A0A077ZJE7_TRITR Loading...

tryptophan--tRNA ligase

AlphaFold DB , UniProt , Accession A0A077ZJE7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 313 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	73.3	Confident	84	Confident	54 Å²	54	47.5 Å²	47.5	27%	0.266	25%	0.252	S	S	.	.				0	-48.1	0	-66.6	-158.4	-78.9	0	0	114.2	Q6 A163 V165 I228 A231 V232	M1-Q6 PolarHBondContact O-NE2 3.38Å; M1-Q6 PolarHBondContact O-OE1 3.49Å; M1-A163 HydrophobicContact CB-CB 4.32Å; M1-V165 HydrophobicContact CB-CG2 4.35Å; M1-V165 HydrophobicContact CE-CG2 3.74Å; M1-I228 HydrophobicContact CE-CG1 4.46Å; M1-I228 HydrophobicContact CE-CG2 4.02Å; M1-A231 HydrophobicContact SD-CB 3.59Å; M1-A231 VanDerWaalsContact SD-CB 3.59Å; M1-V232 HydrophobicContact CE-CG2 4.49Å; M1-V232 HydrophobicContact SD-CG2 3.69Å
2	G	72.2	Confident	84.9	Confident	33 Å²	33	53.3 Å²	53.3	34%	0.34	28%	0.283	S	S	.	.			trans	-84.4	-21.1	-174.2	0	0	0	0	0	117.4
3	A	79.4	Confident	85.7	Confident	35 Å²	35	59.8 Å²	59.8	29%	0.289	32%	0.317	S	S	.	.	S	Bend	trans	-137.2	-60.6	-176.9	0	0	0	0	0	112.8	R5 Q6 W7	A3-R5 VanDerWaalsContact C-N 3.27Å; A3-R5 PolarHBondContact O-N 3.3Å; A3-R5 VanDerWaalsContact O-N 3.15Å; A3-Q6 WeakPolarHBondContact O-CA 3.42Å; A3-Q6 WeakPolarHBondContact O-CB 3.46Å; A3-Q6 PolarHBondContact O-N 3.39Å; A3-Q6 PolarHBondContact O-OE1 2.9Å; A3-W7 HydrophobicContact CB-CH2 4.35Å; A3-W7 HydrophobicContact CB-CZ2 3.93Å; A3-W7 PolarHBondContact O-N 3.3Å
4	L	82.7	Confident	86.3	Confident	28 Å²	28	62.7 Å²	62.7	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-33.8	-172.2	-172.2	58.5	0	0	0	113.9	Q6 W7 V8 Y46 C49 I51	L4-Q6 VanDerWaalsContact C-N 3.35Å; L4-W7 HydrophobicContact CD1-CE3 3.83Å; L4-W7 HydrophobicContact CD1-CZ3 4.45Å; L4-W7 PolarHBondContact O-N 2.93Å; L4-V8 WeakPolarHBondContact O-CG2 3.47Å; L4-V8 PolarHBondContact O-N 2.79Å; L4-Y46 HydrophobicContact CD1-CD1 4.19Å; L4-Y46 HydrophobicContact CD1-CE1 4.15Å; L4-C49 HydrophobicContact CD2-CB 3.68Å; L4-C49 WeakPolarHBondContact CD2-SG 3.37Å; L4-C49 HydrophobicContact CG-CB 3.94Å; L4-I51 HydrophobicContact CD1-CD1 4.33Å; L4-I51 HydrophobicContact CD1-CG1 4.27Å
5	R	83.7	Confident	87	Confident	101 Å²	101	66.9 Å²	66.9	38%	0.381	34%	0.34	S	S	.	.	H	α-helix	trans	-67.7	-37.7	176.9	-175.4	174.4	71.4	-178.7	4.6	111.8	A3 V8 N9 A231	A3-R5 VanDerWaalsContact C-N 3.27Å; A3-R5 PolarHBondContact O-N 3.3Å; A3-R5 VanDerWaalsContact O-N 3.15Å; R5-V8 PolarHBondContact O-N 3.06Å; R5-N9 PolarHBondContact O-N 3.38Å; R5-A231 PolarHBondContact NH1-O 3.38Å; R5-A231 PolarHBondContact NH2-O 2.93Å
6	Q	82.8	Confident	87.6	Confident	33 Å²	33	63.6 Å²	63.6	15%	0.154	33%	0.325	C	S	.	.	H	α-helix	trans	-68.5	-42	177.9	-67.5	72.3	-1.2	0	0	109.3	M1 A3 L4 V8 N9 M10	M1-Q6 PolarHBondContact O-NE2 3.38Å; M1-Q6 PolarHBondContact O-OE1 3.49Å; A3-Q6 WeakPolarHBondContact O-CA 3.42Å; A3-Q6 WeakPolarHBondContact O-CB 3.46Å; A3-Q6 PolarHBondContact O-N 3.39Å; A3-Q6 PolarHBondContact O-OE1 2.9Å; L4-Q6 VanDerWaalsContact C-N 3.35Å; Q6-V8 VanDerWaalsContact C-N 3.34Å; Q6-V8 PolarHBondContact O-N 3.01Å; Q6-N9 PolarHBondContact O-N 3.17Å; Q6-N9 VanDerWaalsContact O-N 3.12Å; Q6-M10 VanDerWaalsContact O-CG 3.26Å; Q6-M10 WeakPolarHBondContact O-CG 3.23Å; Q6-M10 PolarHBondContact O-N 3.2Å
7	W	86.2	Confident	88.3	Confident	52 Å²	52	62.8 Å²	62.8	20%	0.197	32%	0.321	C	S	.	.	H	α-helix	trans	-62.4	-38.4	175.5	-61.5	-18.1	0	0	0	113	A3 L4 N9 M10 Y18 P124	A3-W7 HydrophobicContact CB-CH2 4.35Å; A3-W7 HydrophobicContact CB-CZ2 3.93Å; A3-W7 PolarHBondContact O-N 3.3Å; L4-W7 HydrophobicContact CD1-CE3 3.83Å; L4-W7 HydrophobicContact CD1-CZ3 4.45Å; L4-W7 PolarHBondContact O-N 2.93Å; W7-N9 PolarHBondContact O-N 3.38Å; W7-M10 PolarHBondContact O-N 3.35Å; W7-M10 VanDerWaalsContact O-N 3.08Å; W7-Y18 HydrophobicContact CB-CE1 4.27Å; W7-Y18 WeakPolarHBondContact CB-OH 3.22Å; W7-Y18 HydrophobicContact CE3-CE1 4.02Å; W7-Y18 PolarHBondContact O-OH 3.38Å; W7-P124 HydrophobicContact CH2-CG 4.35Å; W7-P124 HydrophobicContact CZ2-CB 3.61Å; W7-P124 HydrophobicContact CZ2-CG 3.7Å
8	V	90.1	Very high	88.8	Confident	25 Å²	25	60.5 Å²	60.5	15%	0.152	31%	0.308	C	S	.	.	H	α-helix	trans	-57.3	-40.5	173	169.8	0	0	0	0	111.3	L4 R5 Q6 M10 Q11 C49 I51	L4-V8 WeakPolarHBondContact O-CG2 3.47Å; L4-V8 PolarHBondContact O-N 2.79Å; R5-V8 PolarHBondContact O-N 3.06Å; Q6-V8 VanDerWaalsContact C-N 3.34Å; Q6-V8 PolarHBondContact O-N 3.01Å; V8-M10 VanDerWaalsContact C-N 3.28Å; V8-M10 PolarHBondContact O-N 3.46Å; V8-Q11 WeakPolarHBondContact O-CG 3.36Å; V8-Q11 PolarHBondContact O-NE2 3.44Å; V8-C49 HydrophobicContact CG2-CB 4.37Å; V8-C49 VanDerWaalsContact CG2-O 3.29Å; V8-C49 WeakPolarHBondContact CG2-O 3.12Å; V8-I51 HydrophobicContact CG2-CD1 3.68Å; V8-I51 HydrophobicContact CG2-CG1 4.34Å
9	N	87.7	Confident	89.3	Confident	116 Å²	116	59.4 Å²	59.4	62%	0.62	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.5	179.6	-65.8	-9.7	0	0	0	114	R5 Q6 W7	R5-N9 PolarHBondContact O-N 3.38Å; Q6-N9 PolarHBondContact O-N 3.17Å; Q6-N9 VanDerWaalsContact O-N 3.12Å; W7-N9 PolarHBondContact O-N 3.38Å
10	M	90.7	Very high	89.8	Confident	30 Å²	30	57.2 Å²	57.2	15%	0.148	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-6	-179.4	-73.8	167.3	58	0	0	113.3	Q6 W7 V8 D12 D13 Y14 F157	Q6-M10 VanDerWaalsContact O-CG 3.26Å; Q6-M10 WeakPolarHBondContact O-CG 3.23Å; Q6-M10 PolarHBondContact O-N 3.2Å; W7-M10 PolarHBondContact O-N 3.35Å; W7-M10 VanDerWaalsContact O-N 3.08Å; V8-M10 VanDerWaalsContact C-N 3.28Å; V8-M10 PolarHBondContact O-N 3.46Å; M10-D12 PolarHBondContact O-N 2.91Å; M10-D13 PolarHBondContact O-N 3.26Å; M10-D13 VanDerWaalsContact O-N 3.12Å; M10-Y14 HydrophobicContact CB-CD2 3.89Å; M10-Y14 HydrophobicContact CE-CD2 3.67Å; M10-Y14 HydrophobicContact CE-CE2 3.77Å; M10-Y14 HydrophobicContact CE-CG 4.15Å; M10-Y14 HydrophobicContact CG-CD2 4.2Å; M10-Y14 HydrophobicContact CG-CE2 4.33Å; M10-Y14 PolarHBondContact O-N 3.21Å; M10-F157 HydrophobicContact CE-CD1 4.32Å; M10-F157 HydrophobicContact CE-CD2 4.39Å; M10-F157 HydrophobicContact CE-CE1 3.49Å; M10-F157 VanDerWaalsContact CE-CE1 3.49Å; M10-F157 HydrophobicContact CE-CE2 3.58Å; M10-F157 HydrophobicContact CE-CZ 3.07Å; M10-F157 HydrophobicContact SD-CE1 3.65Å; M10-F157 HydrophobicContact SD-CZ 3.48Å; M10-F157 WeakPolarHBondContact SD-CZ 3.49Å
11	Q	95.4	Very high	90.2	Very high	16 Å²	16	57.7 Å²	57.7	8%	0.075	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.5	-172.5	-62.2	-180	95	0	0	113.8	V8 G50 K55 S56	V8-Q11 WeakPolarHBondContact O-CG 3.36Å; V8-Q11 PolarHBondContact O-NE2 3.44Å; Q11-G50 PolarHBondContact NE2-O 3.48Å; Q11-K55 HydrophobicContact CB-CB 4.34Å; Q11-K55 HydrophobicContact CB-CD 4.46Å; Q11-S56 WeakPolarHBondContact CG-OG 3.43Å; Q11-S56 PolarHBondContact OE1-OG 2.93Å
12	D	95	Very high	91.4	Very high	117 Å²	117	56.3 Å²	56.3	63%	0.626	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-28.7	176.6	-63	-57.8	0	0	0	112.3	M10 K55	M10-D12 PolarHBondContact O-N 2.91Å; D12-K55 WeakPolarHBondContact OD1-CE 3.48Å; D12-K55 IonicContact OD1-NZ 3.46Å; D12-K55 PolarHBondContact OD1-NZ 3.39Å; D12-K55 IonicContact OD2-NZ 2.92Å; D12-K55 PolarHBondContact OD2-NZ 3.39Å
13	D	94.3	Very high	92.7	Very high	137 Å²	137	56.8 Å²	56.8	73%	0.733	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-20.8	-177.3	-68.8	-20.9	0	0	0	113	M10	M10-D13 PolarHBondContact O-N 3.26Å; M10-D13 VanDerWaalsContact O-N 3.12Å
14	Y	94.9	Very high	93.6	Very high	101 Å²	101	56.4 Å²	56.4	40%	0.396	28%	0.279	S	S	.	.	S	Bend	trans	-132.6	145.4	-176	-64.9	-93.2	0	0	0	111.3	M10 C16 L122	M10-Y14 HydrophobicContact CB-CD2 3.89Å; M10-Y14 HydrophobicContact CE-CD2 3.67Å; M10-Y14 HydrophobicContact CE-CE2 3.77Å; M10-Y14 HydrophobicContact CE-CG 4.15Å; M10-Y14 HydrophobicContact CG-CD2 4.2Å; M10-Y14 HydrophobicContact CG-CE2 4.33Å; M10-Y14 PolarHBondContact O-N 3.21Å; Y14-C16 PolarHBondContact O-N 2.97Å; Y14-L122 HydrophobicContact CD1-CD1 4.24Å; Y14-L122 HydrophobicContact CE1-CD1 3.66Å
15	H	96.2	Very high	94.2	Very high	125 Å²	125	56.6 Å²	56.6	58%	0.579	29%	0.285	S	S	*	.			trans	-76.3	90.9	165	-174.6	65.1	0	0	0	109.8
16	C	97.4	Very high	94.9	Very high	15 Å²	15	56.4 Å²	56.4	10%	0.101	29%	0.29	C	S	.	.			trans	-82	137.5	-176.4	-62.8	0	0	0	0	112.5	Y14 Y18 T57	Y14-C16 PolarHBondContact O-N 2.97Å; C16-Y18 HydrophobicContact CB-CD2 4.34Å; C16-Y18 HydrophobicContact CB-CE2 3.49Å; C16-Y18 VanDerWaalsContact CB-CE2 3.49Å; C16-T57 PolarHBondContact O-N 2.94Å
17	I	98.4	Very high	95.5	Very high	50 Å²	50	55.7 Å²	55.7	26%	0.256	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	123.7	175.8	-56.4	179.9	0	0	0	108.6	T57 F59 Y118	I17-T57 CarbonylContact C-O 3.4Å; I17-T57 WeakPolarHBondContact CA-O 3.47Å; I17-F59 HydrophobicContact CG2-CD1 4.46Å; I17-F59 HydrophobicContact CG2-CE1 3.63Å; I17-Y118 VanDerWaalsContact CD1-CB 3.46Å; I17-Y118 HydrophobicContact CD1-CD1 3.74Å; I17-Y118 HydrophobicContact CD1-CD2 4.31Å; I17-Y118 HydrophobicContact CD1-CG 3.56Å
18	Y	98.3	Very high	95.8	Very high	21 Å²	21	55 Å²	55	8%	0.082	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	103.8	180	-59.3	-81.7	0	0	0	109.7	W7 C16 Y46 I51 T57 I58 F59	W7-Y18 HydrophobicContact CB-CE1 4.27Å; W7-Y18 WeakPolarHBondContact CB-OH 3.22Å; W7-Y18 HydrophobicContact CE3-CE1 4.02Å; W7-Y18 PolarHBondContact O-OH 3.38Å; C16-Y18 HydrophobicContact CB-CD2 4.34Å; C16-Y18 HydrophobicContact CB-CE2 3.49Å; C16-Y18 VanDerWaalsContact CB-CE2 3.49Å; Y18-Y46 HydrophobicContact CD1-CD1 4.01Å; Y18-Y46 AromaticContact CD1-CE1 3.74Å; Y18-Y46 HydrophobicContact CD1-CE1 3.74Å; Y18-Y46 HydrophobicContact CE1-CE1 4.49Å; Y18-Y46 HydrophobicContact CG-CD1 4.27Å; Y18-Y46 HydrophobicContact CG-CE1 4.33Å; Y18-I51 HydrophobicContact CD2-CD1 4.47Å; Y18-I51 HydrophobicContact CD2-CG2 3.57Å; Y18-I51 HydrophobicContact CE1-CD1 3.91Å; Y18-I51 HydrophobicContact CE1-CG1 4.43Å; Y18-I51 HydrophobicContact CE2-CD1 3.7Å; Y18-I51 HydrophobicContact CE2-CG1 4.25Å; Y18-I51 HydrophobicContact CE2-CG2 3.64Å; Y18-I51 HydrophobicContact CG-CG2 4.28Å; Y18-I51 WeakPolarHBondContact OH-CD1 3.41Å; Y18-T57 PolarHBondContact N-O 3.22Å; Y18-I58 WeakPolarHBondContact O-CA 3.4Å; Y18-F59 PolarHBondContact O-N 3.42Å
19	C	98.7	Very high	95.9	Very high	39 Å²	39	62.4 Å²	62.4	26%	0.264	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.2	179.5	-176.3	0	0	0	0	110.6	V21 F59 Q61	C19-V21 HydrophobicContact CB-CG1 4.47Å; C19-V21 PolarHBondContact O-N 2.58Å; C19-F59 HydrophobicContact CB-CE1 3.94Å; C19-F59 HydrophobicContact CB-CE2 4.37Å; C19-F59 HydrophobicContact CB-CZ 3.73Å; C19-Q61 VanDerWaalsContact SG-CB 3.51Å
20	I	98.7	Very high	96.3	Very high	16 Å²	16	61.3 Å²	61.3	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	100.1	171	-55.8	171.4	0	0	0	107.9	D22 T39 T42 L43 F59 V60 Q61	I20-D22 VanDerWaalsContact C-N 3.31Å; I20-D22 PolarHBondContact O-N 3.39Å; I20-T39 HydrophobicContact CG2-CG2 4.02Å; I20-T42 HydrophobicContact CD1-CG2 4.34Å; I20-T42 HydrophobicContact CG1-CG2 4.19Å; I20-T42 HydrophobicContact CG2-CG2 4.25Å; I20-L43 HydrophobicContact CD1-CB 3.66Å; I20-L43 HydrophobicContact CD1-CD1 4.15Å; I20-L43 HydrophobicContact CD1-CG 4.47Å; I20-F59 PolarHBondContact N-O 2.96Å; I20-V60 HydrophobicContact CB-CG2 4.49Å; I20-V60 HydrophobicContact CD1-CG2 4.38Å; I20-Q61 WeakPolarHBondContact O-CB 3.32Å; I20-Q61 PolarHBondContact O-N 2.93Å
21	V	98.4	Very high	96.6	Very high	68 Å²	68	63.8 Å²	63.8	41%	0.412	32%	0.32	S	S	.	.			trans	-77.7	63.3	-167.9	-69.6	0	0	0	0	114.8	C19 Q23 H24 A25 Q61	C19-V21 HydrophobicContact CB-CG1 4.47Å; C19-V21 PolarHBondContact O-N 2.58Å; V21-Q23 VanDerWaalsContact C-N 3.34Å; V21-Q23 PolarHBondContact O-N 3.28Å; V21-H24 HydrophobicContact CB-CB 4.12Å; V21-H24 HydrophobicContact CG2-CB 4.36Å; V21-H24 PolarHBondContact O-N 3.25Å; V21-A25 PolarHBondContact O-N 2.91Å; V21-Q61 VanDerWaalsContact CA-OE1 3.29Å
22	D	98.5	Very high	96.7	Very high	25 Å²	25	66.3 Å²	66.3	13%	0.134	34%	0.343	C	S	.	.	H	α-helix	trans	-69.5	-25.9	-179.5	65.8	-22.7	0	0	0	114	I20 H24 A25 V60 Q61 S62	I20-D22 VanDerWaalsContact C-N 3.31Å; I20-D22 PolarHBondContact O-N 3.39Å; D22-H24 VanDerWaalsContact C-N 3.34Å; D22-A25 WeakPolarHBondContact O-CB 3.43Å; D22-A25 PolarHBondContact O-N 3.07Å; D22-V60 HydrophobicContact CB-CG1 4.37Å; D22-V60 VanDerWaalsContact CG-CG1 3.47Å; D22-V60 WeakPolarHBondContact OD2-CG1 3.33Å; D22-Q61 WeakPolarHBondContact OD1-CB 3.25Å; D22-S62 WeakPolarHBondContact OD1-CB 3.47Å; D22-S62 PolarHBondContact OD1-N 3.3Å; D22-S62 PolarHBondContact OD1-OG 3.35Å; D22-S62 VanDerWaalsContact OD2-CB 3.26Å; D22-S62 WeakPolarHBondContact OD2-CB 3.36Å; D22-S62 PolarHBondContact OD2-OG 2.94Å
23	Q	98.7	Very high	96.9	Very high	43 Å²	43	67.9 Å²	67.9	20%	0.201	35%	0.347	C	S	.	.	H	α-helix	trans	-68.8	-33.5	172.6	-50.5	-178.2	46.9	0	0	111.6	V21 I26 Q61 L110	V21-Q23 VanDerWaalsContact C-N 3.34Å; V21-Q23 PolarHBondContact O-N 3.28Å; Q23-I26 WeakPolarHBondContact O-CG1 3.16Å; Q23-Q61 HydrophobicContact CG-CB 4.4Å; Q23-Q61 HydrophobicContact CG-CG 4.18Å; Q23-Q61 VanDerWaalsContact N-OE1 3.1Å; Q23-Q61 PolarHBondContact NE2-O 3.46Å; Q23-Q61 VanDerWaalsContact NE2-O 3.07Å; Q23-L110 HydrophobicContact CB-CD2 4Å
24	H	97.9	Very high	97	Very high	27 Å²	27	68.6 Å²	68.6	13%	0.125	34%	0.343	C	S	.	.	H	α-helix	trans	-69.5	-32.6	172.4	-74.3	-93.1	0	0	0	112.5	V21 D22 I26 T27 Q61 Y107 D114	V21-H24 HydrophobicContact CB-CB 4.12Å; V21-H24 HydrophobicContact CG2-CB 4.36Å; V21-H24 PolarHBondContact O-N 3.25Å; D22-H24 VanDerWaalsContact C-N 3.34Å; H24-I26 PolarHBondContact O-N 3.46Å; H24-T27 WeakPolarHBondContact O-CB 3.48Å; H24-T27 VanDerWaalsContact O-CG2 3.29Å; H24-T27 WeakPolarHBondContact O-CG2 3.41Å; H24-T27 PolarHBondContact O-N 3.1Å; H24-T27 PolarHBondContact O-OG1 3.23Å; H24-Q61 PolarHBondContact CD2-NE2 3.44Å; H24-Q61 VanDerWaalsContact CD2-NE2 3.28Å; H24-Q61 PolarHBondContact CD2-OE1 3Å; H24-Q61 PolarHBondContact NE2-NE2 2.95Å; H24-Y107 PolarHBondContact CE1-O 3.16Å; H24-Y107 AromaticContact ND1-CD2 3.62Å; H24-D114 IonicContact CD2-OD2 2.79Å; H24-D114 IonicContact CE1-OD2 3.81Å; H24-D114 IonicContact NE2-OD2 3.52Å; H24-D114 PolarHBondContact NE2-OD2 3.47Å
25	A	96.8	Very high	97.2	Very high	32 Å²	32	65.4 Å²	65.4	26%	0.264	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-30.2	-175.7	0	0	0	0	0	113.2	V21 D22 T27 V28 Q30 L35	V21-A25 PolarHBondContact O-N 2.91Å; D22-A25 WeakPolarHBondContact O-CB 3.43Å; D22-A25 PolarHBondContact O-N 3.07Å; A25-T27 VanDerWaalsContact C-N 3.27Å; A25-T27 PolarHBondContact O-N 2.84Å; A25-V28 VanDerWaalsContact O-O 3.04Å; A25-Q30 PolarHBondContact O-NE2 3.35Å; A25-L35 HydrophobicContact CB-CD1 3.82Å
26	I	97.5	Very high	97.3	Very high	96 Å²	96	67.2 Å²	67.2	49%	0.492	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.4	-178.1	60.2	164.7	0	0	0	114.3	Q23 H24 V28 Q30 L35	Q23-I26 WeakPolarHBondContact O-CG1 3.16Å; H24-I26 PolarHBondContact O-N 3.46Å; I26-V28 CarbonylContact C-O 3.47Å; I26-V28 PolarHBondContact O-N 3.22Å; I26-Q30 HydrophobicContact CG2-CG 4.47Å; I26-L35 HydrophobicContact CG2-CD2 3.73Å
27	T	95.4	Very high	97.3	Very high	19 Å²	19	71.8 Å²	71.8	12%	0.117	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-19.8	167.2	60.3	0	0	0	0	112.2	H24 A25 N101 G103	H24-T27 WeakPolarHBondContact O-CB 3.48Å; H24-T27 VanDerWaalsContact O-CG2 3.29Å; H24-T27 WeakPolarHBondContact O-CG2 3.41Å; H24-T27 PolarHBondContact O-N 3.1Å; H24-T27 PolarHBondContact O-OG1 3.23Å; A25-T27 VanDerWaalsContact C-N 3.27Å; A25-T27 PolarHBondContact O-N 2.84Å; T27-N101 PolarHBondContact O-ND2 3.4Å; T27-G103 WeakPolarHBondContact CG2-O 3.19Å
28	V	92.2	Very high	97.3	Very high	37 Å²	37	71.4 Å²	71.4	22%	0.224	36%	0.358	C	S	.	.	S	Bend	trans	-117.3	141.6	164.3	-179.7	0	0	0	0	107.7	A25 I26 Q30 Y96	A25-V28 VanDerWaalsContact O-O 3.04Å; I26-V28 CarbonylContact C-O 3.47Å; I26-V28 PolarHBondContact O-N 3.22Å; V28-Q30 WeakPolarHBondContact O-CG 3.18Å; V28-Q30 PolarHBondContact O-N 3.2Å; V28-Q30 PolarHBondContact O-NE2 2.87Å; V28-Y96 HydrophobicContact CG1-CE1 4.21Å; V28-Y96 HydrophobicContact CG2-CE2 4.27Å
29	R	93.9	Very high	97.3	Very high	180 Å²	180	71.3 Å²	71.3	68%	0.679	36%	0.359	S	S	*	.			trans	-58.7	128.8	-178.3	-66.9	-67.6	178.7	-115.7	-0.4	111
30	Q	94.4	Very high	97.3	Very high	94 Å²	94	70.6 Å²	70.6	44%	0.439	35%	0.353	S	S	.	.			trans	-112.6	150.6	179.9	-60	-60.2	-36.4	0	0	110.4	A25 I26 V28 L35	A25-Q30 PolarHBondContact O-NE2 3.35Å; I26-Q30 HydrophobicContact CG2-CG 4.47Å; V28-Q30 WeakPolarHBondContact O-CG 3.18Å; V28-Q30 PolarHBondContact O-N 3.2Å; V28-Q30 PolarHBondContact O-NE2 2.87Å; Q30-L35 HydrophobicContact CB-CB 4.15Å; Q30-L35 HydrophobicContact CB-CD2 4.29Å; Q30-L35 HydrophobicContact CG-CD1 4.45Å; Q30-L35 HydrophobicContact CG-CD2 4.25Å
31	D	97.7	Very high	97.3	Very high	81 Å²	81	71.2 Å²	71.2	43%	0.433	36%	0.356	S	S	.	.			trans	-75.1	127.5	158	173.8	-83.9	0	0	0	108.7	Q33 K34 L35	D31-Q33 VanDerWaalsContact C-N 3.32Å; D31-Q33 PolarHBondContact O-N 3.12Å; D31-Q33 PolarHBondContact OD1-N 2.95Å; D31-K34 HydrophobicContact CB-CB 3.99Å; D31-K34 HydrophobicContact CB-CD 3.91Å; D31-K34 HydrophobicContact CB-CG 3.98Å; D31-K34 PolarHBondContact O-N 3.02Å; D31-K34 WeakPolarHBondContact OD1-CG 3.36Å; D31-K34 PolarHBondContact OD1-N 3.42Å; D31-L35 PolarHBondContact O-N 3.46Å
32	A	97.9	Very high	97.2	Very high	69 Å²	69	70.3 Å²	70.3	57%	0.57	35%	0.351	S	S	*	.	H	α-helix	trans	-63.3	-36.1	-171.5	0	0	0	0	0	113.1	R36	A32-R36 PolarHBondContact O-N 2.96Å
33	Q	98	Very high	97.2	Very high	150 Å²	150	69.2 Å²	69.2	70%	0.701	35%	0.345	S	S	*	.	H	α-helix	trans	-74	-40.5	178.4	-66.5	-176.5	-9.8	0	0	110.8	D31 R36 K37	D31-Q33 VanDerWaalsContact C-N 3.32Å; D31-Q33 PolarHBondContact O-N 3.12Å; D31-Q33 PolarHBondContact OD1-N 2.95Å; Q33-R36 PolarHBondContact O-N 3.29Å; Q33-K37 WeakPolarHBondContact O-CB 3.41Å; Q33-K37 PolarHBondContact O-N 3.43Å
34	K	97.7	Very high	97.2	Very high	152 Å²	152	67.1 Å²	67.1	66%	0.661	34%	0.335	S	S	*	.	H	α-helix	trans	-63.4	-42	175.2	-68.5	-177.7	-170.6	171.7	0	112	D31 K37 A38	D31-K34 HydrophobicContact CB-CB 3.99Å; D31-K34 HydrophobicContact CB-CD 3.91Å; D31-K34 HydrophobicContact CB-CG 3.98Å; D31-K34 PolarHBondContact O-N 3.02Å; D31-K34 WeakPolarHBondContact OD1-CG 3.36Å; D31-K34 PolarHBondContact OD1-N 3.42Å; K34-K37 PolarHBondContact O-N 3.46Å; K34-A38 WeakPolarHBondContact O-CB 3.43Å; K34-A38 PolarHBondContact O-N 3.31Å
35	L	98.4	Very high	97.2	Very high	34 Å²	34	67.5 Å²	67.5	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-61.4	-50.4	176.8	179.4	60	0	0	0	110.8	A25 I26 Q30 D31 K37 A38 T39	A25-L35 HydrophobicContact CB-CD1 3.82Å; I26-L35 HydrophobicContact CG2-CD2 3.73Å; Q30-L35 HydrophobicContact CB-CB 4.15Å; Q30-L35 HydrophobicContact CB-CD2 4.29Å; Q30-L35 HydrophobicContact CG-CD1 4.45Å; Q30-L35 HydrophobicContact CG-CD2 4.25Å; D31-L35 PolarHBondContact O-N 3.46Å; L35-K37 VanDerWaalsContact C-N 3.31Å; L35-K37 PolarHBondContact O-N 3.22Å; L35-A38 PolarHBondContact O-N 3.07Å; L35-A38 VanDerWaalsContact O-N 3.13Å; L35-T39 PolarHBondContact O-N 2.75Å; L35-T39 PolarHBondContact O-OG1 2.97Å; L35-T39 VanDerWaalsContact O-OG1 3.13Å
36	R	98.4	Very high	97.3	Very high	164 Å²	164	68.9 Å²	68.9	62%	0.619	34%	0.337	S	S	*	.	H	α-helix	trans	-56.5	-45.8	177	-174.4	179.5	-62.6	105.7	2.3	111.8	A32 Q33 T39 L40	A32-R36 PolarHBondContact O-N 2.96Å; Q33-R36 PolarHBondContact O-N 3.29Å; R36-T39 PolarHBondContact O-N 2.81Å; R36-L40 PolarHBondContact O-N 3.25Å
37	K	98	Very high	97.3	Very high	110 Å²	110	64.6 Å²	64.6	48%	0.478	32%	0.315	S	S	.	.	H	α-helix	trans	-62.4	-45.3	177.1	-171.6	-174.7	177.3	-64.5	0	111.2	Q33 K34 L35 T39 L40 D41	Q33-K37 WeakPolarHBondContact O-CB 3.41Å; Q33-K37 PolarHBondContact O-N 3.43Å; K34-K37 PolarHBondContact O-N 3.46Å; L35-K37 VanDerWaalsContact C-N 3.31Å; L35-K37 PolarHBondContact O-N 3.22Å; K37-T39 VanDerWaalsContact C-N 3.35Å; K37-T39 PolarHBondContact O-N 3.36Å; K37-L40 PolarHBondContact O-N 3.03Å; K37-D41 IonicContact NZ-OD1 2.74Å; K37-D41 PolarHBondContact NZ-OD1 3.46Å; K37-D41 IonicContact NZ-OD2 3.28Å; K37-D41 PolarHBondContact NZ-OD2 3.02Å; K37-D41 WeakPolarHBondContact O-CB 3.36Å; K37-D41 PolarHBondContact O-N 3.34Å
38	A	97.7	Very high	97.4	Very high	43 Å²	43	63.8 Å²	63.8	36%	0.355	31%	0.31	S	S	.	.	H	α-helix	trans	-65.1	-35	-178.7	0	0	0	0	0	112.9	K34 L35 D41 T42	K34-A38 WeakPolarHBondContact O-CB 3.43Å; K34-A38 PolarHBondContact O-N 3.31Å; L35-A38 PolarHBondContact O-N 3.07Å; L35-A38 VanDerWaalsContact O-N 3.13Å; A38-D41 PolarHBondContact O-N 2.89Å; A38-T42 WeakPolarHBondContact O-CB 3.24Å; A38-T42 PolarHBondContact O-N 3.1Å; A38-T42 PolarHBondContact O-OG1 3.32Å
39	T	98.6	Very high	97.6	Very high	18 Å²	18	63.3 Å²	63.3	11%	0.11	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-50.4	172.6	-59.9	0	0	0	0	110.7	I20 L35 R36 K37 T42 L43 V60	I20-T39 HydrophobicContact CG2-CG2 4.02Å; L35-T39 PolarHBondContact O-N 2.75Å; L35-T39 PolarHBondContact O-OG1 2.97Å; L35-T39 VanDerWaalsContact O-OG1 3.13Å; R36-T39 PolarHBondContact O-N 2.81Å; K37-T39 VanDerWaalsContact C-N 3.35Å; K37-T39 PolarHBondContact O-N 3.36Å; T39-T42 PolarHBondContact O-N 3.45Å; T39-L43 PolarHBondContact O-N 3.37Å; T39-V60 HydrophobicContact CG2-CB 4.46Å; T39-V60 HydrophobicContact CG2-CG1 3.88Å; T39-V60 HydrophobicContact CG2-CG2 3.66Å
40	L	98.5	Very high	97.7	Very high	25 Å²	25	55.7 Å²	55.7	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-38.1	177.8	-63.4	176.5	0	0	0	112.6	R36 K37 T42 L43 A44 L281 M285	R36-L40 PolarHBondContact O-N 3.25Å; K37-L40 PolarHBondContact O-N 3.03Å; L40-T42 VanDerWaalsContact C-N 3.29Å; L40-T42 PolarHBondContact O-N 3.17Å; L40-L43 PolarHBondContact O-N 3.29Å; L40-A44 WeakPolarHBondContact O-CB 3.26Å; L40-A44 PolarHBondContact O-N 2.82Å; L40-L281 HydrophobicContact CB-CD1 4.48Å; L40-L281 HydrophobicContact CD2-CD1 4.37Å; L40-M285 HydrophobicContact CD2-CE 3.76Å; L40-M285 HydrophobicContact CD2-SD 3.99Å
41	D	98.1	Very high	97.9	Very high	29 Å²	29	51.4 Å²	51.4	16%	0.155	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-39.9	174.4	-65.7	-12.3	0	0	0	110.6	K37 A38 L45 Y271 R275	K37-D41 IonicContact NZ-OD1 2.74Å; K37-D41 PolarHBondContact NZ-OD1 3.46Å; K37-D41 IonicContact NZ-OD2 3.28Å; K37-D41 PolarHBondContact NZ-OD2 3.02Å; K37-D41 WeakPolarHBondContact O-CB 3.36Å; K37-D41 PolarHBondContact O-N 3.34Å; A38-D41 PolarHBondContact O-N 2.89Å; D41-L45 WeakPolarHBondContact O-CB 3.25Å; D41-L45 PolarHBondContact O-N 3.31Å; D41-Y271 WeakPolarHBondContact O-CE2 3.21Å; D41-Y271 PolarHBondContact OD1-OH 3.28Å; D41-R275 IonicContact OD1-CZ 3.59Å; D41-R275 IonicContact OD1-NE 2.73Å; D41-R275 PolarHBondContact OD1-NE 2.95Å; D41-R275 IonicContact OD1-NH2 3.55Å
42	T	98	Very high	97.9	Very high	49 Å²	49	49.9 Å²	49.9	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-66.6	-47.1	177.5	-59.6	0	0	0	0	110.8	I20 A38 T39 L40 L45 Y46	I20-T42 HydrophobicContact CD1-CG2 4.34Å; I20-T42 HydrophobicContact CG1-CG2 4.19Å; I20-T42 HydrophobicContact CG2-CG2 4.25Å; A38-T42 WeakPolarHBondContact O-CB 3.24Å; A38-T42 PolarHBondContact O-N 3.1Å; A38-T42 PolarHBondContact O-OG1 3.32Å; T39-T42 PolarHBondContact O-N 3.45Å; L40-T42 VanDerWaalsContact C-N 3.29Å; L40-T42 PolarHBondContact O-N 3.17Å; T42-L45 PolarHBondContact O-N 3.26Å; T42-Y46 HydrophobicContact CG2-CD2 3.92Å; T42-Y46 HydrophobicContact CG2-CE2 3.67Å; T42-Y46 WeakPolarHBondContact O-CD2 3.4Å; T42-Y46 PolarHBondContact O-N 3.08Å
43	L	98.5	Very high	97.9	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-56.7	-54	176.8	178.7	59.5	0	0	0	111.4	I20 T39 L40 L45 Y46 L47 I58 L281 V284 M285	I20-L43 HydrophobicContact CD1-CB 3.66Å; I20-L43 HydrophobicContact CD1-CD1 4.15Å; I20-L43 HydrophobicContact CD1-CG 4.47Å; T39-L43 PolarHBondContact O-N 3.37Å; L40-L43 PolarHBondContact O-N 3.29Å; L43-L45 PolarHBondContact O-N 3.27Å; L43-Y46 PolarHBondContact O-N 3.22Å; L43-Y46 VanDerWaalsContact O-N 3.16Å; L43-L47 HydrophobicContact CD1-CD1 4.21Å; L43-L47 HydrophobicContact CD1-CG 4.4Å; L43-L47 HydrophobicContact CG-CD1 4.07Å; L43-L47 WeakPolarHBondContact O-CG 3.46Å; L43-L47 PolarHBondContact O-N 3.13Å; L43-L47 VanDerWaalsContact O-N 3.08Å; L43-I58 HydrophobicContact CD1-CD1 3.6Å; L43-I58 HydrophobicContact CD1-CG1 3.83Å; L43-L281 HydrophobicContact CD2-CB 4.32Å; L43-L281 HydrophobicContact CD2-CD2 4.04Å; L43-L281 HydrophobicContact CG-CD2 4.18Å; L43-V284 HydrophobicContact CD1-CG1 4.12Å; L43-M285 HydrophobicContact CD2-CG 3.42Å; L43-M285 VanDerWaalsContact CD2-CG 3.42Å; L43-M285 HydrophobicContact CD2-SD 4.02Å
44	A	98.5	Very high	97.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-34.7	179.7	0	0	0	0	0	112.3	L40 A48 Y271 F274 R275 L281	L40-A44 WeakPolarHBondContact O-CB 3.26Å; L40-A44 PolarHBondContact O-N 2.82Å; A44-A48 WeakPolarHBondContact O-CB 3.4Å; A44-A48 PolarHBondContact O-N 2.82Å; A44-Y271 HydrophobicContact CB-CD2 3.84Å; A44-Y271 HydrophobicContact CB-CE2 3.72Å; A44-F274 HydrophobicContact CB-CB 4.22Å; A44-R275 HydrophobicContact CB-CB 3.79Å; A44-R275 HydrophobicContact CB-CG 4.42Å; A44-L281 HydrophobicContact CB-CD2 4.39Å
45	L	97.6	Very high	97.9	Very high	34 Å²	34	46.3 Å²	46.3	18%	0.178	23%	0.232	C	C	.	.	H	α-helix	trans	-69.3	-40	177.2	-177.3	62	0	0	0	112.5	D41 T42 L43 A48 C49 L188 L189 L267 Y271	D41-L45 WeakPolarHBondContact O-CB 3.25Å; D41-L45 PolarHBondContact O-N 3.31Å; T42-L45 PolarHBondContact O-N 3.26Å; L43-L45 PolarHBondContact O-N 3.27Å; L45-A48 PolarHBondContact O-N 2.79Å; L45-C49 PolarHBondContact O-N 3.34Å; L45-C49 PolarHBondContact O-SG 3.25Å; L45-C49 VanDerWaalsContact O-SG 3.36Å; L45-L188 HydrophobicContact CD1-CB 4.09Å; L45-L188 HydrophobicContact CD1-CD1 4.12Å; L45-L188 HydrophobicContact CD2-CD1 4.28Å; L45-L188 HydrophobicContact CG-CD1 4.46Å; L45-L189 HydrophobicContact CD1-CD2 4.09Å; L45-L189 HydrophobicContact CD1-CG 4.32Å; L45-L267 HydrophobicContact CD1-CD2 3.84Å; L45-Y271 HydrophobicContact CB-CD2 4.16Å; L45-Y271 HydrophobicContact CB-CE2 4.28Å
46	Y	97.5	Very high	97.8	Very high	61 Å²	61	44.7 Å²	44.7	24%	0.239	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-45.1	175.3	-86.1	-123.1	0	0	0	110.9	L4 Y18 T42 L43 A48 C49 G50 I51 I58	L4-Y46 HydrophobicContact CD1-CD1 4.19Å; L4-Y46 HydrophobicContact CD1-CE1 4.15Å; Y18-Y46 HydrophobicContact CD1-CD1 4.01Å; Y18-Y46 AromaticContact CD1-CE1 3.74Å; Y18-Y46 HydrophobicContact CD1-CE1 3.74Å; Y18-Y46 HydrophobicContact CE1-CE1 4.49Å; Y18-Y46 HydrophobicContact CG-CD1 4.27Å; Y18-Y46 HydrophobicContact CG-CE1 4.33Å; T42-Y46 HydrophobicContact CG2-CD2 3.92Å; T42-Y46 HydrophobicContact CG2-CE2 3.67Å; T42-Y46 WeakPolarHBondContact O-CD2 3.4Å; T42-Y46 PolarHBondContact O-N 3.08Å; L43-Y46 PolarHBondContact O-N 3.22Å; L43-Y46 VanDerWaalsContact O-N 3.16Å; Y46-A48 PolarHBondContact O-N 2.96Å; Y46-C49 PolarHBondContact O-N 3.05Å; Y46-G50 PolarHBondContact O-N 2.78Å; Y46-I51 HydrophobicContact CD1-CG1 4.04Å; Y46-I51 WeakPolarHBondContact O-CB 3.36Å; Y46-I51 PolarHBondContact O-N 2.96Å; Y46-I58 HydrophobicContact CD1-CD1 4.18Å; Y46-I58 HydrophobicContact CG-CD1 4.22Å
47	L	98	Very high	97.9	Very high	7 Å²	7	37.4 Å²	37.4	4%	0.037	20%	0.197	C	C	.	.	H	α-helix	trans	-60.8	-43.8	174.6	-62.3	169.7	0	0	0	111.5	L43 C49 G50 I51 P53 R270 F274 F280 L281 V284	L43-L47 HydrophobicContact CD1-CD1 4.21Å; L43-L47 HydrophobicContact CD1-CG 4.4Å; L43-L47 HydrophobicContact CG-CD1 4.07Å; L43-L47 WeakPolarHBondContact O-CG 3.46Å; L43-L47 PolarHBondContact O-N 3.13Å; L43-L47 VanDerWaalsContact O-N 3.08Å; L47-C49 VanDerWaalsContact C-N 3.27Å; L47-C49 PolarHBondContact O-N 2.88Å; L47-G50 WeakPolarHBondContact O-CA 3.46Å; L47-G50 PolarHBondContact O-N 3.41Å; L47-I51 WeakPolarHBondContact CD2-O 3.39Å; L47-P53 HydrophobicContact CD2-CG 4.2Å; L47-R270 PolarHBondContact O-NH2 3.41Å; L47-F274 HydrophobicContact CB-CD2 3.75Å; L47-F274 HydrophobicContact CB-CE2 3.94Å; L47-F274 HydrophobicContact CB-CG 4.22Å; L47-F280 HydrophobicContact CD1-CE1 4Å; L47-L281 HydrophobicContact CD1-CD2 3.84Å; L47-V284 HydrophobicContact CD1-CG1 4.5Å; L47-V284 HydrophobicContact CD2-CG1 4.4Å
48	A	97.6	Very high	97.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-28	176.3	0	0	0	0	0	113.6	A44 L45 Y46 G50 R270 F274	A44-A48 WeakPolarHBondContact O-CB 3.4Å; A44-A48 PolarHBondContact O-N 2.82Å; L45-A48 PolarHBondContact O-N 2.79Å; Y46-A48 PolarHBondContact O-N 2.96Å; A48-G50 VanDerWaalsContact C-N 3.3Å; A48-R270 HydrophobicContact CB-CB 4.05Å; A48-R270 PolarHBondContact O-NE 3.05Å; A48-R270 VanDerWaalsContact O-NE 3.15Å; A48-R270 PolarHBondContact O-NH1 3.02Å; A48-R270 PolarHBondContact O-NH2 2.81Å; A48-F274 HydrophobicContact CB-CD2 4.29Å
49	C	96.2	Very high	98	Very high	28 Å²	28	30.1 Å²	30.1	19%	0.189	16%	0.158	C	C	.	.	H	α-helix	trans	-76.3	-17.9	171.4	-72.9	0	0	0	0	113.1	L4 V8 L45 Y46 L47	L4-C49 HydrophobicContact CD2-CB 3.68Å; L4-C49 WeakPolarHBondContact CD2-SG 3.37Å; L4-C49 HydrophobicContact CG-CB 3.94Å; V8-C49 HydrophobicContact CG2-CB 4.37Å; V8-C49 VanDerWaalsContact CG2-O 3.29Å; V8-C49 WeakPolarHBondContact CG2-O 3.12Å; L45-C49 PolarHBondContact O-N 3.34Å; L45-C49 PolarHBondContact O-SG 3.25Å; L45-C49 VanDerWaalsContact O-SG 3.36Å; Y46-C49 PolarHBondContact O-N 3.05Å; L47-C49 VanDerWaalsContact C-N 3.27Å; L47-C49 PolarHBondContact O-N 2.88Å
50	G	96.9	Very high	98	Very high	19 Å²	19	29.3 Å²	29.3	20%	0.196	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	110	14.7	178.3	0	0	0	0	0	114.8	Q11 Y46 L47 A48 D52	Q11-G50 PolarHBondContact NE2-O 3.48Å; Y46-G50 PolarHBondContact O-N 2.78Å; L47-G50 WeakPolarHBondContact O-CA 3.46Å; L47-G50 PolarHBondContact O-N 3.41Å; A48-G50 VanDerWaalsContact C-N 3.3Å; G50-D52 PolarHBondContact O-N 3.08Å
51	I	97.7	Very high	98	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	15%	0.147	C	C	.	.			trans	-65.5	121.1	166	-59.3	-51.8	0	0	0	108.1	L4 V8 Y18 Y46 L47 I58	L4-I51 HydrophobicContact CD1-CD1 4.33Å; L4-I51 HydrophobicContact CD1-CG1 4.27Å; V8-I51 HydrophobicContact CG2-CD1 3.68Å; V8-I51 HydrophobicContact CG2-CG1 4.34Å; Y18-I51 HydrophobicContact CD2-CD1 4.47Å; Y18-I51 HydrophobicContact CD2-CG2 3.57Å; Y18-I51 HydrophobicContact CE1-CD1 3.91Å; Y18-I51 HydrophobicContact CE1-CG1 4.43Å; Y18-I51 HydrophobicContact CE2-CD1 3.7Å; Y18-I51 HydrophobicContact CE2-CG1 4.25Å; Y18-I51 HydrophobicContact CE2-CG2 3.64Å; Y18-I51 HydrophobicContact CG-CG2 4.28Å; Y18-I51 WeakPolarHBondContact OH-CD1 3.41Å; Y46-I51 HydrophobicContact CD1-CG1 4.04Å; Y46-I51 WeakPolarHBondContact O-CB 3.36Å; Y46-I51 PolarHBondContact O-N 2.96Å; L47-I51 WeakPolarHBondContact CD2-O 3.39Å; I51-I58 HydrophobicContact CG2-CB 4.44Å; I51-I58 HydrophobicContact CG2-CD1 4.14Å
52	D	97.8	Very high	98	Very high	49 Å²	49	29.6 Å²	29.6	26%	0.262	16%	0.159	S	C	.	.			trans	-100.7	113.5	-174.7	-175.9	-16.3	0	0	0	108.9	G50 E54 K55 S56	G50-D52 PolarHBondContact O-N 3.08Å; D52-E54 PolarHBondContact O-N 3.49Å; D52-E54 WeakPolarHBondContact OD1-CB 3.41Å; D52-E54 PolarHBondContact OD1-N 3.19Å; D52-K55 HydrophobicContact CB-CB 4.22Å; D52-K55 HydrophobicContact CB-CD 4.31Å; D52-K55 HydrophobicContact CB-CG 4.21Å; D52-K55 PolarHBondContact O-N 2.99Å; D52-S56 WeakPolarHBondContact O-CB 3.21Å; D52-S56 PolarHBondContact O-N 3.28Å
53	P	97.9	Very high	98.1	Very high	33 Å²	33	31.3 Å²	31.3	21%	0.214	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.4	-179.3	29.9	-35.5	0	0	0	113.7	L47 S56 I58 V284 K291	L47-P53 HydrophobicContact CD2-CG 4.2Å; P53-S56 CarbonylContact C-O 3.48Å; P53-S56 VanDerWaalsContact O-O 3.09Å; P53-I58 HydrophobicContact CB-CG2 3.86Å; P53-V284 HydrophobicContact CB-CG1 3.98Å; P53-V284 HydrophobicContact CG-CG1 4.36Å; P53-V284 HydrophobicContact CG-CG2 4.23Å; P53-K291 PolarHBondContact O-NZ 2.82Å
54	E	97.5	Very high	98.1	Very high	165 Å²	165	31.2 Å²	31.2	77%	0.771	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-38.2	172.8	-59.6	-169.6	144.4	0	0	111.3	D52	D52-E54 PolarHBondContact O-N 3.49Å; D52-E54 WeakPolarHBondContact OD1-CB 3.41Å; D52-E54 PolarHBondContact OD1-N 3.19Å
55	K	97.6	Very high	98.1	Very high	98 Å²	98	34.9 Å²	34.9	43%	0.426	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-37.3	179.4	-60.3	-175.4	179.4	-164	0	113.7	Q11 D12 D52	Q11-K55 HydrophobicContact CB-CB 4.34Å; Q11-K55 HydrophobicContact CB-CD 4.46Å; D12-K55 WeakPolarHBondContact OD1-CE 3.48Å; D12-K55 IonicContact OD1-NZ 3.46Å; D12-K55 PolarHBondContact OD1-NZ 3.39Å; D12-K55 IonicContact OD2-NZ 2.92Å; D12-K55 PolarHBondContact OD2-NZ 3.39Å; D52-K55 HydrophobicContact CB-CB 4.22Å; D52-K55 HydrophobicContact CB-CD 4.31Å; D52-K55 HydrophobicContact CB-CG 4.21Å; D52-K55 PolarHBondContact O-N 2.99Å
56	S	98.1	Very high	98.2	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	18%	0.183	C	C	.	.	S	Bend	trans	-113.4	156.7	-176.7	-59.7	0	0	0	0	111.6	Q11 D52 P53	Q11-S56 WeakPolarHBondContact CG-OG 3.43Å; Q11-S56 PolarHBondContact OE1-OG 2.93Å; D52-S56 WeakPolarHBondContact O-CB 3.21Å; D52-S56 PolarHBondContact O-N 3.28Å; P53-S56 CarbonylContact C-O 3.48Å; P53-S56 VanDerWaalsContact O-O 3.09Å
57	T	98.6	Very high	98.2	Very high	10 Å²	10	31.3 Å²	31.3	6%	0.061	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	107.2	170.2	-56.2	0	0	0	0	109.1	C16 I17 Y18 F59 K291 A292	C16-T57 PolarHBondContact O-N 2.94Å; I17-T57 CarbonylContact C-O 3.4Å; I17-T57 WeakPolarHBondContact CA-O 3.47Å; Y18-T57 PolarHBondContact N-O 3.22Å; T57-F59 HydrophobicContact CG2-CD1 4.02Å; T57-K291 HydrophobicContact CG2-CB 4.02Å; T57-A292 HydrophobicContact CG2-CB 3.97Å
58	I	98.7	Very high	98.3	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.9	174.6	-176.7	165.8	0	0	0	110.3	Y18 L43 Y46 I51 P53 V284 G288	Y18-I58 WeakPolarHBondContact O-CA 3.4Å; L43-I58 HydrophobicContact CD1-CD1 3.6Å; L43-I58 HydrophobicContact CD1-CG1 3.83Å; Y46-I58 HydrophobicContact CD1-CD1 4.18Å; Y46-I58 HydrophobicContact CG-CD1 4.22Å; I51-I58 HydrophobicContact CG2-CB 4.44Å; I51-I58 HydrophobicContact CG2-CD1 4.14Å; P53-I58 HydrophobicContact CB-CG2 3.86Å; I58-V284 HydrophobicContact CG2-CG1 4.04Å; I58-G288 WeakPolarHBondContact O-CA 3.21Å
59	F	98.9	Very high	98.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	168.4	-173.9	70.3	-77.2	0	0	0	112.4	I17 Y18 C19 I20 T57 V64 H67 Y118 A292	I17-F59 HydrophobicContact CG2-CD1 4.46Å; I17-F59 HydrophobicContact CG2-CE1 3.63Å; Y18-F59 PolarHBondContact O-N 3.42Å; C19-F59 HydrophobicContact CB-CE1 3.94Å; C19-F59 HydrophobicContact CB-CE2 4.37Å; C19-F59 HydrophobicContact CB-CZ 3.73Å; I20-F59 PolarHBondContact N-O 2.96Å; T57-F59 HydrophobicContact CG2-CD1 4.02Å; F59-V64 HydrophobicContact CD2-CB 4.32Å; F59-V64 HydrophobicContact CD2-CG2 3.45Å; F59-V64 VanDerWaalsContact CD2-CG2 3.45Å; F59-V64 HydrophobicContact CE2-CB 4.1Å; F59-V64 HydrophobicContact CE2-CG2 3.66Å; F59-V64 HydrophobicContact CG-CG2 4.37Å; F59-H67 AromaticContact CE2-NE2 3.43Å; F59-H67 WeakPolarHBondContact CE2-NE2 3.25Å; F59-H67 AromaticContact CZ-CE1 3.99Å; F59-H67 AromaticContact CZ-NE2 3.51Å; F59-Y118 HydrophobicContact CZ-CE2 4.06Å; F59-Y118 AromaticContact CZ-CZ 3.73Å; F59-Y118 WeakPolarHBondContact CZ-OH 3.35Å; F59-A292 HydrophobicContact CB-CB 4.5Å; F59-A292 HydrophobicContact CD1-CB 3.78Å; F59-A292 HydrophobicContact CD2-CB 4.01Å; F59-A292 HydrophobicContact CE1-CB 3.93Å; F59-A292 HydrophobicContact CE2-CB 4.15Å; F59-A292 HydrophobicContact CG-CB 3.83Å; F59-A292 HydrophobicContact CZ-CB 4.12Å
60	V	98.9	Very high	98.4	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	128.9	174.3	-179	0	0	0	0	109.1	I20 D22 T39 S62 H63 M285	I20-V60 HydrophobicContact CB-CG2 4.49Å; I20-V60 HydrophobicContact CD1-CG2 4.38Å; D22-V60 HydrophobicContact CB-CG1 4.37Å; D22-V60 VanDerWaalsContact CG-CG1 3.47Å; D22-V60 WeakPolarHBondContact OD2-CG1 3.33Å; T39-V60 HydrophobicContact CG2-CB 4.46Å; T39-V60 HydrophobicContact CG2-CG1 3.88Å; T39-V60 HydrophobicContact CG2-CG2 3.66Å; V60-S62 VanDerWaalsContact C-N 3.31Å; V60-S62 PolarHBondContact O-N 3.41Å; V60-H63 WeakPolarHBondContact O-CB 3.3Å; V60-H63 PolarHBondContact O-N 3.37Å; V60-M285 HydrophobicContact CG2-CG 4.18Å; V60-M285 HydrophobicContact CG2-SD 3.81Å
61	Q	98.9	Very high	98.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-55.3	-43.8	-171.7	-166.1	-166.6	11.8	0	0	112.5	C19 I20 V21 D22 Q23 H24 H63 V64 H67 D114	C19-Q61 VanDerWaalsContact SG-CB 3.51Å; I20-Q61 WeakPolarHBondContact O-CB 3.32Å; I20-Q61 PolarHBondContact O-N 2.93Å; V21-Q61 VanDerWaalsContact CA-OE1 3.29Å; D22-Q61 WeakPolarHBondContact OD1-CB 3.25Å; Q23-Q61 HydrophobicContact CG-CB 4.4Å; Q23-Q61 HydrophobicContact CG-CG 4.18Å; Q23-Q61 VanDerWaalsContact N-OE1 3.1Å; Q23-Q61 PolarHBondContact NE2-O 3.46Å; Q23-Q61 VanDerWaalsContact NE2-O 3.07Å; H24-Q61 PolarHBondContact CD2-NE2 3.44Å; H24-Q61 VanDerWaalsContact CD2-NE2 3.28Å; H24-Q61 PolarHBondContact CD2-OE1 3Å; H24-Q61 PolarHBondContact NE2-NE2 2.95Å; Q61-H63 PolarHBondContact O-N 3.48Å; Q61-V64 PolarHBondContact O-N 2.95Å; Q61-H67 HydrophobicContact CG-CB 4.36Å; Q61-D114 VanDerWaalsContact NE2-CG 3.31Å; Q61-D114 PolarHBondContact NE2-OD1 3Å; Q61-D114 PolarHBondContact NE2-OD2 3.44Å; Q61-D114 VanDerWaalsContact NE2-OD2 3.15Å
62	S	98.8	Very high	98.6	Very high	59 Å²	59	43.3 Å²	43.3	41%	0.413	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.8	-13.9	179.2	66.1	0	0	0	0	114.9	D22 V60 V64	D22-S62 WeakPolarHBondContact OD1-CB 3.47Å; D22-S62 PolarHBondContact OD1-N 3.3Å; D22-S62 PolarHBondContact OD1-OG 3.35Å; D22-S62 VanDerWaalsContact OD2-CB 3.26Å; D22-S62 WeakPolarHBondContact OD2-CB 3.36Å; D22-S62 PolarHBondContact OD2-OG 2.94Å; V60-S62 VanDerWaalsContact C-N 3.31Å; V60-S62 PolarHBondContact O-N 3.41Å; S62-V64 VanDerWaalsContact C-N 3.3Å
63	H	98.8	Very high	98.6	Very high	85 Å²	85	41.2 Å²	41.2	39%	0.394	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-83.7	-6.7	177.4	-61.3	-176.3	0	0	0	113	V60 Q61 A289	V60-H63 WeakPolarHBondContact O-CB 3.3Å; V60-H63 PolarHBondContact O-N 3.37Å; Q61-H63 PolarHBondContact O-N 3.48Å; H63-A289 HydrophobicContact CB-CB 3.87Å
64	V	98.9	Very high	98.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.			trans	-120	95.4	-178.9	179.5	0	0	0	0	108.3	F59 Q61 S62 E66 H67 A289 A292 S293 A296	F59-V64 HydrophobicContact CD2-CB 4.32Å; F59-V64 HydrophobicContact CD2-CG2 3.45Å; F59-V64 VanDerWaalsContact CD2-CG2 3.45Å; F59-V64 HydrophobicContact CE2-CB 4.1Å; F59-V64 HydrophobicContact CE2-CG2 3.66Å; F59-V64 HydrophobicContact CG-CG2 4.37Å; Q61-V64 PolarHBondContact O-N 2.95Å; S62-V64 VanDerWaalsContact C-N 3.3Å; V64-E66 HydrophobicContact CG1-CB 4.33Å; V64-E66 WeakPolarHBondContact CG1-OE2 3.5Å; V64-E66 PolarHBondContact O-N 2.82Å; V64-E66 VanDerWaalsContact O-N 3.1Å; V64-H67 VanDerWaalsContact CG1-CD2 3.48Å; V64-H67 WeakPolarHBondContact CG1-CD2 3.41Å; V64-H67 PolarHBondContact O-CD2 3.08Å; V64-H67 PolarHBondContact O-N 3.28Å; V64-A289 HydrophobicContact CG2-CB 4.27Å; V64-A292 HydrophobicContact CG2-CB 3.74Å; V64-S293 WeakPolarHBondContact CG1-OG 3.34Å; V64-A296 HydrophobicContact CG1-CB 4.17Å
65	P	98.8	Very high	98.7	Very high	76 Å²	76	33.6 Å²	33.6	49%	0.494	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.4	-173	-25.8	34.8	0	0	0	114.3	H67 A68 Q69	P65-H67 PolarHBondContact O-N 3.25Å; P65-H67 VanDerWaalsContact O-N 3.07Å; P65-A68 PolarHBondContact O-N 3.34Å; P65-Q69 WeakPolarHBondContact O-CG 3.36Å; P65-Q69 PolarHBondContact O-N 2.99Å
66	E	98.9	Very high	98.8	Very high	21 Å²	21	33.3 Å²	33.3	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-56.3	-28	-177.7	-67.8	87.4	167.1	0	0	113	V64 Q69 L70 L117 S293 A296 S297 L300	V64-E66 HydrophobicContact CG1-CB 4.33Å; V64-E66 WeakPolarHBondContact CG1-OE2 3.5Å; V64-E66 PolarHBondContact O-N 2.82Å; V64-E66 VanDerWaalsContact O-N 3.1Å; E66-Q69 PolarHBondContact O-N 2.82Å; E66-L70 WeakPolarHBondContact O-CB 3.32Å; E66-L70 PolarHBondContact O-N 2.85Å; E66-L117 HydrophobicContact CB-CD1 3.98Å; E66-L117 HydrophobicContact CB-CD2 3.95Å; E66-S293 PolarHBondContact OE2-OG 3.46Å; E66-S293 VanDerWaalsContact OE2-OG 3.06Å; E66-A296 HydrophobicContact CB-CB 3.71Å; E66-A296 HydrophobicContact CG-CB 3.93Å; E66-S297 WeakPolarHBondContact OE1-CB 3.16Å; E66-L300 HydrophobicContact CB-CD2 4.1Å; E66-L300 HydrophobicContact CG-CB 4.34Å; E66-L300 HydrophobicContact CG-CD2 3.76Å
67	H	98.9	Very high	98.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-53.8	177	-77	-97.8	0	0	0	112.4	F59 Q61 V64 P65 Q69 G71 D114 L117 Y118	F59-H67 AromaticContact CE2-NE2 3.43Å; F59-H67 WeakPolarHBondContact CE2-NE2 3.25Å; F59-H67 AromaticContact CZ-CE1 3.99Å; F59-H67 AromaticContact CZ-NE2 3.51Å; Q61-H67 HydrophobicContact CG-CB 4.36Å; V64-H67 VanDerWaalsContact CG1-CD2 3.48Å; V64-H67 WeakPolarHBondContact CG1-CD2 3.41Å; V64-H67 PolarHBondContact O-CD2 3.08Å; V64-H67 PolarHBondContact O-N 3.28Å; P65-H67 PolarHBondContact O-N 3.25Å; P65-H67 VanDerWaalsContact O-N 3.07Å; H67-Q69 VanDerWaalsContact C-N 3.34Å; H67-G71 PolarHBondContact O-N 2.73Å; H67-D114 IonicContact CE1-OD1 3.51Å; H67-D114 IonicContact CG-OD1 3.65Å; H67-D114 IonicContact ND1-OD1 2.64Å; H67-D114 PolarHBondContact ND1-OD1 2.88Å; H67-L117 HydrophobicContact CB-CD1 4.34Å; H67-Y118 AromaticContact CE1-CE2 3.68Å; H67-Y118 AromaticContact NE2-CE2 3.64Å; H67-Y118 AromaticContact NE2-CZ 3.6Å; H67-Y118 PolarHBondContact NE2-OH 3.35Å
68	A	98.9	Very high	98.8	Very high	50 Å²	50	35.2 Å²	35.2	41%	0.413	19%	0.191	S	C	.	.	H	α-helix	trans	-69.2	-36.7	179.5	0	0	0	0	0	111.4	P65 G71 W72	P65-A68 PolarHBondContact O-N 3.34Å; A68-G71 PolarHBondContact O-N 3.42Å; A68-W72 PolarHBondContact O-N 3.06Å
69	Q	98.9	Very high	98.8	Very high	74 Å²	74	42.2 Å²	42.2	35%	0.346	22%	0.219	S	C	.	.	H	α-helix	trans	-62.7	-46.4	177.6	-73.5	-177.1	-91.5	0	0	112.6	P65 E66 H67 A73 L300 Y304	P65-Q69 WeakPolarHBondContact O-CG 3.36Å; P65-Q69 PolarHBondContact O-N 2.99Å; E66-Q69 PolarHBondContact O-N 2.82Å; H67-Q69 VanDerWaalsContact C-N 3.34Å; Q69-A73 PolarHBondContact O-N 2.76Å; Q69-L300 HydrophobicContact CB-CD1 4.19Å; Q69-L300 HydrophobicContact CB-CD2 3.77Å; Q69-L300 HydrophobicContact CG-CD2 4.38Å; Q69-Y304 WeakPolarHBondContact CB-OH 3.48Å; Q69-Y304 PolarHBondContact NE2-OH 2.9Å
70	L	98.9	Very high	98.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-71	-38	175.3	-175.7	62.3	0	0	0	110.9	E66 W72 A73 L74 A113 L116 L117 F151 L300 V303	E66-L70 WeakPolarHBondContact O-CB 3.32Å; E66-L70 PolarHBondContact O-N 2.85Å; L70-W72 VanDerWaalsContact C-N 3.29Å; L70-W72 PolarHBondContact O-N 3.23Å; L70-A73 HydrophobicContact CD1-CB 4.44Å; L70-A73 PolarHBondContact O-N 2.64Å; L70-A73 VanDerWaalsContact O-N 3.07Å; L70-L74 HydrophobicContact CD1-CD1 4.31Å; L70-L74 HydrophobicContact CD1-CD2 4.11Å; L70-L74 HydrophobicContact CD1-CG 3.89Å; L70-L74 HydrophobicContact CD2-CD1 4.15Å; L70-L74 HydrophobicContact CG-CD1 3.87Å; L70-L74 HydrophobicContact CG-CG 3.89Å; L70-L74 WeakPolarHBondContact O-CG 3.22Å; L70-L74 PolarHBondContact O-N 3.29Å; L70-A113 HydrophobicContact CB-CB 3.93Å; L70-A113 HydrophobicContact CD2-CB 4.08Å; L70-A113 HydrophobicContact CG-CB 3.91Å; L70-L116 HydrophobicContact CD2-CB 4.39Å; L70-L117 HydrophobicContact CB-CD2 4.05Å; L70-L117 HydrophobicContact CB-CG 4.3Å; L70-L117 HydrophobicContact CD2-CD2 3.7Å; L70-L117 HydrophobicContact CD2-CG 3.62Å; L70-L117 HydrophobicContact CG-CD2 4.45Å; L70-F151 HydrophobicContact CD1-CZ 4.05Å; L70-F151 HydrophobicContact CD2-CE1 4.21Å; L70-F151 HydrophobicContact CD2-CZ 4.37Å; L70-L300 HydrophobicContact CB-CD1 3.96Å; L70-L300 HydrophobicContact CD1-CD1 4.3Å; L70-V303 HydrophobicContact CD1-CB 4.4Å; L70-V303 HydrophobicContact CD1-CG1 3.9Å; L70-V303 HydrophobicContact CD1-CG2 4.1Å
71	G	98.8	Very high	98.7	Very high	5 Å²	5	50.1 Å²	50.1	5%	0.052	26%	0.259	C	S	.	.	H	α-helix	trans	-53	-46.7	175.1	0	0	0	0	0	112.3	H67 A68 L74 N75 V109	H67-G71 PolarHBondContact O-N 2.73Å; A68-G71 PolarHBondContact O-N 3.42Å; G71-L74 PolarHBondContact O-N 3.33Å; G71-N75 PolarHBondContact O-N 3.27Å; G71-N75 VanDerWaalsContact O-N 3.1Å; G71-V109 WeakPolarHBondContact O-CG1 3.48Å
72	W	98.9	Very high	98.7	Very high	181 Å²	181	51.2 Å²	51.2	69%	0.686	26%	0.264	S	S	*	.	H	α-helix	trans	-62	-45.4	174.2	173.8	-101.8	0	0	0	113.1	A68 L70 L74 N75	A68-W72 PolarHBondContact O-N 3.06Å; L70-W72 VanDerWaalsContact C-N 3.29Å; L70-W72 PolarHBondContact O-N 3.23Å; W72-L74 VanDerWaalsContact C-N 3.35Å; W72-L74 PolarHBondContact O-N 3.07Å; W72-N75 WeakPolarHBondContact O-CB 3.1Å; W72-N75 PolarHBondContact O-N 2.93Å
73	A	98.8	Very high	98.6	Very high	6 Å²	6	48.8 Å²	48.8	5%	0.05	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-43.7	179.3	0	0	0	0	0	111.6	Q69 L70 N75 C76 Y77 I307	Q69-A73 PolarHBondContact O-N 2.76Å; L70-A73 HydrophobicContact CD1-CB 4.44Å; L70-A73 PolarHBondContact O-N 2.64Å; L70-A73 VanDerWaalsContact O-N 3.07Å; A73-N75 VanDerWaalsContact C-N 3.27Å; A73-N75 PolarHBondContact O-N 2.94Å; A73-C76 WeakPolarHBondContact O-CB 3.43Å; A73-C76 PolarHBondContact O-N 3.13Å; A73-C76 VanDerWaalsContact O-N 3.17Å; A73-Y77 WeakPolarHBondContact O-CD2 3.25Å; A73-I307 HydrophobicContact CB-CD1 4.11Å
74	L	98.9	Very high	98.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-23	-179.6	-65.7	-174.5	0	0	0	113.4	L70 G71 W72 C76 Y77 T78 V109 A112 A113 L116 I139 F151	L70-L74 HydrophobicContact CD1-CD1 4.31Å; L70-L74 HydrophobicContact CD1-CD2 4.11Å; L70-L74 HydrophobicContact CD1-CG 3.89Å; L70-L74 HydrophobicContact CD2-CD1 4.15Å; L70-L74 HydrophobicContact CG-CD1 3.87Å; L70-L74 HydrophobicContact CG-CG 3.89Å; L70-L74 WeakPolarHBondContact O-CG 3.22Å; L70-L74 PolarHBondContact O-N 3.29Å; G71-L74 PolarHBondContact O-N 3.33Å; W72-L74 VanDerWaalsContact C-N 3.35Å; W72-L74 PolarHBondContact O-N 3.07Å; L74-C76 PolarHBondContact O-N 2.81Å; L74-Y77 CarbonylContact O-C 3.47Å; L74-Y77 PolarHBondContact O-N 3.46Å; L74-T78 PolarHBondContact O-N 3.38Å; L74-T78 VanDerWaalsContact O-N 3.12Å; L74-T78 PolarHBondContact O-OG1 3.34Å; L74-V109 HydrophobicContact CB-CG1 3.67Å; L74-A112 HydrophobicContact CD1-CB 4.24Å; L74-A113 HydrophobicContact CD1-CB 4.09Å; L74-L116 HydrophobicContact CD1-CD1 4.02Å; L74-I139 HydrophobicContact CB-CG2 4.27Å; L74-I139 HydrophobicContact CD1-CG2 4.23Å; L74-I139 HydrophobicContact CD2-CG2 3.8Å; L74-I139 HydrophobicContact CG-CG2 4.31Å; L74-F151 HydrophobicContact CD2-CE2 4.01Å; L74-F151 HydrophobicContact CD2-CZ 4.09Å
75	N	98.8	Very high	98.3	Very high	37 Å²	37	53.7 Å²	53.7	20%	0.198	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-37.3	170.9	-92.2	-32.3	0	0	0	112	G71 W72 A73 Y77 T78 D106 V109	G71-N75 PolarHBondContact O-N 3.27Å; G71-N75 VanDerWaalsContact O-N 3.1Å; W72-N75 WeakPolarHBondContact O-CB 3.1Å; W72-N75 PolarHBondContact O-N 2.93Å; A73-N75 VanDerWaalsContact C-N 3.27Å; A73-N75 PolarHBondContact O-N 2.94Å; N75-Y77 PolarHBondContact O-N 3.13Å; N75-T78 PolarHBondContact O-N 3.49Å; N75-T78 VanDerWaalsContact O-N 3.17Å; N75-D106 PolarHBondContact ND2-OD1 2.92Å; N75-D106 PolarHBondContact ND2-OD2 2.96Å; N75-D106 PolarHBondContact OD1-OD1 3.4Å; N75-V109 HydrophobicContact CB-CG1 4.46Å; N75-V109 WeakPolarHBondContact OD1-CB 3.4Å; N75-V109 WeakPolarHBondContact OD1-CG1 3.35Å; N75-V109 VanDerWaalsContact OD1-CG2 3.28Å; N75-V109 WeakPolarHBondContact OD1-CG2 3.22Å
76	C	98.7	Very high	98.1	Very high	92 Å²	92	50.4 Å²	50.4	62%	0.622	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-11.7	177.3	-57	0	0	0	0	113.7	A73 L74	A73-C76 WeakPolarHBondContact O-CB 3.43Å; A73-C76 PolarHBondContact O-N 3.13Å; A73-C76 VanDerWaalsContact O-N 3.17Å; L74-C76 PolarHBondContact O-N 2.81Å
77	Y	98.6	Very high	97.8	Very high	34 Å²	34	53 Å²	53	13%	0.133	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	8.3	176.1	-59.9	-85.3	0	0	0	112.4	A73 L74 N75 R142 F143 L146 Y147 I307	A73-Y77 WeakPolarHBondContact O-CD2 3.25Å; L74-Y77 CarbonylContact O-C 3.47Å; L74-Y77 PolarHBondContact O-N 3.46Å; N75-Y77 PolarHBondContact O-N 3.13Å; Y77-R142 VanDerWaalsContact O-CD 3.29Å; Y77-R142 WeakPolarHBondContact O-CD 3.32Å; Y77-R142 PolarHBondContact O-NH1 3.46Å; Y77-F143 HydrophobicContact CD1-CD2 4.12Å; Y77-F143 AromaticContact CD2-CD2 3.85Å; Y77-F143 HydrophobicContact CD2-CD2 3.85Å; Y77-F143 HydrophobicContact CD2-CE2 4.1Å; Y77-F143 HydrophobicContact CE1-CD2 4.15Å; Y77-F143 HydrophobicContact CE1-CE2 4.35Å; Y77-F143 AromaticContact CE2-CD2 3.9Å; Y77-F143 HydrophobicContact CE2-CD2 3.9Å; Y77-F143 AromaticContact CE2-CE2 3.7Å; Y77-F143 HydrophobicContact CE2-CE2 3.7Å; Y77-F143 AromaticContact CG-CD2 3.99Å; Y77-F143 HydrophobicContact CG-CD2 3.99Å; Y77-F143 AromaticContact CZ-CE2 3.84Å; Y77-L146 HydrophobicContact CD1-CD1 4.02Å; Y77-L146 HydrophobicContact CE1-CD1 3.87Å; Y77-Y147 AromaticContact CE1-CE2 3.59Å; Y77-Y147 HydrophobicContact CE1-CE2 3.59Å; Y77-Y147 AromaticContact CZ-CE2 3.69Å; Y77-Y147 WeakPolarHBondContact OH-CE2 3.32Å; Y77-Y147 PolarHBondContact OH-OH 2.69Å; Y77-I307 HydrophobicContact CE2-CD1 3.96Å; Y77-I307 HydrophobicContact CE2-CG1 4.32Å; Y77-I307 WeakPolarHBondContact OH-CG1 3.47Å
78	T	98.7	Very high	97.3	Very high	18 Å²	18	54.7 Å²	54.7	11%	0.11	27%	0.271	C	S	.	.	S	Bend	trans	-108.4	128.1	178.9	-57.3	0	0	0	0	109.6	L74 N75 L83 V109 L135 I139	L74-T78 PolarHBondContact O-N 3.38Å; L74-T78 VanDerWaalsContact O-N 3.12Å; L74-T78 PolarHBondContact O-OG1 3.34Å; N75-T78 PolarHBondContact O-N 3.49Å; N75-T78 VanDerWaalsContact O-N 3.17Å; T78-L83 HydrophobicContact CG2-CD1 4.19Å; T78-L83 HydrophobicContact CG2-CD2 3.99Å; T78-L83 HydrophobicContact CG2-CG 3.9Å; T78-V109 HydrophobicContact CG2-CG2 3.82Å; T78-L135 HydrophobicContact CG2-CD1 4.33Å; T78-I139 HydrophobicContact CG2-CD1 4.27Å; T78-I139 WeakPolarHBondContact OG1-CD1 3.24Å
79	Y	98.2	Very high	96.9	Very high	147 Å²	147	54 Å²	54	58%	0.576	26%	0.258	S	S	*	.			trans	-76.4	134.9	176.2	-61.6	-65.7	0	0	0	110.2	G81 E82 R142	Y79-G81 PolarHBondContact O-N 3.3Å; Y79-E82 WeakPolarHBondContact CB-OE2 3.39Å; Y79-E82 HydrophobicContact CD2-CG 4.48Å; Y79-E82 WeakPolarHBondContact CD2-OE2 3.43Å; Y79-E82 PolarHBondContact N-OE2 3.47Å; Y79-E82 WeakPolarHBondContact O-CB 3.47Å; Y79-E82 PolarHBondContact O-N 2.86Å; Y79-R142 VanDerWaalsContact CE2-CZ 3.45Å
80	F	98.3	Very high	96.6	Very high	149 Å²	149	56.1 Å²	56.1	65%	0.654	27%	0.267	S	S	*	.	H	α-helix	trans	-49.8	-37	174.6	-179.3	-87.3	0	0	0	113.4	E82 L83 S84 F105	F80-E82 VanDerWaalsContact C-N 3.29Å; F80-E82 PolarHBondContact O-N 3.18Å; F80-L83 PolarHBondContact O-N 3.47Å; F80-S84 PolarHBondContact O-N 3.33Å; F80-S84 PolarHBondContact O-OG 2.93Å; F80-S84 VanDerWaalsContact O-OG 3.06Å; F80-F105 AromaticContact CD2-CE1 3.91Å; F80-F105 HydrophobicContact CD2-CE1 3.91Å; F80-F105 AromaticContact CD2-CZ 3.7Å; F80-F105 HydrophobicContact CD2-CZ 3.7Å; F80-F105 HydrophobicContact CE1-CZ 4.39Å; F80-F105 AromaticContact CE2-CE1 3.76Å; F80-F105 HydrophobicContact CE2-CE1 3.76Å; F80-F105 HydrophobicContact CE2-CE2 4.4Å; F80-F105 AromaticContact CE2-CZ 3.44Å; F80-F105 HydrophobicContact CE2-CZ 3.44Å; F80-F105 VanDerWaalsContact CE2-CZ 3.44Å; F80-F105 HydrophobicContact CG-CZ 4.29Å; F80-F105 HydrophobicContact CZ-CE2 4.42Å; F80-F105 AromaticContact CZ-CZ 3.81Å; F80-F105 HydrophobicContact CZ-CZ 3.81Å
81	G	97.5	Very high	96.1	Very high	19 Å²	19	60.7 Å²	60.7	20%	0.196	29%	0.291	C	S	.	.	H	α-helix	trans	-62.3	-33.1	177.4	0	0	0	0	0	113.6	Y79 S84 R85	Y79-G81 PolarHBondContact O-N 3.3Å; G81-S84 WeakPolarHBondContact CA-OG 3.29Å; G81-S84 PolarHBondContact O-OG 3.3Å; G81-R85 VanDerWaalsContact C-NH1 3.33Å; G81-R85 WeakPolarHBondContact O-CB 3.41Å; G81-R85 VanDerWaalsContact O-CG 3.24Å; G81-R85 WeakPolarHBondContact O-CG 3.21Å; G81-R85 PolarHBondContact O-N 2.75Å; G81-R85 PolarHBondContact O-NE 3.15Å; G81-R85 PolarHBondContact O-NH1 3.46Å; G81-R85 VanDerWaalsContact O-NH1 3.15Å; G81-R85 PolarHBondContact O-NH2 3.28Å
82	E	97.9	Very high	95.5	Very high	23 Å²	23	63.1 Å²	63.1	11%	0.107	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-44.3	178.8	-66.4	171.7	133.7	0	0	110.6	Y79 F80 L135 R142	Y79-E82 WeakPolarHBondContact CB-OE2 3.39Å; Y79-E82 HydrophobicContact CD2-CG 4.48Å; Y79-E82 WeakPolarHBondContact CD2-OE2 3.43Å; Y79-E82 PolarHBondContact N-OE2 3.47Å; Y79-E82 WeakPolarHBondContact O-CB 3.47Å; Y79-E82 PolarHBondContact O-N 2.86Å; F80-E82 VanDerWaalsContact C-N 3.29Å; F80-E82 PolarHBondContact O-N 3.18Å; E82-L135 HydrophobicContact CB-CD1 3.86Å; E82-L135 HydrophobicContact CG-CD1 4.32Å; E82-R142 IonicContact OE1-CZ 2.71Å; E82-R142 IonicContact OE1-NH1 3.53Å; E82-R142 PolarHBondContact OE1-NH1 2.86Å; E82-R142 IonicContact OE1-NH2 3.51Å; E82-R142 PolarHBondContact OE1-NH2 3.21Å; E82-R142 IonicContact OE2-CZ 2.65Å; E82-R142 IonicContact OE2-NH1 3.69Å; E82-R142 PolarHBondContact OE2-NH1 3.2Å; E82-R142 IonicContact OE2-NH2 3.77Å
83	L	97.7	Very high	95	Very high	7 Å²	7	55.3 Å²	55.3	4%	0.037	27%	0.273	C	S	.	.	H	α-helix	trans	-69.9	-46	178.4	-58.3	-178.8	0	0	0	112.4	T78 F80 R85 M86 F105 P108 V109 L135	T78-L83 HydrophobicContact CG2-CD1 4.19Å; T78-L83 HydrophobicContact CG2-CD2 3.99Å; T78-L83 HydrophobicContact CG2-CG 3.9Å; F80-L83 PolarHBondContact O-N 3.47Å; L83-R85 PolarHBondContact O-N 2.91Å; L83-M86 VanDerWaalsContact O-CB 3.31Å; L83-M86 WeakPolarHBondContact O-CB 3.37Å; L83-M86 WeakPolarHBondContact O-CG 3.43Å; L83-M86 PolarHBondContact O-N 2.85Å; L83-M86 VanDerWaalsContact O-N 3.07Å; L83-F105 HydrophobicContact CB-CD1 4.31Å; L83-F105 HydrophobicContact CB-CD2 4.23Å; L83-F105 HydrophobicContact CB-CE1 3.76Å; L83-F105 HydrophobicContact CB-CE2 3.7Å; L83-F105 HydrophobicContact CB-CZ 3.44Å; L83-F105 VanDerWaalsContact CB-CZ 3.44Å; L83-F105 HydrophobicContact CD1-CD1 4.06Å; L83-F105 HydrophobicContact CD1-CE1 3.68Å; L83-F105 HydrophobicContact CD1-CZ 4.23Å; L83-F105 HydrophobicContact CG-CE1 4.38Å; L83-F105 HydrophobicContact CG-CZ 4.46Å; L83-P108 HydrophobicContact CD2-CB 3.98Å; L83-P108 HydrophobicContact CD2-CG 4.19Å; L83-V109 HydrophobicContact CD1-CG2 4.04Å; L83-V109 HydrophobicContact CD2-CG2 3.79Å; L83-V109 HydrophobicContact CG-CG2 4.45Å; L83-L135 HydrophobicContact CD2-CD2 3.73Å
84	S	95.9	Very high	94.6	Very high	40 Å²	40	59.1 Å²	59.1	28%	0.28	30%	0.304	S	S	.	.	H	α-helix	trans	-66.9	-19	-179.3	58	0	0	0	0	114.4	F80 G81 K90	F80-S84 PolarHBondContact O-N 3.33Å; F80-S84 PolarHBondContact O-OG 2.93Å; F80-S84 VanDerWaalsContact O-OG 3.06Å; G81-S84 WeakPolarHBondContact CA-OG 3.29Å; G81-S84 PolarHBondContact O-OG 3.3Å; S84-K90 WeakPolarHBondContact O-CE 3.45Å
85	R	95.5	Very high	94	Very high	149 Å²	149	67.8 Å²	67.8	56%	0.562	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-5	174.5	-71.3	-175	-59.9	-94.4	2.1	114.1	G81 L83 T87 Q131	G81-R85 VanDerWaalsContact C-NH1 3.33Å; G81-R85 WeakPolarHBondContact O-CB 3.41Å; G81-R85 VanDerWaalsContact O-CG 3.24Å; G81-R85 WeakPolarHBondContact O-CG 3.21Å; G81-R85 PolarHBondContact O-N 2.75Å; G81-R85 PolarHBondContact O-NE 3.15Å; G81-R85 PolarHBondContact O-NH1 3.46Å; G81-R85 VanDerWaalsContact O-NH1 3.15Å; G81-R85 PolarHBondContact O-NH2 3.28Å; L83-R85 PolarHBondContact O-N 2.91Å; R85-T87 PolarHBondContact O-N 3.26Å; R85-Q131 PolarHBondContact O-NE2 2.89Å
86	M	94.5	Very high	93.3	Very high	7 Å²	7	69.9 Å²	69.9	3%	0.034	34%	0.343	C	S	.	.			trans	-62.4	125.9	-180	-70.9	-64.9	171.1	0	0	111.6	L83 Q88 F89 K90 P108 Q131 L135	L83-M86 VanDerWaalsContact O-CB 3.31Å; L83-M86 WeakPolarHBondContact O-CB 3.37Å; L83-M86 WeakPolarHBondContact O-CG 3.43Å; L83-M86 PolarHBondContact O-N 2.85Å; L83-M86 VanDerWaalsContact O-N 3.07Å; M86-Q88 VanDerWaalsContact C-N 3.3Å; M86-Q88 PolarHBondContact O-N 3.27Å; M86-F89 HydrophobicContact CB-CB 3.9Å; M86-F89 PolarHBondContact O-N 3.2Å; M86-K90 PolarHBondContact O-N 3.45Å; M86-K90 VanDerWaalsContact O-N 3.15Å; M86-P108 HydrophobicContact CG-CG 4.3Å; M86-Q131 HydrophobicContact CE-CG 4.14Å; M86-Q131 HydrophobicContact SD-CB 4.14Å; M86-Q131 HydrophobicContact SD-CG 3.48Å; M86-Q131 WeakPolarHBondContact SD-CG 3.29Å; M86-Q131 PolarHBondContact SD-OE1 3.08Å; M86-L135 HydrophobicContact CE-CB 3.64Å; M86-L135 HydrophobicContact CE-CD2 3.53Å; M86-L135 HydrophobicContact CE-CG 4.07Å
87	T	92.3	Very high	92.6	Very high	76 Å²	76	69 Å²	69	47%	0.466	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-43.7	178.8	-54.7	0	0	0	0	110.3	R85 F89 K90 D91 Q131	R85-T87 PolarHBondContact O-N 3.26Å; T87-F89 VanDerWaalsContact C-N 3.3Å; T87-F89 PolarHBondContact O-N 3.47Å; T87-K90 PolarHBondContact O-N 2.81Å; T87-K90 VanDerWaalsContact O-N 3.14Å; T87-D91 PolarHBondContact O-N 3.12Å; T87-Q131 PolarHBondContact OG1-OE1 3.41Å
88	Q	87.9	Confident	92.1	Very high	35 Å²	35	77 Å²	77	16%	0.164	38%	0.381	C	S	.	.	H	α-helix	trans	-62.8	-33.9	177.7	-73.1	-81.3	32.7	0	0	113.3	M86 K92 Y107 D128	M86-Q88 VanDerWaalsContact C-N 3.3Å; M86-Q88 PolarHBondContact O-N 3.27Å; Q88-K92 VanDerWaalsContact O-CB 3.26Å; Q88-K92 WeakPolarHBondContact O-CB 3.43Å; Q88-K92 VanDerWaalsContact O-CG 3.24Å; Q88-K92 WeakPolarHBondContact O-CG 3.43Å; Q88-K92 PolarHBondContact O-N 2.74Å; Q88-Y107 VanDerWaalsContact CB-OH 3.31Å; Q88-Y107 WeakPolarHBondContact CB-OH 3.31Å; Q88-D128 PolarHBondContact NE2-O 3.23Å; Q88-D128 PolarHBondContact NE2-OD2 3.22Å
89	F	91.6	Very high	91.5	Very high	35 Å²	35	77.8 Å²	77.8	15%	0.154	38%	0.384	C	S	.	.	H	α-helix	trans	-66.5	-45.5	174.3	174	-111.9	0	0	0	110.6	M86 T87 S93 I100 F105	M86-F89 HydrophobicContact CB-CB 3.9Å; M86-F89 PolarHBondContact O-N 3.2Å; T87-F89 VanDerWaalsContact C-N 3.3Å; T87-F89 PolarHBondContact O-N 3.47Å; F89-S93 VanDerWaalsContact CE2-OG 3.31Å; F89-S93 WeakPolarHBondContact CE2-OG 3.44Å; F89-S93 WeakPolarHBondContact O-CB 3.47Å; F89-S93 PolarHBondContact O-N 2.72Å; F89-S93 PolarHBondContact O-OG 3.31Å; F89-I100 HydrophobicContact CE2-CG2 4.13Å; F89-I100 HydrophobicContact CZ-CG2 4.23Å; F89-F105 AromaticContact CD1-CD2 3.95Å; F89-F105 HydrophobicContact CD1-CD2 3.95Å; F89-F105 HydrophobicContact CD1-CE2 4.39Å; F89-F105 HydrophobicContact CD2-CB 4.08Å; F89-F105 AromaticContact CD2-CD2 3.98Å; F89-F105 HydrophobicContact CD2-CD2 3.98Å; F89-F105 AromaticContact CE1-CD2 3.67Å; F89-F105 HydrophobicContact CE1-CD2 3.67Å; F89-F105 HydrophobicContact CE1-CE2 4.12Å; F89-F105 HydrophobicContact CE2-CB 3.69Å; F89-F105 AromaticContact CE2-CD2 3.7Å; F89-F105 HydrophobicContact CE2-CD2 3.7Å; F89-F105 HydrophobicContact CE2-CG 4.2Å; F89-F105 HydrophobicContact CG-CD2 4.1Å; F89-F105 HydrophobicContact CZ-CB 4.26Å; F89-F105 AromaticContact CZ-CD2 3.55Å; F89-F105 HydrophobicContact CZ-CD2 3.55Å; F89-F105 HydrophobicContact CZ-CE2 4.36Å; F89-F105 HydrophobicContact CZ-CG 4.35Å
90	K	91.3	Very high	91.2	Very high	119 Å²	119	75.1 Å²	75.1	52%	0.517	38%	0.379	S	S	.	.	H	α-helix	trans	-61.8	-48.4	177.7	-67.2	176.5	179.4	176.5	0	112	S84 M86 T87 S93 A94	S84-K90 WeakPolarHBondContact O-CE 3.45Å; M86-K90 PolarHBondContact O-N 3.45Å; M86-K90 VanDerWaalsContact O-N 3.15Å; T87-K90 PolarHBondContact O-N 2.81Å; T87-K90 VanDerWaalsContact O-N 3.14Å; K90-S93 PolarHBondContact O-N 3.19Å; K90-A94 PolarHBondContact O-N 2.94Å
91	D	89.7	Confident	91	Very high	96 Å²	96	69.6 Å²	69.6	51%	0.513	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-46.8	-178.5	-68.4	-12.9	0	0	0	111.9	T87 A94 R95	T87-D91 PolarHBondContact O-N 3.12Å; D91-A94 PolarHBondContact O-N 3.4Å; D91-R95 PolarHBondContact O-N 2.93Å; D91-R95 VanDerWaalsContact O-N 3.07Å
92	K	86.9	Confident	91	Very high	56 Å²	56	72.5 Å²	72.5	24%	0.243	38%	0.379	C	S	.	.	H	α-helix	trans	-68.4	-35.2	177.8	-67.6	-179.4	-173.2	172.6	0	111.8	Q88 A94 R95 Y96 L104 Y107	Q88-K92 VanDerWaalsContact O-CB 3.26Å; Q88-K92 WeakPolarHBondContact O-CB 3.43Å; Q88-K92 VanDerWaalsContact O-CG 3.24Å; Q88-K92 WeakPolarHBondContact O-CG 3.43Å; Q88-K92 PolarHBondContact O-N 2.74Å; K92-A94 VanDerWaalsContact C-N 3.34Å; K92-R95 PolarHBondContact O-N 3.37Å; K92-Y96 HydrophobicContact CB-CD2 4.31Å; K92-Y96 WeakPolarHBondContact O-CB 3.29Å; K92-Y96 WeakPolarHBondContact O-CD2 3.48Å; K92-Y96 PolarHBondContact O-N 3.32Å; K92-L104 HydrophobicContact CB-CD1 4Å; K92-L104 HydrophobicContact CB-CD2 3.99Å; K92-L104 HydrophobicContact CB-CG 4.34Å; K92-L104 HydrophobicContact CD-CD1 3.58Å; K92-L104 HydrophobicContact CG-CD1 4.45Å; K92-Y107 PolarHBondContact NZ-OH 3Å
93	S	88.2	Confident	91	Very high	17 Å²	17	72.9 Å²	72.9	12%	0.119	39%	0.389	C	S	.	.	H	α-helix	trans	-64.1	-39.9	175.6	-64.5	0	0	0	0	111.9	F89 K90 Y96 A97	F89-S93 VanDerWaalsContact CE2-OG 3.31Å; F89-S93 WeakPolarHBondContact CE2-OG 3.44Å; F89-S93 WeakPolarHBondContact O-CB 3.47Å; F89-S93 PolarHBondContact O-N 2.72Å; F89-S93 PolarHBondContact O-OG 3.31Å; K90-S93 PolarHBondContact O-N 3.19Å; S93-Y96 CarbonylContact O-C 3.56Å; S93-A97 WeakPolarHBondContact O-CA 3.39Å; S93-A97 PolarHBondContact O-N 2.86Å
94	A	89.7	Confident	90.9	Very high	85 Å²	85	72.5 Å²	72.5	70%	0.702	39%	0.387	S	S	*	.	H	α-helix	trans	-65	-39.7	174.1	0	0	0	0	0	112.2	K90 D91 K92	K90-A94 PolarHBondContact O-N 2.94Å; D91-A94 PolarHBondContact O-N 3.4Å; K92-A94 VanDerWaalsContact C-N 3.34Å
95	R	86	Confident	91	Very high	182 Å²	182	72.3 Å²	72.3	69%	0.687	38%	0.381	S	S	*	.	H	α-helix	trans	-74.5	-33.1	179.9	-173.2	175	-179.8	171.3	4.2	113.8	D91 K92	D91-R95 PolarHBondContact O-N 2.93Å; D91-R95 VanDerWaalsContact O-N 3.07Å; K92-R95 PolarHBondContact O-N 3.37Å
96	Y	84.7	Confident	91.1	Very high	81 Å²	81	67.5 Å²	67.5	32%	0.318	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	49.8	-175	-60.2	-74.3	0	0	0	111.4	V28 K92 S93 E98 N99 I100	V28-Y96 HydrophobicContact CG1-CE1 4.21Å; V28-Y96 HydrophobicContact CG2-CE2 4.27Å; K92-Y96 HydrophobicContact CB-CD2 4.31Å; K92-Y96 WeakPolarHBondContact O-CB 3.29Å; K92-Y96 WeakPolarHBondContact O-CD2 3.48Å; K92-Y96 PolarHBondContact O-N 3.32Å; S93-Y96 CarbonylContact O-C 3.56Å; Y96-E98 PolarHBondContact O-N 2.79Å; Y96-E98 VanDerWaalsContact O-N 3.1Å; Y96-N99 CarbonylContact O-C 3.45Å; Y96-N99 PolarHBondContact O-N 3.17Å; Y96-I100 PolarHBondContact O-N 3.36Å
97	A	84.3	Confident	91.3	Very high	75 Å²	75	67.9 Å²	67.9	62%	0.62	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-53.9	-33.4	-176.8	0	0	0	0	0	113.6	S93 N99	S93-A97 WeakPolarHBondContact O-CA 3.39Å; S93-A97 PolarHBondContact O-N 2.86Å; A97-N99 VanDerWaalsContact C-N 3.29Å; A97-N99 PolarHBondContact O-N 2.81Å
98	E	87.1	Confident	91.5	Very high	201 Å²	201	64.3 Å²	64.3	94%	0.939	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-69.5	-19.6	176.8	-64.3	-91.1	166.5	0	0	113.8	Y96	Y96-E98 PolarHBondContact O-N 2.79Å; Y96-E98 VanDerWaalsContact O-N 3.1Å
99	N	85.7	Confident	92.1	Very high	34 Å²	34	62.6 Å²	62.6	18%	0.182	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-139.6	46.8	-172.2	-173.6	51.7	0	0	0	112.8	Y96 A97 N101	Y96-N99 CarbonylContact O-C 3.45Å; Y96-N99 PolarHBondContact O-N 3.17Å; A97-N99 VanDerWaalsContact C-N 3.29Å; A97-N99 PolarHBondContact O-N 2.81Å; N99-N101 VanDerWaalsContact C-N 3.29Å; N99-N101 PolarHBondContact ND2-ND2 3.07Å; N99-N101 PolarHBondContact O-N 3.02Å; N99-N101 PolarHBondContact O-ND2 3.27Å
100	I	92.3	Very high	92.4	Very high	91 Å²	91	62.1 Å²	62.1	47%	0.467	34%	0.337	S	S	.	.			trans	-74.7	85.9	168.4	-51.4	174.3	0	0	0	108.2	F89 Y96	F89-I100 HydrophobicContact CE2-CG2 4.13Å; F89-I100 HydrophobicContact CZ-CG2 4.23Å; Y96-I100 PolarHBondContact O-N 3.36Å
101	N	95.3	Very high	92.8	Very high	33 Å²	33	57.8 Å²	57.8	18%	0.176	32%	0.319	C	S	.	.			trans	-96.3	159.3	179.6	63.5	85.7	0	0	0	111.4	T27 N99 G103 L104	T27-N101 PolarHBondContact O-ND2 3.4Å; N99-N101 VanDerWaalsContact C-N 3.29Å; N99-N101 PolarHBondContact ND2-ND2 3.07Å; N99-N101 PolarHBondContact O-N 3.02Å; N99-N101 PolarHBondContact O-ND2 3.27Å; N101-G103 PolarHBondContact O-N 2.76Å; N101-G103 WeakPolarHBondContact OD1-CA 3.36Å; N101-G103 PolarHBondContact OD1-N 3.43Å; N101-G103 VanDerWaalsContact OD1-N 3.13Å; N101-L104 WeakPolarHBondContact O-CB 3.39Å; N101-L104 PolarHBondContact O-N 3.34Å; N101-L104 PolarHBondContact OD1-N 3.1Å; N101-L104 VanDerWaalsContact OD1-N 3.08Å
102	A	97.4	Very high	93.2	Very high	80 Å²	80	53.2 Å²	53.2	66%	0.661	29%	0.294	S	S	*	.	H	α-helix	trans	-57.7	-34	-180	0	0	0	0	0	113	L104 F105 D106	A102-L104 VanDerWaalsContact C-N 3.3Å; A102-L104 PolarHBondContact O-N 2.75Å; A102-F105 WeakPolarHBondContact O-CB 3.48Å; A102-F105 PolarHBondContact O-N 3.31Å; A102-D106 VanDerWaalsContact O-CB 3.22Å; A102-D106 WeakPolarHBondContact O-CB 3.22Å; A102-D106 PolarHBondContact O-N 3.02Å
103	G	97.2	Very high	93.8	Very high	31 Å²	31	50.6 Å²	50.6	32%	0.32	28%	0.283	S	S	.	.	H	α-helix	trans	-61.6	-36.3	175.7	0	0	0	0	0	113	T27 N101 F105 D106 Y107	T27-G103 WeakPolarHBondContact CG2-O 3.19Å; N101-G103 PolarHBondContact O-N 2.76Å; N101-G103 WeakPolarHBondContact OD1-CA 3.36Å; N101-G103 PolarHBondContact OD1-N 3.43Å; N101-G103 VanDerWaalsContact OD1-N 3.13Å; G103-F105 PolarHBondContact O-N 3.06Å; G103-D106 PolarHBondContact O-N 3.15Å; G103-Y107 WeakPolarHBondContact O-CB 3.36Å; G103-Y107 PolarHBondContact O-N 3.08Å
104	L	95.6	Very high	94.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-26.5	175.6	-169.9	64.3	0	0	0	112.9	K92 N101 A102 Y107	K92-L104 HydrophobicContact CB-CD1 4Å; K92-L104 HydrophobicContact CB-CD2 3.99Å; K92-L104 HydrophobicContact CB-CG 4.34Å; K92-L104 HydrophobicContact CD-CD1 3.58Å; K92-L104 HydrophobicContact CG-CD1 4.45Å; N101-L104 WeakPolarHBondContact O-CB 3.39Å; N101-L104 PolarHBondContact O-N 3.34Å; N101-L104 PolarHBondContact OD1-N 3.1Å; N101-L104 VanDerWaalsContact OD1-N 3.08Å; A102-L104 VanDerWaalsContact C-N 3.3Å; A102-L104 PolarHBondContact O-N 2.75Å; L104-Y107 WeakPolarHBondContact O-CD1 3.4Å; L104-Y107 VanDerWaalsContact O-CE1 3.24Å; L104-Y107 WeakPolarHBondContact O-CE1 3.43Å
105	F	97.3	Very high	94.7	Very high	36 Å²	36	47.3 Å²	47.3	16%	0.158	25%	0.252	C	S	.	.	H	α-helix	trans	-82.3	-38.6	174	-179.2	-106.8	0	0	0	112	F80 L83 F89 A102 G103 P108	F80-F105 AromaticContact CD2-CE1 3.91Å; F80-F105 HydrophobicContact CD2-CE1 3.91Å; F80-F105 AromaticContact CD2-CZ 3.7Å; F80-F105 HydrophobicContact CD2-CZ 3.7Å; F80-F105 HydrophobicContact CE1-CZ 4.39Å; F80-F105 AromaticContact CE2-CE1 3.76Å; F80-F105 HydrophobicContact CE2-CE1 3.76Å; F80-F105 HydrophobicContact CE2-CE2 4.4Å; F80-F105 AromaticContact CE2-CZ 3.44Å; F80-F105 HydrophobicContact CE2-CZ 3.44Å; F80-F105 VanDerWaalsContact CE2-CZ 3.44Å; F80-F105 HydrophobicContact CG-CZ 4.29Å; F80-F105 HydrophobicContact CZ-CE2 4.42Å; F80-F105 AromaticContact CZ-CZ 3.81Å; F80-F105 HydrophobicContact CZ-CZ 3.81Å; L83-F105 HydrophobicContact CB-CD1 4.31Å; L83-F105 HydrophobicContact CB-CD2 4.23Å; L83-F105 HydrophobicContact CB-CE1 3.76Å; L83-F105 HydrophobicContact CB-CE2 3.7Å; L83-F105 HydrophobicContact CB-CZ 3.44Å; L83-F105 VanDerWaalsContact CB-CZ 3.44Å; L83-F105 HydrophobicContact CD1-CD1 4.06Å; L83-F105 HydrophobicContact CD1-CE1 3.68Å; L83-F105 HydrophobicContact CD1-CZ 4.23Å; L83-F105 HydrophobicContact CG-CE1 4.38Å; L83-F105 HydrophobicContact CG-CZ 4.46Å; F89-F105 AromaticContact CD1-CD2 3.95Å; F89-F105 HydrophobicContact CD1-CD2 3.95Å; F89-F105 HydrophobicContact CD1-CE2 4.39Å; F89-F105 HydrophobicContact CD2-CB 4.08Å; F89-F105 AromaticContact CD2-CD2 3.98Å; F89-F105 HydrophobicContact CD2-CD2 3.98Å; F89-F105 AromaticContact CE1-CD2 3.67Å; F89-F105 HydrophobicContact CE1-CD2 3.67Å; F89-F105 HydrophobicContact CE1-CE2 4.12Å; F89-F105 HydrophobicContact CE2-CB 3.69Å; F89-F105 AromaticContact CE2-CD2 3.7Å; F89-F105 HydrophobicContact CE2-CD2 3.7Å; F89-F105 HydrophobicContact CE2-CG 4.2Å; F89-F105 HydrophobicContact CG-CD2 4.1Å; F89-F105 HydrophobicContact CZ-CB 4.26Å; F89-F105 AromaticContact CZ-CD2 3.55Å; F89-F105 HydrophobicContact CZ-CD2 3.55Å; F89-F105 HydrophobicContact CZ-CE2 4.36Å; F89-F105 HydrophobicContact CZ-CG 4.35Å; A102-F105 WeakPolarHBondContact O-CB 3.48Å; A102-F105 PolarHBondContact O-N 3.31Å; G103-F105 PolarHBondContact O-N 3.06Å; F105-P108 WeakPolarHBondContact O-CD 3.12Å
106	D	98.5	Very high	95.3	Very high	48 Å²	48	38.7 Å²	38.7	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-93.2	-18.2	-167	-158.1	58.7	0	0	0	114.6	N75 A102 G103 P108 V109	N75-D106 PolarHBondContact ND2-OD1 2.92Å; N75-D106 PolarHBondContact ND2-OD2 2.96Å; N75-D106 PolarHBondContact OD1-OD1 3.4Å; A102-D106 VanDerWaalsContact O-CB 3.22Å; A102-D106 WeakPolarHBondContact O-CB 3.22Å; A102-D106 PolarHBondContact O-N 3.02Å; G103-D106 PolarHBondContact O-N 3.15Å; D106-P108 WeakPolarHBondContact O-CD 3.28Å; D106-V109 WeakPolarHBondContact O-CB 3.34Å; D106-V109 PolarHBondContact O-N 2.72Å
107	Y	97.7	Very high	96	Very high	14 Å²	14	34.9 Å²	34.9	6%	0.055	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-25.3	-176.8	84.5	-85.5	0	0	0	115.8	H24 Q88 K92 G103 L104 V109 L110 M111 H132	H24-Y107 PolarHBondContact CE1-O 3.16Å; H24-Y107 AromaticContact ND1-CD2 3.62Å; Q88-Y107 VanDerWaalsContact CB-OH 3.31Å; Q88-Y107 WeakPolarHBondContact CB-OH 3.31Å; K92-Y107 PolarHBondContact NZ-OH 3Å; G103-Y107 WeakPolarHBondContact O-CB 3.36Å; G103-Y107 PolarHBondContact O-N 3.08Å; L104-Y107 WeakPolarHBondContact O-CD1 3.4Å; L104-Y107 VanDerWaalsContact O-CE1 3.24Å; L104-Y107 WeakPolarHBondContact O-CE1 3.43Å; Y107-V109 PolarHBondContact O-N 3.25Å; Y107-L110 PolarHBondContact O-N 2.98Å; Y107-M111 PolarHBondContact O-N 3.03Å; Y107-H132 AromaticContact CE2-CE1 3.66Å; Y107-H132 AromaticContact CZ-CE1 3.62Å; Y107-H132 AromaticContact CZ-NE2 3.78Å; Y107-H132 PolarHBondContact OH-CE1 2.79Å; Y107-H132 PolarHBondContact OH-NE2 3.17Å
108	P	98.1	Very high	96.7	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	18%	0.177	C	C	.	.	H	α-helix	trans	-60.4	-30.9	171.6	-24.9	37.7	0	0	0	113	L83 M86 F105 D106 M111 A112 L135	L83-P108 HydrophobicContact CD2-CB 3.98Å; L83-P108 HydrophobicContact CD2-CG 4.19Å; M86-P108 HydrophobicContact CG-CG 4.3Å; F105-P108 WeakPolarHBondContact O-CD 3.12Å; D106-P108 WeakPolarHBondContact O-CD 3.28Å; P108-M111 PolarHBondContact O-N 3.4Å; P108-A112 PolarHBondContact O-N 3Å; P108-L135 HydrophobicContact CB-CD2 3.64Å
109	V	98.8	Very high	97.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-74.2	-39.1	175.4	-174.3	0	0	0	0	111.1	G71 L74 N75 T78 L83 D106 Y107 M111 A112 A113	G71-V109 WeakPolarHBondContact O-CG1 3.48Å; L74-V109 HydrophobicContact CB-CG1 3.67Å; N75-V109 HydrophobicContact CB-CG1 4.46Å; N75-V109 WeakPolarHBondContact OD1-CB 3.4Å; N75-V109 WeakPolarHBondContact OD1-CG1 3.35Å; N75-V109 VanDerWaalsContact OD1-CG2 3.28Å; N75-V109 WeakPolarHBondContact OD1-CG2 3.22Å; T78-V109 HydrophobicContact CG2-CG2 3.82Å; L83-V109 HydrophobicContact CD1-CG2 4.04Å; L83-V109 HydrophobicContact CD2-CG2 3.79Å; L83-V109 HydrophobicContact CG-CG2 4.45Å; D106-V109 WeakPolarHBondContact O-CB 3.34Å; D106-V109 PolarHBondContact O-N 2.72Å; Y107-V109 PolarHBondContact O-N 3.25Å; V109-M111 VanDerWaalsContact C-N 3.3Å; V109-M111 PolarHBondContact O-N 3.23Å; V109-A112 WeakPolarHBondContact O-CB 3.36Å; V109-A112 PolarHBondContact O-N 3.49Å; V109-A113 PolarHBondContact O-N 3.46Å
110	L	98.8	Very high	97.8	Very high	25 Å²	25	24.1 Å²	24.1	13%	0.131	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-39.3	171.8	-173.9	62.3	0	0	0	111.2	Q23 Y107 A112 A113 D114	Q23-L110 HydrophobicContact CB-CD2 4Å; Y107-L110 PolarHBondContact O-N 2.98Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.27Å; L110-A113 WeakPolarHBondContact O-CB 3.34Å; L110-A113 PolarHBondContact O-N 3.17Å; L110-D114 PolarHBondContact O-N 3.28Å
111	M	98.6	Very high	98.1	Very high	28 Å²	28	24 Å²	24	14%	0.138	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-40.5	173.6	-179.5	171.9	172.7	0	0	111.8	Y107 P108 V109 D114 I115 V125 H132	Y107-M111 PolarHBondContact O-N 3.03Å; P108-M111 PolarHBondContact O-N 3.4Å; V109-M111 VanDerWaalsContact C-N 3.3Å; V109-M111 PolarHBondContact O-N 3.23Å; M111-D114 WeakPolarHBondContact O-CB 3.48Å; M111-D114 PolarHBondContact O-N 3.25Å; M111-I115 HydrophobicContact CE-CD1 4.12Å; M111-I115 HydrophobicContact CG-CD1 4.09Å; M111-I115 WeakPolarHBondContact O-CD1 3.45Å; M111-I115 WeakPolarHBondContact O-CG1 3.42Å; M111-I115 PolarHBondContact O-N 2.82Å; M111-V125 HydrophobicContact CE-CG1 4.27Å; M111-H132 HydrophobicContact CE-CB 4.06Å; M111-H132 HydrophobicContact SD-CB 3.46Å; M111-H132 WeakPolarHBondContact SD-CB 3.24Å
112	A	98.8	Very high	98.2	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.9	-45.2	172.8	0	0	0	0	0	111.2	L74 P108 V109 L110 D114 I115 L116 S136 I139	L74-A112 HydrophobicContact CD1-CB 4.24Å; P108-A112 PolarHBondContact O-N 3Å; V109-A112 WeakPolarHBondContact O-CB 3.36Å; V109-A112 PolarHBondContact O-N 3.49Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.27Å; A112-D114 VanDerWaalsContact C-N 3.34Å; A112-D114 PolarHBondContact O-N 2.86Å; A112-I115 PolarHBondContact O-N 2.87Å; A112-L116 WeakPolarHBondContact O-CB 3.14Å; A112-L116 WeakPolarHBondContact O-CG 3.31Å; A112-L116 PolarHBondContact O-N 3.48Å; A112-S136 WeakPolarHBondContact CA-OG 3.24Å; A112-I139 HydrophobicContact CB-CD1 3.97Å
113	A	98.9	Very high	98.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.7	-43.3	175.8	0	0	0	0	0	112.4	L70 L74 V109 L110 I115 L116 L117	L70-A113 HydrophobicContact CB-CB 3.93Å; L70-A113 HydrophobicContact CD2-CB 4.08Å; L70-A113 HydrophobicContact CG-CB 3.91Å; L74-A113 HydrophobicContact CD1-CB 4.09Å; V109-A113 PolarHBondContact O-N 3.46Å; L110-A113 WeakPolarHBondContact O-CB 3.34Å; L110-A113 PolarHBondContact O-N 3.17Å; A113-I115 PolarHBondContact O-N 3.31Å; A113-L116 PolarHBondContact O-N 3.13Å; A113-L117 VanDerWaalsContact O-CG 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.4Å; A113-L117 PolarHBondContact O-N 3.38Å; A113-L117 VanDerWaalsContact O-N 3.13Å
114	D	98.8	Very high	97.8	Very high	20 Å²	20	24.1 Å²	24.1	11%	0.107	13%	0.128	C	C	.	.	H	α-helix	trans	-56.8	-37.5	177.8	-59.4	-30.6	0	0	0	112.4	H24 Q61 H67 L110 M111 A112 Y118	H24-D114 IonicContact CD2-OD2 2.79Å; H24-D114 IonicContact CE1-OD2 3.81Å; H24-D114 IonicContact NE2-OD2 3.52Å; H24-D114 PolarHBondContact NE2-OD2 3.47Å; Q61-D114 VanDerWaalsContact NE2-CG 3.31Å; Q61-D114 PolarHBondContact NE2-OD1 3Å; Q61-D114 PolarHBondContact NE2-OD2 3.44Å; Q61-D114 VanDerWaalsContact NE2-OD2 3.15Å; H67-D114 IonicContact CE1-OD1 3.51Å; H67-D114 IonicContact CG-OD1 3.65Å; H67-D114 IonicContact ND1-OD1 2.64Å; H67-D114 PolarHBondContact ND1-OD1 2.88Å; L110-D114 PolarHBondContact O-N 3.28Å; M111-D114 WeakPolarHBondContact O-CB 3.48Å; M111-D114 PolarHBondContact O-N 3.25Å; A112-D114 VanDerWaalsContact C-N 3.34Å; A112-D114 PolarHBondContact O-N 2.86Å; D114-Y118 VanDerWaalsContact O-CD2 3.24Å; D114-Y118 WeakPolarHBondContact O-CD2 3.37Å; D114-Y118 WeakPolarHBondContact O-CE2 3.47Å
115	I	98.8	Very high	97.3	Very high	14 Å²	14	25.7 Å²	25.7	7%	0.072	14%	0.138	C	C	.	.	H	α-helix	trans	-80.6	-47.9	-178.8	-65.5	163.1	0	0	0	110.6	M111 A112 A113 L117 T120 V123 L133 P154	M111-I115 HydrophobicContact CE-CD1 4.12Å; M111-I115 HydrophobicContact CG-CD1 4.09Å; M111-I115 WeakPolarHBondContact O-CD1 3.45Å; M111-I115 WeakPolarHBondContact O-CG1 3.42Å; M111-I115 PolarHBondContact O-N 2.82Å; A112-I115 PolarHBondContact O-N 2.87Å; A113-I115 PolarHBondContact O-N 3.31Å; I115-L117 PolarHBondContact O-N 2.92Å; I115-T120 HydrophobicContact CG2-CG2 4.09Å; I115-T120 VanDerWaalsContact O-CB 3.24Å; I115-T120 WeakPolarHBondContact O-CB 3.22Å; I115-T120 PolarHBondContact O-OG1 3.14Å; I115-V123 HydrophobicContact CD1-CG1 4.18Å; I115-V123 HydrophobicContact CD1-CG2 4.11Å; I115-V123 HydrophobicContact CG1-CG1 4.41Å; I115-V123 HydrophobicContact CG1-CG2 4.06Å; I115-V123 HydrophobicContact CG2-CG2 3.64Å; I115-L133 HydrophobicContact CD1-CD1 4.19Å; I115-P154 HydrophobicContact CG2-CB 3.66Å; I115-P154 HydrophobicContact CG2-CG 3.73Å
116	L	98.8	Very high	96.5	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-75	-26.2	-168.5	-63.3	-179.5	0	0	0	113.3	L70 L74 A112 A113 Y118 Q119 A140 F151 P154	L70-L116 HydrophobicContact CD2-CB 4.39Å; L74-L116 HydrophobicContact CD1-CD1 4.02Å; A112-L116 WeakPolarHBondContact O-CB 3.14Å; A112-L116 WeakPolarHBondContact O-CG 3.31Å; A112-L116 PolarHBondContact O-N 3.48Å; A113-L116 PolarHBondContact O-N 3.13Å; L116-Y118 PolarHBondContact O-N 2.94Å; L116-Y118 VanDerWaalsContact O-N 3.14Å; L116-Q119 PolarHBondContact O-N 2.84Å; L116-A140 HydrophobicContact CD1-CB 3.93Å; L116-A140 HydrophobicContact CD2-CB 3.78Å; L116-F151 HydrophobicContact CB-CD1 3.74Å; L116-F151 HydrophobicContact CB-CE1 3.9Å; L116-F151 HydrophobicContact CB-CG 4.25Å; L116-F151 HydrophobicContact CD1-CD1 4.44Å; L116-F151 HydrophobicContact CD1-CD2 4.16Å; L116-F151 HydrophobicContact CD1-CE2 4.33Å; L116-F151 HydrophobicContact CD1-CG 4.2Å; L116-F151 HydrophobicContact CD2-CB 4.26Å; L116-F151 HydrophobicContact CD2-CG 4.49Å; L116-F151 HydrophobicContact CG-CD1 4.49Å; L116-P154 HydrophobicContact CD2-CG 4.34Å
117	L	98.9	Very high	95.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-33.9	176.4	-83.6	171.4	0	0	0	113.8	E66 H67 L70 A113 I115 A296 T299 L300	E66-L117 HydrophobicContact CB-CD1 3.98Å; E66-L117 HydrophobicContact CB-CD2 3.95Å; H67-L117 HydrophobicContact CB-CD1 4.34Å; L70-L117 HydrophobicContact CB-CD2 4.05Å; L70-L117 HydrophobicContact CB-CG 4.3Å; L70-L117 HydrophobicContact CD2-CD2 3.7Å; L70-L117 HydrophobicContact CD2-CG 3.62Å; L70-L117 HydrophobicContact CG-CD2 4.45Å; A113-L117 VanDerWaalsContact O-CG 3.32Å; A113-L117 WeakPolarHBondContact O-CG 3.4Å; A113-L117 PolarHBondContact O-N 3.38Å; A113-L117 VanDerWaalsContact O-N 3.13Å; I115-L117 PolarHBondContact O-N 2.92Å; L117-A296 HydrophobicContact CB-CB 4.14Å; L117-A296 HydrophobicContact CD1-CB 4.15Å; L117-A296 HydrophobicContact CD2-CB 3.98Å; L117-A296 HydrophobicContact CG-CB 4.3Å; L117-T299 VanDerWaalsContact O-CB 3.25Å; L117-T299 WeakPolarHBondContact O-CB 3.47Å; L117-T299 PolarHBondContact O-OG1 2.66Å; L117-L300 HydrophobicContact CD2-CB 4.37Å
118	Y	98.8	Very high	94.7	Very high	12 Å²	12	35.1 Å²	35.1	5%	0.047	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	14.4	-171.5	-57.1	-73.9	0	0	0	113.8	I17 F59 H67 D114 L116 T120 A292 H295 A296	I17-Y118 VanDerWaalsContact CD1-CB 3.46Å; I17-Y118 HydrophobicContact CD1-CD1 3.74Å; I17-Y118 HydrophobicContact CD1-CD2 4.31Å; I17-Y118 HydrophobicContact CD1-CG 3.56Å; F59-Y118 HydrophobicContact CZ-CE2 4.06Å; F59-Y118 AromaticContact CZ-CZ 3.73Å; F59-Y118 WeakPolarHBondContact CZ-OH 3.35Å; H67-Y118 AromaticContact CE1-CE2 3.68Å; H67-Y118 AromaticContact NE2-CE2 3.64Å; H67-Y118 AromaticContact NE2-CZ 3.6Å; H67-Y118 PolarHBondContact NE2-OH 3.35Å; D114-Y118 VanDerWaalsContact O-CD2 3.24Å; D114-Y118 WeakPolarHBondContact O-CD2 3.37Å; D114-Y118 WeakPolarHBondContact O-CE2 3.47Å; L116-Y118 PolarHBondContact O-N 2.94Å; L116-Y118 VanDerWaalsContact O-N 3.14Å; Y118-T120 PolarHBondContact O-N 3.03Å; Y118-A292 HydrophobicContact CE1-CB 4.11Å; Y118-H295 HydrophobicContact CD1-CB 4.08Å; Y118-H295 AromaticContact CD1-ND1 3.98Å; Y118-H295 HydrophobicContact CE1-CB 4.41Å; Y118-H295 PolarHBondContact O-CE1 3.24Å; Y118-A296 HydrophobicContact CE1-CB 4.09Å
119	Q	98.7	Very high	94.2	Very high	46 Å²	46	37.1 Å²	37.1	22%	0.215	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	41.6	-177.4	-59.1	-63.4	-28	0	0	111.3	L116 N121 I150 K152 T299	L116-Q119 PolarHBondContact O-N 2.84Å; Q119-N121 PolarHBondContact O-N 2.86Å; Q119-I150 PolarHBondContact NE2-O 2.65Å; Q119-I150 PolarHBondContact OE1-O 2.76Å; Q119-K152 HydrophobicContact CB-CD 4.44Å; Q119-K152 HydrophobicContact CB-CG 4.23Å; Q119-K152 WeakPolarHBondContact O-CD 3.24Å; Q119-T299 PolarHBondContact NE2-OG1 2.85Å
120	T	98.5	Very high	93.8	Very high	27 Å²	27	42.8 Å²	42.8	17%	0.166	23%	0.227	C	C	.	.			trans	-66.8	127.6	-167.6	-59.7	0	0	0	0	111.5	I115 Y118 L122 V123	I115-T120 HydrophobicContact CG2-CG2 4.09Å; I115-T120 VanDerWaalsContact O-CB 3.24Å; I115-T120 WeakPolarHBondContact O-CB 3.22Å; I115-T120 PolarHBondContact O-OG1 3.14Å; Y118-T120 PolarHBondContact O-N 3.03Å; T120-L122 WeakPolarHBondContact CG2-O 3.41Å; T120-V123 HydrophobicContact CG2-CG2 3.69Å
121	N	98	Very high	93.6	Very high	88 Å²	88	45 Å²	45	47%	0.471	24%	0.237	S	C	.	.	S	Bend	trans	-86.2	-37	174.9	-74.7	105.2	0	0	0	113	Q119 K152 E155	Q119-N121 PolarHBondContact O-N 2.86Å; N121-K152 WeakPolarHBondContact ND2-CD 3.4Å; N121-K152 PolarHBondContact OD1-NZ 2.75Å; N121-E155 PolarHBondContact O-N 2.71Å
122	L	96.6	Very high	93.5	Very high	67 Å²	67	43.8 Å²	43.8	35%	0.351	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.7	-167.1	-71.4	169.6	0	0	0	110.4	Y14 T120 E155 F157	Y14-L122 HydrophobicContact CD1-CD1 4.24Å; Y14-L122 HydrophobicContact CE1-CD1 3.66Å; T120-L122 WeakPolarHBondContact CG2-O 3.41Å; L122-E155 CarbonylContact C-O 3.28Å; L122-E155 VanDerWaalsContact CA-O 3.31Å; L122-E155 WeakPolarHBondContact CA-O 3.36Å; L122-E155 HydrophobicContact CD2-CB 4.14Å; L122-F157 HydrophobicContact CB-CB 4.18Å; L122-F157 HydrophobicContact CB-CD2 4.35Å; L122-F157 HydrophobicContact CD1-CD2 4.04Å; L122-F157 HydrophobicContact CD2-CD2 4.45Å
123	V	95.7	Very high	93.4	Very high	18 Å²	18	43.8 Å²	43.8	11%	0.109	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.9	178.9	-171	0	0	0	0	110.2	I115 T120 V125 L133 P154 E155 F157	I115-V123 HydrophobicContact CD1-CG1 4.18Å; I115-V123 HydrophobicContact CD1-CG2 4.11Å; I115-V123 HydrophobicContact CG1-CG1 4.41Å; I115-V123 HydrophobicContact CG1-CG2 4.06Å; I115-V123 HydrophobicContact CG2-CG2 3.64Å; T120-V123 HydrophobicContact CG2-CG2 3.69Å; V123-V125 HydrophobicContact CB-CG1 4.39Å; V123-V125 HydrophobicContact CG1-CG1 3.73Å; V123-V125 PolarHBondContact O-N 3.2Å; V123-V125 VanDerWaalsContact O-N 3.15Å; V123-L133 HydrophobicContact CB-CD1 3.94Å; V123-L133 HydrophobicContact CG1-CD1 4.46Å; V123-L133 HydrophobicContact CG2-CD1 3.92Å; V123-P154 HydrophobicContact CG2-CB 3.92Å; V123-E155 PolarHBondContact N-O 3.26Å; V123-F157 PolarHBondContact O-N 3.21Å
124	P	91	Very high	93.4	Very high	62 Å²	62	48 Å²	48	40%	0.403	25%	0.251	S	S	.	.			trans	-74.7	107.2	174.7	29.7	-32.4	0	0	0	110.1	W7 F157	W7-P124 HydrophobicContact CH2-CG 4.35Å; W7-P124 HydrophobicContact CZ2-CB 3.61Å; W7-P124 HydrophobicContact CZ2-CG 3.7Å; P124-F157 HydrophobicContact CB-CB 4.18Å; P124-F157 HydrophobicContact CB-CD1 4.16Å
125	V	85.2	Confident	93.4	Very high	33 Å²	33	47.3 Å²	47.3	20%	0.2	25%	0.247	C	C	.	.			trans	-115.9	141.1	-180	-68.2	0	0	0	0	112.1	M111 V123 Q129 K130 L133 P156	M111-V125 HydrophobicContact CE-CG1 4.27Å; V123-V125 HydrophobicContact CB-CG1 4.39Å; V123-V125 HydrophobicContact CG1-CG1 3.73Å; V123-V125 PolarHBondContact O-N 3.2Å; V123-V125 VanDerWaalsContact O-N 3.15Å; V125-Q129 HydrophobicContact CB-CB 3.99Å; V125-Q129 HydrophobicContact CG1-CB 4.21Å; V125-K130 HydrophobicContact CG2-CG 4.44Å; V125-L133 HydrophobicContact CG1-CB 4.23Å; V125-L133 HydrophobicContact CG1-CD2 4.19Å; V125-L133 HydrophobicContact CG2-CB 4.49Å; V125-L133 HydrophobicContact CG2-CD2 3.72Å; V125-P156 HydrophobicContact CG2-CB 4.37Å
126	G	80.7	Confident	93.3	Very high	34 Å²	34	46.6 Å²	46.6	35%	0.351	24%	0.243	S	C	.	.			trans	-68.8	165	164.5	0	0	0	0	0	111.1	D128 Q129 K130	G126-D128 PolarHBondContact O-N 3.42Å; G126-Q129 PolarHBondContact O-N 3.33Å; G126-K130 PolarHBondContact O-N 2.93Å
127	E	78.4	Confident	93.3	Very high	168 Å²	168	48.3 Å²	48.3	79%	0.785	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-56.7	-35.2	176.5	-68.9	178.5	170.1	0	0	112.2	Q129 K130	E127-Q129 PolarHBondContact O-N 3.5Å; E127-K130 PolarHBondContact O-N 3.4Å
128	D	80.5	Confident	93.3	Very high	93 Å²	93	51.5 Å²	51.5	50%	0.497	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-72.1	-10.9	178.9	66.5	-57.3	0	0	0	114.4	Q88 G126	Q88-D128 PolarHBondContact NE2-O 3.23Å; Q88-D128 PolarHBondContact NE2-OD2 3.22Å; G126-D128 PolarHBondContact O-N 3.42Å
129	Q	86.1	Confident	93.3	Very high	44 Å²	44	50.9 Å²	50.9	21%	0.206	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-111.5	-1.7	-179.4	-57.7	-56.9	-41.6	0	0	113	V125 G126 E127 Q131 H132 L133	V125-Q129 HydrophobicContact CB-CB 3.99Å; V125-Q129 HydrophobicContact CG1-CB 4.21Å; G126-Q129 PolarHBondContact O-N 3.33Å; E127-Q129 PolarHBondContact O-N 3.5Å; Q129-Q131 VanDerWaalsContact C-N 3.32Å; Q129-Q131 PolarHBondContact O-N 2.92Å; Q129-H132 PolarHBondContact O-N 3.42Å; Q129-H132 PolarHBondContact OE1-CE1 3.12Å; Q129-H132 PolarHBondContact OE1-ND1 3.23Å; Q129-L133 PolarHBondContact O-N 2.93Å; Q129-L133 VanDerWaalsContact O-N 3.15Å
130	K	90.9	Very high	93.3	Very high	118 Å²	118	48.7 Å²	48.7	51%	0.513	25%	0.254	S	S	.	.	H	α-helix	trans	-56.5	-43.8	178.9	-74.5	-178.8	176	178.6	0	112.4	V125 G126 E127 H132 L133 E134	V125-K130 HydrophobicContact CG2-CG 4.44Å; G126-K130 PolarHBondContact O-N 2.93Å; E127-K130 PolarHBondContact O-N 3.4Å; K130-H132 VanDerWaalsContact C-N 3.28Å; K130-H132 PolarHBondContact O-N 3.3Å; K130-L133 PolarHBondContact O-N 3.41Å; K130-L133 VanDerWaalsContact O-N 3.15Å; K130-E134 PolarHBondContact O-N 3.33Å
131	Q	95	Very high	93.3	Very high	73 Å²	73	52 Å²	52	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-35.5	-179.4	-161.4	-176.3	13.4	0	0	112.5	R85 M86 T87 Q129 L135	R85-Q131 PolarHBondContact O-NE2 2.89Å; M86-Q131 HydrophobicContact CE-CG 4.14Å; M86-Q131 HydrophobicContact SD-CB 4.14Å; M86-Q131 HydrophobicContact SD-CG 3.48Å; M86-Q131 WeakPolarHBondContact SD-CG 3.29Å; M86-Q131 PolarHBondContact SD-OE1 3.08Å; T87-Q131 PolarHBondContact OG1-OE1 3.41Å; Q129-Q131 VanDerWaalsContact C-N 3.32Å; Q129-Q131 PolarHBondContact O-N 2.92Å; Q131-L135 PolarHBondContact O-N 3.32Å; Q131-L135 VanDerWaalsContact O-N 3.08Å
132	H	96.8	Very high	93.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-73.2	-34.8	176.5	-55.8	142.2	0	0	0	112.3	Y107 M111 Q129 K130 L135 S136	Y107-H132 AromaticContact CE2-CE1 3.66Å; Y107-H132 AromaticContact CZ-CE1 3.62Å; Y107-H132 AromaticContact CZ-NE2 3.78Å; Y107-H132 PolarHBondContact OH-CE1 2.79Å; Y107-H132 PolarHBondContact OH-NE2 3.17Å; M111-H132 HydrophobicContact CE-CB 4.06Å; M111-H132 HydrophobicContact SD-CB 3.46Å; M111-H132 WeakPolarHBondContact SD-CB 3.24Å; Q129-H132 PolarHBondContact O-N 3.42Å; Q129-H132 PolarHBondContact OE1-CE1 3.12Å; Q129-H132 PolarHBondContact OE1-ND1 3.23Å; K130-H132 VanDerWaalsContact C-N 3.28Å; K130-H132 PolarHBondContact O-N 3.3Å; H132-L135 PolarHBondContact O-N 3.39Å; H132-S136 PolarHBondContact O-N 3.14Å; H132-S136 PolarHBondContact O-OG 3.47Å
133	L	97.3	Very high	93.5	Very high	1 Å²	1	47 Å²	47	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-43.1	173	-177.7	61.5	0	0	0	111.2	I115 V123 V125 Q129 K130 L135 S136 R137 P154 P156	I115-L133 HydrophobicContact CD1-CD1 4.19Å; V123-L133 HydrophobicContact CB-CD1 3.94Å; V123-L133 HydrophobicContact CG1-CD1 4.46Å; V123-L133 HydrophobicContact CG2-CD1 3.92Å; V125-L133 HydrophobicContact CG1-CB 4.23Å; V125-L133 HydrophobicContact CG1-CD2 4.19Å; V125-L133 HydrophobicContact CG2-CB 4.49Å; V125-L133 HydrophobicContact CG2-CD2 3.72Å; Q129-L133 PolarHBondContact O-N 2.93Å; Q129-L133 VanDerWaalsContact O-N 3.15Å; K130-L133 PolarHBondContact O-N 3.41Å; K130-L133 VanDerWaalsContact O-N 3.15Å; L133-L135 VanDerWaalsContact C-N 3.34Å; L133-L135 PolarHBondContact O-N 3.02Å; L133-S136 VanDerWaalsContact O-CB 3.32Å; L133-S136 WeakPolarHBondContact O-CB 3.17Å; L133-S136 PolarHBondContact O-N 2.88Å; L133-S136 VanDerWaalsContact O-N 3.09Å; L133-R137 WeakPolarHBondContact O-CG 3.47Å; L133-R137 PolarHBondContact O-N 2.93Å; L133-P154 HydrophobicContact CD1-CB 4.19Å; L133-P154 HydrophobicContact CD1-CG 4Å; L133-P156 HydrophobicContact CD2-CB 3.79Å; L133-P156 HydrophobicContact CD2-CG 4.5Å
134	E	97.5	Very high	93.6	Very high	89 Å²	89	47.2 Å²	47.2	42%	0.416	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-43	174.4	-65.6	-49.7	138.8	0	0	111.7	K130 S136 R137 D138	K130-E134 PolarHBondContact O-N 3.33Å; E134-S136 VanDerWaalsContact C-N 3.27Å; E134-S136 PolarHBondContact O-N 3.39Å; E134-R137 WeakPolarHBondContact O-CB 3.35Å; E134-R137 PolarHBondContact O-N 2.96Å; E134-R137 VanDerWaalsContact O-N 3.07Å; E134-R137 IonicContact OE2-NE 3.54Å; E134-D138 PolarHBondContact O-N 2.85Å
135	L	98.3	Very high	94	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-40.3	173.1	178.3	63	0	0	0	112.1	T78 E82 L83 M86 P108 Q131 H132 L133 R137 D138 I139	T78-L135 HydrophobicContact CG2-CD1 4.33Å; E82-L135 HydrophobicContact CB-CD1 3.86Å; E82-L135 HydrophobicContact CG-CD1 4.32Å; L83-L135 HydrophobicContact CD2-CD2 3.73Å; M86-L135 HydrophobicContact CE-CB 3.64Å; M86-L135 HydrophobicContact CE-CD2 3.53Å; M86-L135 HydrophobicContact CE-CG 4.07Å; P108-L135 HydrophobicContact CB-CD2 3.64Å; Q131-L135 PolarHBondContact O-N 3.32Å; Q131-L135 VanDerWaalsContact O-N 3.08Å; H132-L135 PolarHBondContact O-N 3.39Å; L133-L135 VanDerWaalsContact C-N 3.34Å; L133-L135 PolarHBondContact O-N 3.02Å; L135-R137 VanDerWaalsContact C-N 3.26Å; L135-R137 PolarHBondContact O-N 3.27Å; L135-D138 PolarHBondContact O-N 3.47Å; L135-I139 HydrophobicContact CD1-CD1 3.86Å; L135-I139 HydrophobicContact CD1-CG1 3.98Å; L135-I139 HydrophobicContact CD2-CD1 4.23Å; L135-I139 HydrophobicContact CG-CD1 3.68Å; L135-I139 HydrophobicContact CG-CG1 4.26Å; L135-I139 WeakPolarHBondContact O-CB 3.23Å; L135-I139 VanDerWaalsContact O-CG1 3.28Å; L135-I139 WeakPolarHBondContact O-CG1 3.31Å; L135-I139 PolarHBondContact O-N 2.92Å
136	S	98.6	Very high	94.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-36.9	177.4	-53.4	0	0	0	0	111.6	A112 H132 L133 E134 A140	A112-S136 WeakPolarHBondContact CA-OG 3.24Å; H132-S136 PolarHBondContact O-N 3.14Å; H132-S136 PolarHBondContact O-OG 3.47Å; L133-S136 VanDerWaalsContact O-CB 3.32Å; L133-S136 WeakPolarHBondContact O-CB 3.17Å; L133-S136 PolarHBondContact O-N 2.88Å; L133-S136 VanDerWaalsContact O-N 3.09Å; E134-S136 VanDerWaalsContact C-N 3.27Å; E134-S136 PolarHBondContact O-N 3.39Å; S136-A140 WeakPolarHBondContact O-CB 3.28Å; S136-A140 PolarHBondContact O-N 3.18Å; S136-A140 VanDerWaalsContact O-N 3.12Å
137	R	98.7	Very high	95.5	Very high	37 Å²	37	54.7 Å²	54.7	14%	0.14	27%	0.271	C	S	.	.	H	α-helix	trans	-68.2	-47.1	174.6	-63.9	166.4	62.6	77.2	-6.9	111.4	L133 E134 L135 I139 A140 Q141 V153 P154 E155	L133-R137 WeakPolarHBondContact O-CG 3.47Å; L133-R137 PolarHBondContact O-N 2.93Å; E134-R137 WeakPolarHBondContact O-CB 3.35Å; E134-R137 PolarHBondContact O-N 2.96Å; E134-R137 VanDerWaalsContact O-N 3.07Å; E134-R137 IonicContact OE2-NE 3.54Å; L135-R137 VanDerWaalsContact C-N 3.26Å; L135-R137 PolarHBondContact O-N 3.27Å; R137-I139 PolarHBondContact O-N 3.46Å; R137-A140 PolarHBondContact O-N 3.02Å; R137-Q141 WeakPolarHBondContact O-CB 3.33Å; R137-Q141 VanDerWaalsContact O-CG 3.32Å; R137-Q141 WeakPolarHBondContact O-CG 3.48Å; R137-Q141 PolarHBondContact O-N 3.37Å; R137-V153 HydrophobicContact CB-CG1 3.9Å; R137-V153 HydrophobicContact CG-CG1 3.9Å; R137-P154 WeakPolarHBondContact CD-O 3.48Å; R137-P154 HydrophobicContact CG-CG 4.1Å; R137-P154 VanDerWaalsContact CG-O 3.27Å; R137-P154 WeakPolarHBondContact CG-O 3.37Å; R137-P154 PolarHBondContact NH1-O 2.84Å; R137-E155 IonicContact CZ-OE1 2.75Å; R137-E155 VanDerWaalsContact CZ-OE1 3.23Å; R137-E155 IonicContact CZ-OE2 3.99Å; R137-E155 IonicContact NH1-OE1 2.71Å; R137-E155 PolarHBondContact NH1-OE1 3.31Å; R137-E155 IonicContact NH1-OE2 3.37Å; R137-E155 PolarHBondContact NH1-OE2 3.03Å; R137-E155 IonicContact NH2-OE1 3.23Å; R137-E155 PolarHBondContact NH2-OE1 2.69Å; R137-E155 IonicContact NH2-OE2 3.64Å
138	D	98.6	Very high	96.4	Very high	66 Å²	66	48.5 Å²	48.5	35%	0.353	25%	0.252	S	S	.	.	H	α-helix	trans	-60.6	-44.6	179.7	-71.8	-20.2	0	0	0	111.8	E134 L135 R142	E134-D138 PolarHBondContact O-N 2.85Å; L135-D138 PolarHBondContact O-N 3.47Å; D138-R142 VanDerWaalsContact O-CB 3.23Å; D138-R142 WeakPolarHBondContact O-CB 3.48Å; D138-R142 PolarHBondContact O-N 3.39Å
139	I	98.7	Very high	97.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-46.4	175.8	-68.1	166.8	0	0	0	110.4	L74 T78 A112 L135 R137 R142 F143	L74-I139 HydrophobicContact CB-CG2 4.27Å; L74-I139 HydrophobicContact CD1-CG2 4.23Å; L74-I139 HydrophobicContact CD2-CG2 3.8Å; L74-I139 HydrophobicContact CG-CG2 4.31Å; T78-I139 HydrophobicContact CG2-CD1 4.27Å; T78-I139 WeakPolarHBondContact OG1-CD1 3.24Å; A112-I139 HydrophobicContact CB-CD1 3.97Å; L135-I139 HydrophobicContact CD1-CD1 3.86Å; L135-I139 HydrophobicContact CD1-CG1 3.98Å; L135-I139 HydrophobicContact CD2-CD1 4.23Å; L135-I139 HydrophobicContact CG-CD1 3.68Å; L135-I139 HydrophobicContact CG-CG1 4.26Å; L135-I139 WeakPolarHBondContact O-CB 3.23Å; L135-I139 VanDerWaalsContact O-CG1 3.28Å; L135-I139 WeakPolarHBondContact O-CG1 3.31Å; L135-I139 PolarHBondContact O-N 2.92Å; R137-I139 PolarHBondContact O-N 3.46Å; I139-R142 PolarHBondContact O-N 3.33Å; I139-F143 WeakPolarHBondContact O-CB 3.34Å; I139-F143 PolarHBondContact O-N 3.27Å
140	A	98.8	Very high	97.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.1	-47.3	179.2	0	0	0	0	0	112	L116 S136 R137 R142 F143 N144 F151 V153	L116-A140 HydrophobicContact CD1-CB 3.93Å; L116-A140 HydrophobicContact CD2-CB 3.78Å; S136-A140 WeakPolarHBondContact O-CB 3.28Å; S136-A140 PolarHBondContact O-N 3.18Å; S136-A140 VanDerWaalsContact O-N 3.12Å; R137-A140 PolarHBondContact O-N 3.02Å; A140-R142 PolarHBondContact O-N 3.07Å; A140-F143 PolarHBondContact O-N 3.19Å; A140-N144 WeakPolarHBondContact O-CB 3.16Å; A140-N144 PolarHBondContact O-N 3.03Å; A140-F151 HydrophobicContact CB-CB 4.06Å; A140-F151 HydrophobicContact CB-CD2 4.48Å; A140-V153 HydrophobicContact CB-CG2 4.46Å
141	Q	98.7	Very high	98.1	Very high	95 Å²	95	47.6 Å²	47.6	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-62.5	-42.9	178.2	-72.5	174.2	-9.9	0	0	111.9	R137 N144 A145 V153	R137-Q141 WeakPolarHBondContact O-CB 3.33Å; R137-Q141 VanDerWaalsContact O-CG 3.32Å; R137-Q141 WeakPolarHBondContact O-CG 3.48Å; R137-Q141 PolarHBondContact O-N 3.37Å; Q141-N144 PolarHBondContact O-N 3.15Å; Q141-A145 WeakPolarHBondContact O-CB 3.24Å; Q141-A145 PolarHBondContact O-N 3.27Å; Q141-V153 HydrophobicContact CG-CG1 4.29Å; Q141-V153 HydrophobicContact CG-CG2 3.87Å
142	R	98.7	Very high	98.3	Very high	50 Å²	50	48.5 Å²	48.5	19%	0.189	25%	0.25	C	S	.	.	H	α-helix	trans	-63.6	-45.3	177.5	-177	-177.9	-55.1	138.5	9.7	112.2	Y77 Y79 E82 D138 I139 A140 A145 L146	Y77-R142 VanDerWaalsContact O-CD 3.29Å; Y77-R142 WeakPolarHBondContact O-CD 3.32Å; Y77-R142 PolarHBondContact O-NH1 3.46Å; Y79-R142 VanDerWaalsContact CE2-CZ 3.45Å; E82-R142 IonicContact OE1-CZ 2.71Å; E82-R142 IonicContact OE1-NH1 3.53Å; E82-R142 PolarHBondContact OE1-NH1 2.86Å; E82-R142 IonicContact OE1-NH2 3.51Å; E82-R142 PolarHBondContact OE1-NH2 3.21Å; E82-R142 IonicContact OE2-CZ 2.65Å; E82-R142 IonicContact OE2-NH1 3.69Å; E82-R142 PolarHBondContact OE2-NH1 3.2Å; E82-R142 IonicContact OE2-NH2 3.77Å; D138-R142 VanDerWaalsContact O-CB 3.23Å; D138-R142 WeakPolarHBondContact O-CB 3.48Å; D138-R142 PolarHBondContact O-N 3.39Å; I139-R142 PolarHBondContact O-N 3.33Å; A140-R142 PolarHBondContact O-N 3.07Å; R142-A145 PolarHBondContact O-N 3.07Å; R142-L146 PolarHBondContact O-N 3.02Å
143	F	98.8	Very high	98.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.7	-45.4	176.7	-167.8	-86.3	0	0	0	110.6	Y77 I139 A140 A145 L146 Y147 I150 F151 V303 A306 I307	Y77-F143 HydrophobicContact CD1-CD2 4.12Å; Y77-F143 AromaticContact CD2-CD2 3.85Å; Y77-F143 HydrophobicContact CD2-CD2 3.85Å; Y77-F143 HydrophobicContact CD2-CE2 4.1Å; Y77-F143 HydrophobicContact CE1-CD2 4.15Å; Y77-F143 HydrophobicContact CE1-CE2 4.35Å; Y77-F143 AromaticContact CE2-CD2 3.9Å; Y77-F143 HydrophobicContact CE2-CD2 3.9Å; Y77-F143 AromaticContact CE2-CE2 3.7Å; Y77-F143 HydrophobicContact CE2-CE2 3.7Å; Y77-F143 AromaticContact CG-CD2 3.99Å; Y77-F143 HydrophobicContact CG-CD2 3.99Å; Y77-F143 AromaticContact CZ-CE2 3.84Å; I139-F143 WeakPolarHBondContact O-CB 3.34Å; I139-F143 PolarHBondContact O-N 3.27Å; A140-F143 PolarHBondContact O-N 3.19Å; F143-A145 VanDerWaalsContact C-N 3.33Å; F143-A145 PolarHBondContact O-N 3.38Å; F143-L146 PolarHBondContact O-N 3.41Å; F143-L146 VanDerWaalsContact O-N 3.14Å; F143-Y147 AromaticContact CD1-CD2 3.91Å; F143-Y147 HydrophobicContact CD1-CD2 3.91Å; F143-Y147 AromaticContact CD2-CD2 3.96Å; F143-Y147 HydrophobicContact CD2-CD2 3.96Å; F143-Y147 HydrophobicContact CD2-CE2 4.04Å; F143-Y147 AromaticContact CE1-CD2 3.65Å; F143-Y147 HydrophobicContact CE1-CD2 3.65Å; F143-Y147 HydrophobicContact CE1-CE2 4.47Å; F143-Y147 HydrophobicContact CE1-CG 4.3Å; F143-Y147 AromaticContact CE2-CD2 3.7Å; F143-Y147 HydrophobicContact CE2-CD2 3.7Å; F143-Y147 AromaticContact CE2-CE2 3.71Å; F143-Y147 HydrophobicContact CE2-CE2 3.71Å; F143-Y147 HydrophobicContact CG-CD2 4.06Å; F143-Y147 AromaticContact CZ-CD2 3.53Å; F143-Y147 HydrophobicContact CZ-CD2 3.53Å; F143-Y147 AromaticContact CZ-CE2 3.94Å; F143-Y147 HydrophobicContact CZ-CE2 3.94Å; F143-Y147 HydrophobicContact CZ-CG 4.36Å; F143-Y147 WeakPolarHBondContact O-CD2 3.26Å; F143-Y147 PolarHBondContact O-N 3.37Å; F143-Y147 VanDerWaalsContact O-N 3.08Å; F143-I150 HydrophobicContact CD1-CB 4.14Å; F143-I150 HydrophobicContact CD1-CG1 4.42Å; F143-I150 HydrophobicContact CD1-CG2 4.46Å; F143-I150 HydrophobicContact CE1-CB 3.95Å; F143-I150 HydrophobicContact CE1-CG1 3.97Å; F143-I150 HydrophobicContact CE1-CG2 3.97Å; F143-F151 HydrophobicContact CB-CD2 4.03Å; F143-F151 HydrophobicContact CB-CE2 3.92Å; F143-F151 AromaticContact CD1-CD2 3.81Å; F143-F151 HydrophobicContact CD1-CD2 3.81Å; F143-F151 AromaticContact CD1-CE2 3.49Å; F143-F151 HydrophobicContact CD1-CE2 3.49Å; F143-F151 VanDerWaalsContact CD1-CE2 3.49Å; F143-F151 HydrophobicContact CD1-CZ 4.42Å; F143-F151 HydrophobicContact CD2-CE2 4.2Å; F143-F151 HydrophobicContact CE1-CE2 4.04Å; F143-F151 HydrophobicContact CG-CD2 4.07Å; F143-F151 AromaticContact CG-CE2 3.59Å; F143-F151 HydrophobicContact CG-CE2 3.59Å; F143-V303 HydrophobicContact CE1-CG2 4.41Å; F143-V303 HydrophobicContact CE2-CG1 4.19Å; F143-V303 HydrophobicContact CZ-CB 4.35Å; F143-V303 HydrophobicContact CZ-CG1 3.81Å; F143-V303 HydrophobicContact CZ-CG2 4.38Å; F143-A306 HydrophobicContact CE1-CB 4.32Å; F143-A306 HydrophobicContact CZ-CB 4.24Å; F143-I307 HydrophobicContact CE2-CD1 4.05Å; F143-I307 HydrophobicContact CE2-CG1 3.94Å; F143-I307 HydrophobicContact CZ-CD1 4.37Å; F143-I307 HydrophobicContact CZ-CG1 4Å
144	N	98.8	Very high	98.4	Very high	24 Å²	24	50.5 Å²	50.5	13%	0.128	26%	0.263	C	S	.	.	H	α-helix	trans	-64.6	-35.8	179	-72	-7.6	0	0	0	113.1	A140 Q141 L146 Y147 G148 I150 F151	A140-N144 WeakPolarHBondContact O-CB 3.16Å; A140-N144 PolarHBondContact O-N 3.03Å; Q141-N144 PolarHBondContact O-N 3.15Å; N144-L146 PolarHBondContact O-N 3.04Å; N144-Y147 PolarHBondContact O-N 2.89Å; N144-G148 WeakPolarHBondContact CA-O 3.31Å; N144-G148 CarbonylContact O-C 3.58Å; N144-G148 VanDerWaalsContact O-CA 3.31Å; N144-G148 WeakPolarHBondContact O-CA 3.39Å; N144-G148 PolarHBondContact O-N 3.14Å; N144-G148 PolarHBondContact OD1-O 3.06Å; N144-I150 PolarHBondContact OD1-N 2.84Å; N144-F151 PolarHBondContact ND2-O 3.21Å; N144-F151 PolarHBondContact OD1-N 3.22Å
145	A	98.6	Very high	98.4	Very high	88 Å²	88	50.5 Å²	50.5	73%	0.727	26%	0.263	S	S	*	.	H	α-helix	trans	-63.7	-26.2	176.5	0	0	0	0	0	112.9	Q141 R142 F143	Q141-A145 WeakPolarHBondContact O-CB 3.24Å; Q141-A145 PolarHBondContact O-N 3.27Å; R142-A145 PolarHBondContact O-N 3.07Å; F143-A145 VanDerWaalsContact C-N 3.33Å; F143-A145 PolarHBondContact O-N 3.38Å
146	L	98.5	Very high	98.2	Very high	111 Å²	111	52.7 Å²	52.7	58%	0.581	28%	0.277	S	S	*	.	H	α-helix	trans	-88	-37.9	177.9	-66.8	173.4	0	0	0	112.9	Y77 R142 F143 N144	Y77-L146 HydrophobicContact CD1-CD1 4.02Å; Y77-L146 HydrophobicContact CE1-CD1 3.87Å; R142-L146 PolarHBondContact O-N 3.02Å; F143-L146 PolarHBondContact O-N 3.41Å; F143-L146 VanDerWaalsContact O-N 3.14Å; N144-L146 PolarHBondContact O-N 3.04Å
147	Y	98.5	Very high	97.7	Very high	86 Å²	86	54.1 Å²	54.1	34%	0.337	28%	0.283	S	S	.	.	H	α-helix	trans	-122.8	2.3	-166	-57.3	-64.5	0	0	0	115.5	Y77 F143 N144 A306	Y77-Y147 AromaticContact CE1-CE2 3.59Å; Y77-Y147 HydrophobicContact CE1-CE2 3.59Å; Y77-Y147 AromaticContact CZ-CE2 3.69Å; Y77-Y147 WeakPolarHBondContact OH-CE2 3.32Å; Y77-Y147 PolarHBondContact OH-OH 2.69Å; F143-Y147 AromaticContact CD1-CD2 3.91Å; F143-Y147 HydrophobicContact CD1-CD2 3.91Å; F143-Y147 AromaticContact CD2-CD2 3.96Å; F143-Y147 HydrophobicContact CD2-CD2 3.96Å; F143-Y147 HydrophobicContact CD2-CE2 4.04Å; F143-Y147 AromaticContact CE1-CD2 3.65Å; F143-Y147 HydrophobicContact CE1-CD2 3.65Å; F143-Y147 HydrophobicContact CE1-CE2 4.47Å; F143-Y147 HydrophobicContact CE1-CG 4.3Å; F143-Y147 AromaticContact CE2-CD2 3.7Å; F143-Y147 HydrophobicContact CE2-CD2 3.7Å; F143-Y147 AromaticContact CE2-CE2 3.71Å; F143-Y147 HydrophobicContact CE2-CE2 3.71Å; F143-Y147 HydrophobicContact CG-CD2 4.06Å; F143-Y147 AromaticContact CZ-CD2 3.53Å; F143-Y147 HydrophobicContact CZ-CD2 3.53Å; F143-Y147 AromaticContact CZ-CE2 3.94Å; F143-Y147 HydrophobicContact CZ-CE2 3.94Å; F143-Y147 HydrophobicContact CZ-CG 4.36Å; F143-Y147 WeakPolarHBondContact O-CD2 3.26Å; F143-Y147 PolarHBondContact O-N 3.37Å; F143-Y147 VanDerWaalsContact O-N 3.08Å; N144-Y147 PolarHBondContact O-N 2.89Å; Y147-A306 HydrophobicContact CD1-CB 4.23Å; Y147-A306 VanDerWaalsContact CD1-O 3.24Å; Y147-A306 WeakPolarHBondContact CD1-O 3.43Å; Y147-A306 WeakPolarHBondContact CE1-O 3.18Å; Y147-A306 HydrophobicContact CG-CB 3.97Å
148	G	97.4	Very high	96.8	Very high	38 Å²	38	59.1 Å²	59.1	39%	0.392	31%	0.311	S	S	.	.	S	Bend	trans	89	177.9	-171.7	0	0	0	0	0	112.7	N144 I150	N144-G148 WeakPolarHBondContact CA-O 3.31Å; N144-G148 CarbonylContact O-C 3.58Å; N144-G148 VanDerWaalsContact O-CA 3.31Å; N144-G148 WeakPolarHBondContact O-CA 3.39Å; N144-G148 PolarHBondContact O-N 3.14Å; N144-G148 PolarHBondContact OD1-O 3.06Å; G148-I150 PolarHBondContact O-N 2.9Å
149	E	97.3	Very high	95.4	Very high	190 Å²	190	58 Å²	58	89%	0.888	31%	0.308	S	S	*	.	S	Bend	trans	-70.7	85.2	-175.3	-65.5	-168.4	146	0	0	112.7
150	I	98.4	Very high	93.8	Very high	38 Å²	38	67.6 Å²	67.6	20%	0.195	35%	0.349	C	S	.	.			trans	-94.1	-37.8	177.7	-59.7	-60.5	0	0	0	111.6	Q119 F143 N144 G148 A302 V303 A306	Q119-I150 PolarHBondContact NE2-O 2.65Å; Q119-I150 PolarHBondContact OE1-O 2.76Å; F143-I150 HydrophobicContact CD1-CB 4.14Å; F143-I150 HydrophobicContact CD1-CG1 4.42Å; F143-I150 HydrophobicContact CD1-CG2 4.46Å; F143-I150 HydrophobicContact CE1-CB 3.95Å; F143-I150 HydrophobicContact CE1-CG1 3.97Å; F143-I150 HydrophobicContact CE1-CG2 3.97Å; N144-I150 PolarHBondContact OD1-N 2.84Å; G148-I150 PolarHBondContact O-N 2.9Å; I150-A302 HydrophobicContact CG2-CB 4.37Å; I150-V303 HydrophobicContact CG2-CG2 3.81Å; I150-A306 HydrophobicContact CG1-CB 4.44Å
151	F	98.8	Very high	92	Very high	8 Å²	8	73.2 Å²	73.2	4%	0.035	39%	0.389	C	S	.	.	S	Bend	trans	-110.4	139.4	179.2	-61.9	-56.5	0	0	0	112.1	L70 L74 L116 A140 F143 N144 T299 V303	L70-F151 HydrophobicContact CD1-CZ 4.05Å; L70-F151 HydrophobicContact CD2-CE1 4.21Å; L70-F151 HydrophobicContact CD2-CZ 4.37Å; L74-F151 HydrophobicContact CD2-CE2 4.01Å; L74-F151 HydrophobicContact CD2-CZ 4.09Å; L116-F151 HydrophobicContact CB-CD1 3.74Å; L116-F151 HydrophobicContact CB-CE1 3.9Å; L116-F151 HydrophobicContact CB-CG 4.25Å; L116-F151 HydrophobicContact CD1-CD1 4.44Å; L116-F151 HydrophobicContact CD1-CD2 4.16Å; L116-F151 HydrophobicContact CD1-CE2 4.33Å; L116-F151 HydrophobicContact CD1-CG 4.2Å; L116-F151 HydrophobicContact CD2-CB 4.26Å; L116-F151 HydrophobicContact CD2-CG 4.49Å; L116-F151 HydrophobicContact CG-CD1 4.49Å; A140-F151 HydrophobicContact CB-CB 4.06Å; A140-F151 HydrophobicContact CB-CD2 4.48Å; F143-F151 HydrophobicContact CB-CD2 4.03Å; F143-F151 HydrophobicContact CB-CE2 3.92Å; F143-F151 AromaticContact CD1-CD2 3.81Å; F143-F151 HydrophobicContact CD1-CD2 3.81Å; F143-F151 AromaticContact CD1-CE2 3.49Å; F143-F151 HydrophobicContact CD1-CE2 3.49Å; F143-F151 VanDerWaalsContact CD1-CE2 3.49Å; F143-F151 HydrophobicContact CD1-CZ 4.42Å; F143-F151 HydrophobicContact CD2-CE2 4.2Å; F143-F151 HydrophobicContact CE1-CE2 4.04Å; F143-F151 HydrophobicContact CG-CD2 4.07Å; F143-F151 AromaticContact CG-CE2 3.59Å; F143-F151 HydrophobicContact CG-CE2 3.59Å; N144-F151 PolarHBondContact ND2-O 3.21Å; N144-F151 PolarHBondContact OD1-N 3.22Å; F151-T299 HydrophobicContact CD1-CG2 4.04Å; F151-T299 HydrophobicContact CE1-CG2 3.68Å; F151-V303 HydrophobicContact CE1-CG2 3.57Å; F151-V303 HydrophobicContact CE2-CG2 4.26Å; F151-V303 HydrophobicContact CZ-CG2 3.31Å
152	K	98.6	Very high	90.3	Very high	92 Å²	92	70 Å²	70	40%	0.4	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-68	140	156.5	-65.3	-158.2	-162.1	172.2	0	110.7	Q119 N121 P154	Q119-K152 HydrophobicContact CB-CD 4.44Å; Q119-K152 HydrophobicContact CB-CG 4.23Å; Q119-K152 WeakPolarHBondContact O-CD 3.24Å; N121-K152 WeakPolarHBondContact ND2-CD 3.4Å; N121-K152 PolarHBondContact OD1-NZ 2.75Å; K152-P154 WeakPolarHBondContact O-CD 3.33Å
153	V	98.5	Very high	88.9	Confident	45 Å²	45	68.9 Å²	68.9	27%	0.273	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-84.5	116	173.8	-174.4	0	0	0	0	108.6	R137 A140 Q141	R137-V153 HydrophobicContact CB-CG1 3.9Å; R137-V153 HydrophobicContact CG-CG1 3.9Å; A140-V153 HydrophobicContact CB-CG2 4.46Å; Q141-V153 HydrophobicContact CG-CG1 4.29Å; Q141-V153 HydrophobicContact CG-CG2 3.87Å
154	P	98.2	Very high	87.7	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-78.9	136.6	-171.6	30.9	-36	0	0	0	112.3	I115 L116 V123 L133 R137 K152	I115-P154 HydrophobicContact CG2-CB 3.66Å; I115-P154 HydrophobicContact CG2-CG 3.73Å; L116-P154 HydrophobicContact CD2-CG 4.34Å; V123-P154 HydrophobicContact CG2-CB 3.92Å; L133-P154 HydrophobicContact CD1-CB 4.19Å; L133-P154 HydrophobicContact CD1-CG 4Å; R137-P154 WeakPolarHBondContact CD-O 3.48Å; R137-P154 HydrophobicContact CG-CG 4.1Å; R137-P154 VanDerWaalsContact CG-O 3.27Å; R137-P154 WeakPolarHBondContact CG-O 3.37Å; R137-P154 PolarHBondContact NH1-O 2.84Å; K152-P154 WeakPolarHBondContact O-CD 3.33Å
155	E	97.3	Very high	87.3	Confident	88 Å²	88	77 Å²	77	41%	0.411	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	153.6	175.5	-66.5	-63.7	152.9	0	0	111.9	N121 L122 V123 R137 F157	N121-E155 PolarHBondContact O-N 2.71Å; L122-E155 CarbonylContact C-O 3.28Å; L122-E155 VanDerWaalsContact CA-O 3.31Å; L122-E155 WeakPolarHBondContact CA-O 3.36Å; L122-E155 HydrophobicContact CD2-CB 4.14Å; V123-E155 PolarHBondContact N-O 3.26Å; R137-E155 IonicContact CZ-OE1 2.75Å; R137-E155 VanDerWaalsContact CZ-OE1 3.23Å; R137-E155 IonicContact CZ-OE2 3.99Å; R137-E155 IonicContact NH1-OE1 2.71Å; R137-E155 PolarHBondContact NH1-OE1 3.31Å; R137-E155 IonicContact NH1-OE2 3.37Å; R137-E155 PolarHBondContact NH1-OE2 3.03Å; R137-E155 IonicContact NH2-OE1 3.23Å; R137-E155 PolarHBondContact NH2-OE1 2.69Å; R137-E155 IonicContact NH2-OE2 3.64Å; E155-F157 PolarHBondContact O-N 3.25Å
156	P	93.3	Very high	87.1	Confident	50 Å²	50	73.6 Å²	73.6	33%	0.325	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	131.9	174.2	26.6	-32.9	0	0	0	111.2	V125 L133	V125-P156 HydrophobicContact CG2-CB 4.37Å; L133-P156 HydrophobicContact CD2-CB 3.79Å; L133-P156 HydrophobicContact CD2-CG 4.5Å
157	F	89.3	Confident	87	Confident	31 Å²	31	68.3 Å²	68.3	14%	0.136	36%	0.356	C	S	.	.			trans	-86.9	111.8	169.3	-174.8	-103.5	0	0	0	110.6	M10 L122 V123 P124 E155 P159	M10-F157 HydrophobicContact CE-CD1 4.32Å; M10-F157 HydrophobicContact CE-CD2 4.39Å; M10-F157 HydrophobicContact CE-CE1 3.49Å; M10-F157 VanDerWaalsContact CE-CE1 3.49Å; M10-F157 HydrophobicContact CE-CE2 3.58Å; M10-F157 HydrophobicContact CE-CZ 3.07Å; M10-F157 HydrophobicContact SD-CE1 3.65Å; M10-F157 HydrophobicContact SD-CZ 3.48Å; M10-F157 WeakPolarHBondContact SD-CZ 3.49Å; L122-F157 HydrophobicContact CB-CB 4.18Å; L122-F157 HydrophobicContact CB-CD2 4.35Å; L122-F157 HydrophobicContact CD1-CD2 4.04Å; L122-F157 HydrophobicContact CD2-CD2 4.45Å; V123-F157 PolarHBondContact O-N 3.21Å; P124-F157 HydrophobicContact CB-CB 4.18Å; P124-F157 HydrophobicContact CB-CD1 4.16Å; E155-F157 PolarHBondContact O-N 3.25Å; F157-P159 HydrophobicContact CD1-CB 4.5Å; F157-P159 HydrophobicContact CE1-CB 3.85Å; F157-P159 HydrophobicContact CE1-CG 4.46Å; F157-P159 WeakPolarHBondContact O-CD 3.15Å
158	I	79.7	Confident	86.9	Confident	141 Å²	141	64.3 Å²	64.3	72%	0.723	34%	0.34	S	S	*	.			trans	-100.9	103.4	174.2	-55.7	176.3	0	0	0	107.9	K160	I158-K160 PolarHBondContact O-N 2.84Å
159	P	69.1	Low	86.9	Confident	43 Å²	43	65 Å²	65	28%	0.279	33%	0.334	S	S	.	.			trans	-61.4	139.2	177	21.8	-29.7	0	0	0	110.5	F157 S161	F157-P159 HydrophobicContact CD1-CB 4.5Å; F157-P159 HydrophobicContact CE1-CB 3.85Å; F157-P159 HydrophobicContact CE1-CG 4.46Å; F157-P159 WeakPolarHBondContact O-CD 3.15Å; P159-S161 PolarHBondContact O-N 2.96Å
160	K	65.7	Low	86.9	Confident	201 Å²	201	59.9 Å²	59.9	87%	0.874	31%	0.31	S	S	*	.	S	Bend	trans	-60.2	106.6	170.1	-66.8	-178.5	-178.4	176	0	108	I158 G162	I158-K160 PolarHBondContact O-N 2.84Å; K160-G162 PolarHBondContact O-N 3.03Å
161	S	59.2	Low	86.7	Confident	118 Å²	118	58.9 Å²	58.9	83%	0.825	31%	0.307	S	S	*	.			trans	25.4	89.4	175.8	60.3	0	0	0	0	115.6	P159	P159-S161 PolarHBondContact O-N 2.96Å
162	G	63.1	Low	86.4	Confident	27 Å²	27	64.2 Å²	64.2	28%	0.278	34%	0.34	S	S	.	.			trans	-75.9	156.9	163.1	0	0	0	0	0	111.7	K160 R164	K160-G162 PolarHBondContact O-N 3.03Å; G162-R164 PolarHBondContact O-N 3.36Å; G162-R164 VanDerWaalsContact O-N 3.12Å
163	A	69.1	Low	86.2	Confident	28 Å²	28	63.9 Å²	63.9	23%	0.231	34%	0.338	C	S	.	.			trans	-54.4	120	173.7	0	0	0	0	0	110.5	M1 V165 A231	M1-A163 HydrophobicContact CB-CB 4.32Å; A163-V165 HydrophobicContact CB-CG2 4.35Å; A163-V165 PolarHBondContact O-N 3.4Å; A163-V165 VanDerWaalsContact O-N 3.14Å; A163-A231 HydrophobicContact CB-CB 3.42Å; A163-A231 VanDerWaalsContact CB-CB 3.42Å
164	R	73.9	Confident	85.8	Confident	172 Å²	172	68.9 Å²	68.9	65%	0.649	36%	0.357	S	S	*	.			trans	-84.8	85.4	179	-172.9	179.7	175.8	163.2	0.2	109.1	G162 M166	G162-R164 PolarHBondContact O-N 3.36Å; G162-R164 VanDerWaalsContact O-N 3.12Å; R164-M166 HydrophobicContact CG-SD 3.77Å; R164-M166 PolarHBondContact O-N 3.19Å
165	V	90.6	Very high	85.5	Confident	23 Å²	23	70.9 Å²	70.9	14%	0.139	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-81.6	119.9	-179.8	-176.2	0	0	0	0	110.5	M1 A163 M175 I228	M1-V165 HydrophobicContact CB-CG2 4.35Å; M1-V165 HydrophobicContact CE-CG2 3.74Å; A163-V165 HydrophobicContact CB-CG2 4.35Å; A163-V165 PolarHBondContact O-N 3.4Å; A163-V165 VanDerWaalsContact O-N 3.14Å; V165-M175 HydrophobicContact CG1-CE 3.74Å; V165-M175 HydrophobicContact CG1-SD 4.28Å; V165-M175 PolarHBondContact O-N 2.83Å; V165-I228 HydrophobicContact CG1-CD1 4.08Å; V165-I228 HydrophobicContact CG1-CG1 3.94Å; V165-I228 HydrophobicContact CG2-CG1 4.39Å
166	M	94.4	Very high	85.1	Confident	16 Å²	16	68.8 Å²	68.8	8%	0.079	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-97.3	162.3	-179	-50.9	-60.5	-76.8	0	0	111.4	R164 P171 T172 K174 N224	R164-M166 HydrophobicContact CG-SD 3.77Å; R164-M166 PolarHBondContact O-N 3.19Å; M166-P171 VanDerWaalsContact CB-O 3.27Å; M166-P171 WeakPolarHBondContact CB-O 3.47Å; M166-P171 VanDerWaalsContact CE-O 3.25Å; M166-P171 WeakPolarHBondContact CE-O 3.47Å; M166-P171 WeakPolarHBondContact CG-O 3.48Å; M166-T172 VanDerWaalsContact CE-O 3.23Å; M166-T172 WeakPolarHBondContact CE-O 3.36Å; M166-K174 HydrophobicContact SD-CB 4.42Å; M166-N224 HydrophobicContact CB-CB 4.3Å; M166-N224 WeakPolarHBondContact CB-OD1 3.28Å; M166-N224 PolarHBondContact N-OD1 3.41Å; M166-N224 PolarHBondContact O-ND2 2.63Å; M166-N224 VanDerWaalsContact O-ND2 3.08Å
167	S	96.8	Very high	84.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-60.5	133.9	176.2	-76.7	0	0	0	0	111	L169 E170 P171 K173 N184	S167-L169 VanDerWaalsContact C-N 3.32Å; S167-L169 PolarHBondContact O-N 3.32Å; S167-E170 WeakPolarHBondContact CB-O 3.45Å; S167-E170 CarbonylContact O-C 3.43Å; S167-E170 VanDerWaalsContact O-C 3.28Å; S167-E170 PolarHBondContact O-N 3.46Å; S167-P171 WeakPolarHBondContact O-CA 3.13Å; S167-K173 WeakPolarHBondContact CB-O 3.46Å; S167-K173 PolarHBondContact N-O 3.36Å; S167-N184 WeakPolarHBondContact CA-O 3.22Å
168	L	97.4	Very high	84.4	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.01	41%	0.41	C	S	.	.	S	Bend	trans	-64.6	-30.8	-171.9	-62.9	179.9	0	0	0	114.5	M175 N184 I186 K198 A202 V203 I228	L168-M175 HydrophobicContact CG-CE 4.34Å; L168-N184 PolarHBondContact N-O 3Å; L168-I186 HydrophobicContact CD1-CD1 3.96Å; L168-I186 HydrophobicContact CD1-CG1 3.93Å; L168-I186 HydrophobicContact CD2-CD1 4.48Å; L168-K198 HydrophobicContact CD1-CB 3.82Å; L168-A202 HydrophobicContact CB-CB 4.18Å; L168-A202 HydrophobicContact CD2-CB 4.39Å; L168-A202 CarbonylContact O-C 3.57Å; L168-A202 WeakPolarHBondContact O-CA 3.48Å; L168-V203 PolarHBondContact O-N 3.03Å; L168-I228 HydrophobicContact CD2-CD1 4.07Å
169	L	97.2	Very high	84.8	Confident	52 Å²	52	72.6 Å²	72.6	27%	0.272	38%	0.38	S	S	.	.	S	Bend	trans	-103.8	-10.3	178.6	-52.5	-179.2	0	0	0	112.9	S167 N183 N184 R201	S167-L169 VanDerWaalsContact C-N 3.32Å; S167-L169 PolarHBondContact O-N 3.32Å; L169-N183 HydrophobicContact CD1-CB 3.56Å; L169-N183 HydrophobicContact CG-CB 4.29Å; L169-N184 WeakPolarHBondContact CA-OD1 3.34Å; L169-N184 VanDerWaalsContact CB-OD1 3.26Å; L169-N184 WeakPolarHBondContact CB-OD1 3.44Å; L169-N184 PolarHBondContact N-OD1 2.86Å; L169-R201 WeakPolarHBondContact CD2-O 3.31Å
170	E	96.2	Very high	85.8	Confident	82 Å²	82	78 Å²	78	38%	0.383	41%	0.406	S	S	.	.			trans	-135	70	-180	-67.6	174.4	81.2	0	0	109.5	S167 T172 K173 N184	S167-E170 WeakPolarHBondContact CB-O 3.45Å; S167-E170 CarbonylContact O-C 3.43Å; S167-E170 VanDerWaalsContact O-C 3.28Å; S167-E170 PolarHBondContact O-N 3.46Å; E170-T172 PolarHBondContact O-N 3.49Å; E170-K173 HydrophobicContact CB-CB 4.22Å; E170-K173 WeakPolarHBondContact O-CB 3.36Å; E170-K173 PolarHBondContact O-N 2.87Å; E170-N184 PolarHBondContact N-OD1 3.07Å; E170-N184 PolarHBondContact OE2-ND2 3.42Å
171	P	94.7	Very high	87.2	Confident	18 Å²	18	71 Å²	71	12%	0.117	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.8	-167	29	-37.5	0	0	0	114.4	M166 S167 V203 A220 N224	M166-P171 VanDerWaalsContact CB-O 3.27Å; M166-P171 WeakPolarHBondContact CB-O 3.47Å; M166-P171 VanDerWaalsContact CE-O 3.25Å; M166-P171 WeakPolarHBondContact CE-O 3.47Å; M166-P171 WeakPolarHBondContact CG-O 3.48Å; S167-P171 WeakPolarHBondContact O-CA 3.13Å; P171-V203 HydrophobicContact CG-CG1 3.62Å; P171-A220 HydrophobicContact CB-CB 3.95Å; P171-A220 HydrophobicContact CG-CB 3.8Å; P171-N224 HydrophobicContact CB-CB 4.37Å
172	T	93.1	Very high	88.9	Confident	119 Å²	119	71.4 Å²	71.4	73%	0.73	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-15.9	170	56.7	0	0	0	0	112.6	M166 E170 A220	M166-T172 VanDerWaalsContact CE-O 3.23Å; M166-T172 WeakPolarHBondContact CE-O 3.36Å; E170-T172 PolarHBondContact O-N 3.49Å; T172-A220 HydrophobicContact CG2-CB 4.5Å
173	K	92.7	Very high	90.4	Very high	85 Å²	85	72.8 Å²	72.8	37%	0.37	36%	0.363	S	S	.	.	S	Bend	trans	-102.5	133.1	179.1	-174.8	-172.7	178.6	-167.1	0	110.3	S167 E170 D179	S167-K173 WeakPolarHBondContact CB-O 3.46Å; S167-K173 PolarHBondContact N-O 3.36Å; E170-K173 HydrophobicContact CB-CB 4.22Å; E170-K173 WeakPolarHBondContact O-CB 3.36Å; E170-K173 PolarHBondContact O-N 2.87Å; K173-D179 IonicContact NZ-OD1 3.11Å; K173-D179 IonicContact NZ-OD2 2.74Å; K173-D179 PolarHBondContact NZ-OD2 3.21Å
174	K	90.9	Very high	91.7	Very high	151 Å²	151	71.4 Å²	71.4	66%	0.657	35%	0.352	S	S	*	.	B	Isolated β-bridge	trans	-63.7	137.8	175.4	-174.3	178.1	179.6	179.5	0	109.9	M166 S176	M166-K174 HydrophobicContact SD-CB 4.42Å; K174-S176 PolarHBondContact O-N 2.96Å
175	M	92.2	Very high	92.8	Very high	42 Å²	42	63.6 Å²	63.6	21%	0.207	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-58.8	125.6	176.8	-173.6	-176.2	-72.6	0	0	110	V165 L168 N184 V185	V165-M175 HydrophobicContact CG1-CE 3.74Å; V165-M175 HydrophobicContact CG1-SD 4.28Å; V165-M175 PolarHBondContact O-N 2.83Å; L168-M175 HydrophobicContact CG-CE 4.34Å; M175-N184 VanDerWaalsContact CE-O 3.28Å; M175-N184 WeakPolarHBondContact CE-O 3.35Å; M175-V185 HydrophobicContact CG-CB 4.24Å; M175-V185 HydrophobicContact CG-CG1 4.05Å; M175-V185 HydrophobicContact CG-CG2 4.11Å; M175-V185 HydrophobicContact SD-CB 4.42Å; M175-V185 HydrophobicContact SD-CG1 4.02Å
176	S	88.2	Confident	93	Very high	43 Å²	43	63.9 Å²	63.9	30%	0.301	32%	0.323	S	S	.	.			trans	-115	136.4	178.9	179	0	0	0	0	111.3	K174 S178 D179 V185	K174-S176 PolarHBondContact O-N 2.96Å; S176-S178 PolarHBondContact O-N 3.33Å; S176-S178 PolarHBondContact OG-N 3.23Å; S176-S178 PolarHBondContact OG-OG 3.19Å; S176-D179 WeakPolarHBondContact O-CB 3.22Å; S176-D179 PolarHBondContact O-N 3.06Å; S176-V185 WeakPolarHBondContact O-CG2 3.46Å
177	K	84.5	Confident	93	Very high	197 Å²	197	64.1 Å²	64.1	86%	0.857	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-30.8	175.2	-66.1	-179.1	-177.6	177.5	0	112.1	R182	K177-R182 PolarHBondContact O-NH1 2.89Å
178	S	83.3	Confident	92.9	Very high	91 Å²	91	67.1 Å²	67.1	64%	0.636	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	15.9	-177	69.2	0	0	0	0	113.5	S176 D180	S176-S178 PolarHBondContact O-N 3.33Å; S176-S178 PolarHBondContact OG-N 3.23Å; S176-S178 PolarHBondContact OG-OG 3.19Å; S178-D180 PolarHBondContact O-N 2.89Å
179	D	88.9	Confident	92.8	Very high	15 Å²	15	70.4 Å²	70.4	8%	0.08	36%	0.363	C	S	.	.			trans	-66.1	128.8	174.3	-158.6	-43.7	0	0	0	109.9	K173 S176 N181 N184 V185	K173-D179 IonicContact NZ-OD1 3.11Å; K173-D179 IonicContact NZ-OD2 2.74Å; K173-D179 PolarHBondContact NZ-OD2 3.21Å; S176-D179 WeakPolarHBondContact O-CB 3.22Å; S176-D179 PolarHBondContact O-N 3.06Å; D179-N181 PolarHBondContact O-N 3.42Å; D179-N181 PolarHBondContact OD1-N 3Å; D179-N184 PolarHBondContact OD2-ND2 3.38Å; D179-V185 HydrophobicContact CB-CG2 3.85Å
180	D	90.8	Very high	92.7	Very high	155 Å²	155	69.1 Å²	69.1	83%	0.829	36%	0.356	S	S	*	.	S	Bend	trans	-64.1	-34.2	176.9	-65.9	-36.4	0	0	0	110.7	S178 R182	S178-D180 PolarHBondContact O-N 2.89Å; D180-R182 PolarHBondContact O-N 3.36Å; D180-R182 VanDerWaalsContact O-N 3.1Å
181	N	94.3	Very high	92.7	Very high	56 Å²	56	69.4 Å²	69.4	30%	0.299	36%	0.36	S	S	.	.			trans	-81.7	91.9	173.6	-174.3	-0.3	0	0	0	110.5	D179 N183 N184	D179-N181 PolarHBondContact O-N 3.42Å; D179-N181 PolarHBondContact OD1-N 3Å; N181-N183 PolarHBondContact O-N 3.45Å; N181-N183 WeakPolarHBondContact OD1-CB 3.36Å; N181-N183 PolarHBondContact OD1-N 2.78Å; N181-N183 VanDerWaalsContact OD1-N 3.16Å; N181-N183 PolarHBondContact OD1-ND2 3.15Å; N181-N184 WeakPolarHBondContact O-CB 3.43Å; N181-N184 PolarHBondContact O-N 3.15Å
182	R	94.1	Very high	92.7	Very high	125 Å²	125	69.9 Å²	69.9	47%	0.472	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-58.4	-18.2	179	-59.9	-53.5	-59.6	170.6	-3.2	114.6	K177 D180 N184 V185 K198	K177-R182 PolarHBondContact O-NH1 2.89Å; D180-R182 PolarHBondContact O-N 3.36Å; D180-R182 VanDerWaalsContact O-N 3.1Å; R182-N184 PolarHBondContact O-N 3.23Å; R182-V185 PolarHBondContact O-N 2.78Å; R182-V185 VanDerWaalsContact O-O 3.14Å; R182-K198 WeakPolarHBondContact O-CE 3.11Å; R182-K198 PolarHBondContact O-NZ 3.15Å
183	N	95.8	Very high	92.8	Very high	56 Å²	56	72.4 Å²	72.4	30%	0.299	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-72.2	-17.9	174.9	-60.4	-67.2	0	0	0	112.9	L169 N181 V185	L169-N183 HydrophobicContact CD1-CB 3.56Å; L169-N183 HydrophobicContact CG-CB 4.29Å; N181-N183 PolarHBondContact O-N 3.45Å; N181-N183 WeakPolarHBondContact OD1-CB 3.36Å; N181-N183 PolarHBondContact OD1-N 2.78Å; N181-N183 VanDerWaalsContact OD1-N 3.16Å; N181-N183 PolarHBondContact OD1-ND2 3.15Å; N183-V185 PolarHBondContact O-N 2.85Å
184	N	96.5	Very high	93	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-73.6	-15.4	174.1	-81.3	-27.9	0	0	0	113.4	S167 L168 L169 E170 M175 D179 N181 R182	S167-N184 WeakPolarHBondContact CA-O 3.22Å; L168-N184 PolarHBondContact N-O 3Å; L169-N184 WeakPolarHBondContact CA-OD1 3.34Å; L169-N184 VanDerWaalsContact CB-OD1 3.26Å; L169-N184 WeakPolarHBondContact CB-OD1 3.44Å; L169-N184 PolarHBondContact N-OD1 2.86Å; E170-N184 PolarHBondContact N-OD1 3.07Å; E170-N184 PolarHBondContact OE2-ND2 3.42Å; M175-N184 VanDerWaalsContact CE-O 3.28Å; M175-N184 WeakPolarHBondContact CE-O 3.35Å; D179-N184 PolarHBondContact OD2-ND2 3.38Å; N181-N184 WeakPolarHBondContact O-CB 3.43Å; N181-N184 PolarHBondContact O-N 3.15Å; R182-N184 PolarHBondContact O-N 3.23Å
185	V	95.9	Very high	93.3	Very high	7 Å²	7	63.3 Å²	63.3	4%	0.042	33%	0.33	C	S	.	.			trans	-124.9	137.7	-163.4	-171.4	0	0	0	0	110.7	M175 S176 D179 R182 N183 K198	M175-V185 HydrophobicContact CG-CB 4.24Å; M175-V185 HydrophobicContact CG-CG1 4.05Å; M175-V185 HydrophobicContact CG-CG2 4.11Å; M175-V185 HydrophobicContact SD-CB 4.42Å; M175-V185 HydrophobicContact SD-CG1 4.02Å; S176-V185 WeakPolarHBondContact O-CG2 3.46Å; D179-V185 HydrophobicContact CB-CG2 3.85Å; R182-V185 PolarHBondContact O-N 2.78Å; R182-V185 VanDerWaalsContact O-O 3.14Å; N183-V185 PolarHBondContact O-N 2.85Å; V185-K198 WeakPolarHBondContact O-CD 3.43Å; V185-K198 PolarHBondContact O-NZ 3.39Å
186	I	95.8	Very high	93.5	Very high	29 Å²	29	62.8 Å²	62.8	15%	0.149	33%	0.329	C	S	.	.			trans	-108.9	118.5	167.7	-64.7	169.8	0	0	0	108.2	L168 V195 I199 V260 L264	L168-I186 HydrophobicContact CD1-CD1 3.96Å; L168-I186 HydrophobicContact CD1-CG1 3.93Å; L168-I186 HydrophobicContact CD2-CD1 4.48Å; I186-V195 HydrophobicContact CD1-CG1 4.13Å; I186-V195 HydrophobicContact CG1-CG1 4.42Å; I186-V195 HydrophobicContact CG2-CG1 3.96Å; I186-V195 HydrophobicContact CG2-CG2 3.9Å; I186-I199 HydrophobicContact CD1-CD1 3.69Å; I186-I199 HydrophobicContact CD1-CG1 3.72Å; I186-V260 HydrophobicContact CD1-CG1 4.47Å; I186-V260 HydrophobicContact CG2-CG1 4.46Å; I186-L264 HydrophobicContact CG2-CD1 3.81Å
187	G	94.5	Very high	93.9	Very high	22 Å²	22	67.3 Å²	67.3	23%	0.227	34%	0.343	C	S	.	.			trans	-79.7	149.1	173.3	0	0	0	0	0	112.5	L189 E190	G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 3.02Å; G187-E190 PolarHBondContact N-OE2 3.09Å; G187-E190 VanDerWaalsContact O-CB 3.24Å; G187-E190 WeakPolarHBondContact O-CB 3.34Å; G187-E190 PolarHBondContact O-N 3.32Å
188	L	94.7	Very high	94.6	Very high	62 Å²	62	58.8 Å²	58.8	33%	0.325	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-28.6	176.3	-65.2	-179.4	0	0	0	113	L45 L264 L267 Q268	L45-L188 HydrophobicContact CD1-CB 4.09Å; L45-L188 HydrophobicContact CD1-CD1 4.12Å; L45-L188 HydrophobicContact CD2-CD1 4.28Å; L45-L188 HydrophobicContact CG-CD1 4.46Å; L188-L264 HydrophobicContact CD2-CD2 3.89Å; L188-L267 HydrophobicContact CB-CD2 4.31Å; L188-L267 HydrophobicContact CD2-CD1 4.45Å; L188-Q268 PolarHBondContact O-NE2 3.44Å
189	L	95.1	Very high	95.3	Very high	71 Å²	71	54.4 Å²	54.4	37%	0.372	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	19.1	175.6	-56.6	179.6	0	0	0	111.9	L45 G187 L267 Q268 Y271	L45-L189 HydrophobicContact CD1-CD2 4.09Å; L45-L189 HydrophobicContact CD1-CG 4.32Å; G187-L189 VanDerWaalsContact C-N 3.26Å; G187-L189 PolarHBondContact O-N 3.02Å; L189-L267 HydrophobicContact CD2-CD2 4.33Å; L189-Q268 HydrophobicContact CD2-CG 4.19Å; L189-Y271 HydrophobicContact CD1-CD1 4.19Å; L189-Y271 HydrophobicContact CD1-CD2 4.24Å; L189-Y271 HydrophobicContact CD1-CE1 3.69Å; L189-Y271 HydrophobicContact CD1-CE2 3.74Å; L189-Y271 HydrophobicContact CD1-CG 4.44Å; L189-Y271 VanDerWaalsContact CD1-CZ 3.43Å; L189-Y271 HydrophobicContact CD2-CD1 3.48Å; L189-Y271 VanDerWaalsContact CD2-CD1 3.48Å; L189-Y271 HydrophobicContact CD2-CD2 3.93Å; L189-Y271 HydrophobicContact CD2-CE1 3.88Å; L189-Y271 HydrophobicContact CD2-CE2 4.27Å; L189-Y271 HydrophobicContact CD2-CG 3.51Å; L189-Y271 HydrophobicContact CG-CD1 4.47Å; L189-Y271 HydrophobicContact CG-CE1 4.41Å
190	E	95.7	Very high	95.6	Very high	25 Å²	25	59.8 Å²	59.8	12%	0.117	30%	0.298	C	S	.	.	S	Bend	trans	-76.4	137.2	178	-173.2	169.6	162.4	0	0	110.8	G187 S194 V195 K198 Q268	G187-E190 PolarHBondContact N-OE2 3.09Å; G187-E190 VanDerWaalsContact O-CB 3.24Å; G187-E190 WeakPolarHBondContact O-CB 3.34Å; G187-E190 PolarHBondContact O-N 3.32Å; E190-S194 WeakPolarHBondContact OE1-CB 3.37Å; E190-S194 PolarHBondContact OE1-OG 3.42Å; E190-V195 HydrophobicContact CB-CG2 3.86Å; E190-V195 HydrophobicContact CG-CG2 3.81Å; E190-K198 WeakPolarHBondContact OE1-CD 3.32Å; E190-K198 WeakPolarHBondContact OE1-CE 3.46Å; E190-K198 IonicContact OE1-NZ 2.68Å; E190-K198 PolarHBondContact OE1-NZ 3.01Å; E190-K198 IonicContact OE2-NZ 3.25Å; E190-K198 PolarHBondContact OE2-NZ 2.87Å; E190-Q268 PolarHBondContact O-NE2 2.85Å
191	D	94.5	Very high	96	Very high	89 Å²	89	59 Å²	59	48%	0.476	28%	0.284	S	S	.	.			trans	-51.5	128.1	176.6	168.1	74.1	0	0	0	111.2	K193 S194 V195	D191-K193 PolarHBondContact O-N 3.29Å; D191-K193 VanDerWaalsContact O-N 3.12Å; D191-K193 WeakPolarHBondContact OD2-CA 3.47Å; D191-K193 WeakPolarHBondContact OD2-CB 3.48Å; D191-K193 PolarHBondContact OD2-N 2.89Å; D191-S194 WeakPolarHBondContact O-CA 3.32Å; D191-S194 WeakPolarHBondContact O-CB 3.37Å; D191-S194 PolarHBondContact O-N 3.46Å; D191-S194 PolarHBondContact OD2-N 3.46Å; D191-V195 PolarHBondContact O-N 3.08Å
192	P	94.6	Very high	96.1	Very high	28 Å²	28	56.5 Å²	56.5	18%	0.182	27%	0.271	C	S	.	.	H	α-helix	trans	-53.5	-35	-177.3	-30.2	36.1	0	0	0	114.2	V195 V196 S261	P192-V195 WeakPolarHBondContact O-CB 3.47Å; P192-V195 PolarHBondContact O-N 3.37Å; P192-V196 VanDerWaalsContact O-CG2 3.29Å; P192-V196 WeakPolarHBondContact O-CG2 3.5Å; P192-V196 PolarHBondContact O-N 3.44Å; P192-S261 WeakPolarHBondContact CB-OG 3.47Å
193	K	95.8	Very high	96.3	Very high	172 Å²	172	53.6 Å²	53.6	75%	0.748	27%	0.267	S	S	*	.	H	α-helix	trans	-68.6	-38.2	177.9	-54	176.8	177.3	174.4	0	111.5	D191 K197	D191-K193 PolarHBondContact O-N 3.29Å; D191-K193 VanDerWaalsContact O-N 3.12Å; D191-K193 WeakPolarHBondContact OD2-CA 3.47Å; D191-K193 WeakPolarHBondContact OD2-CB 3.48Å; D191-K193 PolarHBondContact OD2-N 2.89Å; K193-K197 PolarHBondContact O-N 3.32Å
194	S	96.7	Very high	96.3	Very high	45 Å²	45	52.8 Å²	52.8	32%	0.315	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-43.8	172.1	-177.2	0	0	0	0	111.5	E190 D191 K197 K198	E190-S194 WeakPolarHBondContact OE1-CB 3.37Å; E190-S194 PolarHBondContact OE1-OG 3.42Å; D191-S194 WeakPolarHBondContact O-CA 3.32Å; D191-S194 WeakPolarHBondContact O-CB 3.37Å; D191-S194 PolarHBondContact O-N 3.46Å; D191-S194 PolarHBondContact OD2-N 3.46Å; S194-K197 WeakPolarHBondContact O-CB 3.21Å; S194-K197 PolarHBondContact O-N 3.48Å; S194-K198 WeakPolarHBondContact O-CG 3.47Å; S194-K198 PolarHBondContact O-N 2.89Å
195	V	96.6	Very high	96.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.8	-50.8	176.9	177.2	0	0	0	0	111.1	I186 E190 D191 P192 K197 K198 I199 V260 L264	I186-V195 HydrophobicContact CD1-CG1 4.13Å; I186-V195 HydrophobicContact CG1-CG1 4.42Å; I186-V195 HydrophobicContact CG2-CG1 3.96Å; I186-V195 HydrophobicContact CG2-CG2 3.9Å; E190-V195 HydrophobicContact CB-CG2 3.86Å; E190-V195 HydrophobicContact CG-CG2 3.81Å; D191-V195 PolarHBondContact O-N 3.08Å; P192-V195 WeakPolarHBondContact O-CB 3.47Å; P192-V195 PolarHBondContact O-N 3.37Å; V195-K197 VanDerWaalsContact C-N 3.29Å; V195-K197 PolarHBondContact O-N 3.15Å; V195-K198 PolarHBondContact O-N 3.37Å; V195-K198 VanDerWaalsContact O-N 3.12Å; V195-I199 HydrophobicContact CG1-CD1 4.47Å; V195-I199 WeakPolarHBondContact O-CG1 3.29Å; V195-I199 PolarHBondContact O-N 3.42Å; V195-V260 HydrophobicContact CG1-CG1 3.78Å; V195-L264 HydrophobicContact CG1-CD1 4.17Å; V195-L264 HydrophobicContact CG2-CD1 3.78Å
196	V	97.1	Very high	96.3	Very high	30 Å²	30	59.1 Å²	59.1	18%	0.182	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-44.5	176.8	172	0	0	0	0	111.1	P192 K198 I199 K200 A257	P192-V196 VanDerWaalsContact O-CG2 3.29Å; P192-V196 WeakPolarHBondContact O-CG2 3.5Å; P192-V196 PolarHBondContact O-N 3.44Å; V196-K198 PolarHBondContact O-N 2.71Å; V196-I199 PolarHBondContact O-N 3.33Å; V196-K200 HydrophobicContact CG1-CD 4.02Å; V196-K200 HydrophobicContact CG1-CG 4.49Å; V196-K200 WeakPolarHBondContact O-CB 3.4Å; V196-K200 WeakPolarHBondContact O-CG 3.32Å; V196-K200 PolarHBondContact O-N 3.37Å; V196-A257 HydrophobicContact CB-CB 4.36Å; V196-A257 HydrophobicContact CG1-CB 4.17Å; V196-A257 HydrophobicContact CG2-CB 4.16Å
197	K	97.4	Very high	96.3	Very high	138 Å²	138	60.9 Å²	60.9	60%	0.6	32%	0.316	S	S	*	.	H	α-helix	trans	-61.8	-41.5	178.1	-176.6	179.1	178.6	179.5	0	112.2	K193 S194 V195 R201	K193-K197 PolarHBondContact O-N 3.32Å; S194-K197 WeakPolarHBondContact O-CB 3.21Å; S194-K197 PolarHBondContact O-N 3.48Å; V195-K197 VanDerWaalsContact C-N 3.29Å; V195-K197 PolarHBondContact O-N 3.15Å; K197-R201 WeakPolarHBondContact O-CG 3.4Å; K197-R201 PolarHBondContact O-N 3.46Å
198	K	98	Very high	96.2	Very high	18 Å²	18	68.9 Å²	68.9	8%	0.078	35%	0.348	C	S	.	.	H	α-helix	trans	-67.3	-45.2	178.6	-73.5	-178.3	-178	173.7	0	112	L168 R182 V185 E190 S194 V195 V196 K200 R201 A202	L168-K198 HydrophobicContact CD1-CB 3.82Å; R182-K198 WeakPolarHBondContact O-CE 3.11Å; R182-K198 PolarHBondContact O-NZ 3.15Å; V185-K198 WeakPolarHBondContact O-CD 3.43Å; V185-K198 PolarHBondContact O-NZ 3.39Å; E190-K198 WeakPolarHBondContact OE1-CD 3.32Å; E190-K198 WeakPolarHBondContact OE1-CE 3.46Å; E190-K198 IonicContact OE1-NZ 2.68Å; E190-K198 PolarHBondContact OE1-NZ 3.01Å; E190-K198 IonicContact OE2-NZ 3.25Å; E190-K198 PolarHBondContact OE2-NZ 2.87Å; S194-K198 WeakPolarHBondContact O-CG 3.47Å; S194-K198 PolarHBondContact O-N 2.89Å; V195-K198 PolarHBondContact O-N 3.37Å; V195-K198 VanDerWaalsContact O-N 3.12Å; V196-K198 PolarHBondContact O-N 2.71Å; K198-K200 PolarHBondContact O-N 2.94Å; K198-R201 CarbonylContact O-C 3.06Å; K198-R201 PolarHBondContact O-N 3.28Å; K198-R201 VanDerWaalsContact O-N 3.09Å; K198-A202 PolarHBondContact O-N 3.4Å
199	I	97.9	Very high	96.2	Very high	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-64	-42.1	178.7	-63.6	-155.1	0	0	0	111.5	I186 V195 V196 R201 A202 L225 K253 V256 A257 V260	I186-I199 HydrophobicContact CD1-CD1 3.69Å; I186-I199 HydrophobicContact CD1-CG1 3.72Å; V195-I199 HydrophobicContact CG1-CD1 4.47Å; V195-I199 WeakPolarHBondContact O-CG1 3.29Å; V195-I199 PolarHBondContact O-N 3.42Å; V196-I199 PolarHBondContact O-N 3.33Å; I199-R201 PolarHBondContact O-N 2.89Å; I199-R201 VanDerWaalsContact O-N 3.16Å; I199-A202 VanDerWaalsContact O-CB 3.24Å; I199-A202 WeakPolarHBondContact O-CB 3.25Å; I199-A202 PolarHBondContact O-N 3.03Å; I199-L225 HydrophobicContact CG2-CD2 4.13Å; I199-K253 WeakPolarHBondContact CG2-O 3.49Å; I199-V256 HydrophobicContact CD1-CG1 3.67Å; I199-V256 HydrophobicContact CG2-CB 3.99Å; I199-V256 HydrophobicContact CG2-CG1 3.95Å; I199-A257 HydrophobicContact CB-CB 4.19Å; I199-A257 HydrophobicContact CG2-CB 4.08Å; I199-V260 HydrophobicContact CD1-CB 4.11Å; I199-V260 HydrophobicContact CD1-CG1 4.41Å; I199-V260 HydrophobicContact CD1-CG2 3.95Å
200	K	97	Very high	96.2	Very high	127 Å²	127	70.2 Å²	70.2	55%	0.552	36%	0.364	S	S	*	.	H	α-helix	trans	-58.4	-30.2	174.6	-74.4	-178.8	177.1	-178.4	0	112.8	V196 K198 K253	V196-K200 HydrophobicContact CG1-CD 4.02Å; V196-K200 HydrophobicContact CG1-CG 4.49Å; V196-K200 WeakPolarHBondContact O-CB 3.4Å; V196-K200 WeakPolarHBondContact O-CG 3.32Å; V196-K200 PolarHBondContact O-N 3.37Å; K198-K200 PolarHBondContact O-N 2.94Å; K200-K253 WeakPolarHBondContact O-CD 3.27Å; K200-K253 PolarHBondContact O-NZ 3.26Å; K200-K253 VanDerWaalsContact O-NZ 3.1Å
201	R	97.2	Very high	96.3	Very high	140 Å²	140	72.3 Å²	72.3	53%	0.528	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3	177.6	-67.5	-179.2	72.2	-165.9	5.9	114.7	L169 K197 K198 I199	L169-R201 WeakPolarHBondContact CD2-O 3.31Å; K197-R201 WeakPolarHBondContact O-CG 3.4Å; K197-R201 PolarHBondContact O-N 3.46Å; K198-R201 CarbonylContact O-C 3.06Å; K198-R201 PolarHBondContact O-N 3.28Å; K198-R201 VanDerWaalsContact O-N 3.09Å; I199-R201 PolarHBondContact O-N 2.89Å; I199-R201 VanDerWaalsContact O-N 3.16Å
202	A	97.8	Very high	96.5	Very high	3 Å²	3	68.4 Å²	68.4	3%	0.025	36%	0.358	C	S	.	.			trans	-54.4	141.3	178.7	0	0	0	0	0	110.9	L168 K198 I199 L225 K253	L168-A202 HydrophobicContact CB-CB 4.18Å; L168-A202 HydrophobicContact CD2-CB 4.39Å; L168-A202 CarbonylContact O-C 3.57Å; L168-A202 WeakPolarHBondContact O-CA 3.48Å; K198-A202 PolarHBondContact O-N 3.4Å; I199-A202 VanDerWaalsContact O-CB 3.24Å; I199-A202 WeakPolarHBondContact O-CB 3.25Å; I199-A202 PolarHBondContact O-N 3.03Å; A202-L225 HydrophobicContact CB-CD2 4.09Å; A202-K253 WeakPolarHBondContact O-CE 3.26Å; A202-K253 PolarHBondContact O-NZ 2.79Å
203	V	97.2	Very high	96.6	Very high	63 Å²	63	72.5 Å²	72.5	38%	0.382	37%	0.37	S	S	.	.			trans	-69.3	139.4	-179.6	90.9	0	0	0	0	109.1	L168 P171 G221	L168-V203 PolarHBondContact O-N 3.03Å; P171-V203 HydrophobicContact CG-CG1 3.62Å; V203-G221 VanDerWaalsContact O-CA 3.28Å; V203-G221 WeakPolarHBondContact O-CA 3.2Å
204	T	97.2	Very high	96.7	Very high	40 Å²	40	68.2 Å²	68.2	25%	0.245	35%	0.35	C	S	.	.			trans	-122.8	-178.9	169.4	52.6	0	0	0	0	107.7	V222 L225 Y249	T204-V222 HydrophobicContact CG2-CG2 4.1Å; T204-L225 HydrophobicContact CG2-CD1 4.13Å; T204-Y249 HydrophobicContact CG2-CD2 4.14Å; T204-Y249 HydrophobicContact CG2-CG 4.25Å
205	D	96.3	Very high	96.7	Very high	25 Å²	25	67.3 Å²	67.3	13%	0.134	34%	0.341	C	S	.	.			trans	-84.4	-177.9	167.8	58.7	71.6	0	0	0	111.8	D207 K219 V222 Y249	D205-D207 WeakPolarHBondContact OD1-CB 3.46Å; D205-D207 PolarHBondContact OD1-N 2.81Å; D205-K219 IonicContact OD1-NZ 2.69Å; D205-K219 PolarHBondContact OD1-NZ 3.49Å; D205-K219 VanDerWaalsContact OD1-NZ 3.11Å; D205-K219 WeakPolarHBondContact OD2-CB 3Å; D205-K219 WeakPolarHBondContact OD2-CE 3.39Å; D205-K219 WeakPolarHBondContact OD2-CG 3.1Å; D205-K219 IonicContact OD2-NZ 2.85Å; D205-K219 PolarHBondContact OD2-NZ 3.12Å; D205-V222 WeakPolarHBondContact OD2-CG2 3.48Å; D205-Y249 WeakPolarHBondContact OD1-CE2 3.36Å; D205-Y249 VanDerWaalsContact OD1-CZ 3.31Å; D205-Y249 PolarHBondContact OD1-OH 3.12Å; D205-Y249 PolarHBondContact OD2-OH 3.22Å
206	S	95.5	Very high	96.6	Very high	114 Å²	114	71.4 Å²	71.4	80%	0.797	37%	0.366	S	S	*	.			trans	-115.4	29.4	179.5	-54.4	0	0	0	0	111.9	E208	S206-E208 PolarHBondContact O-N 3.2Å
207	D	95.7	Very high	96.5	Very high	66 Å²	66	78.5 Å²	78.5	35%	0.353	40%	0.397	S	S	.	.			trans	-59.6	137.9	176.8	-72.8	-3.6	0	0	0	110.7	D205 P209 P210 K219	D205-D207 WeakPolarHBondContact OD1-CB 3.46Å; D205-D207 PolarHBondContact OD1-N 2.81Å; D207-P209 CarbonylContact C-O 3.54Å; D207-P209 CarbonylContact O-C 3.22Å; D207-P210 WeakPolarHBondContact O-CA 3.32Å; D207-K219 IonicContact OD2-NZ 2.83Å; D207-K219 PolarHBondContact OD2-NZ 3.06Å
208	E	93.4	Very high	96.4	Very high	190 Å²	190	77.3 Å²	77.3	89%	0.888	40%	0.398	S	S	*	.	S	Bend	trans	-122.5	113.9	176.5	-69.6	-173.6	-165.7	0	0	110.1	S206	S206-E208 PolarHBondContact O-N 3.2Å
209	P	93.7	Very high	96.4	Very high	102 Å²	102	76.6 Å²	76.6	66%	0.662	39%	0.394	S	S	*	.	S	Bend	cis	-70	159.6	-4.4	32.2	-36.2	0	0	0	112.5	D207 V211	D207-P209 CarbonylContact C-O 3.54Å; D207-P209 CarbonylContact O-C 3.22Å; P209-V211 PolarHBondContact O-N 3.36Å
210	P	95.8	Very high	96.4	Very high	60 Å²	60	77.5 Å²	77.5	39%	0.39	40%	0.402	S	S	.	.			trans	-60.5	129.4	172.4	-23.3	33.7	0	0	0	111.4	D207 Y249	D207-P210 WeakPolarHBondContact O-CA 3.32Å; P210-Y249 HydrophobicContact CB-CD1 4.13Å; P210-Y249 HydrophobicContact CB-CD2 4.13Å; P210-Y249 HydrophobicContact CB-CE1 3.85Å; P210-Y249 HydrophobicContact CB-CE2 3.87Å; P210-Y249 HydrophobicContact CB-CG 4.25Å
211	V	97.3	Very high	96.4	Very high	68 Å²	68	71.8 Å²	71.8	41%	0.412	38%	0.379	S	S	.	.			trans	-130.3	121	178.4	178.6	0	0	0	0	109.6	P209 R213 K219 Y249	P209-V211 PolarHBondContact O-N 3.36Å; V211-R213 HydrophobicContact CG1-CB 4.07Å; V211-R213 PolarHBondContact O-N 2.95Å; V211-R213 VanDerWaalsContact O-N 3.1Å; V211-K219 WeakPolarHBondContact O-CE 3.24Å; V211-K219 PolarHBondContact O-NZ 3.34Å; V211-Y249 PolarHBondContact N-OH 3.05Å; V211-Y249 WeakPolarHBondContact O-CE1 3.27Å; V211-Y249 PolarHBondContact O-OH 3.08Å
212	V	97.6	Very high	96.4	Very high	8 Å²	8	65.1 Å²	65.1	5%	0.048	35%	0.354	C	S	.	.			trans	-77.3	94.9	174.1	178.4	0	0	0	0	108.6	V222 L226 F244 Y249 L252	V212-V222 HydrophobicContact CG1-CG1 4.27Å; V212-L226 HydrophobicContact CG1-CD1 4.03Å; V212-L226 HydrophobicContact CG1-CD2 3.81Å; V212-L226 HydrophobicContact CG1-CG 4.15Å; V212-F244 HydrophobicContact CB-CB 3.68Å; V212-F244 HydrophobicContact CB-CG 4.49Å; V212-F244 HydrophobicContact CG1-CB 3.68Å; V212-F244 HydrophobicContact CG1-CD2 4.2Å; V212-F244 HydrophobicContact CG1-CG 4.11Å; V212-F244 HydrophobicContact CG2-CB 3.96Å; V212-Y249 HydrophobicContact CG2-CD1 4Å; V212-Y249 HydrophobicContact CG2-CE1 4.29Å; V212-L252 HydrophobicContact CG1-CD1 4.4Å; V212-L252 HydrophobicContact CG1-CD2 3.9Å; V212-L252 HydrophobicContact CG2-CB 4.21Å; V212-L252 HydrophobicContact CG2-CD2 4.2Å
213	R	97.2	Very high	96.4	Very high	114 Å²	114	65 Å²	65	43%	0.43	35%	0.353	S	S	.	.			trans	-139.7	140.4	-179.7	-175.5	175.5	60.3	101.7	5	109.9	V211 D215 K219 E241	V211-R213 HydrophobicContact CG1-CB 4.07Å; V211-R213 PolarHBondContact O-N 2.95Å; V211-R213 VanDerWaalsContact O-N 3.1Å; R213-D215 IonicContact NH1-OD2 3.94Å; R213-D215 IonicContact NH2-OD2 3.84Å; R213-D215 PolarHBondContact O-N 3.34Å; R213-K219 HydrophobicContact CB-CD 4.48Å; R213-K219 WeakPolarHBondContact O-CE 3.39Å; R213-E241 VanDerWaalsContact CA-OE1 3.31Å; R213-E241 WeakPolarHBondContact CA-OE1 3.37Å; R213-E241 VanDerWaalsContact CG-OE1 3.3Å; R213-E241 WeakPolarHBondContact CG-OE1 3.46Å
214	Y	97.4	Very high	96.4	Very high	82 Å²	82	62.1 Å²	62.1	32%	0.322	34%	0.335	S	S	.	.			trans	-79.1	114.3	178.5	-166.2	-91.5	0	0	0	110.3	V216 L226 D227 I237 E241	Y214-V216 HydrophobicContact CE1-CG2 3.7Å; Y214-V216 WeakPolarHBondContact OH-CG2 3.39Å; Y214-L226 HydrophobicContact CD2-CB 4.24Å; Y214-L226 HydrophobicContact CD2-CD1 4.31Å; Y214-D227 WeakPolarHBondContact CE2-OD1 3.29Å; Y214-D227 PolarHBondContact OH-OD1 3.4Å; Y214-D227 PolarHBondContact OH-OD2 3.03Å; Y214-I237 VanDerWaalsContact CB-CG2 3.45Å; Y214-I237 HydrophobicContact CD1-CG2 4.43Å; Y214-I237 HydrophobicContact CD2-CD1 4.06Å; Y214-I237 HydrophobicContact CD2-CG1 4.36Å; Y214-I237 HydrophobicContact CD2-CG2 3.81Å; Y214-I237 HydrophobicContact CE2-CD1 4.2Å; Y214-I237 HydrophobicContact CG-CG2 3.65Å; Y214-E241 PolarHBondContact N-OE1 2.73Å
215	D	96.5	Very high	96.5	Very high	26 Å²	26	60.3 Å²	60.3	14%	0.139	32%	0.324	C	S	.	.			trans	-156.3	98.3	177	-176.5	-24	0	0	0	107.6	R213 Q217 N218 K219 A220 S223	R213-D215 IonicContact NH1-OD2 3.94Å; R213-D215 IonicContact NH2-OD2 3.84Å; R213-D215 PolarHBondContact O-N 3.34Å; D215-Q217 PolarHBondContact O-N 2.8Å; D215-Q217 PolarHBondContact OD1-N 3.05Å; D215-N218 PolarHBondContact OD1-N 2.89Å; D215-N218 PolarHBondContact OD1-ND2 2.86Å; D215-N218 PolarHBondContact OD2-ND2 3.02Å; D215-K219 HydrophobicContact CB-CB 4.14Å; D215-K219 HydrophobicContact CB-CD 4.19Å; D215-K219 HydrophobicContact CB-CG 4.15Å; D215-K219 CarbonylContact O-C 3.56Å; D215-K219 WeakPolarHBondContact O-CA 3.34Å; D215-K219 WeakPolarHBondContact O-CB 3.48Å; D215-K219 PolarHBondContact O-N 3.04Å; D215-A220 PolarHBondContact O-N 2.95Å; D215-S223 PolarHBondContact N-OG 3.45Å; D215-S223 PolarHBondContact O-OG 2.69Å
216	V	95	Very high	96.5	Very high	86 Å²	86	59.1 Å²	59.1	52%	0.521	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.5	-176.7	179.7	0	0	0	0	111.6	Y214 A220	Y214-V216 HydrophobicContact CE1-CG2 3.7Å; Y214-V216 WeakPolarHBondContact OH-CG2 3.39Å; V216-A220 WeakPolarHBondContact O-CB 3.5Å
217	Q	95	Very high	96.6	Very high	179 Å²	179	55.3 Å²	55.3	84%	0.836	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-48.1	-177.2	-65.2	-177.2	-3.3	0	0	111.4	D215	D215-Q217 PolarHBondContact O-N 2.8Å; D215-Q217 PolarHBondContact OD1-N 3.05Å
218	N	96.7	Very high	96.6	Very high	113 Å²	113	52.2 Å²	52.2	60%	0.604	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-22.7	-173.1	-55.9	-61.7	0	0	0	113.3	D215	D215-N218 PolarHBondContact OD1-N 2.89Å; D215-N218 PolarHBondContact OD1-ND2 2.86Å; D215-N218 PolarHBondContact OD2-ND2 3.02Å
219	K	97.3	Very high	96.7	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	23%	0.23	C	C	.	.			trans	-133.8	42.8	-171.1	-53.1	176.9	66.5	65.1	0	111.5	D205 D207 V211 R213 D215 G221 V222 S223 Y249	D205-K219 IonicContact OD1-NZ 2.69Å; D205-K219 PolarHBondContact OD1-NZ 3.49Å; D205-K219 VanDerWaalsContact OD1-NZ 3.11Å; D205-K219 WeakPolarHBondContact OD2-CB 3Å; D205-K219 WeakPolarHBondContact OD2-CE 3.39Å; D205-K219 WeakPolarHBondContact OD2-CG 3.1Å; D205-K219 IonicContact OD2-NZ 2.85Å; D205-K219 PolarHBondContact OD2-NZ 3.12Å; D207-K219 IonicContact OD2-NZ 2.83Å; D207-K219 PolarHBondContact OD2-NZ 3.06Å; V211-K219 WeakPolarHBondContact O-CE 3.24Å; V211-K219 PolarHBondContact O-NZ 3.34Å; R213-K219 HydrophobicContact CB-CD 4.48Å; R213-K219 WeakPolarHBondContact O-CE 3.39Å; D215-K219 HydrophobicContact CB-CB 4.14Å; D215-K219 HydrophobicContact CB-CD 4.19Å; D215-K219 HydrophobicContact CB-CG 4.15Å; D215-K219 CarbonylContact O-C 3.56Å; D215-K219 WeakPolarHBondContact O-CA 3.34Å; D215-K219 WeakPolarHBondContact O-CB 3.48Å; D215-K219 PolarHBondContact O-N 3.04Å; K219-G221 PolarHBondContact O-N 3.18Å; K219-G221 VanDerWaalsContact O-N 3.13Å; K219-V222 HydrophobicContact CB-CB 4.28Å; K219-V222 PolarHBondContact O-N 3.39Å; K219-V222 VanDerWaalsContact O-N 3.1Å; K219-S223 WeakPolarHBondContact O-CB 3.26Å; K219-S223 PolarHBondContact O-N 2.86Å; K219-S223 PolarHBondContact O-OG 3.25Å; K219-Y249 PolarHBondContact NZ-OH 3.45Å
220	A	97.3	Very high	96.7	Very high	19 Å²	19	39.8 Å²	39.8	16%	0.157	21%	0.208	C	C	.	.	H	α-helix	trans	-51.6	-40.2	-174.5	0	0	0	0	0	113.4	P171 T172 D215 V216 N224	P171-A220 HydrophobicContact CB-CB 3.95Å; P171-A220 HydrophobicContact CG-CB 3.8Å; T172-A220 HydrophobicContact CG2-CB 4.5Å; D215-A220 PolarHBondContact O-N 2.95Å; V216-A220 WeakPolarHBondContact O-CB 3.5Å; A220-N224 WeakPolarHBondContact O-CB 3.45Å; A220-N224 PolarHBondContact O-N 2.68Å
221	G	97.6	Very high	96.6	Very high	7 Å²	7	37.3 Å²	37.3	7%	0.072	19%	0.192	C	C	.	.	H	α-helix	trans	-65.6	-46	178.5	0	0	0	0	0	113.6	V203 K219 N224 L225	V203-G221 VanDerWaalsContact O-CA 3.28Å; V203-G221 WeakPolarHBondContact O-CA 3.2Å; K219-G221 PolarHBondContact O-N 3.18Å; K219-G221 VanDerWaalsContact O-N 3.13Å; G221-N224 PolarHBondContact O-N 2.85Å; G221-L225 WeakPolarHBondContact O-CG 3.42Å; G221-L225 PolarHBondContact O-N 2.83Å
222	V	97.9	Very high	96.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.3	-41.9	176.4	177.1	0	0	0	0	110.7	T204 D205 V212 K219 N224 L225 L226 Y249 L252	T204-V222 HydrophobicContact CG2-CG2 4.1Å; D205-V222 WeakPolarHBondContact OD2-CG2 3.48Å; V212-V222 HydrophobicContact CG1-CG1 4.27Å; K219-V222 HydrophobicContact CB-CB 4.28Å; K219-V222 PolarHBondContact O-N 3.39Å; K219-V222 VanDerWaalsContact O-N 3.1Å; V222-N224 PolarHBondContact O-N 3.15Å; V222-L225 PolarHBondContact O-N 2.74Å; V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 PolarHBondContact O-N 2.77Å; V222-Y249 HydrophobicContact CG2-CD1 4.25Å; V222-Y249 HydrophobicContact CG2-CE1 3.9Å; V222-Y249 HydrophobicContact CG2-CE2 4.45Å; V222-L252 HydrophobicContact CG1-CD2 4Å
223	S	97.4	Very high	96.2	Very high	1 Å²	1	38 Å²	38	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-44.7	177	-54.4	0	0	0	0	111.7	D215 K219 L225 L226 D227	D215-S223 PolarHBondContact N-OG 3.45Å; D215-S223 PolarHBondContact O-OG 2.69Å; K219-S223 WeakPolarHBondContact O-CB 3.26Å; K219-S223 PolarHBondContact O-N 2.86Å; K219-S223 PolarHBondContact O-OG 3.25Å; S223-L225 VanDerWaalsContact C-N 3.33Å; S223-L225 PolarHBondContact O-N 2.86Å; S223-L226 WeakPolarHBondContact O-CB 3.36Å; S223-L226 PolarHBondContact O-N 3.04Å; S223-D227 PolarHBondContact O-N 3.35Å
224	N	97.5	Very high	95.9	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-62	-38.7	175.7	-177.2	43.2	0	0	0	112.5	M166 P171 A220 G221 V222 D227 I228	M166-N224 HydrophobicContact CB-CB 4.3Å; M166-N224 WeakPolarHBondContact CB-OD1 3.28Å; M166-N224 PolarHBondContact N-OD1 3.41Å; M166-N224 PolarHBondContact O-ND2 2.63Å; M166-N224 VanDerWaalsContact O-ND2 3.08Å; P171-N224 HydrophobicContact CB-CB 4.37Å; A220-N224 WeakPolarHBondContact O-CB 3.45Å; A220-N224 PolarHBondContact O-N 2.68Å; G221-N224 PolarHBondContact O-N 2.85Å; V222-N224 PolarHBondContact O-N 3.15Å; N224-D227 PolarHBondContact O-N 3.18Å; N224-I228 WeakPolarHBondContact O-CB 3.49Å; N224-I228 WeakPolarHBondContact O-CD1 3.49Å; N224-I228 VanDerWaalsContact O-CG1 3.22Å; N224-I228 WeakPolarHBondContact O-CG1 3.33Å; N224-I228 PolarHBondContact O-N 3.22Å
225	L	97.9	Very high	95.8	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-41.7	175.6	-71.1	172.8	0	0	0	111.6	I199 A202 T204 G221 V222 S223 I228 L229 L252 K253 V256	I199-L225 HydrophobicContact CG2-CD2 4.13Å; A202-L225 HydrophobicContact CB-CD2 4.09Å; T204-L225 HydrophobicContact CG2-CD1 4.13Å; G221-L225 WeakPolarHBondContact O-CG 3.42Å; G221-L225 PolarHBondContact O-N 2.83Å; V222-L225 PolarHBondContact O-N 2.74Å; S223-L225 VanDerWaalsContact C-N 3.33Å; S223-L225 PolarHBondContact O-N 2.86Å; L225-I228 PolarHBondContact O-N 2.96Å; L225-L229 WeakPolarHBondContact O-CB 3.5Å; L225-L229 PolarHBondContact O-N 3.24Å; L225-L252 HydrophobicContact CB-CD2 3.83Å; L225-L252 HydrophobicContact CB-CG 4.12Å; L225-L252 HydrophobicContact CD1-CD2 4.1Å; L225-L252 HydrophobicContact CD1-CG 4.43Å; L225-K253 HydrophobicContact CD1-CG 3.85Å; L225-V256 HydrophobicContact CB-CG2 4.16Å; L225-V256 HydrophobicContact CD2-CB 4.49Å; L225-V256 HydrophobicContact CD2-CG1 4.16Å; L225-V256 HydrophobicContact CD2-CG2 4.34Å
226	L	97.4	Very high	95.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-43.2	173.1	-73.8	168.5	0	0	0	111.8	V212 Y214 V222 S223 I228 L229 S230 I237 L240 E241 F244 L252	V212-L226 HydrophobicContact CG1-CD1 4.03Å; V212-L226 HydrophobicContact CG1-CD2 3.81Å; V212-L226 HydrophobicContact CG1-CG 4.15Å; Y214-L226 HydrophobicContact CD2-CB 4.24Å; Y214-L226 HydrophobicContact CD2-CD1 4.31Å; V222-L226 HydrophobicContact CG1-CD1 4.32Å; V222-L226 PolarHBondContact O-N 2.77Å; S223-L226 WeakPolarHBondContact O-CB 3.36Å; S223-L226 PolarHBondContact O-N 3.04Å; L226-I228 PolarHBondContact O-N 2.9Å; L226-L229 PolarHBondContact O-N 3.15Å; L226-S230 WeakPolarHBondContact O-CB 3.28Å; L226-S230 PolarHBondContact O-N 3.24Å; L226-I237 HydrophobicContact CB-CD1 3.99Å; L226-L240 HydrophobicContact CD2-CB 3.71Å; L226-L240 HydrophobicContact CD2-CD1 4.28Å; L226-E241 HydrophobicContact CD1-CG 4.42Å; L226-F244 HydrophobicContact CD2-CD2 4.46Å; L226-L252 HydrophobicContact CD2-CD1 4.05Å; L226-L252 HydrophobicContact CG-CD1 4.49Å
227	D	96.1	Very high	95.8	Very high	34 Å²	34	33.2 Å²	33.2	18%	0.182	20%	0.2	C	C	.	.	H	α-helix	trans	-60.7	-43.5	175.5	-81	-37	0	0	0	112.1	Y214 S223 N224 A231	Y214-D227 WeakPolarHBondContact CE2-OD1 3.29Å; Y214-D227 PolarHBondContact OH-OD1 3.4Å; Y214-D227 PolarHBondContact OH-OD2 3.03Å; S223-D227 PolarHBondContact O-N 3.35Å; N224-D227 PolarHBondContact O-N 3.18Å; D227-A231 WeakPolarHBondContact O-CB 3.18Å; D227-A231 PolarHBondContact O-N 3.45Å
228	I	95.7	Very high	95.9	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-47.2	176.7	-70.3	164.6	0	0	0	110.1	M1 V165 L168 N224 L225 L226 A231 V232 V256 V260	M1-I228 HydrophobicContact CE-CG1 4.46Å; M1-I228 HydrophobicContact CE-CG2 4.02Å; V165-I228 HydrophobicContact CG1-CD1 4.08Å; V165-I228 HydrophobicContact CG1-CG1 3.94Å; V165-I228 HydrophobicContact CG2-CG1 4.39Å; L168-I228 HydrophobicContact CD2-CD1 4.07Å; N224-I228 WeakPolarHBondContact O-CB 3.49Å; N224-I228 WeakPolarHBondContact O-CD1 3.49Å; N224-I228 VanDerWaalsContact O-CG1 3.22Å; N224-I228 WeakPolarHBondContact O-CG1 3.33Å; N224-I228 PolarHBondContact O-N 3.22Å; L225-I228 PolarHBondContact O-N 2.96Å; L226-I228 PolarHBondContact O-N 2.9Å; I228-A231 WeakPolarHBondContact O-CB 3.39Å; I228-A231 PolarHBondContact O-N 3.32Å; I228-V232 WeakPolarHBondContact O-CG2 3.47Å; I228-V232 PolarHBondContact O-N 3.1Å; I228-V256 HydrophobicContact CB-CG1 4.24Å; I228-V256 HydrophobicContact CG2-CG1 3.69Å; I228-V260 HydrophobicContact CG2-CG2 3.51Å
229	L	96.4	Very high	96	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	18%	0.183	C	C	.	.	H	α-helix	trans	-63.7	-49.3	-179.5	-175.9	59.8	0	0	0	111.1	L225 L226 A231 V232 T233 L240 F244 L252 E255 V256 A259	L225-L229 WeakPolarHBondContact O-CB 3.5Å; L225-L229 PolarHBondContact O-N 3.24Å; L226-L229 PolarHBondContact O-N 3.15Å; L229-A231 PolarHBondContact O-N 3.3Å; L229-V232 PolarHBondContact O-N 3.45Å; L229-T233 HydrophobicContact CD1-CG2 3.69Å; L229-T233 HydrophobicContact CG-CG2 4.34Å; L229-T233 PolarHBondContact O-N 3.45Å; L229-T233 PolarHBondContact O-OG1 3.17Å; L229-T233 VanDerWaalsContact O-OG1 3.12Å; L229-L240 HydrophobicContact CB-CD1 4.2Å; L229-L240 HydrophobicContact CD2-CD1 4.3Å; L229-L240 HydrophobicContact CD2-CD2 3.71Å; L229-L240 HydrophobicContact CG-CD1 4.18Å; L229-L240 HydrophobicContact CG-CD2 4Å; L229-F244 HydrophobicContact CD2-CE2 3.6Å; L229-F244 HydrophobicContact CD2-CZ 3.87Å; L229-L252 HydrophobicContact CD2-CD1 4.26Å; L229-E255 HydrophobicContact CD2-CB 4.44Å; L229-V256 HydrophobicContact CB-CG2 3.97Å; L229-V256 HydrophobicContact CD2-CG2 4.36Å; L229-A259 HydrophobicContact CD1-CB 3.74Å
230	S	94.7	Very high	96	Very high	27 Å²	27	28.5 Å²	28.5	19%	0.189	18%	0.182	C	C	.	.	H	α-helix	trans	-53.9	-43.9	174	176.8	0	0	0	0	111.2	L226 V232 G234 Q235	L226-S230 WeakPolarHBondContact O-CB 3.28Å; L226-S230 PolarHBondContact O-N 3.24Å; S230-V232 VanDerWaalsContact C-N 3.34Å; S230-V232 PolarHBondContact O-N 2.92Å; S230-G234 VanDerWaalsContact O-CA 3.29Å; S230-G234 WeakPolarHBondContact O-CA 3Å; S230-G234 PolarHBondContact O-N 3.12Å; S230-Q235 WeakPolarHBondContact CA-O 3.42Å; S230-Q235 VanDerWaalsContact CB-O 3.25Å; S230-Q235 WeakPolarHBondContact CB-O 3.39Å; S230-Q235 PolarHBondContact OG-O 3.21Å
231	A	92.5	Very high	96	Very high	8 Å²	8	30.2 Å²	30.2	7%	0.066	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-40.4	178.2	0	0	0	0	0	112	M1 R5 A163 D227 I228 L229	M1-A231 HydrophobicContact SD-CB 3.59Å; M1-A231 VanDerWaalsContact SD-CB 3.59Å; R5-A231 PolarHBondContact NH1-O 3.38Å; R5-A231 PolarHBondContact NH2-O 2.93Å; A163-A231 HydrophobicContact CB-CB 3.42Å; A163-A231 VanDerWaalsContact CB-CB 3.42Å; D227-A231 WeakPolarHBondContact O-CB 3.18Å; D227-A231 PolarHBondContact O-N 3.45Å; I228-A231 WeakPolarHBondContact O-CB 3.39Å; I228-A231 PolarHBondContact O-N 3.32Å; L229-A231 PolarHBondContact O-N 3.3Å
232	V	93.2	Very high	96	Very high	32 Å²	32	37.2 Å²	37.2	19%	0.194	22%	0.215	C	C	.	.	H	α-helix	trans	-76	-45.9	-179.2	177.3	0	0	0	0	112	M1 I228 L229 S230 A259 V260 M263	M1-V232 HydrophobicContact CE-CG2 4.49Å; M1-V232 HydrophobicContact SD-CG2 3.69Å; I228-V232 WeakPolarHBondContact O-CG2 3.47Å; I228-V232 PolarHBondContact O-N 3.1Å; L229-V232 PolarHBondContact O-N 3.45Å; S230-V232 VanDerWaalsContact C-N 3.34Å; S230-V232 PolarHBondContact O-N 2.92Å; V232-A259 HydrophobicContact CB-CB 4.47Å; V232-A259 HydrophobicContact CG1-CB 4Å; V232-V260 HydrophobicContact CG2-CG2 3.98Å; V232-M263 HydrophobicContact CG1-CB 4.06Å; V232-M263 HydrophobicContact CG1-SD 4.27Å; V232-M263 HydrophobicContact CG2-CE 4.21Å; V232-M263 HydrophobicContact CG2-SD 3.98Å
233	T	93.4	Very high	96	Very high	59 Å²	59	41.1 Å²	41.1	36%	0.362	23%	0.234	S	C	.	.	H	α-helix	trans	-89	-20	-172	67.3	0	0	0	0	113.8	L229 Q235 A259	L229-T233 HydrophobicContact CD1-CG2 3.69Å; L229-T233 HydrophobicContact CG-CG2 4.34Å; L229-T233 PolarHBondContact O-N 3.45Å; L229-T233 PolarHBondContact O-OG1 3.17Å; L229-T233 VanDerWaalsContact O-OG1 3.12Å; T233-Q235 PolarHBondContact O-N 3.42Å; T233-Q235 WeakPolarHBondContact OG1-CB 3.34Å; T233-Q235 WeakPolarHBondContact OG1-CG 3.44Å; T233-Q235 PolarHBondContact OG1-N 3.18Å; T233-Q235 PolarHBondContact OG1-OE1 2.93Å; T233-A259 HydrophobicContact CG2-CB 4.34Å
234	G	91.8	Very high	96	Very high	67 Å²	67	41.4 Å²	41.4	69%	0.691	24%	0.235	S	C	*	.			trans	78.9	-0.5	-173.1	0	0	0	0	0	114.3	S230	S230-G234 VanDerWaalsContact O-CA 3.29Å; S230-G234 WeakPolarHBondContact O-CA 3Å; S230-G234 PolarHBondContact O-N 3.12Å
235	Q	94.9	Very high	96	Very high	58 Å²	58	48 Å²	48	27%	0.271	27%	0.265	S	S	.	.			trans	-68.7	144.5	175.5	-65.9	170.7	-77.9	0	0	110.7	S230 T233 L240	S230-Q235 WeakPolarHBondContact CA-O 3.42Å; S230-Q235 VanDerWaalsContact CB-O 3.25Å; S230-Q235 WeakPolarHBondContact CB-O 3.39Å; S230-Q235 PolarHBondContact OG-O 3.21Å; T233-Q235 PolarHBondContact O-N 3.42Å; T233-Q235 WeakPolarHBondContact OG1-CB 3.34Å; T233-Q235 WeakPolarHBondContact OG1-CG 3.44Å; T233-Q235 PolarHBondContact OG1-N 3.18Å; T233-Q235 PolarHBondContact OG1-OE1 2.93Å; Q235-L240 HydrophobicContact CB-CD2 3.82Å; Q235-L240 HydrophobicContact CB-CG 3.97Å; Q235-L240 HydrophobicContact CG-CD2 4.41Å
236	S	95.4	Very high	95.9	Very high	50 Å²	50	52.2 Å²	52.2	35%	0.35	31%	0.309	S	S	.	.			trans	-73.4	154	175.7	67.4	0	0	0	0	111.6	P238 E239 L240	S236-P238 VanDerWaalsContact C-N 3.34Å; S236-E239 PolarHBondContact N-OE2 3.02Å; S236-E239 WeakPolarHBondContact O-CB 3.17Å; S236-E239 PolarHBondContact O-N 3.37Å; S236-E239 VanDerWaalsContact O-N 3.12Å; S236-E239 WeakPolarHBondContact OG-CG 3.2Å; S236-E239 PolarHBondContact OG-N 3.35Å; S236-E239 PolarHBondContact OG-OE2 3.45Å; S236-L240 WeakPolarHBondContact O-CG 3.34Å; S236-L240 PolarHBondContact O-N 3.2Å
237	I	96.3	Very high	95.9	Very high	32 Å²	32	56.9 Å²	56.9	16%	0.164	33%	0.33	C	S	.	.	H	α-helix	trans	-54.3	-44.7	176.8	-60.2	-63.4	0	0	0	112.2	Y214 L226 E239 L240 E241	Y214-I237 VanDerWaalsContact CB-CG2 3.45Å; Y214-I237 HydrophobicContact CD1-CG2 4.43Å; Y214-I237 HydrophobicContact CD2-CD1 4.06Å; Y214-I237 HydrophobicContact CD2-CG1 4.36Å; Y214-I237 HydrophobicContact CD2-CG2 3.81Å; Y214-I237 HydrophobicContact CE2-CD1 4.2Å; Y214-I237 HydrophobicContact CG-CG2 3.65Å; L226-I237 HydrophobicContact CB-CD1 3.99Å; I237-E239 VanDerWaalsContact C-N 3.34Å; I237-E239 PolarHBondContact O-N 3.12Å; I237-L240 PolarHBondContact O-N 3.4Å; I237-E241 HydrophobicContact CG2-CG 4.34Å; I237-E241 WeakPolarHBondContact O-CG 3.22Å; I237-E241 PolarHBondContact O-N 2.98Å
238	P	97.3	Very high	95.9	Very high	87 Å²	87	61 Å²	61	57%	0.565	35%	0.349	S	S	*	.	H	α-helix	trans	-62.3	-35.3	176.7	-25.1	36.5	0	0	0	114.5	S236 K242	S236-P238 VanDerWaalsContact C-N 3.34Å; P238-K242 WeakPolarHBondContact O-CB 3.33Å; P238-K242 PolarHBondContact O-N 2.91Å; P238-K242 VanDerWaalsContact O-N 3.1Å
239	E	97.6	Very high	96	Very high	109 Å²	109	61.9 Å²	61.9	51%	0.509	35%	0.352	S	S	.	.	H	α-helix	trans	-66.1	-41.1	175	-73.7	165.5	154.8	0	0	111.3	S236 I237 K242 Q243	S236-E239 PolarHBondContact N-OE2 3.02Å; S236-E239 WeakPolarHBondContact O-CB 3.17Å; S236-E239 PolarHBondContact O-N 3.37Å; S236-E239 VanDerWaalsContact O-N 3.12Å; S236-E239 WeakPolarHBondContact OG-CG 3.2Å; S236-E239 PolarHBondContact OG-N 3.35Å; S236-E239 PolarHBondContact OG-OE2 3.45Å; I237-E239 VanDerWaalsContact C-N 3.34Å; I237-E239 PolarHBondContact O-N 3.12Å; E239-K242 PolarHBondContact O-N 3.46Å; E239-Q243 WeakPolarHBondContact O-CB 3.5Å; E239-Q243 PolarHBondContact O-N 3.08Å
240	L	97.9	Very high	96.1	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-44.9	176.6	-65.8	176.7	0	0	0	111.5	L226 L229 Q235 S236 I237 K242 Q243 F244	L226-L240 HydrophobicContact CD2-CB 3.71Å; L226-L240 HydrophobicContact CD2-CD1 4.28Å; L229-L240 HydrophobicContact CB-CD1 4.2Å; L229-L240 HydrophobicContact CD2-CD1 4.3Å; L229-L240 HydrophobicContact CD2-CD2 3.71Å; L229-L240 HydrophobicContact CG-CD1 4.18Å; L229-L240 HydrophobicContact CG-CD2 4Å; Q235-L240 HydrophobicContact CB-CD2 3.82Å; Q235-L240 HydrophobicContact CB-CG 3.97Å; Q235-L240 HydrophobicContact CG-CD2 4.41Å; S236-L240 WeakPolarHBondContact O-CG 3.34Å; S236-L240 PolarHBondContact O-N 3.2Å; I237-L240 PolarHBondContact O-N 3.4Å; L240-K242 VanDerWaalsContact C-N 3.29Å; L240-K242 PolarHBondContact O-N 3.4Å; L240-Q243 WeakPolarHBondContact O-CB 3.49Å; L240-Q243 PolarHBondContact O-N 3.2Å; L240-Q243 VanDerWaalsContact O-N 3.11Å; L240-F244 HydrophobicContact CD2-CE2 4.49Å; L240-F244 WeakPolarHBondContact O-CD2 3.35Å; L240-F244 PolarHBondContact O-N 2.98Å
241	E	98	Very high	96.2	Very high	54 Å²	54	67 Å²	67	25%	0.252	39%	0.388	S	S	.	.	H	α-helix	trans	-55.5	-46.4	175.2	-72.3	-177.2	132.5	0	0	111.2	R213 Y214 L226 I237 Q243 F244 E245	R213-E241 VanDerWaalsContact CA-OE1 3.31Å; R213-E241 WeakPolarHBondContact CA-OE1 3.37Å; R213-E241 VanDerWaalsContact CG-OE1 3.3Å; R213-E241 WeakPolarHBondContact CG-OE1 3.46Å; Y214-E241 PolarHBondContact N-OE1 2.73Å; L226-E241 HydrophobicContact CD1-CG 4.42Å; I237-E241 HydrophobicContact CG2-CG 4.34Å; I237-E241 WeakPolarHBondContact O-CG 3.22Å; I237-E241 PolarHBondContact O-N 2.98Å; E241-Q243 PolarHBondContact O-N 2.95Å; E241-F244 CarbonylContact O-C 3.51Å; E241-F244 PolarHBondContact O-N 3.15Å; E241-E245 PolarHBondContact O-N 2.97Å; E241-E245 VanDerWaalsContact O-N 3.17Å
242	K	97.7	Very high	96.5	Very high	155 Å²	155	66.7 Å²	66.7	67%	0.674	38%	0.384	S	S	*	.	H	α-helix	trans	-61.2	-42	175.3	-173.3	177.7	-178.9	179.7	0	112.5	P238 E239 L240 F244 E245	P238-K242 WeakPolarHBondContact O-CB 3.33Å; P238-K242 PolarHBondContact O-N 2.91Å; P238-K242 VanDerWaalsContact O-N 3.1Å; E239-K242 PolarHBondContact O-N 3.46Å; L240-K242 VanDerWaalsContact C-N 3.29Å; L240-K242 PolarHBondContact O-N 3.4Å; K242-F244 VanDerWaalsContact C-N 3.25Å; K242-F244 PolarHBondContact O-N 2.94Å; K242-E245 PolarHBondContact O-N 3.46Å
243	Q	97.4	Very high	96.8	Very high	82 Å²	82	66.6 Å²	66.6	38%	0.383	38%	0.382	S	S	.	.	H	α-helix	trans	-62.2	-33	177.7	178.4	178.9	-24.5	0	0	112.4	E239 L240 E241	E239-Q243 WeakPolarHBondContact O-CB 3.5Å; E239-Q243 PolarHBondContact O-N 3.08Å; L240-Q243 WeakPolarHBondContact O-CB 3.49Å; L240-Q243 PolarHBondContact O-N 3.2Å; L240-Q243 VanDerWaalsContact O-N 3.11Å; E241-Q243 PolarHBondContact O-N 2.95Å
244	F	97.8	Very high	97	Very high	7 Å²	7	64.8 Å²	64.8	3%	0.031	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	11.9	-178.4	-68.8	-72.7	0	0	0	114.5	V212 L226 L229 L240 E241 K242 G246 K247 L252 E255	V212-F244 HydrophobicContact CB-CB 3.68Å; V212-F244 HydrophobicContact CB-CG 4.49Å; V212-F244 HydrophobicContact CG1-CB 3.68Å; V212-F244 HydrophobicContact CG1-CD2 4.2Å; V212-F244 HydrophobicContact CG1-CG 4.11Å; V212-F244 HydrophobicContact CG2-CB 3.96Å; L226-F244 HydrophobicContact CD2-CD2 4.46Å; L229-F244 HydrophobicContact CD2-CE2 3.6Å; L229-F244 HydrophobicContact CD2-CZ 3.87Å; L240-F244 HydrophobicContact CD2-CE2 4.49Å; L240-F244 WeakPolarHBondContact O-CD2 3.35Å; L240-F244 PolarHBondContact O-N 2.98Å; E241-F244 CarbonylContact O-C 3.51Å; E241-F244 PolarHBondContact O-N 3.15Å; K242-F244 VanDerWaalsContact C-N 3.25Å; K242-F244 PolarHBondContact O-N 2.94Å; F244-G246 PolarHBondContact O-N 3.28Å; F244-K247 HydrophobicContact CB-CB 4.35Å; F244-K247 HydrophobicContact CB-CG 4.5Å; F244-K247 HydrophobicContact CD1-CB 4.15Å; F244-K247 HydrophobicContact CD1-CG 4.23Å; F244-K247 WeakPolarHBondContact O-CB 3.17Å; F244-K247 PolarHBondContact O-N 2.97Å; F244-L252 HydrophobicContact CD1-CB 4.4Å; F244-L252 HydrophobicContact CD2-CD1 4.05Å; F244-L252 HydrophobicContact CE1-CB 4.29Å; F244-L252 HydrophobicContact CE1-CD1 4.39Å; F244-L252 HydrophobicContact CE2-CD1 3.72Å; F244-L252 HydrophobicContact CZ-CD1 3.89Å; F244-E255 HydrophobicContact CE1-CB 4.23Å; F244-E255 HydrophobicContact CE1-CG 3.78Å; F244-E255 HydrophobicContact CZ-CB 3.75Å; F244-E255 HydrophobicContact CZ-CG 3.69Å
245	E	96.8	Very high	97.3	Very high	141 Å²	141	66 Å²	66	66%	0.659	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	127.8	172.5	-79.1	179.1	-161.6	0	0	111.3	E241 K242 K247	E241-E245 PolarHBondContact O-N 2.97Å; E241-E245 VanDerWaalsContact O-N 3.17Å; K242-E245 PolarHBondContact O-N 3.46Å; E245-K247 PolarHBondContact O-N 3.46Å
246	G	96	Very high	97.4	Very high	90 Å²	90	63.2 Å²	63.2	93%	0.928	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	6	-177.9	0	0	0	0	0	115.5	F244	F244-G246 PolarHBondContact O-N 3.28Å
247	K	96.9	Very high	97.6	Very high	98 Å²	98	60.9 Å²	60.9	43%	0.426	33%	0.333	S	S	.	.			trans	-91.5	143	177.9	-57.3	-60.2	-176.4	-178.9	0	111.7	F244 E245 H251	F244-K247 HydrophobicContact CB-CB 4.35Å; F244-K247 HydrophobicContact CB-CG 4.5Å; F244-K247 HydrophobicContact CD1-CB 4.15Å; F244-K247 HydrophobicContact CD1-CG 4.23Å; F244-K247 WeakPolarHBondContact O-CB 3.17Å; F244-K247 PolarHBondContact O-N 2.97Å; E245-K247 PolarHBondContact O-N 3.46Å; K247-H251 HydrophobicContact CB-CB 4.13Å
248	M	96.8	Very high	97.6	Very high	121 Å²	121	64.4 Å²	64.4	60%	0.596	35%	0.352	S	S	*	.			trans	-72.9	156.8	170.5	-56.2	-174.6	-69.6	0	0	112.2	G250 H251	M248-G250 PolarHBondContact O-N 3.16Å; M248-G250 VanDerWaalsContact O-N 3.07Å; M248-H251 PolarHBondContact N-ND1 3.2Å; M248-H251 WeakPolarHBondContact O-CB 3.37Å; M248-H251 PolarHBondContact O-N 3Å; M248-H251 PolarHBondContact O-ND1 2.94Å
249	Y	97.7	Very high	97.6	Very high	19 Å²	19	61.4 Å²	61.4	8%	0.075	34%	0.335	C	S	.	.	H	α-helix	trans	-55.4	-27.1	176.2	-60.3	-24.8	0	0	0	114.9	T204 D205 P210 V211 V212 K219 V222 H251 L252 K253	T204-Y249 HydrophobicContact CG2-CD2 4.14Å; T204-Y249 HydrophobicContact CG2-CG 4.25Å; D205-Y249 WeakPolarHBondContact OD1-CE2 3.36Å; D205-Y249 VanDerWaalsContact OD1-CZ 3.31Å; D205-Y249 PolarHBondContact OD1-OH 3.12Å; D205-Y249 PolarHBondContact OD2-OH 3.22Å; P210-Y249 HydrophobicContact CB-CD1 4.13Å; P210-Y249 HydrophobicContact CB-CD2 4.13Å; P210-Y249 HydrophobicContact CB-CE1 3.85Å; P210-Y249 HydrophobicContact CB-CE2 3.87Å; P210-Y249 HydrophobicContact CB-CG 4.25Å; V211-Y249 PolarHBondContact N-OH 3.05Å; V211-Y249 WeakPolarHBondContact O-CE1 3.27Å; V211-Y249 PolarHBondContact O-OH 3.08Å; V212-Y249 HydrophobicContact CG2-CD1 4Å; V212-Y249 HydrophobicContact CG2-CE1 4.29Å; K219-Y249 PolarHBondContact NZ-OH 3.45Å; V222-Y249 HydrophobicContact CG2-CD1 4.25Å; V222-Y249 HydrophobicContact CG2-CE1 3.9Å; V222-Y249 HydrophobicContact CG2-CE2 4.45Å; Y249-H251 VanDerWaalsContact C-N 3.26Å; Y249-H251 PolarHBondContact O-N 3.35Å; Y249-L252 PolarHBondContact O-N 3.24Å; Y249-K253 WeakPolarHBondContact O-CG 3.4Å; Y249-K253 PolarHBondContact O-N 3.25Å
250	G	97.7	Very high	97.6	Very high	53 Å²	53	56.4 Å²	56.4	55%	0.546	31%	0.312	S	S	.	.	H	α-helix	trans	-59.6	-35	173.2	0	0	0	0	0	113.4	M248 G254	M248-G250 PolarHBondContact O-N 3.16Å; M248-G250 VanDerWaalsContact O-N 3.07Å; G250-G254 PolarHBondContact O-N 2.86Å
251	H	98	Very high	97.5	Very high	86 Å²	86	57.5 Å²	57.5	40%	0.398	32%	0.319	S	S	.	.	H	α-helix	trans	-70.7	-46.6	176.8	-57.3	97.3	0	0	0	111.1	K247 M248 Y249 K253 G254 E255	K247-H251 HydrophobicContact CB-CB 4.13Å; M248-H251 PolarHBondContact N-ND1 3.2Å; M248-H251 WeakPolarHBondContact O-CB 3.37Å; M248-H251 PolarHBondContact O-N 3Å; M248-H251 PolarHBondContact O-ND1 2.94Å; Y249-H251 VanDerWaalsContact C-N 3.26Å; Y249-H251 PolarHBondContact O-N 3.35Å; H251-K253 VanDerWaalsContact C-N 3.32Å; H251-K253 PolarHBondContact O-N 3.44Å; H251-G254 WeakPolarHBondContact O-CA 3.45Å; H251-G254 PolarHBondContact O-N 3.42Å; H251-G254 VanDerWaalsContact O-N 3.08Å; H251-E255 PolarHBondContact O-N 2.92Å
252	L	98.4	Very high	97.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-55.8	-48.5	174.9	175.3	64	0	0	0	110.9	V212 V222 L225 L226 L229 F244 Y249 G254 E255 V256	V212-L252 HydrophobicContact CG1-CD1 4.4Å; V212-L252 HydrophobicContact CG1-CD2 3.9Å; V212-L252 HydrophobicContact CG2-CB 4.21Å; V212-L252 HydrophobicContact CG2-CD2 4.2Å; V222-L252 HydrophobicContact CG1-CD2 4Å; L225-L252 HydrophobicContact CB-CD2 3.83Å; L225-L252 HydrophobicContact CB-CG 4.12Å; L225-L252 HydrophobicContact CD1-CD2 4.1Å; L225-L252 HydrophobicContact CD1-CG 4.43Å; L226-L252 HydrophobicContact CD2-CD1 4.05Å; L226-L252 HydrophobicContact CG-CD1 4.49Å; L229-L252 HydrophobicContact CD2-CD1 4.26Å; F244-L252 HydrophobicContact CD1-CB 4.4Å; F244-L252 HydrophobicContact CD2-CD1 4.05Å; F244-L252 HydrophobicContact CE1-CB 4.29Å; F244-L252 HydrophobicContact CE1-CD1 4.39Å; F244-L252 HydrophobicContact CE2-CD1 3.72Å; F244-L252 HydrophobicContact CZ-CD1 3.89Å; Y249-L252 PolarHBondContact O-N 3.24Å; L252-G254 VanDerWaalsContact C-N 3.28Å; L252-G254 PolarHBondContact O-N 3.45Å; L252-E255 PolarHBondContact O-N 2.86Å; L252-V256 HydrophobicContact CD1-CG2 3.9Å; L252-V256 HydrophobicContact CG-CG2 4.2Å; L252-V256 WeakPolarHBondContact O-CB 3.44Å; L252-V256 WeakPolarHBondContact O-CG2 3.29Å; L252-V256 PolarHBondContact O-N 3.47Å
253	K	98.4	Very high	97.3	Very high	31 Å²	31	52 Å²	52	14%	0.135	31%	0.307	C	S	.	.	H	α-helix	trans	-61.1	-35.3	177.1	-74.6	173.8	167.3	-175	0	112.9	I199 K200 A202 L225 Y249 H251 A257	I199-K253 WeakPolarHBondContact CG2-O 3.49Å; K200-K253 WeakPolarHBondContact O-CD 3.27Å; K200-K253 PolarHBondContact O-NZ 3.26Å; K200-K253 VanDerWaalsContact O-NZ 3.1Å; A202-K253 WeakPolarHBondContact O-CE 3.26Å; A202-K253 PolarHBondContact O-NZ 2.79Å; L225-K253 HydrophobicContact CD1-CG 3.85Å; Y249-K253 WeakPolarHBondContact O-CG 3.4Å; Y249-K253 PolarHBondContact O-N 3.25Å; H251-K253 VanDerWaalsContact C-N 3.32Å; H251-K253 PolarHBondContact O-N 3.44Å; K253-A257 WeakPolarHBondContact O-CB 3.26Å; K253-A257 PolarHBondContact O-N 2.76Å
254	G	98.1	Very high	97.2	Very high	21 Å²	21	48.2 Å²	48.2	22%	0.216	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-55.8	174.8	0	0	0	0	0	111.7	G250 H251 L252 V256 A257 D258	G250-G254 PolarHBondContact O-N 2.86Å; H251-G254 WeakPolarHBondContact O-CA 3.45Å; H251-G254 PolarHBondContact O-N 3.42Å; H251-G254 VanDerWaalsContact O-N 3.08Å; L252-G254 VanDerWaalsContact C-N 3.28Å; L252-G254 PolarHBondContact O-N 3.45Å; G254-V256 PolarHBondContact O-N 2.89Å; G254-A257 WeakPolarHBondContact O-CB 3.47Å; G254-A257 PolarHBondContact O-N 2.98Å; G254-A257 VanDerWaalsContact O-N 3.09Å; G254-D258 PolarHBondContact O-N 3.47Å
255	E	98	Very high	97.2	Very high	92 Å²	92	51.1 Å²	51.1	43%	0.43	31%	0.308	S	S	.	.	H	α-helix	trans	-59.9	-42.8	179.7	-68.4	-68.1	146.4	0	0	112.4	L229 F244 H251 L252 A257 D258 A259	L229-E255 HydrophobicContact CD2-CB 4.44Å; F244-E255 HydrophobicContact CE1-CB 4.23Å; F244-E255 HydrophobicContact CE1-CG 3.78Å; F244-E255 HydrophobicContact CZ-CB 3.75Å; F244-E255 HydrophobicContact CZ-CG 3.69Å; H251-E255 PolarHBondContact O-N 2.92Å; L252-E255 PolarHBondContact O-N 2.86Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 2.64Å; E255-D258 PolarHBondContact O-N 2.83Å; E255-A259 VanDerWaalsContact O-CB 3.26Å; E255-A259 WeakPolarHBondContact O-CB 3.15Å; E255-A259 PolarHBondContact O-N 3.12Å
256	V	98.1	Very high	97.2	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-42.5	175.9	-176.8	0	0	0	0	110.5	I199 L225 I228 L229 L252 G254 V260	I199-V256 HydrophobicContact CD1-CG1 3.67Å; I199-V256 HydrophobicContact CG2-CB 3.99Å; I199-V256 HydrophobicContact CG2-CG1 3.95Å; L225-V256 HydrophobicContact CB-CG2 4.16Å; L225-V256 HydrophobicContact CD2-CB 4.49Å; L225-V256 HydrophobicContact CD2-CG1 4.16Å; L225-V256 HydrophobicContact CD2-CG2 4.34Å; I228-V256 HydrophobicContact CB-CG1 4.24Å; I228-V256 HydrophobicContact CG2-CG1 3.69Å; L229-V256 HydrophobicContact CB-CG2 3.97Å; L229-V256 HydrophobicContact CD2-CG2 4.36Å; L252-V256 HydrophobicContact CD1-CG2 3.9Å; L252-V256 HydrophobicContact CG-CG2 4.2Å; L252-V256 WeakPolarHBondContact O-CB 3.44Å; L252-V256 WeakPolarHBondContact O-CG2 3.29Å; L252-V256 PolarHBondContact O-N 3.47Å; G254-V256 PolarHBondContact O-N 2.89Å; V256-V260 HydrophobicContact CG1-CG2 4.17Å; V256-V260 WeakPolarHBondContact O-CB 3.48Å; V256-V260 WeakPolarHBondContact O-CG2 3.41Å; V256-V260 PolarHBondContact O-N 2.98Å
257	A	98.1	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-44.5	179.3	0	0	0	0	0	111.7	V196 I199 K253 G254 E255 S261	V196-A257 HydrophobicContact CB-CB 4.36Å; V196-A257 HydrophobicContact CG1-CB 4.17Å; V196-A257 HydrophobicContact CG2-CB 4.16Å; I199-A257 HydrophobicContact CB-CB 4.19Å; I199-A257 HydrophobicContact CG2-CB 4.08Å; K253-A257 WeakPolarHBondContact O-CB 3.26Å; K253-A257 PolarHBondContact O-N 2.76Å; G254-A257 WeakPolarHBondContact O-CB 3.47Å; G254-A257 PolarHBondContact O-N 2.98Å; G254-A257 VanDerWaalsContact O-N 3.09Å; E255-A257 VanDerWaalsContact C-N 3.34Å; E255-A257 PolarHBondContact O-N 2.64Å; A257-S261 WeakPolarHBondContact O-CB 3.5Å; A257-S261 PolarHBondContact O-N 3.01Å
258	D	97.6	Very high	97.2	Very high	107 Å²	107	43.3 Å²	43.3	57%	0.572	25%	0.25	S	C	*	.	H	α-helix	trans	-68.1	-45.2	-179.8	-68.4	-15.6	0	0	0	111.2	G254 E255 S261 G262	G254-D258 PolarHBondContact O-N 3.47Å; E255-D258 PolarHBondContact O-N 2.83Å; D258-S261 PolarHBondContact O-N 2.92Å; D258-G262 PolarHBondContact O-N 3.14Å
259	A	97.2	Very high	97.3	Very high	24 Å²	24	43 Å²	43	20%	0.198	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-49.4	177.5	0	0	0	0	0	112.2	L229 V232 T233 E255 G262 M263	L229-A259 HydrophobicContact CD1-CB 3.74Å; V232-A259 HydrophobicContact CB-CB 4.47Å; V232-A259 HydrophobicContact CG1-CB 4Å; T233-A259 HydrophobicContact CG2-CB 4.34Å; E255-A259 VanDerWaalsContact O-CB 3.26Å; E255-A259 WeakPolarHBondContact O-CB 3.15Å; E255-A259 PolarHBondContact O-N 3.12Å; A259-G262 PolarHBondContact O-N 3.48Å; A259-M263 PolarHBondContact O-N 2.99Å; A259-M263 VanDerWaalsContact O-N 3.08Å
260	V	96.5	Very high	97.3	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.024	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-42.1	179	176.5	0	0	0	0	110.7	I186 V195 I199 I228 V232 V256 M263 L264	I186-V260 HydrophobicContact CD1-CG1 4.47Å; I186-V260 HydrophobicContact CG2-CG1 4.46Å; V195-V260 HydrophobicContact CG1-CG1 3.78Å; I199-V260 HydrophobicContact CD1-CB 4.11Å; I199-V260 HydrophobicContact CD1-CG1 4.41Å; I199-V260 HydrophobicContact CD1-CG2 3.95Å; I228-V260 HydrophobicContact CG2-CG2 3.51Å; V232-V260 HydrophobicContact CG2-CG2 3.98Å; V256-V260 HydrophobicContact CG1-CG2 4.17Å; V256-V260 WeakPolarHBondContact O-CB 3.48Å; V256-V260 WeakPolarHBondContact O-CG2 3.41Å; V256-V260 PolarHBondContact O-N 2.98Å; V260-M263 PolarHBondContact O-N 2.89Å; V260-L264 HydrophobicContact CG1-CD1 3.9Å; V260-L264 HydrophobicContact CG1-CG 4.24Å; V260-L264 WeakPolarHBondContact O-CB 3.02Å; V260-L264 VanDerWaalsContact O-CG 3.28Å; V260-L264 WeakPolarHBondContact O-CG 3.48Å; V260-L264 PolarHBondContact O-N 3.5Å
261	S	96.5	Very high	97.3	Very high	22 Å²	22	43.9 Å²	43.9	15%	0.154	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-44.8	177.4	179.5	0	0	0	0	111.8	P192 A257 D258 L264 T265	P192-S261 WeakPolarHBondContact CB-OG 3.47Å; A257-S261 WeakPolarHBondContact O-CB 3.5Å; A257-S261 PolarHBondContact O-N 3.01Å; D258-S261 PolarHBondContact O-N 2.92Å; S261-L264 PolarHBondContact O-N 3.22Å; S261-T265 WeakPolarHBondContact O-CB 3.45Å; S261-T265 PolarHBondContact O-N 3.31Å; S261-T265 PolarHBondContact O-OG1 3.09Å
262	G	96.5	Very high	97.4	Very high	41 Å²	41	44.4 Å²	44.4	42%	0.423	24%	0.236	S	C	.	.	H	α-helix	trans	-59.8	-51.6	176.6	0	0	0	0	0	112	D258 A259 L264 T265 E266	D258-G262 PolarHBondContact O-N 3.14Å; A259-G262 PolarHBondContact O-N 3.48Å; G262-L264 VanDerWaalsContact C-N 3.33Å; G262-L264 PolarHBondContact O-N 3.32Å; G262-T265 PolarHBondContact O-N 3.45Å; G262-E266 PolarHBondContact O-N 3.07Å
263	M	95.1	Very high	97.3	Very high	53 Å²	53	51.2 Å²	51.2	26%	0.261	26%	0.262	S	S	.	.	H	α-helix	trans	-57.7	-43.4	177	-179.1	-163.9	64.9	0	0	112.3	V232 A259 V260 L267	V232-M263 HydrophobicContact CG1-CB 4.06Å; V232-M263 HydrophobicContact CG1-SD 4.27Å; V232-M263 HydrophobicContact CG2-CE 4.21Å; V232-M263 HydrophobicContact CG2-SD 3.98Å; A259-M263 PolarHBondContact O-N 2.99Å; A259-M263 VanDerWaalsContact O-N 3.08Å; V260-M263 PolarHBondContact O-N 2.89Å; M263-L267 WeakPolarHBondContact O-CB 3.5Å; M263-L267 PolarHBondContact O-N 3.29Å
264	L	95.9	Very high	97.3	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-70.1	-35.7	179.5	-71.1	-178.8	0	0	0	112.5	I186 L188 V195 V260 S261 G262 L267 Q268	I186-L264 HydrophobicContact CG2-CD1 3.81Å; L188-L264 HydrophobicContact CD2-CD2 3.89Å; V195-L264 HydrophobicContact CG1-CD1 4.17Å; V195-L264 HydrophobicContact CG2-CD1 3.78Å; V260-L264 HydrophobicContact CG1-CD1 3.9Å; V260-L264 HydrophobicContact CG1-CG 4.24Å; V260-L264 WeakPolarHBondContact O-CB 3.02Å; V260-L264 VanDerWaalsContact O-CG 3.28Å; V260-L264 WeakPolarHBondContact O-CG 3.48Å; V260-L264 PolarHBondContact O-N 3.5Å; S261-L264 PolarHBondContact O-N 3.22Å; G262-L264 VanDerWaalsContact C-N 3.33Å; G262-L264 PolarHBondContact O-N 3.32Å; L264-L267 PolarHBondContact O-N 2.99Å; L264-Q268 VanDerWaalsContact O-CB 3.25Å; L264-Q268 WeakPolarHBondContact O-CB 3.45Å; L264-Q268 WeakPolarHBondContact O-CG 3.41Å; L264-Q268 PolarHBondContact O-N 3.31Å
265	T	96.9	Very high	97.4	Very high	68 Å²	68	53.3 Å²	53.3	42%	0.417	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-46.2	178.4	-58.3	0	0	0	0	110.9	S261 G262 L267 Q268 E269	S261-T265 WeakPolarHBondContact O-CB 3.45Å; S261-T265 PolarHBondContact O-N 3.31Å; S261-T265 PolarHBondContact O-OG1 3.09Å; G262-T265 PolarHBondContact O-N 3.45Å; T265-L267 PolarHBondContact O-N 2.89Å; T265-Q268 PolarHBondContact O-N 2.84Å; T265-E269 PolarHBondContact O-N 3.47Å
266	E	96	Very high	97.4	Very high	122 Å²	122	55 Å²	55	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-61.3	-44.9	176.1	-172.5	-168.6	164.3	0	0	111.8	G262 Q268 E269 R270	G262-E266 PolarHBondContact O-N 3.07Å; E266-Q268 VanDerWaalsContact C-N 3.34Å; E266-Q268 PolarHBondContact O-N 3.5Å; E266-E269 PolarHBondContact O-N 3.42Å; E266-R270 PolarHBondContact O-N 2.91Å
267	L	96.7	Very high	97.4	Very high	22 Å²	22	58.8 Å²	58.8	12%	0.115	30%	0.296	C	S	.	.	H	α-helix	trans	-61.9	-42.4	176.7	-177.6	155.4	0	0	0	111.5	L45 L188 L189 M263 L264 T265 R270 Y271	L45-L267 HydrophobicContact CD1-CD2 3.84Å; L188-L267 HydrophobicContact CB-CD2 4.31Å; L188-L267 HydrophobicContact CD2-CD1 4.45Å; L189-L267 HydrophobicContact CD2-CD2 4.33Å; M263-L267 WeakPolarHBondContact O-CB 3.5Å; M263-L267 PolarHBondContact O-N 3.29Å; L264-L267 PolarHBondContact O-N 2.99Å; T265-L267 PolarHBondContact O-N 2.89Å; L267-R270 PolarHBondContact O-N 2.87Å; L267-Y271 WeakPolarHBondContact O-CB 3.46Å; L267-Y271 PolarHBondContact O-N 3.31Å
268	Q	97.9	Very high	97.3	Very high	21 Å²	21	64.9 Å²	64.9	10%	0.098	32%	0.324	C	S	.	.	H	α-helix	trans	-67.5	-36.8	179.9	-75.6	166.6	10.2	0	0	111.9	L188 L189 E190 L264 T265 E266 Y271 H272	L188-Q268 PolarHBondContact O-NE2 3.44Å; L189-Q268 HydrophobicContact CD2-CG 4.19Å; E190-Q268 PolarHBondContact O-NE2 2.85Å; L264-Q268 VanDerWaalsContact O-CB 3.25Å; L264-Q268 WeakPolarHBondContact O-CB 3.45Å; L264-Q268 WeakPolarHBondContact O-CG 3.41Å; L264-Q268 PolarHBondContact O-N 3.31Å; T265-Q268 PolarHBondContact O-N 2.84Å; E266-Q268 VanDerWaalsContact C-N 3.34Å; E266-Q268 PolarHBondContact O-N 3.5Å; Q268-Y271 PolarHBondContact O-N 2.87Å; Q268-H272 WeakPolarHBondContact O-CB 3.24Å; Q268-H272 PolarHBondContact O-CD2 2.97Å; Q268-H272 PolarHBondContact O-N 2.98Å
269	E	98.2	Very high	97.4	Very high	116 Å²	116	63.4 Å²	63.4	54%	0.542	33%	0.327	S	S	.	.	H	α-helix	trans	-60.9	-49	173.9	-165.3	-164.9	142.5	0	0	111.2	T265 E266 Y271 H272 R273	T265-E269 PolarHBondContact O-N 3.47Å; E266-E269 PolarHBondContact O-N 3.42Å; E269-Y271 VanDerWaalsContact C-N 3.34Å; E269-Y271 PolarHBondContact O-N 3.12Å; E269-H272 PolarHBondContact O-N 3.36Å; E269-R273 WeakPolarHBondContact O-CB 3.48Å; E269-R273 PolarHBondContact O-N 3.09Å; E269-R273 IonicContact OE1-CZ 3.6Å; E269-R273 IonicContact OE1-NH2 2.69Å; E269-R273 PolarHBondContact OE1-NH2 3.08Å
270	R	97.9	Very high	97.4	Very high	78 Å²	78	65.7 Å²	65.7	29%	0.294	33%	0.332	S	S	.	.	H	α-helix	trans	-59.3	-45.1	174.5	-68.7	169.2	60	-178.9	-4.2	111.4	L47 A48 E266 L267 R273 F274	L47-R270 PolarHBondContact O-NH2 3.41Å; A48-R270 HydrophobicContact CB-CB 4.05Å; A48-R270 PolarHBondContact O-NE 3.05Å; A48-R270 VanDerWaalsContact O-NE 3.15Å; A48-R270 PolarHBondContact O-NH1 3.02Å; A48-R270 PolarHBondContact O-NH2 2.81Å; E266-R270 PolarHBondContact O-N 2.91Å; L267-R270 PolarHBondContact O-N 2.87Å; R270-R273 PolarHBondContact O-N 3.39Å; R270-F274 HydrophobicContact CB-CE2 4.34Å; R270-F274 WeakPolarHBondContact O-CD2 3.12Å; R270-F274 WeakPolarHBondContact O-CG 3.37Å; R270-F274 PolarHBondContact O-N 3.01Å
271	Y	98.5	Very high	97.6	Very high	11 Å²	11	65.6 Å²	65.6	4%	0.043	33%	0.332	C	S	.	.	H	α-helix	trans	-58.7	-50.8	177.7	169.1	-97	0	0	0	112	D41 A44 L45 L189 L267 Q268 E269 R273 F274 R275	D41-Y271 WeakPolarHBondContact O-CE2 3.21Å; D41-Y271 PolarHBondContact OD1-OH 3.28Å; A44-Y271 HydrophobicContact CB-CD2 3.84Å; A44-Y271 HydrophobicContact CB-CE2 3.72Å; L45-Y271 HydrophobicContact CB-CD2 4.16Å; L45-Y271 HydrophobicContact CB-CE2 4.28Å; L189-Y271 HydrophobicContact CD1-CD1 4.19Å; L189-Y271 HydrophobicContact CD1-CD2 4.24Å; L189-Y271 HydrophobicContact CD1-CE1 3.69Å; L189-Y271 HydrophobicContact CD1-CE2 3.74Å; L189-Y271 HydrophobicContact CD1-CG 4.44Å; L189-Y271 VanDerWaalsContact CD1-CZ 3.43Å; L189-Y271 HydrophobicContact CD2-CD1 3.48Å; L189-Y271 VanDerWaalsContact CD2-CD1 3.48Å; L189-Y271 HydrophobicContact CD2-CD2 3.93Å; L189-Y271 HydrophobicContact CD2-CE1 3.88Å; L189-Y271 HydrophobicContact CD2-CE2 4.27Å; L189-Y271 HydrophobicContact CD2-CG 3.51Å; L189-Y271 HydrophobicContact CG-CD1 4.47Å; L189-Y271 HydrophobicContact CG-CE1 4.41Å; L267-Y271 WeakPolarHBondContact O-CB 3.46Å; L267-Y271 PolarHBondContact O-N 3.31Å; Q268-Y271 PolarHBondContact O-N 2.87Å; E269-Y271 VanDerWaalsContact C-N 3.34Å; E269-Y271 PolarHBondContact O-N 3.12Å; Y271-R273 VanDerWaalsContact C-N 3.29Å; Y271-R273 PolarHBondContact O-N 2.86Å; Y271-F274 PolarHBondContact O-N 3.35Å; Y271-R275 HydrophobicContact CE1-CB 4.14Å; Y271-R275 HydrophobicContact CE1-CG 4.23Å; Y271-R275 HydrophobicContact CE2-CB 4.2Å; Y271-R275 HydrophobicContact CE2-CG 4.38Å; Y271-R275 WeakPolarHBondContact O-CB 3.28Å; Y271-R275 PolarHBondContact O-N 3.02Å
272	H	98.3	Very high	97.7	Very high	97 Å²	97	69.1 Å²	69.1	45%	0.449	35%	0.346	S	S	.	.	H	α-helix	trans	-65.4	-34.7	-178.8	-73.8	-56.8	0	0	0	111.9	Q268 E269 N276	Q268-H272 WeakPolarHBondContact O-CB 3.24Å; Q268-H272 PolarHBondContact O-CD2 2.97Å; Q268-H272 PolarHBondContact O-N 2.98Å; E269-H272 PolarHBondContact O-N 3.36Å; H272-N276 VanDerWaalsContact O-CB 3.3Å; H272-N276 WeakPolarHBondContact O-CB 3.33Å; H272-N276 VanDerWaalsContact O-CG 3.23Å; H272-N276 PolarHBondContact O-N 2.97Å; H272-N276 VanDerWaalsContact O-N 3.15Å; H272-N276 PolarHBondContact O-ND2 3.41Å
273	R	98.2	Very high	97.8	Very high	143 Å²	143	71.4 Å²	71.4	54%	0.54	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-53.2	172.9	-165.3	-175.8	-55.5	144.6	2.6	111.4	E269 R270 Y271 D277	E269-R273 WeakPolarHBondContact O-CB 3.48Å; E269-R273 PolarHBondContact O-N 3.09Å; E269-R273 IonicContact OE1-CZ 3.6Å; E269-R273 IonicContact OE1-NH2 2.69Å; E269-R273 PolarHBondContact OE1-NH2 3.08Å; R270-R273 PolarHBondContact O-N 3.39Å; Y271-R273 VanDerWaalsContact C-N 3.29Å; Y271-R273 PolarHBondContact O-N 2.86Å; R273-D277 PolarHBondContact O-N 3.49Å
274	F	98.3	Very high	97.9	Very high	48 Å²	48	69.1 Å²	69.1	21%	0.211	34%	0.335	C	S	.	.	H	α-helix	trans	-66.3	-41.3	178	-64.9	-47.9	0	0	0	112.7	A44 L47 A48 R270 Y271 N276 D277 F280 L281	A44-F274 HydrophobicContact CB-CB 4.22Å; L47-F274 HydrophobicContact CB-CD2 3.75Å; L47-F274 HydrophobicContact CB-CE2 3.94Å; L47-F274 HydrophobicContact CB-CG 4.22Å; A48-F274 HydrophobicContact CB-CD2 4.29Å; R270-F274 HydrophobicContact CB-CE2 4.34Å; R270-F274 WeakPolarHBondContact O-CD2 3.12Å; R270-F274 WeakPolarHBondContact O-CG 3.37Å; R270-F274 PolarHBondContact O-N 3.01Å; Y271-F274 PolarHBondContact O-N 3.35Å; F274-N276 VanDerWaalsContact C-N 3.28Å; F274-N276 PolarHBondContact O-N 3.31Å; F274-D277 PolarHBondContact O-N 2.92Å; F274-F280 AromaticContact CD1-CD1 3.88Å; F274-F280 HydrophobicContact CD1-CD1 3.88Å; F274-F280 AromaticContact CD1-CE1 3.42Å; F274-F280 HydrophobicContact CD1-CE1 3.42Å; F274-F280 VanDerWaalsContact CD1-CE1 3.42Å; F274-F280 HydrophobicContact CD1-CZ 4.34Å; F274-F280 AromaticContact CE1-CE1 3.74Å; F274-F280 HydrophobicContact CE1-CE1 3.74Å; F274-F280 HydrophobicContact CE1-CZ 4.23Å; F274-F280 HydrophobicContact CG-CE1 4.33Å; F274-L281 WeakPolarHBondContact O-CG 3.39Å
275	R	98.5	Very high	98.1	Very high	49 Å²	49	69.5 Å²	69.5	19%	0.185	34%	0.336	C	S	.	.	H	α-helix	trans	-68	-29.2	-173.5	-176.6	56.3	-172.9	87.3	-5.9	113	D41 A44 Y271	D41-R275 IonicContact OD1-CZ 3.59Å; D41-R275 IonicContact OD1-NE 2.73Å; D41-R275 PolarHBondContact OD1-NE 2.95Å; D41-R275 IonicContact OD1-NH2 3.55Å; A44-R275 HydrophobicContact CB-CB 3.79Å; A44-R275 HydrophobicContact CB-CG 4.42Å; Y271-R275 HydrophobicContact CE1-CB 4.14Å; Y271-R275 HydrophobicContact CE1-CG 4.23Å; Y271-R275 HydrophobicContact CE2-CB 4.2Å; Y271-R275 HydrophobicContact CE2-CG 4.38Å; Y271-R275 WeakPolarHBondContact O-CB 3.28Å; Y271-R275 PolarHBondContact O-N 3.02Å
276	N	98.3	Very high	98.2	Very high	128 Å²	128	72.5 Å²	72.5	68%	0.684	34%	0.344	S	S	*	.	H	α-helix	trans	-91.4	-7.6	-179.8	-66	-26.9	0	0	0	113.3	H272 F274 E278	H272-N276 VanDerWaalsContact O-CB 3.3Å; H272-N276 WeakPolarHBondContact O-CB 3.33Å; H272-N276 VanDerWaalsContact O-CG 3.23Å; H272-N276 PolarHBondContact O-N 2.97Å; H272-N276 VanDerWaalsContact O-N 3.15Å; H272-N276 PolarHBondContact O-ND2 3.41Å; F274-N276 VanDerWaalsContact C-N 3.28Å; F274-N276 PolarHBondContact O-N 3.31Å; N276-E278 PolarHBondContact O-N 3.16Å
277	D	98.3	Very high	98.3	Very high	78 Å²	78	69.6 Å²	69.6	42%	0.417	33%	0.332	S	S	.	.			trans	-96.5	82.8	173.4	-169.1	-19.4	0	0	0	110.2	R273 F274 A279 F280 L281	R273-D277 PolarHBondContact O-N 3.49Å; F274-D277 PolarHBondContact O-N 2.92Å; D277-A279 VanDerWaalsContact C-N 3.28Å; D277-A279 PolarHBondContact O-N 3.08Å; D277-A279 PolarHBondContact OD1-N 3.21Å; D277-F280 HydrophobicContact CB-CB 3.95Å; D277-F280 PolarHBondContact O-N 3.1Å; D277-F280 WeakPolarHBondContact OD1-CB 3.48Å; D277-F280 PolarHBondContact OD1-N 2.72Å; D277-F280 WeakPolarHBondContact OD2-CB 3.25Å; D277-L281 WeakPolarHBondContact O-CG 3.25Å; D277-L281 PolarHBondContact O-N 3.02Å; D277-L281 VanDerWaalsContact O-N 3.08Å
278	E	97.3	Very high	98.4	Very high	128 Å²	128	68.8 Å²	68.8	60%	0.598	33%	0.329	S	S	*	.	H	α-helix	trans	-61.4	-37.3	-178.4	-176.2	168.6	-172.9	0	0	112.2	N276 F280 L281 Q282	N276-E278 PolarHBondContact O-N 3.16Å; E278-F280 PolarHBondContact O-N 3.2Å; E278-L281 PolarHBondContact O-N 3.17Å; E278-Q282 HydrophobicContact CG-CG 4.28Å; E278-Q282 WeakPolarHBondContact O-CB 3.23Å; E278-Q282 VanDerWaalsContact O-CG 3.23Å; E278-Q282 WeakPolarHBondContact O-CG 3.43Å; E278-Q282 PolarHBondContact O-N 3.41Å
279	A	98.5	Very high	98.4	Very high	76 Å²	76	68.4 Å²	68.4	63%	0.628	33%	0.33	S	S	*	.	H	α-helix	trans	-63.3	-44.1	179.3	0	0	0	0	0	111.2	D277 Q282 Q283	D277-A279 VanDerWaalsContact C-N 3.28Å; D277-A279 PolarHBondContact O-N 3.08Å; D277-A279 PolarHBondContact OD1-N 3.21Å; A279-Q282 PolarHBondContact O-N 2.62Å; A279-Q283 PolarHBondContact O-N 2.84Å
280	F	98.4	Very high	98.5	Very high	72 Å²	72	69 Å²	69	32%	0.316	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-46.4	174.3	176.7	-111.1	0	0	0	112.1	L47 F274 D277 E278 Q282 Q283 V284	L47-F280 HydrophobicContact CD1-CE1 4Å; F274-F280 AromaticContact CD1-CD1 3.88Å; F274-F280 HydrophobicContact CD1-CD1 3.88Å; F274-F280 AromaticContact CD1-CE1 3.42Å; F274-F280 HydrophobicContact CD1-CE1 3.42Å; F274-F280 VanDerWaalsContact CD1-CE1 3.42Å; F274-F280 HydrophobicContact CD1-CZ 4.34Å; F274-F280 AromaticContact CE1-CE1 3.74Å; F274-F280 HydrophobicContact CE1-CE1 3.74Å; F274-F280 HydrophobicContact CE1-CZ 4.23Å; F274-F280 HydrophobicContact CG-CE1 4.33Å; D277-F280 HydrophobicContact CB-CB 3.95Å; D277-F280 PolarHBondContact O-N 3.1Å; D277-F280 WeakPolarHBondContact OD1-CB 3.48Å; D277-F280 PolarHBondContact OD1-N 2.72Å; D277-F280 WeakPolarHBondContact OD2-CB 3.25Å; E278-F280 PolarHBondContact O-N 3.2Å; F280-Q282 VanDerWaalsContact C-N 3.32Å; F280-Q282 PolarHBondContact O-N 3.37Å; F280-Q283 PolarHBondContact O-N 3.4Å; F280-V284 HydrophobicContact CD1-CG2 4.39Å; F280-V284 HydrophobicContact CD2-CG2 4.22Å; F280-V284 HydrophobicContact CE1-CG2 3.97Å; F280-V284 HydrophobicContact CE2-CG2 3.76Å; F280-V284 HydrophobicContact CZ-CG2 3.63Å; F280-V284 WeakPolarHBondContact O-CG2 3.21Å; F280-V284 PolarHBondContact O-N 3.3Å
281	L	98.7	Very high	98.5	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-39.9	177.8	-65.2	-175.8	0	0	0	112.3	L40 L43 A44 L47 F274 D277 E278 V284 M285	L40-L281 HydrophobicContact CB-CD1 4.48Å; L40-L281 HydrophobicContact CD2-CD1 4.37Å; L43-L281 HydrophobicContact CD2-CB 4.32Å; L43-L281 HydrophobicContact CD2-CD2 4.04Å; L43-L281 HydrophobicContact CG-CD2 4.18Å; A44-L281 HydrophobicContact CB-CD2 4.39Å; L47-L281 HydrophobicContact CD1-CD2 3.84Å; F274-L281 WeakPolarHBondContact O-CG 3.39Å; D277-L281 WeakPolarHBondContact O-CG 3.25Å; D277-L281 PolarHBondContact O-N 3.02Å; D277-L281 VanDerWaalsContact O-N 3.08Å; E278-L281 PolarHBondContact O-N 3.17Å; L281-V284 PolarHBondContact O-N 2.98Å; L281-M285 WeakPolarHBondContact O-CB 3.41Å; L281-M285 VanDerWaalsContact O-CG 3.32Å; L281-M285 WeakPolarHBondContact O-CG 3.5Å; L281-M285 PolarHBondContact O-N 2.92Å
282	Q	98.7	Very high	98.5	Very high	97 Å²	97	69 Å²	69	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-62	-43.7	175	-70.2	-65.1	-20.1	0	0	111.5	E278 A279 F280 M285 K286	E278-Q282 HydrophobicContact CG-CG 4.28Å; E278-Q282 WeakPolarHBondContact O-CB 3.23Å; E278-Q282 VanDerWaalsContact O-CG 3.23Å; E278-Q282 WeakPolarHBondContact O-CG 3.43Å; E278-Q282 PolarHBondContact O-N 3.41Å; A279-Q282 PolarHBondContact O-N 2.62Å; F280-Q282 VanDerWaalsContact C-N 3.32Å; F280-Q282 PolarHBondContact O-N 3.37Å; Q282-M285 HydrophobicContact CG-CE 4.42Å; Q282-M285 PolarHBondContact O-N 3.4Å; Q282-K286 WeakPolarHBondContact O-CB 3.46Å; Q282-K286 PolarHBondContact O-N 3.46Å
283	Q	98.7	Very high	98.5	Very high	88 Å²	88	65.8 Å²	65.8	41%	0.411	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-47.3	177.4	-172.7	58.4	41.2	0	0	111.4	A279 F280 M285 K286 D287	A279-Q283 PolarHBondContact O-N 2.84Å; F280-Q283 PolarHBondContact O-N 3.4Å; Q283-M285 PolarHBondContact O-N 3.07Å; Q283-K286 PolarHBondContact O-N 3.22Å; Q283-D287 PolarHBondContact NE2-OD1 3.47Å; Q283-D287 PolarHBondContact NE2-OD2 2.88Å; Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.48Å
284	V	98.7	Very high	98.6	Very high	6 Å²	6	61.2 Å²	61.2	4%	0.036	32%	0.316	C	S	.	.	H	α-helix	trans	-59.3	-44.7	176.4	172.5	0	0	0	0	111.7	L43 L47 P53 I58 F280 L281 G288	L43-V284 HydrophobicContact CD1-CG1 4.12Å; L47-V284 HydrophobicContact CD1-CG1 4.5Å; L47-V284 HydrophobicContact CD2-CG1 4.4Å; P53-V284 HydrophobicContact CB-CG1 3.98Å; P53-V284 HydrophobicContact CG-CG1 4.36Å; P53-V284 HydrophobicContact CG-CG2 4.23Å; I58-V284 HydrophobicContact CG2-CG1 4.04Å; F280-V284 HydrophobicContact CD1-CG2 4.39Å; F280-V284 HydrophobicContact CD2-CG2 4.22Å; F280-V284 HydrophobicContact CE1-CG2 3.97Å; F280-V284 HydrophobicContact CE2-CG2 3.76Å; F280-V284 HydrophobicContact CZ-CG2 3.63Å; F280-V284 WeakPolarHBondContact O-CG2 3.21Å; F280-V284 PolarHBondContact O-N 3.3Å; L281-V284 PolarHBondContact O-N 2.98Å; V284-G288 PolarHBondContact O-N 3.38Å
285	M	98.8	Very high	98.6	Very high	9 Å²	9	60.9 Å²	60.9	4%	0.044	32%	0.315	C	S	.	.	H	α-helix	trans	-64.3	-39.5	177.8	-73.7	-174	-64.4	0	0	112.4	L40 L43 V60 L281 Q282 Q283 A289	L40-M285 HydrophobicContact CD2-CE 3.76Å; L40-M285 HydrophobicContact CD2-SD 3.99Å; L43-M285 HydrophobicContact CD2-CG 3.42Å; L43-M285 VanDerWaalsContact CD2-CG 3.42Å; L43-M285 HydrophobicContact CD2-SD 4.02Å; V60-M285 HydrophobicContact CG2-CG 4.18Å; V60-M285 HydrophobicContact CG2-SD 3.81Å; L281-M285 WeakPolarHBondContact O-CB 3.41Å; L281-M285 VanDerWaalsContact O-CG 3.32Å; L281-M285 WeakPolarHBondContact O-CG 3.5Å; L281-M285 PolarHBondContact O-N 2.92Å; Q282-M285 HydrophobicContact CG-CE 4.42Å; Q282-M285 PolarHBondContact O-N 3.4Å; Q283-M285 PolarHBondContact O-N 3.07Å; M285-A289 WeakPolarHBondContact O-CB 3.22Å; M285-A289 PolarHBondContact O-N 2.99Å
286	K	98.8	Very high	98.6	Very high	132 Å²	132	58.5 Å²	58.5	57%	0.574	31%	0.306	S	S	*	.	H	α-helix	trans	-64.2	-53.2	177.9	-177.4	-171.6	172.9	-160.8	0	110.8	Q282 Q283 G288 A289 E290	Q282-K286 WeakPolarHBondContact O-CB 3.46Å; Q282-K286 PolarHBondContact O-N 3.46Å; Q283-K286 PolarHBondContact O-N 3.22Å; K286-G288 VanDerWaalsContact C-N 3.33Å; K286-G288 PolarHBondContact O-N 3.02Å; K286-A289 PolarHBondContact O-N 2.88Å; K286-E290 PolarHBondContact O-N 2.89Å
287	D	98.7	Very high	98.6	Very high	61 Å²	61	53.9 Å²	53.9	33%	0.326	28%	0.284	S	S	.	.	H	α-helix	trans	-65	-40.1	-177.4	-64.3	-18.5	0	0	0	111.3	Q283 E290 K291	Q283-D287 PolarHBondContact NE2-OD1 3.47Å; Q283-D287 PolarHBondContact NE2-OD2 2.88Å; Q283-D287 VanDerWaalsContact O-CG 3.3Å; Q283-D287 PolarHBondContact O-N 3.48Å; D287-E290 PolarHBondContact O-N 3.1Å; D287-K291 WeakPolarHBondContact O-CG 3.49Å; D287-K291 PolarHBondContact O-N 2.94Å
288	G	98.8	Very high	98.6	Very high	5 Å²	5	57.2 Å²	57.2	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-62.9	-45.1	175.3	0	0	0	0	0	113.1	I58 V284 K286 K291 A292	I58-G288 WeakPolarHBondContact O-CA 3.21Å; V284-G288 PolarHBondContact O-N 3.38Å; K286-G288 VanDerWaalsContact C-N 3.33Å; K286-G288 PolarHBondContact O-N 3.02Å; G288-K291 PolarHBondContact O-N 3.43Å; G288-A292 VanDerWaalsContact O-CB 3.25Å; G288-A292 WeakPolarHBondContact O-CB 3.49Å; G288-A292 PolarHBondContact O-N 3.46Å
289	A	98.9	Very high	98.7	Very high	13 Å²	13	51.4 Å²	51.4	11%	0.107	26%	0.264	C	S	.	.	H	α-helix	trans	-65.7	-38.9	176.9	0	0	0	0	0	111.9	H63 V64 M285 K286 A292 S293	H63-A289 HydrophobicContact CB-CB 3.87Å; V64-A289 HydrophobicContact CG2-CB 4.27Å; M285-A289 WeakPolarHBondContact O-CB 3.22Å; M285-A289 PolarHBondContact O-N 2.99Å; K286-A289 PolarHBondContact O-N 2.88Å; A289-A292 PolarHBondContact O-N 3.11Å; A289-S293 WeakPolarHBondContact O-CB 3.5Å; A289-S293 PolarHBondContact O-N 3.06Å
290	E	98.8	Very high	98.7	Very high	129 Å²	129	48.1 Å²	48.1	60%	0.603	24%	0.236	S	C	*	.	H	α-helix	trans	-62.5	-48.5	175.3	-175.5	174.5	177.4	0	0	111.6	K286 D287 A292 A294	K286-E290 PolarHBondContact O-N 2.89Å; D287-E290 PolarHBondContact O-N 3.1Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 2.93Å; E290-A294 VanDerWaalsContact O-CB 3.25Å; E290-A294 WeakPolarHBondContact O-CB 3.44Å; E290-A294 PolarHBondContact O-N 3.13Å
291	K	98.6	Very high	98.7	Very high	88 Å²	88	51.7 Å²	51.7	38%	0.383	25%	0.251	S	S	.	.	H	α-helix	trans	-57.2	-45	174.3	-72.7	177.1	-174.4	-175.4	0	111.6	P53 T57 D287 G288 H295	P53-K291 PolarHBondContact O-NZ 2.82Å; T57-K291 HydrophobicContact CG2-CB 4.02Å; D287-K291 WeakPolarHBondContact O-CG 3.49Å; D287-K291 PolarHBondContact O-N 2.94Å; G288-K291 PolarHBondContact O-N 3.43Å; K291-H295 PolarHBondContact O-N 2.91Å
292	A	98.8	Very high	98.7	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-53.4	-179	0	0	0	0	0	112.2	T57 F59 V64 Y118 G288 A289 E290 A294 H295 A296	T57-A292 HydrophobicContact CG2-CB 3.97Å; F59-A292 HydrophobicContact CB-CB 4.5Å; F59-A292 HydrophobicContact CD1-CB 3.78Å; F59-A292 HydrophobicContact CD2-CB 4.01Å; F59-A292 HydrophobicContact CE1-CB 3.93Å; F59-A292 HydrophobicContact CE2-CB 4.15Å; F59-A292 HydrophobicContact CG-CB 3.83Å; F59-A292 HydrophobicContact CZ-CB 4.12Å; V64-A292 HydrophobicContact CG2-CB 3.74Å; Y118-A292 HydrophobicContact CE1-CB 4.11Å; G288-A292 VanDerWaalsContact O-CB 3.25Å; G288-A292 WeakPolarHBondContact O-CB 3.49Å; G288-A292 PolarHBondContact O-N 3.46Å; A289-A292 PolarHBondContact O-N 3.11Å; E290-A292 VanDerWaalsContact C-N 3.32Å; E290-A292 PolarHBondContact O-N 2.93Å; A292-A294 VanDerWaalsContact C-N 3.3Å; A292-A294 PolarHBondContact O-N 3.45Å; A292-H295 PolarHBondContact O-N 3.12Å; A292-H295 VanDerWaalsContact O-N 3.08Å; A292-A296 WeakPolarHBondContact O-CB 3.4Å; A292-A296 PolarHBondContact O-N 3.19Å
293	S	98.8	Very high	98.7	Very high	28 Å²	28	48.7 Å²	48.7	20%	0.196	24%	0.243	C	C	.	.	H	α-helix	trans	-60.2	-37.1	176.9	-79.9	0	0	0	0	112.3	V64 E66 A289 H295 A296 S297	V64-S293 WeakPolarHBondContact CG1-OG 3.34Å; E66-S293 PolarHBondContact OE2-OG 3.46Å; E66-S293 VanDerWaalsContact OE2-OG 3.06Å; A289-S293 WeakPolarHBondContact O-CB 3.5Å; A289-S293 PolarHBondContact O-N 3.06Å; S293-H295 PolarHBondContact O-N 3.38Å; S293-A296 PolarHBondContact O-N 3.21Å; S293-S297 WeakPolarHBondContact O-CB 3.43Å; S293-S297 PolarHBondContact O-N 3Å; S293-S297 PolarHBondContact O-OG 3.41Å
294	A	98.7	Very high	98.7	Very high	48 Å²	48	47.5 Å²	47.5	40%	0.397	24%	0.235	S	C	.	.	H	α-helix	trans	-59.1	-36.4	175.7	0	0	0	0	0	112.3	E290 A292 S297 R298	E290-A294 VanDerWaalsContact O-CB 3.25Å; E290-A294 WeakPolarHBondContact O-CB 3.44Å; E290-A294 PolarHBondContact O-N 3.13Å; A292-A294 VanDerWaalsContact C-N 3.3Å; A292-A294 PolarHBondContact O-N 3.45Å; A294-S297 PolarHBondContact O-OG 3.06Å; A294-R298 PolarHBondContact O-NH1 3.44Å
295	H	98.5	Very high	98.7	Very high	40 Å²	40	54.7 Å²	54.7	19%	0.185	27%	0.268	C	S	.	.	H	α-helix	trans	-77.7	-54.7	173.7	-165.1	165.1	0	0	0	111.7	Y118 K291 A292 S293 S297 R298	Y118-H295 HydrophobicContact CD1-CB 4.08Å; Y118-H295 AromaticContact CD1-ND1 3.98Å; Y118-H295 HydrophobicContact CE1-CB 4.41Å; Y118-H295 PolarHBondContact O-CE1 3.24Å; K291-H295 PolarHBondContact O-N 2.91Å; A292-H295 PolarHBondContact O-N 3.12Å; A292-H295 VanDerWaalsContact O-N 3.08Å; S293-H295 PolarHBondContact O-N 3.38Å; H295-S297 VanDerWaalsContact C-N 3.28Å; H295-S297 PolarHBondContact O-N 2.89Å; H295-R298 PolarHBondContact CD2-NH2 2.73Å; H295-R298 WeakPolarHBondContact O-CB 3.02Å; H295-R298 PolarHBondContact O-N 3.25Å
296	A	98.8	Very high	98.7	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-56.5	-40.5	-175.1	0	0	0	0	0	112.5	V64 E66 L117 Y118 A292 S293 R298 T299 L300	V64-A296 HydrophobicContact CG1-CB 4.17Å; E66-A296 HydrophobicContact CB-CB 3.71Å; E66-A296 HydrophobicContact CG-CB 3.93Å; L117-A296 HydrophobicContact CB-CB 4.14Å; L117-A296 HydrophobicContact CD1-CB 4.15Å; L117-A296 HydrophobicContact CD2-CB 3.98Å; L117-A296 HydrophobicContact CG-CB 4.3Å; Y118-A296 HydrophobicContact CE1-CB 4.09Å; A292-A296 WeakPolarHBondContact O-CB 3.4Å; A292-A296 PolarHBondContact O-N 3.19Å; S293-A296 PolarHBondContact O-N 3.21Å; A296-R298 VanDerWaalsContact C-N 3.28Å; A296-R298 PolarHBondContact O-N 3.1Å; A296-T299 PolarHBondContact O-N 2.55Å; A296-L300 PolarHBondContact O-N 3.43Å
297	S	98.6	Very high	98.7	Very high	31 Å²	31	51.3 Å²	51.3	22%	0.217	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-30.3	179	62.2	0	0	0	0	113.7	E66 S293 A294 H295 K301	E66-S297 WeakPolarHBondContact OE1-CB 3.16Å; S293-S297 WeakPolarHBondContact O-CB 3.43Å; S293-S297 PolarHBondContact O-N 3Å; S293-S297 PolarHBondContact O-OG 3.41Å; A294-S297 PolarHBondContact O-OG 3.06Å; H295-S297 VanDerWaalsContact C-N 3.28Å; H295-S297 PolarHBondContact O-N 2.89Å; S297-K301 WeakPolarHBondContact O-CB 3.47Å; S297-K301 WeakPolarHBondContact O-CG 3.35Å; S297-K301 PolarHBondContact O-N 2.74Å
298	R	98.7	Very high	98.7	Very high	147 Å²	147	51.3 Å²	51.3	56%	0.555	28%	0.275	S	S	*	.	H	α-helix	trans	-67.6	-47.4	175.7	-65.5	-171.3	-62.4	-94.8	6.8	111	A294 H295 A296 K301 A302	A294-R298 PolarHBondContact O-NH1 3.44Å; H295-R298 PolarHBondContact CD2-NH2 2.73Å; H295-R298 WeakPolarHBondContact O-CB 3.02Å; H295-R298 PolarHBondContact O-N 3.25Å; A296-R298 VanDerWaalsContact C-N 3.28Å; A296-R298 PolarHBondContact O-N 3.1Å; R298-K301 PolarHBondContact O-N 2.69Å; R298-A302 PolarHBondContact O-N 3Å; R298-A302 VanDerWaalsContact O-N 3.17Å
299	T	98.7	Very high	98.7	Very high	6 Å²	6	56.3 Å²	56.3	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-63.4	-46	176.6	-59.1	0	0	0	0	110.8	L117 Q119 F151 A296 K301 A302 V303	L117-T299 VanDerWaalsContact O-CB 3.25Å; L117-T299 WeakPolarHBondContact O-CB 3.47Å; L117-T299 PolarHBondContact O-OG1 2.66Å; Q119-T299 PolarHBondContact NE2-OG1 2.85Å; F151-T299 HydrophobicContact CD1-CG2 4.04Å; F151-T299 HydrophobicContact CE1-CG2 3.68Å; A296-T299 PolarHBondContact O-N 2.55Å; T299-K301 VanDerWaalsContact C-N 3.33Å; T299-K301 PolarHBondContact O-N 2.78Å; T299-A302 PolarHBondContact O-N 3.26Å; T299-V303 HydrophobicContact CG2-CG2 4.4Å; T299-V303 VanDerWaalsContact O-CG2 3.32Å; T299-V303 WeakPolarHBondContact O-CG2 3.31Å; T299-V303 PolarHBondContact O-N 3.26Å
300	L	98.8	Very high	98.7	Very high	8 Å²	8	62.7 Å²	62.7	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-62.3	-39.5	-179.7	-171.8	68.2	0	0	0	112.3	E66 Q69 L70 L117 A296 V303 Y304	E66-L300 HydrophobicContact CB-CD2 4.1Å; E66-L300 HydrophobicContact CG-CB 4.34Å; E66-L300 HydrophobicContact CG-CD2 3.76Å; Q69-L300 HydrophobicContact CB-CD1 4.19Å; Q69-L300 HydrophobicContact CB-CD2 3.77Å; Q69-L300 HydrophobicContact CG-CD2 4.38Å; L70-L300 HydrophobicContact CB-CD1 3.96Å; L70-L300 HydrophobicContact CD1-CD1 4.3Å; L117-L300 HydrophobicContact CD2-CB 4.37Å; A296-L300 PolarHBondContact O-N 3.43Å; L300-V303 PolarHBondContact O-N 3.03Å; L300-Y304 HydrophobicContact CD1-CD1 4Å; L300-Y304 HydrophobicContact CD1-CE1 3.47Å; L300-Y304 VanDerWaalsContact CD1-CE1 3.47Å; L300-Y304 HydrophobicContact CD1-CE2 4.45Å; L300-Y304 HydrophobicContact CD2-CE2 4.19Å; L300-Y304 HydrophobicContact CG-CD1 4.27Å; L300-Y304 HydrophobicContact CG-CD2 4.42Å; L300-Y304 HydrophobicContact CG-CE1 3.98Å; L300-Y304 HydrophobicContact CG-CE2 4.13Å; L300-Y304 HydrophobicContact CG-CG 4.5Å; L300-Y304 WeakPolarHBondContact O-CB 3.3Å; L300-Y304 PolarHBondContact O-N 3.11Å
301	K	98.6	Very high	98.6	Very high	147 Å²	147	60.6 Å²	60.6	64%	0.639	34%	0.337	S	S	*	.	H	α-helix	trans	-60.5	-46.8	174.2	-77.3	172.6	-177	-176.2	0	111.8	S297 R298 T299 V303 Y304 E305	S297-K301 WeakPolarHBondContact O-CB 3.47Å; S297-K301 WeakPolarHBondContact O-CG 3.35Å; S297-K301 PolarHBondContact O-N 2.74Å; R298-K301 PolarHBondContact O-N 2.69Å; T299-K301 VanDerWaalsContact C-N 3.33Å; T299-K301 PolarHBondContact O-N 2.78Å; K301-V303 VanDerWaalsContact C-N 3.32Å; K301-V303 PolarHBondContact O-N 2.84Å; K301-Y304 PolarHBondContact O-N 3.4Å; K301-E305 WeakPolarHBondContact O-CB 3.43Å; K301-E305 PolarHBondContact O-N 2.95Å
302	A	98.6	Very high	98.5	Very high	35 Å²	35	65.8 Å²	65.8	29%	0.289	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-40.5	177.1	0	0	0	0	0	112	I150 R298 T299 A306	I150-A302 HydrophobicContact CG2-CB 4.37Å; R298-A302 PolarHBondContact O-N 3Å; R298-A302 VanDerWaalsContact O-N 3.17Å; T299-A302 PolarHBondContact O-N 3.26Å; A302-A306 VanDerWaalsContact O-CB 3.29Å; A302-A306 WeakPolarHBondContact O-CB 3.44Å; A302-A306 PolarHBondContact O-N 3.36Å
303	V	98.8	Very high	98.3	Very high	0 Å²	0	74.9 Å²	74.9	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-62.6	-48.4	174.2	171.1	0	0	0	0	111.1	L70 F143 I150 F151 T299 L300 K301 E305 A306 I307	L70-V303 HydrophobicContact CD1-CB 4.4Å; L70-V303 HydrophobicContact CD1-CG1 3.9Å; L70-V303 HydrophobicContact CD1-CG2 4.1Å; F143-V303 HydrophobicContact CE1-CG2 4.41Å; F143-V303 HydrophobicContact CE2-CG1 4.19Å; F143-V303 HydrophobicContact CZ-CB 4.35Å; F143-V303 HydrophobicContact CZ-CG1 3.81Å; F143-V303 HydrophobicContact CZ-CG2 4.38Å; I150-V303 HydrophobicContact CG2-CG2 3.81Å; F151-V303 HydrophobicContact CE1-CG2 3.57Å; F151-V303 HydrophobicContact CE2-CG2 4.26Å; F151-V303 HydrophobicContact CZ-CG2 3.31Å; T299-V303 HydrophobicContact CG2-CG2 4.4Å; T299-V303 VanDerWaalsContact O-CG2 3.32Å; T299-V303 WeakPolarHBondContact O-CG2 3.31Å; T299-V303 PolarHBondContact O-N 3.26Å; L300-V303 PolarHBondContact O-N 3.03Å; K301-V303 VanDerWaalsContact C-N 3.32Å; K301-V303 PolarHBondContact O-N 2.84Å; V303-E305 VanDerWaalsContact C-N 3.34Å; V303-E305 PolarHBondContact O-N 3.1Å; V303-A306 PolarHBondContact O-N 3.49Å; V303-I307 HydrophobicContact CG1-CD1 3.75Å; V303-I307 HydrophobicContact CG1-CG1 4.41Å; V303-I307 VanDerWaalsContact O-CG1 3.25Å; V303-I307 WeakPolarHBondContact O-CG1 3.47Å; V303-I307 PolarHBondContact O-N 3.39Å
304	Y	98.7	Very high	98.2	Very high	63 Å²	63	77.2 Å²	77.2	25%	0.247	43%	0.43	C	S	.	.	H	α-helix	trans	-64.5	-38.4	-179.1	-77.4	6.4	0	0	0	112.4	Q69 L300 K301 G308 F309	Q69-Y304 WeakPolarHBondContact CB-OH 3.48Å; Q69-Y304 PolarHBondContact NE2-OH 2.9Å; L300-Y304 HydrophobicContact CD1-CD1 4Å; L300-Y304 HydrophobicContact CD1-CE1 3.47Å; L300-Y304 VanDerWaalsContact CD1-CE1 3.47Å; L300-Y304 HydrophobicContact CD1-CE2 4.45Å; L300-Y304 HydrophobicContact CD2-CE2 4.19Å; L300-Y304 HydrophobicContact CG-CD1 4.27Å; L300-Y304 HydrophobicContact CG-CD2 4.42Å; L300-Y304 HydrophobicContact CG-CE1 3.98Å; L300-Y304 HydrophobicContact CG-CE2 4.13Å; L300-Y304 HydrophobicContact CG-CG 4.5Å; L300-Y304 WeakPolarHBondContact O-CB 3.3Å; L300-Y304 PolarHBondContact O-N 3.11Å; K301-Y304 PolarHBondContact O-N 3.4Å; Y304-G308 PolarHBondContact O-N 3.37Å; Y304-G308 VanDerWaalsContact O-N 3.12Å; Y304-F309 AromaticContact CD1-CD2 3.8Å; Y304-F309 HydrophobicContact CD1-CD2 3.8Å; Y304-F309 HydrophobicContact CD1-CE2 4.07Å; Y304-F309 HydrophobicContact CD2-CD2 4.23Å; Y304-F309 HydrophobicContact CE1-CD2 4.21Å; Y304-F309 HydrophobicContact CE1-CE2 4.14Å; Y304-F309 AromaticContact CG-CD2 3.8Å; Y304-F309 HydrophobicContact CG-CD2 3.8Å; Y304-F309 PolarHBondContact O-N 3.17Å
305	E	98.6	Very high	98.2	Very high	157 Å²	157	78.7 Å²	78.7	73%	0.734	43%	0.432	S	S	*	.	H	α-helix	trans	-62.9	-48	173	-175.3	177.8	-177.4	0	0	111.3	K301 V303 I307 G308	K301-E305 WeakPolarHBondContact O-CB 3.43Å; K301-E305 PolarHBondContact O-N 2.95Å; V303-E305 VanDerWaalsContact C-N 3.34Å; V303-E305 PolarHBondContact O-N 3.1Å; E305-I307 PolarHBondContact O-N 3.18Å; E305-G308 WeakPolarHBondContact O-CA 3.48Å; E305-G308 PolarHBondContact O-N 2.98Å
306	A	98.6	Very high	98.2	Very high	30 Å²	30	80.9 Å²	80.9	25%	0.248	45%	0.445	C	S	.	.	H	α-helix	trans	-60.2	-40.7	178.1	0	0	0	0	0	113.4	F143 Y147 I150 A302 V303 G308	F143-A306 HydrophobicContact CE1-CB 4.32Å; F143-A306 HydrophobicContact CZ-CB 4.24Å; Y147-A306 HydrophobicContact CD1-CB 4.23Å; Y147-A306 VanDerWaalsContact CD1-O 3.24Å; Y147-A306 WeakPolarHBondContact CD1-O 3.43Å; Y147-A306 WeakPolarHBondContact CE1-O 3.18Å; Y147-A306 HydrophobicContact CG-CB 3.97Å; I150-A306 HydrophobicContact CG1-CB 4.44Å; A302-A306 VanDerWaalsContact O-CB 3.29Å; A302-A306 WeakPolarHBondContact O-CB 3.44Å; A302-A306 PolarHBondContact O-N 3.36Å; V303-A306 PolarHBondContact O-N 3.49Å; A306-G308 PolarHBondContact O-N 3.27Å
307	I	98.6	Very high	98.2	Very high	40 Å²	40	85.6 Å²	85.6	21%	0.205	47%	0.472	C	S	.	.	H	α-helix	trans	-68.7	-25.9	175.6	-65.6	175.6	0	0	0	111.3	A73 Y77 F143 V303 E305 F309	A73-I307 HydrophobicContact CB-CD1 4.11Å; Y77-I307 HydrophobicContact CE2-CD1 3.96Å; Y77-I307 HydrophobicContact CE2-CG1 4.32Å; Y77-I307 WeakPolarHBondContact OH-CG1 3.47Å; F143-I307 HydrophobicContact CE2-CD1 4.05Å; F143-I307 HydrophobicContact CE2-CG1 3.94Å; F143-I307 HydrophobicContact CZ-CD1 4.37Å; F143-I307 HydrophobicContact CZ-CG1 4Å; V303-I307 HydrophobicContact CG1-CD1 3.75Å; V303-I307 HydrophobicContact CG1-CG1 4.41Å; V303-I307 VanDerWaalsContact O-CG1 3.25Å; V303-I307 WeakPolarHBondContact O-CG1 3.47Å; V303-I307 PolarHBondContact O-N 3.39Å; E305-I307 PolarHBondContact O-N 3.18Å; I307-F309 HydrophobicContact CG2-CD1 4.05Å; I307-F309 HydrophobicContact CG2-CE1 3.67Å; I307-F309 HydrophobicContact CG2-CE2 4.25Å; I307-F309 HydrophobicContact CG2-CG 4.49Å; I307-F309 HydrophobicContact CG2-CZ 3.78Å
308	G	98.4	Very high	98.1	Very high	61 Å²	61	89.1 Å²	89.1	63%	0.629	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	24.4	180	0	0	0	0	0	114.5	Y304 E305 A306	Y304-G308 PolarHBondContact O-N 3.37Å; Y304-G308 VanDerWaalsContact O-N 3.12Å; E305-G308 WeakPolarHBondContact O-CA 3.48Å; E305-G308 PolarHBondContact O-N 2.98Å; A306-G308 PolarHBondContact O-N 3.27Å
309	F	98.5	Very high	98.1	Very high	110 Å²	110	85.2 Å²	85.2	48%	0.482	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-72.8	143.6	171.7	-64.9	-21.7	0	0	0	111.2	Y304 I307 A311	Y304-F309 AromaticContact CD1-CD2 3.8Å; Y304-F309 HydrophobicContact CD1-CD2 3.8Å; Y304-F309 HydrophobicContact CD1-CE2 4.07Å; Y304-F309 HydrophobicContact CD2-CD2 4.23Å; Y304-F309 HydrophobicContact CE1-CD2 4.21Å; Y304-F309 HydrophobicContact CE1-CE2 4.14Å; Y304-F309 AromaticContact CG-CD2 3.8Å; Y304-F309 HydrophobicContact CG-CD2 3.8Å; Y304-F309 PolarHBondContact O-N 3.17Å; I307-F309 HydrophobicContact CG2-CD1 4.05Å; I307-F309 HydrophobicContact CG2-CE1 3.67Å; I307-F309 HydrophobicContact CG2-CE2 4.25Å; I307-F309 HydrophobicContact CG2-CG 4.49Å; I307-F309 HydrophobicContact CG2-CZ 3.78Å; F309-A311 PolarHBondContact O-N 3.37Å
310	V	98.4	Very high	98.1	Very high	148 Å²	148	90.9 Å²	90.9	90%	0.897	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-64.6	124.8	170	-179.9	0	0	0	0	108.6
311	A	97.7	Very high	98	Very high	84 Å²	84	97.2 Å²	97.2	69%	0.694	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.2	-179.1	0	0	0	0	0	111.5	F309	F309-A311 PolarHBondContact O-N 3.37Å
312	K	96.6	Very high	97.9	Very high	197 Å²	197	93.1 Å²	93.1	86%	0.857	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-60.6	127.6	170.2	-175.2	-176.9	176	-169.2	0	108.5
313	P	93.8	Very high	97.9	Very high	192 Å²	192	98.4 Å²	98.4	100%	1.247	57%	0.567	S	S	*	*			trans	-56.1	0	-178.7	-25.6	34	0	0	0	114.7

Retrieved 313 of 313 residues in 388.7 ms (Link to these results)

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