A0A087XDI2_POEFO Loading...

Chloride intracellular channel protein

In the soluble state, catalyzes glutaredoxin-like thiol disulfide exchange reactions with reduced glutathione as electron donor. Can insert into membranes and form voltage-dependent multi-ion conductive channels. Membrane insertion seems to be redox-regulated and may occur only under oxidizing conditions. Has alternate cellular functions like a potential role in angiogenesis or in maintaining apical-basolateral membrane polarity during mitosis and cytokinesis. Could also promote endothelial cell proliferation and regulate endothelial morphogenesis (tubulogenesis). Promotes cell-surface expression of HRH3.

AlphaFold DB , UniProt , Accession A0A087XDI2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 252 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33	Very low	39.8	Very low	191 Å²	191	129.1 Å²	129.1	94%	0.941	74%	0.742	S	S	*	*				0	133.3	0	-78.9	168.7	-109.1	0	0	108.9	L3 E29	M1-L3 PolarHBondContact O-N 2.71Å; M1-E29 PolarHBondContact N-OE2 2.92Å
2	S	30.4	Very low	41.2	Very low	109 Å²	109	123.3 Å²	123.3	76%	0.762	72%	0.721	S	S	*	*			trans	-65.2	118.9	179.3	49.6	0	0	0	0	110.4	S4	S2-S4 PolarHBondContact O-N 2.83Å
3	L	35.2	Very low	42.6	Very low	126 Å²	126	127 Å²	127	66%	0.66	74%	0.736	S	S	*	*			trans	-67.6	101.8	168.1	-72.3	166	0	0	0	107.5	M1 V5	M1-L3 PolarHBondContact O-N 2.71Å; L3-V5 PolarHBondContact O-N 3.24Å
4	S	34.3	Very low	44.6	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	74%	0.744	S	S	*	*			trans	-75	104.8	177.1	51.8	0	0	0	0	109.6	S2	S2-S4 PolarHBondContact O-N 2.83Å
5	V	45	Very low	47.2	Very low	54 Å²	54	125.5 Å²	125.5	33%	0.327	72%	0.717	S	S	.	*			trans	-65.7	150.1	164.4	-176.8	0	0	0	0	108.4	L3 Q7	L3-V5 PolarHBondContact O-N 3.24Å; V5-Q7 PolarHBondContact O-N 2.98Å; V5-Q7 VanDerWaalsContact O-N 3.17Å
6	P	37.9	Very low	50	Low	106 Å²	106	118.9 Å²	118.9	69%	0.688	68%	0.68	S	S	*	*			trans	-56.4	122.5	-173.8	-23.8	33.1	0	0	0	112.3	N8	P6-N8 VanDerWaalsContact C-N 3.32Å; P6-N8 PolarHBondContact O-N 2.87Å
7	Q	42.8	Very low	52.6	Low	190 Å²	190	116.8 Å²	116.8	89%	0.888	67%	0.67	S	S	*	*			trans	-73	87.7	169.4	-78.4	-175	-12.6	0	0	109.2	V5	V5-Q7 PolarHBondContact O-N 2.98Å; V5-Q7 VanDerWaalsContact O-N 3.17Å
8	N	46.9	Very low	55.1	Low	139 Å²	139	110.5 Å²	110.5	74%	0.743	63%	0.634	S	S	*	*			trans	-89.5	112.7	160	-82	-17.8	0	0	0	108.9	P6	P6-N8 VanDerWaalsContact C-N 3.32Å; P6-N8 PolarHBondContact O-N 2.87Å
9	G	43.3	Very low	57.4	Low	69 Å²	69	107.6 Å²	107.6	71%	0.711	61%	0.614	S	S	*	*	S	Bend	trans	111.5	128.7	157	0	0	0	0	0	115.8	K11	G9-K11 PolarHBondContact O-N 2.85Å
10	V	41.4	Very low	59.4	Low	144 Å²	144	102.2 Å²	102.2	87%	0.873	58%	0.583	S	S	*	*			trans	-51.5	127	164.5	176	0	0	0	0	108.9	A12	V10-A12 PolarHBondContact O-N 2.98Å
11	K	47.8	Very low	61.2	Low	179 Å²	179	97.4 Å²	97.4	78%	0.778	56%	0.556	S	S	*	*			trans	-53.2	109.5	173.4	-85.9	-176	173.4	-177.3	0	109.5	G9	G9-K11 PolarHBondContact O-N 2.85Å
12	A	57	Low	64.2	Low	59 Å²	59	88.4 Å²	88.4	49%	0.488	51%	0.511	S	S	.	.			trans	-73.6	141.9	160.6	0	0	0	0	0	108.2	V10 N14 E15	V10-A12 PolarHBondContact O-N 2.98Å; A12-N14 PolarHBondContact O-N 2.97Å; A12-E15 HydrophobicContact CB-CG 4.26Å; A12-E15 PolarHBondContact O-N 3.11Å
13	D	58.8	Low	67.3	Low	172 Å²	172	86.8 Å²	86.8	92%	0.92	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-2.1	-174	-115.9	-5.9	0	0	0	115.4
14	N	70.9	Confident	70.1	Confident	157 Å²	157	81.2 Å²	81.2	84%	0.84	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	13.4	-175.1	-78.2	-14.9	0	0	0	114.5	A12	A12-N14 PolarHBondContact O-N 2.97Å
15	E	83.1	Confident	73	Confident	74 Å²	74	76.3 Å²	76.3	35%	0.346	43%	0.43	S	S	.	.			trans	-83.4	136	175.4	-60.6	-143.1	130.5	0	0	112.2	A12 V17 K102	A12-E15 HydrophobicContact CB-CG 4.26Å; A12-E15 PolarHBondContact O-N 3.11Å; E15-V17 PolarHBondContact O-N 2.77Å; E15-K102 IonicContact OE1-NZ 3.79Å; E15-K102 PolarHBondContact OE1-NZ 2.73Å
16	P	91.4	Very high	75.3	Confident	20 Å²	20	77.3 Å²	77.3	13%	0.13	44%	0.439	C	S	.	.			trans	-65.4	137.9	179.2	28.4	-34	0	0	0	110.5	I18 V49 F79 N80 L98	P16-I18 HydrophobicContact CB-CD1 4.38Å; P16-I18 HydrophobicContact CB-CG1 4.12Å; P16-I18 HydrophobicContact CG-CD1 4.13Å; P16-I18 HydrophobicContact CG-CG1 4.33Å; P16-I18 PolarHBondContact O-N 3.25Å; P16-V49 HydrophobicContact CG-CG2 4.21Å; P16-F79 HydrophobicContact CB-CD2 4.48Å; P16-F79 HydrophobicContact CB-CE1 3.92Å; P16-F79 HydrophobicContact CB-CE2 3.68Å; P16-F79 HydrophobicContact CB-CZ 3.33Å; P16-F79 HydrophobicContact CG-CE2 4.2Å; P16-F79 HydrophobicContact CG-CZ 4.04Å; P16-N80 VanDerWaalsContact CA-OD1 3.31Å; P16-N80 WeakPolarHBondContact CA-OD1 3.46Å; P16-L98 HydrophobicContact CG-CD2 4.22Å
17	V	95.6	Very high	77.9	Confident	83 Å²	83	76.3 Å²	76.3	50%	0.503	43%	0.429	S	S	.	.			trans	-86.3	109.9	171.5	-178.7	0	0	0	0	107.9	E15 N80	E15-V17 PolarHBondContact O-N 2.77Å; V17-N80 PolarHBondContact N-OD1 3.46Å; V17-N80 PolarHBondContact O-N 2.6Å
18	I	97.7	Very high	80.2	Confident	4 Å²	4	68 Å²	68	2%	0.021	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	128.5	-178	-50.5	179.6	0	0	0	109.6	P16 L44 V49 F51 N52 T78 F79 L98	P16-I18 HydrophobicContact CB-CD1 4.38Å; P16-I18 HydrophobicContact CB-CG1 4.12Å; P16-I18 HydrophobicContact CG-CD1 4.13Å; P16-I18 HydrophobicContact CG-CG1 4.33Å; P16-I18 PolarHBondContact O-N 3.25Å; I18-L44 HydrophobicContact CD1-CD2 4.13Å; I18-L44 HydrophobicContact CG2-CD1 4.06Å; I18-L44 HydrophobicContact CG2-CD2 3.99Å; I18-V49 HydrophobicContact CD1-CB 4.45Å; I18-V49 HydrophobicContact CD1-CG1 3.92Å; I18-V49 HydrophobicContact CD1-CG2 3.71Å; I18-F51 HydrophobicContact CB-CB 3.83Å; I18-F51 HydrophobicContact CG2-CB 3.98Å; I18-F51 VanDerWaalsContact O-CA 3.3Å; I18-F51 WeakPolarHBondContact O-CA 3.28Å; I18-F51 WeakPolarHBondContact O-CB 3.2Å; I18-N52 PolarHBondContact O-N 2.87Å; I18-T78 WeakPolarHBondContact CA-O 3.27Å; I18-F79 HydrophobicContact CD1-CD2 3.92Å; I18-F79 HydrophobicContact CD1-CE2 3.71Å; I18-F79 HydrophobicContact CG1-CD2 3.73Å; I18-F79 HydrophobicContact CG1-CE2 3.89Å; I18-L98 HydrophobicContact CD1-CD1 4.19Å; I18-L98 HydrophobicContact CD1-CD2 4.47Å
19	E	97.5	Very high	82.3	Confident	55 Å²	55	66.1 Å²	66.1	26%	0.257	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125.2	169.1	-169.9	176.3	-176.2	0	0	109.6	F21 N52 T54 I77 T78	E19-F21 HydrophobicContact CB-CE2 3.93Å; E19-F21 HydrophobicContact CB-CZ 4.16Å; E19-F21 HydrophobicContact CG-CD2 4.44Å; E19-F21 HydrophobicContact CG-CE1 4.17Å; E19-F21 HydrophobicContact CG-CE2 3.75Å; E19-F21 HydrophobicContact CG-CZ 3.61Å; E19-F21 WeakPolarHBondContact OE1-CE1 3.38Å; E19-F21 WeakPolarHBondContact OE1-CZ 3.33Å; E19-F21 VanDerWaalsContact OE2-CZ 3.32Å; E19-F21 WeakPolarHBondContact OE2-CZ 3.46Å; E19-N52 WeakPolarHBondContact CA-O 3.41Å; E19-N52 HydrophobicContact CG-CB 4.12Å; E19-T54 WeakPolarHBondContact OE1-CB 3.44Å; E19-T54 PolarHBondContact OE1-OG1 2.92Å; E19-I77 CarbonylContact O-C 3.51Å; E19-I77 WeakPolarHBondContact O-CA 3.21Å; E19-T78 WeakPolarHBondContact CB-OG1 3.49Å; E19-T78 PolarHBondContact N-O 3.16Å; E19-T78 VanDerWaalsContact N-O 3.1Å; E19-T78 PolarHBondContact O-N 2.77Å
20	L	98	Very high	84.8	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	123.4	176.7	173.9	66	0	0	0	109.8	V22 L40 F41 L44 F51 N52 V53 T54 I77	L20-V22 HydrophobicContact CD1-CG1 4.3Å; L20-V22 HydrophobicContact CD2-CG1 3.7Å; L20-V22 HydrophobicContact CG-CG1 3.68Å; L20-L40 HydrophobicContact CD1-CB 3.86Å; L20-L40 HydrophobicContact CD1-CD1 4.24Å; L20-F41 HydrophobicContact CD2-CB 3.64Å; L20-F41 HydrophobicContact CD2-CD2 4.39Å; L20-F41 HydrophobicContact CD2-CG 3.97Å; L20-L44 HydrophobicContact CB-CD1 3.95Å; L20-L44 HydrophobicContact CD2-CD1 4.25Å; L20-L44 HydrophobicContact CG-CD1 4.49Å; L20-F51 HydrophobicContact CB-CD2 4.34Å; L20-N52 PolarHBondContact N-O 3.4Å; L20-V53 HydrophobicContact CB-CG2 4.5Å; L20-V53 HydrophobicContact CD2-CG2 4.46Å; L20-V53 CarbonylContact O-C 3.56Å; L20-V53 WeakPolarHBondContact O-CA 3.39Å; L20-T54 PolarHBondContact O-N 2.96Å; L20-I77 HydrophobicContact CB-CG2 4.39Å; L20-I77 HydrophobicContact CD1-CG2 3.6Å
21	F	96.8	Very high	87.3	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.009	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	111.3	176.3	-61.9	-90	0	0	0	109.6	E19 T54 V56 L65 L68 P75 F76 T78	E19-F21 HydrophobicContact CB-CE2 3.93Å; E19-F21 HydrophobicContact CB-CZ 4.16Å; E19-F21 HydrophobicContact CG-CD2 4.44Å; E19-F21 HydrophobicContact CG-CE1 4.17Å; E19-F21 HydrophobicContact CG-CE2 3.75Å; E19-F21 HydrophobicContact CG-CZ 3.61Å; E19-F21 WeakPolarHBondContact OE1-CE1 3.38Å; E19-F21 WeakPolarHBondContact OE1-CZ 3.33Å; E19-F21 VanDerWaalsContact OE2-CZ 3.32Å; E19-F21 WeakPolarHBondContact OE2-CZ 3.46Å; F21-T54 CarbonylContact C-O 3.3Å; F21-T54 VanDerWaalsContact CA-O 3.27Å; F21-T54 WeakPolarHBondContact CA-O 3.21Å; F21-T54 HydrophobicContact CD1-CG2 3.76Å; F21-T54 HydrophobicContact CE1-CG2 3.83Å; F21-V56 HydrophobicContact CB-CG2 3.97Å; F21-V56 HydrophobicContact CD1-CG2 4.11Å; F21-L65 HydrophobicContact CD1-CD2 3.68Å; F21-L65 HydrophobicContact CE1-CD2 3.38Å; F21-L65 HydrophobicContact CZ-CD2 4.27Å; F21-L68 HydrophobicContact CE1-CD2 4.24Å; F21-L68 HydrophobicContact CE2-CD2 4.06Å; F21-L68 HydrophobicContact CZ-CD2 3.59Å; F21-P75 VanDerWaalsContact O-CA 3.25Å; F21-P75 WeakPolarHBondContact O-CA 3.48Å; F21-F76 HydrophobicContact CB-CD1 3.91Å; F21-F76 HydrophobicContact CB-CD2 3.97Å; F21-F76 HydrophobicContact CB-CE1 3.58Å; F21-F76 HydrophobicContact CB-CE2 3.66Å; F21-F76 HydrophobicContact CB-CG 4.09Å; F21-F76 HydrophobicContact CB-CZ 3.44Å; F21-F76 VanDerWaalsContact CB-CZ 3.44Å; F21-F76 HydrophobicContact CD1-CE2 4.04Å; F21-F76 AromaticContact CD1-CZ 3.88Å; F21-F76 HydrophobicContact CD1-CZ 3.88Å; F21-F76 AromaticContact CD2-CD2 3.53Å; F21-F76 HydrophobicContact CD2-CD2 3.53Å; F21-F76 AromaticContact CD2-CE2 3.16Å; F21-F76 HydrophobicContact CD2-CE2 3.16Å; F21-F76 HydrophobicContact CD2-CG 4.42Å; F21-F76 AromaticContact CD2-CZ 3.8Å; F21-F76 HydrophobicContact CD2-CZ 3.8Å; F21-F76 HydrophobicContact CE2-CD2 4.3Å; F21-F76 AromaticContact CE2-CE2 3.75Å; F21-F76 HydrophobicContact CE2-CE2 3.75Å; F21-F76 AromaticContact CG-CD2 3.94Å; F21-F76 HydrophobicContact CG-CD2 3.94Å; F21-F76 HydrophobicContact CG-CE1 4.09Å; F21-F76 AromaticContact CG-CE2 3.32Å; F21-F76 HydrophobicContact CG-CE2 3.32Å; F21-F76 AromaticContact CG-CZ 3.4Å; F21-F76 HydrophobicContact CG-CZ 3.4Å; F21-F76 HydrophobicContact CZ-CE2 4.38Å; F21-F76 PolarHBondContact N-O 3.37Å; F21-F76 PolarHBondContact O-N 3.47Å; F21-T78 HydrophobicContact CE2-CG2 3.82Å; F21-T78 HydrophobicContact CZ-CG2 4.46Å
22	V	96.7	Very high	89.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	160.2	-178	-59.2	0	0	0	0	111.3	L20 A24 V53 T54 T55 V56	L20-V22 HydrophobicContact CD1-CG1 4.3Å; L20-V22 HydrophobicContact CD2-CG1 3.7Å; L20-V22 HydrophobicContact CG-CG1 3.68Å; V22-A24 PolarHBondContact O-N 3.19Å; V22-V53 HydrophobicContact CG1-CG1 4.13Å; V22-V53 HydrophobicContact CG2-CG1 3.76Å; V22-T54 PolarHBondContact N-O 3.21Å; V22-T55 HydrophobicContact CG2-CG2 3.75Å; V22-T55 CarbonylContact O-C 3.53Å; V22-T55 WeakPolarHBondContact O-CA 3.28Å; V22-V56 PolarHBondContact O-N 3.37Å
23	K	94.7	Very high	91.5	Very high	75 Å²	75	48.5 Å²	48.5	33%	0.326	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	129.8	174	-176.5	176.7	175.2	-179	0	110.4	G32 C34 S37 P74	K23-G32 WeakPolarHBondContact O-CA 3.47Å; K23-G32 PolarHBondContact O-N 3.05Å; K23-C34 HydrophobicContact CB-CB 3.97Å; K23-C34 HydrophobicContact CD-CB 4.28Å; K23-S37 PolarHBondContact N-OG 3.25Å; K23-P74 HydrophobicContact CB-CG 4.1Å
24	A	95.3	Very high	93.3	Very high	9 Å²	9	41 Å²	41	7%	0.074	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-72.8	153	171.7	0	0	0	0	0	112.2	V22 S30 V56 D57	V22-A24 PolarHBondContact O-N 3.19Å; A24-S30 CarbonylContact C-O 3.5Å; A24-S30 WeakPolarHBondContact CA-O 3.49Å; A24-V56 VanDerWaalsContact CB-C 3.46Å; A24-V56 WeakPolarHBondContact CB-O 3.23Å; A24-V56 PolarHBondContact N-O 3.44Å; A24-D57 HydrophobicContact CB-CB 4.37Å
25	G	95	Very high	94.6	Very high	10 Å²	10	34.2 Å²	34.2	10%	0.103	19%	0.194	C	C	.	.			trans	-71.2	-176.3	173.3	0	0	0	0	0	112.9	D27 G28 S30 G32 E238	G25-D27 PolarHBondContact O-N 3.26Å; G25-G28 PolarHBondContact O-N 3.4Å; G25-S30 PolarHBondContact N-O 3.13Å; G25-G32 VanDerWaalsContact CA-CA 3.48Å; G25-E238 WeakPolarHBondContact CA-OE2 3.42Å
26	S	93.4	Very high	95.3	Very high	75 Å²	75	35 Å²	35	52%	0.524	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-24.6	-177.3	71.7	0	0	0	0	113.6	G28 E238	S26-G28 VanDerWaalsContact C-N 3.33Å; S26-E238 WeakPolarHBondContact CB-OE1 3.45Å; S26-E238 PolarHBondContact N-OE1 3.14Å; S26-E238 PolarHBondContact N-OE2 3.21Å; S26-E238 PolarHBondContact OG-OE1 3.29Å
27	D	92.9	Very high	95.6	Very high	86 Å²	86	34.1 Å²	34.1	46%	0.46	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.2	172.9	61.5	0.7	0	0	0	113.8	G25 E29 S30	G25-D27 PolarHBondContact O-N 3.26Å; D27-E29 VanDerWaalsContact C-N 3.32Å; D27-E29 PolarHBondContact OD1-N 2.95Å; D27-S30 VanDerWaalsContact CG-OG 3.23Å; D27-S30 WeakPolarHBondContact OD1-CB 3.45Å; D27-S30 PolarHBondContact OD1-N 3.42Å; D27-S30 PolarHBondContact OD1-OG 3.19Å; D27-S30 WeakPolarHBondContact OD2-CB 3.45Å; D27-S30 PolarHBondContact OD2-OG 3.15Å; D27-S30 VanDerWaalsContact OD2-OG 3.11Å
28	G	91.1	Very high	95.8	Very high	14 Å²	14	30.5 Å²	30.5	14%	0.144	17%	0.168	C	C	.	.	S	Bend	trans	82.3	3.9	-176.6	0	0	0	0	0	114.5	G25 S26	G25-G28 PolarHBondContact O-N 3.4Å; S26-G28 VanDerWaalsContact C-N 3.33Å
29	E	91	Very high	95.8	Very high	100 Å²	100	31 Å²	31	47%	0.467	17%	0.17	S	C	.	.	S	Bend	trans	-127.9	-37.9	-177.3	-68	-162.2	-154.6	0	0	113.9	M1 D27 T55	M1-E29 PolarHBondContact N-OE2 2.92Å; D27-E29 VanDerWaalsContact C-N 3.32Å; D27-E29 PolarHBondContact OD1-N 2.95Å; E29-T55 WeakPolarHBondContact O-CG2 3.27Å; E29-T55 PolarHBondContact O-OG1 3.45Å; E29-T55 VanDerWaalsContact O-OG1 3.1Å
30	S	94	Very high	95.9	Very high	36 Å²	36	28.3 Å²	28.3	25%	0.252	16%	0.157	S	C	.	.	S	Bend	trans	-75.4	170.7	-178.6	62.3	0	0	0	0	112.2	A24 G25 D27 G32	A24-S30 CarbonylContact C-O 3.5Å; A24-S30 WeakPolarHBondContact CA-O 3.49Å; G25-S30 PolarHBondContact N-O 3.13Å; D27-S30 VanDerWaalsContact CG-OG 3.23Å; D27-S30 WeakPolarHBondContact OD1-CB 3.45Å; D27-S30 PolarHBondContact OD1-N 3.42Å; D27-S30 PolarHBondContact OD1-OG 3.19Å; D27-S30 WeakPolarHBondContact OD2-CB 3.45Å; D27-S30 PolarHBondContact OD2-OG 3.15Å; D27-S30 VanDerWaalsContact OD2-OG 3.11Å; S30-G32 PolarHBondContact O-N 2.88Å
31	I	95.2	Very high	95.9	Very high	25 Å²	25	28.9 Å²	28.9	13%	0.128	16%	0.16	C	C	.	.	B	Isolated β-bridge	trans	-69.1	121.3	171.9	-60.9	172.6	0	0	0	108.6	F41 P234	I31-F41 HydrophobicContact CD1-CD1 4.44Å; I31-F41 HydrophobicContact CD1-CE1 3.83Å; I31-P234 HydrophobicContact CG2-CB 4.31Å; I31-P234 WeakPolarHBondContact O-CB 3.31Å
32	G	96.1	Very high	96	Very high	3 Å²	3	28.8 Å²	28.8	3%	0.031	16%	0.159	C	C	.	.	P	Polyproline II helix	trans	-89.9	164.8	178.8	0	0	0	0	0	113.6	K23 G25 S30 C34	K23-G32 WeakPolarHBondContact O-CA 3.47Å; K23-G32 PolarHBondContact O-N 3.05Å; G25-G32 VanDerWaalsContact CA-CA 3.48Å; S30-G32 PolarHBondContact O-N 2.88Å; G32-C34 PolarHBondContact O-N 2.99Å
33	N	96.6	Very high	96.1	Very high	17 Å²	17	28.7 Å²	28.7	9%	0.091	16%	0.159	C	C	.	.	S	Bend	trans	-63.3	105.6	175	174.6	49.3	0	0	0	112	I196 I239 A242 Y243	N33-I196 WeakPolarHBondContact OD1-CD1 3.22Å; N33-I239 HydrophobicContact CB-CG1 4.5Å; N33-A242 HydrophobicContact CB-CB 3.58Å; N33-A242 VanDerWaalsContact ND2-CB 3.31Å; N33-A242 WeakPolarHBondContact ND2-CB 3.36Å; N33-Y243 WeakPolarHBondContact ND2-CE2 3.43Å
34	C	97.2	Very high	96.3	Very high	16 Å²	16	25.1 Å²	25.1	11%	0.108	14%	0.143	C	C	.	.			trans	-157.3	105.8	169.7	-177.5	0	0	0	0	110.1	K23 G32 F36 S37 Q38	K23-C34 HydrophobicContact CB-CB 3.97Å; K23-C34 HydrophobicContact CD-CB 4.28Å; G32-C34 PolarHBondContact O-N 2.99Å; C34-F36 PolarHBondContact O-N 3.02Å; C34-F36 VanDerWaalsContact O-N 3.17Å; C34-S37 WeakPolarHBondContact CB-OG 3.34Å; C34-S37 PolarHBondContact O-N 2.82Å; C34-S37 VanDerWaalsContact O-N 3.08Å; C34-S37 PolarHBondContact SG-N 2.99Å; C34-S37 VanDerWaalsContact SG-N 3.42Å; C34-S37 PolarHBondContact SG-OG 2.99Å; C34-Q38 PolarHBondContact O-N 2.84Å; C34-Q38 VanDerWaalsContact O-N 3.12Å
35	P	97.6	Very high	96.4	Very high	14 Å²	14	27.6 Å²	27.6	9%	0.091	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-26.5	-177.8	23.9	-31.6	0	0	0	112.6	R39 F121 P192 K193 I196	P35-R39 WeakPolarHBondContact O-CB 3.46Å; P35-R39 PolarHBondContact O-N 2.72Å; P35-F121 HydrophobicContact CG-CZ 4.2Å; P35-P192 HydrophobicContact CB-CB 3.73Å; P35-K193 HydrophobicContact CB-CG 3.94Å; P35-K193 HydrophobicContact CG-CG 4.43Å; P35-I196 HydrophobicContact CB-CD1 3.76Å; P35-I196 HydrophobicContact CG-CD1 3.78Å
36	F	97.8	Very high	96.5	Very high	89 Å²	89	28.1 Å²	28.1	39%	0.39	15%	0.151	S	C	.	.	H	α-helix	trans	-73.2	-36.6	176.1	-53.2	-66.7	0	0	0	112.9	C34 R39 L40 P75 V87	C34-F36 PolarHBondContact O-N 3.02Å; C34-F36 VanDerWaalsContact O-N 3.17Å; F36-R39 PolarHBondContact O-N 2.91Å; F36-L40 PolarHBondContact O-N 3.08Å; F36-P75 HydrophobicContact CB-CG 3.82Å; F36-V87 HydrophobicContact CB-CG1 4.31Å; F36-V87 HydrophobicContact CB-CG2 3.7Å; F36-V87 HydrophobicContact CD1-CG1 4.37Å; F36-V87 HydrophobicContact CD1-CG2 4.37Å; F36-V87 HydrophobicContact CG-CG2 4.22Å
37	S	97.9	Very high	96.7	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.014	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-46.3	174.9	-63.8	0	0	0	0	109.9	K23 C34 R39 L40 F41	K23-S37 PolarHBondContact N-OG 3.25Å; C34-S37 WeakPolarHBondContact CB-OG 3.34Å; C34-S37 PolarHBondContact O-N 2.82Å; C34-S37 VanDerWaalsContact O-N 3.08Å; C34-S37 PolarHBondContact SG-N 2.99Å; C34-S37 VanDerWaalsContact SG-N 3.42Å; C34-S37 PolarHBondContact SG-OG 2.99Å; S37-R39 VanDerWaalsContact C-N 3.35Å; S37-R39 PolarHBondContact O-N 3.33Å; S37-L40 PolarHBondContact O-N 3.42Å; S37-F41 PolarHBondContact O-N 3.25Å
38	Q	98.5	Very high	96.9	Very high	7 Å²	7	23.9 Å²	23.9	3%	0.033	14%	0.138	C	C	.	.	H	α-helix	trans	-61.3	-42	177.1	-171.4	176.2	6	0	0	111.8	C34 L40 F41 M42 P192 F229 T232 C233	C34-Q38 PolarHBondContact O-N 2.84Å; C34-Q38 VanDerWaalsContact O-N 3.12Å; Q38-L40 PolarHBondContact O-N 3.1Å; Q38-F41 WeakPolarHBondContact O-CB 3.36Å; Q38-F41 PolarHBondContact O-N 2.98Å; Q38-M42 HydrophobicContact CG-CG 4.32Å; Q38-M42 HydrophobicContact CG-SD 4.24Å; Q38-M42 VanDerWaalsContact O-CG 3.3Å; Q38-M42 WeakPolarHBondContact O-CG 3.38Å; Q38-M42 PolarHBondContact O-N 3.39Å; Q38-P192 HydrophobicContact CB-CB 3.98Å; Q38-P192 HydrophobicContact CB-CG 3.93Å; Q38-P192 HydrophobicContact CG-CB 4.15Å; Q38-P192 HydrophobicContact CG-CG 3.79Å; Q38-F229 PolarHBondContact NE2-O 3.34Å; Q38-T232 WeakPolarHBondContact CG-O 3.41Å; Q38-T232 WeakPolarHBondContact CG-OG1 3.43Å; Q38-T232 PolarHBondContact NE2-OG1 3Å; Q38-C233 PolarHBondContact NE2-SG 3.35Å
39	R	98.6	Very high	97.1	Very high	14 Å²	14	23.8 Å²	23.8	5%	0.053	13%	0.134	C	C	.	.	H	α-helix	trans	-52.2	-53.1	174.9	176.2	-178.6	-176.3	-173.6	4.4	112.2	P35 F36 S37 F41 M42 I43 N88 E91 C188	P35-R39 WeakPolarHBondContact O-CB 3.46Å; P35-R39 PolarHBondContact O-N 2.72Å; F36-R39 PolarHBondContact O-N 2.91Å; S37-R39 VanDerWaalsContact C-N 3.35Å; S37-R39 PolarHBondContact O-N 3.33Å; R39-F41 VanDerWaalsContact C-N 3.32Å; R39-F41 PolarHBondContact O-N 3.17Å; R39-M42 PolarHBondContact O-N 3.3Å; R39-I43 HydrophobicContact CG-CD1 3.92Å; R39-I43 WeakPolarHBondContact O-CD1 3.2Å; R39-I43 VanDerWaalsContact O-CG1 3.26Å; R39-I43 WeakPolarHBondContact O-CG1 3.48Å; R39-I43 PolarHBondContact O-N 3.33Å; R39-I43 VanDerWaalsContact O-N 3.08Å; R39-N88 PolarHBondContact NH1-OD1 3.36Å; R39-E91 IonicContact CZ-OE1 3.89Å; R39-E91 IonicContact CZ-OE2 3.16Å; R39-E91 IonicContact NE-OE2 2.77Å; R39-E91 PolarHBondContact NE-OE2 3.18Å; R39-E91 IonicContact NH2-OE1 3.37Å; R39-E91 PolarHBondContact NH2-OE1 3.17Å; R39-E91 IonicContact NH2-OE2 2.78Å; R39-E91 PolarHBondContact NH2-OE2 3.12Å; R39-C188 WeakPolarHBondContact CA-O 3.39Å; R39-C188 VanDerWaalsContact CB-O 3.3Å; R39-C188 WeakPolarHBondContact CB-O 3.4Å; R39-C188 HydrophobicContact CG-CB 4.19Å; R39-C188 WeakPolarHBondContact CG-O 3.24Å
40	L	98.7	Very high	97.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.9	-34.5	-179.6	-65	-175.4	0	0	0	112.4	L20 F36 S37 Q38 I43 L44 P75 V87 I90	L20-L40 HydrophobicContact CD1-CB 3.86Å; L20-L40 HydrophobicContact CD1-CD1 4.24Å; F36-L40 PolarHBondContact O-N 3.08Å; S37-L40 PolarHBondContact O-N 3.42Å; Q38-L40 PolarHBondContact O-N 3.1Å; L40-I43 HydrophobicContact CD2-CD1 4.22Å; L40-I43 PolarHBondContact O-N 3.14Å; L40-L44 PolarHBondContact O-N 3.14Å; L40-L44 VanDerWaalsContact O-N 3.08Å; L40-P75 HydrophobicContact CD1-CB 4.05Å; L40-P75 HydrophobicContact CD1-CG 4.17Å; L40-V87 HydrophobicContact CD2-CG1 4.18Å; L40-V87 HydrophobicContact CG-CG1 4.26Å; L40-I90 HydrophobicContact CD1-CB 4.24Å; L40-I90 HydrophobicContact CD1-CD1 3.83Å; L40-I90 HydrophobicContact CD1-CG2 3.89Å; L40-I90 HydrophobicContact CD2-CB 4.2Å; L40-I90 HydrophobicContact CD2-CG2 3.82Å; L40-I90 HydrophobicContact CG-CG2 4.49Å
41	F	98.6	Very high	97.5	Very high	11 Å²	11	21.8 Å²	21.8	5%	0.048	13%	0.126	C	C	.	.	H	α-helix	trans	-62.9	-48.7	174.8	-160.3	168.4	0	0	0	110.9	L20 I31 S37 Q38 R39 I43 L44 W45 F51 V53 T232	L20-F41 HydrophobicContact CD2-CB 3.64Å; L20-F41 HydrophobicContact CD2-CD2 4.39Å; L20-F41 HydrophobicContact CD2-CG 3.97Å; I31-F41 HydrophobicContact CD1-CD1 4.44Å; I31-F41 HydrophobicContact CD1-CE1 3.83Å; S37-F41 PolarHBondContact O-N 3.25Å; Q38-F41 WeakPolarHBondContact O-CB 3.36Å; Q38-F41 PolarHBondContact O-N 2.98Å; R39-F41 VanDerWaalsContact C-N 3.32Å; R39-F41 PolarHBondContact O-N 3.17Å; F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 3.39Å; F41-L44 PolarHBondContact O-N 3.18Å; F41-W45 HydrophobicContact CD2-CE3 4.14Å; F41-W45 AromaticContact CE2-CE3 3.59Å; F41-W45 HydrophobicContact CE2-CE3 3.59Å; F41-W45 AromaticContact CE2-CZ3 3.89Å; F41-W45 HydrophobicContact CE2-CZ3 3.89Å; F41-W45 HydrophobicContact CZ-CE3 4.24Å; F41-W45 HydrophobicContact CZ-CZ3 4.09Å; F41-W45 WeakPolarHBondContact O-CB 3.41Å; F41-W45 PolarHBondContact O-N 3.33Å; F41-F51 AromaticContact CD2-CE2 3.54Å; F41-F51 HydrophobicContact CD2-CE2 3.54Å; F41-F51 AromaticContact CD2-CZ 3.52Å; F41-F51 HydrophobicContact CD2-CZ 3.52Å; F41-F51 AromaticContact CE2-CE2 3.56Å; F41-F51 HydrophobicContact CE2-CE2 3.56Å; F41-F51 AromaticContact CE2-CZ 3.48Å; F41-F51 HydrophobicContact CE2-CZ 3.48Å; F41-F51 VanDerWaalsContact CE2-CZ 3.48Å; F41-V53 HydrophobicContact CD1-CG2 4.49Å; F41-V53 HydrophobicContact CD2-CG2 4.24Å; F41-V53 HydrophobicContact CE1-CG1 4.27Å; F41-V53 HydrophobicContact CE1-CG2 4.04Å; F41-V53 HydrophobicContact CE2-CG2 3.78Å; F41-V53 HydrophobicContact CZ-CG2 3.68Å; F41-T232 HydrophobicContact CB-CG2 3.98Å; F41-T232 HydrophobicContact CD1-CG2 3.71Å; F41-T232 HydrophobicContact CD2-CG2 3.66Å; F41-T232 HydrophobicContact CE1-CG2 4.03Å; F41-T232 HydrophobicContact CE2-CG2 3.98Å; F41-T232 HydrophobicContact CG-CG2 3.5Å; F41-T232 HydrophobicContact CZ-CG2 4.14Å
42	M	98.7	Very high	97.5	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-56.7	-43.6	175.7	-68.6	177.4	70.4	0	0	111.9	Q38 R39 W45 L46 M183 C188 L191 P192 E228 F229 T232	Q38-M42 HydrophobicContact CG-CG 4.32Å; Q38-M42 HydrophobicContact CG-SD 4.24Å; Q38-M42 VanDerWaalsContact O-CG 3.3Å; Q38-M42 WeakPolarHBondContact O-CG 3.38Å; Q38-M42 PolarHBondContact O-N 3.39Å; R39-M42 PolarHBondContact O-N 3.3Å; M42-W45 PolarHBondContact O-N 3.02Å; M42-L46 WeakPolarHBondContact O-CB 3.22Å; M42-L46 WeakPolarHBondContact O-CG 3.37Å; M42-L46 PolarHBondContact O-N 2.81Å; M42-M183 HydrophobicContact CE-SD 4.07Å; M42-C188 HydrophobicContact CB-CB 4.17Å; M42-L191 HydrophobicContact CE-CB 4.49Å; M42-L191 HydrophobicContact CE-CD1 3.97Å; M42-P192 HydrophobicContact SD-CG 3.86Å; M42-E228 WeakPolarHBondContact CG-O 3.36Å; M42-F229 HydrophobicContact CE-CB 4.02Å; M42-F229 HydrophobicContact CE-CD2 3.84Å; M42-F229 HydrophobicContact CE-CG 4.37Å; M42-F229 HydrophobicContact SD-CD2 3.83Å; M42-T232 HydrophobicContact CG-CG2 4.45Å; M42-T232 WeakPolarHBondContact CG-OG1 3.49Å
43	I	98.7	Very high	97.6	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-51.1	179.9	-68.6	162.5	0	0	0	111.1	R39 L40 F41 W45 L46 K47 E91 L94 L106 L185 C188	R39-I43 HydrophobicContact CG-CD1 3.92Å; R39-I43 WeakPolarHBondContact O-CD1 3.2Å; R39-I43 VanDerWaalsContact O-CG1 3.26Å; R39-I43 WeakPolarHBondContact O-CG1 3.48Å; R39-I43 PolarHBondContact O-N 3.33Å; R39-I43 VanDerWaalsContact O-N 3.08Å; L40-I43 HydrophobicContact CD2-CD1 4.22Å; L40-I43 PolarHBondContact O-N 3.14Å; F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 3.39Å; I43-W45 VanDerWaalsContact C-N 3.27Å; I43-W45 PolarHBondContact O-N 3.23Å; I43-L46 PolarHBondContact O-N 2.75Å; I43-K47 HydrophobicContact CG2-CG 4.45Å; I43-K47 WeakPolarHBondContact O-CB 3.32Å; I43-K47 VanDerWaalsContact O-CG 3.26Å; I43-K47 WeakPolarHBondContact O-CG 3.39Å; I43-K47 PolarHBondContact O-N 3.32Å; I43-E91 HydrophobicContact CD1-CB 4.2Å; I43-E91 HydrophobicContact CD1-CG 3.89Å; I43-E91 WeakPolarHBondContact CD1-OE2 3.37Å; I43-L94 HydrophobicContact CG2-CB 4.48Å; I43-L94 HydrophobicContact CG2-CD1 4.24Å; I43-L106 HydrophobicContact CG2-CD1 4.31Å; I43-L185 HydrophobicContact CD1-CD2 3.93Å; I43-L185 HydrophobicContact CG1-CD2 3.77Å; I43-L185 HydrophobicContact CG2-CD2 4.2Å; I43-C188 HydrophobicContact CD1-CB 4.32Å; I43-C188 HydrophobicContact CG1-CB 3.84Å
44	L	98.5	Very high	97.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.1	-37.3	179.1	-71.9	171.2	0	0	0	111.9	I18 L20 L40 F41 K47 G48 V49 F51 L94 L98	I18-L44 HydrophobicContact CD1-CD2 4.13Å; I18-L44 HydrophobicContact CG2-CD1 4.06Å; I18-L44 HydrophobicContact CG2-CD2 3.99Å; L20-L44 HydrophobicContact CB-CD1 3.95Å; L20-L44 HydrophobicContact CD2-CD1 4.25Å; L20-L44 HydrophobicContact CG-CD1 4.49Å; L40-L44 PolarHBondContact O-N 3.14Å; L40-L44 VanDerWaalsContact O-N 3.08Å; F41-L44 PolarHBondContact O-N 3.18Å; L44-K47 PolarHBondContact O-N 3.42Å; L44-G48 PolarHBondContact O-N 3.29Å; L44-V49 HydrophobicContact CB-CG1 4.43Å; L44-V49 HydrophobicContact CD2-CG1 3.85Å; L44-F51 HydrophobicContact CB-CD1 3.73Å; L44-F51 HydrophobicContact CB-CD2 4.16Å; L44-F51 HydrophobicContact CB-CE1 3.58Å; L44-F51 HydrophobicContact CB-CE2 4Å; L44-F51 HydrophobicContact CB-CG 4.03Å; L44-F51 HydrophobicContact CB-CZ 3.71Å; L44-F51 HydrophobicContact CD1-CB 4.43Å; L44-F51 HydrophobicContact CD1-CD2 3.78Å; L44-F51 HydrophobicContact CD1-CE2 4.13Å; L44-F51 HydrophobicContact CD1-CG 4.02Å; L44-L94 HydrophobicContact CD2-CD1 3.8Å; L44-L94 HydrophobicContact CD2-CD2 3.82Å; L44-L94 HydrophobicContact CD2-CG 4.45Å; L44-L94 HydrophobicContact CG-CD1 4.09Å; L44-L98 HydrophobicContact CD2-CD1 4.28Å
45	W	98.3	Very high	97.3	Very high	60 Å²	60	29 Å²	29	23%	0.227	17%	0.167	C	C	.	.	H	α-helix	trans	-64	-50.6	175.5	-159.1	-48.2	0	0	0	111.7	F41 M42 I43 K47 G48 E227 E228 N231 T232	F41-W45 HydrophobicContact CD2-CE3 4.14Å; F41-W45 AromaticContact CE2-CE3 3.59Å; F41-W45 HydrophobicContact CE2-CE3 3.59Å; F41-W45 AromaticContact CE2-CZ3 3.89Å; F41-W45 HydrophobicContact CE2-CZ3 3.89Å; F41-W45 HydrophobicContact CZ-CE3 4.24Å; F41-W45 HydrophobicContact CZ-CZ3 4.09Å; F41-W45 WeakPolarHBondContact O-CB 3.41Å; F41-W45 PolarHBondContact O-N 3.33Å; M42-W45 PolarHBondContact O-N 3.02Å; I43-W45 VanDerWaalsContact C-N 3.27Å; I43-W45 PolarHBondContact O-N 3.23Å; W45-K47 VanDerWaalsContact C-N 3.26Å; W45-K47 PolarHBondContact O-N 3.3Å; W45-G48 PolarHBondContact O-N 3.1Å; W45-E227 HydrophobicContact CZ2-CB 4.5Å; W45-E228 HydrophobicContact CB-CB 4.5Å; W45-E228 HydrophobicContact CB-CG 4.44Å; W45-E228 HydrophobicContact CG-CB 4.27Å; W45-E228 HydrophobicContact CG-CG 3.97Å; W45-N231 HydrophobicContact CH2-CB 3.6Å; W45-N231 HydrophobicContact CZ3-CB 3.82Å; W45-T232 HydrophobicContact CE3-CG2 3.79Å; W45-T232 HydrophobicContact CZ3-CG2 4.14Å
46	L	98.2	Very high	97.1	Very high	22 Å²	22	28.4 Å²	28.4	12%	0.115	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-30.1	179.2	-74.2	168.3	0	0	0	112.7	M42 I43 G48 V104 L106 M183 C188 E228	M42-L46 WeakPolarHBondContact O-CB 3.22Å; M42-L46 WeakPolarHBondContact O-CG 3.37Å; M42-L46 PolarHBondContact O-N 2.81Å; I43-L46 PolarHBondContact O-N 2.75Å; L46-G48 PolarHBondContact O-N 2.94Å; L46-V104 VanDerWaalsContact O-CG1 3.32Å; L46-V104 WeakPolarHBondContact O-CG1 3.32Å; L46-L106 HydrophobicContact CB-CD1 3.72Å; L46-L106 HydrophobicContact CB-CD2 3.96Å; L46-M183 HydrophobicContact CD1-CB 3.79Å; L46-M183 HydrophobicContact CD1-SD 4.45Å; L46-M183 HydrophobicContact CD2-CB 4.14Å; L46-C188 WeakPolarHBondContact CD1-SG 3.44Å; L46-E228 HydrophobicContact CD2-CB 4.18Å; L46-E228 HydrophobicContact CD2-CG 3.74Å; L46-E228 HydrophobicContact CG-CB 4.24Å; L46-E228 HydrophobicContact CG-CG 4.12Å
47	K	97.4	Very high	96.7	Very high	6 Å²	6	25.3 Å²	25.3	3%	0.026	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.5	171.9	-74	-67.6	-175.9	179.4	0	112.9	I43 L44 W45 V49 E95 L98 Y103 V104 L106	I43-K47 HydrophobicContact CG2-CG 4.45Å; I43-K47 WeakPolarHBondContact O-CB 3.32Å; I43-K47 VanDerWaalsContact O-CG 3.26Å; I43-K47 WeakPolarHBondContact O-CG 3.39Å; I43-K47 PolarHBondContact O-N 3.32Å; L44-K47 PolarHBondContact O-N 3.42Å; W45-K47 VanDerWaalsContact C-N 3.26Å; W45-K47 PolarHBondContact O-N 3.3Å; K47-V49 HydrophobicContact CB-CG1 4.33Å; K47-V49 PolarHBondContact O-N 2.85Å; K47-E95 WeakPolarHBondContact CE-OE2 3.33Å; K47-E95 IonicContact NZ-OE2 3.81Å; K47-E95 PolarHBondContact NZ-OE2 3Å; K47-L98 HydrophobicContact CB-CD1 4.17Å; K47-L98 HydrophobicContact CD-CB 3.88Å; K47-L98 WeakPolarHBondContact CE-O 3.5Å; K47-L98 HydrophobicContact CG-CB 4.31Å; K47-L98 HydrophobicContact CG-CD1 4.07Å; K47-L98 PolarHBondContact NZ-O 3.37Å; K47-Y103 WeakPolarHBondContact O-CD1 3.38Å; K47-V104 WeakPolarHBondContact CD-O 3.31Å; K47-V104 PolarHBondContact NZ-O 3.12Å; K47-L106 HydrophobicContact CD-CD1 4.03Å; K47-L106 HydrophobicContact CD-CG 4.33Å; K47-L106 HydrophobicContact CG-CD1 3.97Å
48	G	95.8	Very high	96.1	Very high	65 Å²	65	29 Å²	29	67%	0.67	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	21.8	-177.7	0	0	0	0	0	113.4	L44 W45 L46	L44-G48 PolarHBondContact O-N 3.29Å; W45-G48 PolarHBondContact O-N 3.1Å; L46-G48 PolarHBondContact O-N 2.94Å
49	V	95.6	Very high	95.4	Very high	13 Å²	13	37.7 Å²	37.7	8%	0.079	21%	0.208	C	C	.	.			trans	-83.9	151.4	175.9	68.8	0	0	0	0	109.9	P16 I18 L44 K47 F51 L98 Y103	P16-V49 HydrophobicContact CG-CG2 4.21Å; I18-V49 HydrophobicContact CD1-CB 4.45Å; I18-V49 HydrophobicContact CD1-CG1 3.92Å; I18-V49 HydrophobicContact CD1-CG2 3.71Å; L44-V49 HydrophobicContact CB-CG1 4.43Å; L44-V49 HydrophobicContact CD2-CG1 3.85Å; K47-V49 HydrophobicContact CB-CG1 4.33Å; K47-V49 PolarHBondContact O-N 2.85Å; V49-F51 HydrophobicContact CG1-CD1 4.26Å; V49-F51 WeakPolarHBondContact O-CD1 3.36Å; V49-L98 HydrophobicContact CB-CD1 4.31Å; V49-L98 HydrophobicContact CG1-CD1 3.94Å; V49-L98 HydrophobicContact CG2-CD2 4.4Å; V49-Y103 HydrophobicContact CB-CE1 4.05Å; V49-Y103 HydrophobicContact CG2-CE1 4.14Å
50	V	95.6	Very high	94.6	Very high	78 Å²	78	45.1 Å²	45.1	47%	0.473	24%	0.236	S	C	.	.			trans	-79.2	127.1	170.6	-179.1	0	0	0	0	109
51	F	97.3	Very high	93.5	Very high	16 Å²	16	47.1 Å²	47.1	7%	0.07	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	158.7	177	66.2	-77.6	0	0	0	110.8	I18 L20 F41 L44 V49 V53	I18-F51 HydrophobicContact CB-CB 3.83Å; I18-F51 HydrophobicContact CG2-CB 3.98Å; I18-F51 VanDerWaalsContact O-CA 3.3Å; I18-F51 WeakPolarHBondContact O-CA 3.28Å; I18-F51 WeakPolarHBondContact O-CB 3.2Å; L20-F51 HydrophobicContact CB-CD2 4.34Å; F41-F51 AromaticContact CD2-CE2 3.54Å; F41-F51 HydrophobicContact CD2-CE2 3.54Å; F41-F51 AromaticContact CD2-CZ 3.52Å; F41-F51 HydrophobicContact CD2-CZ 3.52Å; F41-F51 AromaticContact CE2-CE2 3.56Å; F41-F51 HydrophobicContact CE2-CE2 3.56Å; F41-F51 AromaticContact CE2-CZ 3.48Å; F41-F51 HydrophobicContact CE2-CZ 3.48Å; F41-F51 VanDerWaalsContact CE2-CZ 3.48Å; L44-F51 HydrophobicContact CB-CD1 3.73Å; L44-F51 HydrophobicContact CB-CD2 4.16Å; L44-F51 HydrophobicContact CB-CE1 3.58Å; L44-F51 HydrophobicContact CB-CE2 4Å; L44-F51 HydrophobicContact CB-CG 4.03Å; L44-F51 HydrophobicContact CB-CZ 3.71Å; L44-F51 HydrophobicContact CD1-CB 4.43Å; L44-F51 HydrophobicContact CD1-CD2 3.78Å; L44-F51 HydrophobicContact CD1-CE2 4.13Å; L44-F51 HydrophobicContact CD1-CG 4.02Å; V49-F51 HydrophobicContact CG1-CD1 4.26Å; V49-F51 WeakPolarHBondContact O-CD1 3.36Å; F51-V53 HydrophobicContact CD2-CG2 3.82Å; F51-V53 HydrophobicContact CE2-CG2 3.45Å; F51-V53 VanDerWaalsContact CE2-CG2 3.45Å
52	N	96.8	Very high	92.4	Very high	104 Å²	104	49.8 Å²	49.8	56%	0.556	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.1	152.7	171.6	-69.3	-32.2	0	0	0	110.6	I18 E19 L20	I18-N52 PolarHBondContact O-N 2.87Å; E19-N52 WeakPolarHBondContact CA-O 3.41Å; E19-N52 HydrophobicContact CG-CB 4.12Å; L20-N52 PolarHBondContact N-O 3.4Å
53	V	96.5	Very high	91.4	Very high	25 Å²	25	52.8 Å²	52.8	15%	0.152	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.4	173.2	-178	0	0	0	0	109.5	L20 V22 F41 F51	L20-V53 HydrophobicContact CB-CG2 4.5Å; L20-V53 HydrophobicContact CD2-CG2 4.46Å; L20-V53 CarbonylContact O-C 3.56Å; L20-V53 WeakPolarHBondContact O-CA 3.39Å; V22-V53 HydrophobicContact CG1-CG1 4.13Å; V22-V53 HydrophobicContact CG2-CG1 3.76Å; F41-V53 HydrophobicContact CD1-CG2 4.49Å; F41-V53 HydrophobicContact CD2-CG2 4.24Å; F41-V53 HydrophobicContact CE1-CG1 4.27Å; F41-V53 HydrophobicContact CE1-CG2 4.04Å; F41-V53 HydrophobicContact CE2-CG2 3.78Å; F41-V53 HydrophobicContact CZ-CG2 3.68Å; F51-V53 HydrophobicContact CD2-CG2 3.82Å; F51-V53 HydrophobicContact CE2-CG2 3.45Å; F51-V53 VanDerWaalsContact CE2-CG2 3.45Å
54	T	94.9	Very high	90.4	Very high	42 Å²	42	58.9 Å²	58.9	26%	0.258	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.9	177.2	-68.5	0	0	0	0	109.6	E19 L20 F21 V22	E19-T54 WeakPolarHBondContact OE1-CB 3.44Å; E19-T54 PolarHBondContact OE1-OG1 2.92Å; L20-T54 PolarHBondContact O-N 2.96Å; F21-T54 CarbonylContact C-O 3.3Å; F21-T54 VanDerWaalsContact CA-O 3.27Å; F21-T54 WeakPolarHBondContact CA-O 3.21Å; F21-T54 HydrophobicContact CD1-CG2 3.76Å; F21-T54 HydrophobicContact CE1-CG2 3.83Å; V22-T54 PolarHBondContact N-O 3.21Å
55	T	94.3	Very high	89.4	Confident	40 Å²	40	59.8 Å²	59.8	25%	0.245	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.6	175.8	51.7	0	0	0	0	110.4	V22 E29	V22-T55 HydrophobicContact CG2-CG2 3.75Å; V22-T55 CarbonylContact O-C 3.53Å; V22-T55 WeakPolarHBondContact O-CA 3.28Å; E29-T55 WeakPolarHBondContact O-CG2 3.27Å; E29-T55 PolarHBondContact O-OG1 3.45Å; E29-T55 VanDerWaalsContact O-OG1 3.1Å
56	V	92.8	Very high	88.4	Confident	2 Å²	2	62 Å²	62	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	110.9	-176.5	-176.5	0	0	0	0	110.4	F21 V22 A24 L58 K61 L65 P74	F21-V56 HydrophobicContact CB-CG2 3.97Å; F21-V56 HydrophobicContact CD1-CG2 4.11Å; V22-V56 PolarHBondContact O-N 3.37Å; A24-V56 VanDerWaalsContact CB-C 3.46Å; A24-V56 WeakPolarHBondContact CB-O 3.23Å; A24-V56 PolarHBondContact N-O 3.44Å; V56-L58 PolarHBondContact O-N 3.08Å; V56-K61 HydrophobicContact CG1-CG 4.46Å; V56-L65 HydrophobicContact CB-CD1 4.48Å; V56-L65 HydrophobicContact CG1-CD1 4.12Å; V56-L65 HydrophobicContact CG2-CD1 3.88Å; V56-P74 HydrophobicContact CB-CG 4.31Å
57	D	90.1	Very high	87.6	Confident	24 Å²	24	67 Å²	67	13%	0.128	36%	0.364	C	S	.	.			trans	-73.9	110.7	169	-174.4	-13.9	0	0	0	109.5	A24 K59 R60 K61	A24-D57 HydrophobicContact CB-CB 4.37Å; D57-K59 PolarHBondContact O-N 3.05Å; D57-K59 WeakPolarHBondContact OD1-CB 3.12Å; D57-K59 PolarHBondContact OD1-N 3.47Å; D57-R60 HydrophobicContact CB-CB 4.43Å; D57-R60 CarbonylContact O-C 3.54Å; D57-R60 VanDerWaalsContact O-C 3.3Å; D57-R60 PolarHBondContact O-N 3.28Å; D57-R60 PolarHBondContact OD1-N 3.5Å; D57-R60 IonicContact OD2-CZ 3.24Å; D57-R60 IonicContact OD2-NE 2.71Å; D57-R60 PolarHBondContact OD2-NE 3.3Å; D57-R60 IonicContact OD2-NH2 2.83Å; D57-R60 PolarHBondContact OD2-NH2 3.4Å; D57-K61 WeakPolarHBondContact O-CA 2.96Å; D57-K61 PolarHBondContact O-N 2.94Å
58	L	83.6	Confident	86.8	Confident	80 Å²	80	69.9 Å²	69.9	42%	0.419	38%	0.38	S	S	.	.	S	Bend	trans	-67.6	-20.8	179.6	-70.3	178.9	0	0	0	113.8	V56 P74	V56-L58 PolarHBondContact O-N 3.08Å; L58-P74 HydrophobicContact CD2-CG 4.1Å
59	K	83.6	Confident	86	Confident	190 Å²	190	66.9 Å²	66.9	83%	0.826	35%	0.349	S	S	*	.	S	Bend	trans	-85.3	-28	177.2	-61.7	178.1	-179.3	174.7	0	111.7	D57	D57-K59 PolarHBondContact O-N 3.05Å; D57-K59 WeakPolarHBondContact OD1-CB 3.12Å; D57-K59 PolarHBondContact OD1-N 3.47Å
60	R	82.1	Confident	85.2	Confident	170 Å²	170	71 Å²	71	64%	0.642	38%	0.375	S	S	*	.	S	Bend	trans	-131.2	57.5	-174.5	-66.8	176.4	-74.9	-175.5	-0.9	110.1	D57 P62	D57-R60 HydrophobicContact CB-CB 4.43Å; D57-R60 CarbonylContact O-C 3.54Å; D57-R60 VanDerWaalsContact O-C 3.3Å; D57-R60 PolarHBondContact O-N 3.28Å; D57-R60 PolarHBondContact OD1-N 3.5Å; D57-R60 IonicContact OD2-CZ 3.24Å; D57-R60 IonicContact OD2-NE 2.71Å; D57-R60 PolarHBondContact OD2-NE 3.3Å; D57-R60 IonicContact OD2-NH2 2.83Å; D57-R60 PolarHBondContact OD2-NH2 3.4Å; R60-P62 WeakPolarHBondContact O-CD 3.28Å
61	K	76.7	Confident	84.3	Confident	42 Å²	42	70.7 Å²	70.7	18%	0.183	39%	0.388	C	S	.	.			trans	-68.3	115.5	-177.7	-166.8	173	178.4	-177.7	0	109.9	V56 D57 L65 Q66 A69 T72	V56-K61 HydrophobicContact CG1-CG 4.46Å; D57-K61 WeakPolarHBondContact O-CA 2.96Å; D57-K61 PolarHBondContact O-N 2.94Å; K61-L65 WeakPolarHBondContact CE-O 3.33Å; K61-L65 HydrophobicContact CG-CB 4.12Å; K61-Q66 HydrophobicContact CB-CG 4.47Å; K61-Q66 HydrophobicContact CD-CG 3.99Å; K61-Q66 HydrophobicContact CG-CG 4.04Å; K61-Q66 PolarHBondContact O-NE2 3.18Å; K61-A69 PolarHBondContact NZ-O 3.29Å; K61-T72 PolarHBondContact NZ-O 2.82Å
62	P	75.1	Confident	83.7	Confident	66 Å²	66	71.4 Å²	71.4	43%	0.429	39%	0.394	S	S	.	.			trans	-54.9	147.7	175.6	-23.1	32.6	0	0	0	112.2	R60 D64 L65 Q66	R60-P62 WeakPolarHBondContact O-CD 3.28Å; P62-D64 VanDerWaalsContact C-N 3.27Å; P62-D64 PolarHBondContact O-N 3.42Å; P62-L65 HydrophobicContact CG-CD1 4.11Å; P62-L65 PolarHBondContact O-N 3.03Å; P62-L65 VanDerWaalsContact O-N 3.15Å; P62-Q66 PolarHBondContact O-N 3.28Å; P62-Q66 VanDerWaalsContact O-N 3.13Å
63	A	78.3	Confident	83.2	Confident	64 Å²	64	73 Å²	73	53%	0.529	40%	0.398	S	S	.	.	H	α-helix	trans	-58.5	-39.7	-180	0	0	0	0	0	112.1	L65 Q66 N67	A63-L65 VanDerWaalsContact C-N 3.29Å; A63-L65 PolarHBondContact O-N 3.49Å; A63-Q66 WeakPolarHBondContact O-CA 3.4Å; A63-Q66 WeakPolarHBondContact O-CB 3.47Å; A63-Q66 PolarHBondContact O-N 2.84Å; A63-N67 PolarHBondContact O-N 2.92Å; A63-N67 PolarHBondContact O-ND2 2.95Å
64	D	76.4	Confident	82.9	Confident	128 Å²	128	72.6 Å²	72.6	68%	0.684	40%	0.396	S	S	*	.	H	α-helix	trans	-61.2	-38.7	178.8	-59	-24.7	0	0	0	111.9	P62 N67 L68	P62-D64 VanDerWaalsContact C-N 3.27Å; P62-D64 PolarHBondContact O-N 3.42Å; D64-N67 PolarHBondContact O-N 3.41Å; D64-L68 WeakPolarHBondContact O-CB 3.42Å; D64-L68 PolarHBondContact O-N 3.41Å
65	L	78.1	Confident	83	Confident	19 Å²	19	71.2 Å²	71.2	10%	0.099	39%	0.388	C	S	.	.	H	α-helix	trans	-72	-28.1	174.7	-73.3	-179.2	0	0	0	113	F21 V56 K61 P62 A63 L68 A69	F21-L65 HydrophobicContact CD1-CD2 3.68Å; F21-L65 HydrophobicContact CE1-CD2 3.38Å; F21-L65 HydrophobicContact CZ-CD2 4.27Å; V56-L65 HydrophobicContact CB-CD1 4.48Å; V56-L65 HydrophobicContact CG1-CD1 4.12Å; V56-L65 HydrophobicContact CG2-CD1 3.88Å; K61-L65 WeakPolarHBondContact CE-O 3.33Å; K61-L65 HydrophobicContact CG-CB 4.12Å; P62-L65 HydrophobicContact CG-CD1 4.11Å; P62-L65 PolarHBondContact O-N 3.03Å; P62-L65 VanDerWaalsContact O-N 3.15Å; A63-L65 VanDerWaalsContact C-N 3.29Å; A63-L65 PolarHBondContact O-N 3.49Å; L65-L68 HydrophobicContact CD2-CD2 4.24Å; L65-A69 PolarHBondContact O-N 2.75Å
66	Q	77.4	Confident	83.1	Confident	106 Å²	106	69.3 Å²	69.3	50%	0.495	38%	0.376	S	S	.	.	H	α-helix	trans	-69.3	-38.8	171.6	-69	-175.9	27.6	0	0	111.2	K61 P62 A63 A69 P70	K61-Q66 HydrophobicContact CB-CG 4.47Å; K61-Q66 HydrophobicContact CD-CG 3.99Å; K61-Q66 HydrophobicContact CG-CG 4.04Å; K61-Q66 PolarHBondContact O-NE2 3.18Å; P62-Q66 PolarHBondContact O-N 3.28Å; P62-Q66 VanDerWaalsContact O-N 3.13Å; A63-Q66 WeakPolarHBondContact O-CA 3.4Å; A63-Q66 WeakPolarHBondContact O-CB 3.47Å; A63-Q66 PolarHBondContact O-N 2.84Å; Q66-A69 CarbonylContact O-C 3.47Å; Q66-P70 WeakPolarHBondContact O-CA 3.49Å; Q66-P70 WeakPolarHBondContact O-CD 3.39Å; Q66-P70 VanDerWaalsContact O-CG 3.25Å; Q66-P70 WeakPolarHBondContact O-CG 3.37Å; Q66-P70 VanDerWaalsContact O-N 3.12Å
67	N	80.6	Confident	83.3	Confident	127 Å²	127	69.2 Å²	69.2	68%	0.679	38%	0.376	S	S	*	.	H	α-helix	trans	-72.4	-40.3	178.2	-66.8	-27.7	0	0	0	112.1	A63 D64	A63-N67 PolarHBondContact O-N 2.92Å; A63-N67 PolarHBondContact O-ND2 2.95Å; D64-N67 PolarHBondContact O-N 3.41Å
68	L	81.8	Confident	83.6	Confident	66 Å²	66	68.6 Å²	68.6	35%	0.346	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-49.2	178.3	-178.8	65.6	0	0	0	111.5	F21 D64 L65 T78 V83	F21-L68 HydrophobicContact CE1-CD2 4.24Å; F21-L68 HydrophobicContact CE2-CD2 4.06Å; F21-L68 HydrophobicContact CZ-CD2 3.59Å; D64-L68 WeakPolarHBondContact O-CB 3.42Å; D64-L68 PolarHBondContact O-N 3.41Å; L65-L68 HydrophobicContact CD2-CD2 4.24Å; L68-T78 HydrophobicContact CD1-CG2 3.98Å; L68-T78 HydrophobicContact CD2-CG2 3.91Å; L68-T78 HydrophobicContact CG-CG2 4.24Å; L68-V83 HydrophobicContact CD1-CG2 3.98Å; L68-V83 HydrophobicContact CG-CG2 4Å; L68-V83 WeakPolarHBondContact O-CG2 3.44Å
69	A	79.3	Confident	84.2	Confident	2 Å²	2	65.8 Å²	65.8	2%	0.017	36%	0.357	C	S	.	.	S	Bend	trans	-138.3	80.4	-176.9	0	0	0	0	0	110.9	K61 L65 Q66 G71 T72 F76 V83	K61-A69 PolarHBondContact NZ-O 3.29Å; L65-A69 PolarHBondContact O-N 2.75Å; Q66-A69 CarbonylContact O-C 3.47Å; A69-G71 PolarHBondContact O-N 3.39Å; A69-T72 HydrophobicContact CB-CG2 4.38Å; A69-T72 PolarHBondContact O-N 3.18Å; A69-F76 HydrophobicContact CB-CD2 4.32Å; A69-F76 HydrophobicContact CB-CE2 3.87Å; A69-F76 HydrophobicContact CB-CZ 4Å; A69-V83 HydrophobicContact CB-CG1 4.1Å; A69-V83 HydrophobicContact CB-CG2 4.42Å
70	P	78.1	Confident	84.7	Confident	99 Å²	99	61.6 Å²	61.6	64%	0.643	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	126.2	-178.6	-19.6	29.6	0	0	0	111.5	Q66 T72	Q66-P70 WeakPolarHBondContact O-CA 3.49Å; Q66-P70 WeakPolarHBondContact O-CD 3.39Å; Q66-P70 VanDerWaalsContact O-CG 3.25Å; Q66-P70 WeakPolarHBondContact O-CG 3.37Å; Q66-P70 VanDerWaalsContact O-N 3.12Å; P70-T72 PolarHBondContact O-N 3.02Å
71	G	77.8	Confident	85.2	Confident	72 Å²	72	56.2 Å²	56.2	74%	0.742	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-1.6	179.4	0	0	0	0	0	115.6	A69	A69-G71 PolarHBondContact O-N 3.39Å
72	T	83	Confident	86	Confident	31 Å²	31	59.6 Å²	59.6	19%	0.19	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-79.2	130.3	178.8	-49.1	0	0	0	0	111.1	K61 A69 P70 F76 T85	K61-T72 PolarHBondContact NZ-O 2.82Å; A69-T72 HydrophobicContact CB-CG2 4.38Å; A69-T72 PolarHBondContact O-N 3.18Å; P70-T72 PolarHBondContact O-N 3.02Å; T72-F76 HydrophobicContact CG2-CB 3.97Å; T72-F76 HydrophobicContact CG2-CD1 3.7Å; T72-F76 HydrophobicContact CG2-CE1 4.39Å; T72-F76 HydrophobicContact CG2-CG 3.91Å; T72-T85 HydrophobicContact CG2-CG2 3.52Å
73	H	86.9	Confident	87	Confident	137 Å²	137	58.5 Å²	58.5	63%	0.634	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-93.7	144.4	170.1	-69.7	-79.5	0	0	0	110.4
74	P	91.2	Very high	87.9	Confident	18 Å²	18	57.5 Å²	57.5	12%	0.117	33%	0.333	C	S	.	.	S	Bend	trans	-64.5	149.3	172.2	29.4	-32.8	0	0	0	111.3	K23 V56 L58	K23-P74 HydrophobicContact CB-CG 4.1Å; V56-P74 HydrophobicContact CB-CG 4.31Å; L58-P74 HydrophobicContact CD2-CG 4.1Å
75	P	95.8	Very high	88.7	Confident	13 Å²	13	54.7 Å²	54.7	8%	0.084	32%	0.321	C	S	.	.	S	Bend	cis	-86.4	149.2	3.9	36.8	-38.4	0	0	0	114.1	F21 F36 L40 V87	F21-P75 VanDerWaalsContact O-CA 3.25Å; F21-P75 WeakPolarHBondContact O-CA 3.48Å; F36-P75 HydrophobicContact CB-CG 3.82Å; L40-P75 HydrophobicContact CD1-CB 4.05Å; L40-P75 HydrophobicContact CD1-CG 4.17Å; P75-V87 HydrophobicContact CG-CG2 3.6Å
76	F	96.4	Very high	89.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	166.7	167.8	63.6	-89.1	0	0	0	109.1	F21 A69 T72 V83 K84 T85	F21-F76 HydrophobicContact CB-CD1 3.91Å; F21-F76 HydrophobicContact CB-CD2 3.97Å; F21-F76 HydrophobicContact CB-CE1 3.58Å; F21-F76 HydrophobicContact CB-CE2 3.66Å; F21-F76 HydrophobicContact CB-CG 4.09Å; F21-F76 HydrophobicContact CB-CZ 3.44Å; F21-F76 VanDerWaalsContact CB-CZ 3.44Å; F21-F76 HydrophobicContact CD1-CE2 4.04Å; F21-F76 AromaticContact CD1-CZ 3.88Å; F21-F76 HydrophobicContact CD1-CZ 3.88Å; F21-F76 AromaticContact CD2-CD2 3.53Å; F21-F76 HydrophobicContact CD2-CD2 3.53Å; F21-F76 AromaticContact CD2-CE2 3.16Å; F21-F76 HydrophobicContact CD2-CE2 3.16Å; F21-F76 HydrophobicContact CD2-CG 4.42Å; F21-F76 AromaticContact CD2-CZ 3.8Å; F21-F76 HydrophobicContact CD2-CZ 3.8Å; F21-F76 HydrophobicContact CE2-CD2 4.3Å; F21-F76 AromaticContact CE2-CE2 3.75Å; F21-F76 HydrophobicContact CE2-CE2 3.75Å; F21-F76 AromaticContact CG-CD2 3.94Å; F21-F76 HydrophobicContact CG-CD2 3.94Å; F21-F76 HydrophobicContact CG-CE1 4.09Å; F21-F76 AromaticContact CG-CE2 3.32Å; F21-F76 HydrophobicContact CG-CE2 3.32Å; F21-F76 AromaticContact CG-CZ 3.4Å; F21-F76 HydrophobicContact CG-CZ 3.4Å; F21-F76 HydrophobicContact CZ-CE2 4.38Å; F21-F76 PolarHBondContact N-O 3.37Å; F21-F76 PolarHBondContact O-N 3.47Å; A69-F76 HydrophobicContact CB-CD2 4.32Å; A69-F76 HydrophobicContact CB-CE2 3.87Å; A69-F76 HydrophobicContact CB-CZ 4Å; T72-F76 HydrophobicContact CG2-CB 3.97Å; T72-F76 HydrophobicContact CG2-CD1 3.7Å; T72-F76 HydrophobicContact CG2-CE1 4.39Å; T72-F76 HydrophobicContact CG2-CG 3.91Å; F76-V83 HydrophobicContact CD2-CG1 4.19Å; F76-K84 WeakPolarHBondContact CB-O 3.49Å; F76-T85 HydrophobicContact CB-CG2 4.38Å
77	I	97.2	Very high	90.5	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	157.4	174.5	66.3	167	0	0	0	110.6	E19 L20 F79 V83 K84 I90 F93 L94	E19-I77 CarbonylContact O-C 3.51Å; E19-I77 WeakPolarHBondContact O-CA 3.21Å; L20-I77 HydrophobicContact CB-CG2 4.39Å; L20-I77 HydrophobicContact CD1-CG2 3.6Å; I77-F79 HydrophobicContact CD1-CB 4.39Å; I77-V83 WeakPolarHBondContact O-CA 3.41Å; I77-K84 HydrophobicContact CD1-CB 4.32Å; I77-K84 HydrophobicContact CD1-CG 4.4Å; I77-K84 HydrophobicContact CG1-CB 3.74Å; I77-K84 HydrophobicContact CG1-CG 4.19Å; I77-K84 PolarHBondContact N-O 3.34Å; I77-K84 VanDerWaalsContact N-O 3.09Å; I77-K84 PolarHBondContact O-N 3.49Å; I77-I90 HydrophobicContact CD1-CG2 3.69Å; I77-I90 HydrophobicContact CG1-CG1 4.35Å; I77-I90 HydrophobicContact CG1-CG2 3.92Å; I77-I90 HydrophobicContact CG2-CG2 4.11Å; I77-F93 HydrophobicContact CD1-CD1 4.48Å; I77-L94 HydrophobicContact CD1-CD1 4.48Å; I77-L94 HydrophobicContact CD1-CD2 3.95Å; I77-L94 HydrophobicContact CD1-CG 4.29Å
78	T	96.6	Very high	91.2	Very high	10 Å²	10	51.6 Å²	51.6	6%	0.061	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	137.4	152.1	56.2	0	0	0	0	109	I18 E19 F21 L68 E82 V83	I18-T78 WeakPolarHBondContact CA-O 3.27Å; E19-T78 WeakPolarHBondContact CB-OG1 3.49Å; E19-T78 PolarHBondContact N-O 3.16Å; E19-T78 VanDerWaalsContact N-O 3.1Å; E19-T78 PolarHBondContact O-N 2.77Å; F21-T78 HydrophobicContact CE2-CG2 3.82Å; F21-T78 HydrophobicContact CZ-CG2 4.46Å; L68-T78 HydrophobicContact CD1-CG2 3.98Å; L68-T78 HydrophobicContact CD2-CG2 3.91Å; L68-T78 HydrophobicContact CG-CG2 4.24Å; T78-E82 CarbonylContact C-O 3.51Å; T78-E82 VanDerWaalsContact CA-O 3.29Å; T78-E82 WeakPolarHBondContact CA-O 3.38Å; T78-V83 HydrophobicContact CG2-CG2 3.9Å
79	F	96.4	Very high	92	Very high	21 Å²	21	54.9 Å²	54.9	9%	0.092	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	111.9	173.5	-169.7	-81.4	0	0	0	107.9	P16 I18 I77 G81 E82 F93 V97 L98	P16-F79 HydrophobicContact CB-CD2 4.48Å; P16-F79 HydrophobicContact CB-CE1 3.92Å; P16-F79 HydrophobicContact CB-CE2 3.68Å; P16-F79 HydrophobicContact CB-CZ 3.33Å; P16-F79 HydrophobicContact CG-CE2 4.2Å; P16-F79 HydrophobicContact CG-CZ 4.04Å; I18-F79 HydrophobicContact CD1-CD2 3.92Å; I18-F79 HydrophobicContact CD1-CE2 3.71Å; I18-F79 HydrophobicContact CG1-CD2 3.73Å; I18-F79 HydrophobicContact CG1-CE2 3.89Å; I77-F79 HydrophobicContact CD1-CB 4.39Å; F79-G81 PolarHBondContact O-N 2.96Å; F79-E82 PolarHBondContact N-O 3.33Å; F79-E82 WeakPolarHBondContact O-CB 3.39Å; F79-E82 PolarHBondContact O-N 3.02Å; F79-F93 HydrophobicContact CB-CE1 3.91Å; F79-F93 HydrophobicContact CB-CZ 4.22Å; F79-F93 HydrophobicContact CD1-CE1 4.11Å; F79-F93 AromaticContact CD1-CZ 3.79Å; F79-F93 HydrophobicContact CD1-CZ 3.79Å; F79-F93 AromaticContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CZ 4.18Å; F79-F93 HydrophobicContact CE1-CZ 4.16Å; F79-F93 HydrophobicContact CE2-CE1 4.17Å; F79-F93 AromaticContact CG-CE1 3.63Å; F79-F93 HydrophobicContact CG-CE1 3.63Å; F79-F93 AromaticContact CG-CZ 3.8Å; F79-F93 HydrophobicContact CG-CZ 3.8Å; F79-F93 HydrophobicContact CZ-CZ 4.5Å; F79-V97 HydrophobicContact CE1-CG1 4.11Å; F79-V97 HydrophobicContact CE2-CG1 4.19Å; F79-V97 HydrophobicContact CZ-CG1 3.51Å; F79-L98 HydrophobicContact CE2-CD2 4.38Å
80	N	94.9	Very high	92.9	Very high	102 Å²	102	54.8 Å²	54.8	55%	0.545	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	38.7	-171.5	-64.2	-24.2	0	0	0	112.9	P16 V17 E82	P16-N80 VanDerWaalsContact CA-OD1 3.31Å; P16-N80 WeakPolarHBondContact CA-OD1 3.46Å; V17-N80 PolarHBondContact N-OD1 3.46Å; V17-N80 PolarHBondContact O-N 2.6Å; N80-E82 VanDerWaalsContact C-N 3.27Å; N80-E82 PolarHBondContact O-N 3.41Å
81	G	91.6	Very high	93.9	Very high	57 Å²	57	51.2 Å²	51.2	59%	0.588	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-9.1	-178.4	0	0	0	0	0	115.2	F79	F79-G81 PolarHBondContact O-N 2.96Å
82	E	94.1	Very high	94.8	Very high	113 Å²	113	54 Å²	54	53%	0.528	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	126.1	176.1	-162.9	-165	157.6	0	0	110.9	T78 F79 N80 K84	T78-E82 CarbonylContact C-O 3.51Å; T78-E82 VanDerWaalsContact CA-O 3.29Å; T78-E82 WeakPolarHBondContact CA-O 3.38Å; F79-E82 PolarHBondContact N-O 3.33Å; F79-E82 WeakPolarHBondContact O-CB 3.39Å; F79-E82 PolarHBondContact O-N 3.02Å; N80-E82 VanDerWaalsContact C-N 3.27Å; N80-E82 PolarHBondContact O-N 3.41Å; E82-K84 IonicContact OE1-NZ 3.54Å; E82-K84 PolarHBondContact OE1-NZ 3.32Å; E82-K84 WeakPolarHBondContact OE2-CE 3.38Å; E82-K84 IonicContact OE2-NZ 3.07Å; E82-K84 PolarHBondContact OE2-NZ 3.15Å
83	V	95.5	Very high	95.6	Very high	43 Å²	43	54.9 Å²	54.9	26%	0.261	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127.8	177.6	177.5	0	0	0	0	110.5	L68 A69 F76 I77 T78 T85	L68-V83 HydrophobicContact CD1-CG2 3.98Å; L68-V83 HydrophobicContact CG-CG2 4Å; L68-V83 WeakPolarHBondContact O-CG2 3.44Å; A69-V83 HydrophobicContact CB-CG1 4.1Å; A69-V83 HydrophobicContact CB-CG2 4.42Å; F76-V83 HydrophobicContact CD2-CG1 4.19Å; I77-V83 WeakPolarHBondContact O-CA 3.41Å; T78-V83 HydrophobicContact CG2-CG2 3.9Å; V83-T85 HydrophobicContact CG1-CG2 3.95Å
84	K	96.3	Very high	96.1	Very high	43 Å²	43	48.3 Å²	48.3	19%	0.187	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.2	169.5	-52.4	-66	-176.1	-176.6	0	109.4	F76 I77 E82 I90 F93	F76-K84 WeakPolarHBondContact CB-O 3.49Å; I77-K84 HydrophobicContact CD1-CB 4.32Å; I77-K84 HydrophobicContact CD1-CG 4.4Å; I77-K84 HydrophobicContact CG1-CB 3.74Å; I77-K84 HydrophobicContact CG1-CG 4.19Å; I77-K84 PolarHBondContact N-O 3.34Å; I77-K84 VanDerWaalsContact N-O 3.09Å; I77-K84 PolarHBondContact O-N 3.49Å; E82-K84 IonicContact OE1-NZ 3.54Å; E82-K84 PolarHBondContact OE1-NZ 3.32Å; E82-K84 WeakPolarHBondContact OE2-CE 3.38Å; E82-K84 IonicContact OE2-NZ 3.07Å; E82-K84 PolarHBondContact OE2-NZ 3.15Å; K84-I90 HydrophobicContact CB-CG1 3.88Å; K84-I90 WeakPolarHBondContact O-CD1 3.5Å; K84-F93 HydrophobicContact CG-CD1 4.44Å; K84-F93 HydrophobicContact CG-CE1 4.41Å
85	T	94.7	Very high	96.4	Very high	70 Å²	70	48.9 Å²	48.9	43%	0.429	26%	0.26	S	S	.	.			trans	-122.5	170.9	179.7	66.1	0	0	0	0	110.1	T72 F76 V83	T72-T85 HydrophobicContact CG2-CG2 3.52Å; F76-T85 HydrophobicContact CB-CG2 4.38Å; V83-T85 HydrophobicContact CG1-CG2 3.95Å
86	D	95.4	Very high	96.5	Very high	81 Å²	81	54 Å²	54	43%	0.433	29%	0.286	S	S	.	.	S	Bend	trans	69.5	115.7	-171.9	-172.4	-57.6	0	0	0	112.1	N88 K89 I90	D86-N88 VanDerWaalsContact C-N 3.3Å; D86-N88 PolarHBondContact O-N 3.13Å; D86-N88 PolarHBondContact OD1-N 3.01Å; D86-K89 HydrophobicContact CB-CB 4.1Å; D86-K89 HydrophobicContact CB-CD 4.05Å; D86-K89 HydrophobicContact CB-CG 4.06Å; D86-K89 PolarHBondContact O-N 2.59Å; D86-K89 PolarHBondContact OD1-N 2.9Å; D86-K89 VanDerWaalsContact OD1-N 3.12Å; D86-I90 WeakPolarHBondContact O-CB 3.43Å; D86-I90 WeakPolarHBondContact O-CD1 3.31Å; D86-I90 WeakPolarHBondContact O-CG1 3.42Å; D86-I90 PolarHBondContact O-N 2.77Å
87	V	96.3	Very high	96.5	Very high	21 Å²	21	56.8 Å²	56.8	13%	0.127	30%	0.303	C	S	.	.	H	α-helix	trans	-60.7	-39.3	-172.4	175.9	0	0	0	0	112.1	F36 L40 P75 E91	F36-V87 HydrophobicContact CB-CG1 4.31Å; F36-V87 HydrophobicContact CB-CG2 3.7Å; F36-V87 HydrophobicContact CD1-CG1 4.37Å; F36-V87 HydrophobicContact CD1-CG2 4.37Å; F36-V87 HydrophobicContact CG-CG2 4.22Å; L40-V87 HydrophobicContact CD2-CG1 4.18Å; L40-V87 HydrophobicContact CG-CG1 4.26Å; P75-V87 HydrophobicContact CG-CG2 3.6Å; V87-E91 WeakPolarHBondContact O-CB 3.46Å; V87-E91 PolarHBondContact O-N 3.17Å
88	N	96.4	Very high	96.5	Very high	84 Å²	84	56.8 Å²	56.8	45%	0.449	30%	0.303	S	S	.	.	H	α-helix	trans	-73.7	-41.8	-177.9	-63	-38.4	0	0	0	110.1	R39 D86 I90 E91 E92	R39-N88 PolarHBondContact NH1-OD1 3.36Å; D86-N88 VanDerWaalsContact C-N 3.3Å; D86-N88 PolarHBondContact O-N 3.13Å; D86-N88 PolarHBondContact OD1-N 3.01Å; N88-I90 VanDerWaalsContact C-N 3.33Å; N88-I90 PolarHBondContact O-N 2.87Å; N88-E91 PolarHBondContact O-N 2.99Å; N88-E92 WeakPolarHBondContact O-CG 3.08Å; N88-E92 PolarHBondContact O-N 3.16Å
89	K	97.9	Very high	96.3	Very high	135 Å²	135	58.8 Å²	58.8	59%	0.587	32%	0.317	S	S	*	.	H	α-helix	trans	-64.3	-37.9	175.4	-64.4	-174.5	-179.5	179.5	0	112.6	D86 F93	D86-K89 HydrophobicContact CB-CB 4.1Å; D86-K89 HydrophobicContact CB-CD 4.05Å; D86-K89 HydrophobicContact CB-CG 4.06Å; D86-K89 PolarHBondContact O-N 2.59Å; D86-K89 PolarHBondContact OD1-N 2.9Å; D86-K89 VanDerWaalsContact OD1-N 3.12Å; K89-F93 WeakPolarHBondContact O-CB 3.47Å; K89-F93 PolarHBondContact O-N 2.84Å
90	I	98.4	Very high	96.2	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-63.8	-45.8	174.8	-67	162.2	0	0	0	110.1	L40 I77 K84 D86 N88 F93 L94	L40-I90 HydrophobicContact CD1-CB 4.24Å; L40-I90 HydrophobicContact CD1-CD1 3.83Å; L40-I90 HydrophobicContact CD1-CG2 3.89Å; L40-I90 HydrophobicContact CD2-CB 4.2Å; L40-I90 HydrophobicContact CD2-CG2 3.82Å; L40-I90 HydrophobicContact CG-CG2 4.49Å; I77-I90 HydrophobicContact CD1-CG2 3.69Å; I77-I90 HydrophobicContact CG1-CG1 4.35Å; I77-I90 HydrophobicContact CG1-CG2 3.92Å; I77-I90 HydrophobicContact CG2-CG2 4.11Å; K84-I90 HydrophobicContact CB-CG1 3.88Å; K84-I90 WeakPolarHBondContact O-CD1 3.5Å; D86-I90 WeakPolarHBondContact O-CB 3.43Å; D86-I90 WeakPolarHBondContact O-CD1 3.31Å; D86-I90 WeakPolarHBondContact O-CG1 3.42Å; D86-I90 PolarHBondContact O-N 2.77Å; N88-I90 VanDerWaalsContact C-N 3.33Å; N88-I90 PolarHBondContact O-N 2.87Å; I90-F93 PolarHBondContact O-N 3.4Å; I90-L94 HydrophobicContact CG2-CD1 3.76Å; I90-L94 HydrophobicContact CG2-CG 4.13Å; I90-L94 WeakPolarHBondContact O-CB 3.23Å; I90-L94 VanDerWaalsContact O-CG 3.25Å; I90-L94 WeakPolarHBondContact O-CG 3.29Å; I90-L94 PolarHBondContact O-N 3.42Å
91	E	98.4	Very high	96.2	Very high	23 Å²	23	63.4 Å²	63.4	11%	0.107	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-49.6	176.5	174	174.6	109.1	0	0	112	R39 I43 V87 N88 F93 L94 E95 L185	R39-E91 IonicContact CZ-OE1 3.89Å; R39-E91 IonicContact CZ-OE2 3.16Å; R39-E91 IonicContact NE-OE2 2.77Å; R39-E91 PolarHBondContact NE-OE2 3.18Å; R39-E91 IonicContact NH2-OE1 3.37Å; R39-E91 PolarHBondContact NH2-OE1 3.17Å; R39-E91 IonicContact NH2-OE2 2.78Å; R39-E91 PolarHBondContact NH2-OE2 3.12Å; I43-E91 HydrophobicContact CD1-CB 4.2Å; I43-E91 HydrophobicContact CD1-CG 3.89Å; I43-E91 WeakPolarHBondContact CD1-OE2 3.37Å; V87-E91 WeakPolarHBondContact O-CB 3.46Å; V87-E91 PolarHBondContact O-N 3.17Å; N88-E91 PolarHBondContact O-N 2.99Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.08Å; E91-L94 PolarHBondContact O-N 3Å; E91-E95 WeakPolarHBondContact O-CB 3.36Å; E91-E95 PolarHBondContact O-N 3.31Å; E91-L185 HydrophobicContact CG-CD1 3.93Å; E91-L185 HydrophobicContact CG-CD2 3.94Å; E91-L185 HydrophobicContact CG-CG 4.4Å
92	E	98.1	Very high	96.3	Very high	131 Å²	131	66.1 Å²	66.1	61%	0.612	35%	0.351	S	S	*	.	H	α-helix	trans	-56.9	-46.1	177.3	-73	169.5	-170.5	0	0	111.2	N88 E95 D96	N88-E92 WeakPolarHBondContact O-CG 3.08Å; N88-E92 PolarHBondContact O-N 3.16Å; E92-E95 PolarHBondContact O-N 3.3Å; E92-D96 WeakPolarHBondContact O-CB 3.4Å; E92-D96 PolarHBondContact O-N 3.41Å
93	F	98.4	Very high	96.4	Very high	49 Å²	49	62.1 Å²	62.1	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-61.8	-45.4	177.1	171.3	-98.2	0	0	0	112.5	I77 F79 K84 K89 I90 E91 D96 V97	I77-F93 HydrophobicContact CD1-CD1 4.48Å; F79-F93 HydrophobicContact CB-CE1 3.91Å; F79-F93 HydrophobicContact CB-CZ 4.22Å; F79-F93 HydrophobicContact CD1-CE1 4.11Å; F79-F93 AromaticContact CD1-CZ 3.79Å; F79-F93 HydrophobicContact CD1-CZ 3.79Å; F79-F93 AromaticContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CZ 4.18Å; F79-F93 HydrophobicContact CE1-CZ 4.16Å; F79-F93 HydrophobicContact CE2-CE1 4.17Å; F79-F93 AromaticContact CG-CE1 3.63Å; F79-F93 HydrophobicContact CG-CE1 3.63Å; F79-F93 AromaticContact CG-CZ 3.8Å; F79-F93 HydrophobicContact CG-CZ 3.8Å; F79-F93 HydrophobicContact CZ-CZ 4.5Å; K84-F93 HydrophobicContact CG-CD1 4.44Å; K84-F93 HydrophobicContact CG-CE1 4.41Å; K89-F93 WeakPolarHBondContact O-CB 3.47Å; K89-F93 PolarHBondContact O-N 2.84Å; I90-F93 PolarHBondContact O-N 3.4Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.08Å; F93-D96 PolarHBondContact O-N 3.42Å; F93-V97 HydrophobicContact CD2-CG2 3.85Å; F93-V97 HydrophobicContact CE1-CG2 4.47Å; F93-V97 HydrophobicContact CE2-CG2 3.53Å; F93-V97 HydrophobicContact CG-CG2 4.46Å; F93-V97 HydrophobicContact CZ-CB 4.47Å; F93-V97 HydrophobicContact CZ-CG2 3.87Å; F93-V97 WeakPolarHBondContact O-CB 3.34Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 2.98Å
94	L	98.2	Very high	96.4	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.8	-38	179.2	-71.4	175.3	0	0	0	111.7	I43 L44 I77 I90 E91 L98	I43-L94 HydrophobicContact CG2-CB 4.48Å; I43-L94 HydrophobicContact CG2-CD1 4.24Å; L44-L94 HydrophobicContact CD2-CD1 3.8Å; L44-L94 HydrophobicContact CD2-CD2 3.82Å; L44-L94 HydrophobicContact CD2-CG 4.45Å; L44-L94 HydrophobicContact CG-CD1 4.09Å; I77-L94 HydrophobicContact CD1-CD1 4.48Å; I77-L94 HydrophobicContact CD1-CD2 3.95Å; I77-L94 HydrophobicContact CD1-CG 4.29Å; I90-L94 HydrophobicContact CG2-CD1 3.76Å; I90-L94 HydrophobicContact CG2-CG 4.13Å; I90-L94 WeakPolarHBondContact O-CB 3.23Å; I90-L94 VanDerWaalsContact O-CG 3.25Å; I90-L94 WeakPolarHBondContact O-CG 3.29Å; I90-L94 PolarHBondContact O-N 3.42Å; E91-L94 PolarHBondContact O-N 3Å; L94-L98 HydrophobicContact CD2-CD1 3.93Å; L94-L98 WeakPolarHBondContact O-CA 3.44Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 2.78Å
95	E	98	Very high	96.5	Very high	30 Å²	30	68.8 Å²	68.8	14%	0.14	36%	0.363	C	S	.	.	H	α-helix	trans	-66.8	-37.7	177.3	-177.6	64.9	-177.7	0	0	112.1	K47 E91 E92 K105 L106 G107 L185	K47-E95 WeakPolarHBondContact CE-OE2 3.33Å; K47-E95 IonicContact NZ-OE2 3.81Å; K47-E95 PolarHBondContact NZ-OE2 3Å; E91-E95 WeakPolarHBondContact O-CB 3.36Å; E91-E95 PolarHBondContact O-N 3.31Å; E92-E95 PolarHBondContact O-N 3.3Å; E95-K105 WeakPolarHBondContact OE1-CG 3.45Å; E95-L106 PolarHBondContact OE1-N 3.11Å; E95-L106 PolarHBondContact OE2-N 3.4Å; E95-G107 PolarHBondContact OE1-N 3.35Å; E95-L185 HydrophobicContact CB-CD1 4.23Å; E95-L185 HydrophobicContact CG-CD1 4.09Å
96	D	97.4	Very high	96.7	Very high	121 Å²	121	65.8 Å²	65.8	65%	0.647	34%	0.344	S	S	*	.	H	α-helix	trans	-72.4	-50.3	178.1	-173.5	58.8	0	0	0	112.3	E92 F93 S99	E92-D96 WeakPolarHBondContact O-CB 3.4Å; E92-D96 PolarHBondContact O-N 3.41Å; F93-D96 PolarHBondContact O-N 3.42Å; D96-S99 VanDerWaalsContact O-CB 3.29Å; D96-S99 WeakPolarHBondContact O-CB 3.25Å; D96-S99 PolarHBondContact O-OG 3.18Å
97	V	96.6	Very high	96.7	Very high	57 Å²	57	63.2 Å²	63.2	35%	0.345	34%	0.336	S	S	.	.	H	α-helix	trans	-77.9	-36.8	-174.3	176	0	0	0	0	112.5	F79 F93 S99	F79-V97 HydrophobicContact CE1-CG1 4.11Å; F79-V97 HydrophobicContact CE2-CG1 4.19Å; F79-V97 HydrophobicContact CZ-CG1 3.51Å; F93-V97 HydrophobicContact CD2-CG2 3.85Å; F93-V97 HydrophobicContact CE1-CG2 4.47Å; F93-V97 HydrophobicContact CE2-CG2 3.53Å; F93-V97 HydrophobicContact CG-CG2 4.46Å; F93-V97 HydrophobicContact CZ-CB 4.47Å; F93-V97 HydrophobicContact CZ-CG2 3.87Å; F93-V97 WeakPolarHBondContact O-CB 3.34Å; F93-V97 WeakPolarHBondContact O-CG2 3.34Å; F93-V97 PolarHBondContact O-N 2.98Å; V97-S99 PolarHBondContact O-N 3.3Å
98	L	96.2	Very high	96.8	Very high	1 Å²	1	63.1 Å²	63.1	1%	0.005	34%	0.338	C	S	.	.	S	Bend	trans	-94.8	69.4	175.8	-52.5	176.4	0	0	0	109.3	P16 I18 L44 K47 V49 F79 L94 Y103	P16-L98 HydrophobicContact CG-CD2 4.22Å; I18-L98 HydrophobicContact CD1-CD1 4.19Å; I18-L98 HydrophobicContact CD1-CD2 4.47Å; L44-L98 HydrophobicContact CD2-CD1 4.28Å; K47-L98 HydrophobicContact CB-CD1 4.17Å; K47-L98 HydrophobicContact CD-CB 3.88Å; K47-L98 WeakPolarHBondContact CE-O 3.5Å; K47-L98 HydrophobicContact CG-CB 4.31Å; K47-L98 HydrophobicContact CG-CD1 4.07Å; K47-L98 PolarHBondContact NZ-O 3.37Å; V49-L98 HydrophobicContact CB-CD1 4.31Å; V49-L98 HydrophobicContact CG1-CD1 3.94Å; V49-L98 HydrophobicContact CG2-CD2 4.4Å; F79-L98 HydrophobicContact CE2-CD2 4.38Å; L94-L98 HydrophobicContact CD2-CD1 3.93Å; L94-L98 WeakPolarHBondContact O-CA 3.44Å; L94-L98 WeakPolarHBondContact O-CB 3.43Å; L94-L98 PolarHBondContact O-N 2.78Å; L98-Y103 HydrophobicContact CB-CD2 3.79Å; L98-Y103 HydrophobicContact CB-CE2 4.31Å; L98-Y103 HydrophobicContact CB-CG 3.96Å; L98-Y103 HydrophobicContact CD2-CD2 4.02Å; L98-Y103 HydrophobicContact CD2-CE2 3.63Å; L98-Y103 WeakPolarHBondContact O-CB 3.45Å
99	S	93.2	Very high	96.8	Very high	51 Å²	51	66.5 Å²	66.5	36%	0.357	35%	0.349	S	S	.	.			trans	-110.3	167.6	-173.3	48.3	0	0	0	0	113.9	D96 V97 Y103	D96-S99 VanDerWaalsContact O-CB 3.29Å; D96-S99 WeakPolarHBondContact O-CB 3.25Å; D96-S99 PolarHBondContact O-OG 3.18Å; V97-S99 PolarHBondContact O-N 3.3Å; S99-Y103 CarbonylContact C-O 3.23Å; S99-Y103 PolarHBondContact O-N 3.27Å
100	P	94.5	Very high	96.8	Very high	79 Å²	79	61.1 Å²	61.1	51%	0.513	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	151.5	174.4	-26.4	35.6	0	0	0	112.8	Y103 K105	P100-Y103 VanDerWaalsContact CA-O 3.29Å; P100-Y103 WeakPolarHBondContact CA-O 3.44Å; P100-Y103 WeakPolarHBondContact CD-O 3.38Å; P100-Y103 WeakPolarHBondContact CG-O 3.44Å; P100-Y103 VanDerWaalsContact N-O 3.09Å; P100-K105 HydrophobicContact CG-CB 4.19Å
101	P	94.4	Very high	96.7	Very high	142 Å²	142	66 Å²	66	92%	0.922	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	cis	-85.5	-10.4	8.8	33.8	-36.5	0	0	0	114.6
102	K	94.2	Very high	96.6	Very high	114 Å²	114	71.2 Å²	71.2	50%	0.496	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-39.3	-173.5	-173.8	174.4	179.4	-170.9	0	112.5	E15	E15-K102 IonicContact OE1-NZ 3.79Å; E15-K102 PolarHBondContact OE1-NZ 2.73Å
103	Y	95.9	Very high	96.6	Very high	28 Å²	28	65 Å²	65	11%	0.11	35%	0.353	C	S	.	.	S	Bend	trans	-123.2	149.9	-176.4	-51.9	-75.1	0	0	0	110.8	K47 V49 L98 S99 P100	K47-Y103 WeakPolarHBondContact O-CD1 3.38Å; V49-Y103 HydrophobicContact CB-CE1 4.05Å; V49-Y103 HydrophobicContact CG2-CE1 4.14Å; L98-Y103 HydrophobicContact CB-CD2 3.79Å; L98-Y103 HydrophobicContact CB-CE2 4.31Å; L98-Y103 HydrophobicContact CB-CG 3.96Å; L98-Y103 HydrophobicContact CD2-CD2 4.02Å; L98-Y103 HydrophobicContact CD2-CE2 3.63Å; L98-Y103 WeakPolarHBondContact O-CB 3.45Å; S99-Y103 CarbonylContact C-O 3.23Å; S99-Y103 PolarHBondContact O-N 3.27Å; P100-Y103 VanDerWaalsContact CA-O 3.29Å; P100-Y103 WeakPolarHBondContact CA-O 3.44Å; P100-Y103 WeakPolarHBondContact CD-O 3.38Å; P100-Y103 WeakPolarHBondContact CG-O 3.44Å; P100-Y103 VanDerWaalsContact N-O 3.09Å
104	V	96.1	Very high	96.6	Very high	77 Å²	77	66.4 Å²	66.4	47%	0.467	36%	0.363	S	S	.	.			trans	-68.8	144.1	179.5	66	0	0	0	0	111.2	L46 K47 L106	L46-V104 VanDerWaalsContact O-CG1 3.32Å; L46-V104 WeakPolarHBondContact O-CG1 3.32Å; K47-V104 WeakPolarHBondContact CD-O 3.31Å; K47-V104 PolarHBondContact NZ-O 3.12Å; V104-L106 HydrophobicContact CG1-CD2 3.73Å; V104-L106 HydrophobicContact CG1-CG 4.26Å
105	K	97.4	Very high	96.5	Very high	150 Å²	150	70.1 Å²	70.1	65%	0.652	39%	0.385	S	S	*	.			trans	-78.5	127.5	169.6	-169.7	-178.8	179.4	176.8	0	109.1	E95 P100	E95-K105 WeakPolarHBondContact OE1-CG 3.45Å; P100-K105 HydrophobicContact CG-CB 4.19Å
106	L	98.3	Very high	96.5	Very high	7 Å²	7	69.5 Å²	69.5	4%	0.037	39%	0.385	C	S	.	.			trans	-107.5	-9.7	-177.9	-63.1	179.8	0	0	0	113	I43 L46 K47 E95 V104 A108 T184 L185	I43-L106 HydrophobicContact CG2-CD1 4.31Å; L46-L106 HydrophobicContact CB-CD1 3.72Å; L46-L106 HydrophobicContact CB-CD2 3.96Å; K47-L106 HydrophobicContact CD-CD1 4.03Å; K47-L106 HydrophobicContact CD-CG 4.33Å; K47-L106 HydrophobicContact CG-CD1 3.97Å; E95-L106 PolarHBondContact OE1-N 3.11Å; E95-L106 PolarHBondContact OE2-N 3.4Å; V104-L106 HydrophobicContact CG1-CD2 3.73Å; V104-L106 HydrophobicContact CG1-CG 4.26Å; L106-A108 PolarHBondContact O-N 3.2Å; L106-T184 CarbonylContact O-C 3.34Å; L106-T184 WeakPolarHBondContact O-CA 3.26Å; L106-T184 WeakPolarHBondContact O-CB 3.44Å; L106-L185 HydrophobicContact CB-CD2 3.74Å; L106-L185 HydrophobicContact CB-CG 3.84Å; L106-L185 HydrophobicContact CD1-CD2 4.27Å; L106-L185 PolarHBondContact O-N 3.17Å
107	G	97.4	Very high	96.5	Very high	26 Å²	26	64.2 Å²	64.2	27%	0.268	36%	0.359	S	S	.	.	S	Bend	trans	-58.2	131.4	176	0	0	0	0	0	112.3	E95	E95-G107 PolarHBondContact OE1-N 3.35Å
108	A	97.1	Very high	96.4	Very high	20 Å²	20	67.7 Å²	67.7	17%	0.165	37%	0.374	C	S	.	.			trans	-62.5	140.5	175.1	0	0	0	0	0	111.1	L106 D179 T184	L106-A108 PolarHBondContact O-N 3.2Å; A108-D179 WeakPolarHBondContact CA-OD2 3.37Å; A108-D179 HydrophobicContact CB-CB 4.09Å; A108-T184 HydrophobicContact CB-CG2 4.48Å
109	K	97	Very high	96.4	Very high	154 Å²	154	70.2 Å²	70.2	67%	0.67	39%	0.387	S	S	*	.	S	Bend	trans	-74.6	-40.3	175.4	-59.9	178.6	-174.8	174.7	0	111.3	D160 D179	K109-D160 IonicContact NZ-OD2 2.76Å; K109-D179 WeakPolarHBondContact CB-OD2 3.36Å; K109-D179 PolarHBondContact N-OD2 2.92Å
110	H	97.5	Very high	96.6	Very high	23 Å²	23	67.9 Å²	67.9	11%	0.106	37%	0.371	C	S	.	.	S	Bend	trans	-94.8	120.6	-177.8	-48.8	88.8	0	0	0	109.6	E112 S113 D160 D179	H110-E112 PolarHBondContact O-N 2.92Å; H110-E112 VanDerWaalsContact O-N 3.15Å; H110-S113 VanDerWaalsContact O-CB 3.25Å; H110-S113 WeakPolarHBondContact O-CB 3.46Å; H110-S113 PolarHBondContact O-N 3.47Å; H110-S113 PolarHBondContact O-OG 3.23Å; H110-D160 IonicContact CE1-OD2 3.78Å; H110-D160 IonicContact NE2-OD2 3.96Å; H110-D179 VanDerWaalsContact CB-OD1 3.24Å; H110-D179 WeakPolarHBondContact CB-OD1 3.4Å; H110-D179 IonicContact CE1-OD1 2.67Å; H110-D179 IonicContact CG-OD1 2.76Å; H110-D179 PolarHBondContact N-OD1 2.95Å; H110-D179 IonicContact ND1-OD1 3.7Å; H110-D179 PolarHBondContact ND1-OD1 2.82Å; H110-D179 IonicContact ND1-OD2 3.99Å
111	P	96.1	Very high	96.7	Very high	103 Å²	103	65.8 Å²	65.8	67%	0.669	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-57.2	-32.2	-179.2	-28.2	36	0	0	0	113.9	S113 N114	P111-S113 VanDerWaalsContact C-N 3.27Å; P111-S113 PolarHBondContact O-N 2.89Å; P111-N114 WeakPolarHBondContact O-CB 3.48Å; P111-N114 PolarHBondContact O-N 3Å
112	E	97	Very high	96.9	Very high	132 Å²	132	62.1 Å²	62.1	62%	0.617	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-60.6	-35.2	178.2	-65.8	-175.5	172.7	0	0	112.4	H110 N114 T115 A116 Y153	H110-E112 PolarHBondContact O-N 2.92Å; H110-E112 VanDerWaalsContact O-N 3.15Å; E112-N114 PolarHBondContact O-N 3.38Å; E112-T115 PolarHBondContact O-N 2.92Å; E112-T115 PolarHBondContact O-OG1 3.3Å; E112-A116 PolarHBondContact O-N 3.45Å; E112-Y153 HydrophobicContact CB-CE2 3.85Å
113	S	98.3	Very high	97.1	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.007	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-54.8	-38.2	177	-55.2	0	0	0	0	112.1	H110 P111 T115 Y153 D179 A186	H110-S113 VanDerWaalsContact O-CB 3.25Å; H110-S113 WeakPolarHBondContact O-CB 3.46Å; H110-S113 PolarHBondContact O-N 3.47Å; H110-S113 PolarHBondContact O-OG 3.23Å; P111-S113 VanDerWaalsContact C-N 3.27Å; P111-S113 PolarHBondContact O-N 2.89Å; S113-T115 PolarHBondContact O-N 3.29Å; S113-Y153 WeakPolarHBondContact CA-OH 3.5Å; S113-Y153 PolarHBondContact N-OH 3.34Å; S113-Y153 PolarHBondContact OG-OH 3.35Å; S113-D179 WeakPolarHBondContact CB-OD1 3.49Å; S113-D179 PolarHBondContact OG-OD1 3Å; S113-A186 WeakPolarHBondContact O-CB 3.47Å
114	N	97.1	Very high	97.2	Very high	79 Å²	79	60 Å²	60	42%	0.422	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-70.7	-18.7	-179.4	-63.2	-49.2	0	0	0	113.4	P111 E112	P111-N114 WeakPolarHBondContact O-CB 3.48Å; P111-N114 PolarHBondContact O-N 3Å; E112-N114 PolarHBondContact O-N 3.38Å
115	T	96.8	Very high	97.3	Very high	77 Å²	77	57.6 Å²	57.6	47%	0.472	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-16	-176.4	63.7	0	0	0	0	113.2	E112 S113 G117 M118	E112-T115 PolarHBondContact O-N 2.92Å; E112-T115 PolarHBondContact O-OG1 3.3Å; S113-T115 PolarHBondContact O-N 3.29Å; T115-G117 PolarHBondContact O-N 3.15Å; T115-M118 HydrophobicContact CG2-SD 4.3Å; T115-M118 WeakPolarHBondContact O-CB 3.35Å; T115-M118 VanDerWaalsContact O-CG 3.27Å; T115-M118 WeakPolarHBondContact O-CG 3.43Å; T115-M118 PolarHBondContact O-N 2.94Å; T115-M118 VanDerWaalsContact O-N 3.11Å
116	A	97.8	Very high	97.3	Very high	17 Å²	17	52.8 Å²	52.8	14%	0.14	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	121.8	175.9	0	0	0	0	0	111.1	E112 M118 L150 Y153 L178	E112-A116 PolarHBondContact O-N 3.45Å; A116-M118 VanDerWaalsContact C-N 3.28Å; A116-M118 PolarHBondContact O-N 2.83Å; A116-L150 HydrophobicContact CB-CD1 4.28Å; A116-Y153 HydrophobicContact CB-CD1 3.51Å; A116-Y153 HydrophobicContact CB-CD2 4.49Å; A116-Y153 HydrophobicContact CB-CE1 3.71Å; A116-Y153 HydrophobicContact CB-CG 3.95Å; A116-L178 HydrophobicContact CB-CD2 4.05Å
117	G	97.1	Very high	97.2	Very high	10 Å²	10	52.5 Å²	52.5	10%	0.103	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	9.5	179	0	0	0	0	0	115.9	T115 D119 I120	T115-G117 PolarHBondContact O-N 3.15Å; G117-D119 PolarHBondContact O-N 3.05Å; G117-D119 VanDerWaalsContact O-N 3.17Å; G117-I120 VanDerWaalsContact CA-CD1 3.49Å; G117-I120 WeakPolarHBondContact O-CB 3.28Å; G117-I120 WeakPolarHBondContact O-CG1 3.24Å; G117-I120 PolarHBondContact O-N 3.35Å
118	M	94.6	Very high	97.2	Very high	131 Å²	131	51.3 Å²	51.3	65%	0.645	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-27.5	-176.6	72.8	-179	-61.9	0	0	114.1	T115 A116	T115-M118 HydrophobicContact CG2-SD 4.3Å; T115-M118 WeakPolarHBondContact O-CB 3.35Å; T115-M118 VanDerWaalsContact O-CG 3.27Å; T115-M118 WeakPolarHBondContact O-CG 3.43Å; T115-M118 PolarHBondContact O-N 2.94Å; T115-M118 VanDerWaalsContact O-N 3.11Å; A116-M118 VanDerWaalsContact C-N 3.28Å; A116-M118 PolarHBondContact O-N 2.83Å
119	D	95.8	Very high	97.1	Very high	53 Å²	53	55.5 Å²	55.5	28%	0.283	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.8	-178.2	62.7	-13.4	0	0	0	113.9	G117 F121 A122 K123 T146	G117-D119 PolarHBondContact O-N 3.05Å; G117-D119 VanDerWaalsContact O-N 3.17Å; D119-F121 PolarHBondContact O-N 3.28Å; D119-A122 PolarHBondContact O-N 3.04Å; D119-K123 PolarHBondContact O-N 3.37Å; D119-T146 HydrophobicContact CB-CG2 4.39Å; D119-T146 WeakPolarHBondContact OD1-CG2 3.3Å; D119-T146 WeakPolarHBondContact OD2-CG2 3.35Å
120	I	98.4	Very high	97	Very high	3 Å²	3	49 Å²	49	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-54.7	-50.3	-177.6	-68.3	170.7	0	0	0	110.9	G117 A122 K123 F124 L143 L147 L150 L190 V197	G117-I120 VanDerWaalsContact CA-CD1 3.49Å; G117-I120 WeakPolarHBondContact O-CB 3.28Å; G117-I120 WeakPolarHBondContact O-CG1 3.24Å; G117-I120 PolarHBondContact O-N 3.35Å; I120-A122 VanDerWaalsContact C-N 3.29Å; I120-A122 PolarHBondContact O-N 3.23Å; I120-K123 PolarHBondContact O-N 3.33Å; I120-F124 WeakPolarHBondContact O-CB 3.34Å; I120-F124 PolarHBondContact O-N 3.36Å; I120-L143 HydrophobicContact CG2-CD1 4.14Å; I120-L147 HydrophobicContact CD1-CD2 4.22Å; I120-L147 HydrophobicContact CG2-CD2 4.25Å; I120-L150 HydrophobicContact CD1-CB 3.98Å; I120-L150 HydrophobicContact CD1-CD2 3.59Å; I120-L150 HydrophobicContact CD1-CG 4.38Å; I120-L190 HydrophobicContact CD1-CD1 4.45Å; I120-V197 HydrophobicContact CG2-CG2 4.1Å
121	F	97.6	Very high	96.8	Very high	35 Å²	35	50.3 Å²	50.3	15%	0.154	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-31.4	-173.9	-159.9	-106.8	0	0	0	112.7	P35 D119 F124 S125 K193 I196 V197 Y243	P35-F121 HydrophobicContact CG-CZ 4.2Å; D119-F121 PolarHBondContact O-N 3.28Å; F121-F124 AromaticContact CD2-CD1 3.87Å; F121-F124 HydrophobicContact CD2-CD1 3.87Å; F121-F124 HydrophobicContact CD2-CE1 4.3Å; F121-F124 AromaticContact CE2-CD1 3.9Å; F121-F124 HydrophobicContact CE2-CD1 3.9Å; F121-F124 AromaticContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CG-CD1 4.46Å; F121-F124 HydrophobicContact CZ-CE1 4.29Å; F121-S125 VanDerWaalsContact O-CB 3.3Å; F121-S125 WeakPolarHBondContact O-CB 3.25Å; F121-S125 PolarHBondContact O-N 3.22Å; F121-S125 PolarHBondContact O-OG 2.9Å; F121-K193 HydrophobicContact CB-CB 4.25Å; F121-K193 HydrophobicContact CB-CD 4.04Å; F121-K193 HydrophobicContact CB-CG 4.3Å; F121-K193 HydrophobicContact CD2-CB 3.58Å; F121-K193 HydrophobicContact CD2-CD 4.5Å; F121-K193 HydrophobicContact CD2-CG 3.85Å; F121-K193 HydrophobicContact CE2-CB 4.15Å; F121-K193 HydrophobicContact CE2-CG 4.26Å; F121-K193 HydrophobicContact CG-CB 4.08Å; F121-K193 HydrophobicContact CG-CD 4.19Å; F121-K193 HydrophobicContact CG-CG 3.99Å; F121-I196 HydrophobicContact CE2-CB 4.21Å; F121-I196 HydrophobicContact CE2-CD1 4.35Å; F121-I196 HydrophobicContact CE2-CG2 3.98Å; F121-I196 HydrophobicContact CZ-CG2 4.48Å; F121-V197 HydrophobicContact CD2-CG2 4.25Å; F121-Y243 WeakPolarHBondContact CZ-OH 3.42Å
122	A	98	Very high	96.6	Very high	65 Å²	65	51.8 Å²	51.8	54%	0.537	28%	0.282	S	S	.	.	H	α-helix	trans	-70.4	-43.5	174.7	0	0	0	0	0	111.4	D119 I120 S125 A126	D119-A122 PolarHBondContact O-N 3.04Å; I120-A122 VanDerWaalsContact C-N 3.29Å; I120-A122 PolarHBondContact O-N 3.23Å; A122-S125 PolarHBondContact O-N 3.12Å; A122-A126 PolarHBondContact O-N 3.36Å
123	K	98.3	Very high	96.4	Very high	98 Å²	98	48.2 Å²	48.2	43%	0.426	27%	0.27	S	S	.	.	H	α-helix	trans	-64.6	-43.9	175.2	-65.3	-54.7	-176.7	-177.6	0	112.2	D119 I120 S125 A126 Y127 L143 T146	D119-K123 PolarHBondContact O-N 3.37Å; I120-K123 PolarHBondContact O-N 3.33Å; K123-S125 VanDerWaalsContact C-N 3.33Å; K123-S125 PolarHBondContact O-N 3.39Å; K123-A126 PolarHBondContact O-N 3.44Å; K123-Y127 WeakPolarHBondContact O-CB 3.41Å; K123-Y127 PolarHBondContact O-N 2.87Å; K123-L143 HydrophobicContact CB-CB 4.48Å; K123-L143 HydrophobicContact CB-CD1 4.42Å; K123-T146 HydrophobicContact CB-CG2 4.44Å; K123-T146 HydrophobicContact CG-CG2 3.63Å
124	F	98.3	Very high	96.2	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-55.9	-47.6	171.3	157.1	-107.8	0	0	0	111.5	I120 F121 A126 Y127 I128 L143 I196 V197 V200 T201 Y243	I120-F124 WeakPolarHBondContact O-CB 3.34Å; I120-F124 PolarHBondContact O-N 3.36Å; F121-F124 AromaticContact CD2-CD1 3.87Å; F121-F124 HydrophobicContact CD2-CD1 3.87Å; F121-F124 HydrophobicContact CD2-CE1 4.3Å; F121-F124 AromaticContact CE2-CD1 3.9Å; F121-F124 HydrophobicContact CE2-CD1 3.9Å; F121-F124 AromaticContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CG-CD1 4.46Å; F121-F124 HydrophobicContact CZ-CE1 4.29Å; F124-A126 VanDerWaalsContact C-N 3.3Å; F124-A126 PolarHBondContact O-N 2.87Å; F124-Y127 PolarHBondContact O-N 2.97Å; F124-Y127 VanDerWaalsContact O-N 3.15Å; F124-I128 HydrophobicContact CD2-CB 4.31Å; F124-I128 HydrophobicContact CD2-CG2 4.42Å; F124-I128 HydrophobicContact CE1-CG2 4.4Å; F124-I128 HydrophobicContact CE2-CB 3.91Å; F124-I128 HydrophobicContact CE2-CG1 4.24Å; F124-I128 HydrophobicContact CE2-CG2 4.01Å; F124-I128 HydrophobicContact CZ-CB 4.36Å; F124-I128 HydrophobicContact CZ-CG2 4Å; F124-I128 WeakPolarHBondContact O-CG2 3.32Å; F124-I128 PolarHBondContact O-N 3.15Å; F124-L143 HydrophobicContact CB-CD1 4.02Å; F124-I196 HydrophobicContact CE1-CG2 4Å; F124-I196 HydrophobicContact CZ-CG2 4.08Å; F124-V197 HydrophobicContact CB-CG1 4.49Å; F124-V197 HydrophobicContact CB-CG2 3.75Å; F124-V197 HydrophobicContact CD1-CG2 3.86Å; F124-V197 HydrophobicContact CD2-CB 4.35Å; F124-V197 HydrophobicContact CD2-CG1 4.23Å; F124-V197 HydrophobicContact CD2-CG2 4.05Å; F124-V197 HydrophobicContact CE1-CG2 4.48Å; F124-V197 HydrophobicContact CG-CB 4.39Å; F124-V197 HydrophobicContact CG-CG1 4.47Å; F124-V197 HydrophobicContact CG-CG2 3.61Å; F124-V200 HydrophobicContact CE2-CB 3.89Å; F124-V200 HydrophobicContact CE2-CG1 3.85Å; F124-V200 HydrophobicContact CZ-CB 3.78Å; F124-V200 HydrophobicContact CZ-CG1 3.77Å; F124-V200 HydrophobicContact CZ-CG2 4.21Å; F124-T201 HydrophobicContact CD2-CG2 3.71Å; F124-T201 HydrophobicContact CE2-CG2 3.83Å; F124-Y243 AromaticContact CE1-CE1 3.76Å; F124-Y243 HydrophobicContact CE1-CE1 3.76Å; F124-Y243 AromaticContact CE1-CZ 3.87Å; F124-Y243 HydrophobicContact CZ-CD1 4.25Å; F124-Y243 AromaticContact CZ-CE1 3.68Å; F124-Y243 HydrophobicContact CZ-CE1 3.68Å
125	S	97.1	Very high	96.1	Very high	26 Å²	26	52.5 Å²	52.5	18%	0.182	30%	0.297	C	S	.	.	H	α-helix	trans	-59.8	-40.5	179.8	-68.3	0	0	0	0	112.4	F121 A122 K123 K129	F121-S125 VanDerWaalsContact O-CB 3.3Å; F121-S125 WeakPolarHBondContact O-CB 3.25Å; F121-S125 PolarHBondContact O-N 3.22Å; F121-S125 PolarHBondContact O-OG 2.9Å; A122-S125 PolarHBondContact O-N 3.12Å; K123-S125 VanDerWaalsContact C-N 3.33Å; K123-S125 PolarHBondContact O-N 3.39Å; S125-K129 VanDerWaalsContact O-CB 3.29Å; S125-K129 WeakPolarHBondContact O-CB 3.37Å; S125-K129 WeakPolarHBondContact O-CD 3.48Å; S125-K129 VanDerWaalsContact O-CG 3.23Å; S125-K129 WeakPolarHBondContact O-CG 3.48Å; S125-K129 PolarHBondContact O-N 3.48Å
126	A	97	Very high	96	Very high	48 Å²	48	49.9 Å²	49.9	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-66.4	-44.2	175	0	0	0	0	0	111.8	A122 K123 F124 N130 L139	A122-A126 PolarHBondContact O-N 3.36Å; K123-A126 PolarHBondContact O-N 3.44Å; F124-A126 VanDerWaalsContact C-N 3.3Å; F124-A126 PolarHBondContact O-N 2.87Å; A126-N130 PolarHBondContact O-N 3.37Å; A126-L139 HydrophobicContact CB-CD2 4.04Å
127	Y	97.4	Very high	96	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-50	178.8	174.4	-116.9	0	0	0	112.7	K123 F124 K129 N130 N136 L139 E140 L143 T201 R205	K123-Y127 WeakPolarHBondContact O-CB 3.41Å; K123-Y127 PolarHBondContact O-N 2.87Å; F124-Y127 PolarHBondContact O-N 2.97Å; F124-Y127 VanDerWaalsContact O-N 3.15Å; Y127-K129 PolarHBondContact O-N 2.96Å; Y127-N130 VanDerWaalsContact O-CB 3.27Å; Y127-N130 WeakPolarHBondContact O-CB 3.18Å; Y127-N130 PolarHBondContact O-N 2.93Å; Y127-N136 WeakPolarHBondContact CE2-OD1 3.36Å; Y127-L139 HydrophobicContact CD2-CB 3.91Å; Y127-E140 HydrophobicContact CD2-CB 4.09Å; Y127-E140 HydrophobicContact CE2-CB 3.56Å; Y127-E140 HydrophobicContact CE2-CG 3.97Å; Y127-E140 PolarHBondContact OH-OE2 3.17Å; Y127-L143 HydrophobicContact CD1-CD2 3.97Å; Y127-L143 HydrophobicContact CE1-CD2 4.48Å; Y127-T201 HydrophobicContact CD1-CG2 4.35Å; Y127-T201 HydrophobicContact CE1-CG2 4.27Å; Y127-R205 HydrophobicContact CE1-CB 4.14Å; Y127-R205 HydrophobicContact CE1-CG 3.78Å
128	I	96.9	Very high	96	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-72.1	-32.3	-174.3	-164.7	63	0	0	0	113	F124 N130 V200 R205 Y243 A247	F124-I128 HydrophobicContact CD2-CB 4.31Å; F124-I128 HydrophobicContact CD2-CG2 4.42Å; F124-I128 HydrophobicContact CE1-CG2 4.4Å; F124-I128 HydrophobicContact CE2-CB 3.91Å; F124-I128 HydrophobicContact CE2-CG1 4.24Å; F124-I128 HydrophobicContact CE2-CG2 4.01Å; F124-I128 HydrophobicContact CZ-CB 4.36Å; F124-I128 HydrophobicContact CZ-CG2 4Å; F124-I128 WeakPolarHBondContact O-CG2 3.32Å; F124-I128 PolarHBondContact O-N 3.15Å; I128-N130 VanDerWaalsContact C-N 3.28Å; I128-N130 PolarHBondContact O-N 3.38Å; I128-V200 HydrophobicContact CD1-CG1 3.74Å; I128-V200 HydrophobicContact CG1-CG1 3.63Å; I128-R205 HydrophobicContact CD1-CG 4.05Å; I128-R205 PolarHBondContact O-NH2 3.06Å; I128-R205 VanDerWaalsContact O-NH2 3.08Å; I128-Y243 HydrophobicContact CG2-CD1 4.44Å; I128-Y243 HydrophobicContact CG2-CE1 4.38Å; I128-A247 HydrophobicContact CD1-CB 4.03Å; I128-A247 HydrophobicContact CG1-CB 3.94Å
129	K	95.4	Very high	96.2	Very high	109 Å²	109	53.4 Å²	53.4	47%	0.474	30%	0.3	S	S	.	.	H	α-helix	trans	-81.3	-8.3	178.1	-65.6	177	-178	177.9	0	113.2	S125 Y127 V246	S125-K129 VanDerWaalsContact O-CB 3.29Å; S125-K129 WeakPolarHBondContact O-CB 3.37Å; S125-K129 WeakPolarHBondContact O-CD 3.48Å; S125-K129 VanDerWaalsContact O-CG 3.23Å; S125-K129 WeakPolarHBondContact O-CG 3.48Å; S125-K129 PolarHBondContact O-N 3.48Å; Y127-K129 PolarHBondContact O-N 2.96Å; K129-V246 HydrophobicContact CG-CB 4.39Å
130	N	94.2	Very high	96.2	Very high	17 Å²	17	53.7 Å²	53.7	9%	0.091	30%	0.299	C	S	.	.			trans	-65.1	134.3	178.4	179	42.3	0	0	0	111.5	A126 Y127 I128 K132 L139 R205	A126-N130 PolarHBondContact O-N 3.37Å; Y127-N130 VanDerWaalsContact O-CB 3.27Å; Y127-N130 WeakPolarHBondContact O-CB 3.18Å; Y127-N130 PolarHBondContact O-N 2.93Å; I128-N130 VanDerWaalsContact C-N 3.28Å; I128-N130 PolarHBondContact O-N 3.38Å; N130-K132 PolarHBondContact ND2-O 3.49Å; N130-K132 PolarHBondContact OD1-N 2.88Å; N130-K132 PolarHBondContact OD1-O 3.45Å; N130-L139 HydrophobicContact CB-CD1 3.52Å; N130-R205 PolarHBondContact O-NH2 3.39Å
131	S	93.3	Very high	96.2	Very high	51 Å²	51	59.6 Å²	59.6	36%	0.357	32%	0.322	S	S	.	.			trans	-115.9	-1.6	172.5	59.6	0	0	0	0	113.4
132	K	93.4	Very high	96.3	Very high	134 Å²	134	59 Å²	59	58%	0.583	33%	0.325	S	S	*	.			trans	-99.2	115	-175.5	-59.3	-172.6	175.6	-176.3	0	110.5	N130 D134 A135 N136	N130-K132 PolarHBondContact ND2-O 3.49Å; N130-K132 PolarHBondContact OD1-N 2.88Å; N130-K132 PolarHBondContact OD1-O 3.45Å; K132-D134 VanDerWaalsContact C-N 3.34Å; K132-D134 VanDerWaalsContact CB-OD1 3.23Å; K132-D134 WeakPolarHBondContact CB-OD1 3.46Å; K132-D134 PolarHBondContact O-N 2.85Å; K132-A135 HydrophobicContact CB-CB 4.23Å; K132-A135 PolarHBondContact O-N 3.22Å; K132-N136 PolarHBondContact O-N 2.98Å
133	P	92.4	Very high	96.3	Very high	57 Å²	57	55.9 Å²	55.9	37%	0.37	30%	0.299	S	S	.	.	H	α-helix	trans	-60.7	-38.1	-175.7	-26.2	35.1	0	0	0	114.5	A135 N136 L250 V251	P133-A135 VanDerWaalsContact C-N 3.32Å; P133-A135 PolarHBondContact O-N 3.27Å; P133-N136 WeakPolarHBondContact O-CB 3.47Å; P133-N136 PolarHBondContact O-N 3.11Å; P133-L250 HydrophobicContact CG-CB 4.49Å; P133-V251 VanDerWaalsContact CG-O 3.24Å; P133-V251 WeakPolarHBondContact CG-O 3.47Å
134	D	94.3	Very high	96.3	Very high	138 Å²	138	53.4 Å²	53.4	74%	0.738	29%	0.291	S	S	*	.	H	α-helix	trans	-61.2	-35.2	177.9	61.3	-29.7	0	0	0	113.2	K132	K132-D134 VanDerWaalsContact C-N 3.34Å; K132-D134 VanDerWaalsContact CB-OD1 3.23Å; K132-D134 WeakPolarHBondContact CB-OD1 3.46Å; K132-D134 PolarHBondContact O-N 2.85Å
135	A	94.7	Very high	96.3	Very high	31 Å²	31	60.3 Å²	60.3	26%	0.256	32%	0.32	S	S	.	.	H	α-helix	trans	-81.6	-15.2	177.6	0	0	0	0	0	113.7	K132 P133 E137 A138 L139	K132-A135 HydrophobicContact CB-CB 4.23Å; K132-A135 PolarHBondContact O-N 3.22Å; P133-A135 VanDerWaalsContact C-N 3.32Å; P133-A135 PolarHBondContact O-N 3.27Å; A135-E137 PolarHBondContact O-N 3.49Å; A135-A138 PolarHBondContact O-N 2.87Å; A135-L139 HydrophobicContact CB-CD1 4.34Å; A135-L139 WeakPolarHBondContact O-CG 3.33Å; A135-L139 PolarHBondContact O-N 3.42Å; A135-L139 VanDerWaalsContact O-N 3.12Å
136	N	94.8	Very high	96.4	Very high	23 Å²	23	59.2 Å²	59.2	12%	0.123	31%	0.313	C	S	.	.	H	α-helix	trans	-62.3	-47.4	-168.1	-171.3	75	0	0	0	112.6	Y127 K132 P133 A138 L139 E140 L250	Y127-N136 WeakPolarHBondContact CE2-OD1 3.36Å; K132-N136 PolarHBondContact O-N 2.98Å; P133-N136 WeakPolarHBondContact O-CB 3.47Å; P133-N136 PolarHBondContact O-N 3.11Å; N136-A138 VanDerWaalsContact C-N 3.32Å; N136-A138 PolarHBondContact O-N 3.27Å; N136-L139 PolarHBondContact O-N 3.21Å; N136-E140 WeakPolarHBondContact O-CB 3.3Å; N136-E140 PolarHBondContact O-N 3.47Å; N136-L250 HydrophobicContact CB-CD1 4.12Å; N136-L250 HydrophobicContact CB-CD2 4.31Å; N136-L250 WeakPolarHBondContact OD1-CD1 3.38Å
137	E	96.3	Very high	96.4	Very high	127 Å²	127	57 Å²	57	59%	0.593	29%	0.294	S	S	*	.	H	α-helix	trans	-61.9	-41	-177.9	-160.3	-161.8	169.2	0	0	111.7	A135 E140 R141	A135-E137 PolarHBondContact O-N 3.49Å; E137-E140 PolarHBondContact O-N 3.22Å; E137-R141 VanDerWaalsContact CG-NH1 3.32Å; E137-R141 WeakPolarHBondContact O-CB 3.46Å; E137-R141 WeakPolarHBondContact O-CG 3.21Å; E137-R141 PolarHBondContact O-N 2.94Å; E137-R141 IonicContact OE1-NH1 2.67Å; E137-R141 PolarHBondContact OE1-NH1 2.87Å; E137-R141 IonicContact OE2-NH1 3.42Å; E137-R141 PolarHBondContact OE2-NH1 3.38Å; E137-R141 VanDerWaalsContact OE2-NH1 3.16Å
138	A	97.8	Very high	96.5	Very high	53 Å²	53	60 Å²	60	44%	0.438	31%	0.309	S	S	.	.	H	α-helix	trans	-66	-39.5	177.7	0	0	0	0	0	112.4	A135 N136 G142	A135-A138 PolarHBondContact O-N 2.87Å; N136-A138 VanDerWaalsContact C-N 3.32Å; N136-A138 PolarHBondContact O-N 3.27Å; A138-G142 PolarHBondContact O-N 2.89Å
139	L	97.9	Very high	96.6	Very high	51 Å²	51	65.5 Å²	65.5	27%	0.267	33%	0.332	S	S	.	.	H	α-helix	trans	-70	-40	177.7	-69.8	170.8	0	0	0	112.1	A126 Y127 N130 A135 N136 G142 L143	A126-L139 HydrophobicContact CB-CD2 4.04Å; Y127-L139 HydrophobicContact CD2-CB 3.91Å; N130-L139 HydrophobicContact CB-CD1 3.52Å; A135-L139 HydrophobicContact CB-CD1 4.34Å; A135-L139 WeakPolarHBondContact O-CG 3.33Å; A135-L139 PolarHBondContact O-N 3.42Å; A135-L139 VanDerWaalsContact O-N 3.12Å; N136-L139 PolarHBondContact O-N 3.21Å; L139-G142 WeakPolarHBondContact O-CA 3.25Å; L139-G142 PolarHBondContact O-N 3.35Å; L139-G142 VanDerWaalsContact O-N 3.15Å; L139-L143 PolarHBondContact O-N 3.32Å
140	E	97.8	Very high	96.7	Very high	59 Å²	59	60.3 Å²	60.3	28%	0.276	31%	0.31	S	S	.	.	H	α-helix	trans	-61.8	-48.2	174.8	-166.9	170.4	129.8	0	0	111.5	Y127 N136 E137 G142 L143 L144 F207	Y127-E140 HydrophobicContact CD2-CB 4.09Å; Y127-E140 HydrophobicContact CE2-CB 3.56Å; Y127-E140 HydrophobicContact CE2-CG 3.97Å; Y127-E140 PolarHBondContact OH-OE2 3.17Å; N136-E140 WeakPolarHBondContact O-CB 3.3Å; N136-E140 PolarHBondContact O-N 3.47Å; E137-E140 PolarHBondContact O-N 3.22Å; E140-G142 PolarHBondContact O-N 3.44Å; E140-L143 PolarHBondContact O-N 3.29Å; E140-L143 VanDerWaalsContact O-N 3.11Å; E140-L144 HydrophobicContact CG-CD1 4.39Å; E140-L144 PolarHBondContact O-N 3.33Å; E140-F207 HydrophobicContact CG-CD2 3.94Å; E140-F207 HydrophobicContact CG-CE2 3.94Å
141	R	98	Very high	96.9	Very high	128 Å²	128	59.5 Å²	59.5	48%	0.483	31%	0.306	S	S	.	.	H	α-helix	trans	-57.8	-36.6	172.3	-73.2	-169.9	-55.8	-108.1	-1.5	112	E137 L144 K145	E137-R141 VanDerWaalsContact CG-NH1 3.32Å; E137-R141 WeakPolarHBondContact O-CB 3.46Å; E137-R141 WeakPolarHBondContact O-CG 3.21Å; E137-R141 PolarHBondContact O-N 2.94Å; E137-R141 IonicContact OE1-NH1 2.67Å; E137-R141 PolarHBondContact OE1-NH1 2.87Å; E137-R141 IonicContact OE2-NH1 3.42Å; E137-R141 PolarHBondContact OE2-NH1 3.38Å; E137-R141 VanDerWaalsContact OE2-NH1 3.16Å; R141-L144 PolarHBondContact O-N 3.2Å; R141-K145 WeakPolarHBondContact O-CB 3.37Å; R141-K145 PolarHBondContact O-N 3.06Å
142	G	98.3	Very high	97.2	Very high	22 Å²	22	60.2 Å²	60.2	23%	0.227	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-45.8	174.7	0	0	0	0	0	112.8	A138 L139 E140 T146	A138-G142 PolarHBondContact O-N 2.89Å; L139-G142 WeakPolarHBondContact O-CA 3.25Å; L139-G142 PolarHBondContact O-N 3.35Å; L139-G142 VanDerWaalsContact O-N 3.15Å; E140-G142 PolarHBondContact O-N 3.44Å; G142-T146 PolarHBondContact O-N 3Å
143	L	98.4	Very high	97.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-65.1	-47.5	175.1	176.2	59.6	0	0	0	111.5	I120 K123 F124 Y127 L139 E140 K145 T146 L147 V197 T201 F207	I120-L143 HydrophobicContact CG2-CD1 4.14Å; K123-L143 HydrophobicContact CB-CB 4.48Å; K123-L143 HydrophobicContact CB-CD1 4.42Å; F124-L143 HydrophobicContact CB-CD1 4.02Å; Y127-L143 HydrophobicContact CD1-CD2 3.97Å; Y127-L143 HydrophobicContact CE1-CD2 4.48Å; L139-L143 PolarHBondContact O-N 3.32Å; E140-L143 PolarHBondContact O-N 3.29Å; E140-L143 VanDerWaalsContact O-N 3.11Å; L143-K145 VanDerWaalsContact C-N 3.28Å; L143-K145 PolarHBondContact O-N 3.36Å; L143-T146 PolarHBondContact O-N 3.4Å; L143-T146 PolarHBondContact O-OG1 2.87Å; L143-L147 HydrophobicContact CD1-CD1 4.38Å; L143-L147 HydrophobicContact CD1-CG 4.39Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 PolarHBondContact O-N 3.28Å; L143-V197 HydrophobicContact CD1-CG1 4.5Å; L143-T201 HydrophobicContact CD2-CG2 4.22Å; L143-F207 HydrophobicContact CD2-CE1 4.16Å; L143-F207 HydrophobicContact CD2-CZ 4.48Å
144	L	98.4	Very high	97.7	Very high	46 Å²	46	52.8 Å²	52.8	24%	0.241	27%	0.267	C	S	.	.	H	α-helix	trans	-56.1	-41.7	177.4	-79.3	169	0	0	0	112.2	E140 R141 T146 L147 Q148 F207 P210 M213	E140-L144 HydrophobicContact CG-CD1 4.39Å; E140-L144 PolarHBondContact O-N 3.33Å; R141-L144 PolarHBondContact O-N 3.2Å; L144-T146 VanDerWaalsContact C-N 3.32Å; L144-T146 PolarHBondContact O-N 2.81Å; L144-L147 PolarHBondContact O-N 3.46Å; L144-Q148 WeakPolarHBondContact O-CB 3.45Å; L144-Q148 PolarHBondContact O-N 3.28Å; L144-F207 HydrophobicContact CD1-CE2 4.24Å; L144-F207 HydrophobicContact CD2-CE2 3.72Å; L144-F207 HydrophobicContact CD2-CZ 3.59Å; L144-F207 HydrophobicContact CG-CE2 3.85Å; L144-F207 HydrophobicContact CG-CZ 3.97Å; L144-P210 HydrophobicContact CD2-CG 3.58Å; L144-M213 HydrophobicContact CD2-CE 4.26Å
145	K	98.4	Very high	97.9	Very high	144 Å²	144	49.8 Å²	49.8	63%	0.626	25%	0.245	S	C	*	.	H	α-helix	trans	-62.3	-38.5	176.8	-172.7	174.2	-176.9	174.9	0	112.4	R141 L143 K149	R141-K145 WeakPolarHBondContact O-CB 3.37Å; R141-K145 PolarHBondContact O-N 3.06Å; L143-K145 VanDerWaalsContact C-N 3.28Å; L143-K145 PolarHBondContact O-N 3.36Å; K145-K149 WeakPolarHBondContact O-CG 3.42Å; K145-K149 PolarHBondContact O-N 3.01Å; K145-K149 VanDerWaalsContact O-N 3.15Å
146	T	98.4	Very high	97.9	Very high	4 Å²	4	51.4 Å²	51.4	3%	0.025	25%	0.254	C	S	.	.	H	α-helix	trans	-72.3	-35.5	177.2	56.1	0	0	0	0	112.7	D119 K123 G142 L143 L144 L150	D119-T146 HydrophobicContact CB-CG2 4.39Å; D119-T146 WeakPolarHBondContact OD1-CG2 3.3Å; D119-T146 WeakPolarHBondContact OD2-CG2 3.35Å; K123-T146 HydrophobicContact CB-CG2 4.44Å; K123-T146 HydrophobicContact CG-CG2 3.63Å; G142-T146 PolarHBondContact O-N 3Å; L143-T146 PolarHBondContact O-N 3.4Å; L143-T146 PolarHBondContact O-OG1 2.87Å; L144-T146 VanDerWaalsContact C-N 3.32Å; L144-T146 PolarHBondContact O-N 2.81Å; T146-L150 PolarHBondContact O-N 2.99Å
147	L	98.7	Very high	98	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64	-47.3	170.7	-68.1	168	0	0	0	110.2	I120 L143 L144 K149 L150 D151 L194 F207 I209 M213 I216	I120-L147 HydrophobicContact CD1-CD2 4.22Å; I120-L147 HydrophobicContact CG2-CD2 4.25Å; L143-L147 HydrophobicContact CD1-CD1 4.38Å; L143-L147 HydrophobicContact CD1-CG 4.39Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 PolarHBondContact O-N 3.28Å; L144-L147 PolarHBondContact O-N 3.46Å; L147-K149 VanDerWaalsContact C-N 3.29Å; L147-K149 PolarHBondContact O-N 3.18Å; L147-L150 WeakPolarHBondContact O-CA 3.41Å; L147-L150 WeakPolarHBondContact O-CB 3.3Å; L147-L150 PolarHBondContact O-N 3.05Å; L147-D151 PolarHBondContact O-N 3.21Å; L147-L194 HydrophobicContact CD2-CD1 3.92Å; L147-F207 HydrophobicContact CD1-CE1 4.22Å; L147-F207 HydrophobicContact CD1-CZ 4.17Å; L147-I209 HydrophobicContact CD1-CG1 4.33Å; L147-I209 HydrophobicContact CD2-CD1 4.48Å; L147-M213 HydrophobicContact CB-CE 4.03Å; L147-M213 HydrophobicContact CB-SD 3.72Å; L147-I216 HydrophobicContact CB-CD1 4.1Å; L147-I216 HydrophobicContact CD2-CD1 4.21Å; L147-I216 WeakPolarHBondContact O-CD1 3.38Å
148	Q	98.6	Very high	97.9	Very high	67 Å²	67	46.2 Å²	46.2	31%	0.313	23%	0.232	S	C	.	.	H	α-helix	trans	-56.1	-42.8	178.4	-171.3	59.1	57.7	0	0	112.4	L144 L150 D151 D152 M213	L144-Q148 WeakPolarHBondContact O-CB 3.45Å; L144-Q148 PolarHBondContact O-N 3.28Å; Q148-L150 VanDerWaalsContact C-N 3.31Å; Q148-L150 PolarHBondContact O-N 3.46Å; Q148-D151 WeakPolarHBondContact O-CB 3.41Å; Q148-D151 PolarHBondContact O-N 3.29Å; Q148-D152 PolarHBondContact NE2-OD1 3.36Å; Q148-D152 WeakPolarHBondContact O-CB 3.18Å; Q148-D152 PolarHBondContact O-N 3.34Å; Q148-M213 HydrophobicContact CB-CE 3.97Å
149	K	98.6	Very high	97.6	Very high	114 Å²	114	47.7 Å²	47.7	50%	0.496	24%	0.237	S	C	.	.	H	α-helix	trans	-59.2	-40.5	175	-72.9	177.5	178.3	-173.9	0	113.1	K145 L147 Y153	K145-K149 WeakPolarHBondContact O-CG 3.42Å; K145-K149 PolarHBondContact O-N 3.01Å; K145-K149 VanDerWaalsContact O-N 3.15Å; L147-K149 VanDerWaalsContact C-N 3.29Å; L147-K149 PolarHBondContact O-N 3.18Å; K149-Y153 WeakPolarHBondContact O-CB 3.33Å; K149-Y153 PolarHBondContact O-N 3.33Å
150	L	98.8	Very high	97.2	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-41.3	175.9	174.5	64.8	0	0	0	111.2	A116 I120 T146 L147 Q148 Y153 L154 L178 L190 L194 I216	A116-L150 HydrophobicContact CB-CD1 4.28Å; I120-L150 HydrophobicContact CD1-CB 3.98Å; I120-L150 HydrophobicContact CD1-CD2 3.59Å; I120-L150 HydrophobicContact CD1-CG 4.38Å; T146-L150 PolarHBondContact O-N 2.99Å; L147-L150 WeakPolarHBondContact O-CA 3.41Å; L147-L150 WeakPolarHBondContact O-CB 3.3Å; L147-L150 PolarHBondContact O-N 3.05Å; Q148-L150 VanDerWaalsContact C-N 3.31Å; Q148-L150 PolarHBondContact O-N 3.46Å; L150-Y153 PolarHBondContact O-N 3Å; L150-L154 HydrophobicContact CD1-CD1 4.04Å; L150-L154 HydrophobicContact CD1-CG 4.2Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 WeakPolarHBondContact O-CB 3.39Å; L150-L154 WeakPolarHBondContact O-CG 3.44Å; L150-L154 PolarHBondContact O-N 3.42Å; L150-L178 HydrophobicContact CD1-CD2 3.89Å; L150-L190 HydrophobicContact CD1-CD2 3.78Å; L150-L190 HydrophobicContact CD2-CD2 3.89Å; L150-L194 HydrophobicContact CD2-CD2 4.11Å; L150-I216 HydrophobicContact CB-CD1 4.39Å; L150-I216 HydrophobicContact CD2-CD1 4.28Å; L150-I216 HydrophobicContact CD2-CG1 4.27Å; L150-I216 HydrophobicContact CG-CD1 4.4Å; L150-I216 HydrophobicContact CG-CG1 4.22Å
151	D	98.6	Very high	96.8	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-45.7	176	-167.2	70.9	0	0	0	111.6	L147 Q148 Y153 L154 R155 M213 T214 S215 I216	L147-D151 PolarHBondContact O-N 3.21Å; Q148-D151 WeakPolarHBondContact O-CB 3.41Å; Q148-D151 PolarHBondContact O-N 3.29Å; D151-Y153 VanDerWaalsContact C-N 3.31Å; D151-Y153 PolarHBondContact O-N 2.87Å; D151-L154 PolarHBondContact O-N 2.98Å; D151-R155 WeakPolarHBondContact O-CB 3.35Å; D151-R155 PolarHBondContact O-N 2.79Å; D151-R155 IonicContact OD2-CZ 2.72Å; D151-R155 IonicContact OD2-NE 2.74Å; D151-R155 IonicContact OD2-NH2 2.66Å; D151-R155 PolarHBondContact OD2-NH2 3.42Å; D151-M213 HydrophobicContact CB-CB 4.19Å; D151-M213 HydrophobicContact CB-CG 4.29Å; D151-M213 VanDerWaalsContact OD1-CA 3.28Å; D151-M213 WeakPolarHBondContact OD1-CA 3.44Å; D151-T214 PolarHBondContact OD1-N 3.48Å; D151-S215 WeakPolarHBondContact O-CB 3.48Å; D151-S215 WeakPolarHBondContact OD1-CA 3.21Å; D151-S215 VanDerWaalsContact OD1-CB 3.28Å; D151-S215 WeakPolarHBondContact OD1-CB 3.48Å; D151-S215 PolarHBondContact OD1-N 2.8Å; D151-I216 HydrophobicContact CB-CD1 3.93Å; D151-I216 HydrophobicContact CB-CG1 3.82Å; D151-I216 PolarHBondContact OD1-N 3.44Å
152	D	98.3	Very high	96.2	Very high	65 Å²	65	47 Å²	47	35%	0.348	24%	0.244	S	C	.	.	H	α-helix	trans	-62.3	-39.6	177.3	-64.9	-23.8	0	0	0	111.2	Q148 R155 S156	Q148-D152 PolarHBondContact NE2-OD1 3.36Å; Q148-D152 WeakPolarHBondContact O-CB 3.18Å; Q148-D152 PolarHBondContact O-N 3.34Å; D152-R155 PolarHBondContact O-N 3.07Å; D152-R155 IonicContact OD1-NH1 3.39Å; D152-S156 WeakPolarHBondContact O-CB 3.34Å; D152-S156 PolarHBondContact O-N 2.95Å; D152-S156 PolarHBondContact O-OG 3.37Å
153	Y	98.5	Very high	95.4	Very high	31 Å²	31	50.5 Å²	50.5	12%	0.122	26%	0.257	C	S	.	.	H	α-helix	trans	-63.9	-48.6	175.1	177.6	-101.4	0	0	0	112	E112 S113 A116 K149 L150 D151 R155 S156 R175 L178	E112-Y153 HydrophobicContact CB-CE2 3.85Å; S113-Y153 WeakPolarHBondContact CA-OH 3.5Å; S113-Y153 PolarHBondContact N-OH 3.34Å; S113-Y153 PolarHBondContact OG-OH 3.35Å; A116-Y153 HydrophobicContact CB-CD1 3.51Å; A116-Y153 HydrophobicContact CB-CD2 4.49Å; A116-Y153 HydrophobicContact CB-CE1 3.71Å; A116-Y153 HydrophobicContact CB-CG 3.95Å; K149-Y153 WeakPolarHBondContact O-CB 3.33Å; K149-Y153 PolarHBondContact O-N 3.33Å; L150-Y153 PolarHBondContact O-N 3Å; D151-Y153 VanDerWaalsContact C-N 3.31Å; D151-Y153 PolarHBondContact O-N 2.87Å; Y153-R155 PolarHBondContact O-N 2.76Å; Y153-S156 PolarHBondContact O-N 3.36Å; Y153-R175 VanDerWaalsContact CE1-NH2 3.26Å; Y153-R175 PolarHBondContact O-NH2 2.86Å; Y153-L178 HydrophobicContact CD1-CD2 4.1Å; Y153-L178 HydrophobicContact CE1-CD2 3.95Å; Y153-L178 PolarHBondContact OH-O 3.05Å
154	L	98.4	Very high	94.3	Very high	5 Å²	5	58.6 Å²	58.6	3%	0.026	29%	0.294	C	S	.	.	H	α-helix	trans	-66.7	-24	177.6	-72.2	166.7	0	0	0	112.9	L150 D151 L178 I216 Y219	L150-L154 HydrophobicContact CD1-CD1 4.04Å; L150-L154 HydrophobicContact CD1-CG 4.2Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 WeakPolarHBondContact O-CB 3.39Å; L150-L154 WeakPolarHBondContact O-CG 3.44Å; L150-L154 PolarHBondContact O-N 3.42Å; D151-L154 PolarHBondContact O-N 2.98Å; L154-L178 HydrophobicContact CD2-CD2 4.04Å; L154-I216 HydrophobicContact CD1-CG1 4.17Å; L154-Y219 HydrophobicContact CD1-CD1 4.04Å; L154-Y219 HydrophobicContact CD1-CG 3.98Å; L154-Y219 HydrophobicContact CD2-CD2 4.28Å; L154-Y219 HydrophobicContact CD2-CG 4.19Å
155	R	97.3	Very high	93.3	Very high	75 Å²	75	63.6 Å²	63.6	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-79.8	-37	176.2	-172.7	-178.8	-62.8	160.9	-1.9	112.2	D151 D152 Y153 F172 S173 S215	D151-R155 WeakPolarHBondContact O-CB 3.35Å; D151-R155 PolarHBondContact O-N 2.79Å; D151-R155 IonicContact OD2-CZ 2.72Å; D151-R155 IonicContact OD2-NE 2.74Å; D151-R155 IonicContact OD2-NH2 2.66Å; D151-R155 PolarHBondContact OD2-NH2 3.42Å; D152-R155 PolarHBondContact O-N 3.07Å; D152-R155 IonicContact OD1-NH1 3.39Å; Y153-R155 PolarHBondContact O-N 2.76Å; R155-F172 HydrophobicContact CG-CD1 3.62Å; R155-F172 HydrophobicContact CG-CE1 4.16Å; R155-F172 WeakPolarHBondContact O-CA 3.38Å; R155-S173 PolarHBondContact O-N 2.71Å; R155-S215 WeakPolarHBondContact CA-OG 3.46Å; R155-S215 WeakPolarHBondContact CB-OG 3.31Å
156	S	96.5	Very high	92.4	Very high	64 Å²	64	59.1 Å²	59.1	45%	0.448	31%	0.308	S	S	.	.	S	Bend	trans	-72.4	129.5	-176.9	-59.2	0	0	0	0	110.7	D152 Y153 R175	D152-S156 WeakPolarHBondContact O-CB 3.34Å; D152-S156 PolarHBondContact O-N 2.95Å; D152-S156 PolarHBondContact O-OG 3.37Å; Y153-S156 PolarHBondContact O-N 3.36Å; S156-R175 PolarHBondContact O-NH1 3.28Å
157	P	95.3	Very high	91	Very high	31 Å²	31	67.1 Å²	67.1	20%	0.201	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-57.5	139.5	174.5	-20.9	31.1	0	0	0	111.9	E161 I162 I170	P157-E161 HydrophobicContact CB-CB 4.17Å; P157-I162 HydrophobicContact CB-CD1 4.4Å; P157-I162 HydrophobicContact CB-CG1 4.04Å; P157-I170 HydrophobicContact CB-CG2 4.27Å; P157-I170 HydrophobicContact CG-CG2 3.92Å; P157-I170 VanDerWaalsContact CG-O 3.3Å; P157-I170 WeakPolarHBondContact CG-O 3.46Å
158	L	95.3	Very high	89.9	Confident	10 Å²	10	74.6 Å²	74.6	5%	0.052	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-72.9	159	167.6	-65.3	175.3	0	0	0	110.4	D160 E161 R175 D179	L158-D160 PolarHBondContact O-N 3.46Å; L158-E161 HydrophobicContact CB-CG 4.4Å; L158-E161 PolarHBondContact N-OE2 2.89Å; L158-E161 WeakPolarHBondContact O-CB 3.38Å; L158-E161 PolarHBondContact O-N 3.22Å; L158-R175 VanDerWaalsContact CD1-CD 3.43Å; L158-D179 VanDerWaalsContact CD1-C 3.44Å; L158-D179 WeakPolarHBondContact CD1-O 3.47Å
159	P	92	Very high	88.8	Confident	84 Å²	84	77.8 Å²	77.8	55%	0.545	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-50.6	-40.7	174.8	-28.9	35.2	0	0	0	113.9	E161 I162	P159-E161 PolarHBondContact O-N 3.22Å; P159-I162 PolarHBondContact O-N 3.14Å; P159-I162 VanDerWaalsContact O-N 3.15Å
160	D	89.6	Confident	87.8	Confident	111 Å²	111	76.3 Å²	76.3	59%	0.594	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-66.7	-18.3	178.4	-70.3	-4.6	0	0	0	113.3	K109 H110 L158	K109-D160 IonicContact NZ-OD2 2.76Å; H110-D160 IonicContact CE1-OD2 3.78Å; H110-D160 IonicContact NE2-OD2 3.96Å; L158-D160 PolarHBondContact O-N 3.46Å
161	E	87.9	Confident	87.1	Confident	37 Å²	37	83.5 Å²	83.5	17%	0.173	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-88.6	-6.9	176.8	-65.1	179.8	94.9	0	0	112.5	P157 L158 P159 I170 S173 S174 R175	P157-E161 HydrophobicContact CB-CB 4.17Å; L158-E161 HydrophobicContact CB-CG 4.4Å; L158-E161 PolarHBondContact N-OE2 2.89Å; L158-E161 WeakPolarHBondContact O-CB 3.38Å; L158-E161 PolarHBondContact O-N 3.22Å; P159-E161 PolarHBondContact O-N 3.22Å; E161-I170 WeakPolarHBondContact O-CD1 3.3Å; E161-S173 PolarHBondContact OE1-OG 3.36Å; E161-S173 WeakPolarHBondContact OE2-CB 3.43Å; E161-S173 PolarHBondContact OE2-OG 2.93Å; E161-S174 PolarHBondContact OE1-N 2.97Å; E161-R175 PolarHBondContact OE1-N 3.25Å; E161-R175 IonicContact OE2-NH1 3.74Å
162	I	86.6	Confident	86.7	Confident	77 Å²	77	90.3 Å²	90.3	40%	0.395	46%	0.461	S	S	.	.			trans	-101.1	109.1	-174.4	-58.8	170.5	0	0	0	109.6	P157 P159 H164	P157-I162 HydrophobicContact CB-CD1 4.4Å; P157-I162 HydrophobicContact CB-CG1 4.04Å; P159-I162 PolarHBondContact O-N 3.14Å; P159-I162 VanDerWaalsContact O-N 3.15Å; I162-H164 PolarHBondContact O-N 3.34Å
163	D	80.8	Confident	86.6	Confident	94 Å²	94	87.7 Å²	87.7	50%	0.503	45%	0.448	S	S	.	.			trans	-88.5	103.5	168.8	-177.4	4.1	0	0	0	110.3	N165 S166	D163-N165 PolarHBondContact O-N 2.83Å; D163-N165 VanDerWaalsContact O-N 3.11Å; D163-N165 WeakPolarHBondContact OD1-CB 3.44Å; D163-N165 PolarHBondContact OD1-N 3.22Å; D163-S166 WeakPolarHBondContact O-CB 3.28Å; D163-S166 PolarHBondContact O-N 3.06Å
164	H	76.1	Confident	86.3	Confident	170 Å²	170	90.9 Å²	90.9	79%	0.787	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-12.7	177.8	-69.5	-59.1	0	0	0	114.4	I162	I162-H164 PolarHBondContact O-N 3.34Å
165	N	76.6	Confident	86.3	Confident	152 Å²	152	90.9 Å²	90.9	81%	0.813	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-4	176	-57.8	-54.7	0	0	0	113	D163	D163-N165 PolarHBondContact O-N 2.83Å; D163-N165 VanDerWaalsContact O-N 3.11Å; D163-N165 WeakPolarHBondContact OD1-CB 3.44Å; D163-N165 PolarHBondContact OD1-N 3.22Å
166	S	78.5	Confident	86.3	Confident	49 Å²	49	91.7 Å²	91.7	34%	0.343	48%	0.48	S	S	.	.			trans	-75.5	142.5	175.4	179.1	0	0	0	0	110.9	D163 E168	D163-S166 WeakPolarHBondContact O-CB 3.28Å; D163-S166 PolarHBondContact O-N 3.06Å; S166-E168 VanDerWaalsContact C-N 3.26Å; S166-E168 PolarHBondContact OG-N 3.22Å; S166-E168 VanDerWaalsContact OG-N 3.08Å; S166-E168 PolarHBondContact OG-O 3.33Å
167	I	70.4	Confident	86.4	Confident	173 Å²	173	88.8 Å²	88.8	89%	0.887	46%	0.459	S	S	*	.	S	Bend	trans	-77.5	-20.1	172.7	-54.9	173.8	0	0	0	110.4
168	E	75.6	Confident	86.6	Confident	156 Å²	156	87.3 Å²	87.3	73%	0.729	45%	0.45	S	S	*	.	S	Bend	trans	-93.4	116.3	178.9	-65.8	-172.4	178.6	0	0	111.2	S166 I170	S166-E168 VanDerWaalsContact C-N 3.26Å; S166-E168 PolarHBondContact OG-N 3.22Å; S166-E168 VanDerWaalsContact OG-N 3.08Å; S166-E168 PolarHBondContact OG-O 3.33Å; E168-I170 PolarHBondContact O-N 3.2Å
169	D	74.3	Confident	86.7	Confident	134 Å²	134	87.5 Å²	87.5	72%	0.717	45%	0.451	S	S	*	.			trans	-67.7	110.1	169	-72.4	-32.3	0	0	0	109.9	K171	D169-K171 HydrophobicContact CB-CG 4.34Å; D169-K171 PolarHBondContact O-N 3.01Å
170	I	78.8	Confident	87	Confident	83 Å²	83	84.4 Å²	84.4	43%	0.426	43%	0.434	S	S	.	.			trans	-69.7	102	169	-64.3	168.5	0	0	0	107.4	P157 E161 E168 F172	P157-I170 HydrophobicContact CB-CG2 4.27Å; P157-I170 HydrophobicContact CG-CG2 3.92Å; P157-I170 VanDerWaalsContact CG-O 3.3Å; P157-I170 WeakPolarHBondContact CG-O 3.46Å; E161-I170 WeakPolarHBondContact O-CD1 3.3Å; E168-I170 PolarHBondContact O-N 3.2Å; I170-F172 WeakPolarHBondContact CG2-O 3.26Å
171	K	83.4	Confident	87.4	Confident	152 Å²	152	82.8 Å²	82.8	66%	0.661	43%	0.425	S	S	*	.			trans	-87	-21.4	-179	-67.6	179.8	-176	178.6	0	113.4	D169	D169-K171 HydrophobicContact CB-CG 4.34Å; D169-K171 PolarHBondContact O-N 3.01Å
172	F	90.9	Very high	87.9	Confident	144 Å²	144	86.6 Å²	86.6	63%	0.632	44%	0.443	S	S	*	.	S	Bend	trans	-137	133.7	-174.4	-56.9	-65.6	0	0	0	110.4	R155 I170	R155-F172 HydrophobicContact CG-CD1 3.62Å; R155-F172 HydrophobicContact CG-CE1 4.16Å; R155-F172 WeakPolarHBondContact O-CA 3.38Å; I170-F172 WeakPolarHBondContact CG2-O 3.26Å
173	S	95.3	Very high	88.4	Confident	10 Å²	10	83.2 Å²	83.2	7%	0.07	43%	0.426	C	S	.	.			trans	-68.2	137.5	178	-178.5	0	0	0	0	111.9	R155 E161 R175 K218	R155-S173 PolarHBondContact O-N 2.71Å; E161-S173 PolarHBondContact OE1-OG 3.36Å; E161-S173 WeakPolarHBondContact OE2-CB 3.43Å; E161-S173 PolarHBondContact OE2-OG 2.93Å; S173-R175 VanDerWaalsContact CB-NH1 3.26Å; S173-R175 WeakPolarHBondContact OG-CG 3.43Å; S173-R175 PolarHBondContact OG-N 2.9Å; S173-R175 PolarHBondContact OG-NH1 3.5Å; S173-K218 PolarHBondContact O-NZ 3.39Å
174	S	93.5	Very high	89.3	Confident	98 Å²	98	79.3 Å²	79.3	69%	0.685	41%	0.405	S	S	*	.			trans	-95.9	-12.4	174.7	68.5	0	0	0	0	112.7	E161 K218	E161-S174 PolarHBondContact OE1-N 2.97Å; S174-K218 PolarHBondContact O-NZ 2.99Å
175	R	97.3	Very high	90.4	Very high	4 Å²	4	72 Å²	72	2%	0.015	37%	0.372	C	S	.	.			trans	-52.7	151.5	-174.6	83.2	-172.6	-177.9	-96.2	12.4	114.6	Y153 S156 L158 E161 S173 F177 L178 D181 K218	Y153-R175 VanDerWaalsContact CE1-NH2 3.26Å; Y153-R175 PolarHBondContact O-NH2 2.86Å; S156-R175 PolarHBondContact O-NH1 3.28Å; L158-R175 VanDerWaalsContact CD1-CD 3.43Å; E161-R175 PolarHBondContact OE1-N 3.25Å; E161-R175 IonicContact OE2-NH1 3.74Å; S173-R175 VanDerWaalsContact CB-NH1 3.26Å; S173-R175 WeakPolarHBondContact OG-CG 3.43Å; S173-R175 PolarHBondContact OG-N 2.9Å; S173-R175 PolarHBondContact OG-NH1 3.5Å; R175-F177 VanDerWaalsContact CD-O 3.28Å; R175-F177 WeakPolarHBondContact CD-O 3.43Å; R175-F177 VanDerWaalsContact CG-O 3.26Å; R175-F177 WeakPolarHBondContact CG-O 3.34Å; R175-F177 PolarHBondContact NE-O 2.97Å; R175-F177 VanDerWaalsContact NE-O 3.16Å; R175-L178 PolarHBondContact NE-O 3.36Å; R175-L178 PolarHBondContact NH2-O 3.31Å; R175-D181 WeakPolarHBondContact CA-OD1 3.47Å; R175-K218 WeakPolarHBondContact O-CE 3.18Å; R175-K218 PolarHBondContact O-NZ 2.8Å
176	K	98.3	Very high	91.4	Very high	93 Å²	93	65 Å²	65	40%	0.404	34%	0.335	S	S	.	.	S	Bend	trans	-84.3	-37.9	-178.3	-64	173	-171.4	165.6	0	114.3	G180 D181 N222	K176-G180 PolarHBondContact N-O 2.88Å; K176-D181 HydrophobicContact CD-CB 4.39Å; K176-D181 PolarHBondContact N-OD1 2.95Å; K176-N222 WeakPolarHBondContact CA-ND2 3.4Å; K176-N222 HydrophobicContact CB-CB 4.37Å; K176-N222 PolarHBondContact O-ND2 3.29Å
177	F	98.7	Very high	92.4	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.009	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-127.5	-177.6	-171	-58.3	-62	0	0	0	111.9	R175 D179 G180 D181 E182 M183 D187 Y219 N222 R226	R175-F177 VanDerWaalsContact CD-O 3.28Å; R175-F177 WeakPolarHBondContact CD-O 3.43Å; R175-F177 VanDerWaalsContact CG-O 3.26Å; R175-F177 WeakPolarHBondContact CG-O 3.34Å; R175-F177 PolarHBondContact NE-O 2.97Å; R175-F177 VanDerWaalsContact NE-O 3.16Å; F177-D179 VanDerWaalsContact C-N 3.32Å; F177-D179 PolarHBondContact O-N 3.41Å; F177-G180 WeakPolarHBondContact CA-O 3.44Å; F177-G180 PolarHBondContact N-O 3.47Å; F177-D181 VanDerWaalsContact CD2-O 3.25Å; F177-D181 WeakPolarHBondContact CD2-O 3.28Å; F177-D181 VanDerWaalsContact CE2-O 3.26Å; F177-D181 WeakPolarHBondContact CE2-O 3.48Å; F177-E182 VanDerWaalsContact CD2-C 3.44Å; F177-M183 HydrophobicContact CD1-CE 4.12Å; F177-M183 HydrophobicContact CD1-CG 3.9Å; F177-M183 HydrophobicContact CD2-CG 3.99Å; F177-M183 HydrophobicContact CE1-CE 3.46Å; F177-M183 VanDerWaalsContact CE1-CE 3.46Å; F177-M183 HydrophobicContact CE1-CG 3.87Å; F177-M183 HydrophobicContact CE2-CG 3.96Å; F177-M183 HydrophobicContact CG-CG 3.97Å; F177-M183 HydrophobicContact CZ-CE 3.87Å; F177-M183 HydrophobicContact CZ-CG 3.91Å; F177-D187 WeakPolarHBondContact CB-OD1 3.29Å; F177-Y219 HydrophobicContact CB-CE2 4.25Å; F177-Y219 HydrophobicContact CD1-CD2 4.11Å; F177-Y219 AromaticContact CD1-CE2 3.88Å; F177-Y219 HydrophobicContact CD1-CE2 3.88Å; F177-N222 HydrophobicContact CE1-CB 4.04Å; F177-N222 HydrophobicContact CZ-CB 4.3Å; F177-R226 HydrophobicContact CE1-CG 4.48Å; F177-R226 HydrophobicContact CZ-CG 3.81Å
178	L	98.6	Very high	93.7	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-44.4	-171.8	-75.2	169.1	0	0	0	112.9	A116 L150 Y153 L154 R175 A186 D187 L190 Y219	A116-L178 HydrophobicContact CB-CD2 4.05Å; L150-L178 HydrophobicContact CD1-CD2 3.89Å; Y153-L178 HydrophobicContact CD1-CD2 4.1Å; Y153-L178 HydrophobicContact CE1-CD2 3.95Å; Y153-L178 PolarHBondContact OH-O 3.05Å; L154-L178 HydrophobicContact CD2-CD2 4.04Å; R175-L178 PolarHBondContact NE-O 3.36Å; R175-L178 PolarHBondContact NH2-O 3.31Å; L178-A186 HydrophobicContact CD1-CB 3.74Å; L178-D187 VanDerWaalsContact CB-OD1 3.31Å; L178-D187 WeakPolarHBondContact CB-OD1 3.44Å; L178-D187 VanDerWaalsContact CG-OD1 3.25Å; L178-D187 WeakPolarHBondContact CG-OD1 3.36Å; L178-D187 PolarHBondContact N-OD1 3.1Å; L178-L190 HydrophobicContact CD1-CB 4.23Å; L178-L190 HydrophobicContact CD1-CD2 3.89Å; L178-L190 HydrophobicContact CD2-CD2 4.03Å; L178-L190 HydrophobicContact CG-CD2 4.42Å; L178-Y219 HydrophobicContact CG-CE2 4.27Å
179	D	98.4	Very high	94.8	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.07	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	7.4	-169.4	-159.6	64.4	0	0	0	114	A108 K109 H110 S113 L158 F177 T184	A108-D179 WeakPolarHBondContact CA-OD2 3.37Å; A108-D179 HydrophobicContact CB-CB 4.09Å; K109-D179 WeakPolarHBondContact CB-OD2 3.36Å; K109-D179 PolarHBondContact N-OD2 2.92Å; H110-D179 VanDerWaalsContact CB-OD1 3.24Å; H110-D179 WeakPolarHBondContact CB-OD1 3.4Å; H110-D179 IonicContact CE1-OD1 2.67Å; H110-D179 IonicContact CG-OD1 2.76Å; H110-D179 PolarHBondContact N-OD1 2.95Å; H110-D179 IonicContact ND1-OD1 3.7Å; H110-D179 PolarHBondContact ND1-OD1 2.82Å; H110-D179 IonicContact ND1-OD2 3.99Å; S113-D179 WeakPolarHBondContact CB-OD1 3.49Å; S113-D179 PolarHBondContact OG-OD1 3Å; L158-D179 VanDerWaalsContact CD1-C 3.44Å; L158-D179 WeakPolarHBondContact CD1-O 3.47Å; F177-D179 VanDerWaalsContact C-N 3.32Å; F177-D179 PolarHBondContact O-N 3.41Å; D179-T184 HydrophobicContact CB-CG2 3.77Å
180	G	97.9	Very high	96	Very high	19 Å²	19	42.6 Å²	42.6	20%	0.196	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	148.8	-148.4	-177.4	0	0	0	0	0	112.6	K176 F177	K176-G180 PolarHBondContact N-O 2.88Å; F177-G180 WeakPolarHBondContact CA-O 3.44Å; F177-G180 PolarHBondContact N-O 3.47Å
181	D	97.8	Very high	96.9	Very high	77 Å²	77	38.6 Å²	38.6	41%	0.412	20%	0.198	S	C	.	.	S	Bend	trans	-91.7	-9.6	-176.7	-84.5	-4.4	0	0	0	115	R175 K176 F177	R175-D181 WeakPolarHBondContact CA-OD1 3.47Å; K176-D181 HydrophobicContact CD-CB 4.39Å; K176-D181 PolarHBondContact N-OD1 2.95Å; F177-D181 VanDerWaalsContact CD2-O 3.25Å; F177-D181 WeakPolarHBondContact CD2-O 3.28Å; F177-D181 VanDerWaalsContact CE2-O 3.26Å; F177-D181 WeakPolarHBondContact CE2-O 3.48Å
182	E	97.8	Very high	97.7	Very high	118 Å²	118	31.4 Å²	31.4	55%	0.551	17%	0.166	S	C	*	.	S	Bend	trans	-113.4	150.3	174.7	-64.9	-54.2	148.3	0	0	111.7	F177 R226	F177-E182 VanDerWaalsContact CD2-C 3.44Å; E182-R226 IonicContact OE2-CZ 2.98Å; E182-R226 IonicContact OE2-NH1 3.77Å; E182-R226 PolarHBondContact OE2-NH1 2.66Å; E182-R226 IonicContact OE2-NH2 3.73Å
183	M	98.5	Very high	98	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.03	14%	0.144	C	C	.	.			trans	-70.1	140.8	176.7	-74.6	-173.8	173.7	0	0	111.2	M42 L46 F177 D187 L191 A223 R226 F229	M42-M183 HydrophobicContact CE-SD 4.07Å; L46-M183 HydrophobicContact CD1-CB 3.79Å; L46-M183 HydrophobicContact CD1-SD 4.45Å; L46-M183 HydrophobicContact CD2-CB 4.14Å; F177-M183 HydrophobicContact CD1-CE 4.12Å; F177-M183 HydrophobicContact CD1-CG 3.9Å; F177-M183 HydrophobicContact CD2-CG 3.99Å; F177-M183 HydrophobicContact CE1-CE 3.46Å; F177-M183 VanDerWaalsContact CE1-CE 3.46Å; F177-M183 HydrophobicContact CE1-CG 3.87Å; F177-M183 HydrophobicContact CE2-CG 3.96Å; F177-M183 HydrophobicContact CG-CG 3.97Å; F177-M183 HydrophobicContact CZ-CE 3.87Å; F177-M183 HydrophobicContact CZ-CG 3.91Å; M183-D187 HydrophobicContact CB-CB 4.32Å; M183-D187 HydrophobicContact CG-CB 4.29Å; M183-L191 HydrophobicContact CE-CD1 3.69Å; M183-L191 HydrophobicContact SD-CD1 4.41Å; M183-A223 HydrophobicContact CE-CB 4.06Å; M183-R226 HydrophobicContact CE-CB 3.75Å; M183-R226 HydrophobicContact CE-CG 3.8Å; M183-F229 HydrophobicContact CE-CB 4.19Å
184	T	98.7	Very high	98.2	Very high	12 Å²	12	25.8 Å²	25.8	7%	0.074	14%	0.141	C	C	.	.			trans	-119.4	177.7	178.1	64.3	0	0	0	0	111.2	L106 A108 D179 A186 D187 C188	L106-T184 CarbonylContact O-C 3.34Å; L106-T184 WeakPolarHBondContact O-CA 3.26Å; L106-T184 WeakPolarHBondContact O-CB 3.44Å; A108-T184 HydrophobicContact CB-CG2 4.48Å; D179-T184 HydrophobicContact CB-CG2 3.77Å; T184-A186 PolarHBondContact O-N 2.93Å; T184-A186 PolarHBondContact OG1-N 2.83Å; T184-D187 PolarHBondContact N-OD2 2.89Å; T184-D187 PolarHBondContact O-N 3.45Å; T184-D187 VanDerWaalsContact O-N 3.13Å; T184-D187 PolarHBondContact OG1-OD2 2.86Å; T184-C188 PolarHBondContact O-N 2.67Å; T184-C188 VanDerWaalsContact O-N 3.14Å; T184-C188 PolarHBondContact O-SG 3.46Å
185	L	98.7	Very high	98.4	Very high	16 Å²	16	21.5 Å²	21.5	8%	0.084	11%	0.11	C	C	.	.	H	α-helix	trans	-56.2	-32.4	170.6	-61.8	179.9	0	0	0	112.2	I43 E91 E95 L106 C188 N189	I43-L185 HydrophobicContact CD1-CD2 3.93Å; I43-L185 HydrophobicContact CG1-CD2 3.77Å; I43-L185 HydrophobicContact CG2-CD2 4.2Å; E91-L185 HydrophobicContact CG-CD1 3.93Å; E91-L185 HydrophobicContact CG-CD2 3.94Å; E91-L185 HydrophobicContact CG-CG 4.4Å; E95-L185 HydrophobicContact CB-CD1 4.23Å; E95-L185 HydrophobicContact CG-CD1 4.09Å; L106-L185 HydrophobicContact CB-CD2 3.74Å; L106-L185 HydrophobicContact CB-CG 3.84Å; L106-L185 HydrophobicContact CD1-CD2 4.27Å; L106-L185 PolarHBondContact O-N 3.17Å; L185-C188 PolarHBondContact O-N 2.98Å; L185-N189 WeakPolarHBondContact O-CB 3.39Å; L185-N189 PolarHBondContact O-N 3.09Å
186	A	98.6	Very high	98.5	Very high	5 Å²	5	21.4 Å²	21.4	4%	0.041	11%	0.109	C	C	.	.	H	α-helix	trans	-64.1	-41.9	177.1	0	0	0	0	0	111.7	S113 L178 T184 N189 L190	S113-A186 WeakPolarHBondContact O-CB 3.47Å; L178-A186 HydrophobicContact CD1-CB 3.74Å; T184-A186 PolarHBondContact O-N 2.93Å; T184-A186 PolarHBondContact OG1-N 2.83Å; A186-N189 PolarHBondContact O-N 2.77Å; A186-L190 WeakPolarHBondContact O-CB 3.39Å; A186-L190 PolarHBondContact O-N 2.84Å
187	D	98.8	Very high	98.5	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.2	-43.3	177.9	-54.5	-74.4	0	0	0	110.9	F177 L178 M183 T184 N189 L190 L191 Y219	F177-D187 WeakPolarHBondContact CB-OD1 3.29Å; L178-D187 VanDerWaalsContact CB-OD1 3.31Å; L178-D187 WeakPolarHBondContact CB-OD1 3.44Å; L178-D187 VanDerWaalsContact CG-OD1 3.25Å; L178-D187 WeakPolarHBondContact CG-OD1 3.36Å; L178-D187 PolarHBondContact N-OD1 3.1Å; M183-D187 HydrophobicContact CB-CB 4.32Å; M183-D187 HydrophobicContact CG-CB 4.29Å; T184-D187 PolarHBondContact N-OD2 2.89Å; T184-D187 PolarHBondContact O-N 3.45Å; T184-D187 VanDerWaalsContact O-N 3.13Å; T184-D187 PolarHBondContact OG1-OD2 2.86Å; D187-N189 PolarHBondContact O-N 3.48Å; D187-L190 PolarHBondContact O-N 2.84Å; D187-L191 HydrophobicContact CB-CD1 4.03Å; D187-L191 WeakPolarHBondContact O-CB 3.26Å; D187-L191 WeakPolarHBondContact O-CG 3.43Å; D187-L191 PolarHBondContact O-N 2.87Å; D187-Y219 VanDerWaalsContact OD1-CE2 3.28Å; D187-Y219 WeakPolarHBondContact OD1-CE2 3.36Å; D187-Y219 PolarHBondContact OD1-OH 3.28Å
188	C	98.7	Very high	98.5	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-58	-32.6	174.7	-61.1	0	0	0	0	112.4	R39 M42 I43 L46 T184 L185 P192	R39-C188 WeakPolarHBondContact CA-O 3.39Å; R39-C188 VanDerWaalsContact CB-O 3.3Å; R39-C188 WeakPolarHBondContact CB-O 3.4Å; R39-C188 HydrophobicContact CG-CB 4.19Å; R39-C188 WeakPolarHBondContact CG-O 3.24Å; M42-C188 HydrophobicContact CB-CB 4.17Å; I43-C188 HydrophobicContact CD1-CB 4.32Å; I43-C188 HydrophobicContact CG1-CB 3.84Å; L46-C188 WeakPolarHBondContact CD1-SG 3.44Å; T184-C188 PolarHBondContact O-N 2.67Å; T184-C188 VanDerWaalsContact O-N 3.14Å; T184-C188 PolarHBondContact O-SG 3.46Å; L185-C188 PolarHBondContact O-N 2.98Å; C188-P192 WeakPolarHBondContact O-CD 3.43Å; C188-P192 WeakPolarHBondContact O-CG 3.26Å
189	N	98.5	Very high	98.5	Very high	34 Å²	34	19.3 Å²	19.3	18%	0.182	10%	0.101	C	C	.	.	H	α-helix	trans	-79.6	-40.4	177.9	-176.8	28.7	0	0	0	112.9	L185 A186 D187 K193	L185-N189 WeakPolarHBondContact O-CB 3.39Å; L185-N189 PolarHBondContact O-N 3.09Å; A186-N189 PolarHBondContact O-N 2.77Å; D187-N189 PolarHBondContact O-N 3.48Å; N189-K193 WeakPolarHBondContact O-CD 3.41Å; N189-K193 PolarHBondContact OD1-NZ 3.33Å
190	L	98.8	Very high	98.5	Very high	7 Å²	7	18.7 Å²	18.7	4%	0.037	10%	0.098	C	C	.	.	H	α-helix	trans	-85.4	-43.8	-172.9	-177.6	61.8	0	0	0	113.2	I120 L150 L178 A186 D187 K193 L194 Y219	I120-L190 HydrophobicContact CD1-CD1 4.45Å; L150-L190 HydrophobicContact CD1-CD2 3.78Å; L150-L190 HydrophobicContact CD2-CD2 3.89Å; L178-L190 HydrophobicContact CD1-CB 4.23Å; L178-L190 HydrophobicContact CD1-CD2 3.89Å; L178-L190 HydrophobicContact CD2-CD2 4.03Å; L178-L190 HydrophobicContact CG-CD2 4.42Å; A186-L190 WeakPolarHBondContact O-CB 3.39Å; A186-L190 PolarHBondContact O-N 2.84Å; D187-L190 PolarHBondContact O-N 2.84Å; L190-K193 WeakPolarHBondContact O-CB 3.2Å; L190-K193 PolarHBondContact O-N 3.4Å; L190-K193 VanDerWaalsContact O-N 3.14Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 3.31Å; L190-Y219 HydrophobicContact CD2-CE1 4.18Å
191	L	98.8	Very high	98.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-58.6	-46.8	-172.1	-73.8	167.2	0	0	0	113.8	M42 M183 D187 K193 L194 H195 Y219 L220 A223 F229	M42-L191 HydrophobicContact CE-CB 4.49Å; M42-L191 HydrophobicContact CE-CD1 3.97Å; M183-L191 HydrophobicContact CE-CD1 3.69Å; M183-L191 HydrophobicContact SD-CD1 4.41Å; D187-L191 HydrophobicContact CB-CD1 4.03Å; D187-L191 WeakPolarHBondContact O-CB 3.26Å; D187-L191 WeakPolarHBondContact O-CG 3.43Å; D187-L191 PolarHBondContact O-N 2.87Å; L191-K193 VanDerWaalsContact C-N 3.27Å; L191-K193 PolarHBondContact O-N 3.08Å; L191-L194 PolarHBondContact O-N 3.45Å; L191-H195 WeakPolarHBondContact O-CB 3.48Å; L191-H195 PolarHBondContact O-N 3.47Å; L191-Y219 HydrophobicContact CD2-CD1 4.17Å; L191-Y219 HydrophobicContact CD2-CE1 3.45Å; L191-Y219 VanDerWaalsContact CD2-CE1 3.45Å; L191-Y219 HydrophobicContact CD2-CE2 4.16Å; L191-Y219 VanDerWaalsContact CD2-CZ 3.46Å; L191-Y219 HydrophobicContact CG-CE1 4.13Å; L191-Y219 VanDerWaalsContact CG-OH 3.28Å; L191-Y219 WeakPolarHBondContact CG-OH 3.25Å; L191-L220 HydrophobicContact CD2-CD2 4.44Å; L191-A223 HydrophobicContact CD1-CB 3.75Å; L191-A223 HydrophobicContact CD2-CB 3.47Å; L191-A223 VanDerWaalsContact CD2-CB 3.47Å; L191-A223 HydrophobicContact CG-CB 4.25Å; L191-F229 HydrophobicContact CB-CD2 3.84Å; L191-F229 HydrophobicContact CB-CE2 3.55Å; L191-F229 HydrophobicContact CB-CZ 4.09Å; L191-F229 HydrophobicContact CD1-CD2 4.36Å; L191-F229 HydrophobicContact CD1-CG 4.5Å
192	P	98.7	Very high	98.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.8	-41	176.6	-27.8	37.8	0	0	0	112.7	P35 Q38 M42 C188 I196	P35-P192 HydrophobicContact CB-CB 3.73Å; Q38-P192 HydrophobicContact CB-CB 3.98Å; Q38-P192 HydrophobicContact CB-CG 3.93Å; Q38-P192 HydrophobicContact CG-CB 4.15Å; Q38-P192 HydrophobicContact CG-CG 3.79Å; M42-P192 HydrophobicContact SD-CG 3.86Å; C188-P192 WeakPolarHBondContact O-CD 3.43Å; C188-P192 WeakPolarHBondContact O-CG 3.26Å; P192-I196 WeakPolarHBondContact O-CD1 3.47Å; P192-I196 VanDerWaalsContact O-CG1 3.31Å; P192-I196 WeakPolarHBondContact O-CG1 3.48Å; P192-I196 PolarHBondContact O-N 3.29Å
193	K	98.6	Very high	98.4	Very high	36 Å²	36	19.2 Å²	19.2	16%	0.157	9%	0.089	C	C	.	.	H	α-helix	trans	-67.4	-45.9	178.6	-68.4	171.4	-176.5	163.1	0	111	P35 F121 N189 L190 L191 H195 I196 V197	P35-K193 HydrophobicContact CB-CG 3.94Å; P35-K193 HydrophobicContact CG-CG 4.43Å; F121-K193 HydrophobicContact CB-CB 4.25Å; F121-K193 HydrophobicContact CB-CD 4.04Å; F121-K193 HydrophobicContact CB-CG 4.3Å; F121-K193 HydrophobicContact CD2-CB 3.58Å; F121-K193 HydrophobicContact CD2-CD 4.5Å; F121-K193 HydrophobicContact CD2-CG 3.85Å; F121-K193 HydrophobicContact CE2-CB 4.15Å; F121-K193 HydrophobicContact CE2-CG 4.26Å; F121-K193 HydrophobicContact CG-CB 4.08Å; F121-K193 HydrophobicContact CG-CD 4.19Å; F121-K193 HydrophobicContact CG-CG 3.99Å; N189-K193 WeakPolarHBondContact O-CD 3.41Å; N189-K193 PolarHBondContact OD1-NZ 3.33Å; L190-K193 WeakPolarHBondContact O-CB 3.2Å; L190-K193 PolarHBondContact O-N 3.4Å; L190-K193 VanDerWaalsContact O-N 3.14Å; L191-K193 VanDerWaalsContact C-N 3.27Å; L191-K193 PolarHBondContact O-N 3.08Å; K193-H195 VanDerWaalsContact C-N 3.32Å; K193-H195 PolarHBondContact O-N 2.92Å; K193-I196 PolarHBondContact O-N 3.24Å; K193-V197 VanDerWaalsContact O-CG2 3.25Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å; K193-V197 PolarHBondContact O-N 3.26Å
194	L	98.4	Very high	98.3	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.4	-35.3	-177.9	-169.7	61.2	0	0	0	111.9	L147 L150 L190 L191 V197 K198 I209 I216 Y219 L220	L147-L194 HydrophobicContact CD2-CD1 3.92Å; L150-L194 HydrophobicContact CD2-CD2 4.11Å; L190-L194 WeakPolarHBondContact O-CB 3.47Å; L190-L194 PolarHBondContact O-N 3.31Å; L191-L194 PolarHBondContact O-N 3.45Å; L194-V197 WeakPolarHBondContact O-CB 3.32Å; L194-V197 PolarHBondContact O-N 3.05Å; L194-K198 PolarHBondContact O-N 3.42Å; L194-I209 HydrophobicContact CD1-CD1 4.42Å; L194-I216 HydrophobicContact CD2-CG2 4.28Å; L194-Y219 HydrophobicContact CD2-CD1 4.19Å; L194-Y219 HydrophobicContact CD2-CE1 4.15Å; L194-L220 HydrophobicContact CD2-CD1 4.45Å; L194-L220 HydrophobicContact CD2-CD2 3.75Å; L194-L220 HydrophobicContact CD2-CG 4.1Å; L194-L220 HydrophobicContact CG-CD2 4.08Å
195	H	98.5	Very high	98.1	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.037	11%	0.105	C	C	.	.	H	α-helix	trans	-65.7	-45.3	174.1	-178.8	64.5	0	0	0	112.6	L191 K193 V197 K198 V199 Y224 F229 D236	L191-H195 WeakPolarHBondContact O-CB 3.48Å; L191-H195 PolarHBondContact O-N 3.47Å; K193-H195 VanDerWaalsContact C-N 3.32Å; K193-H195 PolarHBondContact O-N 2.92Å; H195-V197 VanDerWaalsContact C-N 3.3Å; H195-V197 PolarHBondContact O-N 3.31Å; H195-K198 PolarHBondContact O-N 3.08Å; H195-V199 WeakPolarHBondContact O-CG2 3.28Å; H195-V199 PolarHBondContact O-N 2.68Å; H195-Y224 AromaticContact CE1-CE1 3.99Å; H195-Y224 AromaticContact ND1-CE1 3.62Å; H195-Y224 AromaticContact ND1-CZ 3.67Å; H195-Y224 PolarHBondContact ND1-OH 2.9Å; H195-F229 HydrophobicContact CB-CZ 3.85Å; H195-D236 IonicContact CE1-OD1 3.2Å; H195-D236 IonicContact NE2-OD1 3.7Å
196	I	98.6	Very high	98	Very high	2 Å²	2	26 Å²	26	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-57.6	-45.4	172.8	-68.9	166.3	0	0	0	110.8	N33 P35 F121 F124 P192 K193 K198 V199 V200 I239 Y243	N33-I196 WeakPolarHBondContact OD1-CD1 3.22Å; P35-I196 HydrophobicContact CB-CD1 3.76Å; P35-I196 HydrophobicContact CG-CD1 3.78Å; F121-I196 HydrophobicContact CE2-CB 4.21Å; F121-I196 HydrophobicContact CE2-CD1 4.35Å; F121-I196 HydrophobicContact CE2-CG2 3.98Å; F121-I196 HydrophobicContact CZ-CG2 4.48Å; F124-I196 HydrophobicContact CE1-CG2 4Å; F124-I196 HydrophobicContact CZ-CG2 4.08Å; P192-I196 WeakPolarHBondContact O-CD1 3.47Å; P192-I196 VanDerWaalsContact O-CG1 3.31Å; P192-I196 WeakPolarHBondContact O-CG1 3.48Å; P192-I196 PolarHBondContact O-N 3.29Å; K193-I196 PolarHBondContact O-N 3.24Å; I196-K198 PolarHBondContact O-N 3.13Å; I196-V199 PolarHBondContact O-N 3.14Å; I196-V200 HydrophobicContact CG2-CG2 3.9Å; I196-V200 VanDerWaalsContact O-CB 3.28Å; I196-V200 WeakPolarHBondContact O-CB 3.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.17Å; I196-V200 PolarHBondContact O-N 2.75Å; I196-I239 HydrophobicContact CB-CG2 4.46Å; I196-I239 HydrophobicContact CG1-CD1 4.44Å; I196-I239 HydrophobicContact CG1-CG2 4.23Å; I196-I239 HydrophobicContact CG2-CG2 4.24Å; I196-Y243 HydrophobicContact CG2-CD2 4.4Å; I196-Y243 HydrophobicContact CG2-CE2 3.48Å; I196-Y243 VanDerWaalsContact CG2-CE2 3.48Å
197	V	98.5	Very high	97.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-53.5	-55.2	176.3	173	0	0	0	0	109.5	I120 F121 F124 L143 K193 L194 H195 V199 V200 T201	I120-V197 HydrophobicContact CG2-CG2 4.1Å; F121-V197 HydrophobicContact CD2-CG2 4.25Å; F124-V197 HydrophobicContact CB-CG1 4.49Å; F124-V197 HydrophobicContact CB-CG2 3.75Å; F124-V197 HydrophobicContact CD1-CG2 3.86Å; F124-V197 HydrophobicContact CD2-CB 4.35Å; F124-V197 HydrophobicContact CD2-CG1 4.23Å; F124-V197 HydrophobicContact CD2-CG2 4.05Å; F124-V197 HydrophobicContact CE1-CG2 4.48Å; F124-V197 HydrophobicContact CG-CB 4.39Å; F124-V197 HydrophobicContact CG-CG1 4.47Å; F124-V197 HydrophobicContact CG-CG2 3.61Å; L143-V197 HydrophobicContact CD1-CG1 4.5Å; K193-V197 VanDerWaalsContact O-CG2 3.25Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å; K193-V197 PolarHBondContact O-N 3.26Å; L194-V197 WeakPolarHBondContact O-CB 3.32Å; L194-V197 PolarHBondContact O-N 3.05Å; H195-V197 VanDerWaalsContact C-N 3.3Å; H195-V197 PolarHBondContact O-N 3.31Å; V197-V199 PolarHBondContact O-N 2.99Å; V197-V200 PolarHBondContact O-N 2.75Å; V197-T201 HydrophobicContact CG1-CG2 4.19Å; V197-T201 WeakPolarHBondContact O-CB 3.25Å; V197-T201 VanDerWaalsContact O-CG2 3.28Å; V197-T201 WeakPolarHBondContact O-CG2 3.31Å; V197-T201 PolarHBondContact O-N 3.17Å; V197-T201 PolarHBondContact O-OG1 3.18Å
198	K	98.3	Very high	97.7	Very high	44 Å²	44	29.8 Å²	29.8	19%	0.191	15%	0.15	C	C	.	.	H	α-helix	trans	-56	-48.9	-179.6	170	176.2	160.9	-80.2	0	113	L194 H195 I196 K202 L220 Y224	L194-K198 PolarHBondContact O-N 3.42Å; H195-K198 PolarHBondContact O-N 3.08Å; I196-K198 PolarHBondContact O-N 3.13Å; K198-K202 VanDerWaalsContact O-CB 3.22Å; K198-K202 WeakPolarHBondContact O-CB 3.45Å; K198-K202 PolarHBondContact O-N 2.82Å; K198-L220 HydrophobicContact CD-CD1 4.5Å; K198-Y224 PolarHBondContact NZ-OH 2.95Å
199	V	98.3	Very high	97.7	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.048	15%	0.151	C	C	.	.	H	α-helix	trans	-67.1	-48.5	-176.8	173	0	0	0	0	110.7	H195 I196 V197 K203 D236 I239 E240	H195-V199 WeakPolarHBondContact O-CG2 3.28Å; H195-V199 PolarHBondContact O-N 2.68Å; I196-V199 PolarHBondContact O-N 3.14Å; V197-V199 PolarHBondContact O-N 2.99Å; V199-K203 WeakPolarHBondContact O-CB 3.26Å; V199-K203 PolarHBondContact O-N 2.73Å; V199-K203 VanDerWaalsContact O-N 3.08Å; V199-D236 HydrophobicContact CG1-CB 4.19Å; V199-I239 HydrophobicContact CB-CD1 4.47Å; V199-I239 HydrophobicContact CB-CG2 4.15Å; V199-I239 HydrophobicContact CG1-CB 4.07Å; V199-I239 HydrophobicContact CG1-CG2 3.93Å; V199-I239 HydrophobicContact CG2-CD1 4.25Å; V199-E240 HydrophobicContact CG1-CG 4.14Å
200	V	98.3	Very high	97.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-72.7	-44.3	-172.7	178	0	0	0	0	111.8	F124 I128 I196 V197 K202 K203 Y204 I239 Y243	F124-V200 HydrophobicContact CE2-CB 3.89Å; F124-V200 HydrophobicContact CE2-CG1 3.85Å; F124-V200 HydrophobicContact CZ-CB 3.78Å; F124-V200 HydrophobicContact CZ-CG1 3.77Å; F124-V200 HydrophobicContact CZ-CG2 4.21Å; I128-V200 HydrophobicContact CD1-CG1 3.74Å; I128-V200 HydrophobicContact CG1-CG1 3.63Å; I196-V200 HydrophobicContact CG2-CG2 3.9Å; I196-V200 VanDerWaalsContact O-CB 3.28Å; I196-V200 WeakPolarHBondContact O-CB 3.46Å; I196-V200 WeakPolarHBondContact O-CG2 3.17Å; I196-V200 PolarHBondContact O-N 2.75Å; V197-V200 PolarHBondContact O-N 2.75Å; V200-K202 VanDerWaalsContact C-N 3.29Å; V200-K202 PolarHBondContact O-N 2.89Å; V200-K203 PolarHBondContact O-N 3.32Å; V200-Y204 HydrophobicContact CG1-CD2 3.81Å; V200-Y204 HydrophobicContact CG1-CE2 4.38Å; V200-Y204 WeakPolarHBondContact O-CD2 3.4Å; V200-Y204 PolarHBondContact O-N 3.16Å; V200-I239 HydrophobicContact CG2-CG2 3.56Å; V200-Y243 HydrophobicContact CB-CG 4.46Å; V200-Y243 HydrophobicContact CG1-CD1 3.84Å; V200-Y243 HydrophobicContact CG1-CG 3.83Å; V200-Y243 HydrophobicContact CG2-CD1 4.26Å; V200-Y243 HydrophobicContact CG2-CD2 3.54Å; V200-Y243 HydrophobicContact CG2-CE2 3.97Å; V200-Y243 HydrophobicContact CG2-CG 3.7Å
201	T	97.1	Very high	97.6	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-65.5	-36.9	-179.9	60.2	0	0	0	0	111.4	F124 Y127 L143 V197 R205 G206 F207	F124-T201 HydrophobicContact CD2-CG2 3.71Å; F124-T201 HydrophobicContact CE2-CG2 3.83Å; Y127-T201 HydrophobicContact CD1-CG2 4.35Å; Y127-T201 HydrophobicContact CE1-CG2 4.27Å; L143-T201 HydrophobicContact CD2-CG2 4.22Å; V197-T201 HydrophobicContact CG1-CG2 4.19Å; V197-T201 WeakPolarHBondContact O-CB 3.25Å; V197-T201 VanDerWaalsContact O-CG2 3.28Å; V197-T201 WeakPolarHBondContact O-CG2 3.31Å; V197-T201 PolarHBondContact O-N 3.17Å; V197-T201 PolarHBondContact O-OG1 3.18Å; T201-R205 CarbonylContact O-C 3.56Å; T201-R205 WeakPolarHBondContact O-CA 3.4Å; T201-R205 WeakPolarHBondContact O-CB 3.35Å; T201-R205 PolarHBondContact O-N 3.38Å; T201-G206 PolarHBondContact O-N 3.32Å; T201-G206 VanDerWaalsContact O-N 3.14Å; T201-F207 CarbonylContact C-O 3.6Å; T201-F207 VanDerWaalsContact C-O 3.23Å; T201-F207 WeakPolarHBondContact CB-O 3.46Å; T201-F207 HydrophobicContact CG2-CD1 4.17Å; T201-F207 PolarHBondContact O-N 3.11Å; T201-F207 PolarHBondContact OG1-O 3.22Å
202	K	97.4	Very high	97.5	Very high	115 Å²	115	44.7 Å²	44.7	50%	0.5	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-50.7	174.8	-174.9	173.9	-165.3	153.9	0	111.1	K198 V200 G206 F207 D208	K198-K202 VanDerWaalsContact O-CB 3.22Å; K198-K202 WeakPolarHBondContact O-CB 3.45Å; K198-K202 PolarHBondContact O-N 2.82Å; V200-K202 VanDerWaalsContact C-N 3.29Å; V200-K202 PolarHBondContact O-N 2.89Å; K202-G206 WeakPolarHBondContact O-CA 3.2Å; K202-G206 PolarHBondContact O-N 2.91Å; K202-G206 VanDerWaalsContact O-N 3.14Å; K202-F207 WeakPolarHBondContact CA-O 3.25Å; K202-F207 PolarHBondContact N-O 3.35Å; K202-F207 VanDerWaalsContact N-O 3.1Å; K202-D208 WeakPolarHBondContact CD-OD1 3.28Å; K202-D208 IonicContact NZ-OD1 3.33Å; K202-D208 PolarHBondContact NZ-OD1 3.3Å
203	K	97.3	Very high	97.5	Very high	111 Å²	111	45 Å²	45	48%	0.483	22%	0.221	S	C	.	.	H	α-helix	trans	-63.1	-46.3	-177.2	-179.7	57.9	167.4	-122.2	0	113.5	V199 V200 E240	V199-K203 WeakPolarHBondContact O-CB 3.26Å; V199-K203 PolarHBondContact O-N 2.73Å; V199-K203 VanDerWaalsContact O-N 3.08Å; V200-K203 PolarHBondContact O-N 3.32Å; K203-E240 HydrophobicContact CB-CG 4.16Å; K203-E240 HydrophobicContact CD-CG 4.47Å; K203-E240 WeakPolarHBondContact CD-OE1 3.45Å; K203-E240 WeakPolarHBondContact CE-OE2 3.02Å; K203-E240 HydrophobicContact CG-CG 3.88Å; K203-E240 VanDerWaalsContact NZ-CD 3.29Å; K203-E240 IonicContact NZ-OE1 3.96Å; K203-E240 PolarHBondContact NZ-OE1 3.43Å; K203-E240 IonicContact NZ-OE2 3.46Å; K203-E240 PolarHBondContact NZ-OE2 3.05Å
204	Y	96.3	Very high	97.5	Very high	67 Å²	67	47.3 Å²	47.3	26%	0.263	24%	0.238	S	C	.	.	H	α-helix	trans	-104.9	-11	-165.8	-69.4	-77.6	0	0	0	114.8	V200 E240 G244 A247	V200-Y204 HydrophobicContact CG1-CD2 3.81Å; V200-Y204 HydrophobicContact CG1-CE2 4.38Å; V200-Y204 WeakPolarHBondContact O-CD2 3.4Å; V200-Y204 PolarHBondContact O-N 3.16Å; Y204-E240 PolarHBondContact OH-O 3.3Å; Y204-G244 WeakPolarHBondContact OH-CA 3.08Å; Y204-A247 HydrophobicContact CD1-CB 3.54Å; Y204-A247 HydrophobicContact CD2-CB 3.88Å; Y204-A247 HydrophobicContact CE1-CB 3.98Å; Y204-A247 HydrophobicContact CE2-CB 4.29Å; Y204-A247 HydrophobicContact CG-CB 3.49Å; Y204-A247 VanDerWaalsContact CG-CB 3.49Å
205	R	95.3	Very high	97.5	Very high	48 Å²	48	47.9 Å²	47.9	18%	0.181	24%	0.242	C	C	.	.	H	α-helix	trans	-132	-8.2	-179.8	-62.3	-67.5	-176.3	-99.1	4.4	113.7	Y127 I128 N130 T201 F207 K248	Y127-R205 HydrophobicContact CE1-CB 4.14Å; Y127-R205 HydrophobicContact CE1-CG 3.78Å; I128-R205 HydrophobicContact CD1-CG 4.05Å; I128-R205 PolarHBondContact O-NH2 3.06Å; I128-R205 VanDerWaalsContact O-NH2 3.08Å; N130-R205 PolarHBondContact O-NH2 3.39Å; T201-R205 CarbonylContact O-C 3.56Å; T201-R205 WeakPolarHBondContact O-CA 3.4Å; T201-R205 WeakPolarHBondContact O-CB 3.35Å; T201-R205 PolarHBondContact O-N 3.38Å; R205-F207 HydrophobicContact CB-CB 4.2Å; R205-F207 PolarHBondContact O-N 3.15Å; R205-K248 VanDerWaalsContact CZ-O 3.27Å; R205-K248 PolarHBondContact NH1-O 3.05Å; R205-K248 PolarHBondContact NH2-O 3.08Å
206	G	95.3	Very high	97.4	Very high	62 Å²	62	47.5 Å²	47.5	64%	0.639	24%	0.24	S	C	*	.			trans	63.2	19.5	-172	0	0	0	0	0	112.8	T201 K202	T201-G206 PolarHBondContact O-N 3.32Å; T201-G206 VanDerWaalsContact O-N 3.14Å; K202-G206 WeakPolarHBondContact O-CA 3.2Å; K202-G206 PolarHBondContact O-N 2.91Å; K202-G206 VanDerWaalsContact O-N 3.14Å
207	F	96.3	Very high	97.4	Very high	15 Å²	15	50.1 Å²	50.1	7%	0.066	25%	0.25	C	C	.	.			trans	-93.9	119.9	179.3	173.3	-81.5	0	0	0	109.2	E140 L143 L144 L147 T201 K202 R205	E140-F207 HydrophobicContact CG-CD2 3.94Å; E140-F207 HydrophobicContact CG-CE2 3.94Å; L143-F207 HydrophobicContact CD2-CE1 4.16Å; L143-F207 HydrophobicContact CD2-CZ 4.48Å; L144-F207 HydrophobicContact CD1-CE2 4.24Å; L144-F207 HydrophobicContact CD2-CE2 3.72Å; L144-F207 HydrophobicContact CD2-CZ 3.59Å; L144-F207 HydrophobicContact CG-CE2 3.85Å; L144-F207 HydrophobicContact CG-CZ 3.97Å; L147-F207 HydrophobicContact CD1-CE1 4.22Å; L147-F207 HydrophobicContact CD1-CZ 4.17Å; T201-F207 CarbonylContact C-O 3.6Å; T201-F207 VanDerWaalsContact C-O 3.23Å; T201-F207 WeakPolarHBondContact CB-O 3.46Å; T201-F207 HydrophobicContact CG2-CD1 4.17Å; T201-F207 PolarHBondContact O-N 3.11Å; T201-F207 PolarHBondContact OG1-O 3.22Å; K202-F207 WeakPolarHBondContact CA-O 3.25Å; K202-F207 PolarHBondContact N-O 3.35Å; K202-F207 VanDerWaalsContact N-O 3.1Å; R205-F207 HydrophobicContact CB-CB 4.2Å; R205-F207 PolarHBondContact O-N 3.15Å
208	D	96.8	Very high	97.4	Very high	68 Å²	68	53.1 Å²	53.1	36%	0.364	26%	0.263	S	S	.	.			trans	-106.4	153	168.2	-78.2	-77.4	0	0	0	109.2	K202	K202-D208 WeakPolarHBondContact CD-OD1 3.28Å; K202-D208 IonicContact NZ-OD1 3.33Å; K202-D208 PolarHBondContact NZ-OD1 3.3Å
209	I	97.5	Very high	97.5	Very high	3 Å²	3	51.1 Å²	51.1	2%	0.015	25%	0.254	C	S	.	.			trans	-59.5	128.1	170.6	-60.2	174.4	0	0	0	107.8	L147 L194 K211 M213 I216 W217 L220	L147-I209 HydrophobicContact CD1-CG1 4.33Å; L147-I209 HydrophobicContact CD2-CD1 4.48Å; L194-I209 HydrophobicContact CD1-CD1 4.42Å; I209-K211 PolarHBondContact O-N 2.84Å; I209-M213 HydrophobicContact CG2-CB 4.25Å; I209-M213 HydrophobicContact CG2-SD 3.98Å; I209-I216 HydrophobicContact CD1-CG2 4.17Å; I209-I216 HydrophobicContact CG2-CG2 4.36Å; I209-W217 HydrophobicContact CB-CZ2 3.96Å; I209-W217 WeakPolarHBondContact O-CZ2 3.17Å; I209-W217 PolarHBondContact O-NE1 2.72Å; I209-L220 HydrophobicContact CD1-CD1 4.03Å
210	P	98	Very high	97.5	Very high	36 Å²	36	50.7 Å²	50.7	23%	0.234	25%	0.252	C	S	.	.			trans	-52.2	140.7	180	-27.2	34.1	0	0	0	112.2	L144 E212 M213 W217	L144-P210 HydrophobicContact CD2-CG 3.58Å; P210-E212 VanDerWaalsContact CB-OE2 3.24Å; P210-E212 WeakPolarHBondContact CB-OE2 3.5Å; P210-E212 PolarHBondContact O-N 2.66Å; P210-M213 HydrophobicContact CB-CG 4.4Å; P210-M213 HydrophobicContact CG-CE 4.2Å; P210-M213 HydrophobicContact CG-SD 4.3Å; P210-M213 PolarHBondContact O-N 3.33Å; P210-W217 PolarHBondContact O-NE1 2.97Å
211	K	97.1	Very high	97.5	Very high	175 Å²	175	55.1 Å²	55.1	76%	0.761	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.4	-177.1	-71.3	-178.2	179.4	178.8	0	112.3	I209 M213	I209-K211 PolarHBondContact O-N 2.84Å; K211-M213 PolarHBondContact O-N 3.37Å
212	E	97.4	Very high	97.6	Very high	140 Å²	140	57.1 Å²	57.1	65%	0.654	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-19.3	178.3	-56.6	71.9	-155.5	0	0	112	P210 T214	P210-E212 VanDerWaalsContact CB-OE2 3.24Å; P210-E212 WeakPolarHBondContact CB-OE2 3.5Å; P210-E212 PolarHBondContact O-N 2.66Å; E212-T214 PolarHBondContact O-N 2.94Å
213	M	98.1	Very high	97.6	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.039	26%	0.262	C	S	.	.			trans	-78.9	63.4	171.3	-64.8	179.8	177.5	0	0	110.4	L144 L147 Q148 D151 I209 P210 K211 S215 I216 W217	L144-M213 HydrophobicContact CD2-CE 4.26Å; L147-M213 HydrophobicContact CB-CE 4.03Å; L147-M213 HydrophobicContact CB-SD 3.72Å; Q148-M213 HydrophobicContact CB-CE 3.97Å; D151-M213 HydrophobicContact CB-CB 4.19Å; D151-M213 HydrophobicContact CB-CG 4.29Å; D151-M213 VanDerWaalsContact OD1-CA 3.28Å; D151-M213 WeakPolarHBondContact OD1-CA 3.44Å; I209-M213 HydrophobicContact CG2-CB 4.25Å; I209-M213 HydrophobicContact CG2-SD 3.98Å; P210-M213 HydrophobicContact CB-CG 4.4Å; P210-M213 HydrophobicContact CG-CE 4.2Å; P210-M213 HydrophobicContact CG-SD 4.3Å; P210-M213 PolarHBondContact O-N 3.33Å; K211-M213 PolarHBondContact O-N 3.37Å; M213-S215 VanDerWaalsContact C-N 3.28Å; M213-S215 PolarHBondContact O-N 2.87Å; M213-I216 HydrophobicContact CB-CB 4.46Å; M213-I216 HydrophobicContact CB-CD1 4.27Å; M213-I216 PolarHBondContact O-N 3.31Å; M213-I216 HydrophobicContact SD-CD1 4.07Å; M213-W217 PolarHBondContact O-N 3.04Å
214	T	98	Very high	97.6	Very high	84 Å²	84	49.3 Å²	49.3	52%	0.515	25%	0.251	S	S	.	.	H	α-helix	trans	-63.9	-30.1	-170.4	55.2	0	0	0	0	113.3	D151 E212 W217 K218	D151-T214 PolarHBondContact OD1-N 3.48Å; E212-T214 PolarHBondContact O-N 2.94Å; T214-W217 PolarHBondContact O-N 3.32Å; T214-K218 WeakPolarHBondContact O-CB 3.41Å; T214-K218 PolarHBondContact O-N 2.87Å
215	S	98.4	Very high	97.7	Very high	11 Å²	11	51.5 Å²	51.5	8%	0.077	27%	0.271	C	S	.	.	H	α-helix	trans	-73.7	-38.4	-179.7	-59.7	0	0	0	0	111.6	D151 R155 M213 W217 K218 Y219	D151-S215 WeakPolarHBondContact O-CB 3.48Å; D151-S215 WeakPolarHBondContact OD1-CA 3.21Å; D151-S215 VanDerWaalsContact OD1-CB 3.28Å; D151-S215 WeakPolarHBondContact OD1-CB 3.48Å; D151-S215 PolarHBondContact OD1-N 2.8Å; R155-S215 WeakPolarHBondContact CA-OG 3.46Å; R155-S215 WeakPolarHBondContact CB-OG 3.31Å; M213-S215 VanDerWaalsContact C-N 3.28Å; M213-S215 PolarHBondContact O-N 2.87Å; S215-W217 VanDerWaalsContact C-N 3.34Å; S215-K218 PolarHBondContact O-N 3.05Å; S215-Y219 WeakPolarHBondContact O-CB 3.45Å; S215-Y219 PolarHBondContact O-N 3.23Å
216	I	98.3	Very high	97.9	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.4	-44	170.7	-65.2	178.8	0	0	0	110.6	L147 L150 D151 L154 L194 I209 M213 Y219 L220	L147-I216 HydrophobicContact CB-CD1 4.1Å; L147-I216 HydrophobicContact CD2-CD1 4.21Å; L147-I216 WeakPolarHBondContact O-CD1 3.38Å; L150-I216 HydrophobicContact CB-CD1 4.39Å; L150-I216 HydrophobicContact CD2-CD1 4.28Å; L150-I216 HydrophobicContact CD2-CG1 4.27Å; L150-I216 HydrophobicContact CG-CD1 4.4Å; L150-I216 HydrophobicContact CG-CG1 4.22Å; D151-I216 HydrophobicContact CB-CD1 3.93Å; D151-I216 HydrophobicContact CB-CG1 3.82Å; D151-I216 PolarHBondContact OD1-N 3.44Å; L154-I216 HydrophobicContact CD1-CG1 4.17Å; L194-I216 HydrophobicContact CD2-CG2 4.28Å; I209-I216 HydrophobicContact CD1-CG2 4.17Å; I209-I216 HydrophobicContact CG2-CG2 4.36Å; M213-I216 HydrophobicContact CB-CB 4.46Å; M213-I216 HydrophobicContact CB-CD1 4.27Å; M213-I216 PolarHBondContact O-N 3.31Å; M213-I216 HydrophobicContact SD-CD1 4.07Å; I216-Y219 WeakPolarHBondContact O-CB 3.48Å; I216-Y219 PolarHBondContact O-N 3.3Å; I216-L220 HydrophobicContact CG2-CD1 3.91Å; I216-L220 HydrophobicContact CG2-CG 4.24Å; I216-L220 WeakPolarHBondContact O-CB 3.41Å; I216-L220 WeakPolarHBondContact O-CG 3.46Å; I216-L220 PolarHBondContact O-N 3.3Å
217	W	98.4	Very high	98	Very high	57 Å²	57	54.6 Å²	54.6	22%	0.216	27%	0.269	C	S	.	.	H	α-helix	trans	-63.7	-41.1	177.8	-77	113.2	0	0	0	111.9	I209 P210 M213 T214 S215 Y219 L220 N221	I209-W217 HydrophobicContact CB-CZ2 3.96Å; I209-W217 WeakPolarHBondContact O-CZ2 3.17Å; I209-W217 PolarHBondContact O-NE1 2.72Å; P210-W217 PolarHBondContact O-NE1 2.97Å; M213-W217 PolarHBondContact O-N 3.04Å; T214-W217 PolarHBondContact O-N 3.32Å; S215-W217 VanDerWaalsContact C-N 3.34Å; W217-Y219 PolarHBondContact O-N 3.21Å; W217-L220 HydrophobicContact CE3-CD1 4.42Å; W217-L220 PolarHBondContact O-N 2.87Å; W217-N221 VanDerWaalsContact O-CB 3.26Å; W217-N221 WeakPolarHBondContact O-CB 3.37Å; W217-N221 PolarHBondContact O-N 2.95Å; W217-N221 PolarHBondContact O-ND2 3.23Å
218	K	98.5	Very high	98.1	Very high	64 Å²	64	55.3 Å²	55.3	28%	0.278	27%	0.272	S	S	.	.	H	α-helix	trans	-56.3	-50.2	171.7	-176.8	-176.8	63.9	157.4	0	110.9	S173 S174 R175 T214 S215 N221 N222	S173-K218 PolarHBondContact O-NZ 3.39Å; S174-K218 PolarHBondContact O-NZ 2.99Å; R175-K218 WeakPolarHBondContact O-CE 3.18Å; R175-K218 PolarHBondContact O-NZ 2.8Å; T214-K218 WeakPolarHBondContact O-CB 3.41Å; T214-K218 PolarHBondContact O-N 2.87Å; S215-K218 PolarHBondContact O-N 3.05Å; K218-N221 PolarHBondContact O-N 2.89Å; K218-N222 WeakPolarHBondContact O-CB 3.47Å; K218-N222 PolarHBondContact O-N 2.86Å; K218-N222 PolarHBondContact O-ND2 2.83Å
219	Y	98.8	Very high	98.1	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-49.3	179	174.3	-122.9	0	0	0	112.8	L154 F177 L178 D187 L190 L191 L194 S215 I216 W217 N221 N222 A223	L154-Y219 HydrophobicContact CD1-CD1 4.04Å; L154-Y219 HydrophobicContact CD1-CG 3.98Å; L154-Y219 HydrophobicContact CD2-CD2 4.28Å; L154-Y219 HydrophobicContact CD2-CG 4.19Å; F177-Y219 HydrophobicContact CB-CE2 4.25Å; F177-Y219 HydrophobicContact CD1-CD2 4.11Å; F177-Y219 AromaticContact CD1-CE2 3.88Å; F177-Y219 HydrophobicContact CD1-CE2 3.88Å; L178-Y219 HydrophobicContact CG-CE2 4.27Å; D187-Y219 VanDerWaalsContact OD1-CE2 3.28Å; D187-Y219 WeakPolarHBondContact OD1-CE2 3.36Å; D187-Y219 PolarHBondContact OD1-OH 3.28Å; L190-Y219 HydrophobicContact CD2-CE1 4.18Å; L191-Y219 HydrophobicContact CD2-CD1 4.17Å; L191-Y219 HydrophobicContact CD2-CE1 3.45Å; L191-Y219 VanDerWaalsContact CD2-CE1 3.45Å; L191-Y219 HydrophobicContact CD2-CE2 4.16Å; L191-Y219 VanDerWaalsContact CD2-CZ 3.46Å; L191-Y219 HydrophobicContact CG-CE1 4.13Å; L191-Y219 VanDerWaalsContact CG-OH 3.28Å; L191-Y219 WeakPolarHBondContact CG-OH 3.25Å; L194-Y219 HydrophobicContact CD2-CD1 4.19Å; L194-Y219 HydrophobicContact CD2-CE1 4.15Å; S215-Y219 WeakPolarHBondContact O-CB 3.45Å; S215-Y219 PolarHBondContact O-N 3.23Å; I216-Y219 WeakPolarHBondContact O-CB 3.48Å; I216-Y219 PolarHBondContact O-N 3.3Å; W217-Y219 PolarHBondContact O-N 3.21Å; Y219-N221 PolarHBondContact O-N 3.41Å; Y219-N222 PolarHBondContact O-N 3.4Å; Y219-A223 WeakPolarHBondContact O-CB 3.48Å; Y219-A223 PolarHBondContact O-N 3.26Å
220	L	98.6	Very high	98.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-62.1	-44.3	177.3	-77.3	176.1	0	0	0	111.9	L191 L194 K198 I209 I216 W217 N222 A223 Y224	L191-L220 HydrophobicContact CD2-CD2 4.44Å; L194-L220 HydrophobicContact CD2-CD1 4.45Å; L194-L220 HydrophobicContact CD2-CD2 3.75Å; L194-L220 HydrophobicContact CD2-CG 4.1Å; L194-L220 HydrophobicContact CG-CD2 4.08Å; K198-L220 HydrophobicContact CD-CD1 4.5Å; I209-L220 HydrophobicContact CD1-CD1 4.03Å; I216-L220 HydrophobicContact CG2-CD1 3.91Å; I216-L220 HydrophobicContact CG2-CG 4.24Å; I216-L220 WeakPolarHBondContact O-CB 3.41Å; I216-L220 WeakPolarHBondContact O-CG 3.46Å; I216-L220 PolarHBondContact O-N 3.3Å; W217-L220 HydrophobicContact CE3-CD1 4.42Å; W217-L220 PolarHBondContact O-N 2.87Å; L220-N222 VanDerWaalsContact C-N 3.35Å; L220-N222 PolarHBondContact O-N 2.94Å; L220-A223 PolarHBondContact O-N 3.02Å; L220-Y224 HydrophobicContact CB-CD2 4.33Å; L220-Y224 HydrophobicContact CB-CE2 3.96Å; L220-Y224 HydrophobicContact CD2-CE2 4.31Å; L220-Y224 WeakPolarHBondContact O-CD2 3.43Å; L220-Y224 PolarHBondContact O-N 3.36Å
221	N	98.4	Very high	98.1	Very high	92 Å²	92	56.7 Å²	56.7	49%	0.492	28%	0.28	S	S	.	.	H	α-helix	trans	-63.5	-41.8	179.6	-70.1	-18.7	0	0	0	111.3	W217 K218 Y219 A223 Y224 T225	W217-N221 VanDerWaalsContact O-CB 3.26Å; W217-N221 WeakPolarHBondContact O-CB 3.37Å; W217-N221 PolarHBondContact O-N 2.95Å; W217-N221 PolarHBondContact O-ND2 3.23Å; K218-N221 PolarHBondContact O-N 2.89Å; Y219-N221 PolarHBondContact O-N 3.41Å; N221-A223 VanDerWaalsContact C-N 3.34Å; N221-Y224 PolarHBondContact O-N 3.45Å; N221-T225 WeakPolarHBondContact O-CG2 3.21Å; N221-T225 PolarHBondContact O-N 3.12Å
222	N	98.6	Very high	98.1	Very high	42 Å²	42	48.4 Å²	48.4	23%	0.225	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-38.6	172.9	-72.2	-32.4	0	0	0	112	K176 F177 K218 Y219 L220 T225 R226	K176-N222 WeakPolarHBondContact CA-ND2 3.4Å; K176-N222 HydrophobicContact CB-CB 4.37Å; K176-N222 PolarHBondContact O-ND2 3.29Å; F177-N222 HydrophobicContact CE1-CB 4.04Å; F177-N222 HydrophobicContact CZ-CB 4.3Å; K218-N222 WeakPolarHBondContact O-CB 3.47Å; K218-N222 PolarHBondContact O-N 2.86Å; K218-N222 PolarHBondContact O-ND2 2.83Å; Y219-N222 PolarHBondContact O-N 3.4Å; L220-N222 VanDerWaalsContact C-N 3.35Å; L220-N222 PolarHBondContact O-N 2.94Å; N222-T225 PolarHBondContact O-N 2.95Å; N222-T225 PolarHBondContact O-OG1 2.73Å; N222-R226 WeakPolarHBondContact O-CG 3.17Å
223	A	98.4	Very high	98.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-66.5	-39.8	176	0	0	0	0	0	112.1	M183 L191 Y219 L220 N221 T225 R226 F229	M183-A223 HydrophobicContact CE-CB 4.06Å; L191-A223 HydrophobicContact CD1-CB 3.75Å; L191-A223 HydrophobicContact CD2-CB 3.47Å; L191-A223 VanDerWaalsContact CD2-CB 3.47Å; L191-A223 HydrophobicContact CG-CB 4.25Å; Y219-A223 WeakPolarHBondContact O-CB 3.48Å; Y219-A223 PolarHBondContact O-N 3.26Å; L220-A223 PolarHBondContact O-N 3.02Å; N221-A223 VanDerWaalsContact C-N 3.34Å; A223-T225 PolarHBondContact O-N 3.17Å; A223-R226 WeakPolarHBondContact O-CB 3.49Å; A223-R226 PolarHBondContact O-N 2.79Å; A223-F229 HydrophobicContact CB-CD1 3.84Å; A223-F229 HydrophobicContact CB-CE1 4.21Å; A223-F229 HydrophobicContact CB-CG 4.36Å; A223-F229 WeakPolarHBondContact O-CD1 3.39Å
224	Y	98.3	Very high	98	Very high	63 Å²	63	42.9 Å²	42.9	25%	0.247	22%	0.221	C	C	.	.	H	α-helix	trans	-70.2	-9.2	178	-68.4	-56.4	0	0	0	114.2	H195 K198 L220 N221 F229 T230	H195-Y224 AromaticContact CE1-CE1 3.99Å; H195-Y224 AromaticContact ND1-CE1 3.62Å; H195-Y224 AromaticContact ND1-CZ 3.67Å; H195-Y224 PolarHBondContact ND1-OH 2.9Å; K198-Y224 PolarHBondContact NZ-OH 2.95Å; L220-Y224 HydrophobicContact CB-CD2 4.33Å; L220-Y224 HydrophobicContact CB-CE2 3.96Å; L220-Y224 HydrophobicContact CD2-CE2 4.31Å; L220-Y224 WeakPolarHBondContact O-CD2 3.43Å; L220-Y224 PolarHBondContact O-N 3.36Å; N221-Y224 PolarHBondContact O-N 3.45Å; Y224-F229 HydrophobicContact CD1-CD1 4.07Å; Y224-F229 AromaticContact CD1-CE1 3.62Å; Y224-F229 HydrophobicContact CD1-CE1 3.62Å; Y224-F229 HydrophobicContact CE1-CD1 4.39Å; Y224-F229 AromaticContact CE1-CE1 3.5Å; Y224-F229 HydrophobicContact CE1-CE1 3.5Å; Y224-F229 HydrophobicContact CE1-CZ 4.29Å; Y224-F229 HydrophobicContact CG-CE1 4.48Å; Y224-T230 WeakPolarHBondContact O-CG2 3.35Å
225	T	98.1	Very high	97.9	Very high	112 Å²	112	42 Å²	42	69%	0.687	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-4.6	169.7	61.5	0	0	0	0	113	N221 N222 A223	N221-T225 WeakPolarHBondContact O-CG2 3.21Å; N221-T225 PolarHBondContact O-N 3.12Å; N222-T225 PolarHBondContact O-N 2.95Å; N222-T225 PolarHBondContact O-OG1 2.73Å; A223-T225 PolarHBondContact O-N 3.17Å
226	R	98.1	Very high	97.9	Very high	54 Å²	54	45.4 Å²	45.4	20%	0.204	24%	0.236	C	C	.	.			trans	-96.2	127.2	-179.9	-66.5	-65.3	-66.8	-111.5	6	110.7	F177 E182 M183 N222 A223 E228 F229 T230	F177-R226 HydrophobicContact CE1-CG 4.48Å; F177-R226 HydrophobicContact CZ-CG 3.81Å; E182-R226 IonicContact OE2-CZ 2.98Å; E182-R226 IonicContact OE2-NH1 3.77Å; E182-R226 PolarHBondContact OE2-NH1 2.66Å; E182-R226 IonicContact OE2-NH2 3.73Å; M183-R226 HydrophobicContact CE-CB 3.75Å; M183-R226 HydrophobicContact CE-CG 3.8Å; N222-R226 WeakPolarHBondContact O-CG 3.17Å; A223-R226 WeakPolarHBondContact O-CB 3.49Å; A223-R226 PolarHBondContact O-N 2.79Å; R226-E228 WeakPolarHBondContact CB-OE2 3.2Å; R226-E228 IonicContact CZ-OE1 2.68Å; R226-E228 IonicContact CZ-OE2 3.84Å; R226-E228 IonicContact NE-OE1 3.77Å; R226-E228 PolarHBondContact NE-OE1 2.91Å; R226-E228 IonicContact NE-OE2 2.77Å; R226-E228 PolarHBondContact NE-OE2 2.92Å; R226-E228 IonicContact NH2-OE1 3Å; R226-E228 PolarHBondContact NH2-OE1 2.89Å; R226-E228 IonicContact NH2-OE2 3.78Å; R226-E228 PolarHBondContact O-N 2.74Å; R226-F229 PolarHBondContact O-N 3.4Å; R226-T230 PolarHBondContact O-N 2.93Å; R226-T230 PolarHBondContact O-OG1 3.31Å
227	E	97.9	Very high	97.9	Very high	122 Å²	122	52.3 Å²	52.3	57%	0.57	27%	0.266	S	S	*	.	H	α-helix	trans	-63.6	-34.8	179.1	-68.7	-172.5	176.4	0	0	111.4	W45 F229 T230 N231	W45-E227 HydrophobicContact CZ2-CB 4.5Å; E227-F229 PolarHBondContact O-N 3.26Å; E227-T230 WeakPolarHBondContact CA-OG1 3.45Å; E227-T230 PolarHBondContact O-N 2.72Å; E227-N231 VanDerWaalsContact O-CB 3.28Å; E227-N231 WeakPolarHBondContact O-CB 3.42Å; E227-N231 PolarHBondContact O-N 2.96Å
228	E	97.8	Very high	97.8	Very high	30 Å²	30	50.5 Å²	50.5	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-31.4	-179.9	-53.8	95.8	143.4	0	0	111.5	M42 W45 L46 R226 T232	M42-E228 WeakPolarHBondContact CG-O 3.36Å; W45-E228 HydrophobicContact CB-CB 4.5Å; W45-E228 HydrophobicContact CB-CG 4.44Å; W45-E228 HydrophobicContact CG-CB 4.27Å; W45-E228 HydrophobicContact CG-CG 3.97Å; L46-E228 HydrophobicContact CD2-CB 4.18Å; L46-E228 HydrophobicContact CD2-CG 3.74Å; L46-E228 HydrophobicContact CG-CB 4.24Å; L46-E228 HydrophobicContact CG-CG 4.12Å; R226-E228 WeakPolarHBondContact CB-OE2 3.2Å; R226-E228 IonicContact CZ-OE1 2.68Å; R226-E228 IonicContact CZ-OE2 3.84Å; R226-E228 IonicContact NE-OE1 3.77Å; R226-E228 PolarHBondContact NE-OE1 2.91Å; R226-E228 IonicContact NE-OE2 2.77Å; R226-E228 PolarHBondContact NE-OE2 2.92Å; R226-E228 IonicContact NH2-OE1 3Å; R226-E228 PolarHBondContact NH2-OE1 2.89Å; R226-E228 IonicContact NH2-OE2 3.78Å; R226-E228 PolarHBondContact O-N 2.74Å; E228-T232 WeakPolarHBondContact O-CG2 3.25Å; E228-T232 PolarHBondContact O-OG1 2.59Å
229	F	98.4	Very high	97.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-91.2	-50.2	175.6	179.9	-118.9	0	0	0	112.5	Q38 M42 M183 L191 H195 A223 Y224 R226 E227 T232 C233	Q38-F229 PolarHBondContact NE2-O 3.34Å; M42-F229 HydrophobicContact CE-CB 4.02Å; M42-F229 HydrophobicContact CE-CD2 3.84Å; M42-F229 HydrophobicContact CE-CG 4.37Å; M42-F229 HydrophobicContact SD-CD2 3.83Å; M183-F229 HydrophobicContact CE-CB 4.19Å; L191-F229 HydrophobicContact CB-CD2 3.84Å; L191-F229 HydrophobicContact CB-CE2 3.55Å; L191-F229 HydrophobicContact CB-CZ 4.09Å; L191-F229 HydrophobicContact CD1-CD2 4.36Å; L191-F229 HydrophobicContact CD1-CG 4.5Å; H195-F229 HydrophobicContact CB-CZ 3.85Å; A223-F229 HydrophobicContact CB-CD1 3.84Å; A223-F229 HydrophobicContact CB-CE1 4.21Å; A223-F229 HydrophobicContact CB-CG 4.36Å; A223-F229 WeakPolarHBondContact O-CD1 3.39Å; Y224-F229 HydrophobicContact CD1-CD1 4.07Å; Y224-F229 AromaticContact CD1-CE1 3.62Å; Y224-F229 HydrophobicContact CD1-CE1 3.62Å; Y224-F229 HydrophobicContact CE1-CD1 4.39Å; Y224-F229 AromaticContact CE1-CE1 3.5Å; Y224-F229 HydrophobicContact CE1-CE1 3.5Å; Y224-F229 HydrophobicContact CE1-CZ 4.29Å; Y224-F229 HydrophobicContact CG-CE1 4.48Å; R226-F229 PolarHBondContact O-N 3.4Å; E227-F229 PolarHBondContact O-N 3.26Å; F229-T232 PolarHBondContact O-N 3.2Å; F229-T232 PolarHBondContact O-OG1 2.78Å; F229-C233 PolarHBondContact O-N 2.97Å; F229-C233 VanDerWaalsContact O-N 3.16Å; F229-C233 PolarHBondContact O-SG 2.71Å
230	T	97.6	Very high	97.7	Very high	50 Å²	50	49.6 Å²	49.6	31%	0.307	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-40.9	-173.5	48.4	0	0	0	0	113.6	Y224 R226 E227 T232 C233	Y224-T230 WeakPolarHBondContact O-CG2 3.35Å; R226-T230 PolarHBondContact O-N 2.93Å; R226-T230 PolarHBondContact O-OG1 3.31Å; E227-T230 WeakPolarHBondContact CA-OG1 3.45Å; E227-T230 PolarHBondContact O-N 2.72Å; T230-T232 VanDerWaalsContact C-N 3.25Å; T230-T232 PolarHBondContact O-N 3.21Å; T230-C233 PolarHBondContact O-N 3.43Å
231	N	96.9	Very high	97.6	Very high	86 Å²	86	53.4 Å²	53.4	46%	0.46	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.8	-179.6	-65.9	-26.5	0	0	0	113.1	W45 E227	W45-N231 HydrophobicContact CH2-CB 3.6Å; W45-N231 HydrophobicContact CZ3-CB 3.82Å; E227-N231 VanDerWaalsContact O-CB 3.28Å; E227-N231 WeakPolarHBondContact O-CB 3.42Å; E227-N231 PolarHBondContact O-N 2.96Å
232	T	97.2	Very high	97.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-10.7	175.6	64.4	0	0	0	0	112.7	Q38 F41 M42 W45 E228 F229 T230	Q38-T232 WeakPolarHBondContact CG-O 3.41Å; Q38-T232 WeakPolarHBondContact CG-OG1 3.43Å; Q38-T232 PolarHBondContact NE2-OG1 3Å; F41-T232 HydrophobicContact CB-CG2 3.98Å; F41-T232 HydrophobicContact CD1-CG2 3.71Å; F41-T232 HydrophobicContact CD2-CG2 3.66Å; F41-T232 HydrophobicContact CE1-CG2 4.03Å; F41-T232 HydrophobicContact CE2-CG2 3.98Å; F41-T232 HydrophobicContact CG-CG2 3.5Å; F41-T232 HydrophobicContact CZ-CG2 4.14Å; M42-T232 HydrophobicContact CG-CG2 4.45Å; M42-T232 WeakPolarHBondContact CG-OG1 3.49Å; W45-T232 HydrophobicContact CE3-CG2 3.79Å; W45-T232 HydrophobicContact CZ3-CG2 4.14Å; E228-T232 WeakPolarHBondContact O-CG2 3.25Å; E228-T232 PolarHBondContact O-OG1 2.59Å; F229-T232 PolarHBondContact O-N 3.2Å; F229-T232 PolarHBondContact O-OG1 2.78Å; T230-T232 VanDerWaalsContact C-N 3.25Å; T230-T232 PolarHBondContact O-N 3.21Å
233	C	96.8	Very high	97.3	Very high	26 Å²	26	50.3 Å²	50.3	18%	0.176	26%	0.264	C	S	.	.	S	Bend	trans	-67.3	134.1	174.6	-79.3	0	0	0	0	111.2	Q38 F229 T230	Q38-C233 PolarHBondContact NE2-SG 3.35Å; F229-C233 PolarHBondContact O-N 2.97Å; F229-C233 VanDerWaalsContact O-N 3.16Å; F229-C233 PolarHBondContact O-SG 2.71Å; T230-C233 PolarHBondContact O-N 3.43Å
234	P	96.6	Very high	97.1	Very high	7 Å²	7	51.9 Å²	51.9	5%	0.045	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-65.6	161.7	160.7	31.4	-34.6	0	0	0	109.8	I31 E238 I239	I31-P234 HydrophobicContact CG2-CB 4.31Å; I31-P234 WeakPolarHBondContact O-CB 3.31Å; P234-E238 HydrophobicContact CB-CB 4.33Å; P234-I239 HydrophobicContact CB-CG1 4.48Å; P234-I239 HydrophobicContact CG-CD1 4.01Å; P234-I239 HydrophobicContact CG-CG1 3.73Å
235	S	96.9	Very high	96.6	Very high	66 Å²	66	56.5 Å²	56.5	46%	0.462	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-64	149.2	174.2	75	0	0	0	0	111.7	K237 E238 I239	S235-K237 PolarHBondContact O-N 3.31Å; S235-K237 VanDerWaalsContact O-N 3.13Å; S235-E238 WeakPolarHBondContact O-CB 3.5Å; S235-E238 PolarHBondContact O-N 2.99Å; S235-E238 WeakPolarHBondContact OG-CG 3.24Å; S235-E238 PolarHBondContact OG-N 2.89Å; S235-I239 PolarHBondContact O-N 2.76Å; S235-I239 VanDerWaalsContact O-N 3.15Å
236	D	97.6	Very high	96.3	Very high	82 Å²	82	53.8 Å²	53.8	44%	0.439	29%	0.293	S	S	.	.	H	α-helix	trans	-52	-39.4	175.2	-77.9	12.6	0	0	0	111.4	H195 V199 E238 I239 E240	H195-D236 IonicContact CE1-OD1 3.2Å; H195-D236 IonicContact NE2-OD1 3.7Å; V199-D236 HydrophobicContact CG1-CB 4.19Å; D236-E238 VanDerWaalsContact C-N 3.35Å; D236-E238 PolarHBondContact O-N 3.19Å; D236-I239 WeakPolarHBondContact O-CB 3.35Å; D236-I239 PolarHBondContact O-N 2.67Å; D236-E240 VanDerWaalsContact O-CG 3.31Å; D236-E240 WeakPolarHBondContact O-CG 3.27Å; D236-E240 PolarHBondContact O-N 2.75Å
237	K	97.1	Very high	95.8	Very high	145 Å²	145	51.7 Å²	51.7	63%	0.63	29%	0.286	S	S	*	.	H	α-helix	trans	-60.8	-40.2	177.5	-173.7	178.3	178	-175.1	0	112.6	S235 E240 I241	S235-K237 PolarHBondContact O-N 3.31Å; S235-K237 VanDerWaalsContact O-N 3.13Å; K237-E240 PolarHBondContact O-N 2.89Å; K237-I241 HydrophobicContact CG-CD1 3.91Å; K237-I241 HydrophobicContact CG-CG1 4.49Å; K237-I241 WeakPolarHBondContact O-CB 3.3Å; K237-I241 WeakPolarHBondContact O-CD1 3.22Å; K237-I241 WeakPolarHBondContact O-CG1 3.36Å; K237-I241 PolarHBondContact O-N 2.72Å
238	E	97.2	Very high	95	Very high	19 Å²	19	51.1 Å²	51.1	9%	0.089	28%	0.282	C	S	.	.	H	α-helix	trans	-67.6	-37.5	176.3	-76.6	-60	133.5	0	0	112.1	G25 S26 P234 S235 D236 A242	G25-E238 WeakPolarHBondContact CA-OE2 3.42Å; S26-E238 WeakPolarHBondContact CB-OE1 3.45Å; S26-E238 PolarHBondContact N-OE1 3.14Å; S26-E238 PolarHBondContact N-OE2 3.21Å; S26-E238 PolarHBondContact OG-OE1 3.29Å; P234-E238 HydrophobicContact CB-CB 4.33Å; S235-E238 WeakPolarHBondContact O-CB 3.5Å; S235-E238 PolarHBondContact O-N 2.99Å; S235-E238 WeakPolarHBondContact OG-CG 3.24Å; S235-E238 PolarHBondContact OG-N 2.89Å; D236-E238 VanDerWaalsContact C-N 3.35Å; D236-E238 PolarHBondContact O-N 3.19Å; E238-A242 WeakPolarHBondContact O-CB 3.29Å; E238-A242 PolarHBondContact O-N 3.06Å
239	I	97.9	Very high	94.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-47.3	173.6	-59.9	173.3	0	0	0	110.1	N33 I196 V199 V200 P234 S235 D236 A242 Y243	N33-I239 HydrophobicContact CB-CG1 4.5Å; I196-I239 HydrophobicContact CB-CG2 4.46Å; I196-I239 HydrophobicContact CG1-CD1 4.44Å; I196-I239 HydrophobicContact CG1-CG2 4.23Å; I196-I239 HydrophobicContact CG2-CG2 4.24Å; V199-I239 HydrophobicContact CB-CD1 4.47Å; V199-I239 HydrophobicContact CB-CG2 4.15Å; V199-I239 HydrophobicContact CG1-CB 4.07Å; V199-I239 HydrophobicContact CG1-CG2 3.93Å; V199-I239 HydrophobicContact CG2-CD1 4.25Å; V200-I239 HydrophobicContact CG2-CG2 3.56Å; P234-I239 HydrophobicContact CB-CG1 4.48Å; P234-I239 HydrophobicContact CG-CD1 4.01Å; P234-I239 HydrophobicContact CG-CG1 3.73Å; S235-I239 PolarHBondContact O-N 2.76Å; S235-I239 VanDerWaalsContact O-N 3.15Å; D236-I239 WeakPolarHBondContact O-CB 3.35Å; D236-I239 PolarHBondContact O-N 2.67Å; I239-A242 PolarHBondContact O-N 3.35Å; I239-Y243 HydrophobicContact CG2-CD2 4.47Å; I239-Y243 WeakPolarHBondContact O-CD2 3.29Å; I239-Y243 PolarHBondContact O-N 2.91Å
240	E	97.4	Very high	93.4	Very high	46 Å²	46	63 Å²	63	22%	0.215	33%	0.33	C	S	.	.	H	α-helix	trans	-58.5	-53.1	177.3	-68.9	-178.9	169.6	0	0	111.3	V199 K203 Y204 D236 K237 A242 Y243 G244	V199-E240 HydrophobicContact CG1-CG 4.14Å; K203-E240 HydrophobicContact CB-CG 4.16Å; K203-E240 HydrophobicContact CD-CG 4.47Å; K203-E240 WeakPolarHBondContact CD-OE1 3.45Å; K203-E240 WeakPolarHBondContact CE-OE2 3.02Å; K203-E240 HydrophobicContact CG-CG 3.88Å; K203-E240 VanDerWaalsContact NZ-CD 3.29Å; K203-E240 IonicContact NZ-OE1 3.96Å; K203-E240 PolarHBondContact NZ-OE1 3.43Å; K203-E240 IonicContact NZ-OE2 3.46Å; K203-E240 PolarHBondContact NZ-OE2 3.05Å; Y204-E240 PolarHBondContact OH-O 3.3Å; D236-E240 VanDerWaalsContact O-CG 3.31Å; D236-E240 WeakPolarHBondContact O-CG 3.27Å; D236-E240 PolarHBondContact O-N 2.75Å; K237-E240 PolarHBondContact O-N 2.89Å; E240-A242 VanDerWaalsContact C-N 3.27Å; E240-A242 PolarHBondContact O-N 3.26Å; E240-Y243 CarbonylContact O-C 3.58Å; E240-Y243 PolarHBondContact O-N 2.93Å; E240-G244 PolarHBondContact O-N 2.88Å
241	I	95.8	Very high	92.2	Very high	80 Å²	80	65.6 Å²	65.6	41%	0.41	35%	0.346	S	S	.	.	H	α-helix	trans	-54.1	-45.5	179.2	-71.4	165.9	0	0	0	110.9	K237 Y243 G244	K237-I241 HydrophobicContact CG-CD1 3.91Å; K237-I241 HydrophobicContact CG-CG1 4.49Å; K237-I241 WeakPolarHBondContact O-CB 3.3Å; K237-I241 WeakPolarHBondContact O-CD1 3.22Å; K237-I241 WeakPolarHBondContact O-CG1 3.36Å; K237-I241 PolarHBondContact O-N 2.72Å; I241-Y243 PolarHBondContact O-N 3.25Å; I241-G244 PolarHBondContact O-N 3.15Å; I241-G244 VanDerWaalsContact O-N 3.14Å
242	A	95	Very high	90.2	Very high	45 Å²	45	73.9 Å²	73.9	37%	0.372	38%	0.378	S	S	.	.	H	α-helix	trans	-64.1	-22.4	-178.8	0	0	0	0	0	114.1	N33 E238 I239 E240	N33-A242 HydrophobicContact CB-CB 3.58Å; N33-A242 VanDerWaalsContact ND2-CB 3.31Å; N33-A242 WeakPolarHBondContact ND2-CB 3.36Å; E238-A242 WeakPolarHBondContact O-CB 3.29Å; E238-A242 PolarHBondContact O-N 3.06Å; I239-A242 PolarHBondContact O-N 3.35Å; E240-A242 VanDerWaalsContact C-N 3.27Å; E240-A242 PolarHBondContact O-N 3.26Å
243	Y	96.3	Very high	89.9	Confident	23 Å²	23	77.6 Å²	77.6	9%	0.09	40%	0.397	C	S	.	.	H	α-helix	trans	-101	-6.4	176.8	-81.9	-95.9	0	0	0	113.9	N33 F121 F124 I128 I196 V200 I239 E240 I241 D245 V246 A247	N33-Y243 WeakPolarHBondContact ND2-CE2 3.43Å; F121-Y243 WeakPolarHBondContact CZ-OH 3.42Å; F124-Y243 AromaticContact CE1-CE1 3.76Å; F124-Y243 HydrophobicContact CE1-CE1 3.76Å; F124-Y243 AromaticContact CE1-CZ 3.87Å; F124-Y243 HydrophobicContact CZ-CD1 4.25Å; F124-Y243 AromaticContact CZ-CE1 3.68Å; F124-Y243 HydrophobicContact CZ-CE1 3.68Å; I128-Y243 HydrophobicContact CG2-CD1 4.44Å; I128-Y243 HydrophobicContact CG2-CE1 4.38Å; I196-Y243 HydrophobicContact CG2-CD2 4.4Å; I196-Y243 HydrophobicContact CG2-CE2 3.48Å; I196-Y243 VanDerWaalsContact CG2-CE2 3.48Å; V200-Y243 HydrophobicContact CB-CG 4.46Å; V200-Y243 HydrophobicContact CG1-CD1 3.84Å; V200-Y243 HydrophobicContact CG1-CG 3.83Å; V200-Y243 HydrophobicContact CG2-CD1 4.26Å; V200-Y243 HydrophobicContact CG2-CD2 3.54Å; V200-Y243 HydrophobicContact CG2-CE2 3.97Å; V200-Y243 HydrophobicContact CG2-CG 3.7Å; I239-Y243 HydrophobicContact CG2-CD2 4.47Å; I239-Y243 WeakPolarHBondContact O-CD2 3.29Å; I239-Y243 PolarHBondContact O-N 2.91Å; E240-Y243 CarbonylContact O-C 3.58Å; E240-Y243 PolarHBondContact O-N 2.93Å; I241-Y243 PolarHBondContact O-N 3.25Å; Y243-D245 VanDerWaalsContact C-N 3.3Å; Y243-D245 PolarHBondContact O-N 3.49Å; Y243-V246 HydrophobicContact CD1-CG2 3.66Å; Y243-V246 HydrophobicContact CE1-CG2 4.38Å; Y243-V246 HydrophobicContact CG-CG2 4.22Å; Y243-V246 WeakPolarHBondContact O-CG2 3.42Å; Y243-V246 PolarHBondContact O-N 3.15Å; Y243-V246 VanDerWaalsContact O-N 3.12Å; Y243-A247 WeakPolarHBondContact O-CB 3.41Å; Y243-A247 PolarHBondContact O-N 3.2Å
244	G	93.8	Very high	89.5	Confident	33 Å²	33	80.3 Å²	80.3	34%	0.34	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-41.5	-175	0	0	0	0	0	114.7	Y204 E240 I241	Y204-G244 WeakPolarHBondContact OH-CA 3.08Å; E240-G244 PolarHBondContact O-N 2.88Å; I241-G244 PolarHBondContact O-N 3.15Å; I241-G244 VanDerWaalsContact O-N 3.14Å
245	D	88.9	Confident	89.1	Confident	160 Å²	160	84.4 Å²	84.4	86%	0.856	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-27.7	-178.1	-64.1	-27.1	0	0	0	113.3	Y243	Y243-D245 VanDerWaalsContact C-N 3.3Å; Y243-D245 PolarHBondContact O-N 3.49Å
246	V	90.2	Very high	88.7	Confident	56 Å²	56	85.5 Å²	85.5	34%	0.339	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-22.1	-174.6	-63	0	0	0	0	113.1	K129 Y243 K248	K129-V246 HydrophobicContact CG-CB 4.39Å; Y243-V246 HydrophobicContact CD1-CG2 3.66Å; Y243-V246 HydrophobicContact CE1-CG2 4.38Å; Y243-V246 HydrophobicContact CG-CG2 4.22Å; Y243-V246 WeakPolarHBondContact O-CG2 3.42Å; Y243-V246 PolarHBondContact O-N 3.15Å; Y243-V246 VanDerWaalsContact O-N 3.12Å; V246-K248 PolarHBondContact O-N 3.11Å
247	A	88.9	Confident	88.1	Confident	9 Å²	9	85.7 Å²	85.7	7%	0.074	43%	0.426	C	S	.	.	S	Bend	trans	-76.1	73.8	174.5	0	0	0	0	0	110.2	I128 Y204 Y243	I128-A247 HydrophobicContact CD1-CB 4.03Å; I128-A247 HydrophobicContact CG1-CB 3.94Å; Y204-A247 HydrophobicContact CD1-CB 3.54Å; Y204-A247 HydrophobicContact CD2-CB 3.88Å; Y204-A247 HydrophobicContact CE1-CB 3.98Å; Y204-A247 HydrophobicContact CE2-CB 4.29Å; Y204-A247 HydrophobicContact CG-CB 3.49Å; Y204-A247 VanDerWaalsContact CG-CB 3.49Å; Y243-A247 WeakPolarHBondContact O-CB 3.41Å; Y243-A247 PolarHBondContact O-N 3.2Å
248	K	80.5	Confident	87.5	Confident	110 Å²	110	81.7 Å²	81.7	48%	0.478	41%	0.412	S	S	.	.			trans	-59.3	142.6	-175.3	-64.1	-173.3	-179.1	179.7	0	110.9	R205 V246	R205-K248 VanDerWaalsContact CZ-O 3.27Å; R205-K248 PolarHBondContact NH1-O 3.05Å; R205-K248 PolarHBondContact NH2-O 3.08Å; V246-K248 PolarHBondContact O-N 3.11Å
249	R	80.8	Confident	86.8	Confident	215 Å²	215	86.2 Å²	86.2	81%	0.811	44%	0.435	S	S	*	.			trans	-69.9	143.3	171.3	-65.8	-177.7	-178.3	175.8	0.7	109.5	V251	R249-V251 HydrophobicContact CB-CG2 4.24Å; R249-V251 PolarHBondContact O-N 2.9Å
250	L	81.9	Confident	86	Confident	66 Å²	66	92.8 Å²	92.8	35%	0.346	47%	0.469	S	S	.	.			trans	-77.7	97.9	167.7	-61.1	174.9	0	0	0	106.9	P133 N136	P133-L250 HydrophobicContact CG-CB 4.49Å; N136-L250 HydrophobicContact CB-CD1 4.12Å; N136-L250 HydrophobicContact CB-CD2 4.31Å; N136-L250 WeakPolarHBondContact OD1-CD1 3.38Å
251	V	72.9	Confident	85	Confident	104 Å²	104	96.8 Å²	96.8	63%	0.63	49%	0.49	S	S	*	.			trans	-91.9	126.9	176.5	-171.1	0	0	0	0	107.2	P133 R249	P133-V251 VanDerWaalsContact CG-O 3.24Å; P133-V251 WeakPolarHBondContact CG-O 3.47Å; R249-V251 HydrophobicContact CB-CG2 4.24Å; R249-V251 PolarHBondContact O-N 2.9Å
252	K	54.9	Low	84	Confident	260 Å²	260	98.3 Å²	98.3	100%	1.13	50%	0.497	S	S	*	.			trans	-72.6	0	171.9	-80.7	-174.1	176	-178.7	0	110.7

Retrieved 252 of 252 residues in 49.1 ms (Link to these results)

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