG 3.74Å; L120-M148 HydrophobicContact CG-CG 3.94Å; L120-R151 HydrophobicContact CD1-CB 4.22Å; L120-V152 HydrophobicContact CD1-CG2 3.86Å; L120-V152 HydrophobicContact CD2-CB 4.24Å; L120-V152 HydrophobicContact CD2-CG2 3.71Å; L120-V152 HydrophobicContact CG-CG2 4.37Å; L120-L155 HydrophobicContact CD2-CD1 3.95Å
121	A	94.6	Very high	94.7	Very high	21 Å²	21	32.3 Å²	32.3	17%	0.174	16%	0.155	C	C	.	.	H	α-helix	trans	-59.2	-46.3	175.7	0	0	0	0	0	110.5	I106 E117 H118 L123 R124 T125	I106-A121 HydrophobicContact CD1-CB 4.09Å; E117-A121 VanDerWaalsContact O-CB 3.28Å; E117-A121 WeakPolarHBondContact O-CB 3.4Å; E117-A121 PolarHBondContact O-N 3.06Å; H118-A121 PolarHBondContact O-N 3.37Å; A121-L123 PolarHBondContact O-N 3.42Å; A121-R124 PolarHBondContact O-N 2.87Å; A121-T125 WeakPolarHBondContact O-CG2 3.49Å; A121-T125 PolarHBondContact O-N 3.39Å; A121-T125 PolarHBondContact O-OG1 2.95Å; A121-T125 VanDerWaalsContact O-OG1 3.07Å
122	F	95	Very high	94.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.3	-48.8	175.2	175.5	-96.4	0	0	0	112.6	I16 V25 F48 W78 I80 H118 K119 L120 R124 T125 H126 V127	I16-F122 HydrophobicContact CD1-CD2 3.3Å; I16-F122 HydrophobicContact CD1-CE2 3.38Å; V25-F122 HydrophobicContact CG1-CE2 4.29Å; V25-F122 HydrophobicContact CG1-CZ 4.03Å; V25-F122 HydrophobicContact CG2-CD2 4.4Å; V25-F122 HydrophobicContact CG2-CE2 3.78Å; V25-F122 HydrophobicContact CG2-CZ 4.31Å; F48-F122 HydrophobicContact CD2-CE1 4.32Å; F48-F122 AromaticContact CE2-CD1 3.71Å; F48-F122 HydrophobicContact CE2-CD1 3.71Å; F48-F122 AromaticContact CE2-CE1 3.36Å; F48-F122 HydrophobicContact CE2-CE1 3.36Å; F48-F122 HydrophobicContact CE2-CZ 4.35Å; F48-F122 AromaticContact CZ-CD1 3.5Å; F48-F122 HydrophobicContact CZ-CD1 3.5Å; F48-F122 AromaticContact CZ-CE1 3.71Å; F48-F122 HydrophobicContact CZ-CE1 3.71Å; W78-F122 HydrophobicContact CE3-CE1 4.11Å; W78-F122 AromaticContact CE3-CZ 3.88Å; W78-F122 HydrophobicContact CE3-CZ 3.88Å; W78-F122 HydrophobicContact CZ3-CE1 4.42Å; W78-F122 HydrophobicContact CZ3-CZ 4.04Å; I80-F122 HydrophobicContact CD1-CB 3.58Å; I80-F122 HydrophobicContact CD1-CD1 3.97Å; I80-F122 HydrophobicContact CD1-CD2 3.79Å; I80-F122 HydrophobicContact CD1-CE2 4.49Å; I80-F122 HydrophobicContact CD1-CG 3.47Å; I80-F122 VanDerWaalsContact CD1-CG 3.47Å; H118-F122 PolarHBondContact O-N 2.89Å; K119-F122 PolarHBondContact O-N 2.77Å; L120-F122 VanDerWaalsContact C-N 3.33Å; L120-F122 PolarHBondContact O-N 3.26Å; F122-R124 VanDerWaalsContact C-N 3.32Å; F122-R124 PolarHBondContact O-N 3.05Å; F122-T125 PolarHBondContact O-N 2.91Å; F122-T125 PolarHBondContact O-OG1 2.77Å; F122-H126 HydrophobicContact CD2-CB 4.12Å; F122-H126 AromaticContact CD2-CD2 3.28Å; F122-H126 WeakPolarHBondContact CD2-CD2 3.49Å; F122-H126 AromaticContact CD2-CG 3.82Å; F122-H126 AromaticContact CD2-NE2 3.97Å; F122-H126 HydrophobicContact CE1-CB 4.33Å; F122-H126 HydrophobicContact CE2-CB 3.72Å; F122-H126 AromaticContact CE2-CD2 3.52Å; F122-H126 AromaticContact CE2-CG 3.57Å; F122-H126 HydrophobicContact CZ-CB 3.85Å; F122-H126 WeakPolarHBondContact O-CB 3.4Å; F122-H126 PolarHBondContact O-CD2 2.85Å; F122-H126 PolarHBondContact O-N 2.99Å; F122-V127 HydrophobicContact CE1-CG2 4.36Å
123	L	95.1	Very high	94.7	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.042	17%	0.173	C	C	.	.	H	α-helix	trans	-61.8	-41.5	178.8	-69.5	-179.4	0	0	0	111.4	F48 K119 L120 A121 T125 V127 L133 M148 L155	F48-L123 HydrophobicContact CD1-CD2 4.06Å; F48-L123 HydrophobicContact CE1-CD2 4Å; F48-L123 HydrophobicContact CE1-CG 4.31Å; F48-L123 HydrophobicContact CG-CD2 4.31Å; F48-L123 HydrophobicContact CZ-CD2 4.22Å; K119-L123 WeakPolarHBondContact O-CG 3.28Å; K119-L123 PolarHBondContact O-N 3.41Å; K119-L123 VanDerWaalsContact O-N 3.1Å; L120-L123 PolarHBondContact O-N 3.36Å; A121-L123 PolarHBondContact O-N 3.42Å; L123-T125 VanDerWaalsContact C-N 3.33Å; L123-T125 PolarHBondContact O-N 2.65Å; L123-V127 HydrophobicContact CD2-CB 4.23Å; L123-V127 HydrophobicContact CD2-CG2 3.66Å; L123-V127 WeakPolarHBondContact O-CA 3.04Å; L123-V127 VanDerWaalsContact O-CB 3.31Å; L123-V127 WeakPolarHBondContact O-CB 3.49Å; L123-V127 PolarHBondContact O-N 3.47Å; L123-L133 HydrophobicContact CD1-CD1 4.09Å; L123-M148 HydrophobicContact CD1-CE 3.43Å; L123-M148 VanDerWaalsContact CD1-CE 3.43Å; L123-M148 HydrophobicContact CG-CE 4.46Å; L123-L155 HydrophobicContact CD1-CD1 4.41Å; L123-L155 HydrophobicContact CD1-CD2 4.09Å
124	R	92	Very high	94.8	Very high	135 Å²	135	33 Å²	33	51%	0.509	16%	0.155	S	C	.	.	H	α-helix	trans	-62.2	-38.1	178.7	-71.6	169.6	-174.2	156.7	4.3	112.7	L120 A121 F122	L120-R124 VanDerWaalsContact O-CG 3.28Å; L120-R124 WeakPolarHBondContact O-CG 3.49Å; L120-R124 PolarHBondContact O-N 2.8Å; A121-R124 PolarHBondContact O-N 2.87Å; F122-R124 VanDerWaalsContact C-N 3.32Å; F122-R124 PolarHBondContact O-N 3.05Å
125	T	89.3	Confident	94.8	Very high	32 Å²	32	33 Å²	33	20%	0.196	16%	0.155	C	C	.	.	H	α-helix	trans	-96.2	-22	-172.9	60.3	0	0	0	0	114.4	F35 D100 A121 F122 L123	F35-T125 VanDerWaalsContact CE2-O 3.26Å; F35-T125 WeakPolarHBondContact CE2-O 3.45Å; D100-T125 HydrophobicContact CB-CG2 4.12Å; A121-T125 WeakPolarHBondContact O-CG2 3.49Å; A121-T125 PolarHBondContact O-N 3.39Å; A121-T125 PolarHBondContact O-OG1 2.95Å; A121-T125 VanDerWaalsContact O-OG1 3.07Å; F122-T125 PolarHBondContact O-N 2.91Å; F122-T125 PolarHBondContact O-OG1 2.77Å; L123-T125 VanDerWaalsContact C-N 3.33Å; L123-T125 PolarHBondContact O-N 2.65Å
126	H	90.5	Very high	94.9	Very high	17 Å²	17	33 Å²	33	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-118.8	-10.9	-175.3	-62.8	-88.6	0	0	0	114.5	I16 W78 T97 F122	I16-H126 VanDerWaalsContact CD1-NE2 3.3Å; I16-H126 WeakPolarHBondContact CD1-NE2 3.38Å; W78-H126 HydrophobicContact CZ3-CB 4.49Å; T97-H126 WeakPolarHBondContact CG2-CE1 3.36Å; F122-H126 HydrophobicContact CD2-CB 4.12Å; F122-H126 AromaticContact CD2-CD2 3.28Å; F122-H126 WeakPolarHBondContact CD2-CD2 3.49Å; F122-H126 AromaticContact CD2-CG 3.82Å; F122-H126 AromaticContact CD2-NE2 3.97Å; F122-H126 HydrophobicContact CE1-CB 4.33Å; F122-H126 HydrophobicContact CE2-CB 3.72Å; F122-H126 AromaticContact CE2-CD2 3.52Å; F122-H126 AromaticContact CE2-CG 3.57Å; F122-H126 HydrophobicContact CZ-CB 3.85Å; F122-H126 WeakPolarHBondContact O-CB 3.4Å; F122-H126 PolarHBondContact O-CD2 2.85Å; F122-H126 PolarHBondContact O-N 2.99Å
127	V	92.5	Very high	94.9	Very high	8 Å²	8	33 Å²	33	5%	0.048	16%	0.155	C	C	.	.	S	Bend	trans	-120.7	126.7	-178.2	-173.8	0	0	0	0	110.4	L46 W78 F122 L123 M131 L133	L46-V127 HydrophobicContact CD2-CG1 4.08Å; L46-V127 HydrophobicContact CD2-CG2 3.63Å; W78-V127 HydrophobicContact CE3-CG2 4.49Å; W78-V127 HydrophobicContact CZ3-CG2 4.1Å; F122-V127 HydrophobicContact CE1-CG2 4.36Å; L123-V127 HydrophobicContact CD2-CB 4.23Å; L123-V127 HydrophobicContact CD2-CG2 3.66Å; L123-V127 WeakPolarHBondContact O-CA 3.04Å; L123-V127 VanDerWaalsContact O-CB 3.31Å; L123-V127 WeakPolarHBondContact O-CB 3.49Å; L123-V127 PolarHBondContact O-N 3.47Å; V127-M131 HydrophobicContact CG1-CB 3.68Å; V127-M131 HydrophobicContact CG1-CG 3.77Å; V127-L133 HydrophobicContact CG1-CD2 4.29Å
128	P	91.7	Very high	95	Very high	5 Å²	5	31 Å²	31	3%	0.032	15%	0.146	C	C	.	.			trans	-57	140.7	175.6	-23.4	31.7	0	0	0	112.2	L34 F35 D130 M131	L34-P128 HydrophobicContact CB-CG 3.92Å; L34-P128 WeakPolarHBondContact O-CG 3.35Å; F35-P128 HydrophobicContact CD1-CG 4.24Å; F35-P128 HydrophobicContact CE1-CB 4.32Å; F35-P128 HydrophobicContact CE1-CG 4.23Å; P128-D130 VanDerWaalsContact CB-OD1 3.24Å; P128-D130 WeakPolarHBondContact CB-OD1 3.45Å; P128-D130 PolarHBondContact O-N 2.89Å; P128-M131 HydrophobicContact CB-CB 4.39Å; P128-M131 HydrophobicContact CG-CE 4.25Å; P128-M131 WeakPolarHBondContact O-CB 3.42Å; P128-M131 PolarHBondContact O-N 3.49Å
129	K	90.2	Very high	95.1	Very high	205 Å²	205	31.2 Å²	31.2	89%	0.891	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.7	-176.8	-66.6	-175	179.2	-178.9	0	113.9	L156	K129-L156 WeakPolarHBondContact O-CD1 3.48Å
130	D	90.9	Very high	95.1	Very high	110 Å²	110	31.2 Å²	31.2	59%	0.588	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-3	178.6	64.1	-40.1	0	0	0	113.5	P128 K132	P128-D130 VanDerWaalsContact CB-OD1 3.24Å; P128-D130 WeakPolarHBondContact CB-OD1 3.45Å; P128-D130 PolarHBondContact O-N 2.89Å; D130-K132 PolarHBondContact O-N 2.68Å
131	M	93.8	Very high	95.2	Very high	9 Å²	9	31.1 Å²	31.1	4%	0.044	15%	0.146	C	C	.	.			trans	-71	124.6	177.5	-173.4	66.3	62	0	0	110.5	L34 P43 L45 L46 V127 P128	L34-M131 HydrophobicContact CB-CE 4.45Å; L34-M131 HydrophobicContact CD1-CE 4.1Å; L34-M131 HydrophobicContact CD2-CE 4.06Å; L34-M131 HydrophobicContact CG-CE 4.43Å; P43-M131 VanDerWaalsContact O-CE 3.23Å; P43-M131 WeakPolarHBondContact O-CE 3.45Å; L45-M131 VanDerWaalsContact C-SD 3.56Å; L45-M131 PolarHBondContact N-SD 3.22Å; L45-M131 VanDerWaalsContact N-SD 3.39Å; L46-M131 HydrophobicContact CB-CG 3.91Å; L46-M131 HydrophobicContact CB-SD 4.29Å; V127-M131 HydrophobicContact CG1-CB 3.68Å; V127-M131 HydrophobicContact CG1-CG 3.77Å; P128-M131 HydrophobicContact CB-CB 4.39Å; P128-M131 HydrophobicContact CG-CE 4.25Å; P128-M131 WeakPolarHBondContact O-CB 3.42Å; P128-M131 PolarHBondContact O-N 3.49Å
132	K	96.4	Very high	95.4	Very high	82 Å²	82	30.1 Å²	30.1	36%	0.357	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147.7	169.6	-68.2	172.7	175.8	-177.4	0	110.1	K44 L45 L46 D130 L156 I158 M325	K44-K132 WeakPolarHBondContact O-CB 3.28Å; K44-K132 PolarHBondContact O-N 3.47Å; L45-K132 CarbonylContact C-O 3.46Å; L45-K132 WeakPolarHBondContact CA-O 3.31Å; L45-K132 HydrophobicContact CD1-CB 3.53Å; L46-K132 PolarHBondContact N-O 2.95Å; D130-K132 PolarHBondContact O-N 2.68Å; K132-L156 CarbonylContact C-O 3.59Å; K132-L156 WeakPolarHBondContact CA-O 3.45Å; K132-I158 HydrophobicContact CB-CG2 4.1Å; K132-I158 HydrophobicContact CD-CG2 4.07Å; K132-I158 HydrophobicContact CG-CG2 4.15Å; K132-M325 HydrophobicContact CD-CE 3.58Å; K132-M325 HydrophobicContact CD-SD 4.09Å
133	L	98	Very high	95.6	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.026	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	133.4	-176.7	-63.5	173.8	0	0	0	111.6	L46 L123 V127 L135 L155 L156 V157 I158	L46-L133 HydrophobicContact CB-CD2 4.04Å; L46-L133 HydrophobicContact CD2-CD2 4.11Å; L46-L133 HydrophobicContact CG-CD2 4.36Å; L46-L133 WeakPolarHBondContact O-CA 3.46Å; L123-L133 HydrophobicContact CD1-CD1 4.09Å; V127-L133 HydrophobicContact CG1-CD2 4.29Å; L133-L135 HydrophobicContact CB-CD2 4.22Å; L133-L135 HydrophobicContact CD1-CD2 4.41Å; L133-L155 HydrophobicContact CD1-CD2 4.09Å; L133-L156 PolarHBondContact N-O 3.46Å; L133-V157 HydrophobicContact CB-CG2 4.16Å; L133-V157 HydrophobicContact CD1-CG2 4.35Å; L133-V157 WeakPolarHBondContact O-CA 3.14Å; L133-I158 WeakPolarHBondContact O-CG1 3.5Å; L133-I158 PolarHBondContact O-N 3.08Å
134	V	98.4	Very high	95.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	116.7	153.7	172.9	0	0	0	0	107.1	L45 L46 I47 F48 I136 I158 R159 F161 L318	L45-V134 HydrophobicContact CD1-CG2 4.15Å; L45-V134 HydrophobicContact CD2-CG2 4.02Å; L45-V134 HydrophobicContact CG-CG2 4.4Å; L46-V134 PolarHBondContact O-N 3.03Å; I47-V134 WeakPolarHBondContact CA-O 3.35Å; I47-V134 HydrophobicContact CG1-CB 4.18Å; I47-V134 HydrophobicContact CG2-CG1 4.42Å; F48-V134 PolarHBondContact N-O 2.96Å; V134-I136 HydrophobicContact CG1-CG1 4.27Å; V134-I158 HydrophobicContact CG2-CD1 4.01Å; V134-I158 HydrophobicContact CG2-CG1 3.88Å; V134-R159 VanDerWaalsContact CA-O 3.31Å; V134-R159 WeakPolarHBondContact CA-O 3.42Å; V134-R159 HydrophobicContact CG2-CB 4.4Å; V134-F161 HydrophobicContact CG1-CD2 3.91Å; V134-F161 HydrophobicContact CG1-CE2 3.84Å; V134-L318 HydrophobicContact CG1-CD1 4.33Å; V134-L318 HydrophobicContact CG1-CD2 4.21Å; V134-L318 HydrophobicContact CG2-CD2 3.83Å
135	L	98.8	Very high	96.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	135.8	176.1	-59	-177.1	0	0	0	109.8	F48 L133 T145 V157 R159 A160 F161	F48-L135 HydrophobicContact CB-CD2 4.04Å; F48-L135 HydrophobicContact CD1-CD2 4.04Å; L133-L135 HydrophobicContact CB-CD2 4.22Å; L133-L135 HydrophobicContact CD1-CD2 4.41Å; L135-T145 HydrophobicContact CB-CG2 3.88Å; L135-T145 HydrophobicContact CD1-CG2 3.86Å; L135-V157 HydrophobicContact CD1-CG1 4.17Å; L135-V157 HydrophobicContact CD1-CG2 3.63Å; L135-V157 HydrophobicContact CG-CG1 4.09Å; L135-V157 HydrophobicContact CG-CG2 4Å; L135-R159 PolarHBondContact N-O 3.3Å; L135-A160 HydrophobicContact CB-CB 4.1Å; L135-A160 CarbonylContact O-C 3.43Å; L135-A160 VanDerWaalsContact O-CA 3.26Å; L135-A160 WeakPolarHBondContact O-CA 3.13Å; L135-F161 PolarHBondContact O-N 3.13Å
136	I	98.9	Very high	96.5	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	101.4	173.1	-57.2	177	0	0	0	107.6	I47 F48 I49 I50 F63 L67 V134 F161 L163 I314	I47-I136 HydrophobicContact CG2-CD1 3.6Å; I47-I136 HydrophobicContact CG2-CG1 4.3Å; F48-I136 PolarHBondContact O-N 2.9Å; I49-I136 WeakPolarHBondContact CA-O 3.49Å; I49-I136 HydrophobicContact CG1-CB 4.27Å; I49-I136 HydrophobicContact CG1-CD1 4.32Å; I50-I136 PolarHBondContact N-O 3.35Å; F63-I136 HydrophobicContact CE1-CD1 4.47Å; F63-I136 HydrophobicContact CE1-CG2 4.11Å; F63-I136 HydrophobicContact CZ-CD1 4.47Å; F63-I136 HydrophobicContact CZ-CG2 4.25Å; L67-I136 HydrophobicContact CD1-CD1 3.56Å; V134-I136 HydrophobicContact CG1-CG1 4.27Å; I136-F161 WeakPolarHBondContact CA-O 3.31Å; I136-F161 HydrophobicContact CG1-CB 4.38Å; I136-F161 HydrophobicContact CG1-CD2 4.13Å; I136-F161 HydrophobicContact CG2-CB 4.5Å; I136-L163 HydrophobicContact CG2-CD1 3.51Å; I136-L163 HydrophobicContact CG2-CG 4.1Å; I136-I314 HydrophobicContact CD1-CD1 4.33Å; I136-I314 HydrophobicContact CD1-CG2 4.16Å; I136-I314 HydrophobicContact CG2-CD1 4.39Å
137	G	98.8	Very high	96.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.5	173.5	0	0	0	0	0	110.2	G141 S142 F161 L163	G137-G141 VanDerWaalsContact CA-C 3.45Å; G137-G141 WeakPolarHBondContact CA-O 3.38Å; G137-S142 PolarHBondContact O-OG 3.45Å; G137-S142 VanDerWaalsContact O-OG 3.08Å; G137-F161 PolarHBondContact N-O 2.84Å; G137-L163 PolarHBondContact O-N 2.85Å
138	H	98.8	Very high	97.2	Very high	11 Å²	11	23.1 Å²	23.1	5%	0.051	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.9	168.9	167.2	-115.7	0	0	0	110.3	I50 P51 G52 Y60 I140 G141 L163 H300 F302	I50-H138 PolarHBondContact O-N 2.88Å; P51-H138 CarbonylContact C-O 3.51Å; G52-H138 WeakPolarHBondContact CA-O 3.49Å; G52-H138 PolarHBondContact N-ND1 3.47Å; G52-H138 PolarHBondContact N-O 2.86Å; Y60-H138 HydrophobicContact CE1-CB 4.08Å; Y60-H138 AromaticContact CZ-ND1 3.89Å; Y60-H138 WeakPolarHBondContact OH-CB 3.41Å; Y60-H138 VanDerWaalsContact OH-CG 3.3Å; Y60-H138 PolarHBondContact OH-ND1 3.26Å; H138-I140 PolarHBondContact O-N 3.29Å; H138-I140 VanDerWaalsContact O-N 3.13Å; H138-G141 WeakPolarHBondContact O-CA 3.46Å; H138-G141 PolarHBondContact O-N 3.42Å; H138-L163 CarbonylContact C-O 3.33Å; H138-L163 WeakPolarHBondContact CA-O 3.29Å; H138-H300 AromaticContact NE2-CD2 3.91Å; H138-H300 AromaticContact NE2-NE2 3.97Å; H138-H300 PolarHBondContact NE2-O 2.8Å; H138-F302 HydrophobicContact CB-CE1 4.3Å; H138-F302 AromaticContact CD2-CD1 3.9Å; H138-F302 AromaticContact CD2-CE1 3.51Å; H138-F302 AromaticContact CG-CE1 3.91Å
139	S	98.3	Very high	97.5	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.028	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	-122.4	176.5	-171.7	0	0	0	0	109.4	G141 S142 L163 F164 T166 H300	S139-G141 PolarHBondContact O-N 2.79Å; S139-G141 VanDerWaalsContact O-N 3.16Å; S139-S142 WeakPolarHBondContact O-CB 3.47Å; S139-S142 PolarHBondContact O-N 3.45Å; S139-S142 PolarHBondContact O-OG 2.91Å; S139-L163 PolarHBondContact N-O 2.97Å; S139-F164 VanDerWaalsContact CA-O 3.26Å; S139-F164 WeakPolarHBondContact CA-O 3.47Å; S139-F164 PolarHBondContact N-O 3.36Å; S139-T166 PolarHBondContact O-N 2.87Å; S139-T166 PolarHBondContact O-OG1 3.2Å; S139-T166 WeakPolarHBondContact OG-CG2 3.35Å; S139-T166 PolarHBondContact OG-OG1 2.72Å; S139-H300 WeakPolarHBondContact CB-NE2 3.25Å; S139-H300 PolarHBondContact OG-CE1 3Å; S139-H300 PolarHBondContact OG-NE2 2.97Å
140	I	98.7	Very high	97.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-24.5	179.5	-163.3	63	0	0	0	113.3	N53 L112 H138 S142 Y143 F144 T166 E244 V248	N53-I140 HydrophobicContact CB-CG2 4.11Å; L112-I140 HydrophobicContact CD1-CD1 3.77Å; L112-I140 HydrophobicContact CD1-CG1 3.89Å; H138-I140 PolarHBondContact O-N 3.29Å; H138-I140 VanDerWaalsContact O-N 3.13Å; I140-S142 PolarHBondContact O-N 3.44Å; I140-S142 VanDerWaalsContact O-N 3.17Å; I140-Y143 HydrophobicContact CD1-CD1 4.29Å; I140-Y143 HydrophobicContact CD1-CG 4.26Å; I140-Y143 WeakPolarHBondContact O-CB 3.41Å; I140-Y143 PolarHBondContact O-N 2.8Å; I140-F144 HydrophobicContact CG1-CE1 3.95Å; I140-F144 HydrophobicContact CG1-CE2 4.22Å; I140-F144 HydrophobicContact CG1-CZ 3.76Å; I140-F144 HydrophobicContact CG2-CE2 3.92Å; I140-F144 HydrophobicContact CG2-CZ 4.17Å; I140-F144 WeakPolarHBondContact O-CG 3.14Å; I140-F144 PolarHBondContact O-N 3.19Å; I140-T166 WeakPolarHBondContact CA-OG1 3.28Å; I140-T166 PolarHBondContact N-OG1 3Å; I140-E244 HydrophobicContact CB-CG 4.38Å; I140-E244 WeakPolarHBondContact CB-OE2 3.43Å; I140-E244 HydrophobicContact CD1-CB 4.29Å; I140-E244 HydrophobicContact CD1-CG 3.55Å; I140-E244 HydrophobicContact CG1-CG 3.69Å; I140-V248 HydrophobicContact CD1-CG2 3.74Å
141	G	98.8	Very high	98.1	Very high	0 Å²	0	17 Å²	17	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58	-25.8	170.3	0	0	0	0	0	113.2	P51 G137 H138 S139 T145	P51-G141 WeakPolarHBondContact O-CA 3.26Å; P51-G141 PolarHBondContact O-N 2.81Å; G137-G141 VanDerWaalsContact CA-C 3.45Å; G137-G141 WeakPolarHBondContact CA-O 3.38Å; H138-G141 WeakPolarHBondContact O-CA 3.46Å; H138-G141 PolarHBondContact O-N 3.42Å; S139-G141 PolarHBondContact O-N 2.79Å; S139-G141 VanDerWaalsContact O-N 3.16Å; G141-T145 WeakPolarHBondContact O-CB 3.47Å; G141-T145 PolarHBondContact O-N 3.02Å; G141-T145 PolarHBondContact O-OG1 3.22Å
142	S	98.8	Very high	98.2	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.5	-44	172.1	-60.1	0	0	0	0	111.9	G137 S139 I140 F144 T145 L146 L162	G137-S142 PolarHBondContact O-OG 3.45Å; G137-S142 VanDerWaalsContact O-OG 3.08Å; S139-S142 WeakPolarHBondContact O-CB 3.47Å; S139-S142 PolarHBondContact O-N 3.45Å; S139-S142 PolarHBondContact O-OG 2.91Å; I140-S142 PolarHBondContact O-N 3.44Å; I140-S142 VanDerWaalsContact O-N 3.17Å; S142-F144 VanDerWaalsContact C-N 3.35Å; S142-T145 WeakPolarHBondContact O-CB 3.47Å; S142-T145 PolarHBondContact O-N 3.29Å; S142-L146 PolarHBondContact O-N 2.66Å; S142-L162 WeakPolarHBondContact OG-CA 3.46Å
143	Y	98.8	Very high	97.9	Very high	34 Å²	34	17 Å²	17	13%	0.133	8%	0.081	C	C	.	.	H	α-helix	trans	-61.7	-44.4	173.7	179.8	-96.3	0	0	0	111	L112 I116 I140 T145 L146 Q147 V248	L112-Y143 HydrophobicContact CD1-CD1 4.13Å; L112-Y143 HydrophobicContact CD1-CE1 4.19Å; L112-Y143 HydrophobicContact CD2-CD1 4.42Å; L112-Y143 HydrophobicContact CD2-CE1 3.71Å; L112-Y143 HydrophobicContact CG-CD1 4.37Å; L112-Y143 HydrophobicContact CG-CE1 3.93Å; I116-Y143 HydrophobicContact CD1-CE1 4.04Å; I140-Y143 HydrophobicContact CD1-CD1 4.29Å; I140-Y143 HydrophobicContact CD1-CG 4.26Å; I140-Y143 WeakPolarHBondContact O-CB 3.41Å; I140-Y143 PolarHBondContact O-N 2.8Å; Y143-T145 VanDerWaalsContact C-N 3.31Å; Y143-T145 PolarHBondContact O-N 2.87Å; Y143-L146 PolarHBondContact O-N 3.42Å; Y143-Q147 HydrophobicContact CD1-CG 4.11Å; Y143-Q147 HydrophobicContact CE1-CG 3.72Å; Y143-Q147 HydrophobicContact CE2-CG 4.31Å; Y143-Q147 WeakPolarHBondContact O-CG 3.49Å; Y143-Q147 PolarHBondContact O-N 2.98Å; Y143-V248 HydrophobicContact CD1-CG2 4.29Å; Y143-V248 HydrophobicContact CD2-CG1 4.05Å; Y143-V248 HydrophobicContact CD2-CG2 4.13Å; Y143-V248 HydrophobicContact CE1-CG2 4.36Å; Y143-V248 HydrophobicContact CE2-CG1 4.44Å; Y143-V248 HydrophobicContact CE2-CG2 4.21Å; Y143-V248 HydrophobicContact CG-CG2 4.18Å
144	F	98.8	Very high	97.6	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-58.3	-43.8	174	-60.7	-25	0	0	0	112	I50 H82 L112 Q115 I116 K119 I140 S142 L146 Q147 M148 L240	I50-F144 HydrophobicContact CG2-CB 4.22Å; I50-F144 HydrophobicContact CG2-CD2 3.87Å; H82-F144 AromaticContact CE1-CE2 3.63Å; H82-F144 AromaticContact NE2-CE2 3.65Å; L112-F144 HydrophobicContact CD1-CE1 3.57Å; L112-F144 HydrophobicContact CD1-CZ 4.15Å; L112-F144 HydrophobicContact CG-CE1 4.24Å; Q115-F144 HydrophobicContact CB-CE1 4.01Å; Q115-F144 HydrophobicContact CB-CE2 4.14Å; Q115-F144 HydrophobicContact CB-CZ 3.64Å; Q115-F144 HydrophobicContact CG-CZ 4.34Å; I116-F144 HydrophobicContact CD1-CD1 4.19Å; I116-F144 HydrophobicContact CG1-CB 4.41Å; I116-F144 HydrophobicContact CG1-CD1 3.47Å; I116-F144 VanDerWaalsContact CG1-CD1 3.47Å; I116-F144 HydrophobicContact CG1-CE1 4.09Å; I116-F144 HydrophobicContact CG1-CG 4.25Å; K119-F144 VanDerWaalsContact CE-CD2 3.48Å; I140-F144 HydrophobicContact CG1-CE1 3.95Å; I140-F144 HydrophobicContact CG1-CE2 4.22Å; I140-F144 HydrophobicContact CG1-CZ 3.76Å; I140-F144 HydrophobicContact CG2-CE2 3.92Å; I140-F144 HydrophobicContact CG2-CZ 4.17Å; I140-F144 WeakPolarHBondContact O-CG 3.14Å; I140-F144 PolarHBondContact O-N 3.19Å; S142-F144 VanDerWaalsContact C-N 3.35Å; F144-L146 PolarHBondContact O-N 2.93Å; F144-Q147 PolarHBondContact O-N 2.82Å; F144-M148 WeakPolarHBondContact O-CB 3.26Å; F144-M148 WeakPolarHBondContact O-CG 3.42Å; F144-M148 PolarHBondContact O-N 3.08Å; F144-L240 HydrophobicContact CZ-CD1 4.2Å; F144-L240 HydrophobicContact CZ-CD2 4.32Å
145	T	98.8	Very high	97.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59	-46.4	177.8	-60.4	0	0	0	0	111.5	L135 G141 S142 Y143 M148 L149 A160 L162	L135-T145 HydrophobicContact CB-CG2 3.88Å; L135-T145 HydrophobicContact CD1-CG2 3.86Å; G141-T145 WeakPolarHBondContact O-CB 3.47Å; G141-T145 PolarHBondContact O-N 3.02Å; G141-T145 PolarHBondContact O-OG1 3.22Å; S142-T145 WeakPolarHBondContact O-CB 3.47Å; S142-T145 PolarHBondContact O-N 3.29Å; Y143-T145 VanDerWaalsContact C-N 3.31Å; Y143-T145 PolarHBondContact O-N 2.87Å; T145-M148 PolarHBondContact O-N 2.94Å; T145-L149 WeakPolarHBondContact O-CG 3.38Å; T145-L149 PolarHBondContact O-N 2.9Å; T145-L149 VanDerWaalsContact O-N 3.09Å; T145-A160 HydrophobicContact CG2-CB 3.9Å; T145-L162 HydrophobicContact CG2-CD2 3.68Å
146	L	98.7	Very high	97.2	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-62.2	-45.6	176.3	-69.7	177.1	0	0	0	111.7	S142 Y143 F144 M148 L149 K150 L162 I167 I256 L263	S142-L146 PolarHBondContact O-N 2.66Å; Y143-L146 PolarHBondContact O-N 3.42Å; F144-L146 PolarHBondContact O-N 2.93Å; L146-M148 VanDerWaalsContact C-N 3.33Å; L146-M148 PolarHBondContact O-N 3.04Å; L146-L149 PolarHBondContact O-N 2.81Å; L146-K150 PolarHBondContact O-N 2.87Å; L146-L162 HydrophobicContact CD1-CD1 4.1Å; L146-L162 HydrophobicContact CD2-CD1 3.84Å; L146-L162 HydrophobicContact CG-CD1 3.85Å; L146-I167 HydrophobicContact CD1-CB 4.16Å; L146-I167 HydrophobicContact CD1-CD1 4.18Å; L146-I167 HydrophobicContact CD1-CG2 3.77Å; L146-I256 HydrophobicContact CD1-CD1 4.3Å; L146-I256 HydrophobicContact CD1-CG1 4.12Å; L146-I256 HydrophobicContact CD2-CG1 4.06Å; L146-L263 HydrophobicContact CD2-CD1 3.88Å; L146-L263 HydrophobicContact CD2-CD2 4.15Å
147	Q	98.6	Very high	97.2	Very high	17 Å²	17	30.3 Å²	30.3	8%	0.079	15%	0.147	C	C	.	.	H	α-helix	trans	-66.4	-34.4	179.7	-68.3	-60.5	-45.4	0	0	112.9	I116 Y143 F144 K150 R151 D252	I116-Q147 HydrophobicContact CD1-CB 3.54Å; I116-Q147 HydrophobicContact CD1-CG 3.67Å; I116-Q147 HydrophobicContact CG1-CB 4.02Å; I116-Q147 HydrophobicContact CG2-CB 3.96Å; Y143-Q147 HydrophobicContact CD1-CG 4.11Å; Y143-Q147 HydrophobicContact CE1-CG 3.72Å; Y143-Q147 HydrophobicContact CE2-CG 4.31Å; Y143-Q147 WeakPolarHBondContact O-CG 3.49Å; Y143-Q147 PolarHBondContact O-N 2.98Å; F144-Q147 PolarHBondContact O-N 2.82Å; Q147-K150 PolarHBondContact O-N 3.42Å; Q147-R151 WeakPolarHBondContact O-CB 3.43Å; Q147-R151 VanDerWaalsContact O-CG 3.26Å; Q147-R151 WeakPolarHBondContact O-CG 3.46Å; Q147-R151 PolarHBondContact O-N 2.81Å; Q147-D252 PolarHBondContact NE2-OD2 3.13Å
148	M	98.4	Very high	97.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.7	-45.2	173.6	-72.5	167.8	63.7	0	0	111.4	I50 I116 K119 L120 L123 F144 T145 L146 K150 R151 V152 L155	I50-M148 HydrophobicContact CD1-CE 4.18Å; I50-M148 HydrophobicContact CD1-SD 3.57Å; I50-M148 VanDerWaalsContact CD1-SD 3.57Å; I116-M148 HydrophobicContact CG2-CG 4.19Å; K119-M148 HydrophobicContact CB-CE 4.18Å; K119-M148 HydrophobicContact CB-SD 3.76Å; K119-M148 HydrophobicContact CG-SD 4.49Å; L120-M148 HydrophobicContact CD2-CB 3.88Å; L120-M148 HydrophobicContact CD2-CE 4.13Å; L120-M148 HydrophobicContact CD2-CG 3.74Å; L120-M148 HydrophobicContact CG-CG 3.94Å; L123-M148 HydrophobicContact CD1-CE 3.43Å; L123-M148 VanDerWaalsContact CD1-CE 3.43Å; L123-M148 HydrophobicContact CG-CE 4.46Å; F144-M148 WeakPolarHBondContact O-CB 3.26Å; F144-M148 WeakPolarHBondContact O-CG 3.42Å; F144-M148 PolarHBondContact O-N 3.08Å; T145-M148 PolarHBondContact O-N 2.94Å; L146-M148 VanDerWaalsContact C-N 3.33Å; L146-M148 PolarHBondContact O-N 3.04Å; M148-K150 VanDerWaalsContact C-N 3.33Å; M148-K150 PolarHBondContact O-N 2.75Å; M148-R151 PolarHBondContact O-N 2.8Å; M148-V152 PolarHBondContact O-N 2.92Å; M148-L155 HydrophobicContact CB-CD1 4.34Å; M148-L155 HydrophobicContact CE-CD1 4.46Å
149	L	98	Very high	97	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-60.9	-42.4	176.3	-72.3	175.5	0	0	0	111.8	T145 L146 V152 V157 H259 L263	T145-L149 WeakPolarHBondContact O-CG 3.38Å; T145-L149 PolarHBondContact O-N 2.9Å; T145-L149 VanDerWaalsContact O-N 3.09Å; L146-L149 PolarHBondContact O-N 2.81Å; L149-V152 CarbonylContact O-C 3.56Å; L149-V157 HydrophobicContact CD2-CB 3.94Å; L149-V157 HydrophobicContact CD2-CG1 4.25Å; L149-V157 HydrophobicContact CD2-CG2 3.67Å; L149-H259 HydrophobicContact CD1-CB 4.47Å; L149-L263 HydrophobicContact CD1-CD2 3.89Å
150	K	97.7	Very high	97	Very high	106 Å²	106	33.7 Å²	33.7	46%	0.461	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-44.5	176.6	-175.1	179.7	-166.8	162.8	0	113.2	L146 Q147 M148 D252 T255	L146-K150 PolarHBondContact O-N 2.87Å; Q147-K150 PolarHBondContact O-N 3.42Å; M148-K150 VanDerWaalsContact C-N 3.33Å; M148-K150 PolarHBondContact O-N 2.75Å; K150-D252 WeakPolarHBondContact CD-OD2 3.39Å; K150-D252 IonicContact NZ-OD1 3.14Å; K150-D252 IonicContact NZ-OD2 2.72Å; K150-D252 PolarHBondContact NZ-OD2 3.18Å; K150-T255 HydrophobicContact CB-CG2 3.89Å; K150-T255 WeakPolarHBondContact CD-OG1 3.39Å
151	R	97.1	Very high	97	Very high	86 Å²	86	33.7 Å²	33.7	33%	0.325	16%	0.162	S	C	.	.	H	α-helix	trans	-81.3	-31.3	-173.8	-68.9	175.4	-164	-160.5	0	113.2	N113 E117 L120 Q147 M148	N113-R151 PolarHBondContact OD1-NH1 2.87Å; N113-R151 PolarHBondContact OD1-NH2 3.45Å; E117-R151 WeakPolarHBondContact OE1-CD 3.4Å; E117-R151 IonicContact OE1-CZ 2.68Å; E117-R151 IonicContact OE1-NE 3.74Å; E117-R151 IonicContact OE1-NH1 2.96Å; E117-R151 PolarHBondContact OE1-NH1 2.91Å; L120-R151 HydrophobicContact CD1-CB 4.22Å; Q147-R151 WeakPolarHBondContact O-CB 3.43Å; Q147-R151 VanDerWaalsContact O-CG 3.26Å; Q147-R151 WeakPolarHBondContact O-CG 3.46Å; Q147-R151 PolarHBondContact O-N 2.81Å; M148-R151 PolarHBondContact O-N 2.8Å
152	V	95.4	Very high	97	Very high	24 Å²	24	33.7 Å²	33.7	15%	0.145	16%	0.162	C	C	.	.			trans	-133	74.7	-176.5	-166.8	0	0	0	0	108.9	L120 M148 L149 E154 L155	L120-V152 HydrophobicContact CD1-CG2 3.86Å; L120-V152 HydrophobicContact CD2-CB 4.24Å; L120-V152 HydrophobicContact CD2-CG2 3.71Å; L120-V152 HydrophobicContact CG-CG2 4.37Å; M148-V152 PolarHBondContact O-N 2.92Å; L149-V152 CarbonylContact O-C 3.56Å; V152-E154 HydrophobicContact CG1-CB 4.37Å; V152-E154 PolarHBondContact O-N 3.13Å; V152-E154 VanDerWaalsContact O-N 3.11Å; V152-L155 HydrophobicContact CB-CD1 4.12Å; V152-L155 HydrophobicContact CB-CG 3.95Å; V152-L155 HydrophobicContact CG1-CD2 4.38Å; V152-L155 HydrophobicContact CG1-CG 3.82Å; V152-L155 WeakPolarHBondContact O-CB 3.4Å; V152-L155 WeakPolarHBondContact O-CG 3.36Å; V152-L155 PolarHBondContact O-N 3.01Å; V152-L155 VanDerWaalsContact O-N 3.07Å
153	P	89.9	Confident	97	Very high	67 Å²	67	33.8 Å²	33.8	44%	0.435	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-20.6	179.4	25.9	-35	0	0	0	112.6	L155	P153-L155 PolarHBondContact O-N 2.87Å
154	E	91.3	Very high	97	Very high	161 Å²	161	32.4 Å²	32.4	75%	0.752	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.1	176.2	-41.5	-64.8	-172.6	0	0	113.8	V152 L156	V152-E154 HydrophobicContact CG1-CB 4.37Å; V152-E154 PolarHBondContact O-N 3.13Å; V152-E154 VanDerWaalsContact O-N 3.11Å; E154-L156 PolarHBondContact O-N 2.87Å
155	L	94	Very high	96.9	Very high	29 Å²	29	32.4 Å²	32.4	15%	0.152	16%	0.157	C	C	.	.	S	Bend	trans	-61.2	125.1	174.9	-73.6	174.2	0	0	0	109.5	L120 L123 L133 M148 V152 P153 V157	L120-L155 HydrophobicContact CD2-CD1 3.95Å; L123-L155 HydrophobicContact CD1-CD1 4.41Å; L123-L155 HydrophobicContact CD1-CD2 4.09Å; L133-L155 HydrophobicContact CD1-CD2 4.09Å; M148-L155 HydrophobicContact CB-CD1 4.34Å; M148-L155 HydrophobicContact CE-CD1 4.46Å; V152-L155 HydrophobicContact CB-CD1 4.12Å; V152-L155 HydrophobicContact CB-CG 3.95Å; V152-L155 HydrophobicContact CG1-CD2 4.38Å; V152-L155 HydrophobicContact CG1-CG 3.82Å; V152-L155 WeakPolarHBondContact O-CB 3.4Å; V152-L155 WeakPolarHBondContact O-CG 3.36Å; V152-L155 PolarHBondContact O-N 3.01Å; V152-L155 VanDerWaalsContact O-N 3.07Å; P153-L155 PolarHBondContact O-N 2.87Å; L155-V157 HydrophobicContact CB-CG2 3.87Å; L155-V157 PolarHBondContact O-N 2.84Å
156	L	95.8	Very high	96.9	Very high	82 Å²	82	32.5 Å²	32.5	43%	0.429	16%	0.157	S	C	.	.			trans	-74.8	55.7	-178.8	-60.4	-177.7	0	0	0	112.5	K129 K132 L133 E154 I158	K129-L156 WeakPolarHBondContact O-CD1 3.48Å; K132-L156 CarbonylContact C-O 3.59Å; K132-L156 WeakPolarHBondContact CA-O 3.45Å; L133-L156 PolarHBondContact N-O 3.46Å; E154-L156 PolarHBondContact O-N 2.87Å; L156-I158 PolarHBondContact O-N 3.42Å
157	V	97.2	Very high	96.9	Very high	13 Å²	13	32.5 Å²	32.5	8%	0.079	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.9	-179.9	-176.9	0	0	0	0	109.8	L133 L135 L149 L155 R159 A160 K262	L133-V157 HydrophobicContact CB-CG2 4.16Å; L133-V157 HydrophobicContact CD1-CG2 4.35Å; L133-V157 WeakPolarHBondContact O-CA 3.14Å; L135-V157 HydrophobicContact CD1-CG1 4.17Å; L135-V157 HydrophobicContact CD1-CG2 3.63Å; L135-V157 HydrophobicContact CG-CG1 4.09Å; L135-V157 HydrophobicContact CG-CG2 4Å; L149-V157 HydrophobicContact CD2-CB 3.94Å; L149-V157 HydrophobicContact CD2-CG1 4.25Å; L149-V157 HydrophobicContact CD2-CG2 3.67Å; L155-V157 HydrophobicContact CB-CG2 3.87Å; L155-V157 PolarHBondContact O-N 2.84Å; V157-R159 WeakPolarHBondContact CG1-O 3.34Å; V157-A160 HydrophobicContact CG1-CB 4.14Å; V157-K262 HydrophobicContact CB-CD 4.41Å; V157-K262 HydrophobicContact CG1-CD 4.36Å
158	I	96.4	Very high	96.9	Very high	46 Å²	46	32.3 Å²	32.3	24%	0.236	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	-28.9	176.8	63.4	163.5	0	0	0	112.2	L45 K132 L133 V134 L156 M325	L45-I158 HydrophobicContact CD1-CD1 3.42Å; L45-I158 VanDerWaalsContact CD1-CD1 3.42Å; L45-I158 HydrophobicContact CD1-CG1 3.91Å; L45-I158 HydrophobicContact CD2-CD1 4.46Å; K132-I158 HydrophobicContact CB-CG2 4.1Å; K132-I158 HydrophobicContact CD-CG2 4.07Å; K132-I158 HydrophobicContact CG-CG2 4.15Å; L133-I158 WeakPolarHBondContact O-CG1 3.5Å; L133-I158 PolarHBondContact O-N 3.08Å; V134-I158 HydrophobicContact CG2-CD1 4.01Å; V134-I158 HydrophobicContact CG2-CG1 3.88Å; L156-I158 PolarHBondContact O-N 3.42Å; I158-M325 HydrophobicContact CD1-SD 3.78Å
159	R	97.6	Very high	96.9	Very high	40 Å²	40	34.7 Å²	34.7	15%	0.151	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	142.1	179.5	-172.7	65.5	64.3	-160.8	-5.2	109.4	V134 L135 V157 F161 C261 K262 L318 D321	V134-R159 VanDerWaalsContact CA-O 3.31Å; V134-R159 WeakPolarHBondContact CA-O 3.42Å; V134-R159 HydrophobicContact CG2-CB 4.4Å; L135-R159 PolarHBondContact N-O 3.3Å; V157-R159 WeakPolarHBondContact CG1-O 3.34Å; R159-F161 HydrophobicContact CB-CE2 4.37Å; R159-F161 HydrophobicContact CG-CD2 4.08Å; R159-F161 HydrophobicContact CG-CE1 4.14Å; R159-F161 HydrophobicContact CG-CE2 3.44Å; R159-F161 VanDerWaalsContact CG-CE2 3.44Å; R159-F161 HydrophobicContact CG-CZ 3.48Å; R159-F161 VanDerWaalsContact CG-CZ 3.48Å; R159-C261 PolarHBondContact NH1-O 3.11Å; R159-K262 CarbonylContact C-O 3.48Å; R159-K262 WeakPolarHBondContact CA-O 3.26Å; R159-K262 WeakPolarHBondContact CD-O 3.47Å; R159-L318 HydrophobicContact CB-CD2 4.3Å; R159-L318 HydrophobicContact CG-CD2 4.27Å; R159-D321 IonicContact CZ-OD1 3.32Å; R159-D321 IonicContact CZ-OD2 3.02Å; R159-D321 IonicContact NE-OD1 3.31Å; R159-D321 IonicContact NE-OD2 3.76Å; R159-D321 PolarHBondContact NE-OD2 3.03Å; R159-D321 VanDerWaalsContact NH2-CG 3.33Å; R159-D321 IonicContact NH2-OD1 3.06Å; R159-D321 PolarHBondContact NH2-OD1 2.94Å; R159-D321 IonicContact NH2-OD2 3.53Å; R159-D321 PolarHBondContact NH2-OD2 2.94Å
160	A	98.5	Very high	96.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	121.3	172	0	0	0	0	0	110.2	L135 T145 V157 K262 L263 T264	L135-A160 HydrophobicContact CB-CB 4.1Å; L135-A160 CarbonylContact O-C 3.43Å; L135-A160 VanDerWaalsContact O-CA 3.26Å; L135-A160 WeakPolarHBondContact O-CA 3.13Å; T145-A160 HydrophobicContact CG2-CB 3.9Å; V157-A160 HydrophobicContact CG1-CB 4.14Å; A160-K262 PolarHBondContact N-O 2.9Å; A160-L263 HydrophobicContact CB-CD2 3.9Å; A160-T264 PolarHBondContact O-N 3.24Å
161	F	98.7	Very high	96.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	119.3	176.3	-63.6	-78.5	0	0	0	109.6	V134 L135 I136 G137 R159 L163 T264 Y266 I314 L318	V134-F161 HydrophobicContact CG1-CD2 3.91Å; V134-F161 HydrophobicContact CG1-CE2 3.84Å; L135-F161 PolarHBondContact O-N 3.13Å; I136-F161 WeakPolarHBondContact CA-O 3.31Å; I136-F161 HydrophobicContact CG1-CB 4.38Å; I136-F161 HydrophobicContact CG1-CD2 4.13Å; I136-F161 HydrophobicContact CG2-CB 4.5Å; G137-F161 PolarHBondContact N-O 2.84Å; R159-F161 HydrophobicContact CB-CE2 4.37Å; R159-F161 HydrophobicContact CG-CD2 4.08Å; R159-F161 HydrophobicContact CG-CE1 4.14Å; R159-F161 HydrophobicContact CG-CE2 3.44Å; R159-F161 VanDerWaalsContact CG-CE2 3.44Å; R159-F161 HydrophobicContact CG-CZ 3.48Å; R159-F161 VanDerWaalsContact CG-CZ 3.48Å; F161-L163 HydrophobicContact CB-CD2 4.21Å; F161-T264 WeakPolarHBondContact CA-O 3.45Å; F161-T264 HydrophobicContact CD1-CG2 3.89Å; F161-T264 HydrophobicContact CE1-CG2 4.07Å; F161-Y266 HydrophobicContact CD1-CD2 4.44Å; F161-Y266 AromaticContact CD1-CE2 3.84Å; F161-Y266 HydrophobicContact CD1-CE2 3.84Å; F161-Y266 HydrophobicContact CE1-CE2 4.31Å; F161-I314 HydrophobicContact CD1-CG1 4.39Å; F161-I314 HydrophobicContact CD2-CG2 3.86Å; F161-I314 HydrophobicContact CE2-CG2 3.71Å; F161-I314 HydrophobicContact CG-CG1 4.38Å; F161-I314 HydrophobicContact CG-CG2 4.32Å; F161-I314 HydrophobicContact CZ-CG2 4.06Å; F161-L318 HydrophobicContact CE2-CD1 4.09Å; F161-L318 HydrophobicContact CE2-CD2 3.69Å; F161-L318 HydrophobicContact CE2-CG 3.69Å; F161-L318 HydrophobicContact CZ-CD2 3.94Å; F161-L318 HydrophobicContact CZ-CG 3.78Å
162	L	98.8	Very high	96.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	98.1	176.5	-49.8	-166.5	0	0	0	108.3	S142 T145 L146 P165 L263 T264 F265 Y266	S142-L162 WeakPolarHBondContact OG-CA 3.46Å; T145-L162 HydrophobicContact CG2-CD2 3.68Å; L146-L162 HydrophobicContact CD1-CD1 4.1Å; L146-L162 HydrophobicContact CD2-CD1 3.84Å; L146-L162 HydrophobicContact CG-CD1 3.85Å; L162-P165 HydrophobicContact CB-CB 4.04Å; L162-L263 HydrophobicContact CD1-CD2 4.48Å; L162-T264 PolarHBondContact N-O 3.38Å; L162-F265 HydrophobicContact CB-CD1 4.16Å; L162-F265 HydrophobicContact CD1-CD1 3.88Å; L162-F265 HydrophobicContact CD1-CE1 3.48Å; L162-F265 VanDerWaalsContact CD1-CE1 3.48Å; L162-F265 HydrophobicContact CD1-CZ 3.98Å; L162-F265 HydrophobicContact CG-CD1 4.44Å; L162-F265 HydrophobicContact CG-CE1 4.45Å; L162-Y266 PolarHBondContact O-N 2.86Å
163	L	98.6	Very high	96.9	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	121.1	-173.9	-51.4	178.9	0	0	0	109.9	F63 I136 G137 H138 S139 F161 Y266 F302 V310 I314	F63-L163 HydrophobicContact CZ-CD1 4.09Å; I136-L163 HydrophobicContact CG2-CD1 3.51Å; I136-L163 HydrophobicContact CG2-CG 4.1Å; G137-L163 PolarHBondContact O-N 2.85Å; H138-L163 CarbonylContact C-O 3.33Å; H138-L163 WeakPolarHBondContact CA-O 3.29Å; S139-L163 PolarHBondContact N-O 2.97Å; F161-L163 HydrophobicContact CB-CD2 4.21Å; L163-Y266 HydrophobicContact CD2-CD2 3.59Å; L163-Y266 HydrophobicContact CD2-CE2 4.4Å; L163-Y266 HydrophobicContact CD2-CG 4.1Å; L163-F302 HydrophobicContact CB-CE1 4.22Å; L163-F302 HydrophobicContact CD1-CE1 3.9Å; L163-F302 HydrophobicContact CD1-CZ 3.61Å; L163-V310 HydrophobicContact CD1-CG1 4Å; L163-V310 HydrophobicContact CD2-CG1 4.4Å; L163-I314 HydrophobicContact CD1-CD1 3.79Å; L163-I314 HydrophobicContact CD2-CD1 4.01Å; L163-I314 HydrophobicContact CD2-CG1 4.42Å; L163-I314 HydrophobicContact CG-CD1 4.46Å
164	F	98.1	Very high	97.3	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.022	15%	0.154	C	C	.	.	S	Bend	trans	50.5	59.8	-178	-55.9	-85.9	0	0	0	111	S139 T166 Y266 D271 I298 H300 F302	S139-F164 VanDerWaalsContact CA-O 3.26Å; S139-F164 WeakPolarHBondContact CA-O 3.47Å; S139-F164 PolarHBondContact N-O 3.36Å; F164-T166 PolarHBondContact O-N 2.84Å; F164-Y266 WeakPolarHBondContact CA-O 3.35Å; F164-Y266 PolarHBondContact N-O 2.95Å; F164-D271 WeakPolarHBondContact CB-OD2 3.21Å; F164-D271 HydrophobicContact CD1-CB 4.29Å; F164-D271 WeakPolarHBondContact CD1-OD2 3.44Å; F164-I298 HydrophobicContact CE1-CG2 4.48Å; F164-I298 WeakPolarHBondContact CE1-O 3.49Å; F164-I298 HydrophobicContact CE2-CG2 4.31Å; F164-I298 HydrophobicContact CZ-CB 4.04Å; F164-I298 HydrophobicContact CZ-CG2 3.6Å; F164-H300 PolarHBondContact O-CE1 3.09Å; F164-F302 AromaticContact CD2-CD1 3.61Å; F164-F302 HydrophobicContact CD2-CD1 3.61Å; F164-F302 HydrophobicContact CD2-CE1 4.14Å; F164-F302 HydrophobicContact CE2-CB 3.91Å; F164-F302 AromaticContact CE2-CD1 3.42Å; F164-F302 HydrophobicContact CE2-CD1 3.42Å; F164-F302 VanDerWaalsContact CE2-CD1 3.42Å; F164-F302 HydrophobicContact CE2-CE1 4.2Å; F164-F302 AromaticContact CE2-CG 3.9Å; F164-F302 HydrophobicContact CE2-CG 3.9Å; F164-F302 HydrophobicContact CZ-CB 4.31Å
165	P	98.3	Very high	97.6	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	13%	0.131	C	C	.	.			trans	-77.4	106	-156	31.6	-37.6	0	0	0	113.6	L162 I167 F265 Y266 Y267 C274	L162-P165 HydrophobicContact CB-CB 4.04Å; P165-I167 VanDerWaalsContact C-N 3.3Å; P165-I167 HydrophobicContact CB-CD1 4.47Å; P165-I167 HydrophobicContact CB-CG1 4.45Å; P165-I167 HydrophobicContact CB-CG2 4.03Å; P165-I167 PolarHBondContact O-N 3.19Å; P165-F265 HydrophobicContact CG-CD1 4.33Å; P165-Y266 WeakPolarHBondContact CD-O 3.39Å; P165-Y267 HydrophobicContact CG-CD1 4.18Å; P165-Y267 HydrophobicContact CG-CD2 4.35Å; P165-Y267 HydrophobicContact CG-CE1 3.55Å; P165-Y267 HydrophobicContact CG-CE2 3.77Å; P165-Y267 WeakPolarHBondContact CG-OH 3.45Å; P165-C274 PolarHBondContact O-SG 3.4Å
166	T	97.8	Very high	97.7	Very high	1 Å²	1	24 Å²	24	1%	0.006	12%	0.124	C	C	.	.			trans	-81.9	78	171.8	59.4	0	0	0	0	109.8	S139 I140 F164 M170 V248 W273 C274	S139-T166 PolarHBondContact O-N 2.87Å; S139-T166 PolarHBondContact O-OG1 3.2Å; S139-T166 WeakPolarHBondContact OG-CG2 3.35Å; S139-T166 PolarHBondContact OG-OG1 2.72Å; I140-T166 WeakPolarHBondContact CA-OG1 3.28Å; I140-T166 PolarHBondContact N-OG1 3Å; F164-T166 PolarHBondContact O-N 2.84Å; T166-M170 HydrophobicContact CG2-CE 3.76Å; T166-M170 HydrophobicContact CG2-SD 3.58Å; T166-M170 VanDerWaalsContact CG2-SD 3.58Å; T166-V248 WeakPolarHBondContact O-CG1 3.41Å; T166-W273 HydrophobicContact CG2-CB 4.15Å; T166-C274 VanDerWaalsContact CG2-SG 3.54Å
167	I	98.6	Very high	97.8	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.01	14%	0.135	C	C	.	.			trans	-114.4	-3.3	-174.9	62.8	175.6	0	0	0	113.5	L146 P165 V248 R251 I256 F265 I282	L146-I167 HydrophobicContact CD1-CB 4.16Å; L146-I167 HydrophobicContact CD1-CD1 4.18Å; L146-I167 HydrophobicContact CD1-CG2 3.77Å; P165-I167 VanDerWaalsContact C-N 3.3Å; P165-I167 HydrophobicContact CB-CD1 4.47Å; P165-I167 HydrophobicContact CB-CG1 4.45Å; P165-I167 HydrophobicContact CB-CG2 4.03Å; P165-I167 PolarHBondContact O-N 3.19Å; I167-V248 VanDerWaalsContact C-CG1 3.4Å; I167-R251 HydrophobicContact CD1-CG 3.94Å; I167-R251 HydrophobicContact CG1-CG 4.25Å; I167-I256 HydrophobicContact CD1-CD1 4.14Å; I167-F265 HydrophobicContact CD1-CD1 4.47Å; I167-F265 HydrophobicContact CD1-CE1 3.91Å; I167-I282 HydrophobicContact CD1-CD1 4.37Å
168	E	98.4	Very high	97.8	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.061	16%	0.16	C	C	.	.	S	Bend	trans	-159.8	160.7	-178.7	59.5	175	132	0	0	111.2	M170 V248 R251 Y278	E168-M170 PolarHBondContact O-N 3.45Å; E168-V248 CarbonylContact C-O 3.52Å; E168-R251 HydrophobicContact CB-CB 3.86Å; E168-R251 HydrophobicContact CG-CB 4.33Å; E168-R251 WeakPolarHBondContact OE1-CD 3.46Å; E168-R251 IonicContact OE1-CZ 2.83Å; E168-R251 IonicContact OE1-NE 2.77Å; E168-R251 IonicContact OE1-NH1 3.82Å; E168-R251 PolarHBondContact OE1-NH1 3.47Å; E168-Y278 HydrophobicContact CG-CD2 4.13Å; E168-Y278 HydrophobicContact CG-CE2 4.41Å
169	R	98.1	Very high	97.7	Very high	51 Å²	51	32.1 Å²	32.1	19%	0.192	16%	0.155	C	C	.	.			trans	45.3	40.3	167.6	-66.6	177.8	-77.7	175.1	-3.7	113.7	S171 E172 S173 V248 V249 Y278 D281	R169-S171 PolarHBondContact O-N 3.39Å; R169-E172 HydrophobicContact CB-CB 4.2Å; R169-E172 PolarHBondContact O-N 3Å; R169-E172 VanDerWaalsContact O-N 3.11Å; R169-S173 PolarHBondContact O-N 3.03Å; R169-V248 PolarHBondContact N-O 3.02Å; R169-V248 VanDerWaalsContact N-O 3.16Å; R169-V249 PolarHBondContact N-O 3.41Å; R169-Y278 HydrophobicContact CB-CE1 4.27Å; R169-Y278 HydrophobicContact CB-CE2 3.93Å; R169-Y278 WeakPolarHBondContact CB-OH 3.5Å; R169-Y278 VanDerWaalsContact CZ-CD1 3.46Å; R169-Y278 PolarHBondContact O-OH 3.39Å; R169-D281 IonicContact CZ-OD2 3.7Å; R169-D281 VanDerWaalsContact CZ-OD2 3.27Å; R169-D281 IonicContact NH1-OD2 2.69Å; R169-D281 PolarHBondContact NH1-OD2 3.09Å; R169-D281 IonicContact NH2-OD2 3Å; R169-D281 PolarHBondContact NH2-OD2 3.43Å
170	M	97	Very high	97.7	Very high	5 Å²	5	31 Å²	31	3%	0.025	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-63.2	-46.4	-169.2	-172.7	57.8	173.9	0	0	111.9	T166 E168 E172 S173 G176 E244 M245 V248 W273	T166-M170 HydrophobicContact CG2-CE 3.76Å; T166-M170 HydrophobicContact CG2-SD 3.58Å; T166-M170 VanDerWaalsContact CG2-SD 3.58Å; E168-M170 PolarHBondContact O-N 3.45Å; M170-E172 VanDerWaalsContact C-N 3.25Å; M170-E172 PolarHBondContact O-N 2.69Å; M170-S173 PolarHBondContact O-N 3.24Å; M170-S173 PolarHBondContact O-OG 3.22Å; M170-G176 WeakPolarHBondContact O-CA 3.18Å; M170-E244 HydrophobicContact CG-CB 4.28Å; M170-M245 HydrophobicContact CB-SD 4.49Å; M170-M245 HydrophobicContact CE-CE 4Å; M170-M245 HydrophobicContact CG-CE 4Å; M170-M245 HydrophobicContact CG-SD 3.81Å; M170-V248 HydrophobicContact CB-CB 4.07Å; M170-V248 HydrophobicContact CB-CG1 4.36Å; M170-V248 WeakPolarHBondContact CB-O 3.45Å; M170-V248 PolarHBondContact N-O 3.44Å; M170-W273 HydrophobicContact CE-CD2 4.11Å; M170-W273 HydrophobicContact CE-CE3 3.41Å; M170-W273 VanDerWaalsContact CE-CE3 3.41Å; M170-W273 HydrophobicContact CE-CZ3 3.76Å; M170-W273 HydrophobicContact SD-CE3 4.12Å
171	S	97.2	Very high	97.5	Very high	34 Å²	34	32.5 Å²	32.5	24%	0.238	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-70.4	-17.8	177	49.4	0	0	0	0	114.1	R169 G176 R177 T180 M245	R169-S171 PolarHBondContact O-N 3.39Å; S171-G176 CarbonylContact O-C 3.59Å; S171-R177 WeakPolarHBondContact O-CG 3.14Å; S171-R177 PolarHBondContact O-N 2.98Å; S171-T180 WeakPolarHBondContact CB-OG1 3.42Å; S171-M245 WeakPolarHBondContact CB-O 3.34Å; S171-M245 PolarHBondContact OG-O 3.25Å; S171-M245 VanDerWaalsContact OG-O 3.06Å
172	E	97.8	Very high	97.2	Very high	94 Å²	94	37.2 Å²	37.2	44%	0.439	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-88.3	-16.3	179.1	-60.8	179.3	-155.3	0	0	113.2	R169 M170 R177	R169-E172 HydrophobicContact CB-CB 4.2Å; R169-E172 PolarHBondContact O-N 3Å; R169-E172 VanDerWaalsContact O-N 3.11Å; M170-E172 VanDerWaalsContact C-N 3.25Å; M170-E172 PolarHBondContact O-N 2.69Å; E172-R177 PolarHBondContact O-NE 2.93Å; E172-R177 PolarHBondContact O-NH2 3.36Å
173	S	97.3	Very high	96.9	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-61.3	155.1	176	70	0	0	0	0	111.7	R169 M170 N175 G176 R177 W273 Y278	R169-S173 PolarHBondContact O-N 3.03Å; M170-S173 PolarHBondContact O-N 3.24Å; M170-S173 PolarHBondContact O-OG 3.22Å; S173-N175 VanDerWaalsContact C-N 3.3Å; S173-N175 PolarHBondContact O-N 2.79Å; S173-G176 WeakPolarHBondContact O-CA 3.44Å; S173-G176 PolarHBondContact O-N 3.44Å; S173-G176 WeakPolarHBondContact OG-CA 3.39Å; S173-G176 PolarHBondContact OG-N 3.4Å; S173-R177 WeakPolarHBondContact O-CG 3.18Å; S173-R177 PolarHBondContact O-N 2.82Å; S173-W273 WeakPolarHBondContact CB-O 3.25Å; S173-Y278 PolarHBondContact N-OH 3.15Å
174	P	97.6	Very high	96.7	Very high	65 Å²	65	39.9 Å²	39.9	42%	0.422	20%	0.203	S	C	.	.	H	α-helix	trans	-48.1	-48.4	177.6	-29.7	33	0	0	0	113.9	P272 P275	P174-P272 HydrophobicContact CB-CB 4.26Å; P174-P272 WeakPolarHBondContact CD-O 3.33Å; P174-P275 HydrophobicContact CG-CB 4.46Å
175	N	97.4	Very high	96.4	Very high	52 Å²	52	48.3 Å²	48.3	28%	0.278	24%	0.235	S	C	.	.	H	α-helix	trans	-75.8	-34.4	176.5	-85.5	2	0	0	0	112.7	S173 R177 I178 A179 P272 W273	S173-N175 VanDerWaalsContact C-N 3.3Å; S173-N175 PolarHBondContact O-N 2.79Å; N175-R177 VanDerWaalsContact C-N 3.32Å; N175-R177 PolarHBondContact O-N 3.09Å; N175-I178 PolarHBondContact O-N 3.35Å; N175-I178 VanDerWaalsContact O-N 3.15Å; N175-A179 VanDerWaalsContact O-CB 3.32Å; N175-A179 WeakPolarHBondContact O-CB 3.25Å; N175-A179 PolarHBondContact O-N 3.37Å; N175-P272 HydrophobicContact CB-CB 4.3Å; N175-P272 PolarHBondContact N-O 2.69Å; N175-P272 WeakPolarHBondContact ND2-CG 3.45Å; N175-W273 HydrophobicContact CB-CD2 3.51Å; N175-W273 HydrophobicContact CB-CE3 3.52Å; N175-W273 HydrophobicContact CB-CG 4.22Å; N175-W273 HydrophobicContact CB-CH2 3.7Å; N175-W273 HydrophobicContact CB-CZ2 3.67Å; N175-W273 HydrophobicContact CB-CZ3 3.6Å; N175-W273 VanDerWaalsContact ND2-CE2 3.33Å; N175-W273 PolarHBondContact ND2-NE1 3.27Å; N175-W273 VanDerWaalsContact ND2-NE1 3.17Å
176	G	97.1	Very high	96.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-56.9	-42.6	175.9	0	0	0	0	0	113.2	M170 S171 S173 I178 A179 T180	M170-G176 WeakPolarHBondContact O-CA 3.18Å; S171-G176 CarbonylContact O-C 3.59Å; S173-G176 WeakPolarHBondContact O-CA 3.44Å; S173-G176 PolarHBondContact O-N 3.44Å; S173-G176 WeakPolarHBondContact OG-CA 3.39Å; S173-G176 PolarHBondContact OG-N 3.4Å; G176-I178 PolarHBondContact O-N 3.49Å; G176-A179 PolarHBondContact O-N 2.87Å; G176-T180 VanDerWaalsContact O-CB 3.26Å; G176-T180 WeakPolarHBondContact O-CB 3.42Å; G176-T180 PolarHBondContact O-N 2.98Å; G176-T180 PolarHBondContact O-OG1 3.08Å
177	R	97.4	Very high	95.8	Very high	175 Å²	175	57.4 Å²	57.4	66%	0.66	27%	0.272	S	S	*	.	H	α-helix	trans	-61.9	-33	177.7	-68.4	177.5	-169.4	-171.5	0.5	112.8	S171 E172 S173 N175 P181	S171-R177 WeakPolarHBondContact O-CG 3.14Å; S171-R177 PolarHBondContact O-N 2.98Å; E172-R177 PolarHBondContact O-NE 2.93Å; E172-R177 PolarHBondContact O-NH2 3.36Å; S173-R177 WeakPolarHBondContact O-CG 3.18Å; S173-R177 PolarHBondContact O-N 2.82Å; N175-R177 VanDerWaalsContact C-N 3.32Å; N175-R177 PolarHBondContact O-N 3.09Å; R177-P181 WeakPolarHBondContact O-CD 3.49Å
178	I	96.8	Very high	95.4	Very high	120 Å²	120	64.3 Å²	64.3	62%	0.615	30%	0.299	S	S	*	.	H	α-helix	trans	-81.9	-40.6	178.5	-58.5	170.8	0	0	0	110.7	N175 G176 P181	N175-I178 PolarHBondContact O-N 3.35Å; N175-I178 VanDerWaalsContact O-N 3.15Å; G176-I178 PolarHBondContact O-N 3.49Å; I178-P181 WeakPolarHBondContact O-CD 3.13Å
179	A	95.1	Very high	95.1	Very high	16 Å²	16	67.9 Å²	67.9	13%	0.132	32%	0.322	C	S	.	.	H	α-helix	trans	-76.9	-33.4	-175.9	0	0	0	0	0	113.1	N175 G176 L182 L183 M245 W273	N175-A179 VanDerWaalsContact O-CB 3.32Å; N175-A179 WeakPolarHBondContact O-CB 3.25Å; N175-A179 PolarHBondContact O-N 3.37Å; G176-A179 PolarHBondContact O-N 2.87Å; A179-L182 WeakPolarHBondContact O-CB 3.5Å; A179-L182 PolarHBondContact O-N 2.98Å; A179-L183 HydrophobicContact CB-CD1 4.01Å; A179-L183 WeakPolarHBondContact O-CG 3.45Å; A179-L183 PolarHBondContact O-N 2.74Å; A179-M245 HydrophobicContact CB-CE 4.1Å; A179-W273 HydrophobicContact CB-CH2 3.85Å; A179-W273 HydrophobicContact CB-CZ3 4.26Å
180	T	96.3	Very high	94.6	Very high	17 Å²	17	69 Å²	69	10%	0.104	33%	0.331	C	S	.	.	H	α-helix	trans	-55.1	-48.1	-175.2	-63.7	0	0	0	0	113.1	S171 G176 L182 L183 C184 M245	S171-T180 WeakPolarHBondContact CB-OG1 3.42Å; G176-T180 VanDerWaalsContact O-CB 3.26Å; G176-T180 WeakPolarHBondContact O-CB 3.42Å; G176-T180 PolarHBondContact O-N 2.98Å; G176-T180 PolarHBondContact O-OG1 3.08Å; T180-L182 VanDerWaalsContact C-N 3.28Å; T180-L182 PolarHBondContact O-N 3.45Å; T180-L183 PolarHBondContact O-N 3.18Å; T180-C184 HydrophobicContact CG2-CB 4.36Å; T180-C184 VanDerWaalsContact O-CB 3.24Å; T180-C184 WeakPolarHBondContact O-CB 3.33Å; T180-C184 PolarHBondContact O-N 3.4Å; T180-M245 HydrophobicContact CG2-CB 4.45Å; T180-M245 WeakPolarHBondContact OG1-CG 3.31Å; T180-M245 PolarHBondContact OG1-SD 3.43Å
181	P	94.4	Very high	94.3	Very high	30 Å²	30	71.4 Å²	71.4	20%	0.195	34%	0.34	C	S	.	.	I	π-helix	trans	-56.8	-41.6	175.8	-26.3	34.8	0	0	0	113	R177 I178 W185 F186	R177-P181 WeakPolarHBondContact O-CD 3.49Å; I178-P181 WeakPolarHBondContact O-CD 3.13Å; P181-W185 HydrophobicContact CB-CD2 4.34Å; P181-W185 HydrophobicContact CB-CE3 3.61Å; P181-W185 HydrophobicContact CB-CZ3 3.87Å; P181-W185 HydrophobicContact CG-CE3 4.01Å; P181-W185 HydrophobicContact CG-CH2 4.31Å; P181-W185 HydrophobicContact CG-CZ3 3.75Å; P181-W185 WeakPolarHBondContact O-CB 3.35Å; P181-W185 PolarHBondContact O-N 3.05Å; P181-W185 VanDerWaalsContact O-N 3.1Å; P181-F186 HydrophobicContact CB-CD2 4.35Å; P181-F186 HydrophobicContact CB-CE2 4.4Å; P181-F186 VanDerWaalsContact O-CD2 3.28Å; P181-F186 WeakPolarHBondContact O-CD2 3.21Å; P181-F186 PolarHBondContact O-N 3.04Å
182	L	92.7	Very high	94.1	Very high	99 Å²	99	73.9 Å²	73.9	52%	0.518	35%	0.354	S	S	.	.	I	π-helix	trans	-69.9	-44.8	-178.2	-64.9	174.9	0	0	0	112.1	A179 T180 F186 R187	A179-L182 WeakPolarHBondContact O-CB 3.5Å; A179-L182 PolarHBondContact O-N 2.98Å; T180-L182 VanDerWaalsContact C-N 3.28Å; T180-L182 PolarHBondContact O-N 3.45Å; L182-F186 CarbonylContact O-C 3.4Å; L182-R187 PolarHBondContact O-N 3.27Å
183	L	93.6	Very high	93.7	Very high	32 Å²	32	72.3 Å²	72.3	17%	0.168	35%	0.351	C	S	.	.	I	π-helix	trans	-83.5	-28.2	-173.6	-63.5	177.6	0	0	0	113.6	A179 T180 R187 L190 A238 M245	A179-L183 HydrophobicContact CB-CD1 4.01Å; A179-L183 WeakPolarHBondContact O-CG 3.45Å; A179-L183 PolarHBondContact O-N 2.74Å; T180-L183 PolarHBondContact O-N 3.18Å; L183-R187 VanDerWaalsContact O-CB 3.31Å; L183-R187 WeakPolarHBondContact O-CB 3.16Å; L183-L190 HydrophobicContact CD2-CD2 4.27Å; L183-A238 HydrophobicContact CD2-CB 3.9Å; L183-M245 HydrophobicContact CD1-CE 4.04Å
184	C	94	Very high	93.3	Very high	26 Å²	26	73.2 Å²	73.2	18%	0.176	36%	0.36	C	S	.	.	I	π-helix	trans	-103.8	-51	-176.6	-56.5	0	0	0	0	111.7	T180 G242	T180-C184 HydrophobicContact CG2-CB 4.36Å; T180-C184 VanDerWaalsContact O-CB 3.24Å; T180-C184 WeakPolarHBondContact O-CB 3.33Å; T180-C184 PolarHBondContact O-N 3.4Å; C184-G242 PolarHBondContact SG-O 2.94Å
185	W	92.1	Very high	93	Very high	181 Å²	181	76.2 Å²	76.2	69%	0.686	36%	0.364	S	S	*	.	I	π-helix	trans	-89.6	-42.6	-170.6	-50.1	-23	0	0	0	112.3	P181	P181-W185 HydrophobicContact CB-CD2 4.34Å; P181-W185 HydrophobicContact CB-CE3 3.61Å; P181-W185 HydrophobicContact CB-CZ3 3.87Å; P181-W185 HydrophobicContact CG-CE3 4.01Å; P181-W185 HydrophobicContact CG-CH2 4.31Å; P181-W185 HydrophobicContact CG-CZ3 3.75Å; P181-W185 WeakPolarHBondContact O-CB 3.35Å; P181-W185 PolarHBondContact O-N 3.05Å; P181-W185 VanDerWaalsContact O-N 3.1Å
186	F	91.8	Very high	92.7	Very high	114 Å²	114	79.1 Å²	79.1	50%	0.5	38%	0.379	S	S	.	.	S	Bend	trans	-100.3	17.2	-178.2	-60.3	-64.9	0	0	0	113.7	P181 L182 Y188 V189 L190	P181-F186 HydrophobicContact CB-CD2 4.35Å; P181-F186 HydrophobicContact CB-CE2 4.4Å; P181-F186 VanDerWaalsContact O-CD2 3.28Å; P181-F186 WeakPolarHBondContact O-CD2 3.21Å; P181-F186 PolarHBondContact O-N 3.04Å; L182-F186 CarbonylContact O-C 3.4Å; F186-Y188 VanDerWaalsContact C-N 3.3Å; F186-Y188 PolarHBondContact O-N 3.2Å; F186-V189 HydrophobicContact CB-CB 4.49Å; F186-V189 WeakPolarHBondContact O-CA 3.23Å; F186-V189 WeakPolarHBondContact O-CB 3.21Å; F186-V189 PolarHBondContact O-N 3.48Å; F186-L190 PolarHBondContact O-N 3Å
187	R	90.4	Very high	92.3	Very high	79 Å²	79	85.3 Å²	85.3	30%	0.298	41%	0.411	S	S	.	.	H	α-helix	trans	-55.1	-41	-174.3	74.5	-175.5	-176.7	175.4	-1.8	114	L182 L183 V189 L190 Y191	L182-R187 PolarHBondContact O-N 3.27Å; L183-R187 VanDerWaalsContact O-CB 3.31Å; L183-R187 WeakPolarHBondContact O-CB 3.16Å; R187-V189 VanDerWaalsContact C-N 3.33Å; R187-V189 PolarHBondContact O-N 3.17Å; R187-L190 WeakPolarHBondContact O-CB 3.36Å; R187-L190 PolarHBondContact O-N 3.13Å; R187-Y191 HydrophobicContact CB-CE1 4.35Å; R187-Y191 WeakPolarHBondContact O-CD1 3.38Å; R187-Y191 PolarHBondContact O-N 3.02Å
188	Y	90.8	Very high	91.9	Very high	148 Å²	148	78.5 Å²	78.5	58%	0.58	39%	0.388	S	S	*	.	H	α-helix	trans	-69.1	-34.4	179.1	-64	-66.4	0	0	0	111.9	F186 Y191 V192	F186-Y188 VanDerWaalsContact C-N 3.3Å; F186-Y188 PolarHBondContact O-N 3.2Å; Y188-Y191 HydrophobicContact CD1-CD2 4.34Å; Y188-Y191 PolarHBondContact O-N 3.17Å; Y188-V192 WeakPolarHBondContact O-CB 3.47Å; Y188-V192 VanDerWaalsContact O-CG2 3.26Å; Y188-V192 WeakPolarHBondContact O-CG2 3.41Å; Y188-V192 PolarHBondContact O-N 2.87Å
189	V	91.4	Very high	91.5	Very high	88 Å²	88	78.4 Å²	78.4	53%	0.533	38%	0.383	S	S	.	.	H	α-helix	trans	-64.7	-44.6	173	-179.1	0	0	0	0	109.5	F186 R187 Y191 V192 T193	F186-V189 HydrophobicContact CB-CB 4.49Å; F186-V189 WeakPolarHBondContact O-CA 3.23Å; F186-V189 WeakPolarHBondContact O-CB 3.21Å; F186-V189 PolarHBondContact O-N 3.48Å; R187-V189 VanDerWaalsContact C-N 3.33Å; R187-V189 PolarHBondContact O-N 3.17Å; V189-Y191 VanDerWaalsContact C-N 3.34Å; V189-Y191 PolarHBondContact O-N 2.86Å; V189-V192 PolarHBondContact O-N 2.86Å; V189-T193 HydrophobicContact CG1-CG2 4.13Å; V189-T193 WeakPolarHBondContact O-CB 3.38Å; V189-T193 VanDerWaalsContact O-CG2 3.25Å; V189-T193 WeakPolarHBondContact O-CG2 3.47Å; V189-T193 PolarHBondContact O-N 3.48Å; V189-T193 PolarHBondContact O-OG1 3.27Å
190	L	88.6	Confident	91.3	Very high	74 Å²	74	82.4 Å²	82.4	39%	0.387	41%	0.407	S	S	.	.	H	α-helix	trans	-58.2	-44.5	174.8	-179.8	64.7	0	0	0	111.8	L183 F186 R187 T193 G194 A238	L183-L190 HydrophobicContact CD2-CD2 4.27Å; F186-L190 PolarHBondContact O-N 3Å; R187-L190 WeakPolarHBondContact O-CB 3.36Å; R187-L190 PolarHBondContact O-N 3.13Å; L190-T193 WeakPolarHBondContact CA-OG1 3.42Å; L190-T193 PolarHBondContact O-OG1 3.03Å; L190-T193 VanDerWaalsContact O-OG1 3.11Å; L190-G194 PolarHBondContact O-N 3.45Å; L190-A238 HydrophobicContact CD2-CB 3.76Å
191	Y	91.5	Very high	90.8	Very high	55 Å²	55	82.9 Å²	82.9	22%	0.216	41%	0.411	C	S	.	.	H	α-helix	trans	-66.3	-47.3	-179.6	-61.1	-7.2	0	0	0	111.9	R187 Y188 V189 Y195 A235 A238 Y239	R187-Y191 HydrophobicContact CB-CE1 4.35Å; R187-Y191 WeakPolarHBondContact O-CD1 3.38Å; R187-Y191 PolarHBondContact O-N 3.02Å; Y188-Y191 HydrophobicContact CD1-CD2 4.34Å; Y188-Y191 PolarHBondContact O-N 3.17Å; V189-Y191 VanDerWaalsContact C-N 3.34Å; V189-Y191 PolarHBondContact O-N 2.86Å; Y191-Y195 VanDerWaalsContact O-CB 3.27Å; Y191-Y195 WeakPolarHBondContact O-CB 3.14Å; Y191-Y195 PolarHBondContact O-N 2.73Å; Y191-A235 HydrophobicContact CD1-CB 4.12Å; Y191-A235 HydrophobicContact CE1-CB 4.31Å; Y191-A235 HydrophobicContact CG-CB 4.35Å; Y191-A238 HydrophobicContact CE1-CB 3.77Å; Y191-Y239 WeakPolarHBondContact OH-CA 3.44Å; Y191-Y239 WeakPolarHBondContact OH-CB 2.78Å; Y191-Y239 PolarHBondContact OH-N 3.36Å
192	V	92.2	Very high	90.6	Very high	86 Å²	86	85 Å²	85	52%	0.521	43%	0.425	S	S	.	.	H	α-helix	trans	-64.9	-46.9	-179.6	171	0	0	0	0	110.5	Y188 V189 Y195 L196	Y188-V192 WeakPolarHBondContact O-CB 3.47Å; Y188-V192 VanDerWaalsContact O-CG2 3.26Å; Y188-V192 WeakPolarHBondContact O-CG2 3.41Å; Y188-V192 PolarHBondContact O-N 2.87Å; V189-V192 PolarHBondContact O-N 2.86Å; V192-Y195 PolarHBondContact O-N 2.92Å; V192-L196 HydrophobicContact CG1-CD1 3.76Å; V192-L196 HydrophobicContact CG1-CG 4.31Å; V192-L196 WeakPolarHBondContact O-CB 3.05Å; V192-L196 VanDerWaalsContact O-CG 3.25Å; V192-L196 WeakPolarHBondContact O-CG 3.34Å; V192-L196 PolarHBondContact O-N 3.16Å
193	T	89.2	Confident	90.1	Very high	61 Å²	61	85.7 Å²	85.7	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-45.8	178.8	53.2	0	0	0	0	111.8	V189 L190 Y195 L196 L197	V189-T193 HydrophobicContact CG1-CG2 4.13Å; V189-T193 WeakPolarHBondContact O-CB 3.38Å; V189-T193 VanDerWaalsContact O-CG2 3.25Å; V189-T193 WeakPolarHBondContact O-CG2 3.47Å; V189-T193 PolarHBondContact O-N 3.48Å; V189-T193 PolarHBondContact O-OG1 3.27Å; L190-T193 WeakPolarHBondContact CA-OG1 3.42Å; L190-T193 PolarHBondContact O-OG1 3.03Å; L190-T193 VanDerWaalsContact O-OG1 3.11Å; T193-Y195 VanDerWaalsContact C-N 3.34Å; T193-Y195 PolarHBondContact O-N 3.31Å; T193-L196 PolarHBondContact O-N 2.83Å; T193-L197 WeakPolarHBondContact O-CB 2.99Å; T193-L197 VanDerWaalsContact O-CG 3.24Å; T193-L197 WeakPolarHBondContact O-CG 3.24Å; T193-L197 PolarHBondContact O-N 2.98Å
194	G	88.3	Confident	89.7	Confident	19 Å²	19	93 Å²	93	20%	0.196	46%	0.456	C	S	.	.	H	α-helix	trans	-58.4	-44.9	175.2	0	0	0	0	0	112.3	L190 L197 L198	L190-G194 PolarHBondContact O-N 3.45Å; G194-L197 PolarHBondContact O-N 3.23Å; G194-L198 VanDerWaalsContact O-CB 3.23Å; G194-L198 WeakPolarHBondContact O-CB 3.42Å; G194-L198 WeakPolarHBondContact O-CG 3.37Å; G194-L198 PolarHBondContact O-N 3.09Å
195	Y	91	Very high	89.4	Confident	128 Å²	128	95.7 Å²	95.7	50%	0.502	47%	0.468	S	S	.	.	H	α-helix	trans	-62.2	-50.2	176.5	-175.5	-87.7	0	0	0	112	Y191 V192 T193 L197 K199 P231	Y191-Y195 VanDerWaalsContact O-CB 3.27Å; Y191-Y195 WeakPolarHBondContact O-CB 3.14Å; Y191-Y195 PolarHBondContact O-N 2.73Å; V192-Y195 PolarHBondContact O-N 2.92Å; T193-Y195 VanDerWaalsContact C-N 3.34Å; T193-Y195 PolarHBondContact O-N 3.31Å; Y195-L197 VanDerWaalsContact C-N 3.28Å; Y195-L197 PolarHBondContact O-N 3.39Å; Y195-K199 HydrophobicContact CD1-CB 4.33Å; Y195-K199 HydrophobicContact CD2-CB 4.41Å; Y195-K199 HydrophobicContact CE1-CB 4.2Å; Y195-K199 HydrophobicContact CE1-CG 4.2Å; Y195-K199 HydrophobicContact CE2-CB 4.31Å; Y195-K199 HydrophobicContact CE2-CD 4.35Å; Y195-K199 HydrophobicContact CE2-CG 4.11Å; Y195-K199 HydrophobicContact CG-CB 4.43Å; Y195-K199 WeakPolarHBondContact O-CB 3.47Å; Y195-K199 PolarHBondContact O-N 3.26Å; Y195-P231 HydrophobicContact CD2-CB 4.06Å; Y195-P231 HydrophobicContact CD2-CG 4.43Å
196	L	92.4	Very high	89	Confident	114 Å²	114	87.3 Å²	87.3	60%	0.597	44%	0.436	S	S	*	.	H	α-helix	trans	-64.3	-31.5	-178.1	-70.8	175.3	0	0	0	112.9	V192 T193 P200	V192-L196 HydrophobicContact CG1-CD1 3.76Å; V192-L196 HydrophobicContact CG1-CG 4.31Å; V192-L196 WeakPolarHBondContact O-CB 3.05Å; V192-L196 VanDerWaalsContact O-CG 3.25Å; V192-L196 WeakPolarHBondContact O-CG 3.34Å; V192-L196 PolarHBondContact O-N 3.16Å; T193-L196 PolarHBondContact O-N 2.83Å; L196-P200 WeakPolarHBondContact O-CD 3.4Å; L196-P200 WeakPolarHBondContact O-CG 3.37Å
197	L	89.3	Confident	88.5	Confident	129 Å²	129	84.3 Å²	84.3	68%	0.675	43%	0.429	S	S	*	.	H	α-helix	trans	-82.4	-45.1	178.6	-68.5	173.1	0	0	0	112.5	T193 G194 Y195	T193-L197 WeakPolarHBondContact O-CB 2.99Å; T193-L197 VanDerWaalsContact O-CG 3.24Å; T193-L197 WeakPolarHBondContact O-CG 3.24Å; T193-L197 PolarHBondContact O-N 2.98Å; G194-L197 PolarHBondContact O-N 3.23Å; Y195-L197 VanDerWaalsContact C-N 3.28Å; Y195-L197 PolarHBondContact O-N 3.39Å
198	L	88.5	Confident	88.3	Confident	33 Å²	33	85 Å²	85	17%	0.173	44%	0.439	C	S	.	.	H	α-helix	trans	-90.8	-31.1	-169.3	-62.5	171.4	0	0	0	113.1	G194 C201 L229 P231 L234	G194-L198 VanDerWaalsContact O-CB 3.23Å; G194-L198 WeakPolarHBondContact O-CB 3.42Å; G194-L198 WeakPolarHBondContact O-CG 3.37Å; G194-L198 PolarHBondContact O-N 3.09Å; L198-C201 WeakPolarHBondContact O-CB 3.24Å; L198-C201 PolarHBondContact O-N 3.4Å; L198-L229 HydrophobicContact CD2-CB 4.44Å; L198-P231 HydrophobicContact CB-CG 4.06Å; L198-L234 HydrophobicContact CD1-CD1 3.27Å
199	K	87.9	Confident	87.9	Confident	118 Å²	118	82.5 Å²	82.5	51%	0.513	44%	0.435	S	S	.	.	S	Bend	trans	-64.6	-44.2	-179.5	-170.6	62.1	176.1	176.5	0	114	Y195 C201 P231	Y195-K199 HydrophobicContact CD1-CB 4.33Å; Y195-K199 HydrophobicContact CD2-CB 4.41Å; Y195-K199 HydrophobicContact CE1-CB 4.2Å; Y195-K199 HydrophobicContact CE1-CG 4.2Å; Y195-K199 HydrophobicContact CE2-CB 4.31Å; Y195-K199 HydrophobicContact CE2-CD 4.35Å; Y195-K199 HydrophobicContact CE2-CG 4.11Å; Y195-K199 HydrophobicContact CG-CB 4.43Å; Y195-K199 WeakPolarHBondContact O-CB 3.47Å; Y195-K199 PolarHBondContact O-N 3.26Å; K199-C201 VanDerWaalsContact C-N 3.28Å; K199-P231 HydrophobicContact CB-CG 4.49Å
200	P	90.8	Very high	87.5	Confident	99 Å²	99	78.9 Å²	78.9	64%	0.643	41%	0.412	S	S	*	.	S	Bend	trans	-80.2	-9.2	176.8	32.1	-34.9	0	0	0	113	L196 P202	L196-P200 WeakPolarHBondContact O-CD 3.4Å; L196-P200 WeakPolarHBondContact O-CG 3.37Å; P200-P202 WeakPolarHBondContact O-CD 3.35Å
201	C	86.7	Confident	87.1	Confident	27 Å²	27	83.1 Å²	83.1	18%	0.182	42%	0.423	C	S	.	.	S	Bend	trans	-68.8	123.3	-177.8	-171.5	0	0	0	0	110.8	L198 K199 E203 K206	L198-C201 WeakPolarHBondContact O-CB 3.24Å; L198-C201 PolarHBondContact O-N 3.4Å; K199-C201 VanDerWaalsContact C-N 3.28Å; C201-E203 PolarHBondContact O-N 3.11Å; C201-K206 HydrophobicContact CB-CD 4.44Å; C201-K206 HydrophobicContact CB-CG 4.14Å
202	P	88.8	Confident	86.6	Confident	76 Å²	76	88 Å²	88	49%	0.494	44%	0.441	S	S	.	.			trans	-55	138.2	178.4	-26.2	32.4	0	0	0	113.1	P200 K204 I205 K206	P200-P202 WeakPolarHBondContact O-CD 3.35Å; P202-K204 PolarHBondContact O-N 3.27Å; P202-K204 VanDerWaalsContact O-N 3.1Å; P202-I205 HydrophobicContact CB-CD1 4.35Å; P202-I205 HydrophobicContact CB-CG1 4.25Å; P202-I205 HydrophobicContact CG-CD1 4.03Å; P202-I205 HydrophobicContact CG-CG1 4.47Å; P202-I205 WeakPolarHBondContact O-CA 3.23Å; P202-I205 WeakPolarHBondContact O-CB 3.45Å; P202-I205 PolarHBondContact O-N 3.24Å; P202-K206 PolarHBondContact O-N 3.12Å; P202-K206 VanDerWaalsContact O-N 3.13Å
203	E	83.1	Confident	86	Confident	112 Å²	112	86.5 Å²	86.5	52%	0.523	43%	0.434	S	S	.	.	H	α-helix	trans	-54.1	-35.2	-179.8	-66	-54.2	144.1	0	0	113.4	C201 I205 K206 S207	C201-E203 PolarHBondContact O-N 3.11Å; E203-I205 VanDerWaalsContact C-N 3.28Å; E203-I205 PolarHBondContact O-N 3.5Å; E203-K206 PolarHBondContact O-N 3.39Å; E203-K206 WeakPolarHBondContact OE1-CE 3.35Å; E203-K206 IonicContact OE1-NZ 3.74Å; E203-K206 PolarHBondContact OE1-NZ 2.89Å; E203-K206 WeakPolarHBondContact OE2-CE 3.21Å; E203-K206 IonicContact OE2-NZ 2.79Å; E203-K206 PolarHBondContact OE2-NZ 3.26Å; E203-K206 VanDerWaalsContact OE2-NZ 3.14Å; E203-S207 WeakPolarHBondContact O-CB 3.35Å; E203-S207 PolarHBondContact O-N 3.35Å
204	K	85.4	Confident	85.4	Confident	185 Å²	185	84.7 Å²	84.7	80%	0.804	42%	0.422	S	S	*	.	H	α-helix	trans	-61.9	-36.5	176.5	-64.5	-176.1	-179.6	-179.9	0	112.3	P202 L208	P202-K204 PolarHBondContact O-N 3.27Å; P202-K204 VanDerWaalsContact O-N 3.1Å; K204-L208 WeakPolarHBondContact O-CB 3.24Å; K204-L208 PolarHBondContact O-N 3.18Å
205	I	86.4	Confident	84.9	Confident	84 Å²	84	88 Å²	88	43%	0.431	43%	0.432	S	S	.	.	H	α-helix	trans	-74.5	-47.3	178.5	-60	-177.4	0	0	0	109.6	P202 E203 S207 L208 L209	P202-I205 HydrophobicContact CB-CD1 4.35Å; P202-I205 HydrophobicContact CB-CG1 4.25Å; P202-I205 HydrophobicContact CG-CD1 4.03Å; P202-I205 HydrophobicContact CG-CG1 4.47Å; P202-I205 WeakPolarHBondContact O-CA 3.23Å; P202-I205 WeakPolarHBondContact O-CB 3.45Å; P202-I205 PolarHBondContact O-N 3.24Å; E203-I205 VanDerWaalsContact C-N 3.28Å; E203-I205 PolarHBondContact O-N 3.5Å; I205-S207 VanDerWaalsContact C-N 3.31Å; I205-S207 PolarHBondContact O-N 3.41Å; I205-L208 PolarHBondContact O-N 3Å; I205-L209 HydrophobicContact CG2-CD1 4.08Å; I205-L209 HydrophobicContact CG2-CG 4.38Å; I205-L209 WeakPolarHBondContact O-CG 3.39Å; I205-L209 PolarHBondContact O-N 3.36Å
206	K	83.8	Confident	84.3	Confident	5 Å²	5	88.7 Å²	88.7	2%	0.022	44%	0.444	C	S	.	.	H	α-helix	trans	-55.4	-47.6	174.3	-69.4	-169.3	-67.5	173.6	0	111.2	C201 P202 E203 L208 L209 I210 L229 E230	C201-K206 HydrophobicContact CB-CD 4.44Å; C201-K206 HydrophobicContact CB-CG 4.14Å; P202-K206 PolarHBondContact O-N 3.12Å; P202-K206 VanDerWaalsContact O-N 3.13Å; E203-K206 PolarHBondContact O-N 3.39Å; E203-K206 WeakPolarHBondContact OE1-CE 3.35Å; E203-K206 IonicContact OE1-NZ 3.74Å; E203-K206 PolarHBondContact OE1-NZ 2.89Å; E203-K206 WeakPolarHBondContact OE2-CE 3.21Å; E203-K206 IonicContact OE2-NZ 2.79Å; E203-K206 PolarHBondContact OE2-NZ 3.26Å; E203-K206 VanDerWaalsContact OE2-NZ 3.14Å; K206-L208 PolarHBondContact O-N 3.26Å; K206-L209 PolarHBondContact O-N 3.06Å; K206-I210 WeakPolarHBondContact O-CB 3.39Å; K206-I210 VanDerWaalsContact O-CG1 3.23Å; K206-I210 WeakPolarHBondContact O-CG1 3.48Å; K206-I210 PolarHBondContact O-N 3.44Å; K206-L229 HydrophobicContact CB-CD1 4.1Å; K206-L229 HydrophobicContact CD-CB 4.19Å; K206-L229 HydrophobicContact CG-CB 4.48Å; K206-L229 HydrophobicContact CG-CD1 4.28Å; K206-E230 IonicContact NZ-OE1 2.69Å; K206-E230 PolarHBondContact NZ-OE1 2.83Å
207	S	82.5	Confident	83.3	Confident	50 Å²	50	86.5 Å²	86.5	35%	0.35	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-42.9	177.3	-177.3	0	0	0	0	112.5	E203 I205 I210 R211	E203-S207 WeakPolarHBondContact O-CB 3.35Å; E203-S207 PolarHBondContact O-N 3.35Å; I205-S207 VanDerWaalsContact C-N 3.31Å; I205-S207 PolarHBondContact O-N 3.41Å; S207-I210 PolarHBondContact O-N 2.89Å; S207-R211 WeakPolarHBondContact O-CB 3.4Å; S207-R211 PolarHBondContact O-N 3.46Å
208	L	84.8	Confident	82.4	Confident	94 Å²	94	85.6 Å²	85.6	49%	0.492	43%	0.427	S	S	.	.	H	α-helix	trans	-63.8	-43.4	176.3	-179.2	64.4	0	0	0	112.1	K204 I205 K206 R211 R212	K204-L208 WeakPolarHBondContact O-CB 3.24Å; K204-L208 PolarHBondContact O-N 3.18Å; I205-L208 PolarHBondContact O-N 3Å; K206-L208 PolarHBondContact O-N 3.26Å; L208-R211 PolarHBondContact O-N 2.89Å; L208-R212 WeakPolarHBondContact O-CG 3.5Å; L208-R212 PolarHBondContact O-N 3.26Å
209	L	84	Confident	81.5	Confident	96 Å²	96	84 Å²	84	50%	0.503	42%	0.419	S	S	.	.	H	α-helix	trans	-62.8	-46.4	177.3	-71.8	172.6	0	0	0	111.3	I205 K206 R212 C213 L229	I205-L209 HydrophobicContact CG2-CD1 4.08Å; I205-L209 HydrophobicContact CG2-CG 4.38Å; I205-L209 WeakPolarHBondContact O-CG 3.39Å; I205-L209 PolarHBondContact O-N 3.36Å; K206-L209 PolarHBondContact O-N 3.06Å; L209-R212 PolarHBondContact O-N 2.9Å; L209-C213 VanDerWaalsContact O-CB 3.31Å; L209-C213 WeakPolarHBondContact O-CB 3.42Å; L209-C213 PolarHBondContact O-N 3.44Å; L209-L229 HydrophobicContact CB-CD1 4.23Å
210	I	81.8	Confident	80.2	Confident	11 Å²	11	85 Å²	85	6%	0.056	43%	0.425	C	S	.	.	H	α-helix	trans	-59.7	-49.6	176.6	-69.7	166.5	0	0	0	109.8	K206 S207 R212 C213 L214 P225 L226 L229	K206-I210 WeakPolarHBondContact O-CB 3.39Å; K206-I210 VanDerWaalsContact O-CG1 3.23Å; K206-I210 WeakPolarHBondContact O-CG1 3.48Å; K206-I210 PolarHBondContact O-N 3.44Å; S207-I210 PolarHBondContact O-N 2.89Å; I210-R212 VanDerWaalsContact C-N 3.33Å; I210-R212 PolarHBondContact O-N 2.89Å; I210-C213 WeakPolarHBondContact O-CB 3.21Å; I210-C213 PolarHBondContact O-N 2.86Å; I210-C213 VanDerWaalsContact O-N 3.13Å; I210-L214 HydrophobicContact CG2-CD1 3.8Å; I210-L214 HydrophobicContact CG2-CG 4.25Å; I210-L214 VanDerWaalsContact O-CG 3.29Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.04Å; I210-P225 HydrophobicContact CG2-CG 3.79Å; I210-L226 WeakPolarHBondContact CD1-O 3.38Å; I210-L229 HydrophobicContact CD1-CB 4.22Å; I210-L229 HydrophobicContact CD1-CD1 3.97Å; I210-L229 HydrophobicContact CD1-CG 3.89Å; I210-L229 HydrophobicContact CG1-CD1 3.64Å; I210-L229 HydrophobicContact CG1-CG 3.77Å
211	R	80.5	Confident	78.8	Confident	163 Å²	163	81.8 Å²	81.8	62%	0.615	40%	0.403	S	S	*	.	H	α-helix	trans	-58.4	-45.1	179.7	-169	177.6	-166.6	-156.2	2.6	112	S207 L208 L214 Q215	S207-R211 WeakPolarHBondContact O-CB 3.4Å; S207-R211 PolarHBondContact O-N 3.46Å; L208-R211 PolarHBondContact O-N 2.89Å; R211-L214 PolarHBondContact O-N 2.66Å; R211-Q215 WeakPolarHBondContact O-CB 3.34Å; R211-Q215 VanDerWaalsContact O-CG 3.28Å; R211-Q215 WeakPolarHBondContact O-CG 3.26Å; R211-Q215 PolarHBondContact O-N 2.94Å
212	R	81.3	Confident	77.6	Confident	157 Å²	157	86 Å²	86	59%	0.592	42%	0.42	S	S	*	.	H	α-helix	trans	-63.3	-42.9	175.9	-75.8	-172.6	175.7	-166.5	-0.1	112.1	L208 L209 I210 Q215 L216	L208-R212 WeakPolarHBondContact O-CG 3.5Å; L208-R212 PolarHBondContact O-N 3.26Å; L209-R212 PolarHBondContact O-N 2.9Å; I210-R212 VanDerWaalsContact C-N 3.33Å; I210-R212 PolarHBondContact O-N 2.89Å; R212-Q215 PolarHBondContact O-N 2.86Å; R212-L216 WeakPolarHBondContact O-CG 3.26Å; R212-L216 PolarHBondContact O-N 3.03Å
213	C	79.3	Confident	76.4	Confident	56 Å²	56	83.3 Å²	83.3	38%	0.378	40%	0.401	S	S	.	.	H	α-helix	trans	-61.1	-46.1	178	-168.5	0	0	0	0	111.4	L209 I210 Q215 L216 M217	L209-C213 VanDerWaalsContact O-CB 3.31Å; L209-C213 WeakPolarHBondContact O-CB 3.42Å; L209-C213 PolarHBondContact O-N 3.44Å; I210-C213 WeakPolarHBondContact O-CB 3.21Å; I210-C213 PolarHBondContact O-N 2.86Å; I210-C213 VanDerWaalsContact O-N 3.13Å; C213-Q215 PolarHBondContact O-N 2.64Å; C213-L216 WeakPolarHBondContact O-CB 3.32Å; C213-L216 PolarHBondContact O-N 2.54Å; C213-M217 WeakPolarHBondContact O-CG 3.47Å; C213-M217 PolarHBondContact O-N 3.18Å; C213-M217 VanDerWaalsContact SG-CE 3.56Å
214	L	77.3	Confident	75.3	Confident	22 Å²	22	81.1 Å²	81.1	12%	0.115	40%	0.397	C	S	.	.	H	α-helix	trans	-62.7	-40.3	176.9	-68.3	171.8	0	0	0	112.8	F59 I210 R211 L216 M217 N218 L219 P225	F59-L214 HydrophobicContact CD1-CD2 4.43Å; F59-L214 HydrophobicContact CE1-CD2 3.97Å; I210-L214 HydrophobicContact CG2-CD1 3.8Å; I210-L214 HydrophobicContact CG2-CG 4.25Å; I210-L214 VanDerWaalsContact O-CG 3.29Å; I210-L214 WeakPolarHBondContact O-CG 3.47Å; I210-L214 PolarHBondContact O-N 3.04Å; R211-L214 PolarHBondContact O-N 2.66Å; L214-L216 VanDerWaalsContact C-N 3.34Å; L214-M217 CarbonylContact O-C 3.01Å; L214-M217 PolarHBondContact O-N 3.11Å; L214-N218 PolarHBondContact O-N 3.43Å; L214-L219 HydrophobicContact CD2-CB 3.93Å; L214-L219 PolarHBondContact O-N 2.83Å; L214-P225 VanDerWaalsContact CD1-CD 3.43Å; L214-P225 HydrophobicContact CD1-CG 3.47Å; L214-P225 VanDerWaalsContact CD1-CG 3.47Å; L214-P225 HydrophobicContact CD2-CG 3.84Å; L214-P225 HydrophobicContact CG-CG 4.1Å
215	Q	77.9	Confident	74.2	Confident	89 Å²	89	72.7 Å²	72.7	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-44.3	174.5	-77.4	178.9	-24.3	0	0	111.6	R211 R212 C213 M217 N218 E220	R211-Q215 WeakPolarHBondContact O-CB 3.34Å; R211-Q215 VanDerWaalsContact O-CG 3.28Å; R211-Q215 WeakPolarHBondContact O-CG 3.26Å; R211-Q215 PolarHBondContact O-N 2.94Å; R212-Q215 PolarHBondContact O-N 2.86Å; C213-Q215 PolarHBondContact O-N 2.64Å; Q215-M217 VanDerWaalsContact C-N 3.28Å; Q215-M217 PolarHBondContact O-N 2.71Å; Q215-N218 PolarHBondContact O-N 3.1Å; Q215-E220 HydrophobicContact CG-CG 4.14Å; Q215-E220 VanDerWaalsContact CG-OE1 3.31Å; Q215-E220 WeakPolarHBondContact CG-OE1 3.33Å; Q215-E220 PolarHBondContact NE2-OE1 2.89Å
216	L	77.6	Confident	73	Confident	142 Å²	142	72.2 Å²	72.2	74%	0.743	36%	0.359	S	S	*	.	H	α-helix	trans	-63.8	-35	175.5	-69	171.6	0	0	0	112.3	R212 C213 L214 N218 H305	R212-L216 WeakPolarHBondContact O-CG 3.26Å; R212-L216 PolarHBondContact O-N 3.03Å; C213-L216 WeakPolarHBondContact O-CB 3.32Å; C213-L216 PolarHBondContact O-N 2.54Å; L214-L216 VanDerWaalsContact C-N 3.34Å; L216-N218 VanDerWaalsContact C-N 3.28Å; L216-N218 PolarHBondContact O-N 2.76Å; L216-H305 PolarHBondContact O-CE1 3.03Å; L216-H305 VanDerWaalsContact O-CE1 3.25Å
217	M	71	Confident	72.2	Confident	68 Å²	68	73.1 Å²	73.1	34%	0.335	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.1	177.5	-67.7	179.5	178.4	0	0	113.7	C213 L214 Q215 L219 T304 H305	C213-M217 WeakPolarHBondContact O-CG 3.47Å; C213-M217 PolarHBondContact O-N 3.18Å; C213-M217 VanDerWaalsContact SG-CE 3.56Å; L214-M217 CarbonylContact O-C 3.01Å; L214-M217 PolarHBondContact O-N 3.11Å; Q215-M217 VanDerWaalsContact C-N 3.28Å; Q215-M217 PolarHBondContact O-N 2.71Å; M217-L219 HydrophobicContact CB-CB 4.46Å; M217-L219 HydrophobicContact CB-CD1 4.06Å; M217-L219 HydrophobicContact CB-CG 4.15Å; M217-L219 PolarHBondContact O-N 3.36Å; M217-T304 HydrophobicContact CB-CG2 3.96Å; M217-T304 HydrophobicContact CG-CG2 4.01Å; M217-T304 CarbonylContact O-C 3.54Å; M217-T304 WeakPolarHBondContact O-CA 3.48Å; M217-T304 HydrophobicContact SD-CG2 4.16Å; M217-H305 VanDerWaalsContact C-CE1 3.46Å
218	N	71.4	Confident	71.9	Confident	111 Å²	111	72.2 Å²	72.2	59%	0.594	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	33.2	-174	-159.2	43	0	0	0	114	L214 Q215 L216	L214-N218 PolarHBondContact O-N 3.43Å; Q215-N218 PolarHBondContact O-N 3.1Å; L216-N218 VanDerWaalsContact C-N 3.28Å; L216-N218 PolarHBondContact O-N 2.76Å
219	L	69.1	Low	71.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.343	C	S	.	.			trans	-109.9	51.7	179.3	-68.8	175.5	0	0	0	110.4	F59 P62 L214 M217 N221 I303 T304	F59-L219 HydrophobicContact CB-CD1 4.32Å; F59-L219 HydrophobicContact CD1-CD1 3.81Å; F59-L219 HydrophobicContact CE1-CD1 4.49Å; F59-L219 HydrophobicContact CG-CD1 4.27Å; P62-L219 HydrophobicContact CG-CD2 3.86Å; L214-L219 HydrophobicContact CD2-CB 3.93Å; L214-L219 PolarHBondContact O-N 2.83Å; M217-L219 HydrophobicContact CB-CB 4.46Å; M217-L219 HydrophobicContact CB-CD1 4.06Å; M217-L219 HydrophobicContact CB-CG 4.15Å; M217-L219 PolarHBondContact O-N 3.36Å; L219-N221 VanDerWaalsContact C-N 3.25Å; L219-N221 PolarHBondContact O-N 2.95Å; L219-I303 HydrophobicContact CD1-CD1 4.1Å; L219-I303 WeakPolarHBondContact CD2-O 3.32Å; L219-T304 HydrophobicContact CD1-CG2 4.36Å
220	E	60.8	Low	71.9	Confident	137 Å²	137	66.4 Å²	66.4	64%	0.64	33%	0.326	S	S	*	.			trans	-70.8	87.7	168.7	-72	-160.4	153.9	0	0	109.1	Q215	Q215-E220 HydrophobicContact CG-CG 4.14Å; Q215-E220 VanDerWaalsContact CG-OE1 3.31Å; Q215-E220 WeakPolarHBondContact CG-OE1 3.33Å; Q215-E220 PolarHBondContact NE2-OE1 2.89Å
221	N	62.6	Low	72.3	Confident	33 Å²	33	66.7 Å²	66.7	18%	0.176	33%	0.328	C	S	.	.			trans	-104.8	148.6	176.8	-62.8	-29.2	0	0	0	110.2	A58 P62 L219 F223	A58-N221 PolarHBondContact O-ND2 3.16Å; P62-N221 WeakPolarHBondContact CD-ND2 3.27Å; P62-N221 WeakPolarHBondContact CD-OD1 3.33Å; P62-N221 VanDerWaalsContact CG-OD1 3.22Å; P62-N221 WeakPolarHBondContact CG-OD1 3.23Å; L219-N221 VanDerWaalsContact C-N 3.25Å; L219-N221 PolarHBondContact O-N 2.95Å; N221-F223 PolarHBondContact O-N 3Å
222	E	59.6	Low	72.7	Confident	115 Å²	115	63.1 Å²	63.1	54%	0.537	32%	0.317	S	S	.	.	S	Bend	trans	-60.6	-23.4	174.1	-66.1	152.4	-126.5	0	0	112.3	K65	K65-E222 IonicContact NZ-OE1 2.74Å; K65-E222 PolarHBondContact NZ-OE1 3.48Å
223	F	65	Low	73.3	Confident	20 Å²	20	55.6 Å²	55.6	9%	0.088	29%	0.289	C	S	.	.	S	Bend	trans	-91.3	107.9	-179.6	-51.6	-73.4	0	0	0	109.7	V11 E13 L26 A58 V61 N221 P225	V11-F223 HydrophobicContact CB-CE2 3.74Å; V11-F223 HydrophobicContact CB-CZ 3.82Å; V11-F223 HydrophobicContact CG1-CD2 4.43Å; V11-F223 HydrophobicContact CG1-CE2 3.41Å; V11-F223 VanDerWaalsContact CG1-CE2 3.41Å; V11-F223 HydrophobicContact CG1-CZ 3.63Å; V11-F223 WeakPolarHBondContact O-CZ 3.38Å; E13-F223 HydrophobicContact CB-CD1 3.57Å; E13-F223 HydrophobicContact CB-CE1 3.47Å; E13-F223 VanDerWaalsContact CB-CE1 3.47Å; E13-F223 HydrophobicContact CB-CZ 4.45Å; E13-F223 HydrophobicContact CG-CD1 4.18Å; L26-F223 HydrophobicContact CD2-CD1 4.12Å; L26-F223 HydrophobicContact CD2-CD2 4.16Å; L26-F223 HydrophobicContact CD2-CE1 4.33Å; L26-F223 HydrophobicContact CD2-CE2 4.37Å; L26-F223 HydrophobicContact CD2-CG 4.03Å; L26-F223 HydrophobicContact CD2-CZ 4.46Å; A58-F223 HydrophobicContact CB-CB 4.49Å; V61-F223 HydrophobicContact CG1-CD2 4.33Å; V61-F223 HydrophobicContact CG1-CE2 4.27Å; V61-F223 HydrophobicContact CG2-CD2 3.86Å; V61-F223 HydrophobicContact CG2-CE2 4.29Å; N221-F223 PolarHBondContact O-N 3Å; F223-P225 VanDerWaalsContact O-CD 3.25Å; F223-P225 WeakPolarHBondContact O-CD 3.13Å
224	S	60.1	Low	73.9	Confident	65 Å²	65	55.9 Å²	55.9	46%	0.455	29%	0.286	S	S	.	.			trans	-70.4	114.8	179.8	-164.2	0	0	0	0	109.8	L226	S224-L226 PolarHBondContact O-N 3.2Å; S224-L226 WeakPolarHBondContact OG-CD2 3.15Å; S224-L226 VanDerWaalsContact OG-CG 3.24Å; S224-L226 WeakPolarHBondContact OG-CG 3.46Å
225	P	61.8	Low	74.6	Confident	8 Å²	8	56 Å²	56	5%	0.052	29%	0.291	C	S	.	.			trans	-83.1	53.1	179.3	36.4	-31.6	0	0	0	109.3	A58 F59 I210 L214 F223 N227 V228	A58-P225 HydrophobicContact CB-CB 4.31Å; F59-P225 HydrophobicContact CE1-CG 4.49Å; I210-P225 HydrophobicContact CG2-CG 3.79Å; L214-P225 VanDerWaalsContact CD1-CD 3.43Å; L214-P225 HydrophobicContact CD1-CG 3.47Å; L214-P225 VanDerWaalsContact CD1-CG 3.47Å; L214-P225 HydrophobicContact CD2-CG 3.84Å; L214-P225 HydrophobicContact CG-CG 4.1Å; F223-P225 VanDerWaalsContact O-CD 3.25Å; F223-P225 WeakPolarHBondContact O-CD 3.13Å; P225-N227 PolarHBondContact O-N 3.34Å; P225-V228 HydrophobicContact CB-CG2 3.7Å; P225-V228 HydrophobicContact CG-CG2 4.42Å; P225-V228 WeakPolarHBondContact O-CB 3.26Å; P225-V228 WeakPolarHBondContact O-CG2 3.44Å; P225-V228 PolarHBondContact O-N 3.15Å
226	L	61	Low	75.5	Confident	74 Å²	74	52.6 Å²	52.6	39%	0.387	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-54.2	-28.7	-179.8	-66.2	171.8	0	0	0	111.5	I210 S224 V228	I210-L226 WeakPolarHBondContact CD1-O 3.38Å; S224-L226 PolarHBondContact O-N 3.2Å; S224-L226 WeakPolarHBondContact OG-CD2 3.15Å; S224-L226 VanDerWaalsContact OG-CG 3.24Å; S224-L226 WeakPolarHBondContact OG-CG 3.46Å; L226-V228 VanDerWaalsContact C-N 3.26Å; L226-V228 PolarHBondContact O-N 3.28Å
227	N	68.1	Low	76.3	Confident	25 Å²	25	46.2 Å²	46.2	13%	0.134	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-72.6	-12.1	-179.7	-57.5	-31.7	0	0	0	114.5	L87 P225 L229 E230	L87-N227 PolarHBondContact N-ND2 2.65Å; L87-N227 PolarHBondContact O-ND2 3.3Å; P225-N227 PolarHBondContact O-N 3.34Å; N227-L229 PolarHBondContact O-N 2.86Å; N227-E230 WeakPolarHBondContact O-CB 3.41Å; N227-E230 PolarHBondContact O-N 2.72Å
228	V	74.6	Confident	77.5	Confident	31 Å²	31	43.5 Å²	43.5	19%	0.188	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.5	-28	-179	172.2	0	0	0	0	112	F56 F59 P225 L226 L234	F56-V228 HydrophobicContact CD1-CG2 3.82Å; F56-V228 HydrophobicContact CD2-CG2 3.95Å; F56-V228 HydrophobicContact CE1-CB 4.31Å; F56-V228 HydrophobicContact CE1-CG2 3.71Å; F56-V228 HydrophobicContact CE2-CB 4.39Å; F56-V228 HydrophobicContact CE2-CG1 4.31Å; F56-V228 HydrophobicContact CE2-CG2 3.86Å; F56-V228 HydrophobicContact CG-CG2 3.95Å; F56-V228 HydrophobicContact CZ-CB 4.12Å; F56-V228 HydrophobicContact CZ-CG1 4.41Å; F56-V228 HydrophobicContact CZ-CG2 3.79Å; F59-V228 HydrophobicContact CE1-CG2 4.31Å; F59-V228 HydrophobicContact CZ-CG2 3.78Å; P225-V228 HydrophobicContact CB-CG2 3.7Å; P225-V228 HydrophobicContact CG-CG2 4.42Å; P225-V228 WeakPolarHBondContact O-CB 3.26Å; P225-V228 WeakPolarHBondContact O-CG2 3.44Å; P225-V228 PolarHBondContact O-N 3.15Å; L226-V228 VanDerWaalsContact C-N 3.26Å; L226-V228 PolarHBondContact O-N 3.28Å; V228-L234 VanDerWaalsContact O-CD2 3.25Å; V228-L234 WeakPolarHBondContact O-CD2 2.96Å; V228-L234 WeakPolarHBondContact O-CG 3.49Å
229	L	81.6	Confident	78.8	Confident	36 Å²	36	41.1 Å²	41.1	19%	0.188	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-103.1	12.2	176.6	-60.9	-175.9	0	0	0	113.1	L198 K206 L209 I210 N227 P231	L198-L229 HydrophobicContact CD2-CB 4.44Å; K206-L229 HydrophobicContact CB-CD1 4.1Å; K206-L229 HydrophobicContact CD-CB 4.19Å; K206-L229 HydrophobicContact CG-CB 4.48Å; K206-L229 HydrophobicContact CG-CD1 4.28Å; L209-L229 HydrophobicContact CB-CD1 4.23Å; I210-L229 HydrophobicContact CD1-CB 4.22Å; I210-L229 HydrophobicContact CD1-CD1 3.97Å; I210-L229 HydrophobicContact CD1-CG 3.89Å; I210-L229 HydrophobicContact CG1-CD1 3.64Å; I210-L229 HydrophobicContact CG1-CG 3.77Å; N227-L229 PolarHBondContact O-N 2.86Å; L229-P231 WeakPolarHBondContact O-CD 3.4Å
230	E	87.8	Confident	80.2	Confident	32 Å²	32	41.1 Å²	41.1	15%	0.15	22%	0.215	C	C	.	.			trans	-78.3	124.8	175.3	-74.8	-58.4	128.1	0	0	110.4	L87 K206 N227 F232 C233 L234	L87-E230 HydrophobicContact CD1-CB 4.25Å; L87-E230 HydrophobicContact CD1-CG 4.22Å; K206-E230 IonicContact NZ-OE1 2.69Å; K206-E230 PolarHBondContact NZ-OE1 2.83Å; N227-E230 WeakPolarHBondContact O-CB 3.41Å; N227-E230 PolarHBondContact O-N 2.72Å; E230-F232 PolarHBondContact O-N 3.4Å; E230-F232 VanDerWaalsContact O-N 3.12Å; E230-C233 HydrophobicContact CB-CB 4.4Å; E230-C233 PolarHBondContact O-N 2.67Å; E230-L234 PolarHBondContact O-N 2.97Å
231	P	89.4	Confident	81.9	Confident	17 Å²	17	34.7 Å²	34.7	11%	0.11	19%	0.185	C	C	.	.	H	α-helix	trans	-54.5	-36.3	-176.7	-28	33.6	0	0	0	113.8	Y195 L198 K199 L229 A235	Y195-P231 HydrophobicContact CD2-CB 4.06Å; Y195-P231 HydrophobicContact CD2-CG 4.43Å; L198-P231 HydrophobicContact CB-CG 4.06Å; K199-P231 HydrophobicContact CB-CG 4.49Å; L229-P231 WeakPolarHBondContact O-CD 3.4Å; P231-A235 VanDerWaalsContact O-CB 3.27Å; P231-A235 WeakPolarHBondContact O-CB 3.25Å; P231-A235 PolarHBondContact O-N 3.26Å
232	F	90.6	Very high	83.6	Confident	87 Å²	87	33.6 Å²	33.6	38%	0.382	18%	0.181	S	C	.	.	H	α-helix	trans	-62.8	-48.3	177.5	176.6	-102.3	0	0	0	111.9	L87 Y110 E230 L234 A235 N236	L87-F232 HydrophobicContact CD2-CD1 3.8Å; L87-F232 HydrophobicContact CD2-CE1 4.01Å; L87-F232 HydrophobicContact CG-CD1 4.37Å; Y110-F232 HydrophobicContact CE1-CZ 4.3Å; Y110-F232 HydrophobicContact CE2-CZ 4.44Å; Y110-F232 AromaticContact CZ-CZ 3.9Å; E230-F232 PolarHBondContact O-N 3.4Å; E230-F232 VanDerWaalsContact O-N 3.12Å; F232-L234 PolarHBondContact O-N 3.42Å; F232-A235 PolarHBondContact O-N 2.74Å; F232-N236 WeakPolarHBondContact CE1-ND2 3.24Å; F232-N236 WeakPolarHBondContact CZ-ND2 3.28Å; F232-N236 PolarHBondContact O-N 3.25Å; F232-N236 PolarHBondContact O-ND2 3.45Å
233	C	92.4	Very high	85.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.3	-40.9	179.2	-62.9	0	0	0	0	112	F56 G84 H85 E230 N236 A237	F56-C233 HydrophobicContact CE1-CB 4.36Å; F56-C233 HydrophobicContact CZ-CB 4.42Å; G84-C233 WeakPolarHBondContact O-CA 3.44Å; H85-C233 VanDerWaalsContact C-SG 3.54Å; H85-C233 PolarHBondContact O-SG 3.24Å; E230-C233 HydrophobicContact CB-CB 4.4Å; E230-C233 PolarHBondContact O-N 2.67Å; C233-N236 PolarHBondContact O-N 2.95Å; C233-A237 WeakPolarHBondContact O-CB 3.43Å; C233-A237 PolarHBondContact O-N 3Å
234	L	91.4	Very high	87	Confident	62 Å²	62	28.6 Å²	28.6	33%	0.325	16%	0.158	S	C	.	.	H	α-helix	trans	-65.8	-40.5	176.7	-70.7	175.1	0	0	0	112.5	L198 V228 E230 F232 N236 A237 A238	L198-L234 HydrophobicContact CD1-CD1 3.27Å; V228-L234 VanDerWaalsContact O-CD2 3.25Å; V228-L234 WeakPolarHBondContact O-CD2 2.96Å; V228-L234 WeakPolarHBondContact O-CG 3.49Å; E230-L234 PolarHBondContact O-N 2.97Å; F232-L234 PolarHBondContact O-N 3.42Å; L234-N236 VanDerWaalsContact C-N 3.35Å; L234-A237 PolarHBondContact O-N 3.48Å; L234-A238 WeakPolarHBondContact O-CB 3.41Å; L234-A238 PolarHBondContact O-N 3.43Å
235	A	93.9	Very high	88.8	Confident	25 Å²	25	25.6 Å²	25.6	21%	0.207	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175.6	0	0	0	0	0	111.4	Y191 P231 F232 A238 Y239	Y191-A235 HydrophobicContact CD1-CB 4.12Å; Y191-A235 HydrophobicContact CE1-CB 4.31Å; Y191-A235 HydrophobicContact CG-CB 4.35Å; P231-A235 VanDerWaalsContact O-CB 3.27Å; P231-A235 WeakPolarHBondContact O-CB 3.25Å; P231-A235 PolarHBondContact O-N 3.26Å; F232-A235 PolarHBondContact O-N 2.74Å; A235-A238 PolarHBondContact O-N 2.95Å; A235-Y239 VanDerWaalsContact O-CB 3.25Å; A235-Y239 WeakPolarHBondContact O-CB 3.15Å; A235-Y239 PolarHBondContact O-N 3.2Å
236	N	95.5	Very high	90.5	Very high	16 Å²	16	31.1 Å²	31.1	9%	0.086	16%	0.164	C	C	.	.	H	α-helix	trans	-67	-40.9	176.2	-68.9	-29.1	0	0	0	112.3	G84 F232 C233 L234 A238 Y239 L240	G84-N236 PolarHBondContact O-ND2 3.38Å; F232-N236 WeakPolarHBondContact CE1-ND2 3.24Å; F232-N236 WeakPolarHBondContact CZ-ND2 3.28Å; F232-N236 PolarHBondContact O-N 3.25Å; F232-N236 PolarHBondContact O-ND2 3.45Å; C233-N236 PolarHBondContact O-N 2.95Å; L234-N236 VanDerWaalsContact C-N 3.35Å; N236-A238 PolarHBondContact O-N 3.07Å; N236-Y239 PolarHBondContact O-N 2.95Å; N236-L240 WeakPolarHBondContact O-CB 3.41Å; N236-L240 PolarHBondContact O-N 2.83Å
237	A	95.6	Very high	92.2	Very high	9 Å²	9	32.3 Å²	32.3	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-42.2	175.1	0	0	0	0	0	112.5	N53 P54 H85 C233 L234 G241	N53-A237 PolarHBondContact ND2-O 3.05Å; N53-A237 PolarHBondContact OD1-O 2.72Å; P54-A237 HydrophobicContact CB-CB 4.09Å; H85-A237 WeakPolarHBondContact CE1-CA 3.31Å; C233-A237 WeakPolarHBondContact O-CB 3.43Å; C233-A237 PolarHBondContact O-N 3Å; L234-A237 PolarHBondContact O-N 3.48Å; A237-G241 PolarHBondContact O-N 3.36Å
238	A	96.2	Very high	93.7	Very high	11 Å²	11	31.1 Å²	31.1	9%	0.091	16%	0.161	C	C	.	.	H	α-helix	trans	-69.6	-35.9	175.2	0	0	0	0	0	112.4	L183 L190 Y191 L234 A235 N236 G241 G242	L183-A238 HydrophobicContact CD2-CB 3.9Å; L190-A238 HydrophobicContact CD2-CB 3.76Å; Y191-A238 HydrophobicContact CE1-CB 3.77Å; L234-A238 WeakPolarHBondContact O-CB 3.41Å; L234-A238 PolarHBondContact O-N 3.43Å; A235-A238 PolarHBondContact O-N 2.95Å; N236-A238 PolarHBondContact O-N 3.07Å; A238-G241 PolarHBondContact O-N 2.99Å; A238-G242 PolarHBondContact O-N 2.95Å
239	Y	97.3	Very high	94.8	Very high	61 Å²	61	32.7 Å²	32.7	24%	0.239	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-49.3	174.6	177.9	-111.9	0	0	0	111.5	D108 Y191 A235 N236 G241 G242 Q243	D108-Y239 VanDerWaalsContact OD1-CE1 3.28Å; D108-Y239 WeakPolarHBondContact OD1-CE1 3.29Å; D108-Y239 PolarHBondContact OD1-OH 3.11Å; D108-Y239 PolarHBondContact OD2-OH 3.09Å; Y191-Y239 WeakPolarHBondContact OH-CA 3.44Å; Y191-Y239 WeakPolarHBondContact OH-CB 2.78Å; Y191-Y239 PolarHBondContact OH-N 3.36Å; A235-Y239 VanDerWaalsContact O-CB 3.25Å; A235-Y239 WeakPolarHBondContact O-CB 3.15Å; A235-Y239 PolarHBondContact O-N 3.2Å; N236-Y239 PolarHBondContact O-N 2.95Å; Y239-G241 VanDerWaalsContact C-N 3.35Å; Y239-G241 PolarHBondContact O-N 2.78Å; Y239-G242 PolarHBondContact O-N 3.48Å; Y239-Q243 PolarHBondContact O-N 3.1Å; Y239-Q243 VanDerWaalsContact O-N 3.12Å; Y239-Q243 PolarHBondContact OH-NE2 3.47Å
240	L	98.1	Very high	95.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.1	-49.3	173.6	179	60.2	0	0	0	110.4	H82 L112 Q115 F144 N236 G242 Q243 E244	H82-L240 VanDerWaalsContact CD2-CD2 3.49Å; H82-L240 WeakPolarHBondContact CD2-CD2 3.28Å; L112-L240 HydrophobicContact CB-CD1 4.15Å; L112-L240 HydrophobicContact CD1-CD1 4.08Å; Q115-L240 HydrophobicContact CG-CD1 4.08Å; Q115-L240 HydrophobicContact CG-CD2 4.28Å; F144-L240 HydrophobicContact CZ-CD1 4.2Å; F144-L240 HydrophobicContact CZ-CD2 4.32Å; N236-L240 WeakPolarHBondContact O-CB 3.41Å; N236-L240 PolarHBondContact O-N 2.83Å; L240-G242 PolarHBondContact O-N 3.29Å; L240-Q243 CarbonylContact O-C 3.58Å; L240-Q243 WeakPolarHBondContact O-CA 3.35Å; L240-Q243 PolarHBondContact O-N 3.42Å; L240-E244 HydrophobicContact CG-CG 4.45Å; L240-E244 WeakPolarHBondContact O-CG 3.29Å; L240-E244 PolarHBondContact O-N 2.96Å
241	G	97.6	Very high	96	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-58.4	-36.2	178.6	0	0	0	0	0	112.9	N53 A237 A238 Y239 E244 M245	N53-G241 VanDerWaalsContact ND2-CA 3.26Å; N53-G241 WeakPolarHBondContact ND2-CA 3.3Å; N53-G241 PolarHBondContact ND2-N 2.73Å; N53-G241 VanDerWaalsContact ND2-N 3.2Å; A237-G241 PolarHBondContact O-N 3.36Å; A238-G241 PolarHBondContact O-N 2.99Å; Y239-G241 VanDerWaalsContact C-N 3.35Å; Y239-G241 PolarHBondContact O-N 2.78Å; G241-E244 WeakPolarHBondContact O-CB 3.48Å; G241-E244 PolarHBondContact O-N 3.46Å; G241-M245 WeakPolarHBondContact O-CG 3.42Å; G241-M245 PolarHBondContact O-N 3.29Å
242	G	97.9	Very high	96.4	Very high	10 Å²	10	37.7 Å²	37.7	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-39.3	172.8	0	0	0	0	0	113	C184 A238 Y239 L240 M246	C184-G242 PolarHBondContact SG-O 2.94Å; A238-G242 PolarHBondContact O-N 2.95Å; Y239-G242 PolarHBondContact O-N 3.48Å; L240-G242 PolarHBondContact O-N 3.29Å; G242-M246 VanDerWaalsContact O-CG 3.27Å; G242-M246 WeakPolarHBondContact O-CG 3.41Å; G242-M246 PolarHBondContact O-N 3.41Å
243	Q	98.1	Very high	96.8	Very high	26 Å²	26	36 Å²	36	12%	0.121	18%	0.184	C	C	.	.	H	α-helix	trans	-71.5	-35.7	174.2	-72	-169.1	-8.7	0	0	112.2	D108 G111 L112 Y239 L240 M245 M246 E247	D108-Q243 PolarHBondContact OD2-NE2 3.49Å; G111-Q243 VanDerWaalsContact C-OE1 3.24Å; L112-Q243 HydrophobicContact CB-CB 4.03Å; Y239-Q243 PolarHBondContact O-N 3.1Å; Y239-Q243 VanDerWaalsContact O-N 3.12Å; Y239-Q243 PolarHBondContact OH-NE2 3.47Å; L240-Q243 CarbonylContact O-C 3.58Å; L240-Q243 WeakPolarHBondContact O-CA 3.35Å; L240-Q243 PolarHBondContact O-N 3.42Å; Q243-M245 VanDerWaalsContact C-N 3.31Å; Q243-M245 PolarHBondContact O-N 3.19Å; Q243-M246 PolarHBondContact O-N 3.02Å; Q243-M246 VanDerWaalsContact O-N 3.11Å; Q243-E247 WeakPolarHBondContact O-CB 3.26Å; Q243-E247 PolarHBondContact O-N 2.97Å
244	E	98.1	Very high	97	Very high	4 Å²	4	42 Å²	42	2%	0.019	21%	0.212	C	C	.	.	H	α-helix	trans	-54.5	-47.5	173	-65.3	176.4	-128.8	0	0	111.4	N53 L112 I140 M170 L240 G241 M246 V248	N53-E244 WeakPolarHBondContact CB-OE1 3.44Å; N53-E244 VanDerWaalsContact CG-OE1 3.31Å; N53-E244 PolarHBondContact ND2-OE1 2.96Å; L112-E244 HydrophobicContact CD1-CG 4.05Å; I140-E244 HydrophobicContact CB-CG 4.38Å; I140-E244 WeakPolarHBondContact CB-OE2 3.43Å; I140-E244 HydrophobicContact CD1-CB 4.29Å; I140-E244 HydrophobicContact CD1-CG 3.55Å; I140-E244 HydrophobicContact CG1-CG 3.69Å; M170-E244 HydrophobicContact CG-CB 4.28Å; L240-E244 HydrophobicContact CG-CG 4.45Å; L240-E244 WeakPolarHBondContact O-CG 3.29Å; L240-E244 PolarHBondContact O-N 2.96Å; G241-E244 WeakPolarHBondContact O-CB 3.48Å; G241-E244 PolarHBondContact O-N 3.46Å; E244-M246 PolarHBondContact O-N 3.2Å; E244-V248 VanDerWaalsContact O-CB 3.26Å; E244-V248 WeakPolarHBondContact O-CB 3.11Å; E244-V248 PolarHBondContact O-N 3.33Å
245	M	97.7	Very high	97.3	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.015	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-32.2	178.9	-63.8	-53.9	150.1	0	0	113.5	M170 S171 A179 T180 L183 G241 Q243 W273	M170-M245 HydrophobicContact CB-SD 4.49Å; M170-M245 HydrophobicContact CE-CE 4Å; M170-M245 HydrophobicContact CG-CE 4Å; M170-M245 HydrophobicContact CG-SD 3.81Å; S171-M245 WeakPolarHBondContact CB-O 3.34Å; S171-M245 PolarHBondContact OG-O 3.25Å; S171-M245 VanDerWaalsContact OG-O 3.06Å; A179-M245 HydrophobicContact CB-CE 4.1Å; T180-M245 HydrophobicContact CG2-CB 4.45Å; T180-M245 WeakPolarHBondContact OG1-CG 3.31Å; T180-M245 PolarHBondContact OG1-SD 3.43Å; L183-M245 HydrophobicContact CD1-CE 4.04Å; G241-M245 WeakPolarHBondContact O-CG 3.42Å; G241-M245 PolarHBondContact O-N 3.29Å; Q243-M245 VanDerWaalsContact C-N 3.31Å; Q243-M245 PolarHBondContact O-N 3.19Å; M245-W273 HydrophobicContact CE-CH2 4.21Å; M245-W273 HydrophobicContact CE-CZ3 3.64Å
246	M	97.4	Very high	97.6	Very high	124 Å²	124	38.1 Å²	38.1	61%	0.611	19%	0.188	S	C	*	.	H	α-helix	trans	-93.3	-31.6	-171.5	-65.3	-59.4	-56.3	0	0	113.2	G242 Q243 E244 V249	G242-M246 VanDerWaalsContact O-CG 3.27Å; G242-M246 WeakPolarHBondContact O-CG 3.41Å; G242-M246 PolarHBondContact O-N 3.41Å; Q243-M246 PolarHBondContact O-N 3.02Å; Q243-M246 VanDerWaalsContact O-N 3.11Å; E244-M246 PolarHBondContact O-N 3.2Å; M246-V249 WeakPolarHBondContact O-CG2 3.49Å
247	E	97.8	Very high	97.7	Very high	98 Å²	98	44.9 Å²	44.9	46%	0.458	22%	0.217	S	C	.	.	H	α-helix	trans	-111	-28.4	-170	-63.5	-178.5	-129	0	0	112.9	L112 Q243 V249	L112-E247 HydrophobicContact CD2-CB 3.64Å; L112-E247 HydrophobicContact CD2-CG 4.5Å; Q243-E247 WeakPolarHBondContact O-CB 3.26Å; Q243-E247 PolarHBondContact O-N 2.97Å; E247-V249 PolarHBondContact O-N 2.88Å
248	V	98.2	Very high	97.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.			trans	-85	69.5	177.7	-172.3	0	0	0	0	109.7	L112 I140 Y143 T166 I167 E168 R169 M170 E244	L112-V248 HydrophobicContact CD1-CG2 4.29Å; L112-V248 HydrophobicContact CD2-CG2 3.93Å; I140-V248 HydrophobicContact CD1-CG2 3.74Å; Y143-V248 HydrophobicContact CD1-CG2 4.29Å; Y143-V248 HydrophobicContact CD2-CG1 4.05Å; Y143-V248 HydrophobicContact CD2-CG2 4.13Å; Y143-V248 HydrophobicContact CE1-CG2 4.36Å; Y143-V248 HydrophobicContact CE2-CG1 4.44Å; Y143-V248 HydrophobicContact CE2-CG2 4.21Å; Y143-V248 HydrophobicContact CG-CG2 4.18Å; T166-V248 WeakPolarHBondContact O-CG1 3.41Å; I167-V248 VanDerWaalsContact C-CG1 3.4Å; E168-V248 CarbonylContact C-O 3.52Å; R169-V248 PolarHBondContact N-O 3.02Å; R169-V248 VanDerWaalsContact N-O 3.16Å; M170-V248 HydrophobicContact CB-CB 4.07Å; M170-V248 HydrophobicContact CB-CG1 4.36Å; M170-V248 WeakPolarHBondContact CB-O 3.45Å; M170-V248 PolarHBondContact N-O 3.44Å; E244-V248 VanDerWaalsContact O-CB 3.26Å; E244-V248 WeakPolarHBondContact O-CB 3.11Å; E244-V248 PolarHBondContact O-N 3.33Å
249	V	97.5	Very high	97.9	Very high	64 Å²	64	50.7 Å²	50.7	39%	0.388	24%	0.24	S	C	.	.			trans	-106.3	-59.7	-173.7	-177.1	0	0	0	0	111	R169 M246 E247	R169-V249 PolarHBondContact N-O 3.41Å; M246-V249 WeakPolarHBondContact O-CG2 3.49Å; E247-V249 PolarHBondContact O-N 2.88Å
250	K	97.6	Very high	97.9	Very high	159 Å²	159	49.4 Å²	49.4	69%	0.691	24%	0.238	S	C	*	.	S	Bend	trans	-98.8	132.6	-178.1	-169.7	-171.3	173.3	-164.6	0	110.7
251	R	97.6	Very high	97.8	Very high	12 Å²	12	54.9 Å²	54.9	5%	0.045	27%	0.274	C	S	.	.			trans	-63.7	135.9	171.2	-163.8	172.3	61.4	-141.2	1.5	110.9	I167 E168 D253 I256 I282 D285	I167-R251 HydrophobicContact CD1-CG 3.94Å; I167-R251 HydrophobicContact CG1-CG 4.25Å; E168-R251 HydrophobicContact CB-CB 3.86Å; E168-R251 HydrophobicContact CG-CB 4.33Å; E168-R251 WeakPolarHBondContact OE1-CD 3.46Å; E168-R251 IonicContact OE1-CZ 2.83Å; E168-R251 IonicContact OE1-NE 2.77Å; E168-R251 IonicContact OE1-NH1 3.82Å; E168-R251 PolarHBondContact OE1-NH1 3.47Å; R251-D253 VanDerWaalsContact C-N 3.31Å; R251-D253 IonicContact CZ-OD1 3.98Å; R251-D253 VanDerWaalsContact CZ-OD1 3.31Å; R251-D253 IonicContact NE-OD1 2.69Å; R251-D253 PolarHBondContact NE-OD1 2.94Å; R251-D253 IonicContact NH2-OD1 3.27Å; R251-D253 PolarHBondContact NH2-OD1 2.87Å; R251-D253 IonicContact NH2-OD2 2.77Å; R251-D253 PolarHBondContact O-N 2.74Å; R251-D253 VanDerWaalsContact O-N 3.08Å; R251-I256 HydrophobicContact CG-CD1 3.53Å; R251-I282 VanDerWaalsContact NH1-CB 3.32Å; R251-D285 IonicContact CZ-OD2 3.86Å; R251-D285 IonicContact NH2-OD2 2.64Å; R251-D285 PolarHBondContact NH2-OD2 2.92Å
252	D	97.6	Very high	97.7	Very high	20 Å²	20	56.2 Å²	56.2	11%	0.107	28%	0.28	C	S	.	.			trans	-83.3	73.3	177.3	-164.5	-35	0	0	0	110.4	Q147 K150 E254 T255 I256	Q147-D252 PolarHBondContact NE2-OD2 3.13Å; K150-D252 WeakPolarHBondContact CD-OD2 3.39Å; K150-D252 IonicContact NZ-OD1 3.14Å; K150-D252 IonicContact NZ-OD2 2.72Å; K150-D252 PolarHBondContact NZ-OD2 3.18Å; D252-E254 PolarHBondContact O-N 3.32Å; D252-T255 PolarHBondContact O-N 3.39Å; D252-T255 WeakPolarHBondContact OD1-CB 3.34Å; D252-T255 PolarHBondContact OD1-N 2.87Å; D252-T255 PolarHBondContact OD1-OG1 3.39Å; D252-T255 PolarHBondContact OD2-OG1 3Å; D252-I256 VanDerWaalsContact O-CG1 3.31Å; D252-I256 WeakPolarHBondContact O-CG1 3.47Å; D252-I256 PolarHBondContact O-N 2.81Å; D252-I256 VanDerWaalsContact O-N 3.09Å
253	D	98.4	Very high	97.7	Very high	52 Å²	52	55.7 Å²	55.7	28%	0.278	28%	0.275	S	S	.	.	H	α-helix	trans	-61.7	-32.8	-176.7	-75.6	-19.1	0	0	0	112.6	R251 I256 K257 F286	R251-D253 VanDerWaalsContact C-N 3.31Å; R251-D253 IonicContact CZ-OD1 3.98Å; R251-D253 VanDerWaalsContact CZ-OD1 3.31Å; R251-D253 IonicContact NE-OD1 2.69Å; R251-D253 PolarHBondContact NE-OD1 2.94Å; R251-D253 IonicContact NH2-OD1 3.27Å; R251-D253 PolarHBondContact NH2-OD1 2.87Å; R251-D253 IonicContact NH2-OD2 2.77Å; R251-D253 PolarHBondContact O-N 2.74Å; R251-D253 VanDerWaalsContact O-N 3.08Å; D253-I256 PolarHBondContact O-N 3.06Å; D253-K257 VanDerWaalsContact O-CB 3.25Å; D253-K257 WeakPolarHBondContact O-CB 3.24Å; D253-K257 PolarHBondContact O-N 3.29Å; D253-F286 HydrophobicContact CB-CZ 3.97Å
254	E	98.2	Very high	97.7	Very high	126 Å²	126	54.5 Å²	54.5	59%	0.589	27%	0.269	S	S	*	.	H	α-helix	trans	-62.2	-49.5	178.2	-65.3	82.1	-176	0	0	111.2	D252 K257 E258	D252-E254 PolarHBondContact O-N 3.32Å; E254-K257 PolarHBondContact O-N 3.19Å; E254-E258 PolarHBondContact O-N 3.37Å
255	T	97.9	Very high	97.8	Very high	4 Å²	4	54.3 Å²	54.3	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-66.2	-40.3	178.2	-55.8	0	0	0	0	111.4	K150 D252 K257 E258 H259	K150-T255 HydrophobicContact CB-CG2 3.89Å; K150-T255 WeakPolarHBondContact CD-OG1 3.39Å; D252-T255 PolarHBondContact O-N 3.39Å; D252-T255 WeakPolarHBondContact OD1-CB 3.34Å; D252-T255 PolarHBondContact OD1-N 2.87Å; D252-T255 PolarHBondContact OD1-OG1 3.39Å; D252-T255 PolarHBondContact OD2-OG1 3Å; T255-K257 VanDerWaalsContact C-N 3.34Å; T255-K257 PolarHBondContact O-N 3.37Å; T255-E258 PolarHBondContact O-N 3.1Å; T255-H259 PolarHBondContact O-N 2.85Å
256	I	98.6	Very high	97.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-46.6	177.1	-69.3	169.3	0	0	0	110.1	L146 I167 R251 D252 D253 E258 H259 L260 L263 F265 I282 F286	L146-I256 HydrophobicContact CD1-CD1 4.3Å; L146-I256 HydrophobicContact CD1-CG1 4.12Å; L146-I256 HydrophobicContact CD2-CG1 4.06Å; I167-I256 HydrophobicContact CD1-CD1 4.14Å; R251-I256 HydrophobicContact CG-CD1 3.53Å; D252-I256 VanDerWaalsContact O-CG1 3.31Å; D252-I256 WeakPolarHBondContact O-CG1 3.47Å; D252-I256 PolarHBondContact O-N 2.81Å; D252-I256 VanDerWaalsContact O-N 3.09Å; D253-I256 PolarHBondContact O-N 3.06Å; I256-E258 PolarHBondContact O-N 2.86Å; I256-H259 CarbonylContact O-C 3.56Å; I256-H259 PolarHBondContact O-N 3.38Å; I256-L260 HydrophobicContact CG2-CD1 4.05Å; I256-L260 VanDerWaalsContact O-CA 3.28Å; I256-L260 WeakPolarHBondContact O-CA 3.48Å; I256-L260 WeakPolarHBondContact O-CB 3.44Å; I256-L260 PolarHBondContact O-N 2.87Å; I256-L263 HydrophobicContact CB-CD1 4.38Å; I256-L263 HydrophobicContact CG1-CD1 4.39Å; I256-L263 HydrophobicContact CG2-CD1 4.22Å; I256-F265 HydrophobicContact CD1-CE1 4.39Å; I256-F265 HydrophobicContact CD1-CZ 4.22Å; I256-F265 HydrophobicContact CG1-CZ 4.14Å; I256-F265 HydrophobicContact CG2-CE2 4.35Å; I256-F265 HydrophobicContact CG2-CZ 3.88Å; I256-I282 HydrophobicContact CD1-CD1 4.33Å; I256-F286 HydrophobicContact CB-CE2 4.31Å; I256-F286 HydrophobicContact CB-CZ 4.06Å; I256-F286 HydrophobicContact CG2-CD1 4.25Å; I256-F286 HydrophobicContact CG2-CD2 4Å; I256-F286 HydrophobicContact CG2-CE1 3.99Å; I256-F286 HydrophobicContact CG2-CE2 3.71Å; I256-F286 HydrophobicContact CG2-CG 4.25Å; I256-F286 HydrophobicContact CG2-CZ 3.7Å
257	K	98.3	Very high	97.8	Very high	159 Å²	159	48.8 Å²	48.8	69%	0.691	24%	0.241	S	C	*	.	H	α-helix	trans	-60.5	-45.5	178.9	-169.9	176	178.9	177.5	0	112	D253 E254 T255 H259 F286	D253-K257 VanDerWaalsContact O-CB 3.25Å; D253-K257 WeakPolarHBondContact O-CB 3.24Å; D253-K257 PolarHBondContact O-N 3.29Å; E254-K257 PolarHBondContact O-N 3.19Å; T255-K257 VanDerWaalsContact C-N 3.34Å; T255-K257 PolarHBondContact O-N 3.37Å; K257-H259 PolarHBondContact O-N 3.49Å; K257-F286 HydrophobicContact CB-CE1 3.88Å; K257-F286 HydrophobicContact CG-CE1 4.38Å
258	E	97.6	Very high	97.7	Very high	128 Å²	128	44.1 Å²	44.1	60%	0.598	22%	0.219	S	C	*	.	H	α-helix	trans	-61.2	-31.6	-179.8	-172.2	179.9	161.2	0	0	112.5	E254 T255 I256	E254-E258 PolarHBondContact O-N 3.37Å; T255-E258 PolarHBondContact O-N 3.1Å; I256-E258 PolarHBondContact O-N 2.86Å
259	H	97.5	Very high	97.6	Very high	13 Å²	13	46.2 Å²	46.2	6%	0.06	23%	0.232	C	C	.	.	H	α-helix	trans	-114.6	9.9	-173.1	-65.1	-32.2	0	0	0	114.2	L149 T255 I256 K257 C261 K262 L263	L149-H259 HydrophobicContact CD1-CB 4.47Å; T255-H259 PolarHBondContact O-N 2.85Å; I256-H259 CarbonylContact O-C 3.56Å; I256-H259 PolarHBondContact O-N 3.38Å; K257-H259 PolarHBondContact O-N 3.49Å; H259-C261 PolarHBondContact O-N 3.28Å; H259-K262 HydrophobicContact CB-CD 4.41Å; H259-K262 HydrophobicContact CB-CG 4.11Å; H259-K262 WeakPolarHBondContact ND1-CE 3.4Å; H259-K262 PolarHBondContact ND1-NZ 3.06Å; H259-K262 WeakPolarHBondContact O-CG 3.37Å; H259-K262 PolarHBondContact O-N 3.48Å; H259-L263 HydrophobicContact CB-CD1 4.2Å; H259-L263 HydrophobicContact CB-CG 4.24Å; H259-L263 WeakPolarHBondContact O-CG 3.46Å; H259-L263 PolarHBondContact O-N 3.23Å
260	L	97.7	Very high	97.5	Very high	35 Å²	35	47.2 Å²	47.2	18%	0.183	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-52.5	-37.5	-169.3	-168.3	65.5	0	0	0	113.3	I256 K262 L263 F286	I256-L260 HydrophobicContact CG2-CD1 4.05Å; I256-L260 VanDerWaalsContact O-CA 3.28Å; I256-L260 WeakPolarHBondContact O-CA 3.48Å; I256-L260 WeakPolarHBondContact O-CB 3.44Å; I256-L260 PolarHBondContact O-N 2.87Å; L260-K262 VanDerWaalsContact C-N 3.25Å; L260-K262 PolarHBondContact O-N 3.03Å; L260-L263 PolarHBondContact O-N 2.85Å; L260-F286 HydrophobicContact CD1-CB 4.03Å; L260-F286 HydrophobicContact CD1-CD1 4.13Å; L260-F286 HydrophobicContact CD1-CG 4.19Å; L260-F286 HydrophobicContact CD2-CB 4.33Å; L260-F286 HydrophobicContact CD2-CD1 4.12Å
261	C	95.8	Very high	97.5	Very high	114 Å²	114	39.9 Å²	39.9	77%	0.77	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-64.6	-24.1	-178.8	63.2	0	0	0	0	114.7	R159 H259	R159-C261 PolarHBondContact NH1-O 3.11Å; H259-C261 PolarHBondContact O-N 3.28Å
262	K	95.9	Very high	97.4	Very high	29 Å²	29	41.3 Å²	41.3	13%	0.126	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-104.6	-4.7	178.1	61.6	177.3	174.8	-168.7	0	113.2	V157 R159 A160 H259 L260	V157-K262 HydrophobicContact CB-CD 4.41Å; V157-K262 HydrophobicContact CG1-CD 4.36Å; R159-K262 CarbonylContact C-O 3.48Å; R159-K262 WeakPolarHBondContact CA-O 3.26Å; R159-K262 WeakPolarHBondContact CD-O 3.47Å; A160-K262 PolarHBondContact N-O 2.9Å; H259-K262 HydrophobicContact CB-CD 4.41Å; H259-K262 HydrophobicContact CB-CG 4.11Å; H259-K262 WeakPolarHBondContact ND1-CE 3.4Å; H259-K262 PolarHBondContact ND1-NZ 3.06Å; H259-K262 WeakPolarHBondContact O-CG 3.37Å; H259-K262 PolarHBondContact O-N 3.48Å; L260-K262 VanDerWaalsContact C-N 3.25Å; L260-K262 PolarHBondContact O-N 3.03Å
263	L	98.4	Very high	97.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	134.9	-179.5	-63.2	177.9	0	0	0	111.1	L146 L149 A160 L162 I256 H259 L260 F265	L146-L263 HydrophobicContact CD2-CD1 3.88Å; L146-L263 HydrophobicContact CD2-CD2 4.15Å; L149-L263 HydrophobicContact CD1-CD2 3.89Å; A160-L263 HydrophobicContact CB-CD2 3.9Å; L162-L263 HydrophobicContact CD1-CD2 4.48Å; I256-L263 HydrophobicContact CB-CD1 4.38Å; I256-L263 HydrophobicContact CG1-CD1 4.39Å; I256-L263 HydrophobicContact CG2-CD1 4.22Å; H259-L263 HydrophobicContact CB-CD1 4.2Å; H259-L263 HydrophobicContact CB-CG 4.24Å; H259-L263 WeakPolarHBondContact O-CG 3.46Å; H259-L263 PolarHBondContact O-N 3.23Å; L260-L263 PolarHBondContact O-N 2.85Å; L263-F265 HydrophobicContact CB-CD2 4.37Å; L263-F265 HydrophobicContact CB-CE2 3.67Å; L263-F265 HydrophobicContact CB-CZ 4.24Å; L263-F265 HydrophobicContact CD1-CE2 4.08Å; L263-F265 HydrophobicContact CD1-CZ 3.89Å; L263-F265 HydrophobicContact CG-CE2 4.5Å
264	T	98.4	Very high	97.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123	166.8	-61.2	0	0	0	0	108.9	A160 F161 L162 Y266 D290	A160-T264 PolarHBondContact O-N 3.24Å; F161-T264 WeakPolarHBondContact CA-O 3.45Å; F161-T264 HydrophobicContact CD1-CG2 3.89Å; F161-T264 HydrophobicContact CE1-CG2 4.07Å; L162-T264 PolarHBondContact N-O 3.38Å; T264-Y266 HydrophobicContact CG2-CD2 3.88Å; T264-Y266 HydrophobicContact CG2-CE2 3.42Å; T264-Y266 VanDerWaalsContact CG2-CE2 3.42Å; T264-D290 CarbonylContact C-O 3.26Å; T264-D290 VanDerWaalsContact CA-O 3.3Å; T264-D290 WeakPolarHBondContact CA-O 3.41Å; T264-D290 WeakPolarHBondContact CB-OD2 3.27Å; T264-D290 HydrophobicContact CG2-CB 4.47Å; T264-D290 WeakPolarHBondContact CG2-OD2 3.36Å; T264-D290 PolarHBondContact OG1-OD2 3.07Å
265	F	98.6	Very high	97.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.5	179.1	-59	-105.2	0	0	0	110.2	L162 P165 I167 I256 L263 Y267 I282 D290 I291 R292	L162-F265 HydrophobicContact CB-CD1 4.16Å; L162-F265 HydrophobicContact CD1-CD1 3.88Å; L162-F265 HydrophobicContact CD1-CE1 3.48Å; L162-F265 VanDerWaalsContact CD1-CE1 3.48Å; L162-F265 HydrophobicContact CD1-CZ 3.98Å; L162-F265 HydrophobicContact CG-CD1 4.44Å; L162-F265 HydrophobicContact CG-CE1 4.45Å; P165-F265 HydrophobicContact CG-CD1 4.33Å; I167-F265 HydrophobicContact CD1-CD1 4.47Å; I167-F265 HydrophobicContact CD1-CE1 3.91Å; I256-F265 HydrophobicContact CD1-CE1 4.39Å; I256-F265 HydrophobicContact CD1-CZ 4.22Å; I256-F265 HydrophobicContact CG1-CZ 4.14Å; I256-F265 HydrophobicContact CG2-CE2 4.35Å; I256-F265 HydrophobicContact CG2-CZ 3.88Å; L263-F265 HydrophobicContact CB-CD2 4.37Å; L263-F265 HydrophobicContact CB-CE2 3.67Å; L263-F265 HydrophobicContact CB-CZ 4.24Å; L263-F265 HydrophobicContact CD1-CE2 4.08Å; L263-F265 HydrophobicContact CD1-CZ 3.89Å; L263-F265 HydrophobicContact CG-CE2 4.5Å; F265-Y267 HydrophobicContact CB-CD2 4.28Å; F265-Y267 HydrophobicContact CB-CE2 3.81Å; F265-Y267 HydrophobicContact CD1-CE2 4.4Å; F265-Y267 HydrophobicContact CG-CE2 4.49Å; F265-I282 HydrophobicContact CD1-CD1 3.7Å; F265-I282 HydrophobicContact CD2-CD1 4.47Å; F265-I282 HydrophobicContact CE1-CD1 3.43Å; F265-I282 VanDerWaalsContact CE1-CD1 3.43Å; F265-I282 HydrophobicContact CE2-CD1 4.27Å; F265-I282 HydrophobicContact CG-CD1 4.22Å; F265-I282 HydrophobicContact CZ-CD1 3.76Å; F265-D290 PolarHBondContact N-O 3.44Å; F265-I291 HydrophobicContact CB-CB 4.4Å; F265-I291 HydrophobicContact CB-CG1 4.27Å; F265-I291 HydrophobicContact CB-CG2 4.15Å; F265-I291 HydrophobicContact CD2-CG1 3.73Å; F265-I291 HydrophobicContact CE2-CG1 4.43Å; F265-I291 HydrophobicContact CG-CG1 4.25Å; F265-R292 PolarHBondContact O-N 3.02Å
266	Y	97.9	Very high	97.1	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.039	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.1	173.8	-77.8	-81.8	0	0	0	110.4	F161 L162 L163 F164 P165 T264 R292 M313	F161-Y266 HydrophobicContact CD1-CD2 4.44Å; F161-Y266 AromaticContact CD1-CE2 3.84Å; F161-Y266 HydrophobicContact CD1-CE2 3.84Å; F161-Y266 HydrophobicContact CE1-CE2 4.31Å; L162-Y266 PolarHBondContact O-N 2.86Å; L163-Y266 HydrophobicContact CD2-CD2 3.59Å; L163-Y266 HydrophobicContact CD2-CE2 4.4Å; L163-Y266 HydrophobicContact CD2-CG 4.1Å; F164-Y266 WeakPolarHBondContact CA-O 3.35Å; F164-Y266 PolarHBondContact N-O 2.95Å; P165-Y266 WeakPolarHBondContact CD-O 3.39Å; T264-Y266 HydrophobicContact CG2-CD2 3.88Å; T264-Y266 HydrophobicContact CG2-CE2 3.42Å; T264-Y266 VanDerWaalsContact CG2-CE2 3.42Å; Y266-R292 HydrophobicContact CD1-CB 3.87Å; Y266-R292 HydrophobicContact CE1-CB 3.97Å; Y266-R292 VanDerWaalsContact CE1-CD 3.46Å; Y266-R292 HydrophobicContact CE1-CG 4.26Å; Y266-R292 PolarHBondContact OH-NH1 3.12Å; Y266-M313 HydrophobicContact CD1-CE 3.73Å; Y266-M313 HydrophobicContact CE1-CB 4.44Å; Y266-M313 HydrophobicContact CE1-CE 3.71Å; Y266-M313 HydrophobicContact CE1-SD 4.34Å; Y266-M313 HydrophobicContact CG-CE 4.37Å
267	Y	98.2	Very high	97	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	152.5	173.6	-69.8	-96.5	0	0	0	110.8	P165 F265 C274 Y279 I282 I291 R292 C294	P165-Y267 HydrophobicContact CG-CD1 4.18Å; P165-Y267 HydrophobicContact CG-CD2 4.35Å; P165-Y267 HydrophobicContact CG-CE1 3.55Å; P165-Y267 HydrophobicContact CG-CE2 3.77Å; P165-Y267 WeakPolarHBondContact CG-OH 3.45Å; F265-Y267 HydrophobicContact CB-CD2 4.28Å; F265-Y267 HydrophobicContact CB-CE2 3.81Å; F265-Y267 HydrophobicContact CD1-CE2 4.4Å; F265-Y267 HydrophobicContact CG-CE2 4.49Å; Y267-C274 HydrophobicContact CD1-CB 4.11Å; Y267-C274 HydrophobicContact CE1-CB 4.24Å; Y267-Y279 AromaticContact CD2-CD2 3.81Å; Y267-Y279 HydrophobicContact CD2-CD2 3.81Å; Y267-Y279 HydrophobicContact CD2-CG 4.37Å; Y267-Y279 HydrophobicContact CG-CD2 4.21Å; Y267-Y279 HydrophobicContact CG-CG 4.4Å; Y267-I282 HydrophobicContact CE2-CG2 3.78Å; Y267-I291 HydrophobicContact CD2-CG2 4.31Å; Y267-I291 HydrophobicContact CE2-CG2 4.14Å; Y267-R292 PolarHBondContact N-O 3.29Å; Y267-C294 WeakPolarHBondContact O-CB 3.31Å; Y267-C294 PolarHBondContact O-N 3.14Å
268	G	96.3	Very high	97	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	146	173	0	0	0	0	0	111.7	I270	G268-I270 PolarHBondContact O-N 3.33Å
269	T	96	Very high	97	Very high	44 Å²	44	33.6 Å²	33.6	27%	0.27	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.5	175	46.9	0	0	0	0	113.9	L293 C294 E295 N297	T269-L293 HydrophobicContact CG2-CD1 4.2Å; T269-L293 HydrophobicContact CG2-CD2 4.17Å; T269-L293 HydrophobicContact CG2-CG 4.01Å; T269-C294 PolarHBondContact N-O 2.85Å; T269-C294 PolarHBondContact OG1-O 3.33Å; T269-E295 HydrophobicContact CG2-CG 4.43Å; T269-N297 PolarHBondContact OG1-OD1 3.48Å
270	I	95.3	Very high	97.1	Very high	86 Å²	86	37.3 Å²	37.3	44%	0.441	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	17.1	-174.7	64.4	160.1	0	0	0	112.9	G268 P272 N297 P299	G268-I270 PolarHBondContact O-N 3.33Å; I270-P272 WeakPolarHBondContact O-CD 3.14Å; I270-N297 HydrophobicContact CD1-CB 4.2Å; I270-N297 VanDerWaalsContact CD1-O 3.24Å; I270-N297 WeakPolarHBondContact CD1-O 3.4Å; I270-N297 HydrophobicContact CG1-CB 4.5Å; I270-N297 HydrophobicContact CG2-CB 4.35Å; I270-P299 HydrophobicContact CD1-CB 4.39Å
271	D	96.6	Very high	97.1	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.027	20%	0.195	C	C	.	.			trans	-79.3	112.9	-175.4	-174.9	-10.4	0	0	0	111.5	F164 W273 C274 P275 H300	F164-D271 WeakPolarHBondContact CB-OD2 3.21Å; F164-D271 HydrophobicContact CD1-CB 4.29Å; F164-D271 WeakPolarHBondContact CD1-OD2 3.44Å; D271-W273 VanDerWaalsContact C-N 3.28Å; D271-W273 PolarHBondContact O-N 3.4Å; D271-W273 WeakPolarHBondContact OD1-CA 3.28Å; D271-W273 WeakPolarHBondContact OD1-CB 3.45Å; D271-W273 PolarHBondContact OD1-N 2.91Å; D271-C274 CarbonylContact O-C 3.33Å; D271-C274 PolarHBondContact OD1-N 2.81Å; D271-C274 WeakPolarHBondContact OD2-CB 3.44Å; D271-P275 WeakPolarHBondContact O-CA 3.45Å; D271-H300 WeakPolarHBondContact OD1-CB 3.14Å; D271-H300 IonicContact OD1-CG 3.71Å; D271-H300 IonicContact OD1-ND1 3.76Å; D271-H300 PolarHBondContact OD1-ND1 2.71Å; D271-H300 IonicContact OD2-CE1 3.1Å; D271-H300 IonicContact OD2-CG 2.72Å; D271-H300 IonicContact OD2-ND1 2.54Å; D271-H300 PolarHBondContact OD2-ND1 2.77Å
272	P	96.3	Very high	97.2	Very high	42 Å²	42	32.9 Å²	32.9	27%	0.273	16%	0.159	S	C	.	.	S	Bend	trans	-80.2	-4.8	180	36.3	-39.7	0	0	0	114.1	P174 N175 I270	P174-P272 HydrophobicContact CB-CB 4.26Å; P174-P272 WeakPolarHBondContact CD-O 3.33Å; N175-P272 HydrophobicContact CB-CB 4.3Å; N175-P272 PolarHBondContact N-O 2.69Å; N175-P272 WeakPolarHBondContact ND2-CG 3.45Å; I270-P272 WeakPolarHBondContact O-CD 3.14Å
273	W	97.4	Very high	97.3	Very high	59 Å²	59	34.8 Å²	34.8	22%	0.223	17%	0.167	C	C	.	.	S	Bend	trans	-98.2	-34.1	174.4	-64.3	106.4	0	0	0	111.9	T166 M170 S173 N175 A179 M245 D271 H300	T166-W273 HydrophobicContact CG2-CB 4.15Å; M170-W273 HydrophobicContact CE-CD2 4.11Å; M170-W273 HydrophobicContact CE-CE3 3.41Å; M170-W273 VanDerWaalsContact CE-CE3 3.41Å; M170-W273 HydrophobicContact CE-CZ3 3.76Å; M170-W273 HydrophobicContact SD-CE3 4.12Å; S173-W273 WeakPolarHBondContact CB-O 3.25Å; N175-W273 HydrophobicContact CB-CD2 3.51Å; N175-W273 HydrophobicContact CB-CE3 3.52Å; N175-W273 HydrophobicContact CB-CG 4.22Å; N175-W273 HydrophobicContact CB-CH2 3.7Å; N175-W273 HydrophobicContact CB-CZ2 3.67Å; N175-W273 HydrophobicContact CB-CZ3 3.6Å; N175-W273 VanDerWaalsContact ND2-CE2 3.33Å; N175-W273 PolarHBondContact ND2-NE1 3.27Å; N175-W273 VanDerWaalsContact ND2-NE1 3.17Å; A179-W273 HydrophobicContact CB-CH2 3.85Å; A179-W273 HydrophobicContact CB-CZ3 4.26Å; M245-W273 HydrophobicContact CE-CH2 4.21Å; M245-W273 HydrophobicContact CE-CZ3 3.64Å; D271-W273 VanDerWaalsContact C-N 3.28Å; D271-W273 PolarHBondContact O-N 3.4Å; D271-W273 WeakPolarHBondContact OD1-CA 3.28Å; D271-W273 WeakPolarHBondContact OD1-CB 3.45Å; D271-W273 PolarHBondContact OD1-N 2.91Å; W273-H300 AromaticContact CD1-CD2 3.48Å; W273-H300 VanDerWaalsContact CD1-CD2 3.48Å; W273-H300 AromaticContact CD1-CE1 3.96Å; W273-H300 AromaticContact CD1-CG 3.44Å; W273-H300 VanDerWaalsContact CD1-CG 3.44Å; W273-H300 AromaticContact CD1-ND1 3.74Å; W273-H300 AromaticContact CD1-NE2 3.8Å
274	C	95.3	Very high	97.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-126.5	75.9	177.1	-55.9	0	0	0	0	109	P165 T166 Y267 D271	P165-C274 PolarHBondContact O-SG 3.4Å; T166-C274 VanDerWaalsContact CG2-SG 3.54Å; Y267-C274 HydrophobicContact CD1-CB 4.11Å; Y267-C274 HydrophobicContact CE1-CB 4.24Å; D271-C274 CarbonylContact O-C 3.33Å; D271-C274 PolarHBondContact OD1-N 2.81Å; D271-C274 WeakPolarHBondContact OD2-CB 3.44Å
275	P	95.9	Very high	97.3	Very high	15 Å²	15	46.7 Å²	46.7	10%	0.097	22%	0.223	C	C	.	.			trans	-65.9	162	-172.3	34.6	-40.5	0	0	0	110.9	P174 D271 E277 Y278	P174-P275 HydrophobicContact CG-CB 4.46Å; D271-P275 WeakPolarHBondContact O-CA 3.45Å; P275-E277 VanDerWaalsContact CB-OE2 3.28Å; P275-E277 WeakPolarHBondContact CB-OE2 3.37Å; P275-E277 PolarHBondContact O-N 2.81Å; P275-Y278 HydrophobicContact CG-CD1 3.8Å; P275-Y278 HydrophobicContact CG-CD2 4.48Å; P275-Y278 HydrophobicContact CG-CE1 3.64Å; P275-Y278 HydrophobicContact CG-CE2 4.37Å; P275-Y278 HydrophobicContact CG-CG 4.2Å; P275-Y278 WeakPolarHBondContact O-CB 3.48Å; P275-Y278 PolarHBondContact O-N 3.48Å
276	K	96.3	Very high	97.3	Very high	89 Å²	89	47.6 Å²	47.6	39%	0.387	23%	0.227	S	C	.	.	H	α-helix	trans	-56.4	-30.5	-170.2	-170.8	-171.8	175.5	-132.7	0	112.8	Y278 Y279 E280 L293	K276-Y278 PolarHBondContact O-N 3.44Å; K276-Y279 VanDerWaalsContact O-CB 3.32Å; K276-Y279 WeakPolarHBondContact O-CB 3.4Å; K276-Y279 PolarHBondContact O-N 2.93Å; K276-Y279 VanDerWaalsContact O-N 3.09Å; K276-E280 VanDerWaalsContact CE-OE1 3.24Å; K276-E280 WeakPolarHBondContact CE-OE1 3.28Å; K276-E280 IonicContact NZ-OE1 2.74Å; K276-E280 PolarHBondContact NZ-OE1 2.88Å; K276-E280 PolarHBondContact O-N 3.34Å; K276-L293 HydrophobicContact CD-CD2 4.33Å; K276-L293 HydrophobicContact CG-CD1 4.48Å; K276-L293 HydrophobicContact CG-CD2 4.15Å
277	E	97.6	Very high	97.3	Very high	107 Å²	107	50.9 Å²	50.9	50%	0.5	25%	0.25	S	C	.	.	H	α-helix	trans	-57.5	-34.2	176.1	-61.3	75.2	-164.9	0	0	111.6	P275 Y279 E280 D281	P275-E277 VanDerWaalsContact CB-OE2 3.28Å; P275-E277 WeakPolarHBondContact CB-OE2 3.37Å; P275-E277 PolarHBondContact O-N 2.81Å; E277-Y279 VanDerWaalsContact C-N 3.34Å; E277-Y279 PolarHBondContact O-N 3.49Å; E277-E280 PolarHBondContact O-N 3.19Å; E277-D281 WeakPolarHBondContact O-CB 3.04Å; E277-D281 PolarHBondContact O-N 3.32Å
278	Y	97.9	Very high	97.2	Very high	12 Å²	12	59.2 Å²	59.2	5%	0.047	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-36.2	179.4	-65.8	13.2	0	0	0	110.9	E168 R169 S173 P275 K276 I282	E168-Y278 HydrophobicContact CG-CD2 4.13Å; E168-Y278 HydrophobicContact CG-CE2 4.41Å; R169-Y278 HydrophobicContact CB-CE1 4.27Å; R169-Y278 HydrophobicContact CB-CE2 3.93Å; R169-Y278 WeakPolarHBondContact CB-OH 3.5Å; R169-Y278 VanDerWaalsContact CZ-CD1 3.46Å; R169-Y278 PolarHBondContact O-OH 3.39Å; S173-Y278 PolarHBondContact N-OH 3.15Å; P275-Y278 HydrophobicContact CG-CD1 3.8Å; P275-Y278 HydrophobicContact CG-CD2 4.48Å; P275-Y278 HydrophobicContact CG-CE1 3.64Å; P275-Y278 HydrophobicContact CG-CE2 4.37Å; P275-Y278 HydrophobicContact CG-CG 4.2Å; P275-Y278 WeakPolarHBondContact O-CB 3.48Å; P275-Y278 PolarHBondContact O-N 3.48Å; K276-Y278 PolarHBondContact O-N 3.44Å; Y278-I282 WeakPolarHBondContact O-CG2 3.23Å; Y278-I282 PolarHBondContact O-N 3.1Å; Y278-I282 VanDerWaalsContact O-N 3.08Å
279	Y	98.2	Very high	97.3	Very high	45 Å²	45	59.5 Å²	59.5	18%	0.176	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-45.3	170.3	163.2	-96.3	0	0	0	111.7	Y267 K276 E277 I282 K283 I291 L293	Y267-Y279 AromaticContact CD2-CD2 3.81Å; Y267-Y279 HydrophobicContact CD2-CD2 3.81Å; Y267-Y279 HydrophobicContact CD2-CG 4.37Å; Y267-Y279 HydrophobicContact CG-CD2 4.21Å; Y267-Y279 HydrophobicContact CG-CG 4.4Å; K276-Y279 VanDerWaalsContact O-CB 3.32Å; K276-Y279 WeakPolarHBondContact O-CB 3.4Å; K276-Y279 PolarHBondContact O-N 2.93Å; K276-Y279 VanDerWaalsContact O-N 3.09Å; E277-Y279 VanDerWaalsContact C-N 3.34Å; E277-Y279 PolarHBondContact O-N 3.49Å; Y279-I282 WeakPolarHBondContact O-CG2 3.39Å; Y279-K283 HydrophobicContact CE2-CB 4.47Å; Y279-K283 WeakPolarHBondContact O-CB 3.16Å; Y279-K283 PolarHBondContact O-N 3.31Å; Y279-I291 HydrophobicContact CD2-CG2 3.65Å; Y279-I291 HydrophobicContact CE2-CG2 3.65Å; Y279-L293 HydrophobicContact CD1-CB 4.07Å; Y279-L293 HydrophobicContact CD1-CD1 4.25Å; Y279-L293 HydrophobicContact CD1-CD2 3.94Å; Y279-L293 HydrophobicContact CD1-CG 4.32Å; Y279-L293 HydrophobicContact CD2-CB 3.98Å; Y279-L293 HydrophobicContact CE1-CB 3.84Å; Y279-L293 HydrophobicContact CE1-CD2 3.95Å; Y279-L293 HydrophobicContact CE1-CG 4.41Å; Y279-L293 HydrophobicContact CE2-CB 3.73Å; Y279-L293 HydrophobicContact CG-CB 4.15Å; Y279-L293 HydrophobicContact CG-CD1 4.11Å
280	E	98.3	Very high	97.4	Very high	90 Å²	90	59.6 Å²	59.6	42%	0.421	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-42.8	-179.3	-68.2	177	176	0	0	111.1	K276 E277 K284	K276-E280 VanDerWaalsContact CE-OE1 3.24Å; K276-E280 WeakPolarHBondContact CE-OE1 3.28Å; K276-E280 IonicContact NZ-OE1 2.74Å; K276-E280 PolarHBondContact NZ-OE1 2.88Å; K276-E280 PolarHBondContact O-N 3.34Å; E277-E280 PolarHBondContact O-N 3.19Å; E280-K284 VanDerWaalsContact O-CB 3.31Å; E280-K284 WeakPolarHBondContact O-CB 3.32Å; E280-K284 PolarHBondContact O-N 2.92Å
281	D	98.3	Very high	97.5	Very high	56 Å²	56	55.9 Å²	55.9	30%	0.299	27%	0.271	S	S	.	.	H	α-helix	trans	-61.5	-53.8	176.7	-70.1	-24.2	0	0	0	111.5	R169 E277 K283 K284 D285	R169-D281 IonicContact CZ-OD2 3.7Å; R169-D281 VanDerWaalsContact CZ-OD2 3.27Å; R169-D281 IonicContact NH1-OD2 2.69Å; R169-D281 PolarHBondContact NH1-OD2 3.09Å; R169-D281 IonicContact NH2-OD2 3Å; R169-D281 PolarHBondContact NH2-OD2 3.43Å; E277-D281 WeakPolarHBondContact O-CB 3.04Å; E277-D281 PolarHBondContact O-N 3.32Å; D281-K283 VanDerWaalsContact C-N 3.32Å; D281-K283 PolarHBondContact O-N 2.81Å; D281-K284 WeakPolarHBondContact O-CB 3.42Å; D281-K284 PolarHBondContact O-N 3.38Å; D281-D285 PolarHBondContact O-N 3.17Å
282	I	98.4	Very high	97.5	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-65.9	-35.5	-178.6	-163.2	175.3	0	0	0	112.1	I167 R251 I256 F265 Y267 Y278 Y279 K284 D285 F286 I291	I167-I282 HydrophobicContact CD1-CD1 4.37Å; R251-I282 VanDerWaalsContact NH1-CB 3.32Å; I256-I282 HydrophobicContact CD1-CD1 4.33Å; F265-I282 HydrophobicContact CD1-CD1 3.7Å; F265-I282 HydrophobicContact CD2-CD1 4.47Å; F265-I282 HydrophobicContact CE1-CD1 3.43Å; F265-I282 VanDerWaalsContact CE1-CD1 3.43Å; F265-I282 HydrophobicContact CE2-CD1 4.27Å; F265-I282 HydrophobicContact CG-CD1 4.22Å; F265-I282 HydrophobicContact CZ-CD1 3.76Å; Y267-I282 HydrophobicContact CE2-CG2 3.78Å; Y278-I282 WeakPolarHBondContact O-CG2 3.23Å; Y278-I282 PolarHBondContact O-N 3.1Å; Y278-I282 VanDerWaalsContact O-N 3.08Å; Y279-I282 WeakPolarHBondContact O-CG2 3.39Å; I282-K284 VanDerWaalsContact C-N 3.3Å; I282-K284 PolarHBondContact O-N 3.05Å; I282-D285 PolarHBondContact O-N 3.37Å; I282-F286 HydrophobicContact CG1-CD2 3.77Å; I282-F286 HydrophobicContact CG1-CE2 4.33Å; I282-F286 PolarHBondContact O-N 3.5Å; I282-I291 HydrophobicContact CG1-CD1 4.06Å; I282-I291 HydrophobicContact CG2-CD1 4.21Å; I282-I291 HydrophobicContact CG2-CG2 3.71Å
283	K	98.3	Very high	97.5	Very high	69 Å²	69	59.6 Å²	59.6	30%	0.3	28%	0.281	S	S	.	.	H	α-helix	trans	-67.8	-33.8	177.5	-174.3	55.8	172.5	172.2	0	111.7	Y279 D281 F286 P287 G289 I291	Y279-K283 HydrophobicContact CE2-CB 4.47Å; Y279-K283 WeakPolarHBondContact O-CB 3.16Å; Y279-K283 PolarHBondContact O-N 3.31Å; D281-K283 VanDerWaalsContact C-N 3.32Å; D281-K283 PolarHBondContact O-N 2.81Å; K283-F286 CarbonylContact O-C 3.56Å; K283-P287 PolarHBondContact NZ-O 3.26Å; K283-P287 WeakPolarHBondContact O-CA 3.28Å; K283-G289 PolarHBondContact NZ-O 3.39Å; K283-I291 HydrophobicContact CB-CG2 4.43Å; K283-I291 HydrophobicContact CD-CB 4.14Å; K283-I291 HydrophobicContact CD-CD1 4.27Å
284	K	98.3	Very high	97.3	Very high	166 Å²	166	57.3 Å²	57.3	72%	0.722	27%	0.274	S	S	*	.	H	α-helix	trans	-67.3	-43.2	173.7	178.4	-174.6	173	-170.6	0	111.7	E280 D281 I282	E280-K284 VanDerWaalsContact O-CB 3.31Å; E280-K284 WeakPolarHBondContact O-CB 3.32Å; E280-K284 PolarHBondContact O-N 2.92Å; D281-K284 WeakPolarHBondContact O-CB 3.42Å; D281-K284 PolarHBondContact O-N 3.38Å; I282-K284 VanDerWaalsContact C-N 3.3Å; I282-K284 PolarHBondContact O-N 3.05Å
285	D	98.3	Very high	97	Very high	84 Å²	84	64.9 Å²	64.9	45%	0.449	31%	0.31	S	S	.	.	H	α-helix	trans	-76.2	-30.6	-177.1	-63	-28	0	0	0	112.5	R251 D281 I282	R251-D285 IonicContact CZ-OD2 3.86Å; R251-D285 IonicContact NH2-OD2 2.64Å; R251-D285 PolarHBondContact NH2-OD2 2.92Å; D281-D285 PolarHBondContact O-N 3.17Å; I282-D285 PolarHBondContact O-N 3.37Å
286	F	98.4	Very high	96.7	Very high	19 Å²	19	69.7 Å²	69.7	8%	0.083	33%	0.329	C	S	.	.			trans	-127	69.5	179.5	-57.4	-79.1	0	0	0	111.7	D253 I256 K257 L260 I282 K283 E288 G289 I291	D253-F286 HydrophobicContact CB-CZ 3.97Å; I256-F286 HydrophobicContact CB-CE2 4.31Å; I256-F286 HydrophobicContact CB-CZ 4.06Å; I256-F286 HydrophobicContact CG2-CD1 4.25Å; I256-F286 HydrophobicContact CG2-CD2 4Å; I256-F286 HydrophobicContact CG2-CE1 3.99Å; I256-F286 HydrophobicContact CG2-CE2 3.71Å; I256-F286 HydrophobicContact CG2-CG 4.25Å; I256-F286 HydrophobicContact CG2-CZ 3.7Å; K257-F286 HydrophobicContact CB-CE1 3.88Å; K257-F286 HydrophobicContact CG-CE1 4.38Å; L260-F286 HydrophobicContact CD1-CB 4.03Å; L260-F286 HydrophobicContact CD1-CD1 4.13Å; L260-F286 HydrophobicContact CD1-CG 4.19Å; L260-F286 HydrophobicContact CD2-CB 4.33Å; L260-F286 HydrophobicContact CD2-CD1 4.12Å; I282-F286 HydrophobicContact CG1-CD2 3.77Å; I282-F286 HydrophobicContact CG1-CE2 4.33Å; I282-F286 PolarHBondContact O-N 3.5Å; K283-F286 CarbonylContact O-C 3.56Å; F286-E288 PolarHBondContact O-N 3.04Å; F286-G289 PolarHBondContact O-N 3.34Å; F286-I291 HydrophobicContact CB-CD1 3.96Å; F286-I291 WeakPolarHBondContact O-CD1 3.39Å
287	P	97.7	Very high	96.5	Very high	80 Å²	80	70 Å²	70	52%	0.519	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.8	-174.7	23	-33.4	0	0	0	113.1	K283 G289	K283-P287 PolarHBondContact NZ-O 3.26Å; K283-P287 WeakPolarHBondContact O-CA 3.28Å; P287-G289 VanDerWaalsContact C-N 3.28Å; P287-G289 PolarHBondContact O-N 2.94Å
288	E	97.1	Very high	96.3	Very high	176 Å²	176	64.9 Å²	64.9	82%	0.822	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-5.8	178.3	-53.1	-64.3	-172.7	0	0	113.7	F286	F286-E288 PolarHBondContact O-N 3.04Å
289	G	97.3	Very high	96.2	Very high	5 Å²	5	66.2 Å²	66.2	5%	0.052	32%	0.321	C	S	.	.	S	Bend	trans	-71.7	146.5	178.4	0	0	0	0	0	112.7	K283 F286 P287 I291	K283-G289 PolarHBondContact NZ-O 3.39Å; F286-G289 PolarHBondContact O-N 3.34Å; P287-G289 VanDerWaalsContact C-N 3.28Å; P287-G289 PolarHBondContact O-N 2.94Å; G289-I291 VanDerWaalsContact C-N 3.29Å; G289-I291 PolarHBondContact O-N 3.35Å
290	D	97.6	Very high	96.1	Very high	46 Å²	46	64.9 Å²	64.9	25%	0.246	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	84	168.7	-174.3	13	0	0	0	109.8	T264 F265 R292	T264-D290 CarbonylContact C-O 3.26Å; T264-D290 VanDerWaalsContact CA-O 3.3Å; T264-D290 WeakPolarHBondContact CA-O 3.41Å; T264-D290 WeakPolarHBondContact CB-OD2 3.27Å; T264-D290 HydrophobicContact CG2-CB 4.47Å; T264-D290 WeakPolarHBondContact CG2-OD2 3.36Å; T264-D290 PolarHBondContact OG1-OD2 3.07Å; F265-D290 PolarHBondContact N-O 3.44Å; D290-R292 WeakPolarHBondContact OD1-CG 3.46Å; D290-R292 IonicContact OD1-CZ 3.45Å; D290-R292 IonicContact OD1-NE 2.73Å; D290-R292 PolarHBondContact OD1-NE 2.77Å; D290-R292 IonicContact OD1-NH2 3.3Å; D290-R292 PolarHBondContact OD1-NH2 2.91Å; D290-R292 IonicContact OD2-CZ 3.57Å; D290-R292 IonicContact OD2-NE 3.56Å; D290-R292 IonicContact OD2-NH2 2.8Å; D290-R292 PolarHBondContact OD2-NH2 3.12Å
291	I	98.2	Very high	95.8	Very high	8 Å²	8	62.9 Å²	62.9	4%	0.041	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	113.9	-174.7	-56.5	162.5	0	0	0	107.4	F265 Y267 Y279 I282 K283 F286 G289	F265-I291 HydrophobicContact CB-CB 4.4Å; F265-I291 HydrophobicContact CB-CG1 4.27Å; F265-I291 HydrophobicContact CB-CG2 4.15Å; F265-I291 HydrophobicContact CD2-CG1 3.73Å; F265-I291 HydrophobicContact CE2-CG1 4.43Å; F265-I291 HydrophobicContact CG-CG1 4.25Å; Y267-I291 HydrophobicContact CD2-CG2 4.31Å; Y267-I291 HydrophobicContact CE2-CG2 4.14Å; Y279-I291 HydrophobicContact CD2-CG2 3.65Å; Y279-I291 HydrophobicContact CE2-CG2 3.65Å; I282-I291 HydrophobicContact CG1-CD1 4.06Å; I282-I291 HydrophobicContact CG2-CD1 4.21Å; I282-I291 HydrophobicContact CG2-CG2 3.71Å; K283-I291 HydrophobicContact CB-CG2 4.43Å; K283-I291 HydrophobicContact CD-CB 4.14Å; K283-I291 HydrophobicContact CD-CD1 4.27Å; F286-I291 HydrophobicContact CB-CD1 3.96Å; F286-I291 WeakPolarHBondContact O-CD1 3.39Å; G289-I291 VanDerWaalsContact C-N 3.29Å; G289-I291 PolarHBondContact O-N 3.35Å
292	R	96.8	Very high	95.6	Very high	90 Å²	90	60.2 Å²	60.2	34%	0.34	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.7	-170.2	-55	-175.1	-168.1	-179.9	10.3	110.6	F265 Y266 Y267 D290 S317	F265-R292 PolarHBondContact O-N 3.02Å; Y266-R292 HydrophobicContact CD1-CB 3.87Å; Y266-R292 HydrophobicContact CE1-CB 3.97Å; Y266-R292 VanDerWaalsContact CE1-CD 3.46Å; Y266-R292 HydrophobicContact CE1-CG 4.26Å; Y266-R292 PolarHBondContact OH-NH1 3.12Å; Y267-R292 PolarHBondContact N-O 3.29Å; D290-R292 WeakPolarHBondContact OD1-CG 3.46Å; D290-R292 IonicContact OD1-CZ 3.45Å; D290-R292 IonicContact OD1-NE 2.73Å; D290-R292 PolarHBondContact OD1-NE 2.77Å; D290-R292 IonicContact OD1-NH2 3.3Å; D290-R292 PolarHBondContact OD1-NH2 2.91Å; D290-R292 IonicContact OD2-CZ 3.57Å; D290-R292 IonicContact OD2-NE 3.56Å; D290-R292 IonicContact OD2-NH2 2.8Å; D290-R292 PolarHBondContact OD2-NH2 3.12Å; R292-S317 PolarHBondContact NH2-OG 3.05Å
293	L	96.6	Very high	95.3	Very high	35 Å²	35	60.8 Å²	60.8	18%	0.183	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.1	169.6	-175.7	64.6	0	0	0	108.7	T269 K276 Y279 E295	T269-L293 HydrophobicContact CG2-CD1 4.2Å; T269-L293 HydrophobicContact CG2-CD2 4.17Å; T269-L293 HydrophobicContact CG2-CG 4.01Å; K276-L293 HydrophobicContact CD-CD2 4.33Å; K276-L293 HydrophobicContact CG-CD1 4.48Å; K276-L293 HydrophobicContact CG-CD2 4.15Å; Y279-L293 HydrophobicContact CD1-CB 4.07Å; Y279-L293 HydrophobicContact CD1-CD1 4.25Å; Y279-L293 HydrophobicContact CD1-CD2 3.94Å; Y279-L293 HydrophobicContact CD1-CG 4.32Å; Y279-L293 HydrophobicContact CD2-CB 3.98Å; Y279-L293 HydrophobicContact CE1-CB 3.84Å; Y279-L293 HydrophobicContact CE1-CD2 3.95Å; Y279-L293 HydrophobicContact CE1-CG 4.41Å; Y279-L293 HydrophobicContact CE2-CB 3.73Å; Y279-L293 HydrophobicContact CG-CB 4.15Å; Y279-L293 HydrophobicContact CG-CD1 4.11Å; L293-E295 PolarHBondContact O-N 2.97Å
294	C	92	Very high	94.7	Very high	11 Å²	11	58.3 Å²	58.3	7%	0.074	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	106.4	179.7	-170.5	0	0	0	0	110.3	Y267 T269 K296 I298	Y267-C294 WeakPolarHBondContact O-CB 3.31Å; Y267-C294 PolarHBondContact O-N 3.14Å; T269-C294 PolarHBondContact N-O 2.85Å; T269-C294 PolarHBondContact OG1-O 3.33Å; C294-K296 PolarHBondContact O-N 3.23Å; C294-I298 VanDerWaalsContact SG-CD1 3.57Å
295	E	90.4	Very high	94.1	Very high	159 Å²	159	55.3 Å²	55.3	74%	0.743	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-1.7	178.3	-59.7	-172.6	157.5	0	0	113.7	T269 L293 N297	T269-E295 HydrophobicContact CG2-CG 4.43Å; L293-E295 PolarHBondContact O-N 2.97Å; E295-N297 PolarHBondContact O-N 3.09Å; E295-N297 VanDerWaalsContact O-N 3.09Å
296	K	89.6	Confident	93.8	Very high	117 Å²	117	54.4 Å²	54.4	51%	0.509	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	10.3	-179.7	-64.1	-175.9	170.9	-169.1	0	114	C294 I298 E309	C294-K296 PolarHBondContact O-N 3.23Å; K296-I298 HydrophobicContact CB-CD1 4.3Å; K296-I298 HydrophobicContact CB-CG1 3.97Å; K296-I298 PolarHBondContact O-N 2.72Å; K296-E309 HydrophobicContact CD-CG 4.25Å; K296-E309 IonicContact NZ-OE1 2.79Å; K296-E309 PolarHBondContact NZ-OE1 3.3Å
297	N	92.1	Very high	93.6	Very high	94 Å²	94	54.5 Å²	54.5	50%	0.503	28%	0.277	S	S	.	.			trans	51.8	40.6	-177	-60.9	-45.4	0	0	0	113	T269 I270 E295	T269-N297 PolarHBondContact OG1-OD1 3.48Å; I270-N297 HydrophobicContact CD1-CB 4.2Å; I270-N297 VanDerWaalsContact CD1-O 3.24Å; I270-N297 WeakPolarHBondContact CD1-O 3.4Å; I270-N297 HydrophobicContact CG1-CB 4.5Å; I270-N297 HydrophobicContact CG2-CB 4.35Å; E295-N297 PolarHBondContact O-N 3.09Å; E295-N297 VanDerWaalsContact O-N 3.09Å
298	I	93.5	Very high	93.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.271	C	S	.	.			trans	-74.6	125.2	175.7	-58.7	-177.6	0	0	0	108.1	F164 C294 K296 F302 F306 E309 V310	F164-I298 HydrophobicContact CE1-CG2 4.48Å; F164-I298 WeakPolarHBondContact CE1-O 3.49Å; F164-I298 HydrophobicContact CE2-CG2 4.31Å; F164-I298 HydrophobicContact CZ-CB 4.04Å; F164-I298 HydrophobicContact CZ-CG2 3.6Å; C294-I298 VanDerWaalsContact SG-CD1 3.57Å; K296-I298 HydrophobicContact CB-CD1 4.3Å; K296-I298 HydrophobicContact CB-CG1 3.97Å; K296-I298 PolarHBondContact O-N 2.72Å; I298-F302 HydrophobicContact CG2-CB 3.5Å; I298-F302 VanDerWaalsContact CG2-CB 3.5Å; I298-F306 HydrophobicContact CD1-CD1 4.48Å; I298-F306 HydrophobicContact CG1-CD1 3.96Å; I298-F306 HydrophobicContact CG1-CE1 4.46Å; I298-F306 HydrophobicContact CG1-CG 4.3Å; I298-F306 HydrophobicContact CG2-CB 3.75Å; I298-F306 HydrophobicContact CG2-CD1 4.48Å; I298-F306 HydrophobicContact CG2-CD2 4.35Å; I298-F306 HydrophobicContact CG2-CG 3.96Å; I298-E309 HydrophobicContact CD1-CB 4.44Å; I298-E309 HydrophobicContact CD1-CG 4.19Å; I298-V310 HydrophobicContact CD1-CG2 3.93Å; I298-V310 HydrophobicContact CG2-CG2 4.19Å
299	P	94.3	Very high	93.3	Very high	40 Å²	40	50.1 Å²	50.1	26%	0.26	25%	0.249	S	C	.	.			trans	-73.5	161.1	179.1	32	-35.9	0	0	0	111.1	I270 A301 F302 F306	I270-P299 HydrophobicContact CD1-CB 4.39Å; P299-A301 VanDerWaalsContact C-N 3.26Å; P299-A301 PolarHBondContact O-N 3.14Å; P299-F302 PolarHBondContact O-N 2.69Å; P299-F302 VanDerWaalsContact O-N 3.11Å; P299-F306 VanDerWaalsContact CD-CD2 3.46Å; P299-F306 VanDerWaalsContact CD-CE2 3.43Å; P299-F306 HydrophobicContact CG-CD2 3.99Å; P299-F306 HydrophobicContact CG-CE2 3.99Å
300	H	96.1	Very high	93.3	Very high	17 Å²	17	49.9 Å²	49.9	8%	0.079	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-48.4	175	-167	85.4	0	0	0	112.2	H138 S139 F164 D271 W273 F302	H138-H300 AromaticContact NE2-CD2 3.91Å; H138-H300 AromaticContact NE2-NE2 3.97Å; H138-H300 PolarHBondContact NE2-O 2.8Å; S139-H300 WeakPolarHBondContact CB-NE2 3.25Å; S139-H300 PolarHBondContact OG-CE1 3Å; S139-H300 PolarHBondContact OG-NE2 2.97Å; F164-H300 PolarHBondContact O-CE1 3.09Å; D271-H300 WeakPolarHBondContact OD1-CB 3.14Å; D271-H300 IonicContact OD1-CG 3.71Å; D271-H300 IonicContact OD1-ND1 3.76Å; D271-H300 PolarHBondContact OD1-ND1 2.71Å; D271-H300 IonicContact OD2-CE1 3.1Å; D271-H300 IonicContact OD2-CG 2.72Å; D271-H300 IonicContact OD2-ND1 2.54Å; D271-H300 PolarHBondContact OD2-ND1 2.77Å; W273-H300 AromaticContact CD1-CD2 3.48Å; W273-H300 VanDerWaalsContact CD1-CD2 3.48Å; W273-H300 AromaticContact CD1-CE1 3.96Å; W273-H300 AromaticContact CD1-CG 3.44Å; W273-H300 VanDerWaalsContact CD1-CG 3.44Å; W273-H300 AromaticContact CD1-ND1 3.74Å; W273-H300 AromaticContact CD1-NE2 3.8Å; H300-F302 PolarHBondContact O-N 3.44Å
301	A	92.9	Very high	93.3	Very high	48 Å²	48	47.7 Å²	47.7	40%	0.397	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	50	176.8	0	0	0	0	0	113	P299 I303 T304	P299-A301 VanDerWaalsContact C-N 3.26Å; P299-A301 PolarHBondContact O-N 3.14Å; A301-I303 PolarHBondContact O-N 3.19Å; A301-T304 PolarHBondContact O-N 2.95Å; A301-T304 PolarHBondContact O-OG1 3.35Å
302	F	94.3	Very high	93.2	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-25.9	-175.9	78.1	-92.8	0	0	0	113.3	F63 H138 L163 F164 I298 P299 H300 T304 H305 F306 N307 V310	F63-F302 AromaticContact CD2-CE2 3.89Å; F63-F302 HydrophobicContact CD2-CE2 3.89Å; F63-F302 HydrophobicContact CE1-CZ 4.35Å; F63-F302 AromaticContact CE2-CE2 3.87Å; F63-F302 HydrophobicContact CE2-CE2 3.87Å; F63-F302 HydrophobicContact CE2-CZ 4.36Å; F63-F302 HydrophobicContact CG-CE2 4.2Å; F63-F302 HydrophobicContact CZ-CE2 4.17Å; F63-F302 HydrophobicContact CZ-CZ 4.2Å; H138-F302 HydrophobicContact CB-CE1 4.3Å; H138-F302 AromaticContact CD2-CD1 3.9Å; H138-F302 AromaticContact CD2-CE1 3.51Å; H138-F302 AromaticContact CG-CE1 3.91Å; L163-F302 HydrophobicContact CB-CE1 4.22Å; L163-F302 HydrophobicContact CD1-CE1 3.9Å; L163-F302 HydrophobicContact CD1-CZ 3.61Å; F164-F302 AromaticContact CD2-CD1 3.61Å; F164-F302 HydrophobicContact CD2-CD1 3.61Å; F164-F302 HydrophobicContact CD2-CE1 4.14Å; F164-F302 HydrophobicContact CE2-CB 3.91Å; F164-F302 AromaticContact CE2-CD1 3.42Å; F164-F302 HydrophobicContact CE2-CD1 3.42Å; F164-F302 VanDerWaalsContact CE2-CD1 3.42Å; F164-F302 HydrophobicContact CE2-CE1 4.2Å; F164-F302 AromaticContact CE2-CG 3.9Å; F164-F302 HydrophobicContact CE2-CG 3.9Å; F164-F302 HydrophobicContact CZ-CB 4.31Å; I298-F302 HydrophobicContact CG2-CB 3.5Å; I298-F302 VanDerWaalsContact CG2-CB 3.5Å; P299-F302 PolarHBondContact O-N 2.69Å; P299-F302 VanDerWaalsContact O-N 3.11Å; H300-F302 PolarHBondContact O-N 3.44Å; F302-T304 PolarHBondContact O-N 2.88Å; F302-T304 VanDerWaalsContact O-N 3.09Å; F302-H305 PolarHBondContact O-N 3.1Å; F302-F306 HydrophobicContact CB-CB 4.18Å; F302-F306 CarbonylContact O-C 3.56Å; F302-F306 VanDerWaalsContact O-C 3.26Å; F302-F306 VanDerWaalsContact O-CA 3.31Å; F302-F306 WeakPolarHBondContact O-CA 3.09Å; F302-F306 PolarHBondContact O-N 2.97Å; F302-N307 PolarHBondContact O-N 2.97Å; F302-N307 VanDerWaalsContact O-N 3.1Å; F302-V310 HydrophobicContact CB-CG2 4.02Å; F302-V310 HydrophobicContact CD2-CB 3.65Å; F302-V310 HydrophobicContact CD2-CG1 3.94Å; F302-V310 HydrophobicContact CD2-CG2 3.52Å; F302-V310 HydrophobicContact CE2-CB 3.79Å; F302-V310 HydrophobicContact CE2-CG1 3.68Å; F302-V310 HydrophobicContact CE2-CG2 4.15Å; F302-V310 HydrophobicContact CG-CB 4.42Å; F302-V310 HydrophobicContact CG-CG2 3.85Å; F302-V310 HydrophobicContact CZ-CG1 4.07Å
303	I	91.4	Very high	93.1	Very high	12 Å²	12	47.3 Å²	47.3	6%	0.062	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.3	-177.6	54.6	68.7	0	0	0	113.3	F59 Y60 L219 A301 N307	F59-I303 HydrophobicContact CB-CD1 3.87Å; F59-I303 HydrophobicContact CB-CG1 4.36Å; F59-I303 HydrophobicContact CG-CD1 4.43Å; Y60-I303 HydrophobicContact CD1-CG2 3.71Å; Y60-I303 HydrophobicContact CE1-CG2 3.51Å; Y60-I303 HydrophobicContact CE2-CG2 4.47Å; Y60-I303 HydrophobicContact CG-CG2 4.31Å; L219-I303 HydrophobicContact CD1-CD1 4.1Å; L219-I303 WeakPolarHBondContact CD2-O 3.32Å; A301-I303 PolarHBondContact O-N 3.19Å; I303-N307 PolarHBondContact O-ND2 3.06Å
304	T	85.1	Confident	93.1	Very high	18 Å²	18	45.7 Å²	45.7	11%	0.11	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-61.1	179.8	53.7	0	0	0	0	111.7	M217 L219 A301 F302 N307	M217-T304 HydrophobicContact CB-CG2 3.96Å; M217-T304 HydrophobicContact CG-CG2 4.01Å; M217-T304 CarbonylContact O-C 3.54Å; M217-T304 WeakPolarHBondContact O-CA 3.48Å; M217-T304 HydrophobicContact SD-CG2 4.16Å; L219-T304 HydrophobicContact CD1-CG2 4.36Å; A301-T304 PolarHBondContact O-N 2.95Å; A301-T304 PolarHBondContact O-OG1 3.35Å; F302-T304 PolarHBondContact O-N 2.88Å; F302-T304 VanDerWaalsContact O-N 3.09Å; T304-N307 PolarHBondContact O-ND2 2.88Å
305	H	87	Confident	93.3	Very high	103 Å²	103	45.5 Å²	45.5	48%	0.477	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-15.8	-170.2	-61.2	-69.1	0	0	0	114.8	L216 M217 F302	L216-H305 PolarHBondContact O-CE1 3.03Å; L216-H305 VanDerWaalsContact O-CE1 3.25Å; M217-H305 VanDerWaalsContact C-CE1 3.46Å; F302-H305 PolarHBondContact O-N 3.1Å
306	F	92.6	Very high	93.4	Very high	65 Å²	65	42.1 Å²	42.1	29%	0.285	22%	0.217	S	C	.	.			trans	-118.6	16.2	-171.8	-64.5	-89.9	0	0	0	112.8	I298 P299 F302 Q308 E309 V310	I298-F306 HydrophobicContact CD1-CD1 4.48Å; I298-F306 HydrophobicContact CG1-CD1 3.96Å; I298-F306 HydrophobicContact CG1-CE1 4.46Å; I298-F306 HydrophobicContact CG1-CG 4.3Å; I298-F306 HydrophobicContact CG2-CB 3.75Å; I298-F306 HydrophobicContact CG2-CD1 4.48Å; I298-F306 HydrophobicContact CG2-CD2 4.35Å; I298-F306 HydrophobicContact CG2-CG 3.96Å; P299-F306 VanDerWaalsContact CD-CD2 3.46Å; P299-F306 VanDerWaalsContact CD-CE2 3.43Å; P299-F306 HydrophobicContact CG-CD2 3.99Å; P299-F306 HydrophobicContact CG-CE2 3.99Å; F302-F306 HydrophobicContact CB-CB 4.18Å; F302-F306 CarbonylContact O-C 3.56Å; F302-F306 VanDerWaalsContact O-C 3.26Å; F302-F306 VanDerWaalsContact O-CA 3.31Å; F302-F306 WeakPolarHBondContact O-CA 3.09Å; F302-F306 PolarHBondContact O-N 2.97Å; F306-Q308 PolarHBondContact O-N 3.28Å; F306-E309 HydrophobicContact CB-CB 4.38Å; F306-E309 WeakPolarHBondContact O-CB 3.37Å; F306-E309 PolarHBondContact O-N 3.5Å; F306-V310 WeakPolarHBondContact O-CG2 3.28Å; F306-V310 PolarHBondContact O-N 3.24Å
307	N	93	Very high	93.5	Very high	20 Å²	20	37.6 Å²	37.6	11%	0.107	20%	0.2	C	C	.	.	H	α-helix	trans	-55.6	-47.5	-179.9	52	70.7	0	0	0	112.3	P62 F63 F302 I303 T304 E309 V310 A311	P62-N307 HydrophobicContact CB-CB 4.46Å; F63-N307 HydrophobicContact CB-CB 3.83Å; F63-N307 HydrophobicContact CD2-CB 4.46Å; F63-N307 WeakPolarHBondContact CD2-O 3.25Å; F302-N307 PolarHBondContact O-N 2.97Å; F302-N307 VanDerWaalsContact O-N 3.1Å; I303-N307 PolarHBondContact O-ND2 3.06Å; T304-N307 PolarHBondContact O-ND2 2.88Å; N307-E309 PolarHBondContact O-N 3.37Å; N307-V310 PolarHBondContact O-N 2.69Å; N307-A311 VanDerWaalsContact O-CB 3.27Å; N307-A311 WeakPolarHBondContact O-CB 3.45Å; N307-A311 PolarHBondContact O-N 2.89Å
308	Q	94.3	Very high	93.6	Very high	88 Å²	88	33.1 Å²	33.1	41%	0.411	18%	0.176	S	C	.	.	H	α-helix	trans	-63.6	-42	178.2	-174.5	63.2	60.8	0	0	112.2	F306 A311 N312	F306-Q308 PolarHBondContact O-N 3.28Å; Q308-A311 PolarHBondContact O-N 3.45Å; Q308-N312 PolarHBondContact NE2-OD1 3.44Å; Q308-N312 VanDerWaalsContact NE2-OD1 3.09Å; Q308-N312 VanDerWaalsContact O-CG 3.23Å; Q308-N312 PolarHBondContact O-N 3.18Å; Q308-N312 PolarHBondContact O-ND2 2.9Å
309	E	95.4	Very high	93.3	Very high	76 Å²	76	39 Å²	39	36%	0.355	20%	0.202	S	C	.	.	H	α-helix	trans	-60	-49.2	-179.9	-152.7	86.3	-165.9	0	0	110.5	K296 I298 F306 N307 N312 M313	K296-E309 HydrophobicContact CD-CG 4.25Å; K296-E309 IonicContact NZ-OE1 2.79Å; K296-E309 PolarHBondContact NZ-OE1 3.3Å; I298-E309 HydrophobicContact CD1-CB 4.44Å; I298-E309 HydrophobicContact CD1-CG 4.19Å; F306-E309 HydrophobicContact CB-CB 4.38Å; F306-E309 WeakPolarHBondContact O-CB 3.37Å; F306-E309 PolarHBondContact O-N 3.5Å; N307-E309 PolarHBondContact O-N 3.37Å; E309-N312 WeakPolarHBondContact O-CB 3.35Å; E309-N312 PolarHBondContact O-N 2.89Å; E309-M313 WeakPolarHBondContact O-CG 3.27Å; E309-M313 PolarHBondContact O-N 3.11Å
310	V	96.6	Very high	92.8	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-36.2	179.1	177.4	0	0	0	0	111.4	F63 L163 I298 F302 F306 N307 N312 M313 I314	F63-V310 HydrophobicContact CE2-CB 4.3Å; F63-V310 HydrophobicContact CE2-CG1 4Å; F63-V310 HydrophobicContact CZ-CG1 4.43Å; L163-V310 HydrophobicContact CD1-CG1 4Å; L163-V310 HydrophobicContact CD2-CG1 4.4Å; I298-V310 HydrophobicContact CD1-CG2 3.93Å; I298-V310 HydrophobicContact CG2-CG2 4.19Å; F302-V310 HydrophobicContact CB-CG2 4.02Å; F302-V310 HydrophobicContact CD2-CB 3.65Å; F302-V310 HydrophobicContact CD2-CG1 3.94Å; F302-V310 HydrophobicContact CD2-CG2 3.52Å; F302-V310 HydrophobicContact CE2-CB 3.79Å; F302-V310 HydrophobicContact CE2-CG1 3.68Å; F302-V310 HydrophobicContact CE2-CG2 4.15Å; F302-V310 HydrophobicContact CG-CB 4.42Å; F302-V310 HydrophobicContact CG-CG2 3.85Å; F302-V310 HydrophobicContact CZ-CG1 4.07Å; F306-V310 WeakPolarHBondContact O-CG2 3.28Å; F306-V310 PolarHBondContact O-N 3.24Å; N307-V310 PolarHBondContact O-N 2.69Å; V310-N312 VanDerWaalsContact C-N 3.32Å; V310-N312 PolarHBondContact O-N 2.85Å; V310-M313 HydrophobicContact CB-CE 4.42Å; V310-M313 HydrophobicContact CG1-CE 4.24Å; V310-M313 HydrophobicContact CG2-CE 4.23Å; V310-M313 PolarHBondContact O-N 3.34Å; V310-I314 HydrophobicContact CG1-CD1 3.94Å; V310-I314 WeakPolarHBondContact O-CG1 3.21Å; V310-I314 PolarHBondContact O-N 2.96Å
311	A	97.3	Very high	92.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-40.6	174.5	0	0	0	0	0	111.8	F63 A66 L67 L70 N307 Q308 I314 A315	F63-A311 HydrophobicContact CD2-CB 3.88Å; F63-A311 HydrophobicContact CE2-CB 3.92Å; A66-A311 HydrophobicContact CB-CB 3.56Å; L67-A311 HydrophobicContact CD2-CB 4.01Å; L67-A311 HydrophobicContact CG-CB 4.03Å; L70-A311 VanDerWaalsContact CD1-C 3.49Å; L70-A311 HydrophobicContact CD1-CB 3.79Å; N307-A311 VanDerWaalsContact O-CB 3.27Å; N307-A311 WeakPolarHBondContact O-CB 3.45Å; N307-A311 PolarHBondContact O-N 2.89Å; Q308-A311 PolarHBondContact O-N 3.45Å; A311-I314 PolarHBondContact O-N 2.91Å; A311-A315 VanDerWaalsContact O-CB 3.29Å; A311-A315 WeakPolarHBondContact O-CB 3.47Å; A311-A315 PolarHBondContact O-N 3.47Å
312	N	95.9	Very high	91.8	Very high	56 Å²	56	40.9 Å²	40.9	30%	0.299	20%	0.204	S	C	.	.	H	α-helix	trans	-59.8	-47.8	174.3	-68.7	-22.7	0	0	0	111	L70 Q308 E309 V310 I314 A315 D316	L70-N312 VanDerWaalsContact CD1-OD1 3.23Å; L70-N312 WeakPolarHBondContact CD1-OD1 3.38Å; L70-N312 WeakPolarHBondContact CD2-OD1 3.25Å; Q308-N312 PolarHBondContact NE2-OD1 3.44Å; Q308-N312 VanDerWaalsContact NE2-OD1 3.09Å; Q308-N312 VanDerWaalsContact O-CG 3.23Å; Q308-N312 PolarHBondContact O-N 3.18Å; Q308-N312 PolarHBondContact O-ND2 2.9Å; E309-N312 WeakPolarHBondContact O-CB 3.35Å; E309-N312 PolarHBondContact O-N 2.89Å; V310-N312 VanDerWaalsContact C-N 3.32Å; V310-N312 PolarHBondContact O-N 2.85Å; N312-I314 VanDerWaalsContact C-N 3.3Å; N312-I314 PolarHBondContact O-N 2.84Å; N312-A315 PolarHBondContact O-N 3.02Å; N312-D316 WeakPolarHBondContact O-CB 3.24Å; N312-D316 VanDerWaalsContact O-CG 3.27Å; N312-D316 PolarHBondContact O-N 3.46Å
313	M	94.9	Very high	91.1	Very high	34 Å²	34	45.1 Å²	45.1	17%	0.167	23%	0.233	C	C	.	.	H	α-helix	trans	-58.2	-42.3	178.8	-60	-171.7	-35	0	0	112.3	Y266 E309 V310 S317	Y266-M313 HydrophobicContact CD1-CE 3.73Å; Y266-M313 HydrophobicContact CE1-CB 4.44Å; Y266-M313 HydrophobicContact CE1-CE 3.71Å; Y266-M313 HydrophobicContact CE1-SD 4.34Å; Y266-M313 HydrophobicContact CG-CE 4.37Å; E309-M313 WeakPolarHBondContact O-CG 3.27Å; E309-M313 PolarHBondContact O-N 3.11Å; V310-M313 HydrophobicContact CB-CE 4.42Å; V310-M313 HydrophobicContact CG1-CE 4.24Å; V310-M313 HydrophobicContact CG2-CE 4.23Å; V310-M313 PolarHBondContact O-N 3.34Å; M313-S317 WeakPolarHBondContact O-CB 3.4Å; M313-S317 PolarHBondContact O-N 3.43Å; M313-S317 VanDerWaalsContact O-N 3.08Å
314	I	96.3	Very high	90.2	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-70.2	-46.9	179.8	-68.7	167.5	0	0	0	110.8	F63 L67 I136 F161 L163 V310 A311 N312 D316 S317 L318	F63-I314 HydrophobicContact CE2-CD1 3.93Å; F63-I314 HydrophobicContact CZ-CD1 3.5Å; F63-I314 VanDerWaalsContact CZ-CD1 3.5Å; L67-I314 HydrophobicContact CD2-CB 4.02Å; L67-I314 HydrophobicContact CD2-CG2 3.79Å; I136-I314 HydrophobicContact CD1-CD1 4.33Å; I136-I314 HydrophobicContact CD1-CG2 4.16Å; I136-I314 HydrophobicContact CG2-CD1 4.39Å; F161-I314 HydrophobicContact CD1-CG1 4.39Å; F161-I314 HydrophobicContact CD2-CG2 3.86Å; F161-I314 HydrophobicContact CE2-CG2 3.71Å; F161-I314 HydrophobicContact CG-CG1 4.38Å; F161-I314 HydrophobicContact CG-CG2 4.32Å; F161-I314 HydrophobicContact CZ-CG2 4.06Å; L163-I314 HydrophobicContact CD1-CD1 3.79Å; L163-I314 HydrophobicContact CD2-CD1 4.01Å; L163-I314 HydrophobicContact CD2-CG1 4.42Å; L163-I314 HydrophobicContact CG-CD1 4.46Å; V310-I314 HydrophobicContact CG1-CD1 3.94Å; V310-I314 WeakPolarHBondContact O-CG1 3.21Å; V310-I314 PolarHBondContact O-N 2.96Å; A311-I314 PolarHBondContact O-N 2.91Å; N312-I314 VanDerWaalsContact C-N 3.3Å; N312-I314 PolarHBondContact O-N 2.84Å; I314-D316 VanDerWaalsContact C-N 3.31Å; I314-D316 PolarHBondContact O-N 3.24Å; I314-S317 PolarHBondContact O-N 3.18Å; I314-L318 HydrophobicContact CG2-CD1 3.91Å; I314-L318 HydrophobicContact CG2-CG 4.41Å; I314-L318 WeakPolarHBondContact O-CB 3.27Å; I314-L318 WeakPolarHBondContact O-CG 3.2Å; I314-L318 PolarHBondContact O-N 2.77Å
315	A	95.7	Very high	89.5	Confident	8 Å²	8	55.8 Å²	55.8	7%	0.066	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-40.6	179.1	0	0	0	0	0	111.8	L70 A311 N312 L318 K319	L70-A315 HydrophobicContact CB-CB 3.51Å; L70-A315 HydrophobicContact CD1-CB 3.93Å; L70-A315 HydrophobicContact CG-CB 4.26Å; A311-A315 VanDerWaalsContact O-CB 3.29Å; A311-A315 WeakPolarHBondContact O-CB 3.47Å; A311-A315 PolarHBondContact O-N 3.47Å; N312-A315 PolarHBondContact O-N 3.02Å; A315-L318 PolarHBondContact O-N 3.38Å; A315-K319 PolarHBondContact O-N 2.91Å
316	D	93.6	Very high	89.6	Confident	87 Å²	87	53.4 Å²	53.4	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-61	-45.6	174.1	-75.7	-26.8	0	0	0	111.3	N312 I314 L318 K319	N312-D316 WeakPolarHBondContact O-CB 3.24Å; N312-D316 VanDerWaalsContact O-CG 3.27Å; N312-D316 PolarHBondContact O-N 3.46Å; I314-D316 VanDerWaalsContact C-N 3.31Å; I314-D316 PolarHBondContact O-N 3.24Å; D316-L318 PolarHBondContact O-N 3Å; D316-K319 WeakPolarHBondContact O-CB 3.12Å; D316-K319 PolarHBondContact O-N 3.37Å; D316-K319 WeakPolarHBondContact OD1-CE 3.3Å; D316-K319 IonicContact OD1-NZ 2.67Å; D316-K319 PolarHBondContact OD1-NZ 2.91Å
317	S	91.8	Very high	89.4	Confident	22 Å²	22	52.8 Å²	52.8	15%	0.154	27%	0.269	C	S	.	.	H	α-helix	trans	-65.6	-26.5	176.5	-161.5	0	0	0	0	113.3	R292 M313 I314	R292-S317 PolarHBondContact NH2-OG 3.05Å; M313-S317 WeakPolarHBondContact O-CB 3.4Å; M313-S317 PolarHBondContact O-N 3.43Å; M313-S317 VanDerWaalsContact O-N 3.08Å; I314-S317 PolarHBondContact O-N 3.18Å
318	L	92.8	Very high	89.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-81.9	-16.7	179.1	-81.3	174.5	0	0	0	113.6	V134 R159 F161 I314 A315 D316 D320 D321 L322	V134-L318 HydrophobicContact CG1-CD1 4.33Å; V134-L318 HydrophobicContact CG1-CD2 4.21Å; V134-L318 HydrophobicContact CG2-CD2 3.83Å; R159-L318 HydrophobicContact CB-CD2 4.3Å; R159-L318 HydrophobicContact CG-CD2 4.27Å; F161-L318 HydrophobicContact CE2-CD1 4.09Å; F161-L318 HydrophobicContact CE2-CD2 3.69Å; F161-L318 HydrophobicContact CE2-CG 3.69Å; F161-L318 HydrophobicContact CZ-CD2 3.94Å; F161-L318 HydrophobicContact CZ-CG 3.78Å; I314-L318 HydrophobicContact CG2-CD1 3.91Å; I314-L318 HydrophobicContact CG2-CG 4.41Å; I314-L318 WeakPolarHBondContact O-CB 3.27Å; I314-L318 WeakPolarHBondContact O-CG 3.2Å; I314-L318 PolarHBondContact O-N 2.77Å; A315-L318 PolarHBondContact O-N 3.38Å; D316-L318 PolarHBondContact O-N 3Å; L318-D320 VanDerWaalsContact C-N 3.29Å; L318-D320 PolarHBondContact O-N 3.01Å; L318-D321 PolarHBondContact O-N 3.34Å; L318-D321 VanDerWaalsContact O-N 3.09Å; L318-L322 HydrophobicContact CB-CD1 3.86Å; L318-L322 HydrophobicContact CB-CG 4.13Å; L318-L322 WeakPolarHBondContact O-CB 3.12Å; L318-L322 VanDerWaalsContact O-CG 3.23Å; L318-L322 WeakPolarHBondContact O-CG 3.07Å; L318-L322 PolarHBondContact O-N 3.48Å
319	K	89.1	Confident	88.9	Confident	124 Å²	124	52.6 Å²	52.6	54%	0.539	27%	0.27	S	S	.	.	H	α-helix	trans	-51.6	-47.5	-174.1	-80	171.2	177.5	164.7	0	112.6	A315 D316 L322 S323	A315-K319 PolarHBondContact O-N 2.91Å; D316-K319 WeakPolarHBondContact O-CB 3.12Å; D316-K319 PolarHBondContact O-N 3.37Å; D316-K319 WeakPolarHBondContact OD1-CE 3.3Å; D316-K319 IonicContact OD1-NZ 2.67Å; D316-K319 PolarHBondContact OD1-NZ 2.91Å; K319-L322 PolarHBondContact O-N 2.93Å; K319-S323 WeakPolarHBondContact O-CB 3.03Å; K319-S323 PolarHBondContact O-N 2.83Å; K319-S323 PolarHBondContact O-OG 3.22Å
320	D	82.1	Confident	88.5	Confident	112 Å²	112	51.2 Å²	51.2	60%	0.599	27%	0.265	S	S	*	.	H	α-helix	trans	-72.1	-30.9	-177.5	-65.7	-16.2	0	0	0	113.2	L318 S323 K324	L318-D320 VanDerWaalsContact C-N 3.29Å; L318-D320 PolarHBondContact O-N 3.01Å; D320-S323 PolarHBondContact O-OG 3.34Å; D320-S323 VanDerWaalsContact O-OG 3.11Å; D320-K324 VanDerWaalsContact O-CD 3.3Å; D320-K324 WeakPolarHBondContact O-CD 3.26Å; D320-K324 WeakPolarHBondContact O-CE 3.41Å; D320-K324 VanDerWaalsContact O-CG 3.32Å; D320-K324 WeakPolarHBondContact O-CG 3.08Å
321	D	85.3	Confident	88	Confident	25 Å²	25	54.5 Å²	54.5	13%	0.134	28%	0.282	C	S	.	.	H	α-helix	trans	-73	-41.8	176	-66.5	-32.8	0	0	0	110.3	R159 L318 K324	R159-D321 IonicContact CZ-OD1 3.32Å; R159-D321 IonicContact CZ-OD2 3.02Å; R159-D321 IonicContact NE-OD1 3.31Å; R159-D321 IonicContact NE-OD2 3.76Å; R159-D321 PolarHBondContact NE-OD2 3.03Å; R159-D321 VanDerWaalsContact NH2-CG 3.33Å; R159-D321 IonicContact NH2-OD1 3.06Å; R159-D321 PolarHBondContact NH2-OD1 2.94Å; R159-D321 IonicContact NH2-OD2 3.53Å; R159-D321 PolarHBondContact NH2-OD2 2.94Å; L318-D321 PolarHBondContact O-N 3.34Å; L318-D321 VanDerWaalsContact O-N 3.09Å; D321-K324 PolarHBondContact O-N 3.09Å
322	L	83.3	Confident	87.3	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-77.1	-22.3	-178.2	-64	178.5	0	0	0	113.5	L45 T71 F75 L318 K319 K324 M325	L45-L322 HydrophobicContact CD2-CD2 3.46Å; L45-L322 VanDerWaalsContact CD2-CD2 3.46Å; T71-L322 HydrophobicContact CG2-CD1 4.16Å; F75-L322 HydrophobicContact CD2-CD1 4.37Å; F75-L322 HydrophobicContact CD2-CD2 4.17Å; F75-L322 HydrophobicContact CE2-CD1 3.9Å; F75-L322 HydrophobicContact CE2-CD2 3.54Å; F75-L322 HydrophobicContact CE2-CG 4.2Å; F75-L322 HydrophobicContact CZ-CD2 3.95Å; L318-L322 HydrophobicContact CB-CD1 3.86Å; L318-L322 HydrophobicContact CB-CG 4.13Å; L318-L322 WeakPolarHBondContact O-CB 3.12Å; L318-L322 VanDerWaalsContact O-CG 3.23Å; L318-L322 WeakPolarHBondContact O-CG 3.07Å; L318-L322 PolarHBondContact O-N 3.48Å; K319-L322 PolarHBondContact O-N 2.93Å; L322-K324 VanDerWaalsContact C-N 3.3Å; L322-M325 HydrophobicContact CD2-SD 4.44Å
323	S	78.9	Confident	86.7	Confident	88 Å²	88	58.6 Å²	58.6	62%	0.615	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-19.7	175.1	67.4	0	0	0	0	112.9	K319 D320 M325	K319-S323 WeakPolarHBondContact O-CB 3.03Å; K319-S323 PolarHBondContact O-N 2.83Å; K319-S323 PolarHBondContact O-OG 3.22Å; D320-S323 PolarHBondContact O-OG 3.34Å; D320-S323 VanDerWaalsContact O-OG 3.11Å; S323-M325 VanDerWaalsContact C-N 3.31Å
324	K	74.1	Confident	86	Confident	167 Å²	167	60.7 Å²	60.7	73%	0.726	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	0.6	178	-65.7	168.4	-170.9	165.5	0	113	D320 D321 L322	D320-K324 VanDerWaalsContact O-CD 3.3Å; D320-K324 WeakPolarHBondContact O-CD 3.26Å; D320-K324 WeakPolarHBondContact O-CE 3.41Å; D320-K324 VanDerWaalsContact O-CG 3.32Å; D320-K324 WeakPolarHBondContact O-CG 3.08Å; D321-K324 PolarHBondContact O-N 3.09Å; L322-K324 VanDerWaalsContact C-N 3.3Å
325	M	69	Low	85	Confident	87 Å²	87	66.2 Å²	66.2	43%	0.429	34%	0.343	S	S	.	.			trans	-105.7	0	-176.5	-73.6	-169.1	55.4	0	0	112.9	K44 L45 K132 I158 L322 S323	K44-M325 HydrophobicContact CB-CE 4.4Å; L45-M325 HydrophobicContact CB-CE 4.03Å; L45-M325 HydrophobicContact CD1-CE 4.25Å; L45-M325 HydrophobicContact CD1-SD 4.16Å; K132-M325 HydrophobicContact CD-CE 3.58Å; K132-M325 HydrophobicContact CD-SD 4.09Å; I158-M325 HydrophobicContact CD1-SD 3.78Å; L322-M325 HydrophobicContact CD2-SD 4.44Å; S323-M325 VanDerWaalsContact C-N 3.31Å

Retrieved 325 of 325 residues in 2029.3 ms (Link to these results)

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