A0A060WAT0_ONCMY 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 A0A060WAT0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 252 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	39.8	Very low	171 Å²	171	127.1 Å²	127.1	84%	0.842	72%	0.715	S	S	*	*				0	126.2	0	-78.2	176.7	-99.1	0	0	107.9	L3 E29	M1-L3 PolarHBondContact O-N 2.71Å; M1-E29 WeakPolarHBondContact CE-OE2 3.42Å
2	S	31.9	Very low	41	Very low	97 Å²	97	121.4 Å²	121.4	68%	0.678	70%	0.696	S	S	*	*			trans	-70.2	121.8	178.3	41.2	0	0	0	0	109.6	S4	S2-S4 PolarHBondContact O-N 3.14Å; S2-S4 VanDerWaalsContact O-N 3.11Å
3	L	37.2	Very low	42.2	Very low	106 Å²	106	125.2 Å²	125.2	56%	0.555	71%	0.712	S	S	*	*			trans	-74.4	100	167.5	-70.8	167.5	0	0	0	107.1	M1 V5 I31	M1-L3 PolarHBondContact O-N 2.71Å; L3-V5 PolarHBondContact O-N 2.8Å; L3-I31 HydrophobicContact CD1-CD1 4.33Å; L3-I31 HydrophobicContact CD1-CG1 4.42Å
4	S	35.8	Very low	44.2	Very low	103 Å²	103	127.3 Å²	127.3	72%	0.72	72%	0.72	S	S	*	*			trans	-75.5	106.6	172.6	53.4	0	0	0	0	109.4	S2	S2-S4 PolarHBondContact O-N 3.14Å; S2-S4 VanDerWaalsContact O-N 3.11Å
5	V	44.5	Very low	46.7	Very low	49 Å²	49	123.7 Å²	123.7	30%	0.297	70%	0.695	S	S	.	*			trans	-64.8	149	166.2	-177.9	0	0	0	0	108.5	L3 Q7 W45	L3-V5 PolarHBondContact O-N 2.8Å; V5-Q7 PolarHBondContact O-N 3.14Å; V5-W45 HydrophobicContact CG1-CH2 4.44Å; V5-W45 HydrophobicContact CG2-CZ3 4.41Å
6	P	37.2	Very low	49.4	Very low	107 Å²	107	117.3 Å²	117.3	70%	0.695	66%	0.661	S	S	*	*			trans	-55.2	124.7	-172.5	-24.9	33.4	0	0	0	112.8	N8	P6-N8 PolarHBondContact O-N 2.93Å
7	Q	44.8	Very low	52.1	Low	181 Å²	181	116.3 Å²	116.3	85%	0.846	66%	0.657	S	S	*	*			trans	-75.1	91.7	171.5	-73.7	-175.4	-8.2	0	0	109.5	V5	V5-Q7 PolarHBondContact O-N 3.14Å
8	N	45.6	Very low	54.7	Low	148 Å²	148	110.1 Å²	110.1	79%	0.791	62%	0.622	S	S	*	*			trans	-88.7	109.1	159.2	-85.3	-13.4	0	0	0	109	P6	P6-N8 PolarHBondContact O-N 2.93Å
9	G	42.7	Very low	56.9	Low	69 Å²	69	107.2 Å²	107.2	71%	0.711	60%	0.603	S	S	*	*	S	Bend	trans	105	137.6	153.3	0	0	0	0	0	116.6	K11	G9-K11 PolarHBondContact O-N 3.4Å
10	I	40.3	Very low	59	Low	165 Å²	165	101.8 Å²	101.8	85%	0.846	57%	0.573	S	S	*	*			trans	-41.5	126	174.9	-61.8	162.5	0	0	0	111.5	A12	I10-A12 PolarHBondContact O-N 2.82Å
11	K	44.4	Very low	60.8	Low	202 Å²	202	97 Å²	97	88%	0.878	55%	0.546	S	S	*	.			trans	-56.3	103.8	169.3	-83.9	-176.4	174.7	-177.3	0	109.3	G9	G9-K11 PolarHBondContact O-N 3.4Å
12	A	54.5	Low	63.8	Low	59 Å²	59	89 Å²	89	49%	0.488	51%	0.506	S	S	.	.			trans	-72.3	139.5	161	0	0	0	0	0	108	I10 N14 E15	I10-A12 PolarHBondContact O-N 2.82Å; A12-N14 PolarHBondContact O-N 3.34Å; A12-E15 HydrophobicContact CB-CG 4.29Å; A12-E15 PolarHBondContact O-N 3.07Å
13	D	56.7	Low	66.8	Low	170 Å²	170	87.8 Å²	87.8	91%	0.909	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	6	-171.9	-140	12.4	0	0	0	115
14	N	70.3	Confident	69.5	Low	155 Å²	155	83.1 Å²	83.1	83%	0.829	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.1	13.1	-173.4	-82.4	-18.8	0	0	0	114.3	A12	A12-N14 PolarHBondContact O-N 3.34Å
15	E	81.1	Confident	72.4	Confident	74 Å²	74	78.7 Å²	78.7	35%	0.346	44%	0.436	S	S	.	.			trans	-81.3	137	175.1	-59.9	-143.5	130.1	0	0	112.1	A12 V17 K102	A12-E15 HydrophobicContact CB-CG 4.29Å; A12-E15 PolarHBondContact O-N 3.07Å; E15-V17 PolarHBondContact O-N 2.98Å; E15-K102 IonicContact OE1-NZ 3.78Å; E15-K102 PolarHBondContact OE1-NZ 3.46Å
16	P	90.6	Very high	74.7	Confident	21 Å²	21	80 Å²	80	14%	0.136	45%	0.447	C	S	.	.			trans	-65.1	137.5	-179.6	28.2	-34.3	0	0	0	110.6	I18 V49 F79 N80 L98	P16-I18 HydrophobicContact CB-CD1 4.38Å; P16-I18 HydrophobicContact CB-CG1 4.11Å; P16-I18 HydrophobicContact CG-CD1 4.12Å; P16-I18 HydrophobicContact CG-CG1 4.32Å; P16-I18 PolarHBondContact O-N 3.07Å; P16-V49 HydrophobicContact CG-CG2 4.26Å; P16-F79 HydrophobicContact CB-CD2 4.48Å; P16-F79 HydrophobicContact CB-CE1 3.85Å; P16-F79 HydrophobicContact CB-CE2 3.68Å; P16-F79 HydrophobicContact CB-CZ 3.3Å; P16-F79 HydrophobicContact CG-CE2 4.18Å; P16-F79 HydrophobicContact CG-CZ 3.98Å; P16-N80 VanDerWaalsContact CA-OD1 3.31Å; P16-N80 WeakPolarHBondContact CA-OD1 3.44Å; P16-L98 HydrophobicContact CG-CD2 4.21Å
17	V	95.5	Very high	77.4	Confident	100 Å²	100	79.5 Å²	79.5	61%	0.606	44%	0.439	S	S	*	.			trans	-86.1	108.7	171.9	-178.4	0	0	0	0	107.9	E15 N80	E15-V17 PolarHBondContact O-N 2.98Å; V17-N80 PolarHBondContact N-OD1 3.11Å; V17-N80 PolarHBondContact O-N 3.33Å
18	I	97.7	Very high	79.6	Confident	4 Å²	4	71.8 Å²	71.8	2%	0.021	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129	-177.8	-50.9	179.3	0	0	0	109.4	P16 L44 V49 F51 N52 T78 F79 L98	P16-I18 HydrophobicContact CB-CD1 4.38Å; P16-I18 HydrophobicContact CB-CG1 4.11Å; P16-I18 HydrophobicContact CG-CD1 4.12Å; P16-I18 HydrophobicContact CG-CG1 4.32Å; P16-I18 PolarHBondContact O-N 3.07Å; I18-L44 HydrophobicContact CD1-CD2 4.12Å; I18-L44 HydrophobicContact CG2-CD1 4.06Å; I18-L44 HydrophobicContact CG2-CD2 4Å; I18-V49 HydrophobicContact CD1-CB 4.46Å; I18-V49 HydrophobicContact CD1-CG1 3.92Å; I18-V49 HydrophobicContact CD1-CG2 3.73Å; I18-F51 HydrophobicContact CB-CB 3.8Å; I18-F51 HydrophobicContact CG2-CB 3.96Å; I18-F51 VanDerWaalsContact O-CA 3.29Å; I18-F51 WeakPolarHBondContact O-CA 3.31Å; I18-F51 WeakPolarHBondContact O-CB 3.49Å; I18-N52 PolarHBondContact O-N 3.2Å; I18-T78 WeakPolarHBondContact CA-O 3.3Å; I18-F79 HydrophobicContact CD1-CD2 3.92Å; I18-F79 HydrophobicContact CD1-CE2 3.69Å; I18-F79 HydrophobicContact CG1-CD2 3.72Å; I18-F79 HydrophobicContact CG1-CE2 3.85Å; I18-L98 HydrophobicContact CD1-CD1 4.18Å; I18-L98 HydrophobicContact CD1-CD2 4.49Å
19	E	97.5	Very high	81.7	Confident	55 Å²	55	69.6 Å²	69.6	26%	0.257	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	126.2	169	-169.7	176.2	-176.8	0	0	109.7	F21 N52 T54 I77 T78	E19-F21 HydrophobicContact CB-CE2 3.94Å; E19-F21 HydrophobicContact CB-CZ 4.16Å; E19-F21 HydrophobicContact CG-CD2 4.45Å; E19-F21 HydrophobicContact CG-CE1 4.15Å; E19-F21 HydrophobicContact CG-CE2 3.76Å; E19-F21 HydrophobicContact CG-CZ 3.61Å; E19-F21 WeakPolarHBondContact OE1-CE1 3.37Å; E19-F21 WeakPolarHBondContact OE1-CZ 3.36Å; E19-F21 WeakPolarHBondContact OE2-CZ 3.25Å; E19-N52 WeakPolarHBondContact CA-O 3.39Å; E19-N52 HydrophobicContact CG-CB 4.11Å; E19-T54 WeakPolarHBondContact OE1-CB 3.46Å; E19-T54 PolarHBondContact OE1-OG1 3.24Å; E19-I77 CarbonylContact O-C 3.55Å; E19-I77 WeakPolarHBondContact O-CA 3.46Å; E19-I77 WeakPolarHBondContact O-CB 3.21Å; E19-T78 WeakPolarHBondContact CB-OG1 3.47Å; E19-T78 PolarHBondContact N-O 2.8Å; E19-T78 VanDerWaalsContact N-O 3.08Å; E19-T78 PolarHBondContact O-N 3.3Å
20	L	97.9	Very high	84.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	124.3	176.7	174	66.4	0	0	0	109.7	V22 L40 F41 L44 F51 N52 V53 T54 I77	L20-V22 HydrophobicContact CD1-CG1 4.28Å; L20-V22 HydrophobicContact CD2-CG1 3.7Å; L20-V22 HydrophobicContact CG-CG1 3.67Å; L20-L40 HydrophobicContact CD1-CB 3.93Å; L20-L40 HydrophobicContact CD1-CD1 4.34Å; L20-F41 HydrophobicContact CD2-CB 3.62Å; L20-F41 HydrophobicContact CD2-CD1 4.48Å; L20-F41 HydrophobicContact CD2-CD2 4.29Å; L20-F41 HydrophobicContact CD2-CG 3.89Å; L20-L44 HydrophobicContact CB-CD1 3.99Å; L20-L44 HydrophobicContact CD2-CD1 4.28Å; L20-F51 HydrophobicContact CB-CD2 4.29Å; L20-F51 HydrophobicContact CD2-CE2 4.43Å; L20-N52 PolarHBondContact N-O 2.94Å; L20-V53 HydrophobicContact CB-CG2 4.49Å; L20-V53 HydrophobicContact CD2-CG2 4.46Å; L20-V53 WeakPolarHBondContact O-CA 3.05Å; L20-T54 PolarHBondContact O-N 2.94Å; L20-I77 HydrophobicContact CB-CG2 4.4Å; L20-I77 HydrophobicContact CD1-CG2 3.6Å
21	F	96.8	Very high	86.8	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.009	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	111.1	176.2	-61.5	-89.6	0	0	0	109.6	E19 T54 V56 L65 L68 P75 F76 T78	E19-F21 HydrophobicContact CB-CE2 3.94Å; E19-F21 HydrophobicContact CB-CZ 4.16Å; E19-F21 HydrophobicContact CG-CD2 4.45Å; E19-F21 HydrophobicContact CG-CE1 4.15Å; E19-F21 HydrophobicContact CG-CE2 3.76Å; E19-F21 HydrophobicContact CG-CZ 3.61Å; E19-F21 WeakPolarHBondContact OE1-CE1 3.37Å; E19-F21 WeakPolarHBondContact OE1-CZ 3.36Å; E19-F21 WeakPolarHBondContact OE2-CZ 3.25Å; F21-T54 CarbonylContact C-O 3.46Å; F21-T54 VanDerWaalsContact CA-O 3.32Å; F21-T54 WeakPolarHBondContact CA-O 3.41Å; F21-T54 HydrophobicContact CD1-CG2 3.76Å; F21-T54 HydrophobicContact CE1-CG2 3.84Å; F21-V56 HydrophobicContact CB-CG2 3.98Å; F21-V56 HydrophobicContact CD1-CG2 4.1Å; F21-L65 HydrophobicContact CD1-CD2 3.68Å; F21-L65 HydrophobicContact CE1-CD2 3.36Å; F21-L65 HydrophobicContact CZ-CD2 4.27Å; F21-L68 HydrophobicContact CE1-CD2 4.16Å; F21-L68 HydrophobicContact CE2-CD2 4.05Å; F21-L68 HydrophobicContact CZ-CD2 3.55Å; F21-P75 VanDerWaalsContact O-CA 3.3Å; F21-P75 WeakPolarHBondContact O-CA 3.39Å; F21-F76 HydrophobicContact CB-CD1 3.91Å; F21-F76 HydrophobicContact CB-CD2 3.98Å; F21-F76 HydrophobicContact CB-CE1 3.57Å; F21-F76 HydrophobicContact CB-CE2 3.66Å; F21-F76 HydrophobicContact CB-CG 4.09Å; F21-F76 HydrophobicContact CB-CZ 3.43Å; F21-F76 VanDerWaalsContact CB-CZ 3.43Å; F21-F76 HydrophobicContact CD1-CE2 4.04Å; F21-F76 AromaticContact CD1-CZ 3.87Å; F21-F76 HydrophobicContact CD1-CZ 3.87Å; F21-F76 AromaticContact CD2-CD2 3.51Å; F21-F76 HydrophobicContact CD2-CD2 3.51Å; F21-F76 AromaticContact CD2-CE2 3.14Å; F21-F76 HydrophobicContact CD2-CE2 3.14Å; F21-F76 HydrophobicContact CD2-CG 4.39Å; F21-F76 AromaticContact CD2-CZ 3.78Å; F21-F76 HydrophobicContact CD2-CZ 3.78Å; F21-F76 HydrophobicContact CE2-CD2 4.26Å; F21-F76 AromaticContact CE2-CE2 3.73Å; F21-F76 HydrophobicContact CE2-CE2 3.73Å; F21-F76 AromaticContact CG-CD2 3.93Å; F21-F76 HydrophobicContact CG-CD2 3.93Å; F21-F76 HydrophobicContact CG-CE1 4.08Å; F21-F76 AromaticContact CG-CE2 3.31Å; F21-F76 HydrophobicContact CG-CE2 3.31Å; F21-F76 AromaticContact CG-CZ 3.39Å; F21-F76 HydrophobicContact CG-CZ 3.39Å; F21-F76 HydrophobicContact CZ-CE2 4.36Å; F21-F76 PolarHBondContact N-O 3.13Å; F21-F76 PolarHBondContact O-N 2.89Å; F21-T78 HydrophobicContact CE2-CG2 3.72Å; F21-T78 HydrophobicContact CZ-CG2 4.34Å
22	V	96.6	Very high	89.2	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	159.3	-178.6	-58.3	0	0	0	0	111	L20 A24 V53 T54 T55 V56	L20-V22 HydrophobicContact CD1-CG1 4.28Å; L20-V22 HydrophobicContact CD2-CG1 3.7Å; L20-V22 HydrophobicContact CG-CG1 3.67Å; V22-A24 PolarHBondContact O-N 3.32Å; V22-V53 HydrophobicContact CG1-CG1 4.18Å; V22-V53 HydrophobicContact CG2-CG1 3.79Å; V22-T54 PolarHBondContact N-O 3.37Å; V22-T55 HydrophobicContact CG2-CG2 3.7Å; V22-T55 CarbonylContact O-C 3.57Å; V22-T55 WeakPolarHBondContact O-CA 3.21Å; V22-V56 PolarHBondContact O-N 2.91Å
23	K	94.6	Very high	91.2	Very high	73 Å²	73	49.9 Å²	49.9	32%	0.317	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	130.4	174.1	-175.1	-179.5	172.5	-174.4	0	110.2	G32 C34 S37 L58 P74	K23-G32 WeakPolarHBondContact O-CA 3.34Å; K23-G32 PolarHBondContact O-N 3.21Å; K23-C34 HydrophobicContact CB-CB 4.01Å; K23-C34 HydrophobicContact CD-CB 4.34Å; K23-S37 PolarHBondContact N-OG 3.48Å; K23-L58 HydrophobicContact CD-CD1 4.45Å; K23-L58 HydrophobicContact CG-CD1 4.42Å; K23-P74 HydrophobicContact CB-CG 4.1Å
24	A	95.3	Very high	93.2	Very high	8 Å²	8	42.6 Å²	42.6	7%	0.066	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-71.6	153.9	171.9	0	0	0	0	0	112.3	V22 S30 V56 D57	V22-A24 PolarHBondContact O-N 3.32Å; A24-S30 CarbonylContact C-O 3.49Å; A24-S30 VanDerWaalsContact CA-O 3.32Å; A24-S30 WeakPolarHBondContact CA-O 3.3Å; A24-V56 VanDerWaalsContact CB-C 3.47Å; A24-V56 WeakPolarHBondContact CB-O 3.25Å; A24-V56 PolarHBondContact N-O 3.46Å; A24-D57 HydrophobicContact CB-CB 4.35Å
25	G	95.1	Very high	94.5	Very high	10 Å²	10	35.8 Å²	35.8	10%	0.103	20%	0.204	C	C	.	.			trans	-70.2	-177	173.6	0	0	0	0	0	113.2	D27 G28 S30 G32 E238	G25-D27 PolarHBondContact O-N 3.23Å; G25-G28 PolarHBondContact O-N 3Å; G25-S30 PolarHBondContact N-O 3.24Å; G25-G32 VanDerWaalsContact CA-CA 3.49Å; G25-E238 WeakPolarHBondContact CA-OE2 3.44Å
26	S	93.4	Very high	95.3	Very high	76 Å²	76	36.5 Å²	36.5	53%	0.531	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.1	-179.1	71.7	0	0	0	0	113.6	G28 E238	S26-G28 VanDerWaalsContact C-N 3.33Å; S26-E238 WeakPolarHBondContact CB-OE1 3.42Å; S26-E238 PolarHBondContact N-OE1 3.26Å; S26-E238 PolarHBondContact N-OE2 2.94Å; S26-E238 PolarHBondContact OG-OE1 2.86Å
27	D	92.9	Very high	95.6	Very high	96 Å²	96	35.6 Å²	35.6	51%	0.513	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-10.2	173.7	64	2.4	0	0	0	113.9	G25 E29 S30	G25-D27 PolarHBondContact O-N 3.23Å; D27-E29 VanDerWaalsContact C-N 3.27Å; D27-E29 PolarHBondContact OD1-N 3.22Å; D27-S30 PolarHBondContact OD1-N 3.15Å; D27-S30 PolarHBondContact OD1-OG 2.96Å; D27-S30 WeakPolarHBondContact OD2-CB 3.39Å
28	G	91.4	Very high	95.7	Very high	19 Å²	19	31.2 Å²	31.2	20%	0.196	17%	0.174	C	C	.	.	S	Bend	trans	79.3	2.9	-176.6	0	0	0	0	0	114.5	G25 S26	G25-G28 PolarHBondContact O-N 3Å; S26-G28 VanDerWaalsContact C-N 3.33Å
29	E	91.1	Very high	95.8	Very high	102 Å²	102	31.9 Å²	31.9	48%	0.477	18%	0.176	S	C	.	.	S	Bend	trans	-125.8	-44	-175.3	-63.1	-167.4	160.3	0	0	113.2	M1 D27 T55	M1-E29 WeakPolarHBondContact CE-OE2 3.42Å; D27-E29 VanDerWaalsContact C-N 3.27Å; D27-E29 PolarHBondContact OD1-N 3.22Å; E29-T55 WeakPolarHBondContact O-CB 3.44Å; E29-T55 WeakPolarHBondContact O-CG2 3.39Å; E29-T55 PolarHBondContact O-OG1 3.22Å
30	S	93.9	Very high	95.8	Very high	39 Å²	39	29.2 Å²	29.2	27%	0.273	16%	0.163	S	C	.	.	S	Bend	trans	-71.7	172	-176	81.8	0	0	0	0	112.4	A24 G25 D27 G32	A24-S30 CarbonylContact C-O 3.49Å; A24-S30 VanDerWaalsContact CA-O 3.32Å; A24-S30 WeakPolarHBondContact CA-O 3.3Å; G25-S30 PolarHBondContact N-O 3.24Å; D27-S30 PolarHBondContact OD1-N 3.15Å; D27-S30 PolarHBondContact OD1-OG 2.96Å; D27-S30 WeakPolarHBondContact OD2-CB 3.39Å; S30-G32 PolarHBondContact O-N 3.32Å
31	I	95.1	Very high	95.9	Very high	23 Å²	23	29.6 Å²	29.6	12%	0.118	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-66.7	124.5	168.1	-59.7	171.9	0	0	0	108.3	L3 F41 P234	L3-I31 HydrophobicContact CD1-CD1 4.33Å; L3-I31 HydrophobicContact CD1-CG1 4.42Å; I31-F41 HydrophobicContact CD1-CD1 4.42Å; I31-F41 HydrophobicContact CD1-CE1 3.79Å; I31-P234 HydrophobicContact CG2-CB 4.34Å
32	G	96.1	Very high	95.9	Very high	3 Å²	3	29.5 Å²	29.5	3%	0.031	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-94.1	165.8	178.4	0	0	0	0	0	113.4	K23 G25 S30 C34	K23-G32 WeakPolarHBondContact O-CA 3.34Å; K23-G32 PolarHBondContact O-N 3.21Å; G25-G32 VanDerWaalsContact CA-CA 3.49Å; S30-G32 PolarHBondContact O-N 3.32Å; G32-C34 PolarHBondContact O-N 3.16Å
33	N	96.6	Very high	96	Very high	17 Å²	17	29.5 Å²	29.5	9%	0.091	16%	0.164	C	C	.	.	S	Bend	trans	-64.3	105.5	175	175.1	45.1	0	0	0	111.7	I196 A242 Y243	N33-I196 WeakPolarHBondContact OD1-CD1 3.4Å; N33-A242 HydrophobicContact CB-CB 3.61Å; N33-A242 WeakPolarHBondContact ND2-CB 3.21Å; N33-Y243 WeakPolarHBondContact ND2-CE2 3.37Å
34	C	97.1	Very high	96.2	Very high	16 Å²	16	26 Å²	26	11%	0.108	15%	0.149	C	C	.	.			trans	-155.7	105.6	168.8	-178.1	0	0	0	0	109.8	K23 G32 F36 S37 Q38	K23-C34 HydrophobicContact CB-CB 4.01Å; K23-C34 HydrophobicContact CD-CB 4.34Å; G32-C34 PolarHBondContact O-N 3.16Å; C34-F36 PolarHBondContact O-N 2.98Å; C34-S37 WeakPolarHBondContact CB-OG 3.49Å; C34-S37 PolarHBondContact O-N 2.69Å; C34-S37 PolarHBondContact SG-N 2.84Å; C34-S37 VanDerWaalsContact SG-N 3.43Å; C34-S37 PolarHBondContact SG-OG 2.86Å; C34-Q38 PolarHBondContact O-N 3.33Å; C34-Q38 VanDerWaalsContact O-N 3.15Å
35	P	97.4	Very high	96.3	Very high	13 Å²	13	28.4 Å²	28.4	8%	0.084	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-28.5	-177.4	22.7	-31.5	0	0	0	112.6	R39 F121 P192 K193 I196	P35-R39 WeakPolarHBondContact O-CB 3.36Å; P35-R39 PolarHBondContact O-N 2.61Å; P35-F121 HydrophobicContact CG-CZ 4.28Å; P35-P192 HydrophobicContact CB-CB 3.69Å; P35-P192 WeakPolarHBondContact O-CB 3.47Å; P35-K193 HydrophobicContact CB-CG 3.98Å; P35-I196 HydrophobicContact CB-CD1 3.78Å; P35-I196 HydrophobicContact CG-CD1 3.82Å
36	F	97.8	Very high	96.5	Very high	88 Å²	88	29.2 Å²	29.2	39%	0.386	16%	0.158	S	C	.	.	H	α-helix	trans	-72.5	-35.2	176.4	-52.9	-63.7	0	0	0	113	C34 L40 P75 V87	C34-F36 PolarHBondContact O-N 2.98Å; F36-L40 PolarHBondContact O-N 2.96Å; F36-P75 HydrophobicContact CB-CG 3.79Å; F36-V87 HydrophobicContact CB-CG1 4.35Å; F36-V87 HydrophobicContact CB-CG2 3.72Å; F36-V87 HydrophobicContact CD1-CG1 4.45Å; F36-V87 HydrophobicContact CD1-CG2 4.45Å; F36-V87 HydrophobicContact CG-CG2 4.24Å
37	S	97.9	Very high	96.6	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.021	13%	0.134	C	C	.	.	H	α-helix	trans	-66.3	-46.8	175.2	-63.6	0	0	0	0	110.2	K23 C34 R39 L40 F41	K23-S37 PolarHBondContact N-OG 3.48Å; C34-S37 WeakPolarHBondContact CB-OG 3.49Å; C34-S37 PolarHBondContact O-N 2.69Å; C34-S37 PolarHBondContact SG-N 2.84Å; C34-S37 VanDerWaalsContact SG-N 3.43Å; C34-S37 PolarHBondContact SG-OG 2.86Å; S37-R39 VanDerWaalsContact C-N 3.33Å; S37-R39 PolarHBondContact O-N 2.86Å; S37-L40 PolarHBondContact O-N 3.18Å; S37-F41 WeakPolarHBondContact O-CB 3.24Å; S37-F41 PolarHBondContact O-N 3.11Å
38	Q	98.4	Very high	96.7	Very high	8 Å²	8	24.3 Å²	24.3	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-61.7	-40.6	177.2	-171.6	178.4	6.5	0	0	111.6	C34 L40 F41 M42 P192 F229 T232 C233	C34-Q38 PolarHBondContact O-N 3.33Å; C34-Q38 VanDerWaalsContact O-N 3.15Å; Q38-L40 PolarHBondContact O-N 3.25Å; Q38-F41 WeakPolarHBondContact O-CB 3.18Å; Q38-F41 PolarHBondContact O-N 3.28Å; Q38-M42 HydrophobicContact CG-CG 4.32Å; Q38-M42 HydrophobicContact CG-SD 4.22Å; Q38-M42 VanDerWaalsContact O-CG 3.29Å; Q38-M42 WeakPolarHBondContact O-CG 3.18Å; Q38-M42 PolarHBondContact O-N 2.79Å; Q38-P192 HydrophobicContact CB-CB 4.01Å; Q38-P192 HydrophobicContact CB-CG 3.9Å; Q38-P192 HydrophobicContact CG-CB 4.22Å; Q38-P192 HydrophobicContact CG-CG 3.84Å; Q38-F229 VanDerWaalsContact NE2-CE2 3.34Å; Q38-T232 WeakPolarHBondContact CG-O 3.31Å; Q38-T232 PolarHBondContact NE2-OG1 3.45Å; Q38-C233 VanDerWaalsContact NE2-CA 3.27Å
39	R	98.4	Very high	96.9	Very high	17 Å²	17	24 Å²	24	6%	0.064	14%	0.136	C	C	.	.	H	α-helix	trans	-52.2	-54.2	174.2	176	-178.6	-176.7	-174.1	4.7	112.1	P35 S37 F41 M42 I43 N88 E91 C188	P35-R39 WeakPolarHBondContact O-CB 3.36Å; P35-R39 PolarHBondContact O-N 2.61Å; S37-R39 VanDerWaalsContact C-N 3.33Å; S37-R39 PolarHBondContact O-N 2.86Å; R39-F41 VanDerWaalsContact C-N 3.32Å; R39-F41 PolarHBondContact O-N 3.41Å; R39-M42 PolarHBondContact O-N 3.23Å; R39-I43 HydrophobicContact CG-CD1 3.96Å; R39-I43 WeakPolarHBondContact O-CD1 3.45Å; R39-I43 VanDerWaalsContact O-CG1 3.27Å; R39-I43 WeakPolarHBondContact O-CG1 3.35Å; R39-I43 PolarHBondContact O-N 3.37Å; R39-I43 VanDerWaalsContact O-N 3.09Å; R39-N88 PolarHBondContact NH1-OD1 3.46Å; R39-E91 IonicContact CZ-OE1 3.07Å; R39-E91 IonicContact CZ-OE2 3.7Å; R39-E91 IonicContact NE-OE2 3.91Å; R39-E91 PolarHBondContact NE-OE2 3.15Å; R39-E91 IonicContact NH2-OE1 3.94Å; R39-E91 PolarHBondContact NH2-OE1 3.12Å; R39-E91 IonicContact NH2-OE2 3.95Å; R39-E91 PolarHBondContact NH2-OE2 3.11Å; R39-C188 WeakPolarHBondContact CA-O 2.94Å; R39-C188 VanDerWaalsContact CB-O 3.31Å; R39-C188 WeakPolarHBondContact CB-O 3.49Å; R39-C188 HydrophobicContact CG-CB 4.2Å; R39-C188 WeakPolarHBondContact CG-O 3.46Å
40	L	98.6	Very high	97.1	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.7	-34.3	-179.5	-65.1	-175.4	0	0	0	112.5	L20 F36 S37 Q38 I43 L44 P75 V87 I90	L20-L40 HydrophobicContact CD1-CB 3.93Å; L20-L40 HydrophobicContact CD1-CD1 4.34Å; F36-L40 PolarHBondContact O-N 2.96Å; S37-L40 PolarHBondContact O-N 3.18Å; Q38-L40 PolarHBondContact O-N 3.25Å; L40-I43 HydrophobicContact CD2-CD1 4.22Å; L40-I43 PolarHBondContact O-N 3.22Å; L40-L44 PolarHBondContact O-N 3.19Å; L40-L44 VanDerWaalsContact O-N 3.08Å; L40-P75 HydrophobicContact CD1-CB 4.07Å; L40-P75 HydrophobicContact CD1-CG 4.23Å; L40-V87 HydrophobicContact CD2-CG1 4.15Å; L40-V87 HydrophobicContact CG-CG1 4.25Å; L40-I90 HydrophobicContact CD1-CB 4.24Å; L40-I90 HydrophobicContact CD1-CD1 3.85Å; L40-I90 HydrophobicContact CD1-CG2 3.9Å; L40-I90 HydrophobicContact CD2-CB 4.24Å; L40-I90 HydrophobicContact CD2-CG2 3.86Å
41	F	98.6	Very high	97.2	Very high	7 Å²	7	21.6 Å²	21.6	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-63.2	-48.4	175.3	-160	168.7	0	0	0	110.9	L20 I31 S37 Q38 R39 I43 L44 W45 F51 V53 T232	L20-F41 HydrophobicContact CD2-CB 3.62Å; L20-F41 HydrophobicContact CD2-CD1 4.48Å; L20-F41 HydrophobicContact CD2-CD2 4.29Å; L20-F41 HydrophobicContact CD2-CG 3.89Å; I31-F41 HydrophobicContact CD1-CD1 4.42Å; I31-F41 HydrophobicContact CD1-CE1 3.79Å; S37-F41 WeakPolarHBondContact O-CB 3.24Å; S37-F41 PolarHBondContact O-N 3.11Å; Q38-F41 WeakPolarHBondContact O-CB 3.18Å; Q38-F41 PolarHBondContact O-N 3.28Å; R39-F41 VanDerWaalsContact C-N 3.32Å; R39-F41 PolarHBondContact O-N 3.41Å; F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 2.87Å; F41-L44 PolarHBondContact O-N 2.66Å; F41-W45 HydrophobicContact CD2-CE3 4.21Å; F41-W45 AromaticContact CE2-CE3 3.62Å; F41-W45 HydrophobicContact CE2-CE3 3.62Å; F41-W45 AromaticContact CE2-CZ3 3.94Å; F41-W45 HydrophobicContact CE2-CZ3 3.94Å; F41-W45 HydrophobicContact CZ-CE3 4.29Å; F41-W45 HydrophobicContact CZ-CZ3 4.17Å; F41-W45 WeakPolarHBondContact O-CB 3.31Å; F41-W45 PolarHBondContact O-N 3.5Å; F41-F51 AromaticContact CD2-CE2 3.54Å; F41-F51 HydrophobicContact CD2-CE2 3.54Å; F41-F51 AromaticContact CD2-CZ 3.5Å; F41-F51 HydrophobicContact CD2-CZ 3.5Å; F41-F51 VanDerWaalsContact CD2-CZ 3.5Å; F41-F51 AromaticContact CE2-CE2 3.54Å; F41-F51 HydrophobicContact CE2-CE2 3.54Å; F41-F51 AromaticContact CE2-CZ 3.45Å; F41-F51 HydrophobicContact CE2-CZ 3.45Å; F41-F51 VanDerWaalsContact CE2-CZ 3.45Å; F41-V53 HydrophobicContact CD2-CG2 4.25Å; F41-V53 HydrophobicContact CE1-CG1 4.24Å; F41-V53 HydrophobicContact CE1-CG2 4.04Å; F41-V53 HydrophobicContact CE2-CG2 3.75Å; F41-V53 HydrophobicContact CZ-CG2 3.64Å; F41-T232 HydrophobicContact CB-CG2 3.98Å; F41-T232 HydrophobicContact CD1-CG2 3.73Å; F41-T232 HydrophobicContact CD2-CG2 3.6Å; F41-T232 HydrophobicContact CE1-CG2 4.04Å; F41-T232 HydrophobicContact CE2-CG2 3.91Å; F41-T232 HydrophobicContact CG-CG2 3.48Å; F41-T232 VanDerWaalsContact CG-CG2 3.48Å; F41-T232 HydrophobicContact CZ-CG2 4.11Å
42	M	98.6	Very high	97.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-42.7	175.8	-69.4	178	67.8	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 4.22Å; Q38-M42 VanDerWaalsContact O-CG 3.29Å; Q38-M42 WeakPolarHBondContact O-CG 3.18Å; Q38-M42 PolarHBondContact O-N 2.79Å; R39-M42 PolarHBondContact O-N 3.23Å; M42-W45 PolarHBondContact O-N 3.16Å; M42-L46 WeakPolarHBondContact O-CB 3.36Å; M42-L46 WeakPolarHBondContact O-CG 3.49Å; M42-L46 PolarHBondContact O-N 3.4Å; M42-M183 HydrophobicContact CE-SD 4.28Å; M42-C188 HydrophobicContact CB-CB 4.24Å; M42-L191 HydrophobicContact CE-CD1 3.94Å; M42-P192 HydrophobicContact SD-CG 4.05Å; M42-E228 WeakPolarHBondContact CG-O 3.2Å; M42-F229 HydrophobicContact CE-CB 4.2Å; M42-F229 HydrophobicContact CE-CD2 3.97Å; M42-F229 HydrophobicContact SD-CD2 3.92Å; M42-T232 HydrophobicContact CG-CG2 4.42Å; M42-T232 WeakPolarHBondContact CG-OG1 3.44Å
43	I	98.6	Very high	97.3	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-61.1	-51.7	179.1	-68.8	163.3	0	0	0	111	R39 L40 F41 W45 L46 K47 E91 L94 L106 L185 C188	R39-I43 HydrophobicContact CG-CD1 3.96Å; R39-I43 WeakPolarHBondContact O-CD1 3.45Å; R39-I43 VanDerWaalsContact O-CG1 3.27Å; R39-I43 WeakPolarHBondContact O-CG1 3.35Å; R39-I43 PolarHBondContact O-N 3.37Å; R39-I43 VanDerWaalsContact O-N 3.09Å; L40-I43 HydrophobicContact CD2-CD1 4.22Å; L40-I43 PolarHBondContact O-N 3.22Å; F41-I43 VanDerWaalsContact C-N 3.3Å; F41-I43 PolarHBondContact O-N 2.87Å; I43-W45 VanDerWaalsContact C-N 3.28Å; I43-W45 PolarHBondContact O-N 3.14Å; I43-L46 PolarHBondContact O-N 3.45Å; I43-K47 HydrophobicContact CG2-CG 4.49Å; I43-K47 VanDerWaalsContact O-CG 3.28Å; I43-K47 WeakPolarHBondContact O-CG 3.48Å; I43-K47 PolarHBondContact O-N 2.95Å; I43-E91 HydrophobicContact CD1-CB 4.25Å; I43-E91 HydrophobicContact CD1-CG 3.91Å; I43-E91 WeakPolarHBondContact CD1-OE2 3.44Å; I43-L94 HydrophobicContact CG2-CD1 4.25Å; I43-L106 HydrophobicContact CG2-CD1 4.26Å; I43-L185 HydrophobicContact CD1-CD2 3.88Å; I43-L185 HydrophobicContact CG1-CD2 3.76Å; I43-L185 HydrophobicContact CG2-CD2 4.23Å; I43-C188 HydrophobicContact CD1-CB 4.31Å; I43-C188 HydrophobicContact CG1-CB 3.84Å
44	L	98.3	Very high	97.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.9	-37.6	179.1	-72.3	171	0	0	0	112	I18 L20 L40 F41 K47 G48 V49 F51 L94 L98	I18-L44 HydrophobicContact CD1-CD2 4.12Å; I18-L44 HydrophobicContact CG2-CD1 4.06Å; I18-L44 HydrophobicContact CG2-CD2 4Å; L20-L44 HydrophobicContact CB-CD1 3.99Å; L20-L44 HydrophobicContact CD2-CD1 4.28Å; L40-L44 PolarHBondContact O-N 3.19Å; L40-L44 VanDerWaalsContact O-N 3.08Å; F41-L44 PolarHBondContact O-N 2.66Å; L44-K47 PolarHBondContact O-N 3.44Å; L44-G48 PolarHBondContact O-N 3.34Å; L44-V49 HydrophobicContact CB-CG1 4.45Å; L44-V49 HydrophobicContact CD2-CG1 3.86Å; L44-F51 HydrophobicContact CB-CD1 3.77Å; L44-F51 HydrophobicContact CB-CD2 4.21Å; L44-F51 HydrophobicContact CB-CE1 3.58Å; L44-F51 HydrophobicContact CB-CE2 4.01Å; L44-F51 HydrophobicContact CB-CG 4.09Å; L44-F51 HydrophobicContact CB-CZ 3.7Å; L44-F51 HydrophobicContact CD1-CB 4.49Å; L44-F51 HydrophobicContact CD1-CD2 3.8Å; L44-F51 HydrophobicContact CD1-CE2 4.11Å; L44-F51 HydrophobicContact CD1-CG 4.05Å; L44-L94 HydrophobicContact CD2-CD1 3.82Å; L44-L94 HydrophobicContact CD2-CD2 3.83Å; L44-L94 HydrophobicContact CD2-CG 4.46Å; L44-L94 HydrophobicContact CG-CD1 4.08Å; L44-L98 HydrophobicContact CD2-CD1 4.27Å
45	W	97.9	Very high	97.1	Very high	59 Å²	59	26.9 Å²	26.9	22%	0.223	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-49.4	175.2	-160.2	-54.6	0	0	0	111.7	V5 F41 M42 I43 K47 G48 E228 N231 T232	V5-W45 HydrophobicContact CG1-CH2 4.44Å; V5-W45 HydrophobicContact CG2-CZ3 4.41Å; F41-W45 HydrophobicContact CD2-CE3 4.21Å; F41-W45 AromaticContact CE2-CE3 3.62Å; F41-W45 HydrophobicContact CE2-CE3 3.62Å; F41-W45 AromaticContact CE2-CZ3 3.94Å; F41-W45 HydrophobicContact CE2-CZ3 3.94Å; F41-W45 HydrophobicContact CZ-CE3 4.29Å; F41-W45 HydrophobicContact CZ-CZ3 4.17Å; F41-W45 WeakPolarHBondContact O-CB 3.31Å; F41-W45 PolarHBondContact O-N 3.5Å; M42-W45 PolarHBondContact O-N 3.16Å; I43-W45 VanDerWaalsContact C-N 3.28Å; I43-W45 PolarHBondContact O-N 3.14Å; W45-K47 VanDerWaalsContact C-N 3.27Å; W45-K47 PolarHBondContact O-N 3.08Å; W45-G48 PolarHBondContact O-N 3.04Å; W45-E228 VanDerWaalsContact CD1-CG 3.43Å; W45-E228 HydrophobicContact CG-CB 4.26Å; W45-E228 HydrophobicContact CG-CG 4.03Å; W45-N231 HydrophobicContact CH2-CB 3.64Å; W45-N231 HydrophobicContact CZ2-CB 4.45Å; W45-N231 HydrophobicContact CZ3-CB 3.86Å; W45-T232 HydrophobicContact CE3-CG2 3.89Å; W45-T232 HydrophobicContact CZ3-CG2 4.35Å
46	L	97.8	Very high	96.9	Very high	26 Å²	26	26.3 Å²	26.3	14%	0.136	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-29.4	179	-78.5	170	0	0	0	113.1	M42 I43 G48 L106 M183 C188 E228	M42-L46 WeakPolarHBondContact O-CB 3.36Å; M42-L46 WeakPolarHBondContact O-CG 3.49Å; M42-L46 PolarHBondContact O-N 3.4Å; I43-L46 PolarHBondContact O-N 3.45Å; L46-G48 PolarHBondContact O-N 2.83Å; L46-L106 HydrophobicContact CB-CD1 3.69Å; L46-L106 HydrophobicContact CB-CD2 3.94Å; L46-L106 HydrophobicContact CB-CG 4.49Å; L46-L106 HydrophobicContact CD1-CD1 4.48Å; L46-M183 HydrophobicContact CD1-CB 3.81Å; L46-M183 HydrophobicContact CD1-CE 4.3Å; L46-M183 HydrophobicContact CD2-CB 4.25Å; L46-M183 HydrophobicContact CD2-CE 3.83Å; L46-M183 HydrophobicContact CG-CE 4.41Å; L46-C188 VanDerWaalsContact CD1-SG 3.57Å; L46-E228 HydrophobicContact CD2-CB 4.43Å; L46-E228 HydrophobicContact CD2-CG 3.89Å; L46-E228 HydrophobicContact CG-CB 4.37Å; L46-E228 HydrophobicContact CG-CG 4.2Å
47	K	96.8	Very high	96.6	Very high	6 Å²	6	23.6 Å²	23.6	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-66.2	-19.6	171.3	-72.5	-67.2	-176.3	179.5	0	112.7	I43 L44 W45 V49 E95 L98 F103 T104 L106	I43-K47 HydrophobicContact CG2-CG 4.49Å; I43-K47 VanDerWaalsContact O-CG 3.28Å; I43-K47 WeakPolarHBondContact O-CG 3.48Å; I43-K47 PolarHBondContact O-N 2.95Å; L44-K47 PolarHBondContact O-N 3.44Å; W45-K47 VanDerWaalsContact C-N 3.27Å; W45-K47 PolarHBondContact O-N 3.08Å; K47-V49 HydrophobicContact CB-CG1 4.32Å; K47-V49 PolarHBondContact O-N 3.15Å; K47-E95 WeakPolarHBondContact CE-OE2 3.34Å; K47-E95 IonicContact NZ-OE1 3.52Å; K47-E95 IonicContact NZ-OE2 2.75Å; K47-E95 PolarHBondContact NZ-OE2 3.23Å; K47-L98 HydrophobicContact CB-CD1 4.16Å; K47-L98 HydrophobicContact CD-CB 3.88Å; K47-L98 WeakPolarHBondContact CE-O 3.44Å; K47-L98 HydrophobicContact CG-CB 4.29Å; K47-L98 HydrophobicContact CG-CD1 4.05Å; K47-L98 PolarHBondContact NZ-O 3.12Å; K47-F103 HydrophobicContact CD-CB 4.32Å; K47-F103 WeakPolarHBondContact O-CD1 3.4Å; K47-T104 WeakPolarHBondContact CD-O 3.36Å; K47-T104 PolarHBondContact NZ-O 2.95Å; K47-L106 HydrophobicContact CD-CD1 4.07Å; K47-L106 HydrophobicContact CD-CG 4.3Å; K47-L106 HydrophobicContact CG-CD1 4.02Å
48	G	95.2	Very high	96	Very high	64 Å²	64	27.2 Å²	27.2	66%	0.66	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	21.9	-177.8	0	0	0	0	0	113.4	L44 W45 L46	L44-G48 PolarHBondContact O-N 3.34Å; W45-G48 PolarHBondContact O-N 3.04Å; L46-G48 PolarHBondContact O-N 2.83Å
49	V	94.8	Very high	95.3	Very high	13 Å²	13	35.9 Å²	35.9	8%	0.079	20%	0.196	C	C	.	.			trans	-84.2	151.3	176.1	68.5	0	0	0	0	110	P16 I18 L44 K47 F51 L98 F103	P16-V49 HydrophobicContact CG-CG2 4.26Å; I18-V49 HydrophobicContact CD1-CB 4.46Å; I18-V49 HydrophobicContact CD1-CG1 3.92Å; I18-V49 HydrophobicContact CD1-CG2 3.73Å; L44-V49 HydrophobicContact CB-CG1 4.45Å; L44-V49 HydrophobicContact CD2-CG1 3.86Å; K47-V49 HydrophobicContact CB-CG1 4.32Å; K47-V49 PolarHBondContact O-N 3.15Å; V49-F51 HydrophobicContact CG1-CD1 4.24Å; V49-F51 WeakPolarHBondContact O-CD1 3.37Å; V49-L98 HydrophobicContact CB-CD1 4.38Å; V49-L98 HydrophobicContact CG1-CD1 4Å; V49-L98 HydrophobicContact CG2-CD2 4.47Å; V49-F103 HydrophobicContact CB-CE1 3.95Å; V49-F103 HydrophobicContact CG2-CE1 4.09Å; V49-F103 HydrophobicContact CG2-CZ 4.3Å
50	V	95.1	Very high	94.6	Very high	76 Å²	76	44.6 Å²	44.6	46%	0.461	23%	0.229	S	C	.	.			trans	-79.6	126.3	170.5	-178.9	0	0	0	0	109
51	F	97.1	Very high	93.6	Very high	14 Å²	14	47.3 Å²	47.3	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	159.3	176.9	66.2	-77.6	0	0	0	110.7	I18 L20 F41 L44 V49 V53	I18-F51 HydrophobicContact CB-CB 3.8Å; I18-F51 HydrophobicContact CG2-CB 3.96Å; I18-F51 VanDerWaalsContact O-CA 3.29Å; I18-F51 WeakPolarHBondContact O-CA 3.31Å; I18-F51 WeakPolarHBondContact O-CB 3.49Å; L20-F51 HydrophobicContact CB-CD2 4.29Å; L20-F51 HydrophobicContact CD2-CE2 4.43Å; F41-F51 AromaticContact CD2-CE2 3.54Å; F41-F51 HydrophobicContact CD2-CE2 3.54Å; F41-F51 AromaticContact CD2-CZ 3.5Å; F41-F51 HydrophobicContact CD2-CZ 3.5Å; F41-F51 VanDerWaalsContact CD2-CZ 3.5Å; F41-F51 AromaticContact CE2-CE2 3.54Å; F41-F51 HydrophobicContact CE2-CE2 3.54Å; F41-F51 AromaticContact CE2-CZ 3.45Å; F41-F51 HydrophobicContact CE2-CZ 3.45Å; F41-F51 VanDerWaalsContact CE2-CZ 3.45Å; L44-F51 HydrophobicContact CB-CD1 3.77Å; L44-F51 HydrophobicContact CB-CD2 4.21Å; L44-F51 HydrophobicContact CB-CE1 3.58Å; L44-F51 HydrophobicContact CB-CE2 4.01Å; L44-F51 HydrophobicContact CB-CG 4.09Å; L44-F51 HydrophobicContact CB-CZ 3.7Å; L44-F51 HydrophobicContact CD1-CB 4.49Å; L44-F51 HydrophobicContact CD1-CD2 3.8Å; L44-F51 HydrophobicContact CD1-CE2 4.11Å; L44-F51 HydrophobicContact CD1-CG 4.05Å; V49-F51 HydrophobicContact CG1-CD1 4.24Å; V49-F51 WeakPolarHBondContact O-CD1 3.37Å; F51-V53 HydrophobicContact CD2-CG2 3.83Å; F51-V53 HydrophobicContact CE2-CG2 3.46Å; F51-V53 VanDerWaalsContact CE2-CG2 3.46Å
52	N	96.8	Very high	92.5	Very high	94 Å²	94	50.2 Å²	50.2	50%	0.503	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	151.9	172	-69.4	-32.6	0	0	0	110.7	I18 E19 L20	I18-N52 PolarHBondContact O-N 3.2Å; E19-N52 WeakPolarHBondContact CA-O 3.39Å; E19-N52 HydrophobicContact CG-CB 4.11Å; L20-N52 PolarHBondContact N-O 2.94Å
53	V	96.5	Very high	91.6	Very high	8 Å²	8	53 Å²	53	5%	0.048	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.5	172.7	-177.3	0	0	0	0	109.6	L20 V22 F41 F51	L20-V53 HydrophobicContact CB-CG2 4.49Å; L20-V53 HydrophobicContact CD2-CG2 4.46Å; L20-V53 WeakPolarHBondContact O-CA 3.05Å; V22-V53 HydrophobicContact CG1-CG1 4.18Å; V22-V53 HydrophobicContact CG2-CG1 3.79Å; F41-V53 HydrophobicContact CD2-CG2 4.25Å; F41-V53 HydrophobicContact CE1-CG1 4.24Å; F41-V53 HydrophobicContact CE1-CG2 4.04Å; F41-V53 HydrophobicContact CE2-CG2 3.75Å; F41-V53 HydrophobicContact CZ-CG2 3.64Å; F51-V53 HydrophobicContact CD2-CG2 3.83Å; F51-V53 HydrophobicContact CE2-CG2 3.46Å; F51-V53 VanDerWaalsContact CE2-CG2 3.46Å
54	T	94.8	Very high	90.7	Very high	37 Å²	37	59 Å²	59	23%	0.227	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120.3	176.6	-69.5	0	0	0	0	109.4	E19 L20 F21 V22	E19-T54 WeakPolarHBondContact OE1-CB 3.46Å; E19-T54 PolarHBondContact OE1-OG1 3.24Å; L20-T54 PolarHBondContact O-N 2.94Å; F21-T54 CarbonylContact C-O 3.46Å; F21-T54 VanDerWaalsContact CA-O 3.32Å; F21-T54 WeakPolarHBondContact CA-O 3.41Å; F21-T54 HydrophobicContact CD1-CG2 3.76Å; F21-T54 HydrophobicContact CE1-CG2 3.84Å; V22-T54 PolarHBondContact N-O 3.37Å
55	T	94.4	Very high	89.8	Confident	30 Å²	30	60 Å²	60	18%	0.184	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	134.8	174.5	49.9	0	0	0	0	109.9	V22 E29	V22-T55 HydrophobicContact CG2-CG2 3.7Å; V22-T55 CarbonylContact O-C 3.57Å; V22-T55 WeakPolarHBondContact O-CA 3.21Å; E29-T55 WeakPolarHBondContact O-CB 3.44Å; E29-T55 WeakPolarHBondContact O-CG2 3.39Å; E29-T55 PolarHBondContact O-OG1 3.22Å
56	V	93	Very high	88.8	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.006	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	109.5	-175.7	-177.2	0	0	0	0	109.9	F21 V22 A24 L58 L65 P74	F21-V56 HydrophobicContact CB-CG2 3.98Å; F21-V56 HydrophobicContact CD1-CG2 4.1Å; V22-V56 PolarHBondContact O-N 2.91Å; A24-V56 VanDerWaalsContact CB-C 3.47Å; A24-V56 WeakPolarHBondContact CB-O 3.25Å; A24-V56 PolarHBondContact N-O 3.46Å; V56-L58 PolarHBondContact O-N 3.25Å; V56-L65 HydrophobicContact CG1-CD1 4.2Å; V56-L65 HydrophobicContact CG2-CD1 3.93Å; V56-P74 HydrophobicContact CB-CG 4.3Å
57	D	90.6	Very high	88.1	Confident	32 Å²	32	67.3 Å²	67.3	17%	0.171	36%	0.361	C	S	.	.			trans	-74.2	113.4	169	-176.3	-4.5	0	0	0	109.9	A24 K59 R60 K61	A24-D57 HydrophobicContact CB-CB 4.35Å; D57-K59 PolarHBondContact O-N 3.47Å; D57-K59 WeakPolarHBondContact OD1-CB 3.38Å; D57-K59 PolarHBondContact OD1-N 3.48Å; D57-R60 HydrophobicContact CB-CB 4.45Å; D57-R60 CarbonylContact O-C 3.54Å; D57-R60 PolarHBondContact O-N 3.46Å; D57-R60 WeakPolarHBondContact OD2-CB 3.18Å; D57-K61 PolarHBondContact O-N 3.38Å
58	L	84.9	Confident	87.4	Confident	78 Å²	78	70.2 Å²	70.2	41%	0.408	38%	0.377	S	S	.	.	S	Bend	trans	-69.2	-20.7	179.4	-62.6	-179.1	0	0	0	113.6	K23 V56 P74	K23-L58 HydrophobicContact CD-CD1 4.45Å; K23-L58 HydrophobicContact CG-CD1 4.42Å; V56-L58 PolarHBondContact O-N 3.25Å; L58-P74 HydrophobicContact CD2-CG 3.93Å
59	K	84.9	Confident	86.7	Confident	190 Å²	190	67.3 Å²	67.3	83%	0.826	35%	0.346	S	S	*	.	S	Bend	trans	-85.4	-27.6	177.6	-62.8	177.2	-179.1	172.9	0	111.8	D57	D57-K59 PolarHBondContact O-N 3.47Å; D57-K59 WeakPolarHBondContact OD1-CB 3.38Å; D57-K59 PolarHBondContact OD1-N 3.48Å
60	R	83.1	Confident	86	Confident	200 Å²	200	71.1 Å²	71.1	76%	0.755	37%	0.371	S	S	*	.	S	Bend	trans	-132.7	56.8	-174.4	-59.2	176.8	179.7	171.3	1.2	110.3	D57 P62	D57-R60 HydrophobicContact CB-CB 4.45Å; D57-R60 CarbonylContact O-C 3.54Å; D57-R60 PolarHBondContact O-N 3.46Å; D57-R60 WeakPolarHBondContact OD2-CB 3.18Å; R60-P62 VanDerWaalsContact O-CD 3.22Å; R60-P62 WeakPolarHBondContact O-CD 3.21Å
61	K	78.1	Confident	85.2	Confident	58 Å²	58	70.8 Å²	70.8	25%	0.252	38%	0.383	S	S	.	.			trans	-66.7	119	-178.9	-165.6	172.7	-179.3	-178.5	0	109.5	D57 L65 A69 T72	D57-K61 PolarHBondContact O-N 3.38Å; K61-L65 WeakPolarHBondContact CE-O 3.37Å; K61-L65 HydrophobicContact CG-CB 4.11Å; K61-A69 PolarHBondContact NZ-O 3.15Å; K61-A69 VanDerWaalsContact NZ-O 3.12Å; K61-T72 PolarHBondContact NZ-O 2.98Å
62	P	75.9	Confident	84.6	Confident	67 Å²	67	71.7 Å²	71.7	44%	0.435	39%	0.39	S	S	.	.			trans	-58.1	146.8	173.5	-22	32.3	0	0	0	111.8	R60 D64 L65 Q66	R60-P62 VanDerWaalsContact O-CD 3.22Å; R60-P62 WeakPolarHBondContact O-CD 3.21Å; P62-D64 PolarHBondContact O-N 3.01Å; P62-L65 HydrophobicContact CG-CD1 4.1Å; P62-L65 PolarHBondContact O-N 3.41Å; P62-L65 VanDerWaalsContact O-N 3.14Å; P62-Q66 PolarHBondContact O-N 3.22Å; P62-Q66 VanDerWaalsContact O-N 3.13Å
63	A	79.7	Confident	84.2	Confident	60 Å²	60	73.7 Å²	73.7	50%	0.496	40%	0.396	S	S	.	.	H	α-helix	trans	-57.6	-38.5	179.7	0	0	0	0	0	112.2	L65 Q66 N67	A63-L65 VanDerWaalsContact C-N 3.33Å; A63-L65 PolarHBondContact O-N 2.98Å; A63-Q66 WeakPolarHBondContact O-CA 3.36Å; A63-Q66 WeakPolarHBondContact O-CB 3.46Å; A63-Q66 PolarHBondContact O-N 3.42Å; A63-N67 PolarHBondContact O-N 2.9Å; A63-N67 PolarHBondContact O-ND2 3.37Å
64	D	78.4	Confident	83.9	Confident	127 Å²	127	74.2 Å²	74.2	68%	0.679	40%	0.4	S	S	*	.	H	α-helix	trans	-61.8	-40.7	178.9	-60.4	-24	0	0	0	112	P62 Q66 N67 L68	P62-D64 PolarHBondContact O-N 3.01Å; D64-Q66 VanDerWaalsContact C-N 3.3Å; D64-Q66 PolarHBondContact O-N 2.91Å; D64-N67 PolarHBondContact O-N 3.47Å; D64-L68 WeakPolarHBondContact O-CB 3.49Å; D64-L68 PolarHBondContact O-N 2.59Å
65	L	79.3	Confident	84	Confident	20 Å²	20	73.1 Å²	73.1	11%	0.105	39%	0.393	C	S	.	.	H	α-helix	trans	-69.8	-28.4	174.6	-73.5	-179.5	0	0	0	112.6	F21 V56 K61 P62 A63 L68 A69	F21-L65 HydrophobicContact CD1-CD2 3.68Å; F21-L65 HydrophobicContact CE1-CD2 3.36Å; F21-L65 HydrophobicContact CZ-CD2 4.27Å; V56-L65 HydrophobicContact CG1-CD1 4.2Å; V56-L65 HydrophobicContact CG2-CD1 3.93Å; K61-L65 WeakPolarHBondContact CE-O 3.37Å; K61-L65 HydrophobicContact CG-CB 4.11Å; P62-L65 HydrophobicContact CG-CD1 4.1Å; P62-L65 PolarHBondContact O-N 3.41Å; P62-L65 VanDerWaalsContact O-N 3.14Å; A63-L65 VanDerWaalsContact C-N 3.33Å; A63-L65 PolarHBondContact O-N 2.98Å; L65-L68 HydrophobicContact CD2-CD2 4.19Å; L65-A69 PolarHBondContact O-N 2.93Å
66	Q	78.6	Confident	84.1	Confident	115 Å²	115	71.7 Å²	71.7	54%	0.537	38%	0.384	S	S	.	.	H	α-helix	trans	-71.4	-37	174.5	-165.8	172	25.6	0	0	111.4	P62 A63 D64 A69 P70	P62-Q66 PolarHBondContact O-N 3.22Å; P62-Q66 VanDerWaalsContact O-N 3.13Å; A63-Q66 WeakPolarHBondContact O-CA 3.36Å; A63-Q66 WeakPolarHBondContact O-CB 3.46Å; A63-Q66 PolarHBondContact O-N 3.42Å; D64-Q66 VanDerWaalsContact C-N 3.3Å; D64-Q66 PolarHBondContact O-N 2.91Å; Q66-A69 CarbonylContact O-C 3.36Å; Q66-P70 WeakPolarHBondContact O-CA 3.26Å; Q66-P70 WeakPolarHBondContact O-CD 3.28Å; Q66-P70 VanDerWaalsContact O-CG 3.3Å; Q66-P70 WeakPolarHBondContact O-CG 3.29Å; Q66-P70 VanDerWaalsContact O-N 3.14Å
67	N	81.8	Confident	84.3	Confident	124 Å²	124	71.7 Å²	71.7	66%	0.663	38%	0.384	S	S	*	.	H	α-helix	trans	-73.8	-39.6	175.9	-67.4	-27.9	0	0	0	112.3	A63 D64	A63-N67 PolarHBondContact O-N 2.9Å; A63-N67 PolarHBondContact O-ND2 3.37Å; D64-N67 PolarHBondContact O-N 3.47Å
68	L	83.1	Confident	84.6	Confident	67 Å²	67	70.6 Å²	70.6	35%	0.351	38%	0.379	S	S	.	.	H	α-helix	trans	-61.9	-49.9	178.2	-179.6	66	0	0	0	111.4	F21 D64 L65 F76 T78 V83	F21-L68 HydrophobicContact CE1-CD2 4.16Å; F21-L68 HydrophobicContact CE2-CD2 4.05Å; F21-L68 HydrophobicContact CZ-CD2 3.55Å; D64-L68 WeakPolarHBondContact O-CB 3.49Å; D64-L68 PolarHBondContact O-N 2.59Å; L65-L68 HydrophobicContact CD2-CD2 4.19Å; L68-F76 HydrophobicContact CD2-CE2 4.49Å; L68-T78 HydrophobicContact CD1-CG2 3.99Å; L68-T78 HydrophobicContact CD2-CG2 3.95Å; L68-T78 HydrophobicContact CG-CG2 4.26Å; L68-V83 HydrophobicContact CD1-CG2 3.99Å; L68-V83 HydrophobicContact CG-CG2 4.03Å; L68-V83 WeakPolarHBondContact O-CG2 3.43Å
69	A	80.5	Confident	85.1	Confident	3 Å²	3	67.8 Å²	67.8	3%	0.025	36%	0.363	C	S	.	.	S	Bend	trans	-137.4	80.4	-178.5	0	0	0	0	0	110.9	K61 L65 Q66 G71 T72 F76 V83	K61-A69 PolarHBondContact NZ-O 3.15Å; K61-A69 VanDerWaalsContact NZ-O 3.12Å; L65-A69 PolarHBondContact O-N 2.93Å; Q66-A69 CarbonylContact O-C 3.36Å; A69-G71 PolarHBondContact O-N 3.5Å; A69-T72 HydrophobicContact CB-CG2 4.29Å; A69-T72 PolarHBondContact O-N 3.35Å; A69-F76 HydrophobicContact CB-CD2 4.32Å; A69-F76 HydrophobicContact CB-CE2 3.89Å; A69-F76 HydrophobicContact CB-CZ 4.05Å; A69-V83 HydrophobicContact CB-CG1 4.02Å; A69-V83 HydrophobicContact CB-CG2 4.41Å
70	P	80	Confident	85.6	Confident	92 Å²	92	63.6 Å²	63.6	60%	0.597	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	130.9	-179.8	-21.5	31.4	0	0	0	111.3	Q66 T72	Q66-P70 WeakPolarHBondContact O-CA 3.26Å; Q66-P70 WeakPolarHBondContact O-CD 3.28Å; Q66-P70 VanDerWaalsContact O-CG 3.3Å; Q66-P70 WeakPolarHBondContact O-CG 3.29Å; Q66-P70 VanDerWaalsContact O-N 3.14Å; P70-T72 PolarHBondContact O-N 2.98Å; P70-T72 PolarHBondContact O-OG1 2.7Å
71	G	78.7	Confident	86	Confident	70 Å²	70	56.8 Å²	56.8	72%	0.722	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	1.1	178.9	0	0	0	0	0	115.9	A69	A69-G71 PolarHBondContact O-N 3.5Å
72	T	84	Confident	86.8	Confident	32 Å²	32	59.4 Å²	59.4	20%	0.196	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-85.7	130.1	-178.1	-58.3	0	0	0	0	110.5	K61 A69 P70 F76 T85	K61-T72 PolarHBondContact NZ-O 2.98Å; A69-T72 HydrophobicContact CB-CG2 4.29Å; A69-T72 PolarHBondContact O-N 3.35Å; P70-T72 PolarHBondContact O-N 2.98Å; P70-T72 PolarHBondContact O-OG1 2.7Å; T72-F76 HydrophobicContact CG2-CB 4Å; T72-F76 HydrophobicContact CG2-CD1 3.66Å; T72-F76 HydrophobicContact CG2-CE1 4.33Å; T72-F76 HydrophobicContact CG2-CG 3.9Å; T72-T85 HydrophobicContact CG2-CG2 3.58Å
73	H	87.3	Confident	87.7	Confident	137 Å²	137	58.2 Å²	58.2	63%	0.634	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-95.3	143.5	171.5	-70.3	-80.5	0	0	0	110.2
74	P	91.6	Very high	88.5	Confident	19 Å²	19	57.4 Å²	57.4	12%	0.123	33%	0.332	C	S	.	.	S	Bend	trans	-61.7	148.9	171.4	27.9	-34	0	0	0	111.6	K23 V56 L58	K23-P74 HydrophobicContact CB-CG 4.1Å; V56-P74 HydrophobicContact CB-CG 4.3Å; L58-P74 HydrophobicContact CD2-CG 3.93Å
75	P	95.8	Very high	89.3	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.091	32%	0.32	C	S	.	.	S	Bend	cis	-85.9	147.9	4.2	36.3	-38	0	0	0	114.1	F21 F36 L40 V87	F21-P75 VanDerWaalsContact O-CA 3.3Å; F21-P75 WeakPolarHBondContact O-CA 3.39Å; F36-P75 HydrophobicContact CB-CG 3.79Å; L40-P75 HydrophobicContact CD1-CB 4.07Å; L40-P75 HydrophobicContact CD1-CG 4.23Å; P75-V87 HydrophobicContact CG-CG2 3.59Å
76	F	96.6	Very high	90.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	166.4	167.9	63.6	-88.7	0	0	0	109.1	F21 L68 A69 T72 V83 K84 T85	F21-F76 HydrophobicContact CB-CD1 3.91Å; F21-F76 HydrophobicContact CB-CD2 3.98Å; F21-F76 HydrophobicContact CB-CE1 3.57Å; F21-F76 HydrophobicContact CB-CE2 3.66Å; F21-F76 HydrophobicContact CB-CG 4.09Å; F21-F76 HydrophobicContact CB-CZ 3.43Å; F21-F76 VanDerWaalsContact CB-CZ 3.43Å; F21-F76 HydrophobicContact CD1-CE2 4.04Å; F21-F76 AromaticContact CD1-CZ 3.87Å; F21-F76 HydrophobicContact CD1-CZ 3.87Å; F21-F76 AromaticContact CD2-CD2 3.51Å; F21-F76 HydrophobicContact CD2-CD2 3.51Å; F21-F76 AromaticContact CD2-CE2 3.14Å; F21-F76 HydrophobicContact CD2-CE2 3.14Å; F21-F76 HydrophobicContact CD2-CG 4.39Å; F21-F76 AromaticContact CD2-CZ 3.78Å; F21-F76 HydrophobicContact CD2-CZ 3.78Å; F21-F76 HydrophobicContact CE2-CD2 4.26Å; F21-F76 AromaticContact CE2-CE2 3.73Å; F21-F76 HydrophobicContact CE2-CE2 3.73Å; F21-F76 AromaticContact CG-CD2 3.93Å; F21-F76 HydrophobicContact CG-CD2 3.93Å; F21-F76 HydrophobicContact CG-CE1 4.08Å; F21-F76 AromaticContact CG-CE2 3.31Å; F21-F76 HydrophobicContact CG-CE2 3.31Å; F21-F76 AromaticContact CG-CZ 3.39Å; F21-F76 HydrophobicContact CG-CZ 3.39Å; F21-F76 HydrophobicContact CZ-CE2 4.36Å; F21-F76 PolarHBondContact N-O 3.13Å; F21-F76 PolarHBondContact O-N 2.89Å; L68-F76 HydrophobicContact CD2-CE2 4.49Å; A69-F76 HydrophobicContact CB-CD2 4.32Å; A69-F76 HydrophobicContact CB-CE2 3.89Å; A69-F76 HydrophobicContact CB-CZ 4.05Å; T72-F76 HydrophobicContact CG2-CB 4Å; T72-F76 HydrophobicContact CG2-CD1 3.66Å; T72-F76 HydrophobicContact CG2-CE1 4.33Å; T72-F76 HydrophobicContact CG2-CG 3.9Å; F76-V83 HydrophobicContact CD2-CG1 4.16Å; F76-K84 WeakPolarHBondContact CB-O 3.38Å; F76-T85 HydrophobicContact CB-CG2 4.33Å
77	I	97.3	Very high	90.9	Very high	0 Å²	0	53 Å²	53	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	157.6	174.5	66.2	167.1	0	0	0	110.6	E19 L20 F79 V83 K84 I90 L94	E19-I77 CarbonylContact O-C 3.55Å; E19-I77 WeakPolarHBondContact O-CA 3.46Å; E19-I77 WeakPolarHBondContact O-CB 3.21Å; L20-I77 HydrophobicContact CB-CG2 4.4Å; L20-I77 HydrophobicContact CD1-CG2 3.6Å; I77-F79 HydrophobicContact CD1-CB 4.41Å; I77-V83 WeakPolarHBondContact O-CA 3.42Å; I77-K84 HydrophobicContact CD1-CB 4.33Å; I77-K84 HydrophobicContact CD1-CG 4.4Å; I77-K84 HydrophobicContact CG1-CB 3.75Å; I77-K84 HydrophobicContact CG1-CG 4.19Å; I77-K84 PolarHBondContact N-O 2.97Å; I77-K84 VanDerWaalsContact N-O 3.12Å; I77-K84 PolarHBondContact O-N 3.48Å; I77-I90 HydrophobicContact CD1-CG2 3.68Å; I77-I90 HydrophobicContact CG1-CG1 4.33Å; I77-I90 HydrophobicContact CG1-CG2 3.92Å; I77-I90 HydrophobicContact CG2-CG2 4.14Å; I77-L94 HydrophobicContact CD1-CD1 4.45Å; I77-L94 HydrophobicContact CD1-CD2 3.93Å; I77-L94 HydrophobicContact CD1-CG 4.27Å
78	T	96.7	Very high	91.6	Very high	9 Å²	9	51 Å²	51	6%	0.055	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.5	152.9	58.9	0	0	0	0	108.8	I18 E19 F21 L68 E82 V83	I18-T78 WeakPolarHBondContact CA-O 3.3Å; E19-T78 WeakPolarHBondContact CB-OG1 3.47Å; E19-T78 PolarHBondContact N-O 2.8Å; E19-T78 VanDerWaalsContact N-O 3.08Å; E19-T78 PolarHBondContact O-N 3.3Å; F21-T78 HydrophobicContact CE2-CG2 3.72Å; F21-T78 HydrophobicContact CZ-CG2 4.34Å; L68-T78 HydrophobicContact CD1-CG2 3.99Å; L68-T78 HydrophobicContact CD2-CG2 3.95Å; L68-T78 HydrophobicContact CG-CG2 4.26Å; T78-E82 CarbonylContact C-O 3.36Å; T78-E82 VanDerWaalsContact CA-O 3.28Å; T78-E82 WeakPolarHBondContact CA-O 3.22Å; T78-V83 HydrophobicContact CG2-CG2 3.93Å
79	F	96.5	Very high	92.4	Very high	20 Å²	20	54.3 Å²	54.3	9%	0.088	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	111.8	174	-169.1	-80.9	0	0	0	107.9	P16 I18 I77 G81 E82 F93 L94 V97 L98	P16-F79 HydrophobicContact CB-CD2 4.48Å; P16-F79 HydrophobicContact CB-CE1 3.85Å; P16-F79 HydrophobicContact CB-CE2 3.68Å; P16-F79 HydrophobicContact CB-CZ 3.3Å; P16-F79 HydrophobicContact CG-CE2 4.18Å; P16-F79 HydrophobicContact CG-CZ 3.98Å; I18-F79 HydrophobicContact CD1-CD2 3.92Å; I18-F79 HydrophobicContact CD1-CE2 3.69Å; I18-F79 HydrophobicContact CG1-CD2 3.72Å; I18-F79 HydrophobicContact CG1-CE2 3.85Å; I77-F79 HydrophobicContact CD1-CB 4.41Å; F79-G81 PolarHBondContact O-N 3.3Å; F79-E82 PolarHBondContact N-O 3.35Å; F79-E82 WeakPolarHBondContact O-CB 3.47Å; F79-E82 PolarHBondContact O-N 2.9Å; F79-F93 HydrophobicContact CB-CE1 3.92Å; F79-F93 HydrophobicContact CB-CZ 4.24Å; F79-F93 HydrophobicContact CD1-CE1 4.11Å; F79-F93 AromaticContact CD1-CZ 3.8Å; F79-F93 HydrophobicContact CD1-CZ 3.8Å; F79-F93 AromaticContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CZ 4.19Å; F79-F93 HydrophobicContact CE1-CZ 4.17Å; 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 3.82Å; F79-F93 HydrophobicContact CG-CZ 3.82Å; F79-F93 HydrophobicContact CZ-CZ 4.5Å; F79-L94 HydrophobicContact CD2-CD2 4.47Å; F79-V97 HydrophobicContact CE1-CG1 4.11Å; F79-V97 HydrophobicContact CE2-CG1 4.23Å; F79-V97 HydrophobicContact CZ-CG1 3.53Å; F79-L98 HydrophobicContact CE2-CD2 4.38Å
80	N	95.1	Very high	93.2	Very high	102 Å²	102	54.2 Å²	54.2	55%	0.545	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	38.7	-171.3	-64.1	-25	0	0	0	112.9	P16 V17 E82	P16-N80 VanDerWaalsContact CA-OD1 3.31Å; P16-N80 WeakPolarHBondContact CA-OD1 3.44Å; V17-N80 PolarHBondContact N-OD1 3.11Å; V17-N80 PolarHBondContact O-N 3.33Å; N80-E82 VanDerWaalsContact C-N 3.28Å; N80-E82 PolarHBondContact O-N 3.24Å
81	G	91.8	Very high	94.1	Very high	57 Å²	57	51 Å²	51	59%	0.588	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-8.8	-178.5	0	0	0	0	0	115.2	F79	F79-G81 PolarHBondContact O-N 3.3Å
82	E	94.3	Very high	95	Very high	112 Å²	112	54 Å²	54	52%	0.523	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.2	175.8	-163	-164.8	156.9	0	0	110.9	T78 F79 N80 K84	T78-E82 CarbonylContact C-O 3.36Å; T78-E82 VanDerWaalsContact CA-O 3.28Å; T78-E82 WeakPolarHBondContact CA-O 3.22Å; F79-E82 PolarHBondContact N-O 3.35Å; F79-E82 WeakPolarHBondContact O-CB 3.47Å; F79-E82 PolarHBondContact O-N 2.9Å; N80-E82 VanDerWaalsContact C-N 3.28Å; N80-E82 PolarHBondContact O-N 3.24Å; E82-K84 IonicContact OE1-NZ 2.68Å; E82-K84 PolarHBondContact OE1-NZ 2.86Å; E82-K84 WeakPolarHBondContact OE2-CE 3.49Å; E82-K84 IonicContact OE2-NZ 2.77Å; E82-K84 PolarHBondContact OE2-NZ 2.88Å
83	V	95.7	Very high	95.7	Very high	42 Å²	42	54.8 Å²	54.8	26%	0.255	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	126.8	177.6	178.7	0	0	0	0	110.5	L68 A69 F76 I77 T78 T85	L68-V83 HydrophobicContact CD1-CG2 3.99Å; L68-V83 HydrophobicContact CG-CG2 4.03Å; L68-V83 WeakPolarHBondContact O-CG2 3.43Å; A69-V83 HydrophobicContact CB-CG1 4.02Å; A69-V83 HydrophobicContact CB-CG2 4.41Å; F76-V83 HydrophobicContact CD2-CG1 4.16Å; I77-V83 WeakPolarHBondContact O-CA 3.42Å; T78-V83 HydrophobicContact CG2-CG2 3.93Å; V83-T85 HydrophobicContact CG1-CG2 3.97Å
84	K	96.4	Very high	96.2	Very high	44 Å²	44	48.2 Å²	48.2	19%	0.191	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.1	169.8	-53	-66.1	-176.3	-175.7	0	109.4	F76 I77 E82 I90 F93	F76-K84 WeakPolarHBondContact CB-O 3.38Å; I77-K84 HydrophobicContact CD1-CB 4.33Å; I77-K84 HydrophobicContact CD1-CG 4.4Å; I77-K84 HydrophobicContact CG1-CB 3.75Å; I77-K84 HydrophobicContact CG1-CG 4.19Å; I77-K84 PolarHBondContact N-O 2.97Å; I77-K84 VanDerWaalsContact N-O 3.12Å; I77-K84 PolarHBondContact O-N 3.48Å; E82-K84 IonicContact OE1-NZ 2.68Å; E82-K84 PolarHBondContact OE1-NZ 2.86Å; E82-K84 WeakPolarHBondContact OE2-CE 3.49Å; E82-K84 IonicContact OE2-NZ 2.77Å; E82-K84 PolarHBondContact OE2-NZ 2.88Å; K84-I90 HydrophobicContact CB-CG1 3.86Å; K84-I90 WeakPolarHBondContact O-CD1 3.23Å; K84-F93 HydrophobicContact CG-CD1 4.42Å; K84-F93 HydrophobicContact CG-CE1 4.4Å
85	T	94.9	Very high	96.5	Very high	69 Å²	69	48.8 Å²	48.8	42%	0.423	26%	0.259	S	S	.	.			trans	-123.6	172.4	179.3	64.8	0	0	0	0	109.8	T72 F76 V83	T72-T85 HydrophobicContact CG2-CG2 3.58Å; F76-T85 HydrophobicContact CB-CG2 4.33Å; V83-T85 HydrophobicContact CG1-CG2 3.97Å
86	D	95.6	Very high	96.6	Very high	78 Å²	78	53.9 Å²	53.9	42%	0.417	29%	0.285	S	S	.	.	S	Bend	trans	67.3	116.5	-170	-172	-61	0	0	0	112.7	N88 K89 I90	D86-N88 VanDerWaalsContact C-N 3.3Å; D86-N88 PolarHBondContact O-N 3.39Å; D86-N88 PolarHBondContact OD1-N 3.38Å; D86-K89 HydrophobicContact CB-CB 4.09Å; D86-K89 HydrophobicContact CB-CD 4.03Å; D86-K89 HydrophobicContact CB-CG 4.03Å; D86-K89 PolarHBondContact O-N 2.84Å; D86-K89 PolarHBondContact OD1-N 2.95Å; D86-K89 VanDerWaalsContact OD1-N 3.09Å; D86-I90 WeakPolarHBondContact O-CB 3.36Å; D86-I90 WeakPolarHBondContact O-CD1 3.32Å; D86-I90 WeakPolarHBondContact O-CG1 3.41Å; D86-I90 PolarHBondContact O-N 3.05Å
87	V	96.3	Very high	96.5	Very high	22 Å²	22	56.8 Å²	56.8	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-60.3	-39.7	-173	175.9	0	0	0	0	112.2	F36 L40 P75 E91	F36-V87 HydrophobicContact CB-CG1 4.35Å; F36-V87 HydrophobicContact CB-CG2 3.72Å; F36-V87 HydrophobicContact CD1-CG1 4.45Å; F36-V87 HydrophobicContact CD1-CG2 4.45Å; F36-V87 HydrophobicContact CG-CG2 4.24Å; L40-V87 HydrophobicContact CD2-CG1 4.15Å; L40-V87 HydrophobicContact CG-CG1 4.25Å; P75-V87 HydrophobicContact CG-CG2 3.59Å; V87-E91 WeakPolarHBondContact O-CB 3.26Å; V87-E91 PolarHBondContact O-N 3.29Å
88	N	96.6	Very high	96.5	Very high	82 Å²	82	56.8 Å²	56.8	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-74.5	-40.9	-177.3	-62.4	-39.2	0	0	0	110.1	R39 D86 I90 E91 E92	R39-N88 PolarHBondContact NH1-OD1 3.46Å; D86-N88 VanDerWaalsContact C-N 3.3Å; D86-N88 PolarHBondContact O-N 3.39Å; D86-N88 PolarHBondContact OD1-N 3.38Å; N88-I90 VanDerWaalsContact C-N 3.33Å; N88-I90 PolarHBondContact O-N 3.34Å; N88-E91 PolarHBondContact O-N 3.36Å; N88-E92 WeakPolarHBondContact O-CG 3.39Å; N88-E92 PolarHBondContact O-N 3.43Å
89	K	98	Very high	96.3	Very high	137 Å²	137	58.8 Å²	58.8	60%	0.596	32%	0.317	S	S	*	.	H	α-helix	trans	-64.4	-37.9	174.9	-64.2	-174.5	-177.7	179.1	0	112.6	D86 F93	D86-K89 HydrophobicContact CB-CB 4.09Å; D86-K89 HydrophobicContact CB-CD 4.03Å; D86-K89 HydrophobicContact CB-CG 4.03Å; D86-K89 PolarHBondContact O-N 2.84Å; D86-K89 PolarHBondContact OD1-N 2.95Å; D86-K89 VanDerWaalsContact OD1-N 3.09Å; K89-F93 WeakPolarHBondContact O-CB 3.28Å; K89-F93 PolarHBondContact O-N 2.78Å
90	I	98.4	Very high	96.1	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-45.8	174.2	-67.1	162.4	0	0	0	110.1	L40 I77 K84 D86 N88 F93 L94	L40-I90 HydrophobicContact CD1-CB 4.24Å; L40-I90 HydrophobicContact CD1-CD1 3.85Å; L40-I90 HydrophobicContact CD1-CG2 3.9Å; L40-I90 HydrophobicContact CD2-CB 4.24Å; L40-I90 HydrophobicContact CD2-CG2 3.86Å; I77-I90 HydrophobicContact CD1-CG2 3.68Å; I77-I90 HydrophobicContact CG1-CG1 4.33Å; I77-I90 HydrophobicContact CG1-CG2 3.92Å; I77-I90 HydrophobicContact CG2-CG2 4.14Å; K84-I90 HydrophobicContact CB-CG1 3.86Å; K84-I90 WeakPolarHBondContact O-CD1 3.23Å; D86-I90 WeakPolarHBondContact O-CB 3.36Å; D86-I90 WeakPolarHBondContact O-CD1 3.32Å; D86-I90 WeakPolarHBondContact O-CG1 3.41Å; D86-I90 PolarHBondContact O-N 3.05Å; N88-I90 VanDerWaalsContact C-N 3.33Å; N88-I90 PolarHBondContact O-N 3.34Å; I90-F93 PolarHBondContact O-N 2.76Å; I90-L94 HydrophobicContact CG2-CD1 3.74Å; I90-L94 HydrophobicContact CG2-CG 4.11Å; I90-L94 WeakPolarHBondContact O-CB 3.45Å; I90-L94 VanDerWaalsContact O-CG 3.25Å; I90-L94 WeakPolarHBondContact O-CG 3.29Å; I90-L94 PolarHBondContact O-N 3.01Å
91	E	98.4	Very high	96	Very high	24 Å²	24	63.4 Å²	63.4	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-49.5	176.9	174.8	174.2	108.7	0	0	112	R39 I43 V87 N88 F93 L94 E95 L185	R39-E91 IonicContact CZ-OE1 3.07Å; R39-E91 IonicContact CZ-OE2 3.7Å; R39-E91 IonicContact NE-OE2 3.91Å; R39-E91 PolarHBondContact NE-OE2 3.15Å; R39-E91 IonicContact NH2-OE1 3.94Å; R39-E91 PolarHBondContact NH2-OE1 3.12Å; R39-E91 IonicContact NH2-OE2 3.95Å; R39-E91 PolarHBondContact NH2-OE2 3.11Å; I43-E91 HydrophobicContact CD1-CB 4.25Å; I43-E91 HydrophobicContact CD1-CG 3.91Å; I43-E91 WeakPolarHBondContact CD1-OE2 3.44Å; V87-E91 WeakPolarHBondContact O-CB 3.26Å; V87-E91 PolarHBondContact O-N 3.29Å; N88-E91 PolarHBondContact O-N 3.36Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.17Å; E91-L94 PolarHBondContact O-N 2.94Å; E91-E95 WeakPolarHBondContact O-CB 3.36Å; E91-E95 PolarHBondContact O-N 3.45Å; E91-L185 HydrophobicContact CG-CD1 3.95Å; E91-L185 HydrophobicContact CG-CD2 3.91Å; E91-L185 HydrophobicContact CG-CG 4.42Å
92	E	97.9	Very high	96.1	Very high	132 Å²	132	66.2 Å²	66.2	62%	0.617	35%	0.351	S	S	*	.	H	α-helix	trans	-57.1	-46	176.9	-72.7	169.9	-170.5	0	0	111.3	N88 E95 D96	N88-E92 WeakPolarHBondContact O-CG 3.39Å; N88-E92 PolarHBondContact O-N 3.43Å; E92-E95 PolarHBondContact O-N 3.39Å; E92-D96 WeakPolarHBondContact O-CB 3.41Å; E92-D96 PolarHBondContact O-N 2.89Å
93	F	98.3	Very high	96.1	Very high	49 Å²	49	62 Å²	62	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-62.1	-45.2	177.5	171.2	-98.8	0	0	0	112.6	F79 K84 K89 I90 E91 D96 V97	F79-F93 HydrophobicContact CB-CE1 3.92Å; F79-F93 HydrophobicContact CB-CZ 4.24Å; F79-F93 HydrophobicContact CD1-CE1 4.11Å; F79-F93 AromaticContact CD1-CZ 3.8Å; F79-F93 HydrophobicContact CD1-CZ 3.8Å; F79-F93 AromaticContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CE1 3.67Å; F79-F93 HydrophobicContact CD2-CZ 4.19Å; F79-F93 HydrophobicContact CE1-CZ 4.17Å; 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 3.82Å; F79-F93 HydrophobicContact CG-CZ 3.82Å; F79-F93 HydrophobicContact CZ-CZ 4.5Å; K84-F93 HydrophobicContact CG-CD1 4.42Å; K84-F93 HydrophobicContact CG-CE1 4.4Å; K89-F93 WeakPolarHBondContact O-CB 3.28Å; K89-F93 PolarHBondContact O-N 2.78Å; I90-F93 PolarHBondContact O-N 2.76Å; E91-F93 VanDerWaalsContact C-N 3.31Å; E91-F93 PolarHBondContact O-N 3.17Å; F93-D96 PolarHBondContact O-N 3.41Å; F93-V97 HydrophobicContact CD2-CG2 3.87Å; F93-V97 HydrophobicContact CE2-CG2 3.54Å; F93-V97 HydrophobicContact CZ-CB 4.48Å; F93-V97 HydrophobicContact CZ-CG2 3.89Å; F93-V97 WeakPolarHBondContact O-CB 3.47Å; F93-V97 WeakPolarHBondContact O-CG2 3.25Å; F93-V97 PolarHBondContact O-N 3.33Å
94	L	97.9	Very high	96.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.9	-37.9	179	-71.3	175.3	0	0	0	111.6	I43 L44 I77 F79 I90 E91 L98	I43-L94 HydrophobicContact CG2-CD1 4.25Å; L44-L94 HydrophobicContact CD2-CD1 3.82Å; L44-L94 HydrophobicContact CD2-CD2 3.83Å; L44-L94 HydrophobicContact CD2-CG 4.46Å; L44-L94 HydrophobicContact CG-CD1 4.08Å; I77-L94 HydrophobicContact CD1-CD1 4.45Å; I77-L94 HydrophobicContact CD1-CD2 3.93Å; I77-L94 HydrophobicContact CD1-CG 4.27Å; F79-L94 HydrophobicContact CD2-CD2 4.47Å; I90-L94 HydrophobicContact CG2-CD1 3.74Å; I90-L94 HydrophobicContact CG2-CG 4.11Å; I90-L94 WeakPolarHBondContact O-CB 3.45Å; I90-L94 VanDerWaalsContact O-CG 3.25Å; I90-L94 WeakPolarHBondContact O-CG 3.29Å; I90-L94 PolarHBondContact O-N 3.01Å; E91-L94 PolarHBondContact O-N 2.94Å; L94-L98 HydrophobicContact CD2-CD1 3.93Å; L94-L98 WeakPolarHBondContact O-CA 3.19Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 PolarHBondContact O-N 3.08Å
95	E	97.8	Very high	96.1	Very high	30 Å²	30	69.3 Å²	69.3	14%	0.14	37%	0.367	C	S	.	.	H	α-helix	trans	-67.1	-36.9	177.4	-175.5	64.5	-175.2	0	0	112.1	K47 E91 E92 K105 L106 G107 L185	K47-E95 WeakPolarHBondContact CE-OE2 3.34Å; K47-E95 IonicContact NZ-OE1 3.52Å; K47-E95 IonicContact NZ-OE2 2.75Å; K47-E95 PolarHBondContact NZ-OE2 3.23Å; E91-E95 WeakPolarHBondContact O-CB 3.36Å; E91-E95 PolarHBondContact O-N 3.45Å; E92-E95 PolarHBondContact O-N 3.39Å; E95-K105 WeakPolarHBondContact OE1-CG 3.32Å; E95-L106 PolarHBondContact OE1-N 3.06Å; E95-L106 PolarHBondContact OE2-N 3.29Å; E95-G107 PolarHBondContact OE1-N 3.06Å; E95-L185 HydrophobicContact CB-CD1 4.33Å; E95-L185 HydrophobicContact CG-CD1 4.16Å
96	D	97.1	Very high	96.2	Very high	122 Å²	122	66.4 Å²	66.4	65%	0.652	35%	0.349	S	S	*	.	H	α-helix	trans	-72.7	-50.8	178	-173.6	59.7	0	0	0	112.3	E92 F93 S99	E92-D96 WeakPolarHBondContact O-CB 3.41Å; E92-D96 PolarHBondContact O-N 2.89Å; F93-D96 PolarHBondContact O-N 3.41Å; D96-S99 VanDerWaalsContact O-CB 3.31Å; D96-S99 WeakPolarHBondContact O-CB 3.42Å; D96-S99 PolarHBondContact O-OG 3Å
97	V	96.2	Very high	96.3	Very high	60 Å²	60	63.9 Å²	63.9	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-78	-35.1	-174.3	176.6	0	0	0	0	112.5	F79 F93 S99	F79-V97 HydrophobicContact CE1-CG1 4.11Å; F79-V97 HydrophobicContact CE2-CG1 4.23Å; F79-V97 HydrophobicContact CZ-CG1 3.53Å; F93-V97 HydrophobicContact CD2-CG2 3.87Å; F93-V97 HydrophobicContact CE2-CG2 3.54Å; F93-V97 HydrophobicContact CZ-CB 4.48Å; F93-V97 HydrophobicContact CZ-CG2 3.89Å; F93-V97 WeakPolarHBondContact O-CB 3.47Å; F93-V97 WeakPolarHBondContact O-CG2 3.25Å; F93-V97 PolarHBondContact O-N 3.33Å; V97-S99 PolarHBondContact O-N 3.47Å
98	L	95.7	Very high	96.3	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	34%	0.343	C	S	.	.	S	Bend	trans	-96.6	68.8	175.6	-52	176.3	0	0	0	109.4	P16 I18 L44 K47 V49 F79 L94 F103	P16-L98 HydrophobicContact CG-CD2 4.21Å; I18-L98 HydrophobicContact CD1-CD1 4.18Å; I18-L98 HydrophobicContact CD1-CD2 4.49Å; L44-L98 HydrophobicContact CD2-CD1 4.27Å; K47-L98 HydrophobicContact CB-CD1 4.16Å; K47-L98 HydrophobicContact CD-CB 3.88Å; K47-L98 WeakPolarHBondContact CE-O 3.44Å; K47-L98 HydrophobicContact CG-CB 4.29Å; K47-L98 HydrophobicContact CG-CD1 4.05Å; K47-L98 PolarHBondContact NZ-O 3.12Å; V49-L98 HydrophobicContact CB-CD1 4.38Å; V49-L98 HydrophobicContact CG1-CD1 4Å; V49-L98 HydrophobicContact CG2-CD2 4.47Å; F79-L98 HydrophobicContact CE2-CD2 4.38Å; L94-L98 HydrophobicContact CD2-CD1 3.93Å; L94-L98 WeakPolarHBondContact O-CA 3.19Å; L94-L98 WeakPolarHBondContact O-CB 3.48Å; L94-L98 PolarHBondContact O-N 3.08Å; L98-F103 HydrophobicContact CB-CB 4.13Å; L98-F103 HydrophobicContact CB-CD2 3.83Å; L98-F103 HydrophobicContact CB-CE2 4.35Å; L98-F103 HydrophobicContact CB-CG 3.94Å; L98-F103 HydrophobicContact CD2-CD2 4.02Å; L98-F103 HydrophobicContact CD2-CE1 4.43Å; L98-F103 HydrophobicContact CD2-CE2 3.64Å; L98-F103 HydrophobicContact CD2-CZ 3.87Å; L98-F103 WeakPolarHBondContact O-CB 3.43Å
99	S	92.4	Very high	96.3	Very high	50 Å²	50	68.5 Å²	68.5	35%	0.35	35%	0.353	S	S	.	.			trans	-110	167.2	-173.7	49	0	0	0	0	113.9	D96 V97 F103	D96-S99 VanDerWaalsContact O-CB 3.31Å; D96-S99 WeakPolarHBondContact O-CB 3.42Å; D96-S99 PolarHBondContact O-OG 3Å; V97-S99 PolarHBondContact O-N 3.47Å; S99-F103 CarbonylContact C-O 3.57Å; S99-F103 PolarHBondContact O-N 3.32Å
100	P	93.4	Very high	96.2	Very high	79 Å²	79	62.8 Å²	62.8	51%	0.513	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	151.6	174.3	-26.3	35.4	0	0	0	112.7	F103 K105	P100-F103 VanDerWaalsContact CA-O 3.31Å; P100-F103 WeakPolarHBondContact CA-O 3.21Å; P100-F103 WeakPolarHBondContact CD-O 3.36Å; P100-F103 WeakPolarHBondContact CG-O 3.25Å; P100-F103 VanDerWaalsContact N-O 3.1Å; P100-K105 HydrophobicContact CG-CB 4.14Å
101	P	93.3	Very high	96.1	Very high	141 Å²	141	67.7 Å²	67.7	92%	0.916	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.2	-9	9	33.9	-36.6	0	0	0	114.5
102	K	93	Very high	96	Very high	116 Å²	116	72.1 Å²	72.1	50%	0.504	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-37	-173.6	-175	173	177.1	179.6	0	112.6	E15	E15-K102 IonicContact OE1-NZ 3.78Å; E15-K102 PolarHBondContact OE1-NZ 3.46Å
103	F	94.9	Very high	96	Very high	24 Å²	24	65.9 Å²	65.9	11%	0.105	35%	0.352	C	S	.	.	S	Bend	trans	-124.9	148.6	-175.9	-55.6	-74.8	0	0	0	111	K47 V49 L98 S99 P100	K47-F103 HydrophobicContact CD-CB 4.32Å; K47-F103 WeakPolarHBondContact O-CD1 3.4Å; V49-F103 HydrophobicContact CB-CE1 3.95Å; V49-F103 HydrophobicContact CG2-CE1 4.09Å; V49-F103 HydrophobicContact CG2-CZ 4.3Å; L98-F103 HydrophobicContact CB-CB 4.13Å; L98-F103 HydrophobicContact CB-CD2 3.83Å; L98-F103 HydrophobicContact CB-CE2 4.35Å; L98-F103 HydrophobicContact CB-CG 3.94Å; L98-F103 HydrophobicContact CD2-CD2 4.02Å; L98-F103 HydrophobicContact CD2-CE1 4.43Å; L98-F103 HydrophobicContact CD2-CE2 3.64Å; L98-F103 HydrophobicContact CD2-CZ 3.87Å; L98-F103 WeakPolarHBondContact O-CB 3.43Å; S99-F103 CarbonylContact C-O 3.57Å; S99-F103 PolarHBondContact O-N 3.32Å; P100-F103 VanDerWaalsContact CA-O 3.31Å; P100-F103 WeakPolarHBondContact CA-O 3.21Å; P100-F103 WeakPolarHBondContact CD-O 3.36Å; P100-F103 WeakPolarHBondContact CG-O 3.25Å; P100-F103 VanDerWaalsContact N-O 3.1Å
104	T	94.8	Very high	95.9	Very high	92 Å²	92	67.1 Å²	67.1	56%	0.564	36%	0.361	S	S	*	.			trans	-68.2	139.8	179	-57.7	0	0	0	0	111.1	K47 L106	K47-T104 WeakPolarHBondContact CD-O 3.36Å; K47-T104 PolarHBondContact NZ-O 2.95Å; T104-L106 HydrophobicContact CG2-CD2 4.28Å
105	K	96.8	Very high	95.8	Very high	147 Å²	147	71 Å²	71	64%	0.639	39%	0.385	S	S	*	.			trans	-76.6	128.1	170	-169.1	-178.5	-179.3	178.9	0	109.3	E95 P100	E95-K105 WeakPolarHBondContact OE1-CG 3.32Å; P100-K105 HydrophobicContact CG-CB 4.14Å
106	L	97.9	Very high	95.7	Very high	7 Å²	7	70.3 Å²	70.3	4%	0.037	38%	0.384	C	S	.	.			trans	-107.7	-8.6	-178.2	-59	-179.2	0	0	0	112.8	I43 L46 K47 E95 T104 T184 L185	I43-L106 HydrophobicContact CG2-CD1 4.26Å; L46-L106 HydrophobicContact CB-CD1 3.69Å; L46-L106 HydrophobicContact CB-CD2 3.94Å; L46-L106 HydrophobicContact CB-CG 4.49Å; L46-L106 HydrophobicContact CD1-CD1 4.48Å; K47-L106 HydrophobicContact CD-CD1 4.07Å; K47-L106 HydrophobicContact CD-CG 4.3Å; K47-L106 HydrophobicContact CG-CD1 4.02Å; E95-L106 PolarHBondContact OE1-N 3.06Å; E95-L106 PolarHBondContact OE2-N 3.29Å; T104-L106 HydrophobicContact CG2-CD2 4.28Å; L106-T184 CarbonylContact O-C 3.5Å; L106-T184 VanDerWaalsContact O-CA 3.24Å; L106-T184 WeakPolarHBondContact O-CA 3.43Å; L106-T184 WeakPolarHBondContact O-CB 3.47Å; L106-L185 HydrophobicContact CB-CD2 3.8Å; L106-L185 HydrophobicContact CB-CG 3.86Å; L106-L185 HydrophobicContact CD1-CD2 4.3Å; L106-L185 PolarHBondContact O-N 2.89Å
107	G	96.8	Very high	95.7	Very high	25 Å²	25	65.2 Å²	65.2	26%	0.258	36%	0.361	S	S	.	.	S	Bend	trans	-58.1	140.4	174.8	0	0	0	0	0	112.5	E95	E95-G107 PolarHBondContact OE1-N 3.06Å
108	T	96.8	Very high	95.5	Very high	29 Å²	29	68 Å²	68	18%	0.178	37%	0.371	C	S	.	.			trans	-66.1	147.8	177.5	58.8	0	0	0	0	111.9	N114 D179 T184 A186	T108-N114 WeakPolarHBondContact CG2-OD1 3.23Å; T108-N114 PolarHBondContact OG1-ND2 3.33Å; T108-N114 PolarHBondContact OG1-OD1 3.26Å; T108-D179 WeakPolarHBondContact CA-OD2 3.46Å; T108-D179 HydrophobicContact CG2-CB 4.37Å; T108-T184 HydrophobicContact CG2-CG2 4.5Å; T108-A186 HydrophobicContact CG2-CB 3.62Å
109	R	96.3	Very high	95.5	Very high	173 Å²	173	72 Å²	72	65%	0.653	39%	0.393	S	S	*	.	S	Bend	trans	-82.4	-37.5	169.5	-59.8	174.8	64.4	-155.3	-5.4	111.4	D160 D179	R109-D160 IonicContact CZ-OD1 3.31Å; R109-D160 IonicContact CZ-OD2 2.82Å; R109-D160 IonicContact NE-OD2 3.84Å; R109-D160 IonicContact NH1-OD2 3.18Å; R109-D160 PolarHBondContact NH1-OD2 3.5Å; R109-D160 IonicContact NH2-OD1 2.73Å; R109-D160 PolarHBondContact NH2-OD1 3.37Å; R109-D160 IonicContact NH2-OD2 2.75Å; R109-D160 PolarHBondContact NH2-OD2 3Å; R109-D179 WeakPolarHBondContact CB-OD2 3.41Å; R109-D179 PolarHBondContact N-OD2 3.48Å
110	H	96.9	Very high	95.8	Very high	17 Å²	17	69.8 Å²	69.8	8%	0.079	38%	0.377	C	S	.	.	S	Bend	trans	-102.3	121.1	-178.8	-48.3	87.6	0	0	0	110.3	E112 S113 D160 D179	H110-E112 PolarHBondContact O-N 3.01Å; H110-E112 VanDerWaalsContact O-N 3.17Å; H110-S113 VanDerWaalsContact O-CB 3.24Å; H110-S113 WeakPolarHBondContact O-CB 3.46Å; H110-S113 PolarHBondContact O-N 3.38Å; H110-S113 VanDerWaalsContact O-N 3.11Å; H110-S113 PolarHBondContact O-OG 3.47Å; H110-D160 IonicContact CE1-OD2 2.82Å; H110-D160 PolarHBondContact CE1-OD2 3.23Å; H110-D160 IonicContact NE2-OD2 3.2Å; H110-D160 PolarHBondContact NE2-OD2 3.26Å; H110-D179 VanDerWaalsContact CB-OD1 3.26Å; H110-D179 WeakPolarHBondContact CB-OD1 3.42Å; H110-D179 IonicContact CG-OD1 3.4Å; H110-D179 PolarHBondContact N-OD1 2.67Å; H110-D179 IonicContact ND1-OD1 2.69Å; H110-D179 PolarHBondContact ND1-OD1 2.93Å; H110-D179 IonicContact ND1-OD2 2.74Å
111	P	95.2	Very high	96	Very high	103 Å²	103	68 Å²	68	67%	0.669	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-57.5	-31.9	-179.7	-28.1	36	0	0	0	114.1	S113 N114	P111-S113 PolarHBondContact O-N 3.07Å; P111-N114 WeakPolarHBondContact O-CB 3.45Å; P111-N114 PolarHBondContact O-N 2.86Å
112	E	96.1	Very high	96.2	Very high	117 Å²	117	64.2 Å²	64.2	55%	0.547	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-60.5	-34.4	179.2	-69.7	153.4	178.3	0	0	112	H110 N114 T115 A116 Y153	H110-E112 PolarHBondContact O-N 3.01Å; H110-E112 VanDerWaalsContact O-N 3.17Å; E112-N114 PolarHBondContact O-N 3.27Å; E112-T115 PolarHBondContact O-N 3.28Å; E112-T115 PolarHBondContact O-OG1 3.2Å; E112-A116 PolarHBondContact O-N 3.3Å; E112-Y153 HydrophobicContact CB-CE2 3.93Å
113	S	97.8	Very high	96.4	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.007	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-55.1	-37.2	176.4	-53.8	0	0	0	0	112.3	H110 P111 T115 Y153 D179 A186	H110-S113 VanDerWaalsContact O-CB 3.24Å; H110-S113 WeakPolarHBondContact O-CB 3.46Å; H110-S113 PolarHBondContact O-N 3.38Å; H110-S113 VanDerWaalsContact O-N 3.11Å; H110-S113 PolarHBondContact O-OG 3.47Å; P111-S113 PolarHBondContact O-N 3.07Å; S113-T115 VanDerWaalsContact C-N 3.27Å; S113-T115 PolarHBondContact O-N 2.89Å; S113-Y153 WeakPolarHBondContact CA-OH 3.29Å; S113-Y153 PolarHBondContact N-OH 3.24Å; S113-Y153 PolarHBondContact OG-OH 3.16Å; S113-D179 WeakPolarHBondContact CB-OD1 3.32Å; S113-D179 PolarHBondContact OG-OD1 3.27Å; S113-A186 WeakPolarHBondContact O-CB 3.5Å
114	N	95.9	Very high	96.6	Very high	76 Å²	76	62.5 Å²	62.5	41%	0.406	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-70.4	-22.8	179.5	-65.2	-55.8	0	0	0	113.7	T108 P111 E112	T108-N114 WeakPolarHBondContact CG2-OD1 3.23Å; T108-N114 PolarHBondContact OG1-ND2 3.33Å; T108-N114 PolarHBondContact OG1-OD1 3.26Å; P111-N114 WeakPolarHBondContact O-CB 3.45Å; P111-N114 PolarHBondContact O-N 2.86Å; E112-N114 PolarHBondContact O-N 3.27Å
115	T	95.8	Very high	96.7	Very high	80 Å²	80	59.4 Å²	59.4	49%	0.491	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-16.4	-175.8	63.2	0	0	0	0	112.7	E112 S113 G117 M118	E112-T115 PolarHBondContact O-N 3.28Å; E112-T115 PolarHBondContact O-OG1 3.2Å; S113-T115 VanDerWaalsContact C-N 3.27Å; S113-T115 PolarHBondContact O-N 2.89Å; T115-G117 PolarHBondContact O-N 2.98Å; T115-M118 HydrophobicContact CG2-SD 4.29Å; T115-M118 WeakPolarHBondContact O-CB 3.33Å; T115-M118 WeakPolarHBondContact O-CG 3.32Å; T115-M118 PolarHBondContact O-N 3.31Å; T115-M118 VanDerWaalsContact O-N 3.12Å
116	A	97	Very high	96.7	Very high	16 Å²	16	54.7 Å²	54.7	13%	0.132	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	119.5	174.4	0	0	0	0	0	111	E112 M118 L150 Y153 L178	E112-A116 PolarHBondContact O-N 3.3Å; A116-M118 VanDerWaalsContact C-N 3.3Å; A116-M118 PolarHBondContact O-N 3.45Å; A116-L150 HydrophobicContact CB-CD1 4.29Å; A116-Y153 HydrophobicContact CB-CD1 3.61Å; A116-Y153 HydrophobicContact CB-CE1 3.77Å; A116-Y153 HydrophobicContact CB-CG 4.06Å; A116-L178 HydrophobicContact CB-CD2 4.1Å
117	G	95.8	Very high	96.7	Very high	15 Å²	15	54.3 Å²	54.3	16%	0.155	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	7.8	178	0	0	0	0	0	116.1	T115 D119 I120	T115-G117 PolarHBondContact O-N 2.98Å; G117-D119 PolarHBondContact O-N 2.96Å; G117-D119 VanDerWaalsContact O-N 3.16Å; G117-I120 VanDerWaalsContact CA-CD1 3.5Å; G117-I120 WeakPolarHBondContact O-CB 3.28Å; G117-I120 WeakPolarHBondContact O-CG1 3.42Å; G117-I120 PolarHBondContact O-N 3.21Å; G117-I120 VanDerWaalsContact O-N 3.11Å
118	M	93.9	Very high	96.7	Very high	119 Å²	119	53.1 Å²	53.1	59%	0.586	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-32.6	-176.2	72	-178.8	-66.7	0	0	114	T115 A116	T115-M118 HydrophobicContact CG2-SD 4.29Å; T115-M118 WeakPolarHBondContact O-CB 3.33Å; T115-M118 WeakPolarHBondContact O-CG 3.32Å; T115-M118 PolarHBondContact O-N 3.31Å; T115-M118 VanDerWaalsContact O-N 3.12Å; A116-M118 VanDerWaalsContact C-N 3.3Å; A116-M118 PolarHBondContact O-N 3.45Å
119	D	95.2	Very high	96.6	Very high	86 Å²	86	57 Å²	57	46%	0.46	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-14.4	-177.9	-69.7	-27.2	0	0	0	114	G117 F121 A122 K123 T146	G117-D119 PolarHBondContact O-N 2.96Å; G117-D119 VanDerWaalsContact O-N 3.16Å; D119-F121 VanDerWaalsContact C-N 3.31Å; D119-F121 PolarHBondContact O-N 3.35Å; D119-A122 PolarHBondContact O-N 3.27Å; D119-K123 PolarHBondContact O-N 2.9Å; D119-T146 HydrophobicContact CB-CG2 3.99Å
120	I	98.1	Very high	96.5	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-56.5	-48	-172.2	-70.6	170.4	0	0	0	110.3	G117 A122 K123 F124 L143 L147 L150 L190 V197	G117-I120 VanDerWaalsContact CA-CD1 3.5Å; G117-I120 WeakPolarHBondContact O-CB 3.28Å; G117-I120 WeakPolarHBondContact O-CG1 3.42Å; G117-I120 PolarHBondContact O-N 3.21Å; G117-I120 VanDerWaalsContact O-N 3.11Å; I120-A122 VanDerWaalsContact C-N 3.31Å; I120-A122 PolarHBondContact O-N 2.83Å; I120-K123 PolarHBondContact O-N 3.15Å; I120-F124 VanDerWaalsContact O-CB 3.28Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 3.29Å; I120-L143 HydrophobicContact CG2-CD1 4.17Å; I120-L147 HydrophobicContact CD1-CD2 4.22Å; I120-L147 HydrophobicContact CG2-CD2 4.31Å; I120-L150 HydrophobicContact CD1-CB 3.99Å; I120-L150 HydrophobicContact CD1-CD2 3.56Å; I120-L150 HydrophobicContact CD1-CG 4.38Å; I120-L190 HydrophobicContact CD1-CD1 4.4Å; I120-V197 HydrophobicContact CG2-CG2 4Å
121	F	97.3	Very high	96.4	Very high	40 Å²	40	50.9 Å²	50.9	18%	0.175	29%	0.289	C	S	.	.	H	α-helix	trans	-68.5	-31.6	-174.5	-158.8	-106.2	0	0	0	112.7	P35 D119 F124 S125 K193 I196 V197 Y243	P35-F121 HydrophobicContact CG-CZ 4.28Å; D119-F121 VanDerWaalsContact C-N 3.31Å; D119-F121 PolarHBondContact O-N 3.35Å; F121-F124 AromaticContact CD2-CD1 3.86Å; F121-F124 HydrophobicContact CD2-CD1 3.86Å; F121-F124 HydrophobicContact CD2-CE1 4.3Å; F121-F124 AromaticContact CE2-CD1 3.89Å; F121-F124 HydrophobicContact CE2-CD1 3.89Å; F121-F124 AromaticContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CG-CD1 4.44Å; F121-F124 HydrophobicContact CZ-CD1 4.47Å; F121-F124 HydrophobicContact CZ-CE1 4.28Å; F121-S125 VanDerWaalsContact O-CB 3.29Å; F121-S125 WeakPolarHBondContact O-CB 3.3Å; F121-S125 PolarHBondContact O-N 2.86Å; F121-S125 PolarHBondContact O-OG 2.97Å; F121-K193 HydrophobicContact CB-CB 4.24Å; F121-K193 HydrophobicContact CB-CD 4.06Å; F121-K193 HydrophobicContact CB-CG 4.31Å; F121-K193 HydrophobicContact CD2-CB 3.56Å; F121-K193 HydrophobicContact CD2-CD 4.49Å; F121-K193 HydrophobicContact CD2-CG 3.83Å; F121-K193 HydrophobicContact CE2-CB 4.14Å; F121-K193 HydrophobicContact CE2-CG 4.24Å; F121-K193 HydrophobicContact CG-CB 4.08Å; F121-K193 HydrophobicContact CG-CD 4.2Å; F121-K193 HydrophobicContact CG-CG 4Å; F121-I196 HydrophobicContact CE2-CB 4.24Å; F121-I196 HydrophobicContact CE2-CD1 4.37Å; F121-I196 HydrophobicContact CE2-CG2 3.99Å; F121-V197 HydrophobicContact CD2-CG2 4.26Å; F121-Y243 WeakPolarHBondContact CZ-OH 3.39Å
122	A	97.8	Very high	96.3	Very high	63 Å²	63	52.9 Å²	52.9	52%	0.521	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-44.7	175	0	0	0	0	0	111.4	D119 I120 S125 A126	D119-A122 PolarHBondContact O-N 3.27Å; I120-A122 VanDerWaalsContact C-N 3.31Å; I120-A122 PolarHBondContact O-N 2.83Å; A122-S125 WeakPolarHBondContact O-CB 3.48Å; A122-S125 PolarHBondContact O-N 3.34Å; A122-A126 PolarHBondContact O-N 2.87Å; A122-A126 VanDerWaalsContact O-N 3.07Å
123	K	98.2	Very high	96.1	Very high	103 Å²	103	49.7 Å²	49.7	45%	0.448	28%	0.277	S	S	.	.	H	α-helix	trans	-64.8	-43.3	175.3	-63.8	-56	-178.6	-175.4	0	112.1	D119 I120 S125 A126 F127 L143 T146	D119-K123 PolarHBondContact O-N 2.9Å; I120-K123 PolarHBondContact O-N 3.15Å; K123-S125 VanDerWaalsContact C-N 3.33Å; K123-S125 PolarHBondContact O-N 3.47Å; K123-A126 PolarHBondContact O-N 2.84Å; K123-F127 WeakPolarHBondContact O-CB 3.4Å; K123-F127 PolarHBondContact O-N 2.95Å; K123-L143 HydrophobicContact CB-CB 4.46Å; K123-L143 HydrophobicContact CB-CD1 4.45Å; K123-T146 HydrophobicContact CG-CG2 3.72Å
124	F	98.1	Very high	95.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-55.6	-47.9	171	157.9	-107.8	0	0	0	111.5	I120 F121 A126 F127 I128 L143 I196 V197 V200 T201 Y243	I120-F124 VanDerWaalsContact O-CB 3.28Å; I120-F124 WeakPolarHBondContact O-CB 3.49Å; I120-F124 PolarHBondContact O-N 3.29Å; F121-F124 AromaticContact CD2-CD1 3.86Å; F121-F124 HydrophobicContact CD2-CD1 3.86Å; F121-F124 HydrophobicContact CD2-CE1 4.3Å; F121-F124 AromaticContact CE2-CD1 3.89Å; F121-F124 HydrophobicContact CE2-CD1 3.89Å; F121-F124 AromaticContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CE2-CE1 3.86Å; F121-F124 HydrophobicContact CG-CD1 4.44Å; F121-F124 HydrophobicContact CZ-CD1 4.47Å; F121-F124 HydrophobicContact CZ-CE1 4.28Å; F124-A126 VanDerWaalsContact C-N 3.3Å; F124-A126 PolarHBondContact O-N 3.27Å; F124-F127 PolarHBondContact O-N 3.29Å; F124-F127 VanDerWaalsContact O-N 3.15Å; F124-I128 HydrophobicContact CD2-CB 4.31Å; F124-I128 HydrophobicContact CD2-CG2 4.44Å; F124-I128 HydrophobicContact CE1-CG2 4.38Å; F124-I128 HydrophobicContact CE2-CB 3.89Å; F124-I128 HydrophobicContact CE2-CG1 4.2Å; F124-I128 HydrophobicContact CE2-CG2 4.02Å; F124-I128 HydrophobicContact CZ-CB 4.32Å; F124-I128 HydrophobicContact CZ-CG2 4Å; F124-I128 WeakPolarHBondContact O-CG2 3.49Å; F124-I128 PolarHBondContact O-N 3.07Å; F124-L143 HydrophobicContact CB-CD1 4.07Å; F124-I196 HydrophobicContact CE1-CG2 4Å; F124-I196 HydrophobicContact CZ-CG2 4.06Å; F124-V197 HydrophobicContact CB-CG1 4.34Å; F124-V197 HydrophobicContact CB-CG2 3.66Å; F124-V197 HydrophobicContact CD1-CG2 3.84Å; F124-V197 HydrophobicContact CD2-CB 4.26Å; F124-V197 HydrophobicContact CD2-CG1 4.06Å; F124-V197 HydrophobicContact CD2-CG2 3.98Å; F124-V197 HydrophobicContact CE1-CG2 4.47Å; F124-V197 HydrophobicContact CG-CB 4.32Å; F124-V197 HydrophobicContact CG-CG1 4.33Å; F124-V197 HydrophobicContact CG-CG2 3.54Å; F124-V200 HydrophobicContact CE2-CB 3.88Å; F124-V200 HydrophobicContact CE2-CG1 3.84Å; F124-V200 HydrophobicContact CZ-CB 3.79Å; F124-V200 HydrophobicContact CZ-CG1 3.76Å; F124-V200 HydrophobicContact CZ-CG2 4.21Å; F124-T201 HydrophobicContact CD2-CG2 3.62Å; F124-T201 HydrophobicContact CE2-CG2 3.74Å; F124-Y243 AromaticContact CE1-CE1 3.74Å; F124-Y243 HydrophobicContact CE1-CE1 3.74Å; F124-Y243 AromaticContact CE1-CZ 3.87Å; F124-Y243 HydrophobicContact CZ-CD1 4.22Å; F124-Y243 AromaticContact CZ-CE1 3.66Å; F124-Y243 HydrophobicContact CZ-CE1 3.66Å
125	S	97.1	Very high	95.8	Very high	27 Å²	27	55.8 Å²	55.8	19%	0.189	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-40.4	-179.7	-68.8	0	0	0	0	112.4	F121 A122 K123 K129	F121-S125 VanDerWaalsContact O-CB 3.29Å; F121-S125 WeakPolarHBondContact O-CB 3.3Å; F121-S125 PolarHBondContact O-N 2.86Å; F121-S125 PolarHBondContact O-OG 2.97Å; A122-S125 WeakPolarHBondContact O-CB 3.48Å; A122-S125 PolarHBondContact O-N 3.34Å; K123-S125 VanDerWaalsContact C-N 3.33Å; K123-S125 PolarHBondContact O-N 3.47Å; S125-K129 VanDerWaalsContact O-CB 3.3Å; S125-K129 WeakPolarHBondContact O-CB 3.33Å; S125-K129 WeakPolarHBondContact O-CD 3.36Å; S125-K129 VanDerWaalsContact O-CG 3.23Å; S125-K129 WeakPolarHBondContact O-CG 3.46Å; S125-K129 PolarHBondContact O-N 3.25Å
126	A	96.9	Very high	95.8	Very high	48 Å²	48	53.1 Å²	53.1	40%	0.397	30%	0.297	S	S	.	.	H	α-helix	trans	-66.9	-43.9	175	0	0	0	0	0	111.7	A122 K123 F124 N130 L139	A122-A126 PolarHBondContact O-N 2.87Å; A122-A126 VanDerWaalsContact O-N 3.07Å; K123-A126 PolarHBondContact O-N 2.84Å; F124-A126 VanDerWaalsContact C-N 3.3Å; F124-A126 PolarHBondContact O-N 3.27Å; A126-N130 PolarHBondContact O-N 3.2Å; A126-L139 HydrophobicContact CB-CD2 4Å
127	F	97.3	Very high	95.7	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-49.4	178.9	175.4	-123.1	0	0	0	112.8	K123 F124 K129 N130 N136 L139 E140 L143 T201 R205 F207	K123-F127 WeakPolarHBondContact O-CB 3.4Å; K123-F127 PolarHBondContact O-N 2.95Å; F124-F127 PolarHBondContact O-N 3.29Å; F124-F127 VanDerWaalsContact O-N 3.15Å; F127-K129 PolarHBondContact O-N 2.77Å; F127-N130 VanDerWaalsContact O-CB 3.3Å; F127-N130 WeakPolarHBondContact O-CB 3.42Å; F127-N130 PolarHBondContact O-N 3.4Å; F127-N136 WeakPolarHBondContact CE2-OD1 3.28Å; F127-L139 HydrophobicContact CB-CB 4.19Å; F127-L139 HydrophobicContact CD2-CB 3.94Å; F127-E140 HydrophobicContact CD2-CB 4.13Å; F127-E140 HydrophobicContact CE2-CB 3.61Å; F127-E140 HydrophobicContact CE2-CG 4.08Å; F127-E140 HydrophobicContact CZ-CB 4.07Å; F127-E140 HydrophobicContact CZ-CG 4.01Å; F127-L143 HydrophobicContact CD1-CD2 3.86Å; F127-L143 HydrophobicContact CE1-CD2 4.36Å; F127-T201 HydrophobicContact CD1-CG2 4.21Å; F127-T201 HydrophobicContact CE1-CG2 4.18Å; F127-R205 HydrophobicContact CE1-CB 4.09Å; F127-R205 HydrophobicContact CE1-CG 3.83Å; F127-R205 HydrophobicContact CZ-CB 4.02Å; F127-R205 HydrophobicContact CZ-CG 3.83Å; F127-F207 HydrophobicContact CE1-CB 4.48Å
128	I	96.9	Very high	95.8	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-72.3	-31.5	-174.9	-164.4	61.6	0	0	0	112.9	F124 N130 V200 R205 Y243 A247	F124-I128 HydrophobicContact CD2-CB 4.31Å; F124-I128 HydrophobicContact CD2-CG2 4.44Å; F124-I128 HydrophobicContact CE1-CG2 4.38Å; F124-I128 HydrophobicContact CE2-CB 3.89Å; F124-I128 HydrophobicContact CE2-CG1 4.2Å; F124-I128 HydrophobicContact CE2-CG2 4.02Å; F124-I128 HydrophobicContact CZ-CB 4.32Å; F124-I128 HydrophobicContact CZ-CG2 4Å; F124-I128 WeakPolarHBondContact O-CG2 3.49Å; F124-I128 PolarHBondContact O-N 3.07Å; I128-N130 VanDerWaalsContact C-N 3.29Å; I128-V200 HydrophobicContact CD1-CG1 3.7Å; I128-V200 HydrophobicContact CG1-CG1 3.63Å; I128-R205 HydrophobicContact CD1-CG 4.08Å; I128-R205 PolarHBondContact O-NH2 2.94Å; I128-Y243 HydrophobicContact CG2-CD1 4.47Å; I128-Y243 HydrophobicContact CG2-CE1 4.4Å; I128-A247 HydrophobicContact CD1-CB 3.92Å; I128-A247 HydrophobicContact CG1-CB 3.88Å; I128-A247 WeakPolarHBondContact O-CA 3.4Å
129	K	95.5	Very high	96	Very high	110 Å²	110	56.8 Å²	56.8	48%	0.478	32%	0.32	S	S	.	.	H	α-helix	trans	-82.2	-7.5	177.8	-66.2	175.6	-178.1	176.8	0	113.1	S125 F127 K248	S125-K129 VanDerWaalsContact O-CB 3.3Å; S125-K129 WeakPolarHBondContact O-CB 3.33Å; S125-K129 WeakPolarHBondContact O-CD 3.36Å; S125-K129 VanDerWaalsContact O-CG 3.23Å; S125-K129 WeakPolarHBondContact O-CG 3.46Å; S125-K129 PolarHBondContact O-N 3.25Å; F127-K129 PolarHBondContact O-N 2.77Å; K129-K248 WeakPolarHBondContact O-CD 3.39Å
130	N	94.4	Very high	96.1	Very high	18 Å²	18	55.8 Å²	55.8	10%	0.096	31%	0.313	C	S	.	.			trans	-66.6	135.1	179.1	179	42.3	0	0	0	111.6	A126 F127 I128 K132 L139 R205	A126-N130 PolarHBondContact O-N 3.2Å; F127-N130 VanDerWaalsContact O-CB 3.3Å; F127-N130 WeakPolarHBondContact O-CB 3.42Å; F127-N130 PolarHBondContact O-N 3.4Å; I128-N130 VanDerWaalsContact C-N 3.29Å; N130-K132 PolarHBondContact ND2-O 2.88Å; N130-K132 PolarHBondContact OD1-N 3.24Å; N130-K132 PolarHBondContact OD1-O 2.82Å; N130-L139 HydrophobicContact CB-CD1 3.52Å; N130-R205 PolarHBondContact O-NH2 3.33Å
131	S	93.3	Very high	96.1	Very high	43 Å²	43	61.6 Å²	61.6	30%	0.301	34%	0.335	S	S	.	.			trans	-116.9	-4.2	172.7	61.1	0	0	0	0	113.5	V251	S131-V251 PolarHBondContact O-N 2.88Å
132	K	93.5	Very high	96.1	Very high	146 Å²	146	60.7 Å²	60.7	64%	0.635	34%	0.336	S	S	*	.			trans	-95.9	117.3	-176.3	-62.2	-176	-179.4	-176.2	0	110.4	N130 D134 A135 N136	N130-K132 PolarHBondContact ND2-O 2.88Å; N130-K132 PolarHBondContact OD1-N 3.24Å; N130-K132 PolarHBondContact OD1-O 2.82Å; K132-D134 PolarHBondContact O-N 3.1Å; K132-A135 HydrophobicContact CB-CB 4.22Å; K132-A135 PolarHBondContact O-N 3.37Å; K132-N136 PolarHBondContact O-N 3.21Å
133	P	92.2	Very high	96.1	Very high	50 Å²	50	57.7 Å²	57.7	33%	0.325	31%	0.312	S	S	.	.	H	α-helix	trans	-55.4	-45.9	179.8	-27.2	35.3	0	0	0	113.3	A135 N136 L250 V251	P133-A135 PolarHBondContact O-N 2.99Å; P133-A135 VanDerWaalsContact O-N 3.16Å; P133-N136 VanDerWaalsContact O-CB 3.23Å; P133-N136 WeakPolarHBondContact O-CB 3.31Å; P133-N136 PolarHBondContact O-N 2.7Å; P133-L250 HydrophobicContact CG-CB 4.45Å; P133-V251 WeakPolarHBondContact CD-O 3.31Å; P133-V251 VanDerWaalsContact CG-O 3.24Å; P133-V251 WeakPolarHBondContact CG-O 3.37Å
134	D	93.8	Very high	96.1	Very high	165 Å²	165	55 Å²	55	88%	0.882	30%	0.302	S	S	*	.	H	α-helix	trans	-62.4	-27.6	-175.9	-54.4	-15.5	0	0	0	113.6	K132	K132-D134 PolarHBondContact O-N 3.1Å
135	A	94.2	Very high	96.1	Very high	39 Å²	39	61 Å²	61	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-86.5	-14.1	178.2	0	0	0	0	0	113.1	K132 P133 G138 L139	K132-A135 HydrophobicContact CB-CB 4.22Å; K132-A135 PolarHBondContact O-N 3.37Å; P133-A135 PolarHBondContact O-N 2.99Å; P133-A135 VanDerWaalsContact O-N 3.16Å; A135-G138 PolarHBondContact O-N 3.34Å; A135-L139 HydrophobicContact CB-CD1 4.36Å; A135-L139 WeakPolarHBondContact O-CG 3.4Å; A135-L139 PolarHBondContact O-N 3.03Å; A135-L139 VanDerWaalsContact O-N 3.12Å
136	N	94.4	Very high	96.2	Very high	24 Å²	24	60.3 Å²	60.3	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-63.6	-48.4	-168.6	-170.1	77.8	0	0	0	112.2	F127 K132 P133 G138 L139 E140 L250	F127-N136 WeakPolarHBondContact CE2-OD1 3.28Å; K132-N136 PolarHBondContact O-N 3.21Å; P133-N136 VanDerWaalsContact O-CB 3.23Å; P133-N136 WeakPolarHBondContact O-CB 3.31Å; P133-N136 PolarHBondContact O-N 2.7Å; N136-G138 VanDerWaalsContact C-N 3.29Å; N136-G138 PolarHBondContact O-N 2.98Å; N136-L139 PolarHBondContact O-N 3.4Å; N136-E140 WeakPolarHBondContact O-CB 3.41Å; N136-E140 PolarHBondContact O-N 3Å; N136-L250 HydrophobicContact CB-CD1 4.19Å; N136-L250 HydrophobicContact CB-CD2 4.27Å
137	E	95.8	Very high	96.3	Very high	131 Å²	131	58 Å²	58	61%	0.612	30%	0.304	S	S	*	.	H	α-helix	trans	-60.8	-38.6	-179.1	-167.6	-168.5	156.3	0	0	111.9	R141	E137-R141 VanDerWaalsContact CD-NH2 3.32Å; E137-R141 VanDerWaalsContact O-CB 3.26Å; E137-R141 WeakPolarHBondContact O-CB 3.22Å; E137-R141 PolarHBondContact O-N 3Å; E137-R141 IonicContact OE1-CZ 2.76Å; E137-R141 IonicContact OE1-NH2 2.66Å; E137-R141 PolarHBondContact OE1-NH2 3.35Å
138	G	97.6	Very high	96.3	Very high	46 Å²	46	62.7 Å²	62.7	47%	0.474	33%	0.325	S	S	.	.	H	α-helix	trans	-66.3	-41.4	176.5	0	0	0	0	0	112.7	A135 N136 G142	A135-G138 PolarHBondContact O-N 3.34Å; N136-G138 VanDerWaalsContact C-N 3.29Å; N136-G138 PolarHBondContact O-N 2.98Å; G138-G142 PolarHBondContact O-N 3.06Å
139	L	97.6	Very high	96.4	Very high	51 Å²	51	69.4 Å²	69.4	27%	0.267	36%	0.355	S	S	.	.	H	α-helix	trans	-71.6	-41.4	179.4	-69.3	170.4	0	0	0	112.2	A126 F127 N130 A135 N136 G142 L143	A126-L139 HydrophobicContact CB-CD2 4Å; F127-L139 HydrophobicContact CB-CB 4.19Å; F127-L139 HydrophobicContact CD2-CB 3.94Å; N130-L139 HydrophobicContact CB-CD1 3.52Å; A135-L139 HydrophobicContact CB-CD1 4.36Å; A135-L139 WeakPolarHBondContact O-CG 3.4Å; A135-L139 PolarHBondContact O-N 3.03Å; A135-L139 VanDerWaalsContact O-N 3.12Å; N136-L139 PolarHBondContact O-N 3.4Å; L139-G142 WeakPolarHBondContact O-CA 3.45Å; L139-G142 PolarHBondContact O-N 3.13Å; L139-G142 VanDerWaalsContact O-N 3.13Å; L139-L143 PolarHBondContact O-N 3.21Å
140	E	97.5	Very high	96.6	Very high	64 Å²	64	64.2 Å²	64.2	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-59.8	-47.4	174.3	-169.9	176.7	141.6	0	0	110.9	F127 N136 G142 L143 L144 F207	F127-E140 HydrophobicContact CD2-CB 4.13Å; F127-E140 HydrophobicContact CE2-CB 3.61Å; F127-E140 HydrophobicContact CE2-CG 4.08Å; F127-E140 HydrophobicContact CZ-CB 4.07Å; F127-E140 HydrophobicContact CZ-CG 4.01Å; N136-E140 WeakPolarHBondContact O-CB 3.41Å; N136-E140 PolarHBondContact O-N 3Å; E140-G142 PolarHBondContact O-N 2.93Å; E140-L143 WeakPolarHBondContact O-CB 3.32Å; E140-L143 PolarHBondContact O-N 3.13Å; E140-L143 VanDerWaalsContact O-N 3.11Å; E140-L144 HydrophobicContact CG-CD1 4.36Å; E140-L144 PolarHBondContact O-N 3Å; E140-F207 HydrophobicContact CG-CD2 3.86Å; E140-F207 HydrophobicContact CG-CE2 3.89Å
141	R	97.9	Very high	96.8	Very high	126 Å²	126	63.6 Å²	63.6	48%	0.475	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-35.5	174.1	-164.3	-173.7	-37	-140.5	-1.6	112.3	E137 K145	E137-R141 VanDerWaalsContact CD-NH2 3.32Å; E137-R141 VanDerWaalsContact O-CB 3.26Å; E137-R141 WeakPolarHBondContact O-CB 3.22Å; E137-R141 PolarHBondContact O-N 3Å; E137-R141 IonicContact OE1-CZ 2.76Å; E137-R141 IonicContact OE1-NH2 2.66Å; E137-R141 PolarHBondContact OE1-NH2 3.35Å; R141-K145 WeakPolarHBondContact O-CG 3.48Å; R141-K145 PolarHBondContact O-N 3.21Å
142	G	98.1	Very high	97	Very high	21 Å²	21	65.3 Å²	65.3	22%	0.216	33%	0.332	C	S	.	.	H	α-helix	trans	-62.6	-43.9	174	0	0	0	0	0	112.7	G138 L139 E140 T146	G138-G142 PolarHBondContact O-N 3.06Å; L139-G142 WeakPolarHBondContact O-CA 3.45Å; L139-G142 PolarHBondContact O-N 3.13Å; L139-G142 VanDerWaalsContact O-N 3.13Å; E140-G142 PolarHBondContact O-N 2.93Å; G142-T146 PolarHBondContact O-N 2.99Å
143	L	98.3	Very high	97.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.9	-47.1	174.5	176.2	60.2	0	0	0	111.4	I120 K123 F124 F127 L139 E140 K145 T146 L147 V197 T201 F207	I120-L143 HydrophobicContact CG2-CD1 4.17Å; K123-L143 HydrophobicContact CB-CB 4.46Å; K123-L143 HydrophobicContact CB-CD1 4.45Å; F124-L143 HydrophobicContact CB-CD1 4.07Å; F127-L143 HydrophobicContact CD1-CD2 3.86Å; F127-L143 HydrophobicContact CE1-CD2 4.36Å; L139-L143 PolarHBondContact O-N 3.21Å; E140-L143 WeakPolarHBondContact O-CB 3.32Å; E140-L143 PolarHBondContact O-N 3.13Å; E140-L143 VanDerWaalsContact O-N 3.11Å; L143-K145 VanDerWaalsContact C-N 3.31Å; L143-K145 PolarHBondContact O-N 3.3Å; L143-T146 PolarHBondContact O-N 3.37Å; L143-T146 PolarHBondContact O-OG1 2.81Å; L143-L147 HydrophobicContact CD1-CD1 4.39Å; L143-L147 HydrophobicContact CD1-CG 4.39Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 PolarHBondContact O-N 3.36Å; L143-V197 HydrophobicContact CD1-CG1 4.35Å; L143-V197 HydrophobicContact CD2-CG1 4.33Å; L143-T201 HydrophobicContact CD2-CG2 4.18Å; L143-F207 HydrophobicContact CD2-CE1 4.15Å; L143-F207 HydrophobicContact CD2-CZ 4.41Å
144	L	98.3	Very high	97.5	Very high	46 Å²	46	58.3 Å²	58.3	24%	0.241	30%	0.297	C	S	.	.	H	α-helix	trans	-55.7	-44.4	177.6	-79.6	168.7	0	0	0	112.1	E140 T146 L147 Q148 F207 P210 M213	E140-L144 HydrophobicContact CG-CD1 4.36Å; E140-L144 PolarHBondContact O-N 3Å; L144-T146 VanDerWaalsContact C-N 3.3Å; L144-T146 PolarHBondContact O-N 2.79Å; L144-L147 PolarHBondContact O-N 3.37Å; L144-Q148 WeakPolarHBondContact O-CB 3.45Å; L144-Q148 PolarHBondContact O-N 2.75Å; L144-F207 HydrophobicContact CD1-CE2 4.21Å; L144-F207 HydrophobicContact CD2-CE2 3.68Å; L144-F207 HydrophobicContact CD2-CZ 3.58Å; L144-F207 HydrophobicContact CG-CE2 3.79Å; L144-F207 HydrophobicContact CG-CZ 3.95Å; L144-P210 HydrophobicContact CD2-CG 3.62Å; L144-M213 HydrophobicContact CD2-CE 4.21Å
145	K	98.4	Very high	97.7	Very high	126 Å²	126	54.9 Å²	54.9	55%	0.548	27%	0.271	S	S	.	.	H	α-helix	trans	-59.6	-38.4	175.9	-77.3	179	178.3	-172.9	0	112.8	R141 L143 K149	R141-K145 WeakPolarHBondContact O-CG 3.48Å; R141-K145 PolarHBondContact O-N 3.21Å; L143-K145 VanDerWaalsContact C-N 3.31Å; L143-K145 PolarHBondContact O-N 3.3Å; K145-K149 WeakPolarHBondContact O-CG 3.46Å; K145-K149 PolarHBondContact O-N 2.73Å; K145-K149 VanDerWaalsContact O-N 3.13Å
146	T	98.3	Very high	97.7	Very high	13 Å²	13	56.1 Å²	56.1	8%	0.08	28%	0.278	C	S	.	.	H	α-helix	trans	-72.3	-35	177.4	53.2	0	0	0	0	112.8	D119 K123 G142 L143 L144 L150	D119-T146 HydrophobicContact CB-CG2 3.99Å; K123-T146 HydrophobicContact CG-CG2 3.72Å; G142-T146 PolarHBondContact O-N 2.99Å; L143-T146 PolarHBondContact O-N 3.37Å; L143-T146 PolarHBondContact O-OG1 2.81Å; L144-T146 VanDerWaalsContact C-N 3.3Å; L144-T146 PolarHBondContact O-N 2.79Å; T146-L150 PolarHBondContact O-N 3.44Å
147	L	98.6	Very high	97.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-43.4	172.5	-68.7	168.3	0	0	0	110.7	I120 L143 L144 K149 L150 D151 L194 F207 I209 M213 I216	I120-L147 HydrophobicContact CD1-CD2 4.22Å; I120-L147 HydrophobicContact CG2-CD2 4.31Å; L143-L147 HydrophobicContact CD1-CD1 4.39Å; L143-L147 HydrophobicContact CD1-CG 4.39Å; L143-L147 HydrophobicContact CG-CD1 4.13Å; L143-L147 PolarHBondContact O-N 3.36Å; L144-L147 PolarHBondContact O-N 3.37Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.42Å; L147-L150 WeakPolarHBondContact O-CB 3.07Å; L147-L150 PolarHBondContact O-N 3.49Å; L147-L150 VanDerWaalsContact O-N 3.1Å; L147-D151 PolarHBondContact O-N 3.2Å; L147-L194 HydrophobicContact CD2-CD1 3.98Å; L147-F207 HydrophobicContact CD1-CE1 4.12Å; L147-F207 HydrophobicContact CD1-CZ 4.08Å; L147-I209 HydrophobicContact CD1-CG1 4.36Å; L147-M213 HydrophobicContact CB-CE 4.03Å; L147-M213 HydrophobicContact CB-SD 3.74Å; L147-I216 HydrophobicContact CB-CD1 4.11Å; L147-I216 HydrophobicContact CD2-CD1 4.09Å; L147-I216 VanDerWaalsContact O-CD1 3.28Å; L147-I216 WeakPolarHBondContact O-CD1 3.18Å
148	Q	98.4	Very high	97.7	Very high	97 Å²	97	50.5 Å²	50.5	45%	0.453	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-43.1	177.1	-173.9	179	-11.3	0	0	112	L144 L150 D151 E152 M213	L144-Q148 WeakPolarHBondContact O-CB 3.45Å; L144-Q148 PolarHBondContact O-N 2.75Å; Q148-L150 VanDerWaalsContact C-N 3.33Å; Q148-L150 PolarHBondContact O-N 3Å; Q148-D151 PolarHBondContact O-N 3.44Å; Q148-E152 HydrophobicContact CG-CG 4.47Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.43Å; Q148-E152 WeakPolarHBondContact O-CB 3.47Å; Q148-E152 VanDerWaalsContact O-CG 3.31Å; Q148-E152 WeakPolarHBondContact O-CG 3.48Å; Q148-E152 PolarHBondContact O-N 3.17Å; Q148-M213 HydrophobicContact CB-CE 4.08Å
149	K	98.4	Very high	97.4	Very high	141 Å²	141	52.2 Å²	52.2	61%	0.613	26%	0.256	S	S	*	.	H	α-helix	trans	-60.6	-39.7	174.6	-74.1	-179.7	176.9	-168	0	113.1	K145 L147 Y153	K145-K149 WeakPolarHBondContact O-CG 3.46Å; K145-K149 PolarHBondContact O-N 2.73Å; K145-K149 VanDerWaalsContact O-N 3.13Å; L147-K149 VanDerWaalsContact C-N 3.33Å; L147-K149 PolarHBondContact O-N 3.42Å; K149-Y153 WeakPolarHBondContact O-CB 3.48Å; K149-Y153 PolarHBondContact O-N 3.21Å
150	L	98.7	Very high	97	Very high	2 Å²	2	54 Å²	54	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-67.4	-41.9	176	173.2	65	0	0	0	111.2	A116 I120 T146 L147 Q148 Y153 L154 L178 L190 L194 I216	A116-L150 HydrophobicContact CB-CD1 4.29Å; I120-L150 HydrophobicContact CD1-CB 3.99Å; I120-L150 HydrophobicContact CD1-CD2 3.56Å; I120-L150 HydrophobicContact CD1-CG 4.38Å; T146-L150 PolarHBondContact O-N 3.44Å; L147-L150 WeakPolarHBondContact O-CB 3.07Å; L147-L150 PolarHBondContact O-N 3.49Å; L147-L150 VanDerWaalsContact O-N 3.1Å; Q148-L150 VanDerWaalsContact C-N 3.33Å; Q148-L150 PolarHBondContact O-N 3Å; L150-Y153 WeakPolarHBondContact O-CB 3.42Å; L150-Y153 PolarHBondContact O-N 2.89Å; L150-L154 HydrophobicContact CD1-CD1 4.07Å; L150-L154 HydrophobicContact CD1-CG 4.23Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 WeakPolarHBondContact O-CG 3.36Å; L150-L154 PolarHBondContact O-N 3Å; L150-L178 HydrophobicContact CD1-CD2 3.92Å; L150-L190 HydrophobicContact CD1-CD2 3.8Å; L150-L190 HydrophobicContact CD2-CD2 3.91Å; L150-L194 HydrophobicContact CD2-CD2 4.16Å; L150-I216 HydrophobicContact CB-CD1 4.28Å; L150-I216 HydrophobicContact CD2-CD1 4.04Å; L150-I216 HydrophobicContact CD2-CG1 4.1Å; L150-I216 HydrophobicContact CG-CD1 4.21Å; L150-I216 HydrophobicContact CG-CG1 4.11Å
151	D	98.6	Very high	96.4	Very high	5 Å²	5	52.9 Å²	52.9	3%	0.027	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-46.6	176.1	-178.7	77.7	0	0	0	112.1	L147 Q148 Y153 L154 R155 M213 T214 G215 I216	L147-D151 PolarHBondContact O-N 3.2Å; Q148-D151 PolarHBondContact O-N 3.44Å; D151-Y153 VanDerWaalsContact C-N 3.29Å; D151-Y153 PolarHBondContact O-N 2.86Å; D151-L154 PolarHBondContact O-N 3.15Å; D151-R155 WeakPolarHBondContact O-CG 3.27Å; D151-R155 PolarHBondContact O-N 3.39Å; D151-R155 IonicContact OD2-CZ 3.98Å; D151-R155 IonicContact OD2-NE 2.72Å; D151-R155 PolarHBondContact OD2-NE 3.19Å; D151-R155 IonicContact OD2-NH2 3Å; D151-R155 PolarHBondContact OD2-NH2 3.06Å; D151-M213 HydrophobicContact CB-CB 4.14Å; D151-M213 HydrophobicContact CB-CG 4.31Å; D151-M213 WeakPolarHBondContact OD1-CA 3.33Å; D151-T214 PolarHBondContact OD1-N 3.1Å; D151-G215 WeakPolarHBondContact OD1-CA 3.3Å; D151-G215 PolarHBondContact OD1-N 3.28Å; D151-I216 HydrophobicContact CB-CD1 4.06Å; D151-I216 HydrophobicContact CB-CG1 4.01Å; D151-I216 PolarHBondContact OD1-N 3.44Å
152	E	97.9	Very high	95.8	Very high	79 Å²	79	50.5 Å²	50.5	37%	0.369	26%	0.256	S	S	.	.	H	α-helix	trans	-57.7	-43.4	174.9	-74.4	167.5	-173.7	0	0	111.2	Q148 R155 S156	Q148-E152 HydrophobicContact CG-CG 4.47Å; Q148-E152 WeakPolarHBondContact CG-OE1 3.39Å; Q148-E152 PolarHBondContact NE2-OE1 3.43Å; Q148-E152 WeakPolarHBondContact O-CB 3.47Å; Q148-E152 VanDerWaalsContact O-CG 3.31Å; Q148-E152 WeakPolarHBondContact O-CG 3.48Å; Q148-E152 PolarHBondContact O-N 3.17Å; E152-R155 PolarHBondContact O-N 2.85Å; E152-S156 WeakPolarHBondContact O-CB 3.23Å; E152-S156 PolarHBondContact O-N 2.88Å; E152-S156 PolarHBondContact O-OG 2.79Å
153	Y	98.3	Very high	94.9	Very high	36 Å²	36	53.9 Å²	53.9	14%	0.141	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-49	175.3	177	-100.7	0	0	0	112.3	E112 S113 A116 K149 L150 D151 R155 S156 L158 R175 L178	E112-Y153 HydrophobicContact CB-CE2 3.93Å; S113-Y153 WeakPolarHBondContact CA-OH 3.29Å; S113-Y153 PolarHBondContact N-OH 3.24Å; S113-Y153 PolarHBondContact OG-OH 3.16Å; A116-Y153 HydrophobicContact CB-CD1 3.61Å; A116-Y153 HydrophobicContact CB-CE1 3.77Å; A116-Y153 HydrophobicContact CB-CG 4.06Å; K149-Y153 WeakPolarHBondContact O-CB 3.48Å; K149-Y153 PolarHBondContact O-N 3.21Å; L150-Y153 WeakPolarHBondContact O-CB 3.42Å; L150-Y153 PolarHBondContact O-N 2.89Å; D151-Y153 VanDerWaalsContact C-N 3.29Å; D151-Y153 PolarHBondContact O-N 2.86Å; Y153-R155 VanDerWaalsContact C-N 3.28Å; Y153-R155 PolarHBondContact O-N 2.89Å; Y153-S156 PolarHBondContact O-N 2.96Å; Y153-L158 HydrophobicContact CE2-CD2 4.38Å; Y153-R175 PolarHBondContact O-NH2 3.26Å; Y153-L178 HydrophobicContact CD1-CD2 4.13Å; Y153-L178 HydrophobicContact CE1-CD2 3.94Å; Y153-L178 PolarHBondContact OH-O 3.07Å
154	L	98.3	Very high	93.7	Very high	13 Å²	13	61.9 Å²	61.9	7%	0.068	31%	0.307	C	S	.	.	H	α-helix	trans	-62	-34	-179.5	-75.3	165.7	0	0	0	112.8	L150 D151 S173 L178 I216 Y219	L150-L154 HydrophobicContact CD1-CD1 4.07Å; L150-L154 HydrophobicContact CD1-CG 4.23Å; L150-L154 HydrophobicContact CG-CD1 3.94Å; L150-L154 WeakPolarHBondContact O-CG 3.36Å; L150-L154 PolarHBondContact O-N 3Å; D151-L154 PolarHBondContact O-N 3.15Å; L154-S173 VanDerWaalsContact O-CB 3.29Å; L154-S173 WeakPolarHBondContact O-CB 3.49Å; L154-S173 PolarHBondContact O-OG 3.34Å; L154-L178 HydrophobicContact CD2-CD2 4.02Å; L154-I216 HydrophobicContact CD1-CG1 3.94Å; L154-Y219 HydrophobicContact CD1-CD1 4.01Å; L154-Y219 HydrophobicContact CD1-CG 4.09Å; L154-Y219 HydrophobicContact CD2-CD1 4.46Å; L154-Y219 HydrophobicContact CD2-CD2 4.29Å; L154-Y219 HydrophobicContact CD2-CG 4.07Å
155	R	97.1	Very high	92.6	Very high	93 Å²	93	66.9 Å²	66.9	35%	0.351	33%	0.333	S	S	.	.	H	α-helix	trans	-83.1	-22.2	177.9	-67.8	-168.5	-64.6	119.9	-0.5	113.9	D151 E152 Y153 I172 S173 T214	D151-R155 WeakPolarHBondContact O-CG 3.27Å; D151-R155 PolarHBondContact O-N 3.39Å; D151-R155 IonicContact OD2-CZ 3.98Å; D151-R155 IonicContact OD2-NE 2.72Å; D151-R155 PolarHBondContact OD2-NE 3.19Å; D151-R155 IonicContact OD2-NH2 3Å; D151-R155 PolarHBondContact OD2-NH2 3.06Å; E152-R155 PolarHBondContact O-N 2.85Å; Y153-R155 VanDerWaalsContact C-N 3.28Å; Y153-R155 PolarHBondContact O-N 2.89Å; R155-I172 WeakPolarHBondContact O-CA 3.21Å; R155-S173 WeakPolarHBondContact O-CB 3.28Å; R155-S173 PolarHBondContact O-N 3.3Å; R155-T214 WeakPolarHBondContact CD-OG1 3.47Å
156	S	96.1	Very high	91.5	Very high	65 Å²	65	63.2 Å²	63.2	46%	0.455	32%	0.324	S	S	.	.	S	Bend	trans	-77.6	125	178.8	-61.5	0	0	0	0	109.8	E152 Y153 R175	E152-S156 WeakPolarHBondContact O-CB 3.23Å; E152-S156 PolarHBondContact O-N 2.88Å; E152-S156 PolarHBondContact O-OG 2.79Å; Y153-S156 PolarHBondContact O-N 2.96Å; S156-R175 PolarHBondContact O-NH1 2.93Å
157	P	94.7	Very high	90	Very high	30 Å²	30	70.8 Å²	70.8	20%	0.195	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-57.3	138	176.8	-21.9	31.6	0	0	0	111.8	E161 I162 I170	P157-E161 HydrophobicContact CB-CB 4.1Å; P157-I162 HydrophobicContact CB-CD1 4.46Å; P157-I162 HydrophobicContact CB-CG1 4.05Å; P157-I170 HydrophobicContact CB-CG2 4.31Å; P157-I170 HydrophobicContact CG-CG2 3.91Å; P157-I170 VanDerWaalsContact CG-O 3.32Å; P157-I170 WeakPolarHBondContact CG-O 3.44Å
158	L	94.5	Very high	88.9	Confident	7 Å²	7	78.3 Å²	78.3	4%	0.037	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-71.9	159.2	169.1	-64.7	174	0	0	0	110.4	Y153 D160 E161 R175	Y153-L158 HydrophobicContact CE2-CD2 4.38Å; L158-D160 PolarHBondContact O-N 3.49Å; L158-D160 VanDerWaalsContact O-N 3.14Å; L158-E161 HydrophobicContact CB-CG 4.34Å; L158-E161 PolarHBondContact N-OE2 3.11Å; L158-E161 WeakPolarHBondContact O-CB 3.15Å; L158-E161 PolarHBondContact O-N 3.25Å; L158-R175 VanDerWaalsContact CD1-CD 3.44Å
159	P	91.2	Very high	87.6	Confident	81 Å²	81	79.9 Å²	79.9	53%	0.526	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-51	-37.7	176.7	-29.4	35.7	0	0	0	114.3	E161 I162	P159-E161 VanDerWaalsContact C-N 3.26Å; P159-E161 PolarHBondContact O-N 3.29Å; P159-I162 PolarHBondContact O-N 3.17Å
160	D	88.5	Confident	86.5	Confident	89 Å²	89	77.2 Å²	77.2	48%	0.476	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-71	-19.3	178.4	-61.6	-42.3	0	0	0	114	R109 H110 L158 I162	R109-D160 IonicContact CZ-OD1 3.31Å; R109-D160 IonicContact CZ-OD2 2.82Å; R109-D160 IonicContact NE-OD2 3.84Å; R109-D160 IonicContact NH1-OD2 3.18Å; R109-D160 PolarHBondContact NH1-OD2 3.5Å; R109-D160 IonicContact NH2-OD1 2.73Å; R109-D160 PolarHBondContact NH2-OD1 3.37Å; R109-D160 IonicContact NH2-OD2 2.75Å; R109-D160 PolarHBondContact NH2-OD2 3Å; H110-D160 IonicContact CE1-OD2 2.82Å; H110-D160 PolarHBondContact CE1-OD2 3.23Å; H110-D160 IonicContact NE2-OD2 3.2Å; H110-D160 PolarHBondContact NE2-OD2 3.26Å; L158-D160 PolarHBondContact O-N 3.49Å; L158-D160 VanDerWaalsContact O-N 3.14Å; D160-I162 VanDerWaalsContact C-N 3.31Å
161	E	86.3	Confident	85.7	Confident	41 Å²	41	85 Å²	85	19%	0.192	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-84.2	-8.8	176.9	-62.6	179.6	86.8	0	0	111.7	P157 L158 P159 I170 S173 T174 R175	P157-E161 HydrophobicContact CB-CB 4.1Å; L158-E161 HydrophobicContact CB-CG 4.34Å; L158-E161 PolarHBondContact N-OE2 3.11Å; L158-E161 WeakPolarHBondContact O-CB 3.15Å; L158-E161 PolarHBondContact O-N 3.25Å; P159-E161 VanDerWaalsContact C-N 3.26Å; P159-E161 PolarHBondContact O-N 3.29Å; E161-I170 WeakPolarHBondContact O-CD1 3.37Å; E161-S173 PolarHBondContact OE1-OG 2.92Å; E161-S173 PolarHBondContact OE2-OG 2.85Å; E161-T174 PolarHBondContact OE1-N 3.16Å; E161-R175 PolarHBondContact OE1-N 2.77Å; E161-R175 IonicContact OE2-NH1 2.77Å; E161-R175 PolarHBondContact OE2-NH1 3.31Å
162	I	85.2	Confident	85.2	Confident	75 Å²	75	89.9 Å²	89.9	39%	0.385	46%	0.459	S	S	.	.			trans	-99.6	108.2	-174.7	-58.5	169.7	0	0	0	109.5	P157 P159 D160 H164	P157-I162 HydrophobicContact CB-CD1 4.46Å; P157-I162 HydrophobicContact CB-CG1 4.05Å; P159-I162 PolarHBondContact O-N 3.17Å; D160-I162 VanDerWaalsContact C-N 3.31Å; I162-H164 PolarHBondContact O-N 3.3Å
163	D	78.9	Confident	85.1	Confident	92 Å²	92	86.4 Å²	86.4	49%	0.492	44%	0.443	S	S	.	.			trans	-86.3	103.3	168.6	-177.5	4.2	0	0	0	110.3	N165 S166	D163-N165 PolarHBondContact O-N 3.3Å; D163-N165 VanDerWaalsContact O-N 3.1Å; D163-N165 WeakPolarHBondContact OD1-CB 3.39Å; D163-N165 PolarHBondContact OD1-N 3.37Å; D163-S166 WeakPolarHBondContact O-CB 3.42Å; D163-S166 PolarHBondContact O-N 3.06Å
164	H	74.1	Confident	84.8	Confident	169 Å²	169	89.9 Å²	89.9	78%	0.782	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-13.1	177.5	-69.5	-59.1	0	0	0	114.5	I162	I162-H164 PolarHBondContact O-N 3.3Å
165	N	73.6	Confident	84.7	Confident	150 Å²	150	89.9 Å²	89.9	80%	0.802	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-4.6	175.8	-57.9	-54.6	0	0	0	112.9	D163	D163-N165 PolarHBondContact O-N 3.3Å; D163-N165 VanDerWaalsContact O-N 3.1Å; D163-N165 WeakPolarHBondContact OD1-CB 3.39Å; D163-N165 PolarHBondContact OD1-N 3.37Å
166	S	76.6	Confident	84.8	Confident	49 Å²	49	89.9 Å²	89.9	34%	0.343	47%	0.47	S	S	.	.			trans	-74.7	141.8	174.8	177.7	0	0	0	0	110.7	D163 E168	D163-S166 WeakPolarHBondContact O-CB 3.42Å; D163-S166 PolarHBondContact O-N 3.06Å; S166-E168 VanDerWaalsContact C-N 3.27Å; S166-E168 PolarHBondContact OG-N 3.19Å; S166-E168 PolarHBondContact OG-O 2.91Å; S166-E168 VanDerWaalsContact OG-O 3.13Å
167	I	67.1	Low	84.9	Confident	172 Å²	172	86.9 Å²	86.9	88%	0.882	45%	0.449	S	S	*	.	S	Bend	trans	-78	-20.4	172.9	-55.2	171.7	0	0	0	110.3
168	E	74.1	Confident	85	Confident	159 Å²	159	85.4 Å²	85.4	74%	0.743	44%	0.439	S	S	*	.	S	Bend	trans	-94.9	116.9	177.9	-66.1	-173.5	177.6	0	0	110.9	S166 I170	S166-E168 VanDerWaalsContact C-N 3.27Å; S166-E168 PolarHBondContact OG-N 3.19Å; S166-E168 PolarHBondContact OG-O 2.91Å; S166-E168 VanDerWaalsContact OG-O 3.13Å; E168-I170 PolarHBondContact O-N 3.18Å
169	D	72.3	Confident	85.2	Confident	130 Å²	130	85.5 Å²	85.5	70%	0.695	44%	0.44	S	S	*	.			trans	-67.3	110.8	168.2	-70.6	-34.3	0	0	0	109.4	K171	D169-K171 HydrophobicContact CB-CG 4.09Å; D169-K171 PolarHBondContact O-N 2.73Å
170	I	74.4	Confident	85.5	Confident	85 Å²	85	82.6 Å²	82.6	44%	0.436	42%	0.424	S	S	.	.			trans	-67.7	104	165.6	-64.5	167.8	0	0	0	106.7	P157 E161 E168 I172	P157-I170 HydrophobicContact CB-CG2 4.31Å; P157-I170 HydrophobicContact CG-CG2 3.91Å; P157-I170 VanDerWaalsContact CG-O 3.32Å; P157-I170 WeakPolarHBondContact CG-O 3.44Å; E161-I170 WeakPolarHBondContact O-CD1 3.37Å; E168-I170 PolarHBondContact O-N 3.18Å; I170-I172 WeakPolarHBondContact CG2-O 3.46Å
171	K	82.2	Confident	85.9	Confident	166 Å²	166	82.2 Å²	82.2	72%	0.722	42%	0.422	S	S	*	.			trans	-93.8	-18.4	-178.4	-70.8	177	-174.6	177.5	0	113.2	D169	D169-K171 HydrophobicContact CB-CG 4.09Å; D169-K171 PolarHBondContact O-N 2.73Å
172	I	88.8	Confident	86.4	Confident	107 Å²	107	86.1 Å²	86.1	55%	0.549	44%	0.44	S	S	.	.	S	Bend	trans	-133.9	123.9	-177	-55.4	178.9	0	0	0	107.5	R155 I170	R155-I172 WeakPolarHBondContact O-CA 3.21Å; I170-I172 WeakPolarHBondContact CG2-O 3.46Å
173	S	94.4	Very high	87	Confident	5 Å²	5	82.8 Å²	82.8	4%	0.035	42%	0.423	C	S	.	.			trans	-57.7	146	173.5	171.5	0	0	0	0	111.7	L154 R155 E161 R175	L154-S173 VanDerWaalsContact O-CB 3.29Å; L154-S173 WeakPolarHBondContact O-CB 3.49Å; L154-S173 PolarHBondContact O-OG 3.34Å; R155-S173 WeakPolarHBondContact O-CB 3.28Å; R155-S173 PolarHBondContact O-N 3.3Å; E161-S173 PolarHBondContact OE1-OG 2.92Å; E161-S173 PolarHBondContact OE2-OG 2.85Å; S173-R175 WeakPolarHBondContact OG-CG 3.2Å; S173-R175 PolarHBondContact OG-N 3.22Å; S173-R175 PolarHBondContact OG-NH1 3.06Å
174	T	92.8	Very high	88	Confident	109 Å²	109	79 Å²	79	67%	0.669	40%	0.403	S	S	*	.			trans	-117.1	0.4	174	60	0	0	0	0	113.2	E161	E161-T174 PolarHBondContact OE1-N 3.16Å
175	R	96.5	Very high	89.1	Confident	14 Å²	14	71.7 Å²	71.7	5%	0.053	37%	0.37	C	S	.	.			trans	-58.6	150	-178	78.4	-174.5	176.9	-94	4	112.8	Y153 S156 L158 E161 S173 F177 L178 D181	Y153-R175 PolarHBondContact O-NH2 3.26Å; S156-R175 PolarHBondContact O-NH1 2.93Å; L158-R175 VanDerWaalsContact CD1-CD 3.44Å; E161-R175 PolarHBondContact OE1-N 2.77Å; E161-R175 IonicContact OE2-NH1 2.77Å; E161-R175 PolarHBondContact OE2-NH1 3.31Å; S173-R175 WeakPolarHBondContact OG-CG 3.2Å; S173-R175 PolarHBondContact OG-N 3.22Å; S173-R175 PolarHBondContact OG-NH1 3.06Å; R175-F177 VanDerWaalsContact CD-O 3.28Å; R175-F177 WeakPolarHBondContact CD-O 3.28Å; R175-F177 VanDerWaalsContact CG-O 3.25Å; R175-F177 WeakPolarHBondContact CG-O 3.41Å; R175-F177 PolarHBondContact NE-O 3.41Å; R175-L178 PolarHBondContact NE-O 2.99Å; R175-D181 WeakPolarHBondContact CA-OD1 3.38Å
176	K	97.8	Very high	90.3	Very high	92 Å²	92	64.8 Å²	64.8	40%	0.4	33%	0.334	S	S	.	.	S	Bend	trans	-79.2	-35.9	-176.7	-64.8	173	-171.4	165.1	0	114.3	G180 D181 N222	K176-G180 PolarHBondContact N-O 2.6Å; K176-D181 HydrophobicContact CD-CB 4.4Å; K176-D181 PolarHBondContact N-OD1 3.14Å; K176-N222 WeakPolarHBondContact CA-ND2 3.44Å; K176-N222 HydrophobicContact CB-CB 4.46Å; K176-N222 PolarHBondContact O-ND2 3.01Å; K176-N222 VanDerWaalsContact O-ND2 3.07Å
177	F	98.4	Very high	91.4	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.009	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-131.7	-176.2	-170.3	-54.3	-65.5	0	0	0	111.8	R175 D179 G180 D181 E182 M183 D187 Y219 N222 V223 R226	R175-F177 VanDerWaalsContact CD-O 3.28Å; R175-F177 WeakPolarHBondContact CD-O 3.28Å; R175-F177 VanDerWaalsContact CG-O 3.25Å; R175-F177 WeakPolarHBondContact CG-O 3.41Å; R175-F177 PolarHBondContact NE-O 3.41Å; F177-D179 VanDerWaalsContact C-N 3.33Å; F177-D179 PolarHBondContact O-N 3.13Å; F177-G180 CarbonylContact C-O 3.58Å; F177-G180 WeakPolarHBondContact CA-O 3.28Å; F177-G180 PolarHBondContact N-O 3.13Å; F177-D181 VanDerWaalsContact CD2-O 3.28Å; F177-D181 WeakPolarHBondContact CD2-O 3.33Å; F177-D181 WeakPolarHBondContact CE2-O 3.25Å; F177-E182 VanDerWaalsContact CD2-C 3.44Å; F177-M183 HydrophobicContact CD1-CG 3.66Å; F177-M183 HydrophobicContact CD1-SD 4.43Å; F177-M183 HydrophobicContact CD2-CG 3.83Å; F177-M183 HydrophobicContact CE1-CG 3.66Å; F177-M183 HydrophobicContact CE1-SD 4.07Å; F177-M183 HydrophobicContact CE2-CG 3.82Å; F177-M183 HydrophobicContact CG-CG 3.75Å; F177-M183 HydrophobicContact CZ-CG 3.74Å; F177-M183 HydrophobicContact CZ-SD 4.35Å; F177-D187 WeakPolarHBondContact CB-OD1 3.24Å; F177-Y219 HydrophobicContact CB-CE2 4.14Å; F177-Y219 HydrophobicContact CD1-CD2 4.21Å; F177-Y219 AromaticContact CD1-CE2 3.9Å; F177-Y219 HydrophobicContact CD1-CE2 3.9Å; F177-N222 HydrophobicContact CE1-CB 4.15Å; F177-V223 HydrophobicContact CD1-CG2 3.84Å; F177-V223 HydrophobicContact CE1-CG2 3.68Å; F177-R226 HydrophobicContact CE1-CG 4.26Å; F177-R226 HydrophobicContact CZ-CG 3.83Å
178	L	98.1	Very high	92.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-44.7	-171.2	-75.7	170.4	0	0	0	113.2	A116 L150 Y153 L154 R175 A186 D187 L190 Y219	A116-L178 HydrophobicContact CB-CD2 4.1Å; L150-L178 HydrophobicContact CD1-CD2 3.92Å; Y153-L178 HydrophobicContact CD1-CD2 4.13Å; Y153-L178 HydrophobicContact CE1-CD2 3.94Å; Y153-L178 PolarHBondContact OH-O 3.07Å; L154-L178 HydrophobicContact CD2-CD2 4.02Å; R175-L178 PolarHBondContact NE-O 2.99Å; L178-A186 HydrophobicContact CD1-CB 3.82Å; L178-D187 VanDerWaalsContact CB-OD1 3.28Å; L178-D187 WeakPolarHBondContact CB-OD1 3.09Å; L178-D187 VanDerWaalsContact CG-OD1 3.24Å; L178-D187 WeakPolarHBondContact CG-OD1 3.29Å; L178-D187 PolarHBondContact N-OD1 3.21Å; L178-L190 HydrophobicContact CD1-CB 4.23Å; L178-L190 HydrophobicContact CD1-CD2 3.85Å; L178-L190 HydrophobicContact CD2-CD2 4.02Å; L178-L190 HydrophobicContact CG-CD2 4.39Å; L178-Y219 HydrophobicContact CG-CE2 4.42Å
179	D	98.1	Very high	94	Very high	9 Å²	9	48.3 Å²	48.3	5%	0.048	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	5.2	-168.4	-162	61.7	0	0	0	114	T108 R109 H110 S113 F177 T184	T108-D179 WeakPolarHBondContact CA-OD2 3.46Å; T108-D179 HydrophobicContact CG2-CB 4.37Å; R109-D179 WeakPolarHBondContact CB-OD2 3.41Å; R109-D179 PolarHBondContact N-OD2 3.48Å; H110-D179 VanDerWaalsContact CB-OD1 3.26Å; H110-D179 WeakPolarHBondContact CB-OD1 3.42Å; H110-D179 IonicContact CG-OD1 3.4Å; H110-D179 PolarHBondContact N-OD1 2.67Å; H110-D179 IonicContact ND1-OD1 2.69Å; H110-D179 PolarHBondContact ND1-OD1 2.93Å; H110-D179 IonicContact ND1-OD2 2.74Å; S113-D179 WeakPolarHBondContact CB-OD1 3.32Å; S113-D179 PolarHBondContact OG-OD1 3.27Å; F177-D179 VanDerWaalsContact C-N 3.33Å; F177-D179 PolarHBondContact O-N 3.13Å; D179-T184 HydrophobicContact CB-CG2 3.79Å
180	G	97.3	Very high	95.3	Very high	19 Å²	19	42.6 Å²	42.6	20%	0.196	22%	0.218	C	C	.	.	B	Isolated β-bridge	trans	150.8	-149.6	-177.2	0	0	0	0	0	112.4	K176 F177	K176-G180 PolarHBondContact N-O 2.6Å; F177-G180 CarbonylContact C-O 3.58Å; F177-G180 WeakPolarHBondContact CA-O 3.28Å; F177-G180 PolarHBondContact N-O 3.13Å
181	D	97.3	Very high	96.4	Very high	82 Å²	82	38.6 Å²	38.6	44%	0.439	20%	0.198	S	C	.	.	S	Bend	trans	-91.8	-6.5	-176.6	-83.9	-5.1	0	0	0	115.1	R175 K176 F177	R175-D181 WeakPolarHBondContact CA-OD1 3.38Å; K176-D181 HydrophobicContact CD-CB 4.4Å; K176-D181 PolarHBondContact N-OD1 3.14Å; F177-D181 VanDerWaalsContact CD2-O 3.28Å; F177-D181 WeakPolarHBondContact CD2-O 3.33Å; F177-D181 WeakPolarHBondContact CE2-O 3.25Å
182	E	97.1	Very high	97.2	Very high	122 Å²	122	30.7 Å²	30.7	57%	0.57	16%	0.163	S	C	*	.	S	Bend	trans	-115.7	148.3	174.9	-64.1	-57.4	146.6	0	0	110.9	F177	F177-E182 VanDerWaalsContact CD2-C 3.44Å
183	M	98.1	Very high	97.6	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.025	15%	0.145	C	C	.	.			trans	-72.8	140.8	177.8	-72.2	-171.2	-65	0	0	111.4	M42 L46 F177 D187 L191 R226 E228	M42-M183 HydrophobicContact CE-SD 4.28Å; L46-M183 HydrophobicContact CD1-CB 3.81Å; L46-M183 HydrophobicContact CD1-CE 4.3Å; L46-M183 HydrophobicContact CD2-CB 4.25Å; L46-M183 HydrophobicContact CD2-CE 3.83Å; L46-M183 HydrophobicContact CG-CE 4.41Å; F177-M183 HydrophobicContact CD1-CG 3.66Å; F177-M183 HydrophobicContact CD1-SD 4.43Å; F177-M183 HydrophobicContact CD2-CG 3.83Å; F177-M183 HydrophobicContact CE1-CG 3.66Å; F177-M183 HydrophobicContact CE1-SD 4.07Å; F177-M183 HydrophobicContact CE2-CG 3.82Å; F177-M183 HydrophobicContact CG-CG 3.75Å; F177-M183 HydrophobicContact CZ-CG 3.74Å; F177-M183 HydrophobicContact CZ-SD 4.35Å; M183-D187 HydrophobicContact CB-CB 4.29Å; M183-D187 HydrophobicContact CG-CB 4.34Å; M183-L191 HydrophobicContact SD-CD1 4.32Å; M183-R226 HydrophobicContact CE-CB 3.99Å; M183-R226 HydrophobicContact CE-CG 4.07Å; M183-R226 HydrophobicContact SD-CG 4.46Å; M183-E228 HydrophobicContact CE-CB 3.71Å; M183-E228 HydrophobicContact CE-CG 4.06Å
184	T	98.5	Very high	97.8	Very high	12 Å²	12	27.1 Å²	27.1	7%	0.074	14%	0.143	C	C	.	.			trans	-119.3	177.7	-178.5	65.1	0	0	0	0	111.7	L106 T108 D179 A186 D187 C188	L106-T184 CarbonylContact O-C 3.5Å; L106-T184 VanDerWaalsContact O-CA 3.24Å; L106-T184 WeakPolarHBondContact O-CA 3.43Å; L106-T184 WeakPolarHBondContact O-CB 3.47Å; T108-T184 HydrophobicContact CG2-CG2 4.5Å; D179-T184 HydrophobicContact CB-CG2 3.79Å; T184-A186 PolarHBondContact O-N 2.98Å; T184-A186 PolarHBondContact OG1-N 2.86Å; T184-D187 PolarHBondContact N-OD2 2.81Å; T184-D187 PolarHBondContact O-N 2.93Å; T184-D187 VanDerWaalsContact O-N 3.16Å; T184-D187 PolarHBondContact OG1-OD2 2.92Å; T184-C188 PolarHBondContact O-N 3.45Å; T184-C188 VanDerWaalsContact O-N 3.11Å; T184-C188 PolarHBondContact O-SG 3.37Å
185	L	98.5	Very high	98.1	Very high	16 Å²	16	22.4 Å²	22.4	8%	0.084	11%	0.114	C	C	.	.	H	α-helix	trans	-57	-33.1	171	-62.6	-179.9	0	0	0	112.3	I43 E91 E95 L106 C188 N189	I43-L185 HydrophobicContact CD1-CD2 3.88Å; I43-L185 HydrophobicContact CG1-CD2 3.76Å; I43-L185 HydrophobicContact CG2-CD2 4.23Å; E91-L185 HydrophobicContact CG-CD1 3.95Å; E91-L185 HydrophobicContact CG-CD2 3.91Å; E91-L185 HydrophobicContact CG-CG 4.42Å; E95-L185 HydrophobicContact CB-CD1 4.33Å; E95-L185 HydrophobicContact CG-CD1 4.16Å; L106-L185 HydrophobicContact CB-CD2 3.8Å; L106-L185 HydrophobicContact CB-CG 3.86Å; L106-L185 HydrophobicContact CD1-CD2 4.3Å; L106-L185 PolarHBondContact O-N 2.89Å; L185-C188 PolarHBondContact O-N 2.99Å; L185-N189 WeakPolarHBondContact O-CB 3.36Å; L185-N189 PolarHBondContact O-N 2.95Å
186	A	98.4	Very high	98.2	Very high	5 Å²	5	21.9 Å²	21.9	4%	0.041	11%	0.112	C	C	.	.	H	α-helix	trans	-64.8	-41.7	176.9	0	0	0	0	0	111.8	T108 S113 L178 T184 N189 L190	T108-A186 HydrophobicContact CG2-CB 3.62Å; S113-A186 WeakPolarHBondContact O-CB 3.5Å; L178-A186 HydrophobicContact CD1-CB 3.82Å; T184-A186 PolarHBondContact O-N 2.98Å; T184-A186 PolarHBondContact OG1-N 2.86Å; A186-N189 PolarHBondContact O-N 3.34Å; A186-L190 WeakPolarHBondContact O-CB 3.32Å; A186-L190 PolarHBondContact O-N 3.08Å
187	D	98.6	Very high	98.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-64.7	-45.4	176.3	-55.2	-74.3	0	0	0	110.4	F177 L178 M183 T184 N189 L190 L191 Y219	F177-D187 WeakPolarHBondContact CB-OD1 3.24Å; L178-D187 VanDerWaalsContact CB-OD1 3.28Å; L178-D187 WeakPolarHBondContact CB-OD1 3.09Å; L178-D187 VanDerWaalsContact CG-OD1 3.24Å; L178-D187 WeakPolarHBondContact CG-OD1 3.29Å; L178-D187 PolarHBondContact N-OD1 3.21Å; M183-D187 HydrophobicContact CB-CB 4.29Å; M183-D187 HydrophobicContact CG-CB 4.34Å; T184-D187 PolarHBondContact N-OD2 2.81Å; T184-D187 PolarHBondContact O-N 2.93Å; T184-D187 VanDerWaalsContact O-N 3.16Å; T184-D187 PolarHBondContact OG1-OD2 2.92Å; D187-N189 PolarHBondContact O-N 3.33Å; D187-L190 PolarHBondContact O-N 3.44Å; D187-L191 HydrophobicContact CB-CD1 3.93Å; D187-L191 VanDerWaalsContact O-CB 3.27Å; D187-L191 WeakPolarHBondContact O-CB 3.42Å; D187-L191 VanDerWaalsContact O-CG 3.23Å; D187-L191 WeakPolarHBondContact O-CG 3.29Å; D187-L191 PolarHBondContact O-N 3.36Å; D187-Y219 WeakPolarHBondContact OD1-CE2 3.43Å; D187-Y219 PolarHBondContact OD1-OH 3.39Å
188	C	98.5	Very high	98.2	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.1	-32.6	175.9	-62.1	0	0	0	0	112.7	R39 M42 I43 L46 T184 L185 P192	R39-C188 WeakPolarHBondContact CA-O 2.94Å; R39-C188 VanDerWaalsContact CB-O 3.31Å; R39-C188 WeakPolarHBondContact CB-O 3.49Å; R39-C188 HydrophobicContact CG-CB 4.2Å; R39-C188 WeakPolarHBondContact CG-O 3.46Å; M42-C188 HydrophobicContact CB-CB 4.24Å; I43-C188 HydrophobicContact CD1-CB 4.31Å; I43-C188 HydrophobicContact CG1-CB 3.84Å; L46-C188 VanDerWaalsContact CD1-SG 3.57Å; T184-C188 PolarHBondContact O-N 3.45Å; T184-C188 VanDerWaalsContact O-N 3.11Å; T184-C188 PolarHBondContact O-SG 3.37Å; L185-C188 PolarHBondContact O-N 2.99Å; C188-P192 WeakPolarHBondContact O-CD 3.44Å; C188-P192 WeakPolarHBondContact O-CG 3.33Å
189	N	98.3	Very high	98.2	Very high	35 Å²	35	20.1 Å²	20.1	19%	0.187	11%	0.105	C	C	.	.	H	α-helix	trans	-79.1	-42	177.9	-178.3	29.8	0	0	0	112.9	L185 A186 D187 K193	L185-N189 WeakPolarHBondContact O-CB 3.36Å; L185-N189 PolarHBondContact O-N 2.95Å; A186-N189 PolarHBondContact O-N 3.34Å; D187-N189 PolarHBondContact O-N 3.33Å; N189-K193 WeakPolarHBondContact O-CD 3.36Å; N189-K193 PolarHBondContact OD1-NZ 3.34Å
190	L	98.5	Very high	98.2	Very high	9 Å²	9	19.7 Å²	19.7	5%	0.047	10%	0.102	C	C	.	.	H	α-helix	trans	-80.6	-42.9	-174.4	-179.8	61.6	0	0	0	112.7	I120 L150 L178 A186 D187 K193 L194 Y219	I120-L190 HydrophobicContact CD1-CD1 4.4Å; L150-L190 HydrophobicContact CD1-CD2 3.8Å; L150-L190 HydrophobicContact CD2-CD2 3.91Å; L178-L190 HydrophobicContact CD1-CB 4.23Å; L178-L190 HydrophobicContact CD1-CD2 3.85Å; L178-L190 HydrophobicContact CD2-CD2 4.02Å; L178-L190 HydrophobicContact CG-CD2 4.39Å; A186-L190 WeakPolarHBondContact O-CB 3.32Å; A186-L190 PolarHBondContact O-N 3.08Å; D187-L190 PolarHBondContact O-N 3.44Å; L190-K193 WeakPolarHBondContact O-CB 3.34Å; L190-K193 PolarHBondContact O-N 2.88Å; L190-K193 VanDerWaalsContact O-N 3.16Å; L190-L194 WeakPolarHBondContact O-CB 3.29Å; L190-L194 PolarHBondContact O-N 3.4Å; L190-Y219 HydrophobicContact CD2-CE1 4.22Å
191	L	98.3	Very high	98.2	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-46.6	-168	-72.5	169.5	0	0	0	114.7	M42 M183 D187 K193 L194 H195 Y219 V223 F229	M42-L191 HydrophobicContact CE-CD1 3.94Å; M183-L191 HydrophobicContact SD-CD1 4.32Å; D187-L191 HydrophobicContact CB-CD1 3.93Å; D187-L191 VanDerWaalsContact O-CB 3.27Å; D187-L191 WeakPolarHBondContact O-CB 3.42Å; D187-L191 VanDerWaalsContact O-CG 3.23Å; D187-L191 WeakPolarHBondContact O-CG 3.29Å; D187-L191 PolarHBondContact O-N 3.36Å; L191-K193 PolarHBondContact O-N 3.36Å; L191-L194 PolarHBondContact O-N 3.31Å; L191-H195 WeakPolarHBondContact O-CB 3.45Å; L191-H195 PolarHBondContact O-N 3.28Å; L191-Y219 HydrophobicContact CD2-CD1 4.24Å; L191-Y219 HydrophobicContact CD2-CE1 3.4Å; L191-Y219 HydrophobicContact CD2-CE2 4.27Å; L191-Y219 VanDerWaalsContact CD2-CZ 3.42Å; L191-Y219 WeakPolarHBondContact CD2-OH 3.45Å; L191-Y219 HydrophobicContact CG-CE1 4.23Å; L191-Y219 WeakPolarHBondContact CG-OH 3.48Å; L191-V223 HydrophobicContact CD1-CB 4.31Å; L191-V223 HydrophobicContact CD1-CG1 3.71Å; L191-V223 HydrophobicContact CD1-CG2 3.6Å; L191-V223 HydrophobicContact CD2-CB 4.22Å; L191-V223 HydrophobicContact CD2-CG1 3.9Å; L191-V223 HydrophobicContact CD2-CG2 3.72Å; L191-V223 HydrophobicContact CG-CG1 4.31Å; L191-V223 HydrophobicContact CG-CG2 4.28Å; L191-F229 HydrophobicContact CB-CD2 3.81Å; L191-F229 HydrophobicContact CB-CE2 3.69Å; L191-F229 HydrophobicContact CD1-CD2 4.32Å
192	P	98.4	Very high	98.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-57.6	-40.2	175.8	-26.9	37.1	0	0	0	112.1	P35 Q38 M42 C188 I196	P35-P192 HydrophobicContact CB-CB 3.69Å; P35-P192 WeakPolarHBondContact O-CB 3.47Å; Q38-P192 HydrophobicContact CB-CB 4.01Å; Q38-P192 HydrophobicContact CB-CG 3.9Å; Q38-P192 HydrophobicContact CG-CB 4.22Å; Q38-P192 HydrophobicContact CG-CG 3.84Å; M42-P192 HydrophobicContact SD-CG 4.05Å; C188-P192 WeakPolarHBondContact O-CD 3.44Å; C188-P192 WeakPolarHBondContact O-CG 3.33Å; P192-I196 WeakPolarHBondContact O-CD1 3.39Å; P192-I196 VanDerWaalsContact O-CG1 3.25Å; P192-I196 WeakPolarHBondContact O-CG1 3.3Å; P192-I196 PolarHBondContact O-N 3.02Å
193	K	98.4	Very high	98.2	Very high	38 Å²	38	19.6 Å²	19.6	17%	0.165	9%	0.091	C	C	.	.	H	α-helix	trans	-68	-47.9	178.9	-67.5	171	-176.2	163.2	0	111.1	P35 F121 N189 L190 L191 H195 I196 V197	P35-K193 HydrophobicContact CB-CG 3.98Å; F121-K193 HydrophobicContact CB-CB 4.24Å; F121-K193 HydrophobicContact CB-CD 4.06Å; F121-K193 HydrophobicContact CB-CG 4.31Å; F121-K193 HydrophobicContact CD2-CB 3.56Å; F121-K193 HydrophobicContact CD2-CD 4.49Å; F121-K193 HydrophobicContact CD2-CG 3.83Å; F121-K193 HydrophobicContact CE2-CB 4.14Å; F121-K193 HydrophobicContact CE2-CG 4.24Å; F121-K193 HydrophobicContact CG-CB 4.08Å; F121-K193 HydrophobicContact CG-CD 4.2Å; F121-K193 HydrophobicContact CG-CG 4Å; N189-K193 WeakPolarHBondContact O-CD 3.36Å; N189-K193 PolarHBondContact OD1-NZ 3.34Å; L190-K193 WeakPolarHBondContact O-CB 3.34Å; L190-K193 PolarHBondContact O-N 2.88Å; L190-K193 VanDerWaalsContact O-N 3.16Å; L191-K193 PolarHBondContact O-N 3.36Å; K193-H195 VanDerWaalsContact C-N 3.34Å; K193-H195 PolarHBondContact O-N 3.36Å; K193-I196 PolarHBondContact O-N 3.34Å; K193-V197 WeakPolarHBondContact O-CG2 3.45Å; K193-V197 PolarHBondContact O-N 2.74Å
194	L	98.4	Very high	98.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.8	-39.3	-178.1	-175.2	60.9	0	0	0	111.7	L147 L150 L190 L191 V197 K198 I209 Y219 L220	L147-L194 HydrophobicContact CD2-CD1 3.98Å; L150-L194 HydrophobicContact CD2-CD2 4.16Å; L190-L194 WeakPolarHBondContact O-CB 3.29Å; L190-L194 PolarHBondContact O-N 3.4Å; L191-L194 PolarHBondContact O-N 3.31Å; L194-V197 WeakPolarHBondContact O-CB 3.4Å; L194-V197 PolarHBondContact O-N 3.09Å; L194-K198 PolarHBondContact O-N 3.11Å; L194-I209 HydrophobicContact CD1-CD1 4.4Å; L194-Y219 HydrophobicContact CD2-CD1 4.32Å; L194-Y219 HydrophobicContact CD2-CE1 4.28Å; L194-L220 HydrophobicContact CD2-CD2 3.89Å; L194-L220 HydrophobicContact CD2-CG 4.41Å; L194-L220 HydrophobicContact CG-CD2 4.29Å
195	H	98.3	Very high	98	Very high	10 Å²	10	24 Å²	24	5%	0.046	11%	0.106	C	C	.	.	H	α-helix	trans	-65.1	-43.1	175.7	-178.5	65.1	0	0	0	112.2	L191 K193 V197 K198 V199 Y224 F229 C233 D236	L191-H195 WeakPolarHBondContact O-CB 3.45Å; L191-H195 PolarHBondContact O-N 3.28Å; K193-H195 VanDerWaalsContact C-N 3.34Å; K193-H195 PolarHBondContact O-N 3.36Å; H195-V197 VanDerWaalsContact C-N 3.32Å; H195-V197 PolarHBondContact O-N 3.45Å; H195-K198 PolarHBondContact O-N 3.01Å; H195-V199 WeakPolarHBondContact O-CG2 3.24Å; H195-V199 PolarHBondContact O-N 3.16Å; H195-Y224 AromaticContact ND1-CE1 3.88Å; H195-Y224 AromaticContact ND1-CZ 3.89Å; H195-Y224 PolarHBondContact ND1-OH 2.95Å; H195-Y224 VanDerWaalsContact ND1-OH 3.08Å; H195-F229 HydrophobicContact CB-CE2 4.46Å; H195-F229 HydrophobicContact CB-CZ 3.72Å; H195-F229 AromaticContact CG-CZ 3.85Å; H195-C233 PolarHBondContact CD2-SG 2.87Å; H195-C233 PolarHBondContact NE2-SG 2.86Å; H195-D236 IonicContact CE1-OD1 2.69Å; H195-D236 IonicContact NE2-OD1 3.81Å
196	I	98.4	Very high	97.8	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-57.5	-45.8	171.8	-69.2	166	0	0	0	110.8	N33 P35 F121 F124 P192 K193 K198 V199 V200 I239 Y243	N33-I196 WeakPolarHBondContact OD1-CD1 3.4Å; P35-I196 HydrophobicContact CB-CD1 3.78Å; P35-I196 HydrophobicContact CG-CD1 3.82Å; F121-I196 HydrophobicContact CE2-CB 4.24Å; F121-I196 HydrophobicContact CE2-CD1 4.37Å; F121-I196 HydrophobicContact CE2-CG2 3.99Å; F124-I196 HydrophobicContact CE1-CG2 4Å; F124-I196 HydrophobicContact CZ-CG2 4.06Å; P192-I196 WeakPolarHBondContact O-CD1 3.39Å; P192-I196 VanDerWaalsContact O-CG1 3.25Å; P192-I196 WeakPolarHBondContact O-CG1 3.3Å; P192-I196 PolarHBondContact O-N 3.02Å; K193-I196 PolarHBondContact O-N 3.34Å; I196-K198 VanDerWaalsContact C-N 3.34Å; I196-K198 PolarHBondContact O-N 2.91Å; I196-V199 PolarHBondContact O-N 3.28Å; I196-V200 HydrophobicContact CG2-CG2 3.86Å; I196-V200 VanDerWaalsContact O-CB 3.28Å; I196-V200 WeakPolarHBondContact O-CB 3.32Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 3.29Å; I196-I239 HydrophobicContact CB-CG2 4.44Å; I196-I239 HydrophobicContact CG1-CD1 4.44Å; I196-I239 HydrophobicContact CG1-CG2 4.16Å; I196-I239 HydrophobicContact CG2-CG2 4.25Å; I196-Y243 HydrophobicContact CG2-CD2 4.41Å; I196-Y243 HydrophobicContact CG2-CE2 3.5Å; I196-Y243 VanDerWaalsContact CG2-CE2 3.5Å
197	V	98.4	Very high	97.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.8	-51.7	176.7	176.1	0	0	0	0	110.1	I120 F121 F124 L143 K193 L194 H195 V199 T201	I120-V197 HydrophobicContact CG2-CG2 4Å; F121-V197 HydrophobicContact CD2-CG2 4.26Å; F124-V197 HydrophobicContact CB-CG1 4.34Å; F124-V197 HydrophobicContact CB-CG2 3.66Å; F124-V197 HydrophobicContact CD1-CG2 3.84Å; F124-V197 HydrophobicContact CD2-CB 4.26Å; F124-V197 HydrophobicContact CD2-CG1 4.06Å; F124-V197 HydrophobicContact CD2-CG2 3.98Å; F124-V197 HydrophobicContact CE1-CG2 4.47Å; F124-V197 HydrophobicContact CG-CB 4.32Å; F124-V197 HydrophobicContact CG-CG1 4.33Å; F124-V197 HydrophobicContact CG-CG2 3.54Å; L143-V197 HydrophobicContact CD1-CG1 4.35Å; L143-V197 HydrophobicContact CD2-CG1 4.33Å; K193-V197 WeakPolarHBondContact O-CG2 3.45Å; K193-V197 PolarHBondContact O-N 2.74Å; L194-V197 WeakPolarHBondContact O-CB 3.4Å; L194-V197 PolarHBondContact O-N 3.09Å; H195-V197 VanDerWaalsContact C-N 3.32Å; H195-V197 PolarHBondContact O-N 3.45Å; V197-V199 PolarHBondContact O-N 3.25Å; V197-T201 HydrophobicContact CG1-CG2 4.06Å; V197-T201 VanDerWaalsContact O-CB 3.29Å; V197-T201 WeakPolarHBondContact O-CB 3.27Å; V197-T201 VanDerWaalsContact O-CG2 3.26Å; V197-T201 WeakPolarHBondContact O-CG2 3.28Å; V197-T201 PolarHBondContact O-N 3.29Å; V197-T201 PolarHBondContact O-OG1 3.39Å
198	K	98.1	Very high	97.6	Very high	48 Å²	48	29.9 Å²	29.9	21%	0.209	15%	0.151	C	C	.	.	H	α-helix	trans	-57.3	-50.3	-179.9	176.7	-173.9	165.3	-129.6	0	112.5	L194 H195 I196 K202 L220 Y224	L194-K198 PolarHBondContact O-N 3.11Å; H195-K198 PolarHBondContact O-N 3.01Å; I196-K198 VanDerWaalsContact C-N 3.34Å; I196-K198 PolarHBondContact O-N 2.91Å; K198-K202 VanDerWaalsContact O-CB 3.25Å; K198-K202 WeakPolarHBondContact O-CB 3.39Å; K198-K202 PolarHBondContact O-N 2.72Å; K198-L220 HydrophobicContact CD-CD1 4.36Å; K198-Y224 PolarHBondContact NZ-OH 2.69Å; K198-Y224 VanDerWaalsContact NZ-OH 3.12Å
199	V	98.3	Very high	97.6	Very high	9 Å²	9	30 Å²	30	6%	0.055	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-49.4	-176.9	173.6	0	0	0	0	111.1	H195 I196 V197 K203 D236 I239 E240	H195-V199 WeakPolarHBondContact O-CG2 3.24Å; H195-V199 PolarHBondContact O-N 3.16Å; I196-V199 PolarHBondContact O-N 3.28Å; V197-V199 PolarHBondContact O-N 3.25Å; V199-K203 WeakPolarHBondContact O-CB 3.45Å; V199-K203 PolarHBondContact O-N 2.69Å; V199-D236 HydrophobicContact CG1-CB 4.16Å; V199-I239 HydrophobicContact CB-CG2 4.17Å; V199-I239 HydrophobicContact CG1-CB 4.14Å; V199-I239 HydrophobicContact CG1-CG2 3.98Å; V199-I239 HydrophobicContact CG2-CD1 4.32Å; V199-E240 HydrophobicContact CG1-CG 4.08Å
200	V	98.3	Very high	97.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-71.7	-44	-172.3	177.9	0	0	0	0	111.7	F124 I128 I196 K202 K203 Y204 I239 Y243	F124-V200 HydrophobicContact CE2-CB 3.88Å; F124-V200 HydrophobicContact CE2-CG1 3.84Å; F124-V200 HydrophobicContact CZ-CB 3.79Å; F124-V200 HydrophobicContact CZ-CG1 3.76Å; F124-V200 HydrophobicContact CZ-CG2 4.21Å; I128-V200 HydrophobicContact CD1-CG1 3.7Å; I128-V200 HydrophobicContact CG1-CG1 3.63Å; I196-V200 HydrophobicContact CG2-CG2 3.86Å; I196-V200 VanDerWaalsContact O-CB 3.28Å; I196-V200 WeakPolarHBondContact O-CB 3.32Å; I196-V200 WeakPolarHBondContact O-CG2 3.39Å; I196-V200 PolarHBondContact O-N 3.29Å; V200-K202 VanDerWaalsContact C-N 3.32Å; V200-K202 PolarHBondContact O-N 3.35Å; V200-K203 PolarHBondContact O-N 3.4Å; V200-Y204 HydrophobicContact CG1-CD2 3.8Å; V200-Y204 HydrophobicContact CG1-CE2 4.38Å; V200-Y204 WeakPolarHBondContact O-CD2 3.45Å; V200-Y204 PolarHBondContact O-N 3.37Å; V200-I239 HydrophobicContact CG2-CG2 3.59Å; V200-Y243 HydrophobicContact CB-CG 4.44Å; V200-Y243 HydrophobicContact CG1-CD1 3.81Å; V200-Y243 HydrophobicContact CG1-CD2 4.47Å; V200-Y243 HydrophobicContact CG1-CG 3.79Å; V200-Y243 HydrophobicContact CG2-CD1 4.27Å; V200-Y243 HydrophobicContact CG2-CD2 3.54Å; V200-Y243 HydrophobicContact CG2-CE2 3.98Å; V200-Y243 HydrophobicContact CG2-CG 3.7Å
201	T	97.1	Very high	97.5	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-37.3	-179.4	56.5	0	0	0	0	111.8	F124 F127 L143 V197 R205 G206 F207	F124-T201 HydrophobicContact CD2-CG2 3.62Å; F124-T201 HydrophobicContact CE2-CG2 3.74Å; F127-T201 HydrophobicContact CD1-CG2 4.21Å; F127-T201 HydrophobicContact CE1-CG2 4.18Å; L143-T201 HydrophobicContact CD2-CG2 4.18Å; V197-T201 HydrophobicContact CG1-CG2 4.06Å; V197-T201 VanDerWaalsContact O-CB 3.29Å; V197-T201 WeakPolarHBondContact O-CB 3.27Å; V197-T201 VanDerWaalsContact O-CG2 3.26Å; V197-T201 WeakPolarHBondContact O-CG2 3.28Å; V197-T201 PolarHBondContact O-N 3.29Å; V197-T201 PolarHBondContact O-OG1 3.39Å; T201-R205 CarbonylContact O-C 3.6Å; T201-R205 WeakPolarHBondContact O-CA 3.44Å; T201-R205 WeakPolarHBondContact O-CB 3.4Å; T201-R205 PolarHBondContact O-N 2.98Å; T201-G206 PolarHBondContact O-N 3.43Å; T201-G206 VanDerWaalsContact O-N 3.15Å; T201-F207 CarbonylContact C-O 3.28Å; T201-F207 VanDerWaalsContact C-O 3.28Å; T201-F207 HydrophobicContact CG2-CD1 4.31Å; T201-F207 PolarHBondContact O-N 3.27Å; T201-F207 PolarHBondContact OG1-O 2.89Å
202	K	97.4	Very high	97.4	Very high	113 Å²	113	44.7 Å²	44.7	49%	0.491	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-51.5	172.5	-174.6	174.7	-163.3	131.7	0	111.6	K198 V200 G206 F207 D208	K198-K202 VanDerWaalsContact O-CB 3.25Å; K198-K202 WeakPolarHBondContact O-CB 3.39Å; K198-K202 PolarHBondContact O-N 2.72Å; V200-K202 VanDerWaalsContact C-N 3.32Å; V200-K202 PolarHBondContact O-N 3.35Å; K202-G206 WeakPolarHBondContact O-CA 3.38Å; K202-G206 PolarHBondContact O-N 3.31Å; K202-G206 VanDerWaalsContact O-N 3.13Å; K202-F207 VanDerWaalsContact CA-O 3.25Å; K202-F207 WeakPolarHBondContact CA-O 3.31Å; K202-F207 PolarHBondContact N-O 2.73Å; K202-F207 VanDerWaalsContact N-O 3.07Å; K202-D208 WeakPolarHBondContact CD-OD1 3.46Å; K202-D208 WeakPolarHBondContact CE-OD1 3.24Å; K202-D208 IonicContact NZ-OD1 2.8Å; K202-D208 PolarHBondContact NZ-OD1 2.74Å; K202-D208 IonicContact NZ-OD2 3.58Å
203	K	97.3	Very high	97.4	Very high	108 Å²	108	45.4 Å²	45.4	47%	0.47	23%	0.227	S	C	.	.	H	α-helix	trans	-63.5	-46	-176.2	-179.7	57.2	166.7	-117.7	0	113.4	V199 V200 E240	V199-K203 WeakPolarHBondContact O-CB 3.45Å; V199-K203 PolarHBondContact O-N 2.69Å; V200-K203 PolarHBondContact O-N 3.4Å; K203-E240 HydrophobicContact CB-CG 4.19Å; K203-E240 WeakPolarHBondContact CD-OE1 3.46Å; K203-E240 HydrophobicContact CG-CG 3.9Å; K203-E240 IonicContact NZ-OE1 3.14Å; K203-E240 PolarHBondContact NZ-OE1 2.61Å; K203-E240 VanDerWaalsContact NZ-OE1 3.14Å; K203-E240 IonicContact NZ-OE2 2.71Å; K203-E240 PolarHBondContact NZ-OE2 3.2Å
204	Y	96.4	Very high	97.4	Very high	58 Å²	58	47.4 Å²	47.4	23%	0.227	24%	0.243	C	C	.	.	H	α-helix	trans	-105.8	-10.3	-166.7	-67.8	-76.7	0	0	0	114.8	V200 E240 Q244 A247	V200-Y204 HydrophobicContact CG1-CD2 3.8Å; V200-Y204 HydrophobicContact CG1-CE2 4.38Å; V200-Y204 WeakPolarHBondContact O-CD2 3.45Å; V200-Y204 PolarHBondContact O-N 3.37Å; Y204-E240 PolarHBondContact OH-O 3.22Å; Y204-Q244 WeakPolarHBondContact OH-CA 3.33Å; Y204-A247 HydrophobicContact CD1-CB 3.64Å; Y204-A247 HydrophobicContact CD2-CB 3.89Å; Y204-A247 HydrophobicContact CE1-CB 4.13Å; Y204-A247 HydrophobicContact CE2-CB 4.34Å; Y204-A247 HydrophobicContact CG-CB 3.52Å
205	R	95.2	Very high	97.4	Very high	51 Å²	51	47.5 Å²	47.5	19%	0.192	24%	0.244	C	C	.	.	H	α-helix	trans	-131.4	-7.5	179.6	-63.5	-67	-176.2	-93.3	3.1	113.8	F127 I128 N130 T201 F207 K248	F127-R205 HydrophobicContact CE1-CB 4.09Å; F127-R205 HydrophobicContact CE1-CG 3.83Å; F127-R205 HydrophobicContact CZ-CB 4.02Å; F127-R205 HydrophobicContact CZ-CG 3.83Å; I128-R205 HydrophobicContact CD1-CG 4.08Å; I128-R205 PolarHBondContact O-NH2 2.94Å; N130-R205 PolarHBondContact O-NH2 3.33Å; T201-R205 CarbonylContact O-C 3.6Å; T201-R205 WeakPolarHBondContact O-CA 3.44Å; T201-R205 WeakPolarHBondContact O-CB 3.4Å; T201-R205 PolarHBondContact O-N 2.98Å; R205-F207 HydrophobicContact CB-CB 4.22Å; R205-F207 PolarHBondContact O-N 3.39Å; R205-K248 VanDerWaalsContact CZ-O 3.24Å; R205-K248 PolarHBondContact NH1-O 3.01Å; R205-K248 PolarHBondContact NH2-O 3.12Å
206	G	95.2	Very high	97.4	Very high	62 Å²	62	47 Å²	47	64%	0.639	24%	0.242	S	C	*	.			trans	62.3	20.5	-173.1	0	0	0	0	0	112.7	T201 K202	T201-G206 PolarHBondContact O-N 3.43Å; T201-G206 VanDerWaalsContact O-N 3.15Å; K202-G206 WeakPolarHBondContact O-CA 3.38Å; K202-G206 PolarHBondContact O-N 3.31Å; K202-G206 VanDerWaalsContact O-N 3.13Å
207	F	96.6	Very high	97.3	Very high	15 Å²	15	50.1 Å²	50.1	7%	0.066	25%	0.253	C	S	.	.			trans	-92.9	123.7	178.5	173.7	-82.5	0	0	0	108.5	F127 E140 L143 L144 L147 T201 K202 R205	F127-F207 HydrophobicContact CE1-CB 4.48Å; E140-F207 HydrophobicContact CG-CD2 3.86Å; E140-F207 HydrophobicContact CG-CE2 3.89Å; L143-F207 HydrophobicContact CD2-CE1 4.15Å; L143-F207 HydrophobicContact CD2-CZ 4.41Å; L144-F207 HydrophobicContact CD1-CE2 4.21Å; L144-F207 HydrophobicContact CD2-CE2 3.68Å; L144-F207 HydrophobicContact CD2-CZ 3.58Å; L144-F207 HydrophobicContact CG-CE2 3.79Å; L144-F207 HydrophobicContact CG-CZ 3.95Å; L147-F207 HydrophobicContact CD1-CE1 4.12Å; L147-F207 HydrophobicContact CD1-CZ 4.08Å; T201-F207 CarbonylContact C-O 3.28Å; T201-F207 VanDerWaalsContact C-O 3.28Å; T201-F207 HydrophobicContact CG2-CD1 4.31Å; T201-F207 PolarHBondContact O-N 3.27Å; T201-F207 PolarHBondContact OG1-O 2.89Å; K202-F207 VanDerWaalsContact CA-O 3.25Å; K202-F207 WeakPolarHBondContact CA-O 3.31Å; K202-F207 PolarHBondContact N-O 2.73Å; K202-F207 VanDerWaalsContact N-O 3.07Å; R205-F207 HydrophobicContact CB-CB 4.22Å; R205-F207 PolarHBondContact O-N 3.39Å
208	D	96.8	Very high	97.3	Very high	68 Å²	68	53.9 Å²	53.9	36%	0.364	27%	0.271	S	S	.	.			trans	-110.8	152.3	168.5	-78.6	-81.9	0	0	0	108.7	K202 P210	K202-D208 WeakPolarHBondContact CD-OD1 3.46Å; K202-D208 WeakPolarHBondContact CE-OD1 3.24Å; K202-D208 IonicContact NZ-OD1 2.8Å; K202-D208 PolarHBondContact NZ-OD1 2.74Å; K202-D208 IonicContact NZ-OD2 3.58Å; D208-P210 WeakPolarHBondContact O-CD 3.47Å
209	I	97.4	Very high	97.3	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.021	26%	0.262	C	S	.	.			trans	-58.5	127.4	170.4	-59.9	175.8	0	0	0	107.7	L147 L194 K211 M213 I216 W217 L220	L147-I209 HydrophobicContact CD1-CG1 4.36Å; L194-I209 HydrophobicContact CD1-CD1 4.4Å; I209-K211 PolarHBondContact O-N 3.14Å; I209-M213 HydrophobicContact CG2-CB 4.25Å; I209-M213 HydrophobicContact CG2-SD 3.89Å; I209-I216 HydrophobicContact CD1-CG2 4.05Å; I209-I216 HydrophobicContact CG2-CG2 4.17Å; I209-W217 HydrophobicContact CB-CZ2 4Å; I209-W217 VanDerWaalsContact O-CZ2 3.3Å; I209-W217 WeakPolarHBondContact O-CZ2 3.35Å; I209-L220 HydrophobicContact CD1-CD1 4.2Å
210	P	97.9	Very high	97.3	Very high	39 Å²	39	51.4 Å²	51.4	25%	0.253	26%	0.26	S	S	.	.			trans	-53	139.3	179.5	-29.9	37.1	0	0	0	112.8	L144 D208 D212 M213 W217	L144-P210 HydrophobicContact CD2-CG 3.62Å; D208-P210 WeakPolarHBondContact O-CD 3.47Å; P210-D212 WeakPolarHBondContact CB-OD1 3.35Å; P210-D212 PolarHBondContact O-N 2.9Å; P210-M213 HydrophobicContact CB-CE 4.49Å; P210-M213 HydrophobicContact CB-CG 4.3Å; P210-M213 HydrophobicContact CB-SD 4.49Å; P210-M213 HydrophobicContact CG-CE 4.05Å; P210-M213 HydrophobicContact CG-SD 4.33Å; P210-M213 WeakPolarHBondContact O-CB 3.33Å; P210-M213 PolarHBondContact O-N 3.03Å; P210-W217 PolarHBondContact O-NE1 3.39Å
211	K	96.9	Very high	97.3	Very high	187 Å²	187	57.3 Å²	57.3	81%	0.813	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.9	-174.6	-70.1	-174.2	178.4	-179.9	0	113.8	I209 M213	I209-K211 PolarHBondContact O-N 3.14Å; K211-M213 VanDerWaalsContact C-N 3.3Å
212	D	96.9	Very high	97.3	Very high	126 Å²	126	59.1 Å²	59.1	67%	0.674	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.4	176	58.8	-23.1	0	0	0	113.3	P210 T214	P210-D212 WeakPolarHBondContact CB-OD1 3.35Å; P210-D212 PolarHBondContact O-N 2.9Å; D212-T214 PolarHBondContact O-N 2.91Å
213	M	97.9	Very high	97.3	Very high	16 Å²	16	53.8 Å²	53.8	8%	0.079	27%	0.273	C	S	.	.			trans	-76.3	65.9	168.4	-64.6	-177.3	178	0	0	110.8	L144 L147 Q148 D151 I209 P210 K211 G215 I216 W217	L144-M213 HydrophobicContact CD2-CE 4.21Å; L147-M213 HydrophobicContact CB-CE 4.03Å; L147-M213 HydrophobicContact CB-SD 3.74Å; Q148-M213 HydrophobicContact CB-CE 4.08Å; D151-M213 HydrophobicContact CB-CB 4.14Å; D151-M213 HydrophobicContact CB-CG 4.31Å; D151-M213 WeakPolarHBondContact OD1-CA 3.33Å; I209-M213 HydrophobicContact CG2-CB 4.25Å; I209-M213 HydrophobicContact CG2-SD 3.89Å; P210-M213 HydrophobicContact CB-CE 4.49Å; P210-M213 HydrophobicContact CB-CG 4.3Å; P210-M213 HydrophobicContact CB-SD 4.49Å; P210-M213 HydrophobicContact CG-CE 4.05Å; P210-M213 HydrophobicContact CG-SD 4.33Å; P210-M213 WeakPolarHBondContact O-CB 3.33Å; P210-M213 PolarHBondContact O-N 3.03Å; K211-M213 VanDerWaalsContact C-N 3.3Å; M213-G215 VanDerWaalsContact C-N 3.31Å; M213-G215 PolarHBondContact O-N 2.76Å; M213-I216 HydrophobicContact CB-CB 4.45Å; M213-I216 PolarHBondContact O-N 3.31Å; M213-I216 HydrophobicContact SD-CD1 4.22Å; M213-W217 PolarHBondContact O-N 3.46Å; M213-W217 VanDerWaalsContact O-N 3.15Å
214	T	97.8	Very high	97.3	Very high	79 Å²	79	51.9 Å²	51.9	49%	0.485	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-31.2	-170.4	56.6	0	0	0	0	113.6	D151 R155 D212 W217 Q218	D151-T214 PolarHBondContact OD1-N 3.1Å; R155-T214 WeakPolarHBondContact CD-OG1 3.47Å; D212-T214 PolarHBondContact O-N 2.91Å; T214-W217 PolarHBondContact O-N 3.39Å; T214-Q218 WeakPolarHBondContact O-CB 3.46Å; T214-Q218 PolarHBondContact O-N 2.89Å
215	G	98.2	Very high	97.3	Very high	3 Å²	3	54.5 Å²	54.5	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-65.8	-44.6	177.1	0	0	0	0	0	111.6	D151 M213 W217 Q218 Y219	D151-G215 WeakPolarHBondContact OD1-CA 3.3Å; D151-G215 PolarHBondContact OD1-N 3.28Å; M213-G215 VanDerWaalsContact C-N 3.31Å; M213-G215 PolarHBondContact O-N 2.76Å; G215-W217 PolarHBondContact O-N 3.04Å; G215-Q218 PolarHBondContact O-N 3.08Å; G215-Y219 VanDerWaalsContact O-CB 3.32Å; G215-Y219 WeakPolarHBondContact O-CB 3.33Å; G215-Y219 PolarHBondContact O-N 3.24Å
216	I	98.3	Very high	97.4	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-43.7	174.3	-70.1	176.8	0	0	0	111	L147 L150 D151 L154 I209 M213 Y219 L220	L147-I216 HydrophobicContact CB-CD1 4.11Å; L147-I216 HydrophobicContact CD2-CD1 4.09Å; L147-I216 VanDerWaalsContact O-CD1 3.28Å; L147-I216 WeakPolarHBondContact O-CD1 3.18Å; L150-I216 HydrophobicContact CB-CD1 4.28Å; L150-I216 HydrophobicContact CD2-CD1 4.04Å; L150-I216 HydrophobicContact CD2-CG1 4.1Å; L150-I216 HydrophobicContact CG-CD1 4.21Å; L150-I216 HydrophobicContact CG-CG1 4.11Å; D151-I216 HydrophobicContact CB-CD1 4.06Å; D151-I216 HydrophobicContact CB-CG1 4.01Å; D151-I216 PolarHBondContact OD1-N 3.44Å; L154-I216 HydrophobicContact CD1-CG1 3.94Å; I209-I216 HydrophobicContact CD1-CG2 4.05Å; I209-I216 HydrophobicContact CG2-CG2 4.17Å; M213-I216 HydrophobicContact CB-CB 4.45Å; M213-I216 PolarHBondContact O-N 3.31Å; M213-I216 HydrophobicContact SD-CD1 4.22Å; I216-Y219 PolarHBondContact O-N 2.93Å; I216-L220 HydrophobicContact CG2-CD1 3.88Å; I216-L220 HydrophobicContact CG2-CG 4.23Å; I216-L220 WeakPolarHBondContact O-CB 3.2Å; I216-L220 WeakPolarHBondContact O-CG 3.38Å; I216-L220 PolarHBondContact O-N 3.06Å
217	W	98.1	Very high	97.5	Very high	66 Å²	66	58 Å²	58	25%	0.25	29%	0.285	C	S	.	.	H	α-helix	trans	-64.8	-41.7	-179.5	-77.3	113.8	0	0	0	112.5	I209 P210 M213 T214 G215 L220 Q221	I209-W217 HydrophobicContact CB-CZ2 4Å; I209-W217 VanDerWaalsContact O-CZ2 3.3Å; I209-W217 WeakPolarHBondContact O-CZ2 3.35Å; P210-W217 PolarHBondContact O-NE1 3.39Å; M213-W217 PolarHBondContact O-N 3.46Å; M213-W217 VanDerWaalsContact O-N 3.15Å; T214-W217 PolarHBondContact O-N 3.39Å; G215-W217 PolarHBondContact O-N 3.04Å; W217-L220 HydrophobicContact CE3-CD1 4.45Å; W217-L220 PolarHBondContact O-N 3.22Å; W217-Q221 WeakPolarHBondContact O-CB 3.25Å; W217-Q221 WeakPolarHBondContact O-CG 3.36Å; W217-Q221 PolarHBondContact O-N 3.33Å
218	Q	97.9	Very high	97.5	Very high	80 Å²	80	58.5 Å²	58.5	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-62.3	-45.7	174	-176.6	176.1	4.3	0	0	111.3	T214 G215 L220 Q221 N222	T214-Q218 WeakPolarHBondContact O-CB 3.46Å; T214-Q218 PolarHBondContact O-N 2.89Å; G215-Q218 PolarHBondContact O-N 3.08Å; Q218-L220 PolarHBondContact O-N 2.88Å; Q218-Q221 PolarHBondContact O-N 3.12Å; Q218-N222 VanDerWaalsContact O-CG 3.29Å; Q218-N222 PolarHBondContact O-N 3.32Å; Q218-N222 PolarHBondContact O-ND2 3.12Å
219	Y	98.4	Very high	97.5	Very high	3 Å²	3	55.4 Å²	55.4	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-58.2	-48.5	176.5	177.4	-128.6	0	0	0	112.2	L154 F177 L178 D187 L190 L191 L194 G215 I216 Q221 N222 V223	L154-Y219 HydrophobicContact CD1-CD1 4.01Å; L154-Y219 HydrophobicContact CD1-CG 4.09Å; L154-Y219 HydrophobicContact CD2-CD1 4.46Å; L154-Y219 HydrophobicContact CD2-CD2 4.29Å; L154-Y219 HydrophobicContact CD2-CG 4.07Å; F177-Y219 HydrophobicContact CB-CE2 4.14Å; F177-Y219 HydrophobicContact CD1-CD2 4.21Å; F177-Y219 AromaticContact CD1-CE2 3.9Å; F177-Y219 HydrophobicContact CD1-CE2 3.9Å; L178-Y219 HydrophobicContact CG-CE2 4.42Å; D187-Y219 WeakPolarHBondContact OD1-CE2 3.43Å; D187-Y219 PolarHBondContact OD1-OH 3.39Å; L190-Y219 HydrophobicContact CD2-CE1 4.22Å; L191-Y219 HydrophobicContact CD2-CD1 4.24Å; L191-Y219 HydrophobicContact CD2-CE1 3.4Å; L191-Y219 HydrophobicContact CD2-CE2 4.27Å; L191-Y219 VanDerWaalsContact CD2-CZ 3.42Å; L191-Y219 WeakPolarHBondContact CD2-OH 3.45Å; L191-Y219 HydrophobicContact CG-CE1 4.23Å; L191-Y219 WeakPolarHBondContact CG-OH 3.48Å; L194-Y219 HydrophobicContact CD2-CD1 4.32Å; L194-Y219 HydrophobicContact CD2-CE1 4.28Å; G215-Y219 VanDerWaalsContact O-CB 3.32Å; G215-Y219 WeakPolarHBondContact O-CB 3.33Å; G215-Y219 PolarHBondContact O-N 3.24Å; I216-Y219 PolarHBondContact O-N 2.93Å; Y219-Q221 PolarHBondContact O-N 2.79Å; Y219-N222 PolarHBondContact O-N 2.75Å; Y219-V223 HydrophobicContact CD2-CG2 4.13Å; Y219-V223 HydrophobicContact CE2-CG2 3.94Å; Y219-V223 WeakPolarHBondContact O-CB 3.18Å; Y219-V223 WeakPolarHBondContact O-CG2 3.43Å; Y219-V223 PolarHBondContact O-N 2.93Å
220	L	98.1	Very high	97.5	Very high	2 Å²	2	58 Å²	58	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-39.3	176.8	-71.6	177	0	0	0	112.5	L194 K198 I209 I216 W217 Q218 V223 Y224	L194-L220 HydrophobicContact CD2-CD2 3.89Å; L194-L220 HydrophobicContact CD2-CG 4.41Å; L194-L220 HydrophobicContact CG-CD2 4.29Å; K198-L220 HydrophobicContact CD-CD1 4.36Å; I209-L220 HydrophobicContact CD1-CD1 4.2Å; I216-L220 HydrophobicContact CG2-CD1 3.88Å; I216-L220 HydrophobicContact CG2-CG 4.23Å; I216-L220 WeakPolarHBondContact O-CB 3.2Å; I216-L220 WeakPolarHBondContact O-CG 3.38Å; I216-L220 PolarHBondContact O-N 3.06Å; W217-L220 HydrophobicContact CE3-CD1 4.45Å; W217-L220 PolarHBondContact O-N 3.22Å; Q218-L220 PolarHBondContact O-N 2.88Å; L220-V223 PolarHBondContact O-N 2.88Å; L220-Y224 HydrophobicContact CB-CD2 4.44Å; L220-Y224 HydrophobicContact CB-CE2 3.98Å; L220-Y224 WeakPolarHBondContact O-CD2 3.45Å; L220-Y224 VanDerWaalsContact O-CG 3.26Å; L220-Y224 PolarHBondContact O-N 2.72Å
221	Q	97.6	Very high	97.4	Very high	124 Å²	124	60 Å²	60	58%	0.579	30%	0.296	S	S	*	.	H	α-helix	trans	-61.2	-47.6	176.1	-78.5	172.3	-6.2	0	0	111.3	W217 Q218 Y219 V223 Y224 T225	W217-Q221 WeakPolarHBondContact O-CB 3.25Å; W217-Q221 WeakPolarHBondContact O-CG 3.36Å; W217-Q221 PolarHBondContact O-N 3.33Å; Q218-Q221 PolarHBondContact O-N 3.12Å; Y219-Q221 PolarHBondContact O-N 2.79Å; Q221-V223 VanDerWaalsContact C-N 3.33Å; Q221-V223 PolarHBondContact O-N 2.66Å; Q221-Y224 PolarHBondContact O-N 2.75Å; Q221-T225 PolarHBondContact O-N 2.78Å
222	N	97.9	Very high	97.4	Very high	38 Å²	38	51.1 Å²	51.1	20%	0.203	26%	0.257	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.3	-68.1	-30	0	0	0	111	K176 F177 Q218 Y219 Y224 T225	K176-N222 WeakPolarHBondContact CA-ND2 3.44Å; K176-N222 HydrophobicContact CB-CB 4.46Å; K176-N222 PolarHBondContact O-ND2 3.01Å; K176-N222 VanDerWaalsContact O-ND2 3.07Å; F177-N222 HydrophobicContact CE1-CB 4.15Å; Q218-N222 VanDerWaalsContact O-CG 3.29Å; Q218-N222 PolarHBondContact O-N 3.32Å; Q218-N222 PolarHBondContact O-ND2 3.12Å; Y219-N222 PolarHBondContact O-N 2.75Å; N222-Y224 PolarHBondContact O-N 2.93Å; N222-T225 PolarHBondContact O-N 3.37Å; N222-T225 VanDerWaalsContact O-N 3.14Å; N222-T225 PolarHBondContact O-OG1 2.74Å
223	V	96.6	Very high	97.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.1	-38.8	-178.1	169.4	0	0	0	0	112.6	F177 L191 Y219 L220 Q221 T225 R226 F229	F177-V223 HydrophobicContact CD1-CG2 3.84Å; F177-V223 HydrophobicContact CE1-CG2 3.68Å; L191-V223 HydrophobicContact CD1-CB 4.31Å; L191-V223 HydrophobicContact CD1-CG1 3.71Å; L191-V223 HydrophobicContact CD1-CG2 3.6Å; L191-V223 HydrophobicContact CD2-CB 4.22Å; L191-V223 HydrophobicContact CD2-CG1 3.9Å; L191-V223 HydrophobicContact CD2-CG2 3.72Å; L191-V223 HydrophobicContact CG-CG1 4.31Å; L191-V223 HydrophobicContact CG-CG2 4.28Å; Y219-V223 HydrophobicContact CD2-CG2 4.13Å; Y219-V223 HydrophobicContact CE2-CG2 3.94Å; Y219-V223 WeakPolarHBondContact O-CB 3.18Å; Y219-V223 WeakPolarHBondContact O-CG2 3.43Å; Y219-V223 PolarHBondContact O-N 2.93Å; L220-V223 PolarHBondContact O-N 2.88Å; Q221-V223 VanDerWaalsContact C-N 3.33Å; Q221-V223 PolarHBondContact O-N 2.66Å; V223-T225 PolarHBondContact O-N 3.07Å; V223-T225 VanDerWaalsContact O-N 3.16Å; V223-R226 WeakPolarHBondContact O-CB 3.47Å; V223-R226 PolarHBondContact O-N 2.73Å; V223-F229 HydrophobicContact CG1-CB 3.6Å; V223-F229 HydrophobicContact CG1-CD1 3.68Å; V223-F229 HydrophobicContact CG1-CD2 3.71Å; V223-F229 HydrophobicContact CG1-CE1 4.37Å; V223-F229 HydrophobicContact CG1-CE2 4.38Å; V223-F229 HydrophobicContact CG1-CG 3.33Å
224	Y	96.3	Very high	97.3	Very high	69 Å²	69	46 Å²	46	27%	0.271	23%	0.232	S	C	.	.	H	α-helix	trans	-69.7	-8.7	177.8	-64.9	-39.4	0	0	0	113.8	H195 K198 L220 Q221 N222 F229 T230	H195-Y224 AromaticContact ND1-CE1 3.88Å; H195-Y224 AromaticContact ND1-CZ 3.89Å; H195-Y224 PolarHBondContact ND1-OH 2.95Å; H195-Y224 VanDerWaalsContact ND1-OH 3.08Å; K198-Y224 PolarHBondContact NZ-OH 2.69Å; K198-Y224 VanDerWaalsContact NZ-OH 3.12Å; L220-Y224 HydrophobicContact CB-CD2 4.44Å; L220-Y224 HydrophobicContact CB-CE2 3.98Å; L220-Y224 WeakPolarHBondContact O-CD2 3.45Å; L220-Y224 VanDerWaalsContact O-CG 3.26Å; L220-Y224 PolarHBondContact O-N 2.72Å; Q221-Y224 PolarHBondContact O-N 2.75Å; N222-Y224 PolarHBondContact O-N 2.93Å; Y224-F229 HydrophobicContact CD1-CD1 4Å; Y224-F229 AromaticContact CD1-CE1 3.82Å; Y224-F229 HydrophobicContact CD1-CE1 3.82Å; Y224-F229 HydrophobicContact CE1-CD1 4.2Å; Y224-F229 AromaticContact CE1-CE1 3.56Å; Y224-F229 HydrophobicContact CE1-CE1 3.56Å; Y224-F229 HydrophobicContact CE1-CZ 4.29Å; Y224-T230 VanDerWaalsContact O-CG2 3.31Å; Y224-T230 WeakPolarHBondContact O-CG2 3.21Å
225	T	96.9	Very high	97.3	Very high	113 Å²	113	45.4 Å²	45.4	69%	0.693	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-6.4	168.6	69.7	0	0	0	0	113.5	Q221 N222 V223	Q221-T225 PolarHBondContact O-N 2.78Å; N222-T225 PolarHBondContact O-N 3.37Å; N222-T225 VanDerWaalsContact O-N 3.14Å; N222-T225 PolarHBondContact O-OG1 2.74Å; V223-T225 PolarHBondContact O-N 3.07Å; V223-T225 VanDerWaalsContact O-N 3.16Å
226	R	97.3	Very high	97.2	Very high	61 Å²	61	49.3 Å²	49.3	23%	0.23	25%	0.251	C	S	.	.			trans	-95	126.9	-177.1	-65.4	-55.7	-68.5	-131.2	-3.5	111.3	F177 M183 V223 E228 F229 T230	F177-R226 HydrophobicContact CE1-CG 4.26Å; F177-R226 HydrophobicContact CZ-CG 3.83Å; M183-R226 HydrophobicContact CE-CB 3.99Å; M183-R226 HydrophobicContact CE-CG 4.07Å; M183-R226 HydrophobicContact SD-CG 4.46Å; V223-R226 WeakPolarHBondContact O-CB 3.47Å; V223-R226 PolarHBondContact O-N 2.73Å; R226-E228 VanDerWaalsContact CB-OE2 3.29Å; R226-E228 WeakPolarHBondContact CB-OE2 3.47Å; R226-E228 IonicContact CZ-OE1 3.47Å; R226-E228 IonicContact CZ-OE2 3.08Å; R226-E228 IonicContact NE-OE1 3.71Å; R226-E228 PolarHBondContact NE-OE1 2.82Å; R226-E228 IonicContact NE-OE2 3.55Å; R226-E228 PolarHBondContact NE-OE2 2.97Å; R226-E228 VanDerWaalsContact NE-OE2 3.08Å; R226-E228 IonicContact NH2-OE1 3.2Å; R226-E228 PolarHBondContact NH2-OE1 3.17Å; R226-E228 IonicContact NH2-OE2 3.42Å; R226-E228 PolarHBondContact O-N 3.33Å; R226-F229 PolarHBondContact O-N 3.31Å; R226-T230 WeakPolarHBondContact O-CG2 3.33Å; R226-T230 PolarHBondContact O-N 3.2Å; R226-T230 PolarHBondContact O-OG1 3.47Å
227	E	97.3	Very high	97.2	Very high	125 Å²	125	56.2 Å²	56.2	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-64.1	-33.4	177.4	-69.7	-171.6	178.3	0	0	111.7	F229 T230 N231	E227-F229 PolarHBondContact O-N 3.11Å; E227-T230 WeakPolarHBondContact CA-OG1 3.26Å; E227-T230 PolarHBondContact O-N 3.18Å; E227-N231 VanDerWaalsContact O-CB 3.28Å; E227-N231 WeakPolarHBondContact O-CB 3.5Å; E227-N231 PolarHBondContact O-N 3.23Å
228	E	96.8	Very high	97.1	Very high	25 Å²	25	54 Å²	54	12%	0.117	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-31.4	-179.3	-51.8	94.1	143.8	0	0	111.5	M42 W45 L46 M183 R226 T232	M42-E228 WeakPolarHBondContact CG-O 3.2Å; W45-E228 VanDerWaalsContact CD1-CG 3.43Å; W45-E228 HydrophobicContact CG-CB 4.26Å; W45-E228 HydrophobicContact CG-CG 4.03Å; L46-E228 HydrophobicContact CD2-CB 4.43Å; L46-E228 HydrophobicContact CD2-CG 3.89Å; L46-E228 HydrophobicContact CG-CB 4.37Å; L46-E228 HydrophobicContact CG-CG 4.2Å; M183-E228 HydrophobicContact CE-CB 3.71Å; M183-E228 HydrophobicContact CE-CG 4.06Å; R226-E228 VanDerWaalsContact CB-OE2 3.29Å; R226-E228 WeakPolarHBondContact CB-OE2 3.47Å; R226-E228 IonicContact CZ-OE1 3.47Å; R226-E228 IonicContact CZ-OE2 3.08Å; R226-E228 IonicContact NE-OE1 3.71Å; R226-E228 PolarHBondContact NE-OE1 2.82Å; R226-E228 IonicContact NE-OE2 3.55Å; R226-E228 PolarHBondContact NE-OE2 2.97Å; R226-E228 VanDerWaalsContact NE-OE2 3.08Å; R226-E228 IonicContact NH2-OE1 3.2Å; R226-E228 PolarHBondContact NH2-OE1 3.17Å; R226-E228 IonicContact NH2-OE2 3.42Å; R226-E228 PolarHBondContact O-N 3.33Å; E228-T232 WeakPolarHBondContact O-CB 3.34Å; E228-T232 WeakPolarHBondContact O-CG2 3.48Å; E228-T232 PolarHBondContact O-OG1 3.27Å
229	F	97.9	Very high	97.1	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-88.5	-50.3	173	-178.7	-89.7	0	0	0	112.1	Q38 M42 L191 H195 V223 Y224 R226 E227 N231 T232 C233	Q38-F229 VanDerWaalsContact NE2-CE2 3.34Å; M42-F229 HydrophobicContact CE-CB 4.2Å; M42-F229 HydrophobicContact CE-CD2 3.97Å; M42-F229 HydrophobicContact SD-CD2 3.92Å; L191-F229 HydrophobicContact CB-CD2 3.81Å; L191-F229 HydrophobicContact CB-CE2 3.69Å; L191-F229 HydrophobicContact CD1-CD2 4.32Å; H195-F229 HydrophobicContact CB-CE2 4.46Å; H195-F229 HydrophobicContact CB-CZ 3.72Å; H195-F229 AromaticContact CG-CZ 3.85Å; V223-F229 HydrophobicContact CG1-CB 3.6Å; V223-F229 HydrophobicContact CG1-CD1 3.68Å; V223-F229 HydrophobicContact CG1-CD2 3.71Å; V223-F229 HydrophobicContact CG1-CE1 4.37Å; V223-F229 HydrophobicContact CG1-CE2 4.38Å; V223-F229 HydrophobicContact CG1-CG 3.33Å; Y224-F229 HydrophobicContact CD1-CD1 4Å; Y224-F229 AromaticContact CD1-CE1 3.82Å; Y224-F229 HydrophobicContact CD1-CE1 3.82Å; Y224-F229 HydrophobicContact CE1-CD1 4.2Å; Y224-F229 AromaticContact CE1-CE1 3.56Å; Y224-F229 HydrophobicContact CE1-CE1 3.56Å; Y224-F229 HydrophobicContact CE1-CZ 4.29Å; R226-F229 PolarHBondContact O-N 3.31Å; E227-F229 PolarHBondContact O-N 3.11Å; F229-N231 PolarHBondContact O-N 2.83Å; F229-T232 PolarHBondContact O-N 2.99Å; F229-T232 PolarHBondContact O-OG1 2.77Å; F229-T232 VanDerWaalsContact O-OG1 3.06Å; F229-C233 HydrophobicContact CE1-CB 4.15Å; F229-C233 HydrophobicContact CZ-CB 4.42Å; F229-C233 WeakPolarHBondContact O-CB 3.49Å; F229-C233 PolarHBondContact O-N 2.84Å
230	T	96.8	Very high	97.1	Very high	57 Å²	57	52.1 Å²	52.1	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-66.4	-38	-171.1	49.7	0	0	0	0	113.2	Y224 R226 E227 T232	Y224-T230 VanDerWaalsContact O-CG2 3.31Å; Y224-T230 WeakPolarHBondContact O-CG2 3.21Å; R226-T230 WeakPolarHBondContact O-CG2 3.33Å; R226-T230 PolarHBondContact O-N 3.2Å; R226-T230 PolarHBondContact O-OG1 3.47Å; E227-T230 WeakPolarHBondContact CA-OG1 3.26Å; E227-T230 PolarHBondContact O-N 3.18Å; T230-T232 VanDerWaalsContact C-N 3.34Å
231	N	96	Very high	97	Very high	83 Å²	83	54.9 Å²	54.9	44%	0.444	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-13.9	179.3	-66.6	-28.8	0	0	0	113.5	W45 E227 F229	W45-N231 HydrophobicContact CH2-CB 3.64Å; W45-N231 HydrophobicContact CZ2-CB 4.45Å; W45-N231 HydrophobicContact CZ3-CB 3.86Å; E227-N231 VanDerWaalsContact O-CB 3.28Å; E227-N231 WeakPolarHBondContact O-CB 3.5Å; E227-N231 PolarHBondContact O-N 3.23Å; F229-N231 PolarHBondContact O-N 2.83Å
232	T	96.6	Very high	96.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-12.4	176.6	64.2	0	0	0	0	112.5	Q38 F41 M42 W45 E228 F229 T230	Q38-T232 WeakPolarHBondContact CG-O 3.31Å; Q38-T232 PolarHBondContact NE2-OG1 3.45Å; F41-T232 HydrophobicContact CB-CG2 3.98Å; F41-T232 HydrophobicContact CD1-CG2 3.73Å; F41-T232 HydrophobicContact CD2-CG2 3.6Å; F41-T232 HydrophobicContact CE1-CG2 4.04Å; F41-T232 HydrophobicContact CE2-CG2 3.91Å; F41-T232 HydrophobicContact CG-CG2 3.48Å; F41-T232 VanDerWaalsContact CG-CG2 3.48Å; F41-T232 HydrophobicContact CZ-CG2 4.11Å; M42-T232 HydrophobicContact CG-CG2 4.42Å; M42-T232 WeakPolarHBondContact CG-OG1 3.44Å; W45-T232 HydrophobicContact CE3-CG2 3.89Å; W45-T232 HydrophobicContact CZ3-CG2 4.35Å; E228-T232 WeakPolarHBondContact O-CB 3.34Å; E228-T232 WeakPolarHBondContact O-CG2 3.48Å; E228-T232 PolarHBondContact O-OG1 3.27Å; F229-T232 PolarHBondContact O-N 2.99Å; F229-T232 PolarHBondContact O-OG1 2.77Å; F229-T232 VanDerWaalsContact O-OG1 3.06Å; T230-T232 VanDerWaalsContact C-N 3.34Å
233	C	96.2	Very high	96.8	Very high	25 Å²	25	50.5 Å²	50.5	17%	0.169	27%	0.265	C	S	.	.	S	Bend	trans	-76.8	130.9	-177.5	-165.2	0	0	0	0	111.5	Q38 H195 F229	Q38-C233 VanDerWaalsContact NE2-CA 3.27Å; H195-C233 PolarHBondContact CD2-SG 2.87Å; H195-C233 PolarHBondContact NE2-SG 2.86Å; F229-C233 HydrophobicContact CE1-CB 4.15Å; F229-C233 HydrophobicContact CZ-CB 4.42Å; F229-C233 WeakPolarHBondContact O-CB 3.49Å; F229-C233 PolarHBondContact O-N 2.84Å
234	P	96.6	Very high	96.7	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.058	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.9	159.3	167.5	29.9	-34.8	0	0	0	110.2	I31 E238 I239	I31-P234 HydrophobicContact CG2-CB 4.34Å; P234-E238 HydrophobicContact CB-CB 4.32Å; P234-I239 HydrophobicContact CB-CG1 4.5Å; P234-I239 HydrophobicContact CG-CD1 4.09Å; P234-I239 HydrophobicContact CG-CG1 3.84Å
235	S	96.8	Very high	96.3	Very high	67 Å²	67	59.9 Å²	59.9	47%	0.469	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-63.7	149.6	174.7	75.1	0	0	0	0	111.7	K237 E238 I239	S235-K237 PolarHBondContact O-N 2.95Å; S235-K237 VanDerWaalsContact O-N 3.14Å; S235-E238 WeakPolarHBondContact O-CB 3.45Å; S235-E238 PolarHBondContact O-N 3.47Å; S235-E238 WeakPolarHBondContact OG-CG 3.28Å; S235-E238 PolarHBondContact OG-N 3.18Å; S235-I239 PolarHBondContact O-N 2.97Å; S235-I239 VanDerWaalsContact O-N 3.15Å
236	D	97.4	Very high	96	Very high	84 Å²	84	57.2 Å²	57.2	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-51.8	-39.4	175	-75.7	12	0	0	0	111.5	H195 V199 E238 I239 E240	H195-D236 IonicContact CE1-OD1 2.69Å; H195-D236 IonicContact NE2-OD1 3.81Å; V199-D236 HydrophobicContact CG1-CB 4.16Å; D236-E238 VanDerWaalsContact C-N 3.35Å; D236-E238 PolarHBondContact O-N 3.4Å; D236-I239 WeakPolarHBondContact O-CB 3.4Å; D236-I239 PolarHBondContact O-N 3.41Å; D236-E240 VanDerWaalsContact O-CG 3.31Å; D236-E240 WeakPolarHBondContact O-CG 3.36Å; D236-E240 PolarHBondContact O-N 3.35Å
237	K	97	Very high	95.7	Very high	145 Å²	145	54.7 Å²	54.7	63%	0.63	29%	0.291	S	S	*	.	H	α-helix	trans	-61.1	-40.6	178	-172.7	178.6	178.3	-174.3	0	112.5	S235 E240 I241	S235-K237 PolarHBondContact O-N 2.95Å; S235-K237 VanDerWaalsContact O-N 3.14Å; K237-E240 PolarHBondContact O-N 3.43Å; K237-I241 HydrophobicContact CG-CD1 3.93Å; K237-I241 WeakPolarHBondContact O-CB 3.17Å; K237-I241 WeakPolarHBondContact O-CD1 3.43Å; K237-I241 WeakPolarHBondContact O-CG1 3.45Å; K237-I241 PolarHBondContact O-N 3.05Å
238	E	97.1	Very high	95	Very high	19 Å²	19	54 Å²	54	9%	0.089	29%	0.286	C	S	.	.	H	α-helix	trans	-66.8	-37.7	176	-76.6	-60.1	133.7	0	0	112	G25 S26 P234 S235 D236 A242	G25-E238 WeakPolarHBondContact CA-OE2 3.44Å; S26-E238 WeakPolarHBondContact CB-OE1 3.42Å; S26-E238 PolarHBondContact N-OE1 3.26Å; S26-E238 PolarHBondContact N-OE2 2.94Å; S26-E238 PolarHBondContact OG-OE1 2.86Å; P234-E238 HydrophobicContact CB-CB 4.32Å; S235-E238 WeakPolarHBondContact O-CB 3.45Å; S235-E238 PolarHBondContact O-N 3.47Å; S235-E238 WeakPolarHBondContact OG-CG 3.28Å; S235-E238 PolarHBondContact OG-N 3.18Å; D236-E238 VanDerWaalsContact C-N 3.35Å; D236-E238 PolarHBondContact O-N 3.4Å; E238-A242 WeakPolarHBondContact O-CB 3.39Å; E238-A242 PolarHBondContact O-N 2.91Å; E238-A242 VanDerWaalsContact O-N 3.11Å
239	I	97.9	Very high	94.3	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-46.8	174.1	-60.3	172.9	0	0	0	110.1	I196 V199 V200 P234 S235 D236 A242 Y243	I196-I239 HydrophobicContact CB-CG2 4.44Å; I196-I239 HydrophobicContact CG1-CD1 4.44Å; I196-I239 HydrophobicContact CG1-CG2 4.16Å; I196-I239 HydrophobicContact CG2-CG2 4.25Å; V199-I239 HydrophobicContact CB-CG2 4.17Å; V199-I239 HydrophobicContact CG1-CB 4.14Å; V199-I239 HydrophobicContact CG1-CG2 3.98Å; V199-I239 HydrophobicContact CG2-CD1 4.32Å; V200-I239 HydrophobicContact CG2-CG2 3.59Å; P234-I239 HydrophobicContact CB-CG1 4.5Å; P234-I239 HydrophobicContact CG-CD1 4.09Å; P234-I239 HydrophobicContact CG-CG1 3.84Å; S235-I239 PolarHBondContact O-N 2.97Å; S235-I239 VanDerWaalsContact O-N 3.15Å; D236-I239 WeakPolarHBondContact O-CB 3.4Å; D236-I239 PolarHBondContact O-N 3.41Å; I239-A242 PolarHBondContact O-N 2.88Å; I239-Y243 WeakPolarHBondContact O-CD2 3.31Å; I239-Y243 PolarHBondContact O-N 3.36Å
240	E	97.5	Very high	93.6	Very high	45 Å²	45	66.3 Å²	66.3	21%	0.21	34%	0.336	C	S	.	.	H	α-helix	trans	-58.9	-53.2	177.5	-69.5	-178.5	167	0	0	111.4	V199 K203 Y204 D236 K237 A242 Y243 Q244	V199-E240 HydrophobicContact CG1-CG 4.08Å; K203-E240 HydrophobicContact CB-CG 4.19Å; K203-E240 WeakPolarHBondContact CD-OE1 3.46Å; K203-E240 HydrophobicContact CG-CG 3.9Å; K203-E240 IonicContact NZ-OE1 3.14Å; K203-E240 PolarHBondContact NZ-OE1 2.61Å; K203-E240 VanDerWaalsContact NZ-OE1 3.14Å; K203-E240 IonicContact NZ-OE2 2.71Å; K203-E240 PolarHBondContact NZ-OE2 3.2Å; Y204-E240 PolarHBondContact OH-O 3.22Å; D236-E240 VanDerWaalsContact O-CG 3.31Å; D236-E240 WeakPolarHBondContact O-CG 3.36Å; D236-E240 PolarHBondContact O-N 3.35Å; K237-E240 PolarHBondContact O-N 3.43Å; E240-A242 PolarHBondContact O-N 3.46Å; E240-Y243 CarbonylContact O-C 3.59Å; E240-Y243 PolarHBondContact O-N 3.29Å; E240-Q244 PolarHBondContact O-N 3.39Å
241	I	95.9	Very high	92.6	Very high	60 Å²	60	68.4 Å²	68.4	31%	0.308	35%	0.349	S	S	.	.	H	α-helix	trans	-53.7	-44.4	179.4	-71.4	165.7	0	0	0	110.8	K237 Y243 Q244	K237-I241 HydrophobicContact CG-CD1 3.93Å; K237-I241 WeakPolarHBondContact O-CB 3.17Å; K237-I241 WeakPolarHBondContact O-CD1 3.43Å; K237-I241 WeakPolarHBondContact O-CG1 3.45Å; K237-I241 PolarHBondContact O-N 3.05Å; I241-Y243 PolarHBondContact O-N 2.96Å; I241-Q244 WeakPolarHBondContact O-CB 3.41Å; I241-Q244 PolarHBondContact O-N 3.25Å
242	A	95.1	Very high	90.6	Very high	45 Å²	45	76.9 Å²	76.9	37%	0.372	38%	0.382	S	S	.	.	H	α-helix	trans	-64.7	-21.2	-179.3	0	0	0	0	0	114.1	N33 E238 I239 E240	N33-A242 HydrophobicContact CB-CB 3.61Å; N33-A242 WeakPolarHBondContact ND2-CB 3.21Å; E238-A242 WeakPolarHBondContact O-CB 3.39Å; E238-A242 PolarHBondContact O-N 2.91Å; E238-A242 VanDerWaalsContact O-N 3.11Å; I239-A242 PolarHBondContact O-N 2.88Å; E240-A242 PolarHBondContact O-N 3.46Å
243	Y	96.4	Very high	90.3	Very high	25 Å²	25	80.8 Å²	80.8	10%	0.098	40%	0.401	C	S	.	.	H	α-helix	trans	-103	-6.7	178	-82.2	-95.4	0	0	0	114.1	N33 F121 F124 I128 I196 V200 I239 E240 I241 D245 V246 A247	N33-Y243 WeakPolarHBondContact ND2-CE2 3.37Å; F121-Y243 WeakPolarHBondContact CZ-OH 3.39Å; F124-Y243 AromaticContact CE1-CE1 3.74Å; F124-Y243 HydrophobicContact CE1-CE1 3.74Å; F124-Y243 AromaticContact CE1-CZ 3.87Å; F124-Y243 HydrophobicContact CZ-CD1 4.22Å; F124-Y243 AromaticContact CZ-CE1 3.66Å; F124-Y243 HydrophobicContact CZ-CE1 3.66Å; I128-Y243 HydrophobicContact CG2-CD1 4.47Å; I128-Y243 HydrophobicContact CG2-CE1 4.4Å; I196-Y243 HydrophobicContact CG2-CD2 4.41Å; I196-Y243 HydrophobicContact CG2-CE2 3.5Å; I196-Y243 VanDerWaalsContact CG2-CE2 3.5Å; V200-Y243 HydrophobicContact CB-CG 4.44Å; V200-Y243 HydrophobicContact CG1-CD1 3.81Å; V200-Y243 HydrophobicContact CG1-CD2 4.47Å; V200-Y243 HydrophobicContact CG1-CG 3.79Å; V200-Y243 HydrophobicContact CG2-CD1 4.27Å; V200-Y243 HydrophobicContact CG2-CD2 3.54Å; V200-Y243 HydrophobicContact CG2-CE2 3.98Å; V200-Y243 HydrophobicContact CG2-CG 3.7Å; I239-Y243 WeakPolarHBondContact O-CD2 3.31Å; I239-Y243 PolarHBondContact O-N 3.36Å; E240-Y243 CarbonylContact O-C 3.59Å; E240-Y243 PolarHBondContact O-N 3.29Å; I241-Y243 PolarHBondContact O-N 2.96Å; Y243-D245 VanDerWaalsContact C-N 3.3Å; Y243-D245 PolarHBondContact O-N 3.3Å; Y243-V246 HydrophobicContact CD1-CG2 3.64Å; Y243-V246 HydrophobicContact CE1-CG2 4.34Å; Y243-V246 HydrophobicContact CG-CG2 4.17Å; Y243-V246 WeakPolarHBondContact O-CG2 3.18Å; Y243-V246 PolarHBondContact O-N 2.93Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; Y243-A247 WeakPolarHBondContact O-CB 3.08Å; Y243-A247 PolarHBondContact O-N 3.09Å
244	Q	94.4	Very high	90	Very high	118 Å²	118	83.7 Å²	83.7	55%	0.551	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-43.1	-175	-178.1	175.3	-25.7	0	0	113.8	Y204 E240 I241	Y204-Q244 WeakPolarHBondContact OH-CA 3.33Å; E240-Q244 PolarHBondContact O-N 3.39Å; I241-Q244 WeakPolarHBondContact O-CB 3.41Å; I241-Q244 PolarHBondContact O-N 3.25Å
245	D	89.3	Confident	89.6	Confident	148 Å²	148	87.8 Å²	87.8	79%	0.791	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-25.8	-176.7	-63.7	-28.5	0	0	0	113.3	Y243	Y243-D245 VanDerWaalsContact C-N 3.3Å; Y243-D245 PolarHBondContact O-N 3.3Å
246	V	90.8	Very high	89.2	Confident	56 Å²	56	89.1 Å²	89.1	34%	0.339	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-22.7	-176.2	-64.5	0	0	0	0	113	Y243 K248	Y243-V246 HydrophobicContact CD1-CG2 3.64Å; Y243-V246 HydrophobicContact CE1-CG2 4.34Å; Y243-V246 HydrophobicContact CG-CG2 4.17Å; Y243-V246 WeakPolarHBondContact O-CG2 3.18Å; Y243-V246 PolarHBondContact O-N 2.93Å; Y243-V246 VanDerWaalsContact O-N 3.15Å; V246-K248 PolarHBondContact O-N 2.77Å
247	A	89.8	Confident	88.7	Confident	8 Å²	8	89.4 Å²	89.4	7%	0.066	43%	0.429	C	S	.	.	S	Bend	trans	-76.1	74	174.5	0	0	0	0	0	110.1	I128 Y204 Y243	I128-A247 HydrophobicContact CD1-CB 3.92Å; I128-A247 HydrophobicContact CG1-CB 3.88Å; I128-A247 WeakPolarHBondContact O-CA 3.4Å; Y204-A247 HydrophobicContact CD1-CB 3.64Å; Y204-A247 HydrophobicContact CD2-CB 3.89Å; Y204-A247 HydrophobicContact CE1-CB 4.13Å; Y204-A247 HydrophobicContact CE2-CB 4.34Å; Y204-A247 HydrophobicContact CG-CB 3.52Å; Y243-A247 WeakPolarHBondContact O-CB 3.08Å; Y243-A247 PolarHBondContact O-N 3.09Å
248	K	82.4	Confident	88.2	Confident	112 Å²	112	85.7 Å²	85.7	49%	0.487	42%	0.416	S	S	.	.			trans	-58.5	142.2	-175.5	-61.7	-171.3	-176.8	178.6	0	110.8	K129 R205 V246	K129-K248 WeakPolarHBondContact O-CD 3.39Å; R205-K248 VanDerWaalsContact CZ-O 3.24Å; R205-K248 PolarHBondContact NH1-O 3.01Å; R205-K248 PolarHBondContact NH2-O 3.12Å; V246-K248 PolarHBondContact O-N 2.77Å
249	R	83.3	Confident	87.5	Confident	218 Å²	218	90.4 Å²	90.4	82%	0.823	44%	0.439	S	S	*	.			trans	-69.8	146.6	169.2	-65.6	-177.8	-178.1	177.3	0.6	109.2	V251	R249-V251 PolarHBondContact O-N 2.68Å
250	L	82.3	Confident	86.7	Confident	69 Å²	69	97.4 Å²	97.4	36%	0.361	47%	0.473	S	S	.	.			trans	-71.6	110.9	168.3	-61.9	177.7	0	0	0	107.2	P133 N136	P133-L250 HydrophobicContact CG-CB 4.45Å; N136-L250 HydrophobicContact CB-CD1 4.19Å; N136-L250 HydrophobicContact CB-CD2 4.27Å
251	V	75.8	Confident	85.8	Confident	100 Å²	100	101.8 Å²	101.8	61%	0.606	50%	0.495	S	S	*	.			trans	-95.4	122.5	179.5	-173.4	0	0	0	0	107	S131 P133 R249	S131-V251 PolarHBondContact O-N 2.88Å; P133-V251 WeakPolarHBondContact CD-O 3.31Å; P133-V251 VanDerWaalsContact CG-O 3.24Å; P133-V251 WeakPolarHBondContact CG-O 3.37Å; R249-V251 PolarHBondContact O-N 2.68Å
252	K	54.3	Low	84.9	Confident	262 Å²	262	105.5 Å²	105.5	100%	1.139	51%	0.512	S	S	*	.			trans	-70.6	0	171.1	-76.9	-173	176.8	-177.2	0	110.6

Retrieved 252 of 252 residues in 1515.9 ms (Link to these results)

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