A0A5K4ENZ0_SCHMA Loading...

Putative leucine-rich repeat-containing protein

AlphaFold DB , UniProt , Accession A0A5K4ENZ0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 439 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	62.9	Low	59.4	Low	72 Å²	72	72.8 Å²	72.8	36%	0.355	44%	0.438	S	S	.	.				0	150.6	0	-66.4	160.6	72.4	0	0	107.6	L62 Y65 L66 I67 I109	M1-L62 HydrophobicContact CE-CD2 3.61Å; M1-Y65 HydrophobicContact CB-CD1 4.48Å; M1-Y65 HydrophobicContact CE-CD1 3.91Å; M1-Y65 HydrophobicContact CE-CG 4.09Å; M1-L66 CarbonylContact C-O 3.58Å; M1-L66 VanDerWaalsContact CA-O 3.29Å; M1-L66 WeakPolarHBondContact CA-O 3.43Å; M1-I67 HydrophobicContact CE-CD1 4.32Å; M1-I67 HydrophobicContact CE-CG1 4.34Å; M1-I67 HydrophobicContact CG-CG1 4.35Å; M1-I109 HydrophobicContact SD-CD1 4.28Å
2	V	66.2	Low	57.9	Low	6 Å²	6	77.2 Å²	77.2	4%	0.036	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.7	174.1	176.7	0	0	0	0	108	L25 L27 Y65 L66 L68	V2-L25 WeakPolarHBondContact CA-O 3.41Å; V2-L25 HydrophobicContact CG1-CB 4.42Å; V2-L25 HydrophobicContact CG1-CD2 4.27Å; V2-L25 HydrophobicContact CG1-CG 4.19Å; V2-L25 HydrophobicContact CG2-CB 4.3Å; V2-L25 HydrophobicContact CG2-CD2 4.01Å; V2-L25 HydrophobicContact CG2-CG 4.48Å; V2-L27 HydrophobicContact CG1-CB 4.39Å; V2-L27 HydrophobicContact CG1-CD1 3.8Å; V2-L27 HydrophobicContact CG1-CG 3.68Å; V2-Y65 CarbonylContact O-C 3.6Å; V2-Y65 VanDerWaalsContact O-CA 3.3Å; V2-Y65 WeakPolarHBondContact O-CA 3.43Å; V2-L66 HydrophobicContact CB-CB 4.32Å; V2-L66 PolarHBondContact N-O 2.92Å; V2-L66 PolarHBondContact O-N 3.49Å; V2-L68 HydrophobicContact CG2-CD1 3.58Å; V2-L68 HydrophobicContact CG2-CD2 4.32Å; V2-L68 HydrophobicContact CG2-CG 3.9Å
3	K	74.6	Confident	56.7	Low	51 Å²	51	86.8 Å²	86.8	22%	0.222	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	137.4	170.6	-161.5	-154.9	164.4	-164.3	0	109.3	D5 Q24 L25 T26 L27	K3-D5 IonicContact NZ-OD1 2.62Å; K3-D5 IonicContact NZ-OD2 3.58Å; K3-D5 PolarHBondContact NZ-OD2 2.79Å; K3-Q24 HydrophobicContact CB-CG 4.45Å; K3-L25 PolarHBondContact N-O 3.42Å; K3-T26 HydrophobicContact CB-CG2 4.15Å; K3-T26 HydrophobicContact CD-CG2 4.06Å; K3-T26 WeakPolarHBondContact O-CA 3.37Å; K3-L27 PolarHBondContact O-N 3.2Å
4	L	73.1	Confident	55.9	Low	2 Å²	2	92.9 Å²	92.9	1%	0.01	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	135.4	164.3	-64.7	170.4	0	0	0	109.2	L6 L27 F32 L44 Y55 D64 L66	L4-L6 HydrophobicContact CB-CG 4.27Å; L4-L27 CarbonylContact C-O 3.44Å; L4-F32 HydrophobicContact CD2-CE2 4.07Å; L4-F32 HydrophobicContact CD2-CZ 3.83Å; L4-L44 HydrophobicContact CD1-CD1 3.64Å; L4-L44 HydrophobicContact CD2-CD1 4.26Å; L4-Y55 HydrophobicContact CD1-CD2 4.02Å; L4-Y55 HydrophobicContact CD1-CE2 3.57Å; L4-D64 PolarHBondContact N-O 3.46Å; L4-L66 HydrophobicContact CD1-CD2 3.96Å; L4-L66 HydrophobicContact CD1-CG 4.07Å; L4-L66 HydrophobicContact CD2-CD1 4.03Å; L4-L66 HydrophobicContact CD2-CG 4.04Å; L4-L66 HydrophobicContact CG-CD2 4.5Å; L4-L66 HydrophobicContact CG-CG 4.07Å
5	D	76.7	Confident	55.1	Low	70 Å²	70	89.7 Å²	89.7	37%	0.374	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	72.7	169.1	-135.1	-33.4	0	0	0	109.8	K3 G7 T26 L27 D28 K29	K3-D5 IonicContact NZ-OD1 2.62Å; K3-D5 IonicContact NZ-OD2 3.58Å; K3-D5 PolarHBondContact NZ-OD2 2.79Å; D5-G7 PolarHBondContact O-N 3.17Å; D5-T26 HydrophobicContact CB-CG2 3.93Å; D5-L27 PolarHBondContact N-O 3.27Å; D5-D28 HydrophobicContact CB-CB 4.25Å; D5-D28 WeakPolarHBondContact O-CA 3.38Å; D5-K29 PolarHBondContact O-N 2.65Å
6	L	69.1	Low	54.9	Low	72 Å²	72	88.3 Å²	88.3	38%	0.377	51%	0.508	S	S	.	.			trans	-81.2	13.7	179.6	-53	-179.3	0	0	0	112.6	L4 F32 I40	L4-L6 HydrophobicContact CB-CG 4.27Å; L6-F32 HydrophobicContact CD2-CD2 4.1Å; L6-F32 HydrophobicContact CD2-CE2 3.93Å; L6-I40 HydrophobicContact CD1-CG2 4.13Å; L6-I40 HydrophobicContact CD2-CD1 4.04Å; L6-I40 HydrophobicContact CD2-CG2 4.06Å
7	G	61.1	Low	54.8	Low	47 Å²	47	84.4 Å²	84.4	49%	0.485	49%	0.487	S	S	.	.	S	Bend	trans	-61.3	147.1	170.8	0	0	0	0	0	111.1	D5 G9	D5-G7 PolarHBondContact O-N 3.17Å; G7-G9 PolarHBondContact O-N 3.24Å; G7-G9 VanDerWaalsContact O-N 3.14Å
8	S	49.8	Very low	54.8	Low	99 Å²	99	82.6 Å²	82.6	69%	0.692	48%	0.48	S	S	*	.			trans	-56	118.2	-175	55.4	0	0	0	0	112.1	Q10	S8-Q10 PolarHBondContact O-N 3.45Å
9	G	42.6	Very low	54.8	Low	66 Å²	66	83.6 Å²	83.6	68%	0.68	48%	0.478	S	S	*	.			trans	-63.4	95.8	175	0	0	0	0	0	111.6	G7 N11	G7-G9 PolarHBondContact O-N 3.24Å; G7-G9 VanDerWaalsContact O-N 3.14Å; G9-N11 PolarHBondContact O-N 3.33Å
10	Q	39.8	Very low	54.8	Low	156 Å²	156	86.5 Å²	86.5	73%	0.729	49%	0.49	S	S	*	.			trans	-86.5	100.9	168.9	-73.4	-170.8	-24	0	0	109.4	S8 N12	S8-Q10 PolarHBondContact O-N 3.45Å; Q10-N12 PolarHBondContact O-N 3Å; Q10-N12 VanDerWaalsContact O-N 3.08Å; Q10-N12 PolarHBondContact O-ND2 3.07Å
11	N	37.3	Very low	54.4	Low	160 Å²	160	84.2 Å²	84.2	86%	0.856	49%	0.486	S	S	*	.	S	Bend	trans	35.3	61.6	148.9	-55.6	7.9	0	0	0	116.2	G9	G9-N11 PolarHBondContact O-N 3.33Å
12	N	42.3	Very low	53.8	Low	125 Å²	125	87.8 Å²	87.8	67%	0.668	51%	0.507	S	S	*	.			trans	-124.6	97.2	166.3	-77.9	-77.3	0	0	0	108.6	Q10 D14 C15	Q10-N12 PolarHBondContact O-N 3Å; Q10-N12 VanDerWaalsContact O-N 3.08Å; Q10-N12 PolarHBondContact O-ND2 3.07Å; N12-D14 PolarHBondContact O-N 3.28Å; N12-C15 HydrophobicContact CB-CB 4.09Å; N12-C15 VanDerWaalsContact O-CB 3.27Å; N12-C15 WeakPolarHBondContact O-CB 3.16Å; N12-C15 PolarHBondContact O-N 3.29Å; N12-C15 VanDerWaalsContact O-N 3.14Å
13	E	41.8	Very low	52.9	Low	203 Å²	203	95.7 Å²	95.7	95%	0.949	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.2	-174.4	-61.4	-179.4	137.3	0	0	113.1
14	D	46.1	Very low	52	Low	172 Å²	172	94.6 Å²	94.6	92%	0.92	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	10.9	174.8	-69.3	-54.7	0	0	0	114.4	N12 S16	N12-D14 PolarHBondContact O-N 3.28Å; D14-S16 PolarHBondContact O-N 3.25Å
15	C	43.2	Very low	51.6	Low	45 Å²	45	97.3 Å²	97.3	30%	0.304	56%	0.559	S	S	.	*			trans	-83.5	101.8	-173.8	-165	0	0	0	0	112.8	N12 S17 K19	N12-C15 HydrophobicContact CB-CB 4.09Å; N12-C15 VanDerWaalsContact O-CB 3.27Å; N12-C15 WeakPolarHBondContact O-CB 3.16Å; N12-C15 PolarHBondContact O-N 3.29Å; N12-C15 VanDerWaalsContact O-N 3.14Å; C15-S17 PolarHBondContact O-N 3.43Å; C15-K19 PolarHBondContact SG-NZ 3.19Å
16	S	51.8	Low	51.1	Low	67 Å²	67	95.3 Å²	95.3	47%	0.469	55%	0.549	S	S	.	.			trans	-57.5	122	175.1	62.2	0	0	0	0	112.8	D14 S18	D14-S16 PolarHBondContact O-N 3.25Å; S16-S18 CarbonylContact O-C 3.58Å; S16-S18 PolarHBondContact O-N 3.29Å; S16-S18 PolarHBondContact OG-O 2.86Å
17	S	53.8	Low	51.3	Low	22 Å²	22	92.7 Å²	92.7	15%	0.154	54%	0.535	C	S	.	.	S	Bend	trans	-61.2	-8.7	-173.7	62.2	0	0	0	0	116	C15 E34	C15-S17 PolarHBondContact O-N 3.43Å; S17-E34 WeakPolarHBondContact CB-OE1 3.13Å; S17-E34 WeakPolarHBondContact CB-OE2 2.99Å; S17-E34 PolarHBondContact OG-OE1 3.25Å; S17-E34 PolarHBondContact OG-OE2 2.99Å
18	S	54.1	Low	52.1	Low	52 Å²	52	91.4 Å²	91.4	36%	0.364	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	145.9	159.7	63.3	0	0	0	0	111.5	S16 T26	S16-S18 CarbonylContact O-C 3.58Å; S16-S18 PolarHBondContact O-N 3.29Å; S16-S18 PolarHBondContact OG-O 2.86Å; S18-T26 WeakPolarHBondContact CA-O 3.39Å
19	K	55.5	Low	53.1	Low	101 Å²	101	90.7 Å²	90.7	44%	0.439	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.9	175.9	-70.2	173.1	-173.6	165.6	0	109.8	C15 T26	C15-K19 PolarHBondContact SG-NZ 3.19Å; K19-T26 PolarHBondContact N-O 3.19Å; K19-T26 PolarHBondContact O-N 3.18Å
20	I	53.4	Low	54.5	Low	141 Å²	141	90.3 Å²	90.3	72%	0.723	49%	0.486	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.3	110.5	173.7	-59.3	176.2	0	0	0	107.7	L25	I20-L25 HydrophobicContact CG1-CD1 3.9Å
21	G	47.7	Very low	56.2	Low	39 Å²	39	85.2 Å²	85.2	40%	0.402	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	145.1	176.7	0	0	0	0	0	110.2	N23 Q24	G21-N23 VanDerWaalsContact C-N 3.25Å; G21-N23 PolarHBondContact O-N 2.58Å; G21-Q24 PolarHBondContact N-O 3.42Å; G21-Q24 VanDerWaalsContact N-O 3.11Å; G21-Q24 WeakPolarHBondContact O-CA 3.26Å; G21-Q24 WeakPolarHBondContact O-CB 3.32Å; G21-Q24 PolarHBondContact O-N 3.2Å; G21-Q24 VanDerWaalsContact O-O 3.13Å
22	N	49.5	Very low	58.1	Low	147 Å²	147	78 Å²	78	79%	0.786	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	40.3	-179.1	-58	-16.5	0	0	0	114.2	Q24	N22-Q24 PolarHBondContact O-N 3.34Å; N22-Q24 VanDerWaalsContact O-N 3.12Å
23	N	48.3	Very low	59.6	Low	172 Å²	172	75.5 Å²	75.5	92%	0.92	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	15.9	-173.4	-59.8	-20	0	0	0	115.2	G21	G21-N23 VanDerWaalsContact C-N 3.25Å; G21-N23 PolarHBondContact O-N 2.58Å
24	Q	54.6	Low	61.2	Low	29 Å²	29	71.7 Å²	71.7	14%	0.136	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.7	-179.9	-170.5	175.8	22.7	0	0	109.9	K3 G21 N22 Y144	K3-Q24 HydrophobicContact CB-CG 4.45Å; G21-Q24 PolarHBondContact N-O 3.42Å; G21-Q24 VanDerWaalsContact N-O 3.11Å; G21-Q24 WeakPolarHBondContact O-CA 3.26Å; G21-Q24 WeakPolarHBondContact O-CB 3.32Å; G21-Q24 PolarHBondContact O-N 3.2Å; G21-Q24 VanDerWaalsContact O-O 3.13Å; N22-Q24 PolarHBondContact O-N 3.34Å; N22-Q24 VanDerWaalsContact O-N 3.12Å; Q24-Y144 VanDerWaalsContact OE1-CE1 3.27Å; Q24-Y144 VanDerWaalsContact OE1-CZ 3.28Å; Q24-Y144 PolarHBondContact OE1-OH 3.17Å
25	L	65	Low	62.6	Low	59 Å²	59	68.7 Å²	68.7	31%	0.309	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.1	164.7	-179.9	65.6	0	0	0	108.4	V2 K3 I20 L27	V2-L25 WeakPolarHBondContact CA-O 3.41Å; V2-L25 HydrophobicContact CG1-CB 4.42Å; V2-L25 HydrophobicContact CG1-CD2 4.27Å; V2-L25 HydrophobicContact CG1-CG 4.19Å; V2-L25 HydrophobicContact CG2-CB 4.3Å; V2-L25 HydrophobicContact CG2-CD2 4.01Å; V2-L25 HydrophobicContact CG2-CG 4.48Å; K3-L25 PolarHBondContact N-O 3.42Å; I20-L25 HydrophobicContact CG1-CD1 3.9Å; L25-L27 HydrophobicContact CD1-CD2 4.49Å; L25-L27 HydrophobicContact CD2-CD2 4.26Å; L25-L27 HydrophobicContact CG-CD2 4.3Å
26	T	67	Low	64.2	Low	27 Å²	27	75 Å²	75	17%	0.166	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.3	166.4	-55.4	0	0	0	0	108.9	K3 D5 S18 K19	K3-T26 HydrophobicContact CB-CG2 4.15Å; K3-T26 HydrophobicContact CD-CG2 4.06Å; K3-T26 WeakPolarHBondContact O-CA 3.37Å; D5-T26 HydrophobicContact CB-CG2 3.93Å; S18-T26 WeakPolarHBondContact CA-O 3.39Å; K19-T26 PolarHBondContact N-O 3.19Å; K19-T26 PolarHBondContact O-N 3.18Å
27	L	73.7	Confident	65.3	Low	18 Å²	18	73.8 Å²	73.8	9%	0.094	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.5	167.7	-59.2	176.6	0	0	0	107.5	V2 K3 L4 D5 L25 F31 F32	V2-L27 HydrophobicContact CG1-CB 4.39Å; V2-L27 HydrophobicContact CG1-CD1 3.8Å; V2-L27 HydrophobicContact CG1-CG 3.68Å; K3-L27 PolarHBondContact O-N 3.2Å; L4-L27 CarbonylContact C-O 3.44Å; D5-L27 PolarHBondContact N-O 3.27Å; L25-L27 HydrophobicContact CD1-CD2 4.49Å; L25-L27 HydrophobicContact CD2-CD2 4.26Å; L25-L27 HydrophobicContact CG-CD2 4.3Å; L27-F31 HydrophobicContact CB-CD1 4.31Å; L27-F31 HydrophobicContact CB-CG 4.46Å; L27-F31 HydrophobicContact CD1-CD1 3.99Å; L27-F31 HydrophobicContact CD1-CE1 3.78Å; L27-F31 HydrophobicContact CD1-CZ 4.23Å; L27-F31 HydrophobicContact CD2-CB 4.48Å; L27-F31 HydrophobicContact CD2-CD1 4.05Å; L27-F31 HydrophobicContact CD2-CD2 3.82Å; L27-F31 HydrophobicContact CD2-CE1 4.17Å; L27-F31 HydrophobicContact CD2-CE2 3.94Å; L27-F31 HydrophobicContact CD2-CG 3.86Å; L27-F31 HydrophobicContact CD2-CZ 4.1Å; L27-F31 HydrophobicContact CG-CD1 4.33Å; L27-F31 HydrophobicContact CG-CE1 4.48Å; L27-F32 HydrophobicContact CB-CE2 4.25Å
28	D	75.8	Confident	66	Low	20 Å²	20	80.4 Å²	80.4	11%	0.107	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	178.1	173.9	56.2	41.9	0	0	0	111	D5 T30 F31 F32	D5-D28 HydrophobicContact CB-CB 4.25Å; D5-D28 WeakPolarHBondContact O-CA 3.38Å; D28-T30 VanDerWaalsContact CG-OG1 3.32Å; D28-T30 PolarHBondContact O-N 3.17Å; D28-T30 VanDerWaalsContact OD1-CB 3.23Å; D28-T30 WeakPolarHBondContact OD1-CB 3.16Å; D28-T30 PolarHBondContact OD1-N 3.36Å; D28-T30 VanDerWaalsContact OD1-N 3.17Å; D28-T30 PolarHBondContact OD1-OG1 3.43Å; D28-F31 PolarHBondContact O-N 3.19Å; D28-F32 WeakPolarHBondContact O-CD2 3.22Å
29	K	70.9	Confident	67.2	Low	83 Å²	83	81.9 Å²	81.9	36%	0.361	42%	0.421	S	S	.	.	H	α-helix	trans	-56.8	-35.7	179.8	-166.7	-175.2	175.2	-82.3	0	112.5	D5 F31 F32 D33 I40	D5-K29 PolarHBondContact O-N 2.65Å; K29-F31 PolarHBondContact O-N 2.93Å; K29-F32 PolarHBondContact O-N 3.38Å; K29-D33 IonicContact NZ-OD1 2.68Å; K29-D33 PolarHBondContact NZ-OD1 2.87Å; K29-D33 IonicContact NZ-OD2 2.63Å; K29-D33 PolarHBondContact NZ-OD2 3.17Å; K29-D33 PolarHBondContact O-N 3.38Å; K29-I40 HydrophobicContact CG-CD1 4Å
30	T	72.7	Confident	68.4	Low	58 Å²	58	78 Å²	78	36%	0.356	41%	0.405	S	S	.	.	H	α-helix	trans	-57	-35.6	-177.8	-7.5	0	0	0	0	112.6	D28 F32 D33 E34	D28-T30 VanDerWaalsContact CG-OG1 3.32Å; D28-T30 PolarHBondContact O-N 3.17Å; D28-T30 VanDerWaalsContact OD1-CB 3.23Å; D28-T30 WeakPolarHBondContact OD1-CB 3.16Å; D28-T30 PolarHBondContact OD1-N 3.36Å; D28-T30 VanDerWaalsContact OD1-N 3.17Å; D28-T30 PolarHBondContact OD1-OG1 3.43Å; T30-F32 VanDerWaalsContact C-N 3.34Å; T30-F32 PolarHBondContact O-N 2.98Å; T30-D33 PolarHBondContact O-N 2.85Å; T30-E34 WeakPolarHBondContact O-CB 3.49Å; T30-E34 VanDerWaalsContact O-CG 3.31Å; T30-E34 WeakPolarHBondContact O-CG 3.49Å; T30-E34 PolarHBondContact O-N 3.35Å
31	F	76.2	Confident	69.6	Low	50 Å²	50	76 Å²	76	22%	0.219	39%	0.392	C	S	.	.	H	α-helix	trans	-61.1	-38.9	173.3	177.6	-97.1	0	0	0	113.5	L27 D28 K29 M35	L27-F31 HydrophobicContact CB-CD1 4.31Å; L27-F31 HydrophobicContact CB-CG 4.46Å; L27-F31 HydrophobicContact CD1-CD1 3.99Å; L27-F31 HydrophobicContact CD1-CE1 3.78Å; L27-F31 HydrophobicContact CD1-CZ 4.23Å; L27-F31 HydrophobicContact CD2-CB 4.48Å; L27-F31 HydrophobicContact CD2-CD1 4.05Å; L27-F31 HydrophobicContact CD2-CD2 3.82Å; L27-F31 HydrophobicContact CD2-CE1 4.17Å; L27-F31 HydrophobicContact CD2-CE2 3.94Å; L27-F31 HydrophobicContact CD2-CG 3.86Å; L27-F31 HydrophobicContact CD2-CZ 4.1Å; L27-F31 HydrophobicContact CG-CD1 4.33Å; L27-F31 HydrophobicContact CG-CE1 4.48Å; D28-F31 PolarHBondContact O-N 3.19Å; K29-F31 PolarHBondContact O-N 2.93Å; F31-M35 HydrophobicContact CD1-SD 4.45Å; F31-M35 HydrophobicContact CE1-CE 3.87Å; F31-M35 HydrophobicContact CE1-SD 3.74Å; F31-M35 HydrophobicContact CE2-CE 3.83Å; F31-M35 HydrophobicContact CZ-CE 3.31Å; F31-M35 HydrophobicContact CZ-SD 3.86Å; F31-M35 WeakPolarHBondContact O-CG 3.48Å; F31-M35 PolarHBondContact O-N 2.98Å; F31-M35 VanDerWaalsContact O-N 3.13Å
32	F	76.2	Confident	70.9	Confident	9 Å²	9	78.8 Å²	78.8	4%	0.039	40%	0.398	C	S	.	.	H	α-helix	trans	-77.7	-34.5	178.4	-62.8	-85.3	0	0	0	111.6	L4 L6 L27 D28 K29 T30 M35 K36 I37 I40 L44	L4-F32 HydrophobicContact CD2-CE2 4.07Å; L4-F32 HydrophobicContact CD2-CZ 3.83Å; L6-F32 HydrophobicContact CD2-CD2 4.1Å; L6-F32 HydrophobicContact CD2-CE2 3.93Å; L27-F32 HydrophobicContact CB-CE2 4.25Å; D28-F32 WeakPolarHBondContact O-CD2 3.22Å; K29-F32 PolarHBondContact O-N 3.38Å; T30-F32 VanDerWaalsContact C-N 3.34Å; T30-F32 PolarHBondContact O-N 2.98Å; F32-M35 CarbonylContact O-C 3.59Å; F32-M35 PolarHBondContact O-N 2.89Å; F32-K36 PolarHBondContact O-N 2.99Å; F32-I37 HydrophobicContact CB-CB 4.38Å; F32-I37 HydrophobicContact CD1-CD1 4.18Å; F32-I37 PolarHBondContact O-N 2.71Å; F32-I40 HydrophobicContact CB-CD1 3.52Å; F32-I40 HydrophobicContact CB-CG1 3.73Å; F32-I40 HydrophobicContact CD1-CD1 4.5Å; F32-I40 HydrophobicContact CD1-CG1 4.21Å; F32-I40 HydrophobicContact CD1-CG2 3.83Å; F32-I40 HydrophobicContact CD2-CD1 3.98Å; F32-I40 HydrophobicContact CD2-CG2 4.25Å; F32-I40 HydrophobicContact CE1-CG2 3.88Å; F32-I40 HydrophobicContact CE2-CG2 4.3Å; F32-I40 HydrophobicContact CG-CD1 3.76Å; F32-I40 HydrophobicContact CG-CG1 3.92Å; F32-I40 HydrophobicContact CG-CG2 4.02Å; F32-I40 HydrophobicContact CZ-CG2 4.12Å; F32-L44 HydrophobicContact CE1-CD2 4.32Å
33	D	74.3	Confident	72.3	Confident	71 Å²	71	73.1 Å²	73.1	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-42.5	171.6	-64.8	-32.1	0	0	0	110.9	K29 T30 M35 K36	K29-D33 IonicContact NZ-OD1 2.68Å; K29-D33 PolarHBondContact NZ-OD1 2.87Å; K29-D33 IonicContact NZ-OD2 2.63Å; K29-D33 PolarHBondContact NZ-OD2 3.17Å; K29-D33 PolarHBondContact O-N 3.38Å; T30-D33 PolarHBondContact O-N 2.85Å; D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 2.93Å; D33-K36 PolarHBondContact O-N 2.87Å
34	E	76.4	Confident	73.9	Confident	123 Å²	123	65.1 Å²	65.1	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-58.6	-39.7	171.2	-79.4	173.9	176.1	0	0	112.3	S17 T30 K36	S17-E34 WeakPolarHBondContact CB-OE1 3.13Å; S17-E34 WeakPolarHBondContact CB-OE2 2.99Å; S17-E34 PolarHBondContact OG-OE1 3.25Å; S17-E34 PolarHBondContact OG-OE2 2.99Å; T30-E34 WeakPolarHBondContact O-CB 3.49Å; T30-E34 VanDerWaalsContact O-CG 3.31Å; T30-E34 WeakPolarHBondContact O-CG 3.49Å; T30-E34 PolarHBondContact O-N 3.35Å; E34-K36 VanDerWaalsContact C-N 3.28Å; E34-K36 PolarHBondContact O-N 2.81Å
35	M	75	Confident	74.8	Confident	110 Å²	110	66 Å²	66	54%	0.542	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.6	175.4	-71.9	-166.3	169.2	0	0	114.4	F31 F32 D33 I37	F31-M35 HydrophobicContact CD1-SD 4.45Å; F31-M35 HydrophobicContact CE1-CE 3.87Å; F31-M35 HydrophobicContact CE1-SD 3.74Å; F31-M35 HydrophobicContact CE2-CE 3.83Å; F31-M35 HydrophobicContact CZ-CE 3.31Å; F31-M35 HydrophobicContact CZ-SD 3.86Å; F31-M35 WeakPolarHBondContact O-CG 3.48Å; F31-M35 PolarHBondContact O-N 2.98Å; F31-M35 VanDerWaalsContact O-N 3.13Å; F32-M35 CarbonylContact O-C 3.59Å; F32-M35 PolarHBondContact O-N 2.89Å; D33-M35 VanDerWaalsContact C-N 3.31Å; D33-M35 PolarHBondContact O-N 2.93Å; M35-I37 HydrophobicContact CB-CD1 3.67Å; M35-I37 HydrophobicContact CB-CG1 3.83Å; M35-I37 HydrophobicContact SD-CD1 4.16Å
36	K	77.3	Confident	75	Confident	178 Å²	178	69.6 Å²	69.6	77%	0.774	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	41.9	-175.6	-50.9	179.5	-177.4	-180	0	113.3	F32 D33 E34	F32-K36 PolarHBondContact O-N 2.99Å; D33-K36 PolarHBondContact O-N 2.87Å; E34-K36 VanDerWaalsContact C-N 3.28Å; E34-K36 PolarHBondContact O-N 2.81Å
37	I	74.8	Confident	75	Confident	40 Å²	40	72.4 Å²	72.4	21%	0.205	35%	0.351	C	S	.	.			trans	-101	83.4	178.8	-57.8	172.4	0	0	0	108.6	F32 M35 N39 I40 C43	F32-I37 HydrophobicContact CB-CB 4.38Å; F32-I37 HydrophobicContact CD1-CD1 4.18Å; F32-I37 PolarHBondContact O-N 2.71Å; M35-I37 HydrophobicContact CB-CD1 3.67Å; M35-I37 HydrophobicContact CB-CG1 3.83Å; M35-I37 HydrophobicContact SD-CD1 4.16Å; I37-N39 VanDerWaalsContact C-N 3.28Å; I37-N39 PolarHBondContact O-N 3.07Å; I37-I40 HydrophobicContact CG2-CG1 4.48Å; I37-I40 WeakPolarHBondContact O-CG1 3.27Å; I37-C43 HydrophobicContact CG2-CB 3.65Å
38	D	68.1	Low	75	Confident	161 Å²	161	74.2 Å²	74.2	86%	0.861	36%	0.359	S	S	*	.	S	Bend	trans	-61.6	-35.2	-177	-60	-39.9	0	0	0	112.8
39	N	79.3	Confident	74.2	Confident	83 Å²	83	77.7 Å²	77.7	44%	0.444	39%	0.385	S	S	.	.			trans	-111.9	83.1	179.2	-170.2	-16.5	0	0	0	110.7	I37 D42 C43	I37-N39 VanDerWaalsContact C-N 3.28Å; I37-N39 PolarHBondContact O-N 3.07Å; N39-D42 PolarHBondContact ND2-OD2 2.92Å; N39-D42 WeakPolarHBondContact OD1-CB 3.5Å; N39-D42 PolarHBondContact OD1-N 3.11Å; N39-D42 VanDerWaalsContact OD1-N 3.1Å; N39-C43 WeakPolarHBondContact O-CB 3.3Å; N39-C43 PolarHBondContact O-N 3.11Å; N39-C43 VanDerWaalsContact O-N 3.15Å
40	I	80.1	Confident	73.8	Confident	19 Å²	19	77.5 Å²	77.5	10%	0.097	39%	0.387	C	S	.	.	H	α-helix	trans	-63	-43.7	-177.1	-55.7	175.1	0	0	0	111	L6 K29 F32 I37 C43 L44	L6-I40 HydrophobicContact CD1-CG2 4.13Å; L6-I40 HydrophobicContact CD2-CD1 4.04Å; L6-I40 HydrophobicContact CD2-CG2 4.06Å; K29-I40 HydrophobicContact CG-CD1 4Å; F32-I40 HydrophobicContact CB-CD1 3.52Å; F32-I40 HydrophobicContact CB-CG1 3.73Å; F32-I40 HydrophobicContact CD1-CD1 4.5Å; F32-I40 HydrophobicContact CD1-CG1 4.21Å; F32-I40 HydrophobicContact CD1-CG2 3.83Å; F32-I40 HydrophobicContact CD2-CD1 3.98Å; F32-I40 HydrophobicContact CD2-CG2 4.25Å; F32-I40 HydrophobicContact CE1-CG2 3.88Å; F32-I40 HydrophobicContact CE2-CG2 4.3Å; F32-I40 HydrophobicContact CG-CD1 3.76Å; F32-I40 HydrophobicContact CG-CG1 3.92Å; F32-I40 HydrophobicContact CG-CG2 4.02Å; F32-I40 HydrophobicContact CZ-CG2 4.12Å; I37-I40 HydrophobicContact CG2-CG1 4.48Å; I37-I40 WeakPolarHBondContact O-CG1 3.27Å; I40-C43 WeakPolarHBondContact O-CB 3.06Å; I40-C43 PolarHBondContact O-N 3.19Å; I40-L44 HydrophobicContact CG2-CD1 3.97Å; I40-L44 HydrophobicContact CG2-CG 4.19Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.42Å; I40-L44 PolarHBondContact O-N 2.69Å
41	E	78.8	Confident	72.9	Confident	100 Å²	100	76.7 Å²	76.7	47%	0.467	39%	0.39	S	S	.	.	H	α-helix	trans	-67	-43.5	-175.4	-177.4	162	-171.2	0	0	112	C43 L44 N45 Y55 P57	E41-C43 VanDerWaalsContact C-N 3.33Å; E41-C43 PolarHBondContact O-N 3.15Å; E41-L44 PolarHBondContact O-N 3.17Å; E41-N45 WeakPolarHBondContact CG-ND2 3.41Å; E41-N45 VanDerWaalsContact O-CB 3.31Å; E41-N45 WeakPolarHBondContact O-CB 3.46Å; E41-N45 PolarHBondContact O-N 3.35Å; E41-N45 PolarHBondContact O-ND2 2.94Å; E41-N45 VanDerWaalsContact O-ND2 3.14Å; E41-Y55 HydrophobicContact CG-CE1 4.44Å; E41-P57 WeakPolarHBondContact OE1-CB 3.36Å
42	D	75.6	Confident	72.3	Confident	98 Å²	98	79.9 Å²	79.9	52%	0.524	41%	0.406	S	S	.	.	H	α-helix	trans	-67.4	-34	175.2	-74.3	-19.1	0	0	0	112.4	N39 N45 Y46	N39-D42 PolarHBondContact ND2-OD2 2.92Å; N39-D42 WeakPolarHBondContact OD1-CB 3.5Å; N39-D42 PolarHBondContact OD1-N 3.11Å; N39-D42 VanDerWaalsContact OD1-N 3.1Å; D42-N45 PolarHBondContact O-N 3.08Å; D42-Y46 VanDerWaalsContact O-CB 3.27Å; D42-Y46 WeakPolarHBondContact O-CB 3.33Å; D42-Y46 PolarHBondContact O-N 2.69Å
43	C	79.2	Confident	72.1	Confident	28 Å²	28	80.7 Å²	80.7	19%	0.189	41%	0.409	C	S	.	.	H	α-helix	trans	-61.3	-49.1	172.2	-177.1	0	0	0	0	111.4	I37 N39 I40 E41 N45 Y46 Y47	I37-C43 HydrophobicContact CG2-CB 3.65Å; N39-C43 WeakPolarHBondContact O-CB 3.3Å; N39-C43 PolarHBondContact O-N 3.11Å; N39-C43 VanDerWaalsContact O-N 3.15Å; I40-C43 WeakPolarHBondContact O-CB 3.06Å; I40-C43 PolarHBondContact O-N 3.19Å; E41-C43 VanDerWaalsContact C-N 3.33Å; E41-C43 PolarHBondContact O-N 3.15Å; C43-N45 PolarHBondContact O-N 3.1Å; C43-Y46 PolarHBondContact O-N 2.86Å; C43-Y47 VanDerWaalsContact O-CD2 3.24Å; C43-Y47 WeakPolarHBondContact O-CD2 3.14Å; C43-Y47 PolarHBondContact O-N 3.07Å; C43-Y47 VanDerWaalsContact O-N 3.07Å
44	L	80.4	Confident	71.8	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.021	40%	0.396	C	S	.	.	H	α-helix	trans	-65.7	-37.8	177.7	-64.1	-179.5	0	0	0	112.2	L4 F32 I40 E41 H48 F53 Y55 L66	L4-L44 HydrophobicContact CD1-CD1 3.64Å; L4-L44 HydrophobicContact CD2-CD1 4.26Å; F32-L44 HydrophobicContact CE1-CD2 4.32Å; I40-L44 HydrophobicContact CG2-CD1 3.97Å; I40-L44 HydrophobicContact CG2-CG 4.19Å; I40-L44 VanDerWaalsContact O-CG 3.29Å; I40-L44 WeakPolarHBondContact O-CG 3.42Å; I40-L44 PolarHBondContact O-N 2.69Å; E41-L44 PolarHBondContact O-N 3.17Å; L44-H48 VanDerWaalsContact O-CB 3.23Å; L44-H48 WeakPolarHBondContact O-CB 3.38Å; L44-H48 PolarHBondContact O-N 2.93Å; L44-F53 HydrophobicContact CB-CE2 4.36Å; L44-F53 HydrophobicContact CD2-CE2 3.9Å; L44-F53 HydrophobicContact CD2-CZ 3.58Å; L44-F53 WeakPolarHBondContact O-CE2 3.41Å; L44-Y55 HydrophobicContact CB-CD1 3.49Å; L44-Y55 VanDerWaalsContact CB-CD1 3.49Å; L44-Y55 HydrophobicContact CB-CD2 4.5Å; L44-Y55 HydrophobicContact CB-CE1 3.67Å; L44-Y55 HydrophobicContact CB-CG 3.94Å; L44-Y55 HydrophobicContact CD1-CD1 4.4Å; L44-Y55 HydrophobicContact CD1-CD2 4.17Å; L44-Y55 HydrophobicContact CD1-CE1 4.09Å; L44-Y55 HydrophobicContact CD1-CE2 3.83Å; L44-Y55 HydrophobicContact CD1-CG 4.44Å; L44-L66 HydrophobicContact CD1-CD2 4.27Å; L44-L66 HydrophobicContact CD2-CD1 3.82Å; L44-L66 HydrophobicContact CD2-CD2 3.91Å; L44-L66 HydrophobicContact CD2-CG 4.48Å
45	N	73.2	Confident	71.6	Confident	47 Å²	47	72.9 Å²	72.9	25%	0.251	37%	0.371	S	S	.	.	H	α-helix	trans	-67.8	-37.8	175.1	-73.8	-32.4	0	0	0	112.4	E41 D42 C43 H48 S49	E41-N45 WeakPolarHBondContact CG-ND2 3.41Å; E41-N45 VanDerWaalsContact O-CB 3.31Å; E41-N45 WeakPolarHBondContact O-CB 3.46Å; E41-N45 PolarHBondContact O-N 3.35Å; E41-N45 PolarHBondContact O-ND2 2.94Å; E41-N45 VanDerWaalsContact O-ND2 3.14Å; D42-N45 PolarHBondContact O-N 3.08Å; C43-N45 PolarHBondContact O-N 3.1Å; N45-H48 PolarHBondContact O-N 3.16Å; N45-S49 PolarHBondContact O-N 3.02Å; N45-S49 PolarHBondContact O-OG 3.48Å
46	Y	70.2	Confident	71.3	Confident	135 Å²	135	68.1 Å²	68.1	53%	0.529	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-56.7	173.4	172.7	-99.1	0	0	0	110.7	D42 C43 H48 S49 I50	D42-Y46 VanDerWaalsContact O-CB 3.27Å; D42-Y46 WeakPolarHBondContact O-CB 3.33Å; D42-Y46 PolarHBondContact O-N 2.69Å; C43-Y46 PolarHBondContact O-N 2.86Å; Y46-H48 PolarHBondContact O-N 2.98Å; Y46-S49 PolarHBondContact O-N 3.16Å; Y46-S49 PolarHBondContact O-OG 3.01Å; Y46-I50 HydrophobicContact CD1-CD1 4.41Å; Y46-I50 HydrophobicContact CE1-CD1 3.78Å; Y46-I50 HydrophobicContact CE2-CG2 4.33Å; Y46-I50 PolarHBondContact O-N 2.97Å; Y46-I50 VanDerWaalsContact O-N 3.13Å
47	Y	67.3	Low	70.8	Confident	85 Å²	85	61.4 Å²	61.4	33%	0.333	32%	0.322	S	S	.	.	H	α-helix	trans	-63	-27.2	179.4	-78.5	-66.7	0	0	0	113.6	C43 I50 G51 Q52 F53	C43-Y47 VanDerWaalsContact O-CD2 3.24Å; C43-Y47 WeakPolarHBondContact O-CD2 3.14Å; C43-Y47 PolarHBondContact O-N 3.07Å; C43-Y47 VanDerWaalsContact O-N 3.07Å; Y47-I50 HydrophobicContact CD1-CD1 4Å; Y47-I50 HydrophobicContact CE1-CD1 4.42Å; Y47-G51 PolarHBondContact O-N 2.77Å; Y47-Q52 HydrophobicContact CD1-CB 4.28Å; Y47-Q52 HydrophobicContact CD1-CG 4.42Å; Y47-Q52 VanDerWaalsContact CD1-OE1 3.26Å; Y47-Q52 VanDerWaalsContact CE1-OE1 3.32Å; Y47-Q52 PolarHBondContact O-N 2.87Å; Y47-F53 VanDerWaalsContact CB-CE1 3.42Å; Y47-F53 HydrophobicContact CD2-CE1 4.26Å; Y47-F53 HydrophobicContact CD2-CZ 4.19Å; Y47-F53 AromaticContact CG-CE1 3.87Å; Y47-F53 HydrophobicContact CG-CE1 3.87Å; Y47-F53 AromaticContact CG-CZ 3.97Å; Y47-F53 HydrophobicContact CG-CZ 3.97Å
48	H	74.2	Confident	70.3	Confident	56 Å²	56	69.2 Å²	69.2	26%	0.259	35%	0.354	S	S	.	.	H	α-helix	trans	-68.8	-46.5	169.6	177	34.6	0	0	0	112.8	L44 N45 Y46 I50 G51 F53 Y55	L44-H48 VanDerWaalsContact O-CB 3.23Å; L44-H48 WeakPolarHBondContact O-CB 3.38Å; L44-H48 PolarHBondContact O-N 2.93Å; N45-H48 PolarHBondContact O-N 3.16Å; Y46-H48 PolarHBondContact O-N 2.98Å; H48-I50 VanDerWaalsContact C-N 3.33Å; H48-I50 PolarHBondContact O-N 2.98Å; H48-G51 WeakPolarHBondContact O-CA 3.29Å; H48-G51 PolarHBondContact O-N 3.2Å; H48-F53 WeakPolarHBondContact CA-O 3.42Å; H48-Y55 PolarHBondContact CD2-O 2.74Å; H48-Y55 PolarHBondContact NE2-O 3.12Å
49	S	58.4	Low	69.8	Low	94 Å²	94	63.4 Å²	63.4	66%	0.657	32%	0.321	S	S	*	.	H	α-helix	trans	-66.9	-31.2	-178.1	66.7	0	0	0	0	113.4	N45 Y46 G51	N45-S49 PolarHBondContact O-N 3.02Å; N45-S49 PolarHBondContact O-OG 3.48Å; Y46-S49 PolarHBondContact O-N 3.16Å; Y46-S49 PolarHBondContact O-OG 3.01Å; S49-G51 VanDerWaalsContact C-N 3.29Å
50	I	61.7	Low	68.5	Low	79 Å²	79	66.9 Å²	66.9	41%	0.405	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	2.6	170.8	68	170.9	0	0	0	113.8	Y46 Y47 H48 Q52	Y46-I50 HydrophobicContact CD1-CD1 4.41Å; Y46-I50 HydrophobicContact CE1-CD1 3.78Å; Y46-I50 HydrophobicContact CE2-CG2 4.33Å; Y46-I50 PolarHBondContact O-N 2.97Å; Y46-I50 VanDerWaalsContact O-N 3.13Å; Y47-I50 HydrophobicContact CD1-CD1 4Å; Y47-I50 HydrophobicContact CE1-CD1 4.42Å; H48-I50 VanDerWaalsContact C-N 3.33Å; H48-I50 PolarHBondContact O-N 2.98Å; I50-Q52 HydrophobicContact CD1-CG 3.98Å; I50-Q52 HydrophobicContact CG1-CG 4.1Å; I50-Q52 PolarHBondContact O-N 3.37Å
51	G	53.9	Low	67.1	Low	41 Å²	41	70.4 Å²	70.4	42%	0.423	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	21.6	172.1	0	0	0	0	0	116.2	Y47 H48 S49 P70	Y47-G51 PolarHBondContact O-N 2.77Å; H48-G51 WeakPolarHBondContact O-CA 3.29Å; H48-G51 PolarHBondContact O-N 3.2Å; S49-G51 VanDerWaalsContact C-N 3.29Å; G51-P70 WeakPolarHBondContact O-CG 3.1Å
52	Q	63.2	Low	66.3	Low	117 Å²	117	66 Å²	66	55%	0.547	33%	0.325	S	S	.	.	S	Bend	trans	-74.4	-35.9	175.3	-73.7	-170.5	15.4	0	0	112.2	Y47 I50	Y47-Q52 HydrophobicContact CD1-CB 4.28Å; Y47-Q52 HydrophobicContact CD1-CG 4.42Å; Y47-Q52 VanDerWaalsContact CD1-OE1 3.26Å; Y47-Q52 VanDerWaalsContact CE1-OE1 3.32Å; Y47-Q52 PolarHBondContact O-N 2.87Å; I50-Q52 HydrophobicContact CD1-CG 3.98Å; I50-Q52 HydrophobicContact CG1-CG 4.1Å; I50-Q52 PolarHBondContact O-N 3.37Å
53	F	72.3	Confident	65.8	Low	25 Å²	25	65.5 Å²	65.5	11%	0.11	32%	0.318	C	S	.	.	S	Bend	trans	-142.3	172	167.2	52.3	-112.2	0	0	0	110.1	L44 Y47 H48 L66 I67 L68	L44-F53 HydrophobicContact CB-CE2 4.36Å; L44-F53 HydrophobicContact CD2-CE2 3.9Å; L44-F53 HydrophobicContact CD2-CZ 3.58Å; L44-F53 WeakPolarHBondContact O-CE2 3.41Å; Y47-F53 VanDerWaalsContact CB-CE1 3.42Å; Y47-F53 HydrophobicContact CD2-CE1 4.26Å; Y47-F53 HydrophobicContact CD2-CZ 4.19Å; Y47-F53 AromaticContact CG-CE1 3.87Å; Y47-F53 HydrophobicContact CG-CE1 3.87Å; Y47-F53 AromaticContact CG-CZ 3.97Å; Y47-F53 HydrophobicContact CG-CZ 3.97Å; H48-F53 WeakPolarHBondContact CA-O 3.42Å; F53-L66 HydrophobicContact CD2-CD2 4.01Å; F53-L66 HydrophobicContact CE2-CD1 4.43Å; F53-L66 HydrophobicContact CE2-CD2 3.82Å; F53-L66 HydrophobicContact CZ-CD1 4.36Å; F53-L66 HydrophobicContact CZ-CD2 4.49Å; F53-I67 WeakPolarHBondContact CA-O 3.47Å; F53-I67 WeakPolarHBondContact CB-O 3.16Å; F53-L68 HydrophobicContact CB-CD2 4.35Å; F53-L68 HydrophobicContact CD1-CD2 4.47Å
54	L	67.6	Low	65.4	Low	18 Å²	18	67 Å²	67	9%	0.094	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-106.7	136.7	169.5	-47	173	0	0	0	110.4	F56 I67 P70 F73	L54-F56 HydrophobicContact CB-CD2 4.47Å; L54-F56 HydrophobicContact CB-CE2 3.48Å; L54-F56 VanDerWaalsContact CB-CE2 3.48Å; L54-F56 HydrophobicContact CB-CZ 3.67Å; L54-F56 HydrophobicContact CD1-CE2 4.39Å; L54-F56 HydrophobicContact CD1-CZ 4.09Å; L54-F56 HydrophobicContact CG-CZ 4.39Å; L54-I67 HydrophobicContact CB-CB 4Å; L54-I67 HydrophobicContact CB-CD1 4.47Å; L54-I67 HydrophobicContact CB-CG1 4.34Å; L54-I67 PolarHBondContact N-O 2.95Å; L54-I67 PolarHBondContact O-N 3.1Å; L54-P70 HydrophobicContact CD1-CB 4.34Å; L54-P70 HydrophobicContact CD2-CB 4.08Å; L54-P70 HydrophobicContact CD2-CG 4.25Å; L54-P70 HydrophobicContact CG-CB 4Å; L54-P70 HydrophobicContact CG-CG 4.07Å; L54-F73 HydrophobicContact CD1-CB 4.18Å; L54-F73 HydrophobicContact CD1-CD1 3.37Å; L54-F73 HydrophobicContact CD1-CE1 3.88Å; L54-F73 HydrophobicContact CD1-CG 3.85Å
55	Y	73.2	Confident	64.9	Low	12 Å²	12	67.8 Å²	67.8	5%	0.047	33%	0.327	C	S	.	.			trans	-139	134.9	178.7	173.7	-122.7	0	0	0	108.2	L4 E41 L44 H48 P57 K63 L66	L4-Y55 HydrophobicContact CD1-CD2 4.02Å; L4-Y55 HydrophobicContact CD1-CE2 3.57Å; E41-Y55 HydrophobicContact CG-CE1 4.44Å; L44-Y55 HydrophobicContact CB-CD1 3.49Å; L44-Y55 VanDerWaalsContact CB-CD1 3.49Å; L44-Y55 HydrophobicContact CB-CD2 4.5Å; L44-Y55 HydrophobicContact CB-CE1 3.67Å; L44-Y55 HydrophobicContact CB-CG 3.94Å; L44-Y55 HydrophobicContact CD1-CD1 4.4Å; L44-Y55 HydrophobicContact CD1-CD2 4.17Å; L44-Y55 HydrophobicContact CD1-CE1 4.09Å; L44-Y55 HydrophobicContact CD1-CE2 3.83Å; L44-Y55 HydrophobicContact CD1-CG 4.44Å; H48-Y55 PolarHBondContact CD2-O 2.74Å; H48-Y55 PolarHBondContact NE2-O 3.12Å; Y55-P57 HydrophobicContact CD1-CG 4.19Å; Y55-P57 HydrophobicContact CE1-CB 3.77Å; Y55-P57 HydrophobicContact CE1-CG 3.8Å; Y55-K63 WeakPolarHBondContact CE2-O 3.4Å; Y55-L66 HydrophobicContact CD2-CD2 3.63Å; Y55-L66 HydrophobicContact CG-CD2 3.98Å
56	F	69.5	Low	64.8	Low	11 Å²	11	65.9 Å²	65.9	5%	0.048	32%	0.317	C	S	.	.			trans	-130.3	70.9	-170.6	-60.1	-84.5	0	0	0	111.5	L54 K58 H59 L62 K63 I67 F238	L54-F56 HydrophobicContact CB-CD2 4.47Å; L54-F56 HydrophobicContact CB-CE2 3.48Å; L54-F56 VanDerWaalsContact CB-CE2 3.48Å; L54-F56 HydrophobicContact CB-CZ 3.67Å; L54-F56 HydrophobicContact CD1-CE2 4.39Å; L54-F56 HydrophobicContact CD1-CZ 4.09Å; L54-F56 HydrophobicContact CG-CZ 4.39Å; F56-K58 PolarHBondContact O-N 2.73Å; F56-K58 VanDerWaalsContact O-N 3.13Å; F56-H59 HydrophobicContact CB-CB 3.66Å; F56-H59 PolarHBondContact O-N 2.61Å; F56-L62 HydrophobicContact CB-CB 3.88Å; F56-L62 HydrophobicContact CD2-CB 3.98Å; F56-L62 HydrophobicContact CD2-CD1 3.9Å; F56-L62 HydrophobicContact CE2-CD1 4.28Å; F56-L62 HydrophobicContact CG-CB 4.28Å; F56-L62 HydrophobicContact CG-CD1 4.41Å; F56-K63 VanDerWaalsContact O-CA 3.23Å; F56-K63 WeakPolarHBondContact O-CA 3.32Å; F56-K63 PolarHBondContact O-N 3.27Å; F56-I67 HydrophobicContact CE2-CD1 3.9Å; F56-F238 HydrophobicContact CD1-CZ 4.35Å; F56-F238 HydrophobicContact CE1-CD1 4.22Å; F56-F238 HydrophobicContact CE1-CD2 4.37Å; F56-F238 AromaticContact CE1-CE1 3.57Å; F56-F238 HydrophobicContact CE1-CE1 3.57Å; F56-F238 AromaticContact CE1-CE2 3.76Å; F56-F238 HydrophobicContact CE1-CE2 3.76Å; F56-F238 AromaticContact CE1-CZ 3.3Å; F56-F238 HydrophobicContact CE1-CZ 3.3Å; F56-F238 HydrophobicContact CE2-CZ 4.16Å; F56-F238 HydrophobicContact CZ-CD1 4.43Å; F56-F238 AromaticContact CZ-CE1 3.42Å; F56-F238 HydrophobicContact CZ-CE1 3.42Å; F56-F238 VanDerWaalsContact CZ-CE1 3.42Å; F56-F238 HydrophobicContact CZ-CE2 4.08Å; F56-F238 AromaticContact CZ-CZ 3.19Å; F56-F238 HydrophobicContact CZ-CZ 3.19Å
57	P	66.4	Low	64.7	Low	37 Å²	37	59.5 Å²	59.5	24%	0.24	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-33.1	-171.3	21.2	-31.7	0	0	0	113	E41 Y55 K63	E41-P57 WeakPolarHBondContact OE1-CB 3.36Å; Y55-P57 HydrophobicContact CD1-CG 4.19Å; Y55-P57 HydrophobicContact CE1-CB 3.77Å; Y55-P57 HydrophobicContact CE1-CG 3.8Å; P57-K63 VanDerWaalsContact O-CB 3.25Å; P57-K63 WeakPolarHBondContact O-CB 3.42Å
58	K	63.7	Low	64.7	Low	204 Å²	204	59.4 Å²	59.4	89%	0.887	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-13.7	178.6	-62.5	177.3	-177.2	174	0	113.8	F56	F56-K58 PolarHBondContact O-N 2.73Å; F56-K58 VanDerWaalsContact O-N 3.13Å
59	H	58.7	Low	64.3	Low	38 Å²	38	62 Å²	62	18%	0.176	31%	0.309	C	S	.	.	S	Bend	trans	-89.5	116.2	-174.5	-177.1	-102.7	0	0	0	111.9	F56 Y61 L62 K63	F56-H59 HydrophobicContact CB-CB 3.66Å; F56-H59 PolarHBondContact O-N 2.61Å; H59-Y61 PolarHBondContact O-N 3.29Å; H59-L62 HydrophobicContact CB-CB 4.26Å; H59-L62 VanDerWaalsContact ND1-CB 3.3Å; H59-L62 WeakPolarHBondContact ND1-CB 3.01Å; H59-L62 WeakPolarHBondContact ND1-CG 3.22Å; H59-L62 PolarHBondContact ND1-N 3.15Å; H59-L62 VanDerWaalsContact ND1-N 3.2Å; H59-L62 PolarHBondContact O-N 2.95Å; H59-K63 PolarHBondContact O-N 3.33Å
60	K	50.5	Low	64.5	Low	157 Å²	157	58.3 Å²	58.3	68%	0.683	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.3	-29.6	-173.9	-176.4	175.4	179.3	-178.9	0	116.4
61	Y	51.6	Low	64.2	Low	92 Å²	92	57.8 Å²	57.8	36%	0.361	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-2.7	-176.5	-49.5	-78.6	0	0	0	114.7	H59 L139 P140	H59-Y61 PolarHBondContact O-N 3.29Å; Y61-L139 HydrophobicContact CD2-CD2 3.48Å; Y61-L139 VanDerWaalsContact CD2-CD2 3.48Å; Y61-L139 HydrophobicContact CE2-CD2 4.37Å; Y61-L139 HydrophobicContact CG-CD2 3.77Å; Y61-P140 VanDerWaalsContact O-CD 3.32Å; Y61-P140 WeakPolarHBondContact O-CD 3.46Å; Y61-P140 VanDerWaalsContact O-CG 3.24Å; Y61-P140 WeakPolarHBondContact O-CG 3.27Å
62	L	61.3	Low	64.2	Low	8 Å²	8	57.2 Å²	57.2	4%	0.042	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-9	-179.3	-71.1	172.3	0	0	0	113.9	M1 F56 H59 D64 Y65	M1-L62 HydrophobicContact CE-CD2 3.61Å; F56-L62 HydrophobicContact CB-CB 3.88Å; F56-L62 HydrophobicContact CD2-CB 3.98Å; F56-L62 HydrophobicContact CD2-CD1 3.9Å; F56-L62 HydrophobicContact CE2-CD1 4.28Å; F56-L62 HydrophobicContact CG-CB 4.28Å; F56-L62 HydrophobicContact CG-CD1 4.41Å; H59-L62 HydrophobicContact CB-CB 4.26Å; H59-L62 VanDerWaalsContact ND1-CB 3.3Å; H59-L62 WeakPolarHBondContact ND1-CB 3.01Å; H59-L62 WeakPolarHBondContact ND1-CG 3.22Å; H59-L62 PolarHBondContact ND1-N 3.15Å; H59-L62 VanDerWaalsContact ND1-N 3.2Å; H59-L62 PolarHBondContact O-N 2.95Å; L62-D64 PolarHBondContact O-N 2.78Å; L62-Y65 PolarHBondContact O-N 3.18Å
63	K	65.8	Low	64.1	Low	88 Å²	88	51.7 Å²	51.7	38%	0.383	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-25.2	173.7	66.8	170.8	-167	66.5	0	114.5	Y55 F56 P57 H59	Y55-K63 WeakPolarHBondContact CE2-O 3.4Å; F56-K63 VanDerWaalsContact O-CA 3.23Å; F56-K63 WeakPolarHBondContact O-CA 3.32Å; F56-K63 PolarHBondContact O-N 3.27Å; P57-K63 VanDerWaalsContact O-CB 3.25Å; P57-K63 WeakPolarHBondContact O-CB 3.42Å; H59-K63 PolarHBondContact O-N 3.33Å
64	D	71.1	Confident	63.4	Low	60 Å²	60	53.9 Å²	53.9	32%	0.321	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	17.3	-179.2	-51.2	-52.4	0	0	0	112.5	L4 L62	L4-D64 PolarHBondContact N-O 3.46Å; L62-D64 PolarHBondContact O-N 2.78Å
65	Y	69.7	Low	62.7	Low	19 Å²	19	55 Å²	55	8%	0.075	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	135.1	-172	-68.3	-97	0	0	0	113.3	M1 V2 L62 P140	M1-Y65 HydrophobicContact CB-CD1 4.48Å; M1-Y65 HydrophobicContact CE-CD1 3.91Å; M1-Y65 HydrophobicContact CE-CG 4.09Å; V2-Y65 CarbonylContact O-C 3.6Å; V2-Y65 VanDerWaalsContact O-CA 3.3Å; V2-Y65 WeakPolarHBondContact O-CA 3.43Å; L62-Y65 PolarHBondContact O-N 3.18Å; Y65-P140 HydrophobicContact CD2-CG 4Å; Y65-P140 HydrophobicContact CE1-CB 4.41Å; Y65-P140 HydrophobicContact CE1-CG 4.2Å; Y65-P140 HydrophobicContact CE2-CB 4.15Å; Y65-P140 HydrophobicContact CE2-CG 3.38Å; Y65-P140 VanDerWaalsContact CZ-CG 3.5Å; Y65-P140 WeakPolarHBondContact OH-CB 3.25Å
66	L	71.6	Confident	61.8	Low	7 Å²	7	54.4 Å²	54.4	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137.7	167.6	-58.7	-177.6	0	0	0	111.9	M1 V2 L4 L44 F53 Y55 L68	M1-L66 CarbonylContact C-O 3.58Å; M1-L66 VanDerWaalsContact CA-O 3.29Å; M1-L66 WeakPolarHBondContact CA-O 3.43Å; V2-L66 HydrophobicContact CB-CB 4.32Å; V2-L66 PolarHBondContact N-O 2.92Å; V2-L66 PolarHBondContact O-N 3.49Å; L4-L66 HydrophobicContact CD1-CD2 3.96Å; L4-L66 HydrophobicContact CD1-CG 4.07Å; L4-L66 HydrophobicContact CD2-CD1 4.03Å; L4-L66 HydrophobicContact CD2-CG 4.04Å; L4-L66 HydrophobicContact CG-CD2 4.5Å; L4-L66 HydrophobicContact CG-CG 4.07Å; L44-L66 HydrophobicContact CD1-CD2 4.27Å; L44-L66 HydrophobicContact CD2-CD1 3.82Å; L44-L66 HydrophobicContact CD2-CD2 3.91Å; L44-L66 HydrophobicContact CD2-CG 4.48Å; F53-L66 HydrophobicContact CD2-CD2 4.01Å; F53-L66 HydrophobicContact CE2-CD1 4.43Å; F53-L66 HydrophobicContact CE2-CD2 3.82Å; F53-L66 HydrophobicContact CZ-CD1 4.36Å; F53-L66 HydrophobicContact CZ-CD2 4.49Å; Y55-L66 HydrophobicContact CD2-CD2 3.63Å; Y55-L66 HydrophobicContact CG-CD2 3.98Å; L66-L68 HydrophobicContact CB-CD2 4.33Å
67	I	66.9	Low	61.2	Low	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-109.6	85.7	179.2	-44.2	-167.3	0	0	0	109.3	M1 F53 L54 F56 H69 F73 Y105	M1-I67 HydrophobicContact CE-CD1 4.32Å; M1-I67 HydrophobicContact CE-CG1 4.34Å; M1-I67 HydrophobicContact CG-CG1 4.35Å; F53-I67 WeakPolarHBondContact CA-O 3.47Å; F53-I67 WeakPolarHBondContact CB-O 3.16Å; L54-I67 HydrophobicContact CB-CB 4Å; L54-I67 HydrophobicContact CB-CD1 4.47Å; L54-I67 HydrophobicContact CB-CG1 4.34Å; L54-I67 PolarHBondContact N-O 2.95Å; L54-I67 PolarHBondContact O-N 3.1Å; F56-I67 HydrophobicContact CE2-CD1 3.9Å; I67-H69 PolarHBondContact O-N 3.18Å; I67-F73 HydrophobicContact CD1-CD2 3.42Å; I67-F73 VanDerWaalsContact CD1-CD2 3.42Å; I67-F73 HydrophobicContact CD1-CE2 3.34Å; I67-F73 HydrophobicContact CD1-CG 4.2Å; I67-F73 HydrophobicContact CD1-CZ 4.09Å; I67-F73 HydrophobicContact CG2-CB 3.88Å; I67-F73 HydrophobicContact CG2-CD2 3.93Å; I67-F73 HydrophobicContact CG2-CG 4.12Å; I67-Y105 WeakPolarHBondContact CG2-OH 3.21Å
68	L	67.8	Low	60.5	Low	84 Å²	84	54.4 Å²	54.4	44%	0.44	26%	0.262	S	S	.	.	S	Bend	trans	-62.7	-7.7	-175.3	-56	-173.8	0	0	0	115.9	V2 F53 L66	V2-L68 HydrophobicContact CG2-CD1 3.58Å; V2-L68 HydrophobicContact CG2-CD2 4.32Å; V2-L68 HydrophobicContact CG2-CG 3.9Å; F53-L68 HydrophobicContact CB-CD2 4.35Å; F53-L68 HydrophobicContact CD1-CD2 4.47Å; L66-L68 HydrophobicContact CB-CD2 4.33Å
69	H	65.6	Low	59.8	Low	111 Å²	111	44.7 Å²	44.7	51%	0.514	22%	0.22	S	C	.	.			trans	-131.1	76.1	179.2	-61	-38.1	0	0	0	110.6	I67 T71 V72 F73	I67-H69 PolarHBondContact O-N 3.18Å; H69-T71 PolarHBondContact O-N 3.48Å; H69-V72 HydrophobicContact CB-CB 4.46Å; H69-V72 HydrophobicContact CB-CG2 3.99Å; H69-V72 PolarHBondContact O-N 2.93Å; H69-V72 VanDerWaalsContact O-N 3.13Å; H69-F73 PolarHBondContact O-N 3.47Å
70	P	63.1	Low	59.4	Low	15 Å²	15	43.3 Å²	43.3	10%	0.097	21%	0.213	C	C	.	.	H	α-helix	trans	-51.9	-40.5	177.8	-28.4	37.4	0	0	0	112.5	G51 L54 V72 F73 L74	G51-P70 WeakPolarHBondContact O-CG 3.1Å; L54-P70 HydrophobicContact CD1-CB 4.34Å; L54-P70 HydrophobicContact CD2-CB 4.08Å; L54-P70 HydrophobicContact CD2-CG 4.25Å; L54-P70 HydrophobicContact CG-CB 4Å; L54-P70 HydrophobicContact CG-CG 4.07Å; P70-V72 VanDerWaalsContact C-N 3.31Å; P70-V72 PolarHBondContact O-N 3.01Å; P70-F73 PolarHBondContact O-N 2.99Å; P70-L74 WeakPolarHBondContact O-CB 3.47Å; P70-L74 VanDerWaalsContact O-CG 3.27Å; P70-L74 WeakPolarHBondContact O-CG 3.5Å; P70-L74 PolarHBondContact O-N 3.44Å
71	T	54.1	Low	59.2	Low	68 Å²	68	38.6 Å²	38.6	42%	0.417	20%	0.195	S	C	.	.	H	α-helix	trans	-54.8	-42.4	178.6	-35.9	0	0	0	0	113	H69 T75 F210	H69-T71 PolarHBondContact O-N 3.48Å; T71-T75 WeakPolarHBondContact O-CB 3.43Å; T71-T75 PolarHBondContact O-N 3.41Å; T71-T75 PolarHBondContact O-OG1 2.86Å; T71-F210 HydrophobicContact CG2-CD2 4.14Å; T71-F210 HydrophobicContact CG2-CE1 4.44Å; T71-F210 HydrophobicContact CG2-CE2 3.92Å; T71-F210 HydrophobicContact CG2-CG 4.48Å; T71-F210 HydrophobicContact CG2-CZ 4.08Å
72	V	54.3	Low	59.2	Low	29 Å²	29	35.4 Å²	35.4	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-79.9	-33.8	-177.3	-160	0	0	0	0	111	H69 P70 T75 I76 L102 Y105	H69-V72 HydrophobicContact CB-CB 4.46Å; H69-V72 HydrophobicContact CB-CG2 3.99Å; H69-V72 PolarHBondContact O-N 2.93Å; H69-V72 VanDerWaalsContact O-N 3.13Å; P70-V72 VanDerWaalsContact C-N 3.31Å; P70-V72 PolarHBondContact O-N 3.01Å; V72-T75 WeakPolarHBondContact O-CB 3.36Å; V72-T75 PolarHBondContact O-N 3.44Å; V72-I76 PolarHBondContact O-N 3.11Å; V72-L102 HydrophobicContact CG1-CD1 4.01Å; V72-Y105 HydrophobicContact CB-CD1 3.91Å; V72-Y105 HydrophobicContact CB-CD2 4.45Å; V72-Y105 HydrophobicContact CB-CE1 3.87Å; V72-Y105 HydrophobicContact CB-CE2 4.43Å; V72-Y105 HydrophobicContact CB-CG 4.19Å; V72-Y105 HydrophobicContact CG1-CD1 3.28Å; V72-Y105 HydrophobicContact CG1-CD2 4.21Å; V72-Y105 HydrophobicContact CG1-CE1 3.78Å; V72-Y105 HydrophobicContact CG1-CG 3.52Å
73	F	61.7	Low	58.6	Low	2 Å²	2	37.2 Å²	37.2	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-64.2	-44.9	171.4	-175.9	-85.3	0	0	0	112.2	L54 I67 H69 P70 T75 I76 I77 L138 F238	L54-F73 HydrophobicContact CD1-CB 4.18Å; L54-F73 HydrophobicContact CD1-CD1 3.37Å; L54-F73 HydrophobicContact CD1-CE1 3.88Å; L54-F73 HydrophobicContact CD1-CG 3.85Å; I67-F73 HydrophobicContact CD1-CD2 3.42Å; I67-F73 VanDerWaalsContact CD1-CD2 3.42Å; I67-F73 HydrophobicContact CD1-CE2 3.34Å; I67-F73 HydrophobicContact CD1-CG 4.2Å; I67-F73 HydrophobicContact CD1-CZ 4.09Å; I67-F73 HydrophobicContact CG2-CB 3.88Å; I67-F73 HydrophobicContact CG2-CD2 3.93Å; I67-F73 HydrophobicContact CG2-CG 4.12Å; H69-F73 PolarHBondContact O-N 3.47Å; P70-F73 PolarHBondContact O-N 2.99Å; F73-T75 VanDerWaalsContact C-N 3.29Å; F73-T75 PolarHBondContact O-N 2.86Å; F73-I76 WeakPolarHBondContact O-CB 3.47Å; F73-I76 PolarHBondContact O-N 3.1Å; F73-I76 VanDerWaalsContact O-N 3.15Å; F73-I77 HydrophobicContact CD1-CD1 3.96Å; F73-I77 HydrophobicContact CE1-CD1 3.42Å; F73-I77 VanDerWaalsContact CE1-CD1 3.42Å; F73-I77 HydrophobicContact CE1-CG1 4.21Å; F73-I77 HydrophobicContact CZ-CD1 4.28Å; F73-I77 PolarHBondContact O-N 2.84Å; F73-L138 HydrophobicContact CD2-CD2 3.94Å; F73-L138 HydrophobicContact CE2-CB 4.33Å; F73-L138 HydrophobicContact CE2-CD1 4.13Å; F73-L138 HydrophobicContact CE2-CD2 3.62Å; F73-L138 HydrophobicContact CE2-CG 4.23Å; F73-L138 HydrophobicContact CZ-CD1 3.92Å; F73-L138 HydrophobicContact CZ-CD2 4.25Å; F73-F238 HydrophobicContact CD1-CE1 4.44Å; F73-F238 AromaticContact CE1-CE1 3.53Å; F73-F238 HydrophobicContact CE1-CE1 3.53Å; F73-F238 AromaticContact CE1-CZ 3.41Å; F73-F238 HydrophobicContact CE1-CZ 3.41Å; F73-F238 VanDerWaalsContact CE1-CZ 3.41Å; F73-F238 HydrophobicContact CZ-CE1 4.24Å; F73-F238 AromaticContact CZ-CZ 3.65Å; F73-F238 HydrophobicContact CZ-CZ 3.65Å
74	L	57.7	Low	58	Low	70 Å²	70	40 Å²	40	37%	0.366	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-32.3	171.9	-69.8	170.2	0	0	0	111.8	P70 I77 N78	P70-L74 WeakPolarHBondContact O-CB 3.47Å; P70-L74 VanDerWaalsContact O-CG 3.27Å; P70-L74 WeakPolarHBondContact O-CG 3.5Å; P70-L74 PolarHBondContact O-N 3.44Å; L74-I77 PolarHBondContact O-N 3.47Å; L74-N78 VanDerWaalsContact O-CB 3.3Å; L74-N78 WeakPolarHBondContact O-CB 3.39Å; L74-N78 PolarHBondContact O-N 3.37Å
75	T	53.2	Low	57.2	Low	42 Å²	42	39.9 Å²	39.9	26%	0.258	21%	0.21	S	C	.	.	H	α-helix	trans	-68.2	-36	172.1	-55.7	0	0	0	0	111.6	T71 V72 F73 G79 L102	T71-T75 WeakPolarHBondContact O-CB 3.43Å; T71-T75 PolarHBondContact O-N 3.41Å; T71-T75 PolarHBondContact O-OG1 2.86Å; V72-T75 WeakPolarHBondContact O-CB 3.36Å; V72-T75 PolarHBondContact O-N 3.44Å; F73-T75 VanDerWaalsContact C-N 3.29Å; F73-T75 PolarHBondContact O-N 2.86Å; T75-G79 PolarHBondContact O-N 3.35Å; T75-L102 HydrophobicContact CG2-CD1 3.64Å; T75-L102 HydrophobicContact CG2-CD2 3.86Å; T75-L102 HydrophobicContact CG2-CG 4.38Å
76	I	54.4	Low	56.5	Low	0 Å²	0	39 Å²	39	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-50.2	168.6	-67.2	-176.7	0	0	0	110.1	V72 F73 N78 G79 I80 L102 Y105 L106 I109 L138	V72-I76 PolarHBondContact O-N 3.11Å; F73-I76 WeakPolarHBondContact O-CB 3.47Å; F73-I76 PolarHBondContact O-N 3.1Å; F73-I76 VanDerWaalsContact O-N 3.15Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 2.83Å; I76-G79 CarbonylContact O-C 3.56Å; I76-G79 WeakPolarHBondContact O-CA 3.5Å; I76-G79 PolarHBondContact O-N 3.39Å; I76-I80 HydrophobicContact CG2-CD1 3.96Å; I76-I80 HydrophobicContact CG2-CG1 4.23Å; I76-I80 WeakPolarHBondContact O-CG1 3.38Å; I76-I80 PolarHBondContact O-N 2.9Å; I76-L102 HydrophobicContact CG1-CD1 4.37Å; I76-Y105 HydrophobicContact CD1-CD1 3.63Å; I76-Y105 HydrophobicContact CD1-CE1 3.74Å; I76-Y105 HydrophobicContact CG1-CD1 4.28Å; I76-Y105 HydrophobicContact CG1-CE1 4.41Å; I76-L106 HydrophobicContact CD1-CD2 3.72Å; I76-L106 HydrophobicContact CD1-CG 4.32Å; I76-L106 HydrophobicContact CG1-CD2 3.9Å; I76-L106 HydrophobicContact CG1-CG 4.41Å; I76-I109 HydrophobicContact CD1-CD1 4.35Å; I76-L138 HydrophobicContact CB-CD2 4.34Å; I76-L138 HydrophobicContact CD1-CD2 4.31Å; I76-L138 HydrophobicContact CG2-CD2 3.79Å; I76-L138 HydrophobicContact CG2-CG 4.48Å
77	I	55	Low	55.6	Low	9 Å²	9	40 Å²	40	5%	0.046	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-48.2	178.1	-73.9	176.6	0	0	0	111.4	F73 L74 G79 I80 I81 L138 L233 F238	F73-I77 HydrophobicContact CD1-CD1 3.96Å; F73-I77 HydrophobicContact CE1-CD1 3.42Å; F73-I77 VanDerWaalsContact CE1-CD1 3.42Å; F73-I77 HydrophobicContact CE1-CG1 4.21Å; F73-I77 HydrophobicContact CZ-CD1 4.28Å; F73-I77 PolarHBondContact O-N 2.84Å; L74-I77 PolarHBondContact O-N 3.47Å; I77-G79 PolarHBondContact O-N 3.16Å; I77-I80 WeakPolarHBondContact O-CB 3.36Å; I77-I80 PolarHBondContact O-N 3.49Å; I77-I81 HydrophobicContact CG2-CD1 3.85Å; I77-I81 HydrophobicContact CG2-CG1 4.47Å; I77-I81 WeakPolarHBondContact O-CG1 3.5Å; I77-I81 PolarHBondContact O-N 2.91Å; I77-L138 HydrophobicContact CG1-CD1 4.33Å; I77-L233 HydrophobicContact CD1-CD2 3.68Å; I77-L233 HydrophobicContact CG1-CD2 4.34Å; I77-L233 HydrophobicContact CG2-CD1 4.09Å; I77-F238 HydrophobicContact CD1-CD1 4.39Å; I77-F238 HydrophobicContact CD1-CE1 4.01Å; I77-F238 HydrophobicContact CD1-CZ 4.24Å
78	N	52.5	Low	55.1	Low	39 Å²	39	43.2 Å²	43.2	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-59.2	-37	175.7	-169.3	13.2	0	0	0	111.4	L74 I76 I81 N82 I85 L212	L74-N78 VanDerWaalsContact O-CB 3.3Å; L74-N78 WeakPolarHBondContact O-CB 3.39Å; L74-N78 PolarHBondContact O-N 3.37Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 2.83Å; N78-I81 PolarHBondContact O-N 2.91Å; N78-N82 WeakPolarHBondContact O-CA 3.18Å; N78-N82 VanDerWaalsContact O-CB 3.29Å; N78-N82 WeakPolarHBondContact O-CB 3.36Å; N78-N82 PolarHBondContact O-N 3Å; N78-N82 PolarHBondContact OD1-ND2 2.86Å; N78-I85 WeakPolarHBondContact ND2-CD1 3.42Å; N78-I85 WeakPolarHBondContact OD1-CD1 3.2Å; N78-L212 HydrophobicContact CB-CD2 4.09Å
79	G	49.7	Very low	54.6	Low	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-21.7	173	0	0	0	0	0	115.8	T75 I76 I77 N82 P83	T75-G79 PolarHBondContact O-N 3.35Å; I76-G79 CarbonylContact O-C 3.56Å; I76-G79 WeakPolarHBondContact O-CA 3.5Å; I76-G79 PolarHBondContact O-N 3.39Å; I77-G79 PolarHBondContact O-N 3.16Å; G79-N82 CarbonylContact O-C 3.41Å; G79-P83 WeakPolarHBondContact O-CA 3.3Å
80	I	49.8	Very low	54.2	Low	8 Å²	8	35.1 Å²	35.1	4%	0.041	20%	0.197	C	C	.	.	H	α-helix	trans	-77.9	-40.5	169.9	-58.1	164.8	0	0	0	110.3	I76 I77 P131 L134 L138 L229	I76-I80 HydrophobicContact CG2-CD1 3.96Å; I76-I80 HydrophobicContact CG2-CG1 4.23Å; I76-I80 WeakPolarHBondContact O-CG1 3.38Å; I76-I80 PolarHBondContact O-N 2.9Å; I77-I80 WeakPolarHBondContact O-CB 3.36Å; I77-I80 PolarHBondContact O-N 3.49Å; I80-P131 HydrophobicContact CG2-CB 3.61Å; I80-P131 HydrophobicContact CG2-CG 4.12Å; I80-L134 HydrophobicContact CD1-CB 3.72Å; I80-L134 HydrophobicContact CG1-CB 3.58Å; I80-L134 HydrophobicContact CG1-CD1 3.64Å; I80-L134 HydrophobicContact CG1-CG 4.24Å; I80-L138 HydrophobicContact CD1-CD1 4.28Å; I80-L229 HydrophobicContact CB-CD1 4.42Å; I80-L229 HydrophobicContact CB-CD2 4.05Å; I80-L229 HydrophobicContact CG2-CD1 3.73Å; I80-L229 HydrophobicContact CG2-CD2 3.7Å; I80-L229 HydrophobicContact CG2-CG 4.31Å
81	I	47.1	Very low	53.8	Low	58 Å²	58	40.4 Å²	40.4	30%	0.297	22%	0.216	S	C	.	.	H	α-helix	trans	-65.6	-49	174.3	-62	164.3	0	0	0	110.1	I77 N78 P83 L229	I77-I81 HydrophobicContact CG2-CD1 3.85Å; I77-I81 HydrophobicContact CG2-CG1 4.47Å; I77-I81 WeakPolarHBondContact O-CG1 3.5Å; I77-I81 PolarHBondContact O-N 2.91Å; N78-I81 PolarHBondContact O-N 2.91Å; I81-P83 VanDerWaalsContact C-CD 3.42Å; I81-P83 VanDerWaalsContact O-CD 3.23Å; I81-P83 WeakPolarHBondContact O-CD 3.46Å; I81-L229 HydrophobicContact CB-CD2 4.45Å; I81-L229 HydrophobicContact CG1-CD2 3.47Å; I81-L229 VanDerWaalsContact CG1-CD2 3.47Å
82	N	49.8	Very low	53.9	Low	26 Å²	26	39.7 Å²	39.7	14%	0.139	21%	0.209	C	C	.	.	S	Bend	trans	-120.3	74.9	-173.9	-59.9	-57.8	0	0	0	110.3	N78 G79 Q84 I85	N78-N82 WeakPolarHBondContact O-CA 3.18Å; N78-N82 VanDerWaalsContact O-CB 3.29Å; N78-N82 WeakPolarHBondContact O-CB 3.36Å; N78-N82 PolarHBondContact O-N 3Å; N78-N82 PolarHBondContact OD1-ND2 2.86Å; G79-N82 CarbonylContact O-C 3.41Å; N82-Q84 PolarHBondContact O-N 3.46Å; N82-I85 HydrophobicContact CB-CD1 3.67Å; N82-I85 HydrophobicContact CB-CG1 3.96Å; N82-I85 WeakPolarHBondContact O-CB 3.41Å; N82-I85 PolarHBondContact O-N 2.84Å
83	P	49.2	Very low	53.7	Low	46 Å²	46	46 Å²	46	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-26	-53.5	172.4	-45.3	41.9	0	0	0	117.5	G79 I81 I85 I86 T87 W124	G79-P83 WeakPolarHBondContact O-CA 3.3Å; I81-P83 VanDerWaalsContact C-CD 3.42Å; I81-P83 VanDerWaalsContact O-CD 3.23Å; I81-P83 WeakPolarHBondContact O-CD 3.46Å; P83-I85 PolarHBondContact O-N 2.74Å; P83-I86 PolarHBondContact O-N 3.19Å; P83-T87 PolarHBondContact O-N 2.93Å; P83-T87 VanDerWaalsContact O-N 3.08Å; P83-T87 PolarHBondContact O-OG1 3.48Å; P83-W124 VanDerWaalsContact CA-CZ2 3.45Å; P83-W124 HydrophobicContact CB-CD2 4.27Å; P83-W124 VanDerWaalsContact CB-CE2 3.46Å; P83-W124 HydrophobicContact CB-CH2 4.39Å; P83-W124 HydrophobicContact CB-CZ2 3.55Å; P83-W124 HydrophobicContact CG-CZ2 3.99Å; P83-W124 WeakPolarHBondContact O-CH2 3.2Å
84	Q	53.2	Low	53.2	Low	146 Å²	146	49.7 Å²	49.7	68%	0.682	27%	0.265	S	S	*	.	H	α-helix	trans	-56.7	-21.7	-173.8	-63.3	173.3	-8.5	0	0	113.5	N82 T87 S88	N82-Q84 PolarHBondContact O-N 3.46Å; Q84-T87 WeakPolarHBondContact CA-OG1 3.37Å; Q84-S88 VanDerWaalsContact O-CB 3.25Å; Q84-S88 WeakPolarHBondContact O-CB 3.49Å; Q84-S88 PolarHBondContact O-N 3.3Å; Q84-S88 PolarHBondContact O-OG 3.45Å
85	I	54.2	Low	53	Low	58 Å²	58	51 Å²	51	30%	0.297	27%	0.272	S	S	.	.	H	α-helix	trans	-72.7	-40.2	176.8	-58.9	-178.4	0	0	0	111.4	N78 N82 P83 S88 A89	N78-I85 WeakPolarHBondContact ND2-CD1 3.42Å; N78-I85 WeakPolarHBondContact OD1-CD1 3.2Å; N82-I85 HydrophobicContact CB-CD1 3.67Å; N82-I85 HydrophobicContact CB-CG1 3.96Å; N82-I85 WeakPolarHBondContact O-CB 3.41Å; N82-I85 PolarHBondContact O-N 2.84Å; P83-I85 PolarHBondContact O-N 2.74Å; I85-S88 PolarHBondContact O-OG 2.97Å; I85-S88 VanDerWaalsContact O-OG 3.12Å; I85-A89 WeakPolarHBondContact O-CB 3.39Å; I85-A89 PolarHBondContact O-N 2.84Å; I85-A89 VanDerWaalsContact O-N 3.1Å
86	I	55	Low	53.3	Low	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-76.8	-38.7	172.9	-66.9	169.7	0	0	0	110	P83 S88 A89 Y90 L102 L106 F121 W124 L134	P83-I86 PolarHBondContact O-N 3.19Å; I86-S88 PolarHBondContact O-N 3.32Å; I86-A89 PolarHBondContact O-N 2.64Å; I86-A89 VanDerWaalsContact O-N 3.16Å; I86-Y90 HydrophobicContact CG2-CD2 4.12Å; I86-Y90 HydrophobicContact CG2-CE2 4.29Å; I86-Y90 PolarHBondContact O-N 3.41Å; I86-Y90 VanDerWaalsContact O-N 3.1Å; I86-L102 HydrophobicContact CG1-CD2 4.31Å; I86-L106 HydrophobicContact CD1-CD1 4.39Å; I86-L106 HydrophobicContact CG1-CD1 4.39Å; I86-L106 HydrophobicContact CG2-CD1 3.82Å; I86-F121 HydrophobicContact CG2-CD1 4.22Å; I86-F121 HydrophobicContact CG2-CD2 3.82Å; I86-F121 HydrophobicContact CG2-CE1 3.91Å; I86-F121 HydrophobicContact CG2-CE2 3.49Å; I86-F121 VanDerWaalsContact CG2-CE2 3.49Å; I86-F121 HydrophobicContact CG2-CG 4.18Å; I86-F121 HydrophobicContact CG2-CZ 3.54Å; I86-W124 HydrophobicContact CB-CH2 3.74Å; I86-W124 HydrophobicContact CB-CZ3 3.88Å; I86-W124 HydrophobicContact CD1-CH2 4.4Å; I86-W124 HydrophobicContact CG2-CH2 3.99Å; I86-W124 HydrophobicContact CG2-CZ3 3.85Å; I86-L134 HydrophobicContact CD1-CD1 4.12Å
87	T	53	Low	53.3	Low	29 Å²	29	56.6 Å²	56.6	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-55.8	-53.7	175.4	-30.7	0	0	0	0	110.2	P83 Q84 A89 Y90 Y91 W124	P83-T87 PolarHBondContact O-N 2.93Å; P83-T87 VanDerWaalsContact O-N 3.08Å; P83-T87 PolarHBondContact O-OG1 3.48Å; Q84-T87 WeakPolarHBondContact CA-OG1 3.37Å; T87-A89 VanDerWaalsContact C-N 3.33Å; T87-A89 PolarHBondContact O-N 3.39Å; T87-Y90 PolarHBondContact O-N 2.89Å; T87-Y91 HydrophobicContact CG2-CD2 3.93Å; T87-Y91 HydrophobicContact CG2-CE2 3.87Å; T87-Y91 VanDerWaalsContact O-CD2 3.3Å; T87-Y91 WeakPolarHBondContact O-CD2 3.3Å; T87-Y91 PolarHBondContact O-N 3.29Å; T87-W124 HydrophobicContact CG2-CE3 4.15Å; T87-W124 WeakPolarHBondContact OG1-CZ3 3.41Å
88	S	57.4	Low	53.3	Low	67 Å²	67	64.1 Å²	64.1	47%	0.469	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-38.3	175.7	55	0	0	0	0	112.5	Q84 I85 I86 Y90 Y91 D92	Q84-S88 VanDerWaalsContact O-CB 3.25Å; Q84-S88 WeakPolarHBondContact O-CB 3.49Å; Q84-S88 PolarHBondContact O-N 3.3Å; Q84-S88 PolarHBondContact O-OG 3.45Å; I85-S88 PolarHBondContact O-OG 2.97Å; I85-S88 VanDerWaalsContact O-OG 3.12Å; I86-S88 PolarHBondContact O-N 3.32Å; S88-Y90 PolarHBondContact O-N 3.44Å; S88-Y90 VanDerWaalsContact O-N 3.16Å; S88-Y91 PolarHBondContact O-N 3.25Å; S88-D92 WeakPolarHBondContact O-CA 3.23Å; S88-D92 WeakPolarHBondContact O-CB 3.29Å; S88-D92 PolarHBondContact O-N 2.88Å
89	A	56.2	Low	53.6	Low	13 Å²	13	62.3 Å²	62.3	11%	0.107	33%	0.327	C	S	.	.	H	α-helix	trans	-63.5	-18	174.1	0	0	0	0	0	114.7	I85 I86 T87 L102 R103	I85-A89 WeakPolarHBondContact O-CB 3.39Å; I85-A89 PolarHBondContact O-N 2.84Å; I85-A89 VanDerWaalsContact O-N 3.1Å; I86-A89 PolarHBondContact O-N 2.64Å; I86-A89 VanDerWaalsContact O-N 3.16Å; T87-A89 VanDerWaalsContact C-N 3.33Å; T87-A89 PolarHBondContact O-N 3.39Å; A89-L102 HydrophobicContact CB-CD2 3.69Å; A89-R103 VanDerWaalsContact O-CZ 3.25Å; A89-R103 PolarHBondContact O-NE 2.97Å; A89-R103 PolarHBondContact O-NH2 3.47Å
90	Y	57.2	Low	54	Low	13 Å²	13	66.1 Å²	66.1	5%	0.051	35%	0.347	C	S	.	.	H	α-helix	trans	-96.2	-25.8	171.9	-87.7	-99.2	0	0	0	114.2	I86 T87 S88 R103 L106 L117 K118 F121	I86-Y90 HydrophobicContact CG2-CD2 4.12Å; I86-Y90 HydrophobicContact CG2-CE2 4.29Å; I86-Y90 PolarHBondContact O-N 3.41Å; I86-Y90 VanDerWaalsContact O-N 3.1Å; T87-Y90 PolarHBondContact O-N 2.89Å; S88-Y90 PolarHBondContact O-N 3.44Å; S88-Y90 VanDerWaalsContact O-N 3.16Å; Y90-R103 HydrophobicContact CD1-CG 4.34Å; Y90-R103 HydrophobicContact CD2-CG 4.26Å; Y90-R103 HydrophobicContact CE1-CG 3.94Å; Y90-R103 HydrophobicContact CE2-CG 3.84Å; Y90-R103 HydrophobicContact CG-CG 4.49Å; Y90-R103 WeakPolarHBondContact OH-CA 3.37Å; Y90-L106 HydrophobicContact CE2-CD1 3.86Å; Y90-L117 HydrophobicContact CE1-CB 3.65Å; Y90-L117 VanDerWaalsContact OH-CD1 3.29Å; Y90-L117 WeakPolarHBondContact OH-CD1 3.38Å; Y90-K118 HydrophobicContact CD1-CB 4.05Å; Y90-F121 HydrophobicContact CD1-CD2 4.25Å; Y90-F121 AromaticContact CD2-CD2 3.55Å; Y90-F121 HydrophobicContact CD2-CD2 3.55Å; Y90-F121 AromaticContact CD2-CE2 3.84Å; Y90-F121 HydrophobicContact CD2-CE2 3.84Å; Y90-F121 HydrophobicContact CE1-CD2 4.36Å; Y90-F121 AromaticContact CE2-CD2 3.68Å; Y90-F121 HydrophobicContact CE2-CD2 3.68Å; Y90-F121 AromaticContact CE2-CE2 3.49Å; Y90-F121 HydrophobicContact CE2-CE2 3.49Å; Y90-F121 VanDerWaalsContact CE2-CE2 3.49Å; Y90-F121 AromaticContact CG-CD2 3.86Å; Y90-F121 HydrophobicContact CG-CD2 3.86Å; Y90-F121 AromaticContact CZ-CE2 3.89Å
91	Y	55.9	Low	54.4	Low	126 Å²	126	72.7 Å²	72.7	49%	0.494	37%	0.372	S	S	.	.	H	α-helix	trans	-90.6	-14	173.7	-74.7	-79.5	0	0	0	114.1	T87 S88 M93 S122	T87-Y91 HydrophobicContact CG2-CD2 3.93Å; T87-Y91 HydrophobicContact CG2-CE2 3.87Å; T87-Y91 VanDerWaalsContact O-CD2 3.3Å; T87-Y91 WeakPolarHBondContact O-CD2 3.3Å; T87-Y91 PolarHBondContact O-N 3.29Å; S88-Y91 PolarHBondContact O-N 3.25Å; Y91-M93 PolarHBondContact O-N 3.1Å; Y91-S122 WeakPolarHBondContact OH-CA 3.21Å; Y91-S122 WeakPolarHBondContact OH-CB 3.35Å
92	D	56	Low	54.9	Low	52 Å²	52	70.4 Å²	70.4	28%	0.278	36%	0.36	S	S	.	.			trans	-65.6	98.1	173.7	176.2	19.9	0	0	0	110.5	S88 S94 S96 R103	S88-D92 WeakPolarHBondContact O-CA 3.23Å; S88-D92 WeakPolarHBondContact O-CB 3.29Å; S88-D92 PolarHBondContact O-N 2.88Å; D92-S94 PolarHBondContact O-N 3.38Å; D92-S94 WeakPolarHBondContact OD1-CB 3.49Å; D92-S94 PolarHBondContact OD1-N 2.78Å; D92-S94 PolarHBondContact OD1-OG 3.47Å; D92-S94 PolarHBondContact OD2-OG 3.1Å; D92-S96 PolarHBondContact OD2-OG 3.41Å; D92-R103 PolarHBondContact O-NH2 3.43Å
93	M	49.9	Very low	55.4	Low	161 Å²	161	70.9 Å²	70.9	79%	0.793	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-3.6	178.2	-66.1	-70.8	-75.2	0	0	113	Y91 N95	Y91-M93 PolarHBondContact O-N 3.1Å; M93-N95 PolarHBondContact O-N 3.33Å; M93-N95 VanDerWaalsContact O-N 3.15Å
94	S	51.1	Low	55.9	Low	81 Å²	81	76.4 Å²	76.4	57%	0.566	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.1	-175.9	72.9	0	0	0	0	114.7	D92 S96	D92-S94 PolarHBondContact O-N 3.38Å; D92-S94 WeakPolarHBondContact OD1-CB 3.49Å; D92-S94 PolarHBondContact OD1-N 2.78Å; D92-S94 PolarHBondContact OD1-OG 3.47Å; D92-S94 PolarHBondContact OD2-OG 3.1Å; S94-S96 PolarHBondContact O-N 3.02Å; S94-S96 WeakPolarHBondContact OG-CB 3.48Å; S94-S96 PolarHBondContact OG-N 2.88Å
95	N	53	Low	56	Low	96 Å²	96	70 Å²	70	51%	0.513	35%	0.345	S	S	.	.			trans	51.4	33	-170.8	-75.6	-30.8	0	0	0	112.9	M93 N97 L100	M93-N95 PolarHBondContact O-N 3.33Å; M93-N95 VanDerWaalsContact O-N 3.15Å; N95-N97 PolarHBondContact O-N 2.76Å; N95-L100 HydrophobicContact CB-CD1 4.33Å; N95-L100 WeakPolarHBondContact O-CD1 3.36Å
96	S	59.2	Low	56.1	Low	41 Å²	41	67.4 Å²	67.4	29%	0.287	33%	0.331	S	S	.	.			trans	-49.1	134.7	171.5	63.6	0	0	0	0	110.2	D92 S94 K98 S99 L100	D92-S96 PolarHBondContact OD2-OG 3.41Å; S94-S96 PolarHBondContact O-N 3.02Å; S94-S96 WeakPolarHBondContact OG-CB 3.48Å; S94-S96 PolarHBondContact OG-N 2.88Å; S96-K98 PolarHBondContact O-N 2.96Å; S96-S99 PolarHBondContact N-OG 3.15Å; S96-S99 PolarHBondContact O-N 3.38Å; S96-S99 PolarHBondContact O-OG 2.83Å; S96-S99 VanDerWaalsContact OG-CB 3.31Å; S96-S99 WeakPolarHBondContact OG-CB 3.46Å; S96-S99 PolarHBondContact OG-N 3.44Å; S96-S99 PolarHBondContact OG-OG 2.98Å; S96-S99 VanDerWaalsContact OG-OG 3.1Å; S96-L100 PolarHBondContact O-N 3.23Å; S96-L100 VanDerWaalsContact O-N 3.1Å
97	N	55.7	Low	56.1	Low	119 Å²	119	68.9 Å²	68.9	64%	0.636	34%	0.342	S	S	*	.	H	α-helix	trans	-51.7	-35.7	-179.4	-78.1	-17.4	0	0	0	111.8	N95 L100 Y101	N95-N97 PolarHBondContact O-N 2.76Å; N97-L100 PolarHBondContact O-N 3.27Å; N97-Y101 HydrophobicContact CB-CD2 4.39Å; N97-Y101 HydrophobicContact CB-CE2 4.31Å; N97-Y101 WeakPolarHBondContact O-CB 3.21Å; N97-Y101 WeakPolarHBondContact O-CD2 3.4Å; N97-Y101 PolarHBondContact O-N 3.21Å
98	K	54.3	Low	55.9	Low	167 Å²	167	70.4 Å²	70.4	73%	0.726	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-46.2	174.7	-63.4	-174.3	179.4	-177.2	0	112.5	S96 L102	S96-K98 PolarHBondContact O-N 2.96Å; K98-L102 WeakPolarHBondContact O-CB 3.41Å; K98-L102 PolarHBondContact O-N 2.8Å
99	S	58.2	Low	55.4	Low	2 Å²	2	68.2 Å²	68.2	1%	0.014	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-42.7	176	69.9	0	0	0	0	112	S96 L102 R103	S96-S99 PolarHBondContact N-OG 3.15Å; S96-S99 PolarHBondContact O-N 3.38Å; S96-S99 PolarHBondContact O-OG 2.83Å; S96-S99 VanDerWaalsContact OG-CB 3.31Å; S96-S99 WeakPolarHBondContact OG-CB 3.46Å; S96-S99 PolarHBondContact OG-N 3.44Å; S96-S99 PolarHBondContact OG-OG 2.98Å; S96-S99 VanDerWaalsContact OG-OG 3.1Å; S99-L102 PolarHBondContact O-N 2.95Å; S99-R103 WeakPolarHBondContact O-CB 3.35Å; S99-R103 WeakPolarHBondContact O-CG 3.31Å; S99-R103 PolarHBondContact O-N 3.26Å
100	L	58.5	Low	55	Low	79 Å²	79	68.8 Å²	68.8	41%	0.414	34%	0.344	S	S	.	.	H	α-helix	trans	-63.4	-45.9	178.6	-70.1	171.8	0	0	0	112.2	N95 S96 N97 W104	N95-L100 HydrophobicContact CB-CD1 4.33Å; N95-L100 WeakPolarHBondContact O-CD1 3.36Å; S96-L100 PolarHBondContact O-N 3.23Å; S96-L100 VanDerWaalsContact O-N 3.1Å; N97-L100 PolarHBondContact O-N 3.27Å; L100-W104 WeakPolarHBondContact O-CB 3.45Å; L100-W104 PolarHBondContact O-N 3.39Å
101	Y	57.4	Low	54.4	Low	147 Å²	147	71.1 Å²	71.1	58%	0.576	37%	0.371	S	S	*	.	H	α-helix	trans	-62.8	-41.6	175.1	-78.2	-58.8	0	0	0	112.2	N97 Y105	N97-Y101 HydrophobicContact CB-CD2 4.39Å; N97-Y101 HydrophobicContact CB-CE2 4.31Å; N97-Y101 WeakPolarHBondContact O-CB 3.21Å; N97-Y101 WeakPolarHBondContact O-CD2 3.4Å; N97-Y101 PolarHBondContact O-N 3.21Å; Y101-Y105 WeakPolarHBondContact O-CB 3.3Å; Y101-Y105 PolarHBondContact O-N 3.19Å
102	L	58	Low	54.2	Low	9 Å²	9	66.7 Å²	66.7	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-68.5	-41.7	179.7	-167	64.7	0	0	0	112	V72 T75 I76 I86 A89 K98 S99 Y105 L106	V72-L102 HydrophobicContact CG1-CD1 4.01Å; T75-L102 HydrophobicContact CG2-CD1 3.64Å; T75-L102 HydrophobicContact CG2-CD2 3.86Å; T75-L102 HydrophobicContact CG2-CG 4.38Å; I76-L102 HydrophobicContact CG1-CD1 4.37Å; I86-L102 HydrophobicContact CG1-CD2 4.31Å; A89-L102 HydrophobicContact CB-CD2 3.69Å; K98-L102 WeakPolarHBondContact O-CB 3.41Å; K98-L102 PolarHBondContact O-N 2.8Å; S99-L102 PolarHBondContact O-N 2.95Å; L102-Y105 PolarHBondContact O-N 3Å; L102-L106 HydrophobicContact CD1-CD1 4.39Å; L102-L106 HydrophobicContact CG-CD1 3.94Å; L102-L106 VanDerWaalsContact O-CB 3.3Å; L102-L106 WeakPolarHBondContact O-CB 3.29Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.14Å
103	R	61.2	Low	54.4	Low	37 Å²	37	66.4 Å²	66.4	14%	0.14	36%	0.356	C	S	.	.	H	α-helix	trans	-60.1	-49.4	174	-71.2	171.2	-167.9	172.1	7.9	111.5	A89 Y90 D92 S99 Y105 L106 S107	A89-R103 VanDerWaalsContact O-CZ 3.25Å; A89-R103 PolarHBondContact O-NE 2.97Å; A89-R103 PolarHBondContact O-NH2 3.47Å; Y90-R103 HydrophobicContact CD1-CG 4.34Å; Y90-R103 HydrophobicContact CD2-CG 4.26Å; Y90-R103 HydrophobicContact CE1-CG 3.94Å; Y90-R103 HydrophobicContact CE2-CG 3.84Å; Y90-R103 HydrophobicContact CG-CG 4.49Å; Y90-R103 WeakPolarHBondContact OH-CA 3.37Å; D92-R103 PolarHBondContact O-NH2 3.43Å; S99-R103 WeakPolarHBondContact O-CB 3.35Å; S99-R103 WeakPolarHBondContact O-CG 3.31Å; S99-R103 PolarHBondContact O-N 3.26Å; R103-Y105 PolarHBondContact O-N 2.73Å; R103-L106 PolarHBondContact O-N 2.88Å; R103-S107 WeakPolarHBondContact O-CB 3.47Å; R103-S107 PolarHBondContact O-N 3.1Å
104	W	58.9	Low	54.9	Low	161 Å²	161	62.1 Å²	62.1	61%	0.61	34%	0.336	S	S	*	.	H	α-helix	trans	-60.4	-45	177.8	177.7	82.2	0	0	0	112.1	L100 S107 A108	L100-W104 WeakPolarHBondContact O-CB 3.45Å; L100-W104 PolarHBondContact O-N 3.39Å; W104-S107 PolarHBondContact O-N 3.43Å; W104-A108 VanDerWaalsContact O-CB 3.24Å; W104-A108 WeakPolarHBondContact O-CB 3.42Å; W104-A108 PolarHBondContact O-N 3.37Å
105	Y	55.4	Low	55.4	Low	13 Å²	13	64.4 Å²	64.4	5%	0.051	34%	0.338	C	S	.	.	H	α-helix	trans	-70.6	-39.4	-178.4	-167.4	-106.3	0	0	0	112.2	I67 V72 I76 Y101 L102 R103 A108 I109	I67-Y105 WeakPolarHBondContact CG2-OH 3.21Å; V72-Y105 HydrophobicContact CB-CD1 3.91Å; V72-Y105 HydrophobicContact CB-CD2 4.45Å; V72-Y105 HydrophobicContact CB-CE1 3.87Å; V72-Y105 HydrophobicContact CB-CE2 4.43Å; V72-Y105 HydrophobicContact CB-CG 4.19Å; V72-Y105 HydrophobicContact CG1-CD1 3.28Å; V72-Y105 HydrophobicContact CG1-CD2 4.21Å; V72-Y105 HydrophobicContact CG1-CE1 3.78Å; V72-Y105 HydrophobicContact CG1-CG 3.52Å; I76-Y105 HydrophobicContact CD1-CD1 3.63Å; I76-Y105 HydrophobicContact CD1-CE1 3.74Å; I76-Y105 HydrophobicContact CG1-CD1 4.28Å; I76-Y105 HydrophobicContact CG1-CE1 4.41Å; Y101-Y105 WeakPolarHBondContact O-CB 3.3Å; Y101-Y105 PolarHBondContact O-N 3.19Å; L102-Y105 PolarHBondContact O-N 3Å; R103-Y105 PolarHBondContact O-N 2.73Å; Y105-A108 PolarHBondContact O-N 3.05Å; Y105-I109 HydrophobicContact CD1-CD1 3.69Å; Y105-I109 HydrophobicContact CD2-CD1 4.22Å; Y105-I109 HydrophobicContact CE1-CD1 3.3Å; Y105-I109 HydrophobicContact CE2-CD1 3.88Å; Y105-I109 HydrophobicContact CG-CD1 4.14Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.42Å; Y105-I109 WeakPolarHBondContact O-CB 3.31Å; Y105-I109 VanDerWaalsContact O-CG1 3.32Å; Y105-I109 WeakPolarHBondContact O-CG1 3.44Å; Y105-I109 PolarHBondContact O-N 2.76Å
106	L	56.4	Low	55.8	Low	2 Å²	2	62 Å²	62	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-41.9	172.2	-78.7	166.8	0	0	0	111.7	I76 I86 Y90 L102 R103 S110 L117 F121 L134	I76-L106 HydrophobicContact CD1-CD2 3.72Å; I76-L106 HydrophobicContact CD1-CG 4.32Å; I76-L106 HydrophobicContact CG1-CD2 3.9Å; I76-L106 HydrophobicContact CG1-CG 4.41Å; I86-L106 HydrophobicContact CD1-CD1 4.39Å; I86-L106 HydrophobicContact CG1-CD1 4.39Å; I86-L106 HydrophobicContact CG2-CD1 3.82Å; Y90-L106 HydrophobicContact CE2-CD1 3.86Å; L102-L106 HydrophobicContact CD1-CD1 4.39Å; L102-L106 HydrophobicContact CG-CD1 3.94Å; L102-L106 VanDerWaalsContact O-CB 3.3Å; L102-L106 WeakPolarHBondContact O-CB 3.29Å; L102-L106 WeakPolarHBondContact O-CG 3.43Å; L102-L106 PolarHBondContact O-N 3.14Å; R103-L106 PolarHBondContact O-N 2.88Å; L106-S110 WeakPolarHBondContact O-CB 3.31Å; L106-S110 PolarHBondContact O-N 2.9Å; L106-S110 PolarHBondContact O-OG 3.1Å; L106-L117 HydrophobicContact CB-CD1 4.22Å; L106-F121 HydrophobicContact CD1-CE2 4.23Å; L106-F121 HydrophobicContact CD1-CZ 4.38Å; L106-L134 HydrophobicContact CD2-CD2 3.94Å
107	S	55.4	Low	55.8	Low	32 Å²	32	60.2 Å²	60.2	22%	0.224	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-48.2	174	-177.6	0	0	0	0	111.9	R103 W104 I109 G111 Y112	R103-S107 WeakPolarHBondContact O-CB 3.47Å; R103-S107 PolarHBondContact O-N 3.1Å; W104-S107 PolarHBondContact O-N 3.43Å; S107-I109 VanDerWaalsContact C-N 3.31Å; S107-I109 PolarHBondContact O-N 2.86Å; S107-G111 WeakPolarHBondContact O-CA 3.46Å; S107-G111 PolarHBondContact O-N 3.06Å; S107-Y112 WeakPolarHBondContact CA-O 3.41Å; S107-Y112 WeakPolarHBondContact CB-O 3.26Å; S107-Y112 PolarHBondContact OG-O 2.99Å
108	A	48.1	Very low	56.1	Low	61 Å²	61	59.6 Å²	59.6	50%	0.504	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-29.8	-179.4	0	0	0	0	0	114.1	W104 Y105	W104-A108 VanDerWaalsContact O-CB 3.24Å; W104-A108 WeakPolarHBondContact O-CB 3.42Å; W104-A108 PolarHBondContact O-N 3.37Å; Y105-A108 PolarHBondContact O-N 3.05Å
109	I	47.6	Very low	56.5	Low	20 Å²	20	58.4 Å²	58.4	10%	0.103	31%	0.305	C	S	.	.	H	α-helix	trans	-89.9	-40.7	179.3	-68.4	-173.8	0	0	0	112	M1 I76 Y105 S107 C137	M1-I109 HydrophobicContact SD-CD1 4.28Å; I76-I109 HydrophobicContact CD1-CD1 4.35Å; Y105-I109 HydrophobicContact CD1-CD1 3.69Å; Y105-I109 HydrophobicContact CD2-CD1 4.22Å; Y105-I109 HydrophobicContact CE1-CD1 3.3Å; Y105-I109 HydrophobicContact CE2-CD1 3.88Å; Y105-I109 HydrophobicContact CG-CD1 4.14Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.42Å; Y105-I109 WeakPolarHBondContact O-CB 3.31Å; Y105-I109 VanDerWaalsContact O-CG1 3.32Å; Y105-I109 WeakPolarHBondContact O-CG1 3.44Å; Y105-I109 PolarHBondContact O-N 2.76Å; S107-I109 VanDerWaalsContact C-N 3.31Å; S107-I109 PolarHBondContact O-N 2.86Å; I109-C137 HydrophobicContact CG2-CB 3.84Å; I109-C137 WeakPolarHBondContact CG2-O 3.29Å
110	S	48.5	Very low	56.4	Low	26 Å²	26	59.2 Å²	59.2	18%	0.182	31%	0.308	C	S	.	.	H	α-helix	trans	-78.4	-27	179.9	66	0	0	0	0	113.9	L106 Y112 C137	L106-S110 WeakPolarHBondContact O-CB 3.31Å; L106-S110 PolarHBondContact O-N 2.9Å; L106-S110 PolarHBondContact O-OG 3.1Å; S110-Y112 PolarHBondContact O-N 2.74Å; S110-Y112 PolarHBondContact OG-N 3.26Å; S110-C137 WeakPolarHBondContact CB-SG 3.36Å
111	G	44.6	Very low	56.3	Low	61 Å²	61	55.6 Å²	55.6	63%	0.629	29%	0.288	S	S	*	.			trans	78.8	-1.5	-169.3	0	0	0	0	0	114.3	S107	S107-G111 WeakPolarHBondContact O-CA 3.46Å; S107-G111 PolarHBondContact O-N 3.06Å
112	Y	50.3	Low	56.1	Low	34 Å²	34	51.8 Å²	51.8	13%	0.133	28%	0.283	C	S	.	.			trans	-82.1	152	176.4	-62.6	-50.9	0	0	0	111.8	S107 S110 L117 Q133 L174	S107-Y112 WeakPolarHBondContact CA-O 3.41Å; S107-Y112 WeakPolarHBondContact CB-O 3.26Å; S107-Y112 PolarHBondContact OG-O 2.99Å; S110-Y112 PolarHBondContact O-N 2.74Å; S110-Y112 PolarHBondContact OG-N 3.26Å; Y112-L117 HydrophobicContact CD2-CD2 3.93Å; Y112-L117 HydrophobicContact CG-CD2 4.48Å; Y112-Q133 PolarHBondContact OH-OE1 2.9Å; Y112-L174 WeakPolarHBondContact OH-CD1 3.19Å
113	S	60.7	Low	55.9	Low	45 Å²	45	53.1 Å²	53.1	32%	0.315	29%	0.294	S	S	.	.			trans	-73.9	167	173.1	90	0	0	0	0	111.6	E115 S116 L117	S113-E115 WeakPolarHBondContact CB-OE2 2.91Å; S113-E115 PolarHBondContact O-N 3.47Å; S113-E115 PolarHBondContact OG-N 3.17Å; S113-E115 PolarHBondContact OG-OE2 2.9Å; S113-S116 PolarHBondContact O-N 3.34Å; S113-S116 PolarHBondContact OG-N 3.39Å; S113-S116 PolarHBondContact OG-OG 3Å; S113-L117 WeakPolarHBondContact O-CB 3.34Å; S113-L117 WeakPolarHBondContact O-CG 3.5Å; S113-L117 PolarHBondContact O-N 3.42Å
114	N	59.8	Low	55.5	Low	71 Å²	71	52.9 Å²	52.9	38%	0.38	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-31.5	176.2	-77.2	-41.4	0	0	0	112.1	K118	N114-K118 WeakPolarHBondContact O-CB 3.37Å; N114-K118 PolarHBondContact O-N 2.89Å
115	E	62.5	Low	54.9	Low	129 Å²	129	52.6 Å²	52.6	60%	0.603	30%	0.303	S	S	*	.	H	α-helix	trans	-70.1	-50.4	177.2	-55.4	67.1	-142.4	0	0	109.9	S113 L117 K118 E119	S113-E115 WeakPolarHBondContact CB-OE2 2.91Å; S113-E115 PolarHBondContact O-N 3.47Å; S113-E115 PolarHBondContact OG-N 3.17Å; S113-E115 PolarHBondContact OG-OE2 2.9Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 2.81Å; E115-K118 PolarHBondContact O-N 3.31Å; E115-K118 VanDerWaalsContact O-N 3.17Å; E115-E119 WeakPolarHBondContact O-CB 3.24Å; E115-E119 PolarHBondContact O-N 2.95Å
116	S	61.2	Low	54.2	Low	46 Å²	46	59.5 Å²	59.5	32%	0.322	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-40.3	175.4	-55.3	0	0	0	0	112.2	S113 Y120	S113-S116 PolarHBondContact O-N 3.34Å; S113-S116 PolarHBondContact OG-N 3.39Å; S113-S116 PolarHBondContact OG-OG 3Å; S116-Y120 WeakPolarHBondContact O-CB 3.32Å; S116-Y120 PolarHBondContact O-N 2.96Å
117	L	59.1	Low	53.5	Low	4 Å²	4	63 Å²	63	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-68.9	-40.2	175.7	-73.4	165.5	0	0	0	111.8	Y90 L106 Y112 S113 E115 Y120 F121	Y90-L117 HydrophobicContact CE1-CB 3.65Å; Y90-L117 VanDerWaalsContact OH-CD1 3.29Å; Y90-L117 WeakPolarHBondContact OH-CD1 3.38Å; L106-L117 HydrophobicContact CB-CD1 4.22Å; Y112-L117 HydrophobicContact CD2-CD2 3.93Å; Y112-L117 HydrophobicContact CG-CD2 4.48Å; S113-L117 WeakPolarHBondContact O-CB 3.34Å; S113-L117 WeakPolarHBondContact O-CG 3.5Å; S113-L117 PolarHBondContact O-N 3.42Å; E115-L117 VanDerWaalsContact C-N 3.31Å; E115-L117 PolarHBondContact O-N 2.81Å; L117-Y120 PolarHBondContact O-N 3.12Å; L117-F121 HydrophobicContact CB-CD2 4.23Å; L117-F121 HydrophobicContact CB-CE2 3.98Å; L117-F121 HydrophobicContact CD2-CE2 3.85Å; L117-F121 HydrophobicContact CD2-CZ 3.97Å; L117-F121 HydrophobicContact CG-CE2 4.47Å; L117-F121 VanDerWaalsContact O-CB 3.32Å; L117-F121 WeakPolarHBondContact O-CB 3.4Å; L117-F121 WeakPolarHBondContact O-CD2 3.3Å; L117-F121 WeakPolarHBondContact O-CG 3.48Å; L117-F121 PolarHBondContact O-N 2.97Å
118	K	62.6	Low	52.6	Low	106 Å²	106	70.5 Å²	70.5	46%	0.461	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-42.6	175.3	-175.5	-179.9	178.7	-178.2	0	111.8	Y90 N114 E115 S122	Y90-K118 HydrophobicContact CD1-CB 4.05Å; N114-K118 WeakPolarHBondContact O-CB 3.37Å; N114-K118 PolarHBondContact O-N 2.89Å; E115-K118 PolarHBondContact O-N 3.31Å; E115-K118 VanDerWaalsContact O-N 3.17Å; K118-S122 WeakPolarHBondContact O-CB 3.08Å; K118-S122 PolarHBondContact O-N 2.89Å
119	E	61.2	Low	52.2	Low	141 Å²	141	69.6 Å²	69.6	66%	0.659	37%	0.37	S	S	*	.	H	α-helix	trans	-64.3	-49.2	175.6	-173.6	175.2	-172	0	0	110.8	E115 F121 S122 S123	E115-E119 WeakPolarHBondContact O-CB 3.24Å; E115-E119 PolarHBondContact O-N 2.95Å; E119-F121 VanDerWaalsContact C-N 3.33Å; E119-F121 PolarHBondContact O-N 2.9Å; E119-S122 WeakPolarHBondContact O-CA 3.32Å; E119-S122 WeakPolarHBondContact O-CB 3.5Å; E119-S122 PolarHBondContact O-N 3.18Å; E119-S122 PolarHBondContact O-OG 3.15Å; E119-S123 PolarHBondContact O-N 2.91Å
120	Y	56.4	Low	51.7	Low	20 Å²	20	68.8 Å²	68.8	8%	0.078	37%	0.366	C	S	.	.	H	α-helix	trans	-60.1	-37.5	177.3	-175.6	-105.9	0	0	0	113.7	S116 L117 S122 S123 I130 Q133 L174	S116-Y120 WeakPolarHBondContact O-CB 3.32Å; S116-Y120 PolarHBondContact O-N 2.96Å; L117-Y120 PolarHBondContact O-N 3.12Å; Y120-S122 VanDerWaalsContact C-N 3.34Å; Y120-S123 PolarHBondContact O-OG 3.03Å; Y120-I130 HydrophobicContact CE1-CG1 3.82Å; Y120-I130 WeakPolarHBondContact OH-CG1 3.49Å; Y120-Q133 WeakPolarHBondContact OH-CB 3.32Å; Y120-Q133 PolarHBondContact OH-NE2 2.79Å; Y120-L174 HydrophobicContact CD2-CD1 3.95Å; Y120-L174 HydrophobicContact CE2-CD1 3.89Å
121	F	57.1	Low	51.3	Low	2 Å²	2	68.6 Å²	68.6	1%	0.009	36%	0.364	C	S	.	.	H	α-helix	trans	-82.9	-8.6	174.5	-61	-41.3	0	0	0	113.5	I86 Y90 L106 L117 E119 W124	I86-F121 HydrophobicContact CG2-CD1 4.22Å; I86-F121 HydrophobicContact CG2-CD2 3.82Å; I86-F121 HydrophobicContact CG2-CE1 3.91Å; I86-F121 HydrophobicContact CG2-CE2 3.49Å; I86-F121 VanDerWaalsContact CG2-CE2 3.49Å; I86-F121 HydrophobicContact CG2-CG 4.18Å; I86-F121 HydrophobicContact CG2-CZ 3.54Å; Y90-F121 HydrophobicContact CD1-CD2 4.25Å; Y90-F121 AromaticContact CD2-CD2 3.55Å; Y90-F121 HydrophobicContact CD2-CD2 3.55Å; Y90-F121 AromaticContact CD2-CE2 3.84Å; Y90-F121 HydrophobicContact CD2-CE2 3.84Å; Y90-F121 HydrophobicContact CE1-CD2 4.36Å; Y90-F121 AromaticContact CE2-CD2 3.68Å; Y90-F121 HydrophobicContact CE2-CD2 3.68Å; Y90-F121 AromaticContact CE2-CE2 3.49Å; Y90-F121 HydrophobicContact CE2-CE2 3.49Å; Y90-F121 VanDerWaalsContact CE2-CE2 3.49Å; Y90-F121 AromaticContact CG-CD2 3.86Å; Y90-F121 HydrophobicContact CG-CD2 3.86Å; Y90-F121 AromaticContact CZ-CE2 3.89Å; L106-F121 HydrophobicContact CD1-CE2 4.23Å; L106-F121 HydrophobicContact CD1-CZ 4.38Å; L117-F121 HydrophobicContact CB-CD2 4.23Å; L117-F121 HydrophobicContact CB-CE2 3.98Å; L117-F121 HydrophobicContact CD2-CE2 3.85Å; L117-F121 HydrophobicContact CD2-CZ 3.97Å; L117-F121 HydrophobicContact CG-CE2 4.47Å; L117-F121 VanDerWaalsContact O-CB 3.32Å; L117-F121 WeakPolarHBondContact O-CB 3.4Å; L117-F121 WeakPolarHBondContact O-CD2 3.3Å; L117-F121 WeakPolarHBondContact O-CG 3.48Å; L117-F121 PolarHBondContact O-N 2.97Å; E119-F121 VanDerWaalsContact C-N 3.33Å; E119-F121 PolarHBondContact O-N 2.9Å; F121-W124 HydrophobicContact CB-CE3 3.8Å; F121-W124 HydrophobicContact CB-CZ3 3.95Å; F121-W124 HydrophobicContact CD1-CD2 4.42Å; F121-W124 AromaticContact CD1-CE3 3.5Å; F121-W124 HydrophobicContact CD1-CE3 3.5Å; F121-W124 VanDerWaalsContact CD1-CE3 3.5Å; F121-W124 AromaticContact CD1-CH2 3.74Å; F121-W124 HydrophobicContact CD1-CH2 3.74Å; F121-W124 AromaticContact CD1-CZ3 3.1Å; F121-W124 HydrophobicContact CD1-CZ3 3.1Å; F121-W124 HydrophobicContact CE1-CE3 4.42Å; F121-W124 AromaticContact CE1-CH2 3.85Å; F121-W124 HydrophobicContact CE1-CH2 3.85Å; F121-W124 AromaticContact CE1-CZ3 3.68Å; F121-W124 HydrophobicContact CE1-CZ3 3.68Å; F121-W124 AromaticContact CG-CE3 3.97Å; F121-W124 HydrophobicContact CG-CE3 3.97Å; F121-W124 AromaticContact CG-CZ3 3.65Å; F121-W124 HydrophobicContact CG-CZ3 3.65Å
122	S	54.1	Low	51	Low	67 Å²	67	72.2 Å²	72.2	47%	0.469	36%	0.36	S	S	.	.	H	α-helix	trans	-83.5	-27	169.4	76.8	0	0	0	0	112.9	Y91 K118 E119 Y120 W124	Y91-S122 WeakPolarHBondContact OH-CA 3.21Å; Y91-S122 WeakPolarHBondContact OH-CB 3.35Å; K118-S122 WeakPolarHBondContact O-CB 3.08Å; K118-S122 PolarHBondContact O-N 2.89Å; E119-S122 WeakPolarHBondContact O-CA 3.32Å; E119-S122 WeakPolarHBondContact O-CB 3.5Å; E119-S122 PolarHBondContact O-N 3.18Å; E119-S122 PolarHBondContact O-OG 3.15Å; Y120-S122 VanDerWaalsContact C-N 3.34Å; S122-W124 VanDerWaalsContact C-N 3.27Å; S122-W124 PolarHBondContact O-N 2.92Å
123	S	52.8	Low	50.7	Low	38 Å²	38	72.5 Å²	72.5	27%	0.266	36%	0.362	S	S	.	.	S	Bend	trans	-89.3	19.1	174.6	60.1	0	0	0	0	113.8	E119 Y120 D125 H126 H127	E119-S123 PolarHBondContact O-N 2.91Å; Y120-S123 PolarHBondContact O-OG 3.03Å; S123-D125 VanDerWaalsContact C-N 3.33Å; S123-D125 PolarHBondContact O-N 3.02Å; S123-H126 PolarHBondContact O-N 3.34Å; S123-H127 PolarHBondContact O-CD2 3.47Å; S123-H127 PolarHBondContact OG-CD2 2.84Å; S123-H127 VanDerWaalsContact OG-CD2 3.25Å
124	W	53.7	Low	50	Low	31 Å²	31	70.7 Å²	70.7	12%	0.117	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-54.2	-44.7	-166.2	-156	-55.4	0	0	0	113.6	P83 I86 T87 F121 S122 H126 H127 I130	P83-W124 VanDerWaalsContact CA-CZ2 3.45Å; P83-W124 HydrophobicContact CB-CD2 4.27Å; P83-W124 VanDerWaalsContact CB-CE2 3.46Å; P83-W124 HydrophobicContact CB-CH2 4.39Å; P83-W124 HydrophobicContact CB-CZ2 3.55Å; P83-W124 HydrophobicContact CG-CZ2 3.99Å; P83-W124 WeakPolarHBondContact O-CH2 3.2Å; I86-W124 HydrophobicContact CB-CH2 3.74Å; I86-W124 HydrophobicContact CB-CZ3 3.88Å; I86-W124 HydrophobicContact CD1-CH2 4.4Å; I86-W124 HydrophobicContact CG2-CH2 3.99Å; I86-W124 HydrophobicContact CG2-CZ3 3.85Å; T87-W124 HydrophobicContact CG2-CE3 4.15Å; T87-W124 WeakPolarHBondContact OG1-CZ3 3.41Å; F121-W124 HydrophobicContact CB-CE3 3.8Å; F121-W124 HydrophobicContact CB-CZ3 3.95Å; F121-W124 HydrophobicContact CD1-CD2 4.42Å; F121-W124 AromaticContact CD1-CE3 3.5Å; F121-W124 HydrophobicContact CD1-CE3 3.5Å; F121-W124 VanDerWaalsContact CD1-CE3 3.5Å; F121-W124 AromaticContact CD1-CH2 3.74Å; F121-W124 HydrophobicContact CD1-CH2 3.74Å; F121-W124 AromaticContact CD1-CZ3 3.1Å; F121-W124 HydrophobicContact CD1-CZ3 3.1Å; F121-W124 HydrophobicContact CE1-CE3 4.42Å; F121-W124 AromaticContact CE1-CH2 3.85Å; F121-W124 HydrophobicContact CE1-CH2 3.85Å; F121-W124 AromaticContact CE1-CZ3 3.68Å; F121-W124 HydrophobicContact CE1-CZ3 3.68Å; F121-W124 AromaticContact CG-CE3 3.97Å; F121-W124 HydrophobicContact CG-CE3 3.97Å; F121-W124 AromaticContact CG-CZ3 3.65Å; F121-W124 HydrophobicContact CG-CZ3 3.65Å; S122-W124 VanDerWaalsContact C-N 3.27Å; S122-W124 PolarHBondContact O-N 2.92Å; W124-H126 PolarHBondContact O-N 2.67Å; W124-H127 PolarHBondContact O-N 2.93Å; W124-I130 HydrophobicContact CB-CD1 4.42Å; W124-I130 HydrophobicContact CD2-CD1 3.9Å; W124-I130 HydrophobicContact CG-CD1 3.73Å; W124-I130 HydrophobicContact CH2-CG2 4.33Å; W124-I130 HydrophobicContact CZ2-CD1 4.4Å; W124-I130 HydrophobicContact CZ2-CG2 3.6Å
125	D	45.4	Very low	49.3	Very low	156 Å²	156	69.2 Å²	69.2	83%	0.834	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-60.4	-5.7	-174.9	-73.5	-35.9	0	0	0	114.7	S123	S123-D125 VanDerWaalsContact C-N 3.33Å; S123-D125 PolarHBondContact O-N 3.02Å
126	H	40.2	Very low	48.4	Very low	157 Å²	157	68.2 Å²	68.2	73%	0.727	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-119.6	-17.3	-175.8	-58.2	-19.5	0	0	0	114.4	S123 W124 K128	S123-H126 PolarHBondContact O-N 3.34Å; W124-H126 PolarHBondContact O-N 2.67Å; H126-K128 PolarHBondContact O-N 2.92Å
127	H	42	Very low	47.5	Very low	75 Å²	75	66.8 Å²	66.8	35%	0.347	32%	0.322	S	S	.	.			trans	-97.3	87.5	-172.2	-73	-68.7	0	0	0	114.4	S123 W124 S129 I130	S123-H127 PolarHBondContact O-CD2 3.47Å; S123-H127 PolarHBondContact OG-CD2 2.84Å; S123-H127 VanDerWaalsContact OG-CD2 3.25Å; W124-H127 PolarHBondContact O-N 2.93Å; H127-S129 PolarHBondContact O-N 3Å; H127-I130 HydrophobicContact CB-CD1 3.86Å; H127-I130 HydrophobicContact CB-CG1 3.87Å; H127-I130 WeakPolarHBondContact O-CG1 3.39Å; H127-I130 PolarHBondContact O-N 3.09Å; H127-I130 VanDerWaalsContact O-N 3.11Å
128	K	37.4	Very low	46.8	Very low	190 Å²	190	67.4 Å²	67.4	83%	0.826	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-15.3	170.1	-64.2	-178	179.8	178.9	0	115.1	H126	H126-K128 PolarHBondContact O-N 2.92Å
129	S	39.1	Very low	45.8	Very low	42 Å²	42	63.6 Å²	63.6	29%	0.294	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-5.4	-178.5	62.1	0	0	0	0	115	H127 Y132 Q133	H127-S129 PolarHBondContact O-N 3Å; S129-Y132 CarbonylContact O-C 2.85Å; S129-Y132 WeakPolarHBondContact O-CA 3.25Å; S129-Y132 WeakPolarHBondContact O-CB 3.19Å; S129-Y132 PolarHBondContact O-N 3.48Å; S129-Q133 PolarHBondContact O-N 3.08Å; S129-Q133 PolarHBondContact OG-NE2 2.88Å
130	I	37.6	Very low	44.5	Very low	3 Å²	3	57.4 Å²	57.4	2%	0.015	28%	0.282	C	S	.	.	H	α-helix	trans	-55.4	-48.2	-173.5	-70.8	166	0	0	0	113.5	Y120 W124 H127 Y132 Q133 L134	Y120-I130 HydrophobicContact CE1-CG1 3.82Å; Y120-I130 WeakPolarHBondContact OH-CG1 3.49Å; W124-I130 HydrophobicContact CB-CD1 4.42Å; W124-I130 HydrophobicContact CD2-CD1 3.9Å; W124-I130 HydrophobicContact CG-CD1 3.73Å; W124-I130 HydrophobicContact CH2-CG2 4.33Å; W124-I130 HydrophobicContact CZ2-CD1 4.4Å; W124-I130 HydrophobicContact CZ2-CG2 3.6Å; H127-I130 HydrophobicContact CB-CD1 3.86Å; H127-I130 HydrophobicContact CB-CG1 3.87Å; H127-I130 WeakPolarHBondContact O-CG1 3.39Å; H127-I130 PolarHBondContact O-N 3.09Å; H127-I130 VanDerWaalsContact O-N 3.11Å; I130-Y132 VanDerWaalsContact C-N 3.33Å; I130-Y132 PolarHBondContact O-N 3.25Å; I130-Q133 PolarHBondContact O-N 3.18Å; I130-Q133 VanDerWaalsContact O-N 3.16Å; I130-L134 HydrophobicContact CG2-CD1 3.66Å; I130-L134 HydrophobicContact CG2-CG 4.25Å; I130-L134 WeakPolarHBondContact O-CB 3.45Å; I130-L134 WeakPolarHBondContact O-CG 3.47Å; I130-L134 PolarHBondContact O-N 3.11Å
131	P	39.4	Very low	43.7	Very low	23 Å²	23	59.8 Å²	59.8	15%	0.149	30%	0.299	C	S	.	.	H	α-helix	trans	-59	-42.6	175.3	-27.7	37.5	0	0	0	113	I80 Q133 L134 I135 N225	I80-P131 HydrophobicContact CG2-CB 3.61Å; I80-P131 HydrophobicContact CG2-CG 4.12Å; P131-Q133 PolarHBondContact O-N 2.88Å; P131-L134 PolarHBondContact O-N 3.45Å; P131-I135 WeakPolarHBondContact O-CB 3.35Å; P131-I135 WeakPolarHBondContact O-CD1 3.24Å; P131-I135 WeakPolarHBondContact O-CG1 3.49Å; P131-I135 PolarHBondContact O-N 2.87Å; P131-N225 HydrophobicContact CG-CB 4.18Å
132	Y	39.4	Very low	42.4	Very low	137 Å²	137	66.6 Å²	66.6	54%	0.537	33%	0.329	S	S	.	.	H	α-helix	trans	-67.1	-33.3	177.1	180	-101.9	0	0	0	112.9	S129 I130 R136	S129-Y132 CarbonylContact O-C 2.85Å; S129-Y132 WeakPolarHBondContact O-CA 3.25Å; S129-Y132 WeakPolarHBondContact O-CB 3.19Å; S129-Y132 PolarHBondContact O-N 3.48Å; I130-Y132 VanDerWaalsContact C-N 3.33Å; I130-Y132 PolarHBondContact O-N 3.25Å; Y132-R136 HydrophobicContact CE1-CG 4.31Å; Y132-R136 WeakPolarHBondContact O-CB 3.2Å; Y132-R136 WeakPolarHBondContact O-CG 3.45Å; Y132-R136 PolarHBondContact O-N 3.1Å; Y132-R136 PolarHBondContact OH-NE 3.1Å; Y132-R136 PolarHBondContact OH-NH2 3.27Å
133	Q	42.7	Very low	41.2	Very low	39 Å²	39	65.7 Å²	65.7	18%	0.182	33%	0.331	C	S	.	.	H	α-helix	trans	-73.6	-41.2	174.2	-69.8	-156.1	55.3	0	0	111.9	Y112 Y120 S129 I130 P131 R136 C137	Y112-Q133 PolarHBondContact OH-OE1 2.9Å; Y120-Q133 WeakPolarHBondContact OH-CB 3.32Å; Y120-Q133 PolarHBondContact OH-NE2 2.79Å; S129-Q133 PolarHBondContact O-N 3.08Å; S129-Q133 PolarHBondContact OG-NE2 2.88Å; I130-Q133 PolarHBondContact O-N 3.18Å; I130-Q133 VanDerWaalsContact O-N 3.16Å; P131-Q133 PolarHBondContact O-N 2.88Å; Q133-R136 CarbonylContact O-C 3.55Å; Q133-R136 WeakPolarHBondContact O-CA 3.26Å; Q133-R136 VanDerWaalsContact O-CB 3.3Å; Q133-R136 WeakPolarHBondContact O-CB 3.35Å; Q133-R136 PolarHBondContact O-N 3.31Å; Q133-R136 VanDerWaalsContact O-N 3.11Å; Q133-C137 PolarHBondContact O-N 3.32Å; Q133-C137 PolarHBondContact O-SG 3.11Å
134	L	46.4	Very low	40.2	Very low	7 Å²	7	68.4 Å²	68.4	4%	0.037	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-38.6	175.3	-69.9	171.2	0	0	0	111.6	I80 I86 L106 I130 P131 R136 C137 L138	I80-L134 HydrophobicContact CD1-CB 3.72Å; I80-L134 HydrophobicContact CG1-CB 3.58Å; I80-L134 HydrophobicContact CG1-CD1 3.64Å; I80-L134 HydrophobicContact CG1-CG 4.24Å; I86-L134 HydrophobicContact CD1-CD1 4.12Å; L106-L134 HydrophobicContact CD2-CD2 3.94Å; I130-L134 HydrophobicContact CG2-CD1 3.66Å; I130-L134 HydrophobicContact CG2-CG 4.25Å; I130-L134 WeakPolarHBondContact O-CB 3.45Å; I130-L134 WeakPolarHBondContact O-CG 3.47Å; I130-L134 PolarHBondContact O-N 3.11Å; P131-L134 PolarHBondContact O-N 3.45Å; L134-R136 VanDerWaalsContact C-N 3.32Å; L134-R136 PolarHBondContact O-N 3.41Å; L134-C137 CarbonylContact O-C 3.47Å; L134-C137 WeakPolarHBondContact O-CA 3.48Å; L134-C137 VanDerWaalsContact O-CB 3.26Å; L134-C137 WeakPolarHBondContact O-CB 3.45Å; L134-C137 PolarHBondContact O-N 2.91Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 2.91Å
135	I	45.4	Very low	39.1	Very low	40 Å²	40	70.9 Å²	70.9	21%	0.205	35%	0.345	C	S	.	.	H	α-helix	trans	-59.6	-42.9	166.6	-68.7	163	0	0	0	110.4	P131 C137 L138 L139 L229	P131-I135 WeakPolarHBondContact O-CB 3.35Å; P131-I135 WeakPolarHBondContact O-CD1 3.24Å; P131-I135 WeakPolarHBondContact O-CG1 3.49Å; P131-I135 PolarHBondContact O-N 2.87Å; I135-C137 PolarHBondContact O-N 2.98Å; I135-L138 PolarHBondContact O-N 3.39Å; I135-L138 VanDerWaalsContact O-N 3.17Å; I135-L139 HydrophobicContact CG2-CD1 4.34Å; I135-L139 VanDerWaalsContact O-CG 3.31Å; I135-L139 WeakPolarHBondContact O-CG 3.34Å; I135-L139 PolarHBondContact O-N 3.41Å; I135-L139 VanDerWaalsContact O-N 3.1Å; I135-L229 HydrophobicContact CD1-CD1 3.89Å; I135-L229 HydrophobicContact CG1-CD1 4.21Å
136	R	43.5	Very low	38.2	Very low	108 Å²	108	67.3 Å²	67.3	41%	0.408	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-23.6	171.9	-85	-173.9	175.5	-152.1	5.3	113.7	Y132 Q133 L134 L139 R145	Y132-R136 HydrophobicContact CE1-CG 4.31Å; Y132-R136 WeakPolarHBondContact O-CB 3.2Å; Y132-R136 WeakPolarHBondContact O-CG 3.45Å; Y132-R136 PolarHBondContact O-N 3.1Å; Y132-R136 PolarHBondContact OH-NE 3.1Å; Y132-R136 PolarHBondContact OH-NH2 3.27Å; Q133-R136 CarbonylContact O-C 3.55Å; Q133-R136 WeakPolarHBondContact O-CA 3.26Å; Q133-R136 VanDerWaalsContact O-CB 3.3Å; Q133-R136 WeakPolarHBondContact O-CB 3.35Å; Q133-R136 PolarHBondContact O-N 3.31Å; Q133-R136 VanDerWaalsContact O-N 3.11Å; L134-R136 VanDerWaalsContact C-N 3.32Å; L134-R136 PolarHBondContact O-N 3.41Å; R136-L139 VanDerWaalsContact O-O 3.04Å; R136-R145 PolarHBondContact O-NH2 3.17Å
137	C	42.3	Very low	37.4	Very low	17 Å²	17	64.3 Å²	64.3	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-77.7	-44.1	171.7	-61.9	0	0	0	0	110.5	I109 S110 Q133 L134 I135 L139	I109-C137 HydrophobicContact CG2-CB 3.84Å; I109-C137 WeakPolarHBondContact CG2-O 3.29Å; S110-C137 WeakPolarHBondContact CB-SG 3.36Å; Q133-C137 PolarHBondContact O-N 3.32Å; Q133-C137 PolarHBondContact O-SG 3.11Å; L134-C137 CarbonylContact O-C 3.47Å; L134-C137 WeakPolarHBondContact O-CA 3.48Å; L134-C137 VanDerWaalsContact O-CB 3.26Å; L134-C137 WeakPolarHBondContact O-CB 3.45Å; L134-C137 PolarHBondContact O-N 2.91Å; I135-C137 PolarHBondContact O-N 2.98Å; C137-L139 PolarHBondContact O-N 2.88Å; C137-L139 VanDerWaalsContact O-O 3.06Å
138	L	44.6	Very low	36.6	Very low	16 Å²	16	70.1 Å²	70.1	8%	0.084	35%	0.352	C	S	.	.	H	α-helix	trans	-58.3	-21.6	173.5	-59.3	-172.4	0	0	0	113	F73 I76 I77 I80 L134 I135	F73-L138 HydrophobicContact CD2-CD2 3.94Å; F73-L138 HydrophobicContact CE2-CB 4.33Å; F73-L138 HydrophobicContact CE2-CD1 4.13Å; F73-L138 HydrophobicContact CE2-CD2 3.62Å; F73-L138 HydrophobicContact CE2-CG 4.23Å; F73-L138 HydrophobicContact CZ-CD1 3.92Å; F73-L138 HydrophobicContact CZ-CD2 4.25Å; I76-L138 HydrophobicContact CB-CD2 4.34Å; I76-L138 HydrophobicContact CD1-CD2 4.31Å; I76-L138 HydrophobicContact CG2-CD2 3.79Å; I76-L138 HydrophobicContact CG2-CG 4.48Å; I77-L138 HydrophobicContact CG1-CD1 4.33Å; I80-L138 HydrophobicContact CD1-CD1 4.28Å; L134-L138 WeakPolarHBondContact O-CG 3.32Å; L134-L138 PolarHBondContact O-N 2.91Å; I135-L138 PolarHBondContact O-N 3.39Å; I135-L138 VanDerWaalsContact O-N 3.17Å
139	L	40.1	Very low	36	Very low	27 Å²	27	66 Å²	66	14%	0.141	35%	0.347	C	S	.	.	S	Bend	trans	-88.6	142.4	171.8	-64.2	171	0	0	0	111.2	Y61 I135 R136 C137 R145	Y61-L139 HydrophobicContact CD2-CD2 3.48Å; Y61-L139 VanDerWaalsContact CD2-CD2 3.48Å; Y61-L139 HydrophobicContact CE2-CD2 4.37Å; Y61-L139 HydrophobicContact CG-CD2 3.77Å; I135-L139 HydrophobicContact CG2-CD1 4.34Å; I135-L139 VanDerWaalsContact O-CG 3.31Å; I135-L139 WeakPolarHBondContact O-CG 3.34Å; I135-L139 PolarHBondContact O-N 3.41Å; I135-L139 VanDerWaalsContact O-N 3.1Å; R136-L139 VanDerWaalsContact O-O 3.04Å; C137-L139 PolarHBondContact O-N 2.88Å; C137-L139 VanDerWaalsContact O-O 3.06Å; L139-R145 VanDerWaalsContact CB-CZ 3.45Å; L139-R145 VanDerWaalsContact CB-NH2 3.27Å; L139-R145 PolarHBondContact O-NH2 2.8Å
140	P	35	Very low	35.3	Very low	11 Å²	11	70.7 Å²	70.7	7%	0.071	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-50.9	150.5	-174.8	-29.7	35.8	0	0	0	115.1	Y61 Y65 R145	Y61-P140 VanDerWaalsContact O-CD 3.32Å; Y61-P140 WeakPolarHBondContact O-CD 3.46Å; Y61-P140 VanDerWaalsContact O-CG 3.24Å; Y61-P140 WeakPolarHBondContact O-CG 3.27Å; Y65-P140 HydrophobicContact CD2-CG 4Å; Y65-P140 HydrophobicContact CE1-CB 4.41Å; Y65-P140 HydrophobicContact CE1-CG 4.2Å; Y65-P140 HydrophobicContact CE2-CB 4.15Å; Y65-P140 HydrophobicContact CE2-CG 3.38Å; Y65-P140 VanDerWaalsContact CZ-CG 3.5Å; Y65-P140 WeakPolarHBondContact OH-CB 3.25Å; P140-R145 PolarHBondContact O-NE 3.19Å; P140-R145 PolarHBondContact O-NH2 3.01Å
141	P	39.2	Very low	34.7	Very low	70 Å²	70	76.2 Å²	76.2	46%	0.455	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-53.9	147.2	-174.7	-25.6	33.7	0	0	0	113.1	G143 Y144	P141-G143 PolarHBondContact O-N 3.39Å; P141-Y144 HydrophobicContact CB-CD2 4.07Å; P141-Y144 HydrophobicContact CG-CD2 4.31Å; P141-Y144 WeakPolarHBondContact O-CB 3.24Å; P141-Y144 PolarHBondContact O-N 3.42Å
142	F	30.4	Very low	34.1	Very low	145 Å²	145	79.9 Å²	79.9	64%	0.636	43%	0.43	S	S	*	.	H	α-helix	trans	-56.2	-35.9	-164.9	-155.9	-91.5	0	0	0	113.8	Y144 R145	F142-Y144 VanDerWaalsContact C-N 3.25Å; F142-Y144 PolarHBondContact O-N 3.26Å; F142-R145 WeakPolarHBondContact O-CB 3.15Å; F142-R145 PolarHBondContact O-N 3.06Å
143	G	29.3	Very low	33.4	Very low	48 Å²	48	81 Å²	81	50%	0.495	45%	0.445	S	S	.	.	H	α-helix	trans	-60.4	-26.4	175.1	0	0	0	0	0	115.1	P141 S146 C147	P141-G143 PolarHBondContact O-N 3.39Å; G143-S146 PolarHBondContact O-OG 3.11Å; G143-C147 PolarHBondContact O-SG 3.01Å; G143-C147 VanDerWaalsContact O-SG 3.37Å
144	Y	32.1	Very low	32.7	Very low	94 Å²	94	88.4 Å²	88.4	37%	0.369	48%	0.476	S	S	.	.	H	α-helix	trans	-79.1	-21.5	174.4	-70.4	-104.5	0	0	0	112.4	Q24 P141 F142 S146	Q24-Y144 VanDerWaalsContact OE1-CE1 3.27Å; Q24-Y144 VanDerWaalsContact OE1-CZ 3.28Å; Q24-Y144 PolarHBondContact OE1-OH 3.17Å; P141-Y144 HydrophobicContact CB-CD2 4.07Å; P141-Y144 HydrophobicContact CG-CD2 4.31Å; P141-Y144 WeakPolarHBondContact O-CB 3.24Å; P141-Y144 PolarHBondContact O-N 3.42Å; F142-Y144 VanDerWaalsContact C-N 3.25Å; F142-Y144 PolarHBondContact O-N 3.26Å; Y144-S146 VanDerWaalsContact C-N 3.32Å
145	R	29.7	Very low	31.7	Very low	83 Å²	83	93.1 Å²	93.1	31%	0.313	51%	0.508	S	S	.	.	H	α-helix	trans	-79.2	-16.6	177.7	-53.4	-174.5	-155	177.4	13.7	112.8	R136 L139 P140 F142	R136-R145 PolarHBondContact O-NH2 3.17Å; L139-R145 VanDerWaalsContact CB-CZ 3.45Å; L139-R145 VanDerWaalsContact CB-NH2 3.27Å; L139-R145 PolarHBondContact O-NH2 2.8Å; P140-R145 PolarHBondContact O-NE 3.19Å; P140-R145 PolarHBondContact O-NH2 3.01Å; F142-R145 WeakPolarHBondContact O-CB 3.15Å; F142-R145 PolarHBondContact O-N 3.06Å
146	S	25.9	Very low	30.8	Very low	81 Å²	81	99.7 Å²	99.7	57%	0.566	54%	0.537	S	S	*	.	S	Bend	trans	-95.5	-6.4	179.9	41.5	0	0	0	0	114.9	G143 Y144 K148	G143-S146 PolarHBondContact O-OG 3.11Å; Y144-S146 VanDerWaalsContact C-N 3.32Å; S146-K148 PolarHBondContact O-N 2.85Å
147	C	23.3	Very low	30	Very low	95 Å²	95	103.1 Å²	103.1	64%	0.642	56%	0.558	S	S	*	*			trans	-75.7	53.7	-178.1	-69.9	0	0	0	0	114.2	G143 S149	G143-C147 PolarHBondContact O-SG 3.01Å; G143-C147 VanDerWaalsContact O-SG 3.37Å; C147-S149 PolarHBondContact O-N 3.26Å
148	K	24.9	Very low	29.3	Very low	196 Å²	196	110.9 Å²	110.9	85%	0.852	59%	0.592	S	S	*	*			trans	-89.8	51.8	156.2	-79.9	-164	171.8	-167.8	0	110.5	S146 I150	S146-K148 PolarHBondContact O-N 2.85Å; K148-I150 PolarHBondContact O-N 3.22Å; K148-I150 VanDerWaalsContact O-N 3.11Å
149	S	26.2	Very low	28.4	Very low	103 Å²	103	117.6 Å²	117.6	72%	0.72	63%	0.627	S	S	*	*			trans	-81.9	83.3	172.4	53.9	0	0	0	0	109.9	C147 P151	C147-S149 PolarHBondContact O-N 3.26Å; S149-P151 WeakPolarHBondContact O-CD 3.47Å
150	I	24.4	Very low	27.8	Very low	142 Å²	142	122.8 Å²	122.8	73%	0.728	65%	0.653	S	S	*	*			trans	-60.4	124.4	167.4	-60.9	169.1	0	0	0	107.7	K148 S152	K148-I150 PolarHBondContact O-N 3.22Å; K148-I150 VanDerWaalsContact O-N 3.11Å; I150-S152 PolarHBondContact O-N 3.24Å
151	P	24.1	Very low	27.4	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	69%	0.687	S	S	*	*			trans	-79.1	72.2	178.5	32.2	-34.5	0	0	0	110.9	S149 N153	S149-P151 WeakPolarHBondContact O-CD 3.47Å; P151-N153 PolarHBondContact O-N 3.13Å
152	S	26.4	Very low	26.7	Very low	99 Å²	99	135.8 Å²	135.8	69%	0.692	71%	0.707	S	S	*	*			trans	-79.3	94.6	172.8	57.7	0	0	0	0	110.3	I150 K154	I150-S152 PolarHBondContact O-N 3.24Å; S152-K154 PolarHBondContact O-N 3.23Å
153	N	25.8	Very low	26.6	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	72%	0.716	S	S	*	*			trans	-62.4	91.3	176.9	-81.5	-17	0	0	0	112.4	P151	P151-N153 PolarHBondContact O-N 3.13Å
154	K	27.5	Very low	26.3	Very low	195 Å²	195	148.3 Å²	148.3	85%	0.848	74%	0.735	S	S	*	*			trans	-141.2	124	158.2	-72	-164.6	176.3	-176.2	0	110.1	S152	S152-K154 PolarHBondContact O-N 3.23Å
155	P	24.6	Very low	26.2	Very low	107 Å²	107	150.8 Å²	150.8	70%	0.695	75%	0.754	S	S	*	*			trans	-84.8	167.7	176.8	34.6	-35.3	0	0	0	113
156	H	26.6	Very low	26	Very low	177 Å²	177	153.4 Å²	153.4	82%	0.819	77%	0.773	S	S	*	*			trans	79.4	158.5	169.5	-54.8	-52.2	0	0	0	118.7
157	Q	28.3	Very low	26	Very low	181 Å²	181	156.2 Å²	156.2	85%	0.846	79%	0.789	S	S	*	*			trans	66.3	88.8	-178.1	-54.9	-179.7	2.4	0	0	112.2
158	Q	26.2	Very low	26	Very low	179 Å²	179	156 Å²	156	84%	0.836	79%	0.789	S	S	*	*				57.9	155.7	63.4	-61	-168.8	-25	0	0	114.5
159	I	26.1	Very low	26.1	Very low	158 Å²	158	155.8 Å²	155.8	81%	0.81	79%	0.788	S	S	*	*			trans	63.8	144.3	174.9	-0.5	-178.9	0	0	0	112
160	I	27.6	Very low	26	Very low	136 Å²	136	160.1 Å²	160.1	70%	0.697	80%	0.797	S	S	*	*			cis	-141.6	134.1	24.3	-74.3	-178.7	0	0	0	112.4
161	Q	26.1	Very low	26	Very low	167 Å²	167	159 Å²	159	78%	0.78	79%	0.793	S	S	*	*			trans	39.3	131.2	147.6	-59.1	165.9	-7.2	0	0	122.9	R163	Q161-R163 PolarHBondContact O-N 3.45Å
162	Q	25.6	Very low	26.1	Very low	186 Å²	186	162.1 Å²	162.1	87%	0.869	80%	0.797	S	S	*	*			trans	-37.5	127.7	143.9	-58.7	163.2	-11.2	0	0	112.8
163	R	27.5	Very low	26.2	Very low	219 Å²	219	164.8 Å²	164.8	83%	0.826	80%	0.798	S	S	*	*			trans	-113.7	109.7	156.8	-83.1	-168.9	172.6	-168	-1.4	110.3	Q161 L165	Q161-R163 PolarHBondContact O-N 3.45Å; R163-L165 PolarHBondContact O-N 2.9Å
164	R	23.9	Very low	26.3	Very low	238 Å²	238	161.3 Å²	161.3	90%	0.898	78%	0.779	S	S	*	*			trans	-63.4	124.8	159.8	-65.3	176	178	171.2	-2.1	107.6
165	L	28.7	Very low	26.2	Very low	145 Å²	145	159.4 Å²	159.4	76%	0.759	78%	0.778	S	S	*	*			trans	-126.6	148.2	168.7	-79.6	168.1	0	0	0	109.1	R163	R163-L165 PolarHBondContact O-N 2.9Å
166	L	27.1	Very low	26.3	Very low	139 Å²	139	159.5 Å²	159.5	73%	0.728	78%	0.776	S	S	*	*			trans	-76.3	143.1	-153.7	-76.7	67.2	0	0	0	113.3	S168	L166-S168 VanDerWaalsContact C-N 3.28Å; L166-S168 PolarHBondContact O-N 2.79Å
167	P	25.4	Very low	26.2	Very low	139 Å²	139	154.8 Å²	154.8	90%	0.903	76%	0.761	S	S	*	*	S	Bend	trans	-78.2	72	175.8	34.1	-35.9	0	0	0	111.2
168	S	23.8	Very low	26	Very low	90 Å²	90	151.7 Å²	151.7	63%	0.629	76%	0.759	S	S	*	*			trans	-148.3	49.5	-178.3	69.4	0	0	0	0	114.6	L166	L166-S168 VanDerWaalsContact C-N 3.28Å; L166-S168 PolarHBondContact O-N 2.79Å
169	K	26	Very low	26	Very low	192 Å²	192	150.1 Å²	150.1	84%	0.835	75%	0.752	S	S	*	*			trans	-174.2	98.5	152.2	-105.8	163.4	-174.1	179.7	0	110.1	N171	K169-N171 PolarHBondContact O-N 3.27Å
170	Q	23.6	Very low	25.9	Very low	195 Å²	195	151.9 Å²	151.9	91%	0.911	76%	0.756	S	S	*	*			trans	-72.4	104.9	168.3	-75.8	175.6	-44.5	0	0	109
171	N	25.4	Very low	25.7	Very low	119 Å²	119	153.3 Å²	153.3	64%	0.636	76%	0.76	S	S	*	*			trans	-90.6	136.9	160.7	-76	-14.8	0	0	0	108	K169 H173	K169-N171 PolarHBondContact O-N 3.27Å; N171-H173 PolarHBondContact O-N 3.03Å
172	H	26.6	Very low	25.5	Very low	184 Å²	184	152.1 Å²	152.1	85%	0.852	76%	0.764	S	S	*	*			trans	-73.3	66.5	-179.7	-63.9	-80.7	0	0	0	112.9
173	H	28	Very low	25.4	Very low	154 Å²	154	147.5 Å²	147.5	71%	0.713	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-97.8	130	160.9	-67.2	-51.2	0	0	0	108.4	N171 D175	N171-H173 PolarHBondContact O-N 3.03Å; H173-D175 PolarHBondContact O-N 3.33Å
174	L	28.1	Very low	25	Very low	88 Å²	88	148.2 Å²	148.2	46%	0.461	76%	0.755	S	S	.	*	P	Polyproline II helix	trans	-68.4	117.4	176.7	-69.3	164	0	0	0	108.7	Y112 Y120 V176	Y112-L174 WeakPolarHBondContact OH-CD1 3.19Å; Y120-L174 HydrophobicContact CD2-CD1 3.95Å; Y120-L174 HydrophobicContact CE2-CD1 3.89Å; L174-V176 PolarHBondContact O-N 3.09Å
175	D	25.7	Very low	25	Very low	154 Å²	154	146 Å²	146	82%	0.824	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-65.5	119.2	170.7	-76.6	-48.7	0	0	0	109.1	H173 P177	H173-D175 PolarHBondContact O-N 3.33Å; D175-P177 WeakPolarHBondContact O-CD 3.22Å
176	V	27	Very low	24.6	Very low	110 Å²	110	145.2 Å²	145.2	67%	0.667	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-76.1	120.6	178.5	179.1	0	0	0	0	108.6	L174 S178	L174-V176 PolarHBondContact O-N 3.09Å; V176-S178 PolarHBondContact O-N 3.17Å
177	P	24.5	Very low	24.5	Very low	78 Å²	78	147.4 Å²	147.4	51%	0.506	76%	0.762	S	S	.	*	P	Polyproline II helix	trans	-64.2	118.1	-176.7	-22.9	34.2	0	0	0	112.2	D175 H179	D175-P177 WeakPolarHBondContact O-CD 3.22Å; P177-H179 PolarHBondContact O-N 3.16Å
178	S	22.8	Very low	24.3	Very low	115 Å²	115	152.2 Å²	152.2	80%	0.804	76%	0.762	S	S	*	*			trans	-79.5	55	177.5	52.5	0	0	0	0	112.4	V176	V176-S178 PolarHBondContact O-N 3.17Å
179	H	27.1	Very low	24.2	Very low	147 Å²	147	153.7 Å²	153.7	68%	0.681	77%	0.773	S	S	*	*			trans	-111.4	108.2	-174.5	-78.9	-52.7	0	0	0	114.3	P177 Q181	P177-H179 PolarHBondContact O-N 3.16Å; H179-Q181 PolarHBondContact O-N 2.65Å
180	H	24	Very low	24.3	Very low	194 Å²	194	150.2 Å²	150.2	90%	0.898	77%	0.772	S	S	*	*			trans	-65.3	97.3	157.8	-63.9	-82.5	0	0	0	109.9
181	Q	23.2	Very low	24.3	Very low	166 Å²	166	145.3 Å²	145.3	78%	0.776	77%	0.766	S	S	*	*			trans	-127.7	118.2	166.1	-73.9	-166.2	-6.3	0	0	110.9	H179 S183	H179-Q181 PolarHBondContact O-N 2.65Å; Q181-S183 PolarHBondContact O-N 2.81Å
182	V	21.7	Very low	24.2	Very low	142 Å²	142	149.7 Å²	149.7	86%	0.861	78%	0.779	S	S	*	*			trans	-92.4	90.2	179.3	-178.2	0	0	0	0	109.1	R184	V182-R184 PolarHBondContact O-N 3.33Å
183	S	22.8	Very low	24.1	Very low	89 Å²	89	146.7 Å²	146.7	62%	0.622	78%	0.779	S	S	*	*			trans	-80.5	100.7	177.4	47.6	0	0	0	0	111.7	Q181 F185	Q181-S183 PolarHBondContact O-N 2.81Å; S183-F185 PolarHBondContact O-N 3.38Å
184	R	20.3	Very low	23.9	Very low	234 Å²	234	149.4 Å²	149.4	88%	0.883	79%	0.788	S	S	*	*			trans	-69.3	111.7	169.7	-75.7	-179.7	173.9	162.1	-2.3	110.3	V182	V182-R184 PolarHBondContact O-N 3.33Å
185	F	24.3	Very low	23.8	Very low	191 Å²	191	150.8 Å²	150.8	84%	0.838	81%	0.806	S	S	*	*			trans	-102.6	106.7	167.8	-84.3	-84.4	0	0	0	111.3	S183 M187	S183-F185 PolarHBondContact O-N 3.38Å; F185-M187 PolarHBondContact O-N 3.29Å
186	T	19.6	Very low	23.6	Very low	129 Å²	129	148.6 Å²	148.6	79%	0.791	80%	0.8	S	S	*	*			trans	-85.2	103.9	172.6	49.8	0	0	0	0	110.6	R188	T186-R188 PolarHBondContact O-N 2.79Å
187	M	23.7	Very low	23.4	Very low	185 Å²	185	150.3 Å²	150.3	91%	0.911	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.3	166.3	-106.6	-172	170.7	0	0	110.1	F185	F185-M187 PolarHBondContact O-N 3.29Å
188	R	22.2	Very low	23.3	Very low	240 Å²	240	153.6 Å²	153.6	91%	0.906	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-78.5	117.1	170	-77.8	-179	169.6	174.1	-3.8	109.4	T186	T186-R188 PolarHBondContact O-N 2.79Å
189	S	22	Very low	23.2	Very low	122 Å²	122	154 Å²	154	85%	0.853	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80.6	133.1	166.8	51	0	0	0	0	110.5
190	S	28	Very low	22.8	Very low	118 Å²	118	153.3 Å²	153.3	83%	0.825	83%	0.83	S	S	*	*			trans	-135.2	90.2	173.4	59.1	0	0	0	0	109.9
191	A	22.6	Very low	22.7	Very low	93 Å²	93	152.8 Å²	152.8	77%	0.769	83%	0.825	S	S	*	*			trans	-80.2	147.3	176.2	0	0	0	0	0	111.7
192	K	23.7	Very low	22.5	Very low	210 Å²	210	153.6 Å²	153.6	91%	0.913	83%	0.829	S	S	*	*			trans	170.2	108.2	138.5	-95.7	162.7	-175.7	-179.6	0	112.6
193	S	25.7	Very low	22.5	Very low	122 Å²	122	152.9 Å²	152.9	85%	0.853	82%	0.824	S	S	*	*			trans	-161.1	153.4	132.3	57	0	0	0	0	109.1
194	K	23.8	Very low	22.4	Very low	210 Å²	210	156.6 Å²	156.6	91%	0.913	83%	0.832	S	S	*	*			trans	-125.7	135.1	174.1	-67.4	-179.3	178.2	-177.7	0	108.3
195	S	24.4	Very low	22.4	Very low	118 Å²	118	150.5 Å²	150.5	83%	0.825	82%	0.821	S	S	*	*			trans	-154	153.8	152.6	50	0	0	0	0	110
196	P	23.1	Very low	22.3	Very low	108 Å²	108	150.4 Å²	150.4	70%	0.701	82%	0.823	S	S	*	*			trans	-128.6	161.2	-157.9	40.8	-25.1	0	0	0	116.1
197	I	22.8	Very low	22.5	Very low	145 Å²	145	150.8 Å²	150.8	74%	0.744	81%	0.814	S	S	*	*			trans	65.6	127.8	145.5	-67.8	163.7	0	0	0	118.6
198	N	21.2	Very low	22.4	Very low	148 Å²	148	149 Å²	149	79%	0.791	81%	0.808	S	S	*	*			trans	56.9	91.7	159.9	-63.1	-2.8	0	0	0	119.3
199	C	20.7	Very low	22.4	Very low	124 Å²	124	144.3 Å²	144.3	84%	0.838	79%	0.792	S	S	*	*			trans	-140.2	95.5	141.8	-96.9	0	0	0	0	109.9	K201	C199-K201 PolarHBondContact O-N 2.93Å
200	S	18.4	Very low	22.5	Very low	131 Å²	131	144.8 Å²	144.8	92%	0.916	78%	0.778	S	S	*	*			trans	-75.1	88.3	168.6	53.6	0	0	0	0	109.6
201	K	21.6	Very low	22.3	Very low	184 Å²	184	144.7 Å²	144.7	80%	0.8	77%	0.768	S	S	*	*			trans	-109.8	155	163.7	-80.1	-169.8	171.3	-172.7	0	109.8	C199 V203	C199-K201 PolarHBondContact O-N 2.93Å; K201-V203 PolarHBondContact O-N 2.81Å
202	Q	20.4	Very low	22.4	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	75%	0.748	S	S	*	*			trans	-56.6	131	177.6	-69.3	151.2	-88.6	0	0	110	E204	Q202-E204 PolarHBondContact O-N 3.14Å; Q202-E204 VanDerWaalsContact O-N 3.07Å
203	V	20.7	Very low	22.5	Very low	127 Å²	127	137.3 Å²	137.3	77%	0.77	73%	0.733	S	S	*	*			trans	-78.9	84.9	162.8	-177.4	0	0	0	0	106.6	K201 T205	K201-V203 PolarHBondContact O-N 2.81Å; V203-T205 HydrophobicContact CG1-CG2 4.2Å; V203-T205 PolarHBondContact O-N 3.13Å
204	E	20.6	Very low	22.6	Very low	167 Å²	167	133.9 Å²	133.9	78%	0.78	71%	0.706	S	S	*	*			trans	-57.3	121.5	150.7	-70.3	-170.7	139.2	0	0	106.2	Q202 E206	Q202-E204 PolarHBondContact O-N 3.14Å; Q202-E204 VanDerWaalsContact O-N 3.07Å; E204-E206 PolarHBondContact O-N 2.84Å
205	T	21.9	Very low	22.7	Very low	107 Å²	107	127.4 Å²	127.4	66%	0.656	69%	0.688	S	S	*	*			trans	-77.8	96.5	-178.5	32.6	0	0	0	0	107.9	V203 K207	V203-T205 HydrophobicContact CG1-CG2 4.2Å; V203-T205 PolarHBondContact O-N 3.13Å; T205-K207 PolarHBondContact O-N 2.62Å
206	E	21.9	Very low	22.7	Very low	189 Å²	189	126.1 Å²	126.1	88%	0.883	68%	0.678	S	S	*	*			trans	-57.7	91	163.9	-74.9	-171	127.7	0	0	108.3	E204 D208	E204-E206 PolarHBondContact O-N 2.84Å; E206-D208 PolarHBondContact O-N 3.17Å
207	K	23.5	Very low	22.9	Very low	137 Å²	137	123.6 Å²	123.6	60%	0.596	66%	0.661	S	S	*	*			trans	-73	98.7	174.1	-69.3	-176.6	171.3	-173.1	0	107.4	T205 Y209	T205-K207 PolarHBondContact O-N 2.62Å; K207-Y209 HydrophobicContact CB-CD2 3.69Å; K207-Y209 HydrophobicContact CB-CE2 3.56Å; K207-Y209 HydrophobicContact CB-CG 4.45Å; K207-Y209 HydrophobicContact CD-CD2 4.43Å; K207-Y209 HydrophobicContact CD-CE2 3.48Å; K207-Y209 VanDerWaalsContact CD-CE2 3.48Å; K207-Y209 HydrophobicContact CG-CE2 4.18Å; K207-Y209 PolarHBondContact NZ-OH 3.37Å; K207-Y209 PolarHBondContact O-N 3.19Å
208	D	21.1	Very low	23	Very low	148 Å²	148	119.9 Å²	119.9	79%	0.791	65%	0.648	S	S	*	*			trans	-69.9	59.9	-178.5	-135.6	-2.7	0	0	0	111.5	E206 F210	E206-D208 PolarHBondContact O-N 3.17Å; D208-F210 PolarHBondContact O-N 3.39Å; D208-F210 VanDerWaalsContact O-N 3.09Å
209	Y	23.4	Very low	23.3	Very low	141 Å²	141	118.4 Å²	118.4	55%	0.553	64%	0.636	S	S	*	*			trans	-71.7	98.2	177.4	-73.1	-59.5	0	0	0	109.5	K207 N211	K207-Y209 HydrophobicContact CB-CD2 3.69Å; K207-Y209 HydrophobicContact CB-CE2 3.56Å; K207-Y209 HydrophobicContact CB-CG 4.45Å; K207-Y209 HydrophobicContact CD-CD2 4.43Å; K207-Y209 HydrophobicContact CD-CE2 3.48Å; K207-Y209 VanDerWaalsContact CD-CE2 3.48Å; K207-Y209 HydrophobicContact CG-CE2 4.18Å; K207-Y209 PolarHBondContact NZ-OH 3.37Å; K207-Y209 PolarHBondContact O-N 3.19Å; Y209-N211 PolarHBondContact O-N 2.83Å
210	F	23.4	Very low	23.5	Very low	131 Å²	131	118.4 Å²	118.4	58%	0.575	63%	0.634	S	S	*	*			trans	-61	96.9	167.3	-97.4	-97.2	0	0	0	110.6	T71 D208 L212	T71-F210 HydrophobicContact CG2-CD2 4.14Å; T71-F210 HydrophobicContact CG2-CE1 4.44Å; T71-F210 HydrophobicContact CG2-CE2 3.92Å; T71-F210 HydrophobicContact CG2-CG 4.48Å; T71-F210 HydrophobicContact CG2-CZ 4.08Å; D208-F210 PolarHBondContact O-N 3.39Å; D208-F210 VanDerWaalsContact O-N 3.09Å; F210-L212 PolarHBondContact O-N 3.2Å
211	N	22.9	Very low	23.9	Very low	116 Å²	116	119.5 Å²	119.5	62%	0.62	62%	0.623	S	S	*	*			trans	-67.3	121.8	174	-89.8	-17.4	0	0	0	111.1	Y209 S213 N242	Y209-N211 PolarHBondContact O-N 2.83Å; N211-S213 VanDerWaalsContact C-N 3.26Å; N211-S213 PolarHBondContact O-N 2.96Å; N211-N242 PolarHBondContact OD1-ND2 3.08Å
212	L	25.5	Very low	24.2	Very low	66 Å²	66	115.2 Å²	115.2	35%	0.346	61%	0.608	S	S	.	*			trans	-81.1	70.9	173.6	-114.6	162.9	0	0	0	109.6	N78 F210 V214	N78-L212 HydrophobicContact CB-CD2 4.09Å; F210-L212 PolarHBondContact O-N 3.2Å; L212-V214 PolarHBondContact O-N 3Å; L212-V214 VanDerWaalsContact O-N 3.09Å
213	S	25.2	Very low	24.6	Very low	83 Å²	83	109.1 Å²	109.1	58%	0.58	59%	0.585	S	S	*	*			trans	-70.7	103.4	179.8	61.4	0	0	0	0	111	N211 S215	N211-S213 VanDerWaalsContact C-N 3.26Å; N211-S213 PolarHBondContact O-N 2.96Å; S213-S215 PolarHBondContact O-N 3.47Å
214	V	29.2	Very low	24.9	Very low	49 Å²	49	108.2 Å²	108.2	30%	0.297	58%	0.575	S	S	.	*			trans	-76.2	18.8	176.9	-166.2	0	0	0	0	111.9	L212 S216 V217 I244	L212-V214 PolarHBondContact O-N 3Å; L212-V214 VanDerWaalsContact O-N 3.09Å; V214-S216 PolarHBondContact O-N 3.09Å; V214-V217 HydrophobicContact CG1-CB 4.17Å; V214-V217 HydrophobicContact CG1-CG2 3.44Å; V214-V217 VanDerWaalsContact CG1-CG2 3.44Å; V214-V217 PolarHBondContact O-N 3.17Å; V214-I244 HydrophobicContact CB-CG2 3.91Å; V214-I244 HydrophobicContact CG2-CD1 4.14Å; V214-I244 HydrophobicContact CG2-CG1 4.35Å; V214-I244 HydrophobicContact CG2-CG2 3.63Å
215	S	23.9	Very low	25.1	Very low	75 Å²	75	103 Å²	103	52%	0.524	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	19.8	-173.2	57.1	0	0	0	0	115.3	S213	S213-S215 PolarHBondContact O-N 3.47Å
216	S	24.8	Very low	25.4	Very low	90 Å²	90	99.7 Å²	99.7	63%	0.629	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.8	1.3	179.6	56.3	0	0	0	0	113.7	V214 S218	V214-S216 PolarHBondContact O-N 3.09Å; S216-S218 PolarHBondContact O-N 3.25Å
217	V	27.2	Very low	25.8	Very low	56 Å²	56	93.3 Å²	93.3	34%	0.339	51%	0.507	S	S	.	.			trans	-78.7	101.4	176.4	177.9	0	0	0	0	110	V214 E219 L222	V214-V217 HydrophobicContact CG1-CB 4.17Å; V214-V217 HydrophobicContact CG1-CG2 3.44Å; V214-V217 VanDerWaalsContact CG1-CG2 3.44Å; V214-V217 PolarHBondContact O-N 3.17Å; V217-E219 PolarHBondContact O-N 3.4Å; V217-L222 HydrophobicContact CG1-CG 4.48Å
218	S	25.8	Very low	26.1	Very low	66 Å²	66	88.1 Å²	88.1	46%	0.462	49%	0.486	S	S	.	.			trans	-65.6	126.8	170.6	62.5	0	0	0	0	110.9	S216 P220 K221	S216-S218 PolarHBondContact O-N 3.25Å; S218-P220 VanDerWaalsContact C-N 3.33Å; S218-P220 WeakPolarHBondContact O-CD 3.3Å; S218-P220 VanDerWaalsContact O-N 3.08Å; S218-K221 PolarHBondContact O-N 2.96Å; S218-K221 VanDerWaalsContact O-N 3.15Å
219	E	27	Very low	26.9	Very low	118 Å²	118	81.4 Å²	81.4	55%	0.551	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-49.4	-34.4	-172.5	-65	172.8	132.9	0	0	116.2	V217 K221	V217-E219 PolarHBondContact O-N 3.4Å; E219-K221 PolarHBondContact O-N 2.61Å; E219-K221 VanDerWaalsContact O-N 3.11Å
220	P	26.1	Very low	27.7	Very low	123 Å²	123	77.1 Å²	77.1	80%	0.799	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-70.9	-3	-179.8	-20.5	33.6	0	0	0	116.4	S218	S218-P220 VanDerWaalsContact C-N 3.33Å; S218-P220 WeakPolarHBondContact O-CD 3.3Å; S218-P220 VanDerWaalsContact O-N 3.08Å
221	K	26.1	Very low	28.5	Very low	155 Å²	155	71.4 Å²	71.4	67%	0.674	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-120.9	18.7	-166.4	-70.7	-171.7	175.5	-178.1	0	116	S218 E219 S223	S218-K221 PolarHBondContact O-N 2.96Å; S218-K221 VanDerWaalsContact O-N 3.15Å; E219-K221 PolarHBondContact O-N 2.61Å; E219-K221 VanDerWaalsContact O-N 3.11Å; K221-S223 VanDerWaalsContact C-N 3.31Å; K221-S223 PolarHBondContact O-N 3.07Å
222	L	28.1	Very low	29.4	Very low	93 Å²	93	69.6 Å²	69.6	49%	0.487	40%	0.403	S	S	.	.			trans	-68	85.7	169.5	-93.3	165.8	0	0	0	111.5	V217 I263	V217-L222 HydrophobicContact CG1-CG 4.48Å; L222-I263 HydrophobicContact CD1-CD1 3.87Å
223	S	28.2	Very low	30.1	Very low	54 Å²	54	67.5 Å²	67.5	38%	0.378	39%	0.392	S	S	.	.			trans	-69.5	151.2	-179.8	81.8	0	0	0	0	112.3	K221 N225 S226	K221-S223 VanDerWaalsContact C-N 3.31Å; K221-S223 PolarHBondContact O-N 3.07Å; S223-N225 PolarHBondContact O-N 3.06Å; S223-N225 PolarHBondContact OG-N 3.23Å; S223-S226 WeakPolarHBondContact O-CB 3.33Å; S223-S226 PolarHBondContact O-N 2.97Å; S223-S226 PolarHBondContact O-OG 3.24Å; S223-S226 PolarHBondContact OG-OG 3Å
224	I	26.2	Very low	30.9	Very low	108 Å²	108	66 Å²	66	55%	0.554	38%	0.377	S	S	*	.	H	α-helix	trans	-52.3	-27.6	174.7	-67.7	167	0	0	0	112.4	S226 L228 P305	I224-S226 VanDerWaalsContact C-N 3.34Å; I224-S226 PolarHBondContact O-N 3.09Å; I224-L228 HydrophobicContact CG2-CD1 4.08Å; I224-L228 WeakPolarHBondContact O-CG 3.35Å; I224-L228 PolarHBondContact O-N 3.37Å; I224-P305 HydrophobicContact CG2-CB 3.94Å
225	N	26.2	Very low	31.4	Very low	58 Å²	58	69 Å²	69	31%	0.31	39%	0.388	S	S	.	.	H	α-helix	trans	-68.5	-29.9	178.5	-64	-18.9	0	0	0	113.3	P131 S223 L228 L229	P131-N225 HydrophobicContact CG-CB 4.18Å; S223-N225 PolarHBondContact O-N 3.06Å; S223-N225 PolarHBondContact OG-N 3.23Å; N225-L228 PolarHBondContact O-N 2.97Å; N225-L229 WeakPolarHBondContact O-CB 3.32Å; N225-L229 PolarHBondContact O-N 3.2Å
226	S	28.8	Very low	32	Very low	37 Å²	37	66.4 Å²	66.4	26%	0.259	37%	0.371	S	S	.	.	H	α-helix	trans	-69.1	-36.3	-177.4	-52.2	0	0	0	0	111.8	S223 I224 L230	S223-S226 WeakPolarHBondContact O-CB 3.33Å; S223-S226 PolarHBondContact O-N 2.97Å; S223-S226 PolarHBondContact O-OG 3.24Å; S223-S226 PolarHBondContact OG-OG 3Å; I224-S226 VanDerWaalsContact C-N 3.34Å; I224-S226 PolarHBondContact O-N 3.09Å; S226-L230 PolarHBondContact O-N 2.87Å
227	V	30.1	Very low	32.3	Very low	55 Å²	55	64.5 Å²	64.5	33%	0.333	37%	0.365	S	S	.	.	H	α-helix	trans	-74.6	-36.2	176.6	-178.1	0	0	0	0	111.7	L230 T231	V227-L230 PolarHBondContact O-N 3.19Å; V227-T231 PolarHBondContact O-N 3.15Å; V227-T231 VanDerWaalsContact O-N 3.1Å; V227-T231 PolarHBondContact O-OG1 3.17Å
228	L	28.8	Very low	32.7	Very low	28 Å²	28	63.4 Å²	63.4	15%	0.147	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-44.7	173.7	-68.7	165.2	0	0	0	110.9	I224 N225 L230 T231 D232 R308 Y312	I224-L228 HydrophobicContact CG2-CD1 4.08Å; I224-L228 WeakPolarHBondContact O-CG 3.35Å; I224-L228 PolarHBondContact O-N 3.37Å; N225-L228 PolarHBondContact O-N 2.97Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 3.26Å; L228-T231 WeakPolarHBondContact O-CB 3.3Å; L228-T231 PolarHBondContact O-N 2.6Å; L228-T231 VanDerWaalsContact O-N 3.14Å; L228-D232 PolarHBondContact O-N 2.87Å; L228-R308 VanDerWaalsContact CD2-NH2 3.32Å; L228-Y312 HydrophobicContact CD2-CE2 3.99Å
229	L	37.2	Very low	33.1	Very low	8 Å²	8	65.8 Å²	65.8	4%	0.042	36%	0.358	C	S	.	.	H	α-helix	trans	-58.8	-43.8	175.2	-175.8	72.9	0	0	0	112.1	I80 I81 I135 N225 T231 D232 L233	I80-L229 HydrophobicContact CB-CD1 4.42Å; I80-L229 HydrophobicContact CB-CD2 4.05Å; I80-L229 HydrophobicContact CG2-CD1 3.73Å; I80-L229 HydrophobicContact CG2-CD2 3.7Å; I80-L229 HydrophobicContact CG2-CG 4.31Å; I81-L229 HydrophobicContact CB-CD2 4.45Å; I81-L229 HydrophobicContact CG1-CD2 3.47Å; I81-L229 VanDerWaalsContact CG1-CD2 3.47Å; I135-L229 HydrophobicContact CD1-CD1 3.89Å; I135-L229 HydrophobicContact CG1-CD1 4.21Å; N225-L229 WeakPolarHBondContact O-CB 3.32Å; N225-L229 PolarHBondContact O-N 3.2Å; L229-T231 VanDerWaalsContact C-N 3.27Å; L229-T231 PolarHBondContact O-N 2.84Å; L229-D232 PolarHBondContact O-N 2.91Å; L229-L233 HydrophobicContact CD1-CD1 4.41Å; L229-L233 HydrophobicContact CD1-CG 4.47Å; L229-L233 HydrophobicContact CD2-CD1 4.45Å; L229-L233 HydrophobicContact CG-CD1 3.92Å; L229-L233 HydrophobicContact CG-CG 4.37Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 WeakPolarHBondContact O-CG 3.13Å; L229-L233 PolarHBondContact O-N 3.07Å
230	L	41.3	Very low	33.5	Very low	50 Å²	50	61.9 Å²	61.9	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-41.5	176.2	-163.8	80.9	0	0	0	111.3	S226 V227 L228 L234 I240	S226-L230 PolarHBondContact O-N 2.87Å; V227-L230 PolarHBondContact O-N 3.19Å; L228-L230 VanDerWaalsContact C-N 3.34Å; L228-L230 PolarHBondContact O-N 3.26Å; L230-L234 HydrophobicContact CG-CD1 4.3Å; L230-L234 WeakPolarHBondContact O-CB 3.47Å; L230-L234 VanDerWaalsContact O-CG 3.26Å; L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 3.2Å; L230-I240 HydrophobicContact CD1-CD1 3.52Å
231	T	40.5	Very low	33.6	Very low	11 Å²	11	60.7 Å²	60.7	7%	0.067	33%	0.325	C	S	.	.	H	α-helix	trans	-68	-47.2	179.2	-51.6	0	0	0	0	111.5	V227 L228 L229 L233 L234 E235 Y312 L316	V227-T231 PolarHBondContact O-N 3.15Å; V227-T231 VanDerWaalsContact O-N 3.1Å; V227-T231 PolarHBondContact O-OG1 3.17Å; L228-T231 WeakPolarHBondContact O-CB 3.3Å; L228-T231 PolarHBondContact O-N 2.6Å; L228-T231 VanDerWaalsContact O-N 3.14Å; L229-T231 VanDerWaalsContact C-N 3.27Å; L229-T231 PolarHBondContact O-N 2.84Å; T231-L233 VanDerWaalsContact C-N 3.31Å; T231-L233 PolarHBondContact O-N 3.02Å; T231-L234 PolarHBondContact O-N 2.98Å; T231-E235 PolarHBondContact O-N 2.92Å; T231-Y312 HydrophobicContact CG2-CE2 4.34Å; T231-Y312 PolarHBondContact OG1-OH 3.35Å; T231-L316 HydrophobicContact CG2-CD1 4.29Å
232	D	41.5	Very low	33.6	Very low	79 Å²	79	56.1 Å²	56.1	42%	0.422	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-36.4	177.3	-72	-11.5	0	0	0	111.8	L228 L229 A236	L228-D232 PolarHBondContact O-N 2.87Å; L229-D232 PolarHBondContact O-N 2.91Å; D232-A236 VanDerWaalsContact O-CB 3.25Å; D232-A236 WeakPolarHBondContact O-CB 3.39Å; D232-A236 PolarHBondContact O-N 3.02Å
233	L	41	Very low	33.5	Very low	21 Å²	21	58.7 Å²	58.7	11%	0.11	32%	0.321	C	S	.	.	H	α-helix	trans	-68.1	-43.5	174.9	-73.6	171.5	0	0	0	111.8	I77 L229 T231 A236 G237 F238	I77-L233 HydrophobicContact CD1-CD2 3.68Å; I77-L233 HydrophobicContact CG1-CD2 4.34Å; I77-L233 HydrophobicContact CG2-CD1 4.09Å; L229-L233 HydrophobicContact CD1-CD1 4.41Å; L229-L233 HydrophobicContact CD1-CG 4.47Å; L229-L233 HydrophobicContact CD2-CD1 4.45Å; L229-L233 HydrophobicContact CG-CD1 3.92Å; L229-L233 HydrophobicContact CG-CG 4.37Å; L229-L233 WeakPolarHBondContact O-CB 3.49Å; L229-L233 WeakPolarHBondContact O-CG 3.13Å; L229-L233 PolarHBondContact O-N 3.07Å; T231-L233 VanDerWaalsContact C-N 3.31Å; T231-L233 PolarHBondContact O-N 3.02Å; L233-A236 CarbonylContact O-C 3.59Å; L233-A236 PolarHBondContact O-N 2.89Å; L233-G237 PolarHBondContact O-N 2.99Å; L233-G237 VanDerWaalsContact O-N 3.17Å; L233-F238 HydrophobicContact CB-CB 4.15Å; L233-F238 HydrophobicContact CB-CD2 4.2Å; L233-F238 HydrophobicContact CB-CG 4.42Å; L233-F238 HydrophobicContact CD2-CB 4.47Å; L233-F238 HydrophobicContact CD2-CD2 3.5Å; L233-F238 HydrophobicContact CD2-CE2 3.81Å; L233-F238 HydrophobicContact CD2-CG 3.9Å; L233-F238 HydrophobicContact CD2-CZ 4.45Å; L233-F238 HydrophobicContact CG-CD2 4.47Å; L233-F238 WeakPolarHBondContact O-CB 3.42Å; L233-F238 WeakPolarHBondContact O-CD2 3.07Å; L233-F238 PolarHBondContact O-N 3.09Å
234	L	41.8	Very low	33.3	Very low	53 Å²	53	57.9 Å²	57.9	28%	0.277	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-41.9	176	-71.1	168.4	0	0	0	111.6	L230 T231 A236 G237	L230-L234 HydrophobicContact CG-CD1 4.3Å; L230-L234 WeakPolarHBondContact O-CB 3.47Å; L230-L234 VanDerWaalsContact O-CG 3.26Å; L230-L234 WeakPolarHBondContact O-CG 3.38Å; L230-L234 PolarHBondContact O-N 3.2Å; T231-L234 PolarHBondContact O-N 2.98Å; L234-A236 VanDerWaalsContact C-N 3.28Å; L234-A236 PolarHBondContact O-N 3.19Å; L234-G237 PolarHBondContact O-N 2.71Å; L234-G237 VanDerWaalsContact O-N 3.09Å
235	E	38.1	Very low	33.2	Very low	110 Å²	110	58.8 Å²	58.8	51%	0.514	32%	0.317	S	S	.	.	H	α-helix	trans	-64	-30.8	172.8	-74.3	-162.3	176.6	0	0	112.6	T231 G237	T231-E235 PolarHBondContact O-N 2.92Å; E235-G237 VanDerWaalsContact C-N 3.28Å; E235-G237 PolarHBondContact O-N 3.33Å
236	A	36.5	Very low	33.2	Very low	22 Å²	22	59.7 Å²	59.7	18%	0.182	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-3.2	173.8	0	0	0	0	0	114.4	D232 L233 L234 F238	D232-A236 VanDerWaalsContact O-CB 3.25Å; D232-A236 WeakPolarHBondContact O-CB 3.39Å; D232-A236 PolarHBondContact O-N 3.02Å; L233-A236 CarbonylContact O-C 3.59Å; L233-A236 PolarHBondContact O-N 2.89Å; L234-A236 VanDerWaalsContact C-N 3.28Å; L234-A236 PolarHBondContact O-N 3.19Å; A236-F238 HydrophobicContact CB-CD2 3.93Å; A236-F238 HydrophobicContact CB-CE2 3.96Å
237	G	31.7	Very low	32.9	Very low	49 Å²	49	62.6 Å²	62.6	51%	0.505	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	16.8	175.9	0	0	0	0	0	115.5	L233 L234 E235 K239	L233-G237 PolarHBondContact O-N 2.99Å; L233-G237 VanDerWaalsContact O-N 3.17Å; L234-G237 PolarHBondContact O-N 2.71Å; L234-G237 VanDerWaalsContact O-N 3.09Å; E235-G237 VanDerWaalsContact C-N 3.28Å; E235-G237 PolarHBondContact O-N 3.33Å; G237-K239 PolarHBondContact O-N 2.9Å
238	F	35.5	Very low	32.6	Very low	34 Å²	34	66.5 Å²	66.5	15%	0.149	36%	0.356	C	S	.	.			trans	-71.7	108.4	175	-74.8	-86.6	0	0	0	111.4	F56 F73 I77 L233 A236 I240	F56-F238 HydrophobicContact CD1-CZ 4.35Å; F56-F238 HydrophobicContact CE1-CD1 4.22Å; F56-F238 HydrophobicContact CE1-CD2 4.37Å; F56-F238 AromaticContact CE1-CE1 3.57Å; F56-F238 HydrophobicContact CE1-CE1 3.57Å; F56-F238 AromaticContact CE1-CE2 3.76Å; F56-F238 HydrophobicContact CE1-CE2 3.76Å; F56-F238 AromaticContact CE1-CZ 3.3Å; F56-F238 HydrophobicContact CE1-CZ 3.3Å; F56-F238 HydrophobicContact CE2-CZ 4.16Å; F56-F238 HydrophobicContact CZ-CD1 4.43Å; F56-F238 AromaticContact CZ-CE1 3.42Å; F56-F238 HydrophobicContact CZ-CE1 3.42Å; F56-F238 VanDerWaalsContact CZ-CE1 3.42Å; F56-F238 HydrophobicContact CZ-CE2 4.08Å; F56-F238 AromaticContact CZ-CZ 3.19Å; F56-F238 HydrophobicContact CZ-CZ 3.19Å; F73-F238 HydrophobicContact CD1-CE1 4.44Å; F73-F238 AromaticContact CE1-CE1 3.53Å; F73-F238 HydrophobicContact CE1-CE1 3.53Å; F73-F238 AromaticContact CE1-CZ 3.41Å; F73-F238 HydrophobicContact CE1-CZ 3.41Å; F73-F238 VanDerWaalsContact CE1-CZ 3.41Å; F73-F238 HydrophobicContact CZ-CE1 4.24Å; F73-F238 AromaticContact CZ-CZ 3.65Å; F73-F238 HydrophobicContact CZ-CZ 3.65Å; I77-F238 HydrophobicContact CD1-CD1 4.39Å; I77-F238 HydrophobicContact CD1-CE1 4.01Å; I77-F238 HydrophobicContact CD1-CZ 4.24Å; L233-F238 HydrophobicContact CB-CB 4.15Å; L233-F238 HydrophobicContact CB-CD2 4.2Å; L233-F238 HydrophobicContact CB-CG 4.42Å; L233-F238 HydrophobicContact CD2-CB 4.47Å; L233-F238 HydrophobicContact CD2-CD2 3.5Å; L233-F238 HydrophobicContact CD2-CE2 3.81Å; L233-F238 HydrophobicContact CD2-CG 3.9Å; L233-F238 HydrophobicContact CD2-CZ 4.45Å; L233-F238 HydrophobicContact CG-CD2 4.47Å; L233-F238 WeakPolarHBondContact O-CB 3.42Å; L233-F238 WeakPolarHBondContact O-CD2 3.07Å; L233-F238 PolarHBondContact O-N 3.09Å; A236-F238 HydrophobicContact CB-CD2 3.93Å; A236-F238 HydrophobicContact CB-CE2 3.96Å; F238-I240 PolarHBondContact O-N 3.37Å
239	K	35.4	Very low	32.5	Very low	115 Å²	115	72.5 Å²	72.5	50%	0.5	38%	0.383	S	S	.	.			trans	-72.5	116.5	165.6	-60.9	178.6	-179.9	178	0	109.1	G237 H241 D270	G237-K239 PolarHBondContact O-N 2.9Å; K239-H241 WeakPolarHBondContact CB-NE2 3.3Å; K239-H241 PolarHBondContact O-N 3.45Å; K239-D270 WeakPolarHBondContact CE-OD1 3.3Å; K239-D270 IonicContact NZ-OD1 3.59Å; K239-D270 PolarHBondContact NZ-OD1 3.39Å; K239-D270 IonicContact NZ-OD2 3.86Å; K239-D270 PolarHBondContact NZ-OD2 3.45Å
240	I	34.1	Very low	32	Very low	36 Å²	36	77.6 Å²	77.6	19%	0.185	41%	0.41	C	S	.	.			trans	-79.8	99.2	171.9	-56.6	179.4	0	0	0	106.9	L230 F238 I244 I267	L230-I240 HydrophobicContact CD1-CD1 3.52Å; F238-I240 PolarHBondContact O-N 3.37Å; I240-I244 HydrophobicContact CG2-CD1 4.2Å; I240-I267 HydrophobicContact CG2-CG1 4.09Å
241	H	27.9	Very low	31.1	Very low	99 Å²	99	83.6 Å²	83.6	46%	0.458	43%	0.434	S	S	.	.			trans	-98.3	160	174.4	-65.8	-40	0	0	0	111.3	K239	K239-H241 WeakPolarHBondContact CB-NE2 3.3Å; K239-H241 PolarHBondContact O-N 3.45Å
242	N	26.6	Very low	30.3	Very low	59 Å²	59	90.5 Å²	90.5	32%	0.316	47%	0.471	S	S	.	.	S	Bend	trans	75.3	145.3	-169.9	-60.2	11.7	0	0	0	115.1	N211 I244 I267	N211-N242 PolarHBondContact OD1-ND2 3.08Å; N242-I244 PolarHBondContact O-N 2.83Å; N242-I267 WeakPolarHBondContact O-CD1 3.4Å
243	L	25.4	Very low	29.6	Very low	146 Å²	146	91.5 Å²	91.5	76%	0.764	48%	0.479	S	S	*	.			trans	-64.9	116.3	177.7	-80.7	72.9	0	0	0	110.4	L245	L243-L245 VanDerWaalsContact C-N 3.35Å; L243-L245 PolarHBondContact O-N 3.41Å
244	I	25.8	Very low	28.8	Very low	37 Å²	37	99.7 Å²	99.7	19%	0.19	52%	0.517	C	S	.	.			trans	-83.6	87.8	160.9	-59.3	172.5	0	0	0	106.9	V214 I240 N242 V246 P265 I267	V214-I244 HydrophobicContact CB-CG2 3.91Å; V214-I244 HydrophobicContact CG2-CD1 4.14Å; V214-I244 HydrophobicContact CG2-CG1 4.35Å; V214-I244 HydrophobicContact CG2-CG2 3.63Å; I240-I244 HydrophobicContact CG2-CD1 4.2Å; N242-I244 PolarHBondContact O-N 2.83Å; I244-V246 HydrophobicContact CG2-CG2 4.13Å; I244-V246 PolarHBondContact O-N 2.92Å; I244-P265 HydrophobicContact CB-CG 4.06Å; I244-P265 HydrophobicContact CD1-CB 4.18Å; I244-P265 HydrophobicContact CD1-CG 3.75Å; I244-P265 HydrophobicContact CG1-CG 4.49Å; I244-P265 HydrophobicContact CG2-CG 4.06Å; I244-I267 HydrophobicContact CB-CD1 4.17Å; I244-I267 HydrophobicContact CG1-CD1 4.25Å
245	L	23.6	Very low	28.1	Very low	128 Å²	128	103.6 Å²	103.6	67%	0.67	54%	0.537	S	S	*	.			trans	-66.4	97.2	166.6	-87.5	163.7	0	0	0	108.9	L243	L243-L245 VanDerWaalsContact C-N 3.35Å; L243-L245 PolarHBondContact O-N 3.41Å
246	V	24.8	Very low	27.5	Very low	77 Å²	77	106 Å²	106	47%	0.467	55%	0.554	S	S	.	*			trans	-74.5	130	165.1	-176.4	0	0	0	0	107.5	I244	I244-V246 HydrophobicContact CG2-CG2 4.13Å; I244-V246 PolarHBondContact O-N 2.92Å
247	N	23.1	Very low	26.9	Very low	98 Å²	98	112.6 Å²	112.6	52%	0.524	59%	0.586	S	S	.	*			trans	64.5	94.4	-179.8	-65.4	-26.9	0	0	0	117.4	L250	N247-L250 HydrophobicContact CB-CD1 4.3Å
248	D	24.1	Very low	26.7	Very low	137 Å²	137	114.5 Å²	114.5	73%	0.733	59%	0.589	S	S	*	*	S	Bend	trans	-138.8	16.8	153.2	-155.1	8.2	0	0	0	112.9
249	H	26	Very low	26.2	Very low	153 Å²	153	121.3 Å²	121.3	71%	0.708	62%	0.619	S	S	*	*			trans	-126.5	13	-177.5	-75.3	2.8	0	0	0	113.8	K251	H249-K251 PolarHBondContact O-N 3.45Å
250	L	26.7	Very low	25.7	Very low	115 Å²	115	119.9 Å²	119.9	60%	0.602	62%	0.621	S	S	*	*			trans	-74.4	57.4	170.2	-80.4	169.6	0	0	0	112	N247	N247-L250 HydrophobicContact CB-CD1 4.3Å
251	K	23	Very low	25.3	Very low	176 Å²	176	125.2 Å²	125.2	77%	0.765	64%	0.64	S	S	*	*			trans	-88.8	126.7	167.4	-73.2	-176.4	177.5	175.5	0	109.6	H249	H249-K251 PolarHBondContact O-N 3.45Å
252	N	24.5	Very low	25.3	Very low	157 Å²	157	126.1 Å²	126.1	84%	0.84	65%	0.647	S	S	*	*	S	Bend	trans	78.2	21.3	164.4	-48.2	-12.9	0	0	0	118.4
253	V	26.5	Very low	25.3	Very low	100 Å²	100	128.3 Å²	128.3	61%	0.606	66%	0.658	S	S	*	*			trans	-91.5	99.1	163.2	-178.2	0	0	0	0	109.4	L255	V253-L255 HydrophobicContact CG1-CB 4.42Å; V253-L255 HydrophobicContact CG1-CD1 3.7Å; V253-L255 HydrophobicContact CG1-CG 3.83Å; V253-L255 PolarHBondContact O-N 3.06Å
254	Q	23.7	Very low	25.2	Very low	193 Å²	193	129.8 Å²	129.8	90%	0.902	65%	0.654	S	S	*	*			trans	-76.8	95.4	171.4	-71.4	-177.8	-17.2	0	0	109.9
255	L	27	Very low	25.2	Very low	135 Å²	135	129.6 Å²	129.6	71%	0.707	66%	0.655	S	S	*	*			trans	-130.9	129.6	169.9	-75.7	174	0	0	0	110.3	V253	V253-L255 HydrophobicContact CG1-CB 4.42Å; V253-L255 HydrophobicContact CG1-CD1 3.7Å; V253-L255 HydrophobicContact CG1-CG 3.83Å; V253-L255 PolarHBondContact O-N 3.06Å
256	N	24.5	Very low	25.3	Very low	161 Å²	161	125.2 Å²	125.2	86%	0.861	64%	0.635	S	S	*	*	S	Bend	trans	-75.9	127.5	-178.8	-63.3	-35.1	0	0	0	110.3
257	N	25.1	Very low	25.3	Very low	160 Å²	160	124.6 Å²	124.6	86%	0.856	63%	0.629	S	S	*	*			trans	62.3	59.6	167.1	-56.8	-18.9	0	0	0	118.9
258	P	27.3	Very low	25.4	Very low	88 Å²	88	123.4 Å²	123.4	57%	0.571	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-77.4	132.1	155.4	32.6	-30.5	0	0	0	110.8
259	K	24.6	Very low	25.4	Very low	178 Å²	178	120.2 Å²	120.2	77%	0.774	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-75.3	137.9	161.4	-72.4	-178.1	178.9	178.5	0	108.8	Y261	K259-Y261 VanDerWaalsContact O-CD1 3.31Å; K259-Y261 WeakPolarHBondContact O-CD1 3.45Å; K259-Y261 PolarHBondContact O-N 2.89Å
260	P	25.3	Very low	25.3	Very low	84 Å²	84	116.9 Å²	116.9	55%	0.545	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-68.8	128.9	175.8	27.8	-33.6	0	0	0	111.1	Y291	P260-Y291 HydrophobicContact CG-CE1 4.46Å
261	Y	26.3	Very low	25.2	Very low	149 Å²	149	117.7 Å²	117.7	58%	0.584	60%	0.6	S	S	*	*			trans	-127.4	139.2	167.8	48.8	-92.5	0	0	0	108.9	K259	K259-Y261 VanDerWaalsContact O-CD1 3.31Å; K259-Y261 WeakPolarHBondContact O-CD1 3.45Å; K259-Y261 PolarHBondContact O-N 2.89Å
262	I	26.6	Very low	25.2	Very low	118 Å²	118	115.9 Å²	115.9	61%	0.605	60%	0.598	S	S	*	*			trans	-119.3	108.8	-174	-49.6	176.9	0	0	0	109.5	Y264	I262-Y264 HydrophobicContact CB-CD2 4.35Å; I262-Y264 HydrophobicContact CB-CE2 4.04Å; I262-Y264 HydrophobicContact CG2-CD2 3.7Å; I262-Y264 HydrophobicContact CG2-CE1 4.25Å; I262-Y264 HydrophobicContact CG2-CE2 3.4Å; I262-Y264 HydrophobicContact CG2-CG 4.26Å; I262-Y264 PolarHBondContact O-N 3.03Å
263	I	26.5	Very low	25.1	Very low	104 Å²	104	113.8 Å²	113.8	53%	0.533	60%	0.596	S	S	.	*			trans	-87.8	100.7	173.2	-57.1	176.6	0	0	0	108	L222 P265	L222-I263 HydrophobicContact CD1-CD1 3.87Å; I263-P265 WeakPolarHBondContact O-CD 3.38Å
264	Y	25.2	Very low	25	Very low	177 Å²	177	114.4 Å²	114.4	69%	0.694	60%	0.595	S	S	*	*			trans	-84.1	113.7	175.7	-80.5	-75.4	0	0	0	111.7	I262	I262-Y264 HydrophobicContact CB-CD2 4.35Å; I262-Y264 HydrophobicContact CB-CE2 4.04Å; I262-Y264 HydrophobicContact CG2-CD2 3.7Å; I262-Y264 HydrophobicContact CG2-CE1 4.25Å; I262-Y264 HydrophobicContact CG2-CE2 3.4Å; I262-Y264 HydrophobicContact CG2-CG 4.26Å; I262-Y264 PolarHBondContact O-N 3.03Å
265	P	25.1	Very low	24.9	Very low	33 Å²	33	112.7 Å²	112.7	21%	0.214	59%	0.587	C	S	.	*			trans	-67.4	128.9	155.9	29.6	-32.4	0	0	0	108.8	I244 I263 I267	I244-P265 HydrophobicContact CB-CG 4.06Å; I244-P265 HydrophobicContact CD1-CB 4.18Å; I244-P265 HydrophobicContact CD1-CG 3.75Å; I244-P265 HydrophobicContact CG1-CG 4.49Å; I244-P265 HydrophobicContact CG2-CG 4.06Å; I263-P265 WeakPolarHBondContact O-CD 3.38Å; P265-I267 PolarHBondContact O-N 3.04Å
266	C	25.9	Very low	24.8	Very low	36 Å²	36	115 Å²	115	24%	0.243	59%	0.591	C	S	.	*			trans	-64.5	107.5	-174.7	-68.9	0	0	0	0	112.8	F268	C266-F268 HydrophobicContact CB-CD2 4.06Å; C266-F268 HydrophobicContact CB-CE2 3.73Å
267	I	23.6	Very low	24.6	Very low	65 Å²	65	114.5 Å²	114.5	33%	0.333	59%	0.588	S	S	.	*			trans	-101.6	125	170.4	-67	159.8	0	0	0	107.6	I240 N242 I244 P265	I240-I267 HydrophobicContact CG2-CG1 4.09Å; N242-I267 WeakPolarHBondContact O-CD1 3.4Å; I244-I267 HydrophobicContact CB-CD1 4.17Å; I244-I267 HydrophobicContact CG1-CD1 4.25Å; P265-I267 PolarHBondContact O-N 3.04Å
268	F	27.1	Very low	24.5	Very low	72 Å²	72	116.3 Å²	116.3	32%	0.316	58%	0.584	S	S	.	*			trans	-138.3	121.4	175.8	-70.2	-76.4	0	0	0	110.4	C266 V323 I324	C266-F268 HydrophobicContact CB-CD2 4.06Å; C266-F268 HydrophobicContact CB-CE2 3.73Å; F268-V323 HydrophobicContact CB-CG1 3.8Å; F268-V323 HydrophobicContact CD1-CG1 4.01Å; F268-V323 HydrophobicContact CD2-CG1 3.24Å; F268-V323 HydrophobicContact CE1-CG1 4.41Å; F268-V323 HydrophobicContact CE2-CG1 3.68Å; F268-V323 HydrophobicContact CG-CG1 3.41Å; F268-V323 VanDerWaalsContact CG-CG1 3.41Å; F268-V323 HydrophobicContact CZ-CG1 4.26Å; F268-I324 HydrophobicContact CE1-CG1 4.04Å; F268-I324 HydrophobicContact CZ-CD1 4.45Å; F268-I324 HydrophobicContact CZ-CG1 3.67Å
269	S	23.4	Very low	24.3	Very low	70 Å²	70	117 Å²	117	49%	0.49	59%	0.591	S	S	.	*			trans	-97	152.1	172.6	50.9	0	0	0	0	110.7
270	D	24.6	Very low	24.2	Very low	84 Å²	84	113.7 Å²	113.7	45%	0.449	58%	0.582	S	S	.	*	S	Bend	trans	-64.7	136.5	-178.4	-62	-75.2	0	0	0	113.6	K239 N272	K239-D270 WeakPolarHBondContact CE-OD1 3.3Å; K239-D270 IonicContact NZ-OD1 3.59Å; K239-D270 PolarHBondContact NZ-OD1 3.39Å; K239-D270 IonicContact NZ-OD2 3.86Å; K239-D270 PolarHBondContact NZ-OD2 3.45Å; D270-N272 PolarHBondContact O-N 3.36Å
271	N	23.8	Very low	24.1	Very low	132 Å²	132	115.5 Å²	115.5	71%	0.706	59%	0.592	S	S	*	*	S	Bend	trans	52.3	0.5	149.6	-66	35.7	0	0	0	120.9
272	N	22.6	Very low	24	Very low	137 Å²	137	114 Å²	114	73%	0.733	60%	0.598	S	S	*	*			trans	-101.2	131.1	171.8	-75.4	-23.1	0	0	0	111.4	D270 I274	D270-N272 PolarHBondContact O-N 3.36Å; N272-I274 PolarHBondContact O-N 3.35Å
273	S	21.9	Very low	23.9	Very low	114 Å²	114	115.7 Å²	115.7	80%	0.797	61%	0.609	S	S	*	*			trans	-61.2	119.8	173.7	47.9	0	0	0	0	111.2	E275	S273-E275 PolarHBondContact O-N 3.12Å
274	I	25.3	Very low	23.8	Very low	112 Å²	112	116.2 Å²	116.2	57%	0.574	62%	0.62	S	S	*	*			trans	-80.7	97.3	176.5	-59.1	178	0	0	0	109.3	N272 F276	N272-I274 PolarHBondContact O-N 3.35Å; I274-F276 HydrophobicContact CG2-CD2 4.35Å; I274-F276 HydrophobicContact CG2-CE2 4.14Å; I274-F276 HydrophobicContact CG2-CZ 4.34Å
275	E	21.4	Very low	23.9	Very low	158 Å²	158	113.2 Å²	113.2	74%	0.738	62%	0.615	S	S	*	*			trans	-72.5	127.9	157.8	-66.1	-172.4	142.8	0	0	109.2	S273 L277	S273-E275 PolarHBondContact O-N 3.12Å; E275-L277 VanDerWaalsContact C-N 3.33Å; E275-L277 PolarHBondContact O-N 3.43Å
276	F	24.2	Very low	24.1	Very low	183 Å²	183	115.8 Å²	115.8	80%	0.803	63%	0.627	S	S	*	*			trans	-80.5	79.9	175.5	-78.6	-90.9	0	0	0	110.6	I274 Y278	I274-F276 HydrophobicContact CG2-CD2 4.35Å; I274-F276 HydrophobicContact CG2-CE2 4.14Å; I274-F276 HydrophobicContact CG2-CZ 4.34Å; F276-Y278 PolarHBondContact O-N 3.42Å
277	L	21.7	Very low	24.3	Very low	150 Å²	150	118.7 Å²	118.7	79%	0.785	64%	0.639	S	S	*	*			trans	-70.5	107.9	175.6	-98.6	165.1	0	0	0	111.5	E275 S279	E275-L277 VanDerWaalsContact C-N 3.33Å; E275-L277 PolarHBondContact O-N 3.43Å; L277-S279 PolarHBondContact O-N 2.85Å
278	Y	22.7	Very low	24.6	Very low	198 Å²	198	118.8 Å²	118.8	78%	0.776	64%	0.643	S	S	*	*			trans	-78.1	77.7	-175.3	-154.4	-83.8	0	0	0	111.2	F276 N280	F276-Y278 PolarHBondContact O-N 3.42Å; Y278-N280 VanDerWaalsContact C-N 3.3Å; Y278-N280 HydrophobicContact CD1-CB 3.98Å; Y278-N280 HydrophobicContact CE1-CB 4.26Å; Y278-N280 PolarHBondContact O-N 2.8Å
279	S	22	Very low	24.8	Very low	102 Å²	102	120.4 Å²	120.4	71%	0.713	66%	0.659	S	S	*	*			trans	-73.5	77.9	-178.2	64.4	0	0	0	0	112.5	L277 T281	L277-S279 PolarHBondContact O-N 2.85Å; S279-T281 PolarHBondContact O-N 3.45Å
280	N	22.7	Very low	25.1	Very low	109 Å²	109	123.1 Å²	123.1	58%	0.583	66%	0.664	S	S	*	*			trans	-78.6	70.7	-171.9	-148.8	11.2	0	0	0	112.5	Y278	Y278-N280 VanDerWaalsContact C-N 3.3Å; Y278-N280 HydrophobicContact CD1-CB 3.98Å; Y278-N280 HydrophobicContact CE1-CB 4.26Å; Y278-N280 PolarHBondContact O-N 2.8Å
281	T	23.5	Very low	25.4	Very low	123 Å²	123	123.7 Å²	123.7	76%	0.755	66%	0.661	S	S	*	*			trans	-130.1	-9.5	-173.1	49	0	0	0	0	116.9	S279	S279-T281 PolarHBondContact O-N 3.45Å
282	T	23.8	Very low	25.7	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.724	67%	0.668	S	S	*	*	S	Bend	trans	-134.6	116.7	174.1	45	0	0	0	0	112
283	N	24.8	Very low	26.1	Very low	153 Å²	153	124 Å²	124	82%	0.818	65%	0.652	S	S	*	*			trans	61.1	85.5	175.5	-59.1	-21.9	0	0	0	115.7	I285	N283-I285 PolarHBondContact O-N 2.93Å
284	C	23.9	Very low	26.4	Very low	114 Å²	114	124.9 Å²	124.9	77%	0.77	64%	0.641	S	S	*	*			trans	-61.6	100.5	167.4	-56.6	0	0	0	0	111.3
285	I	28.8	Very low	26.5	Very low	115 Å²	115	127.2 Å²	127.2	59%	0.59	65%	0.65	S	S	*	*			trans	-105.6	107.3	158.8	-60.5	179.4	0	0	0	106.8	N283 L287	N283-I285 PolarHBondContact O-N 2.93Å; I285-L287 VanDerWaalsContact C-N 3.33Å; I285-L287 HydrophobicContact CG2-CD2 4.09Å; I285-L287 HydrophobicContact CG2-CG 4.33Å; I285-L287 PolarHBondContact O-N 3.2Å
286	D	28.8	Very low	26.7	Very low	87 Å²	87	126.8 Å²	126.8	47%	0.465	65%	0.653	S	S	.	*			trans	-79.7	80.6	-176.3	-166.7	55.8	0	0	0	110.2	T288 T289 Q290	D286-T288 PolarHBondContact O-N 3.18Å; D286-T288 PolarHBondContact OD1-OG1 3.05Å; D286-T288 PolarHBondContact OD2-OG1 2.87Å; D286-T289 PolarHBondContact O-N 3.13Å; D286-T289 VanDerWaalsContact O-N 3.15Å; D286-T289 PolarHBondContact O-OG1 3.42Å; D286-T289 VanDerWaalsContact O-OG1 3.09Å; D286-T289 VanDerWaalsContact OD2-CB 3.3Å; D286-T289 WeakPolarHBondContact OD2-CB 3.35Å; D286-T289 WeakPolarHBondContact OD2-CG2 3.49Å; D286-T289 PolarHBondContact OD2-OG1 3.31Å; D286-Q290 PolarHBondContact O-N 2.92Å
287	L	29.5	Very low	26.7	Very low	96 Å²	96	123.8 Å²	123.8	50%	0.503	64%	0.641	S	S	.	*	H	α-helix	trans	-60.3	-27.3	-174.7	-70.2	168.4	0	0	0	113.1	I285 Y291	I285-L287 VanDerWaalsContact C-N 3.33Å; I285-L287 HydrophobicContact CG2-CD2 4.09Å; I285-L287 HydrophobicContact CG2-CG 4.33Å; I285-L287 PolarHBondContact O-N 3.2Å; L287-Y291 HydrophobicContact CD2-CD2 4.07Å; L287-Y291 HydrophobicContact CD2-CE2 3.85Å; L287-Y291 PolarHBondContact O-N 2.93Å
288	T	29.1	Very low	26.9	Very low	67 Å²	67	125.4 Å²	125.4	41%	0.411	64%	0.638	S	S	.	*	H	α-helix	trans	-58.1	-52.4	171.4	42.1	0	0	0	0	112	D286 K292	D286-T288 PolarHBondContact O-N 3.18Å; D286-T288 PolarHBondContact OD1-OG1 3.05Å; D286-T288 PolarHBondContact OD2-OG1 2.87Å; T288-K292 PolarHBondContact O-N 2.98Å
289	T	33	Very low	27.1	Very low	107 Å²	107	121.7 Å²	121.7	66%	0.656	63%	0.63	S	S	*	*	H	α-helix	trans	-73.5	-31	178	49.8	0	0	0	0	113.5	D286	D286-T289 PolarHBondContact O-N 3.13Å; D286-T289 VanDerWaalsContact O-N 3.15Å; D286-T289 PolarHBondContact O-OG1 3.42Å; D286-T289 VanDerWaalsContact O-OG1 3.09Å; D286-T289 VanDerWaalsContact OD2-CB 3.3Å; D286-T289 WeakPolarHBondContact OD2-CB 3.35Å; D286-T289 WeakPolarHBondContact OD2-CG2 3.49Å; D286-T289 PolarHBondContact OD2-OG1 3.31Å
290	Q	29.3	Very low	27.4	Very low	127 Å²	127	124.3 Å²	124.3	59%	0.593	62%	0.624	S	S	*	*	H	α-helix	trans	-70.4	-39.4	176.9	-76.3	-165.1	-16.5	0	0	113.9	D286	D286-Q290 PolarHBondContact O-N 2.92Å
291	Y	30.7	Very low	27.6	Very low	96 Å²	96	124.2 Å²	124.2	38%	0.376	62%	0.621	S	S	.	*	H	α-helix	trans	-113.1	-0.5	-167.9	-67.4	-83.2	0	0	0	115.5	P260 L287 I293	P260-Y291 HydrophobicContact CG-CE1 4.46Å; L287-Y291 HydrophobicContact CD2-CD2 4.07Å; L287-Y291 HydrophobicContact CD2-CE2 3.85Å; L287-Y291 PolarHBondContact O-N 2.93Å; Y291-I293 HydrophobicContact CG-CD1 4.42Å; Y291-I293 PolarHBondContact O-N 3.42Å; Y291-I293 VanDerWaalsContact O-N 3.17Å
292	K	30.3	Very low	28	Very low	199 Å²	199	121.9 Å²	121.9	87%	0.865	60%	0.603	S	S	*	*			trans	53.4	27.8	-173.7	-61.8	-175.2	176.3	-179.1	0	113.7	T288 K294	T288-K292 PolarHBondContact O-N 2.98Å; K292-K294 PolarHBondContact O-N 3.25Å
293	I	31.1	Very low	28.4	Very low	76 Å²	76	125 Å²	125	39%	0.39	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-70.6	124.2	176.3	-63.8	166.9	0	0	0	107.4	Y291	Y291-I293 HydrophobicContact CG-CD1 4.42Å; Y291-I293 PolarHBondContact O-N 3.42Å; Y291-I293 VanDerWaalsContact O-N 3.17Å
294	K	28.3	Very low	28.8	Very low	132 Å²	132	119.9 Å²	119.9	57%	0.574	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-66.2	143.2	169.1	-75.1	159.9	170.1	171.3	0	109.4	K292 N296 E297	K292-K294 PolarHBondContact O-N 3.25Å; K294-N296 PolarHBondContact O-N 3.24Å; K294-E297 HydrophobicContact CB-CB 4.46Å; K294-E297 HydrophobicContact CB-CG 4.37Å; K294-E297 HydrophobicContact CD-CG 4.24Å; K294-E297 WeakPolarHBondContact CD-OE1 3.34Å; K294-E297 WeakPolarHBondContact CD-OE2 3.12Å; K294-E297 WeakPolarHBondContact CE-OE1 3.3Å; K294-E297 IonicContact NZ-OE1 2.8Å; K294-E297 PolarHBondContact NZ-OE1 3.4Å; K294-E297 IonicContact NZ-OE2 2.63Å; K294-E297 PolarHBondContact O-N 2.94Å
295	E	26	Very low	29	Very low	162 Å²	162	115.2 Å²	115.2	76%	0.757	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	135.9	165	-61.7	178.1	134.5	0	0	109.8	E297	E295-E297 PolarHBondContact O-N 3.06Å
296	N	26.6	Very low	28.9	Very low	149 Å²	149	114.5 Å²	114.5	80%	0.797	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	-3.8	179.6	-45.4	-55.7	0	0	0	118.4	K294 Y298	K294-N296 PolarHBondContact O-N 3.24Å; N296-Y298 PolarHBondContact O-N 3.37Å
297	E	24.3	Very low	28.9	Very low	119 Å²	119	114.3 Å²	114.3	56%	0.556	56%	0.556	S	S	*	*			trans	-87.3	78.3	173.2	-77.3	-176.3	-171.6	0	0	112.6	K294 E295	K294-E297 HydrophobicContact CB-CB 4.46Å; K294-E297 HydrophobicContact CB-CG 4.37Å; K294-E297 HydrophobicContact CD-CG 4.24Å; K294-E297 WeakPolarHBondContact CD-OE1 3.34Å; K294-E297 WeakPolarHBondContact CD-OE2 3.12Å; K294-E297 WeakPolarHBondContact CE-OE1 3.3Å; K294-E297 IonicContact NZ-OE1 2.8Å; K294-E297 PolarHBondContact NZ-OE1 3.4Å; K294-E297 IonicContact NZ-OE2 2.63Å; K294-E297 PolarHBondContact O-N 2.94Å; E295-E297 PolarHBondContact O-N 3.06Å
298	Y	25.5	Very low	29.1	Very low	184 Å²	184	115 Å²	115	72%	0.722	55%	0.552	S	S	*	*			trans	-107.4	100.4	176.2	-70.5	-74	0	0	0	113.2	N296	N296-Y298 PolarHBondContact O-N 3.37Å
299	I	26.7	Very low	29.1	Very low	121 Å²	121	116.4 Å²	116.4	62%	0.621	56%	0.562	S	S	*	*			trans	-80.8	130.5	167.8	-60.8	174.1	0	0	0	109.2	E301	I299-E301 HydrophobicContact CG2-CG 4.28Å
300	R	28.5	Very low	29.1	Very low	156 Å²	156	115.2 Å²	115.2	59%	0.589	55%	0.55	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	108.6	173.2	-66.3	-177.8	179.4	179.1	0.3	109.7
301	E	28	Very low	29.3	Very low	108 Å²	108	111 Å²	111	51%	0.505	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.5	174.6	-65	-173	160.8	0	0	111.2	I299 W303	I299-E301 HydrophobicContact CG2-CG 4.28Å; E301-W303 WeakPolarHBondContact OE2-CZ2 3.29Å; E301-W303 PolarHBondContact OE2-NE1 2.97Å
302	I	31.4	Very low	29.6	Very low	73 Å²	73	108.2 Å²	108.2	37%	0.374	53%	0.53	S	S	.	.			trans	-120.1	119.1	171.3	-58.7	-178.1	0	0	0	108.1	F304 V360	I302-F304 HydrophobicContact CB-CE2 3.98Å; I302-F304 HydrophobicContact CB-CZ 4.28Å; I302-F304 HydrophobicContact CG2-CD2 4.33Å; I302-F304 HydrophobicContact CG2-CE1 4.28Å; I302-F304 HydrophobicContact CG2-CE2 3.73Å; I302-F304 HydrophobicContact CG2-CZ 3.7Å; I302-F304 WeakPolarHBondContact O-CD2 3.23Å; I302-F304 VanDerWaalsContact O-CE2 3.29Å; I302-F304 WeakPolarHBondContact O-CE2 3.2Å; I302-V360 HydrophobicContact CD1-CG2 4.23Å; I302-V360 HydrophobicContact CG1-CG2 4.48Å
303	W	32.7	Very low	30	Very low	183 Å²	183	100.2 Å²	100.2	69%	0.693	50%	0.495	S	S	*	.			trans	-92.6	127.6	-176.8	-68.8	80.8	0	0	0	110.9	E301	E301-W303 WeakPolarHBondContact OE2-CZ2 3.29Å; E301-W303 PolarHBondContact OE2-NE1 2.97Å
304	F	31.9	Very low	30.2	Very low	46 Å²	46	101.2 Å²	101.2	20%	0.202	50%	0.501	C	S	.	.			trans	-115.5	145.4	-176.7	-61.7	-96.2	0	0	0	111.8	I302 L306 F313 L316 F358	I302-F304 HydrophobicContact CB-CE2 3.98Å; I302-F304 HydrophobicContact CB-CZ 4.28Å; I302-F304 HydrophobicContact CG2-CD2 4.33Å; I302-F304 HydrophobicContact CG2-CE1 4.28Å; I302-F304 HydrophobicContact CG2-CE2 3.73Å; I302-F304 HydrophobicContact CG2-CZ 3.7Å; I302-F304 WeakPolarHBondContact O-CD2 3.23Å; I302-F304 VanDerWaalsContact O-CE2 3.29Å; I302-F304 WeakPolarHBondContact O-CE2 3.2Å; F304-L306 PolarHBondContact O-N 2.73Å; F304-F313 HydrophobicContact CB-CD1 4.19Å; F304-F313 HydrophobicContact CB-CE1 3.28Å; F304-F313 HydrophobicContact CB-CZ 3.64Å; F304-F313 AromaticContact CD1-CD1 3.63Å; F304-F313 HydrophobicContact CD1-CD1 3.63Å; F304-F313 AromaticContact CD1-CE1 3.64Å; F304-F313 HydrophobicContact CD1-CE1 3.64Å; F304-F313 HydrophobicContact CD1-CZ 4.47Å; F304-F313 HydrophobicContact CD2-CD1 4.26Å; F304-F313 AromaticContact CD2-CE1 3.87Å; F304-F313 HydrophobicContact CD2-CE1 3.87Å; F304-F313 AromaticContact CE1-CD1 3.98Å; F304-F313 HydrophobicContact CE1-CD1 3.98Å; F304-F313 HydrophobicContact CE1-CE1 4.38Å; F304-F313 AromaticContact CG-CD1 3.79Å; F304-F313 HydrophobicContact CG-CD1 3.79Å; F304-F313 AromaticContact CG-CE1 3.34Å; F304-F313 HydrophobicContact CG-CE1 3.34Å; F304-F313 HydrophobicContact CG-CZ 4.18Å; F304-F313 HydrophobicContact CZ-CD1 4.44Å; F304-L316 HydrophobicContact CD1-CD2 3.98Å; F304-L316 HydrophobicContact CE1-CD2 3.76Å; F304-L316 HydrophobicContact CE1-CG 4.3Å; F304-F358 HydrophobicContact CD2-CD2 4.29Å; F304-F358 HydrophobicContact CE2-CD2 4.23Å
305	P	28.1	Very low	30.8	Very low	16 Å²	16	102.8 Å²	102.8	10%	0.104	50%	0.504	C	S	.	.			trans	-72.3	129.2	179	28.7	-34	0	0	0	112.5	I224 R308 Y312	I224-P305 HydrophobicContact CG2-CB 3.94Å; P305-R308 HydrophobicContact CG-CG 4.14Å; P305-Y312 HydrophobicContact CG-CE1 4.32Å
306	L	27.5	Very low	31.6	Very low	101 Å²	101	96 Å²	96	53%	0.529	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	151.7	174.4	-69.8	170.8	0	0	0	112.6	F304 R308	F304-L306 PolarHBondContact O-N 2.73Å; L306-R308 VanDerWaalsContact C-N 3.35Å; L306-R308 PolarHBondContact O-N 3.05Å
307	G	27.9	Very low	32.2	Very low	83 Å²	83	90.6 Å²	90.6	86%	0.856	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	14.6	173.1	0	0	0	0	0	115.3
308	R	34.5	Very low	33	Very low	111 Å²	111	87.6 Å²	87.6	42%	0.419	44%	0.436	S	S	.	.			trans	-92.3	139.4	168.5	-64.8	-53.9	-166.2	179.3	5	110.9	L228 P305 L306 Y312 F313	L228-R308 VanDerWaalsContact CD2-NH2 3.32Å; P305-R308 HydrophobicContact CG-CG 4.14Å; L306-R308 VanDerWaalsContact C-N 3.35Å; L306-R308 PolarHBondContact O-N 3.05Å; R308-Y312 HydrophobicContact CB-CD1 4.01Å; R308-Y312 HydrophobicContact CB-CG 4.02Å; R308-Y312 HydrophobicContact CG-CD1 4.2Å; R308-Y312 HydrophobicContact CG-CG 4.27Å; R308-F313 HydrophobicContact CB-CE2 4.18Å
309	P	29.6	Very low	33.7	Very low	96 Å²	96	80.8 Å²	80.8	62%	0.623	42%	0.416	S	S	*	.			trans	-65.5	151.2	176.6	29	-35.3	0	0	0	110.5	G311 Y312	P309-G311 PolarHBondContact O-N 2.77Å; P309-Y312 VanDerWaalsContact O-CB 3.3Å; P309-Y312 WeakPolarHBondContact O-CB 3.44Å; P309-Y312 PolarHBondContact O-N 2.93Å
310	M	33	Very low	34.4	Very low	81 Å²	81	76.4 Å²	76.4	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-57.4	-24.3	-175.4	-149.6	72	84.6	0	0	113.5	Y312 F313 N314 Y342	M310-Y312 PolarHBondContact O-N 3.14Å; M310-F313 WeakPolarHBondContact O-CB 3.21Å; M310-F313 PolarHBondContact O-N 2.86Å; M310-F313 VanDerWaalsContact O-N 3.1Å; M310-F313 HydrophobicContact SD-CD2 4.39Å; M310-F313 HydrophobicContact SD-CG 4.43Å; M310-N314 PolarHBondContact O-N 3.47Å; M310-Y342 HydrophobicContact CE-CD2 4.42Å; M310-Y342 HydrophobicContact CE-CE2 4.19Å
311	G	32.5	Very low	34.8	Very low	40 Å²	40	70 Å²	70	41%	0.412	37%	0.372	S	S	.	.	H	α-helix	trans	-60.7	-23.7	170.9	0	0	0	0	0	115.1	P309 R315	P309-G311 PolarHBondContact O-N 2.77Å; G311-R315 WeakPolarHBondContact O-CB 3.3Å; G311-R315 WeakPolarHBondContact O-CG 3.27Å; G311-R315 PolarHBondContact O-N 3.2Å; G311-R315 VanDerWaalsContact O-N 3.09Å
312	Y	37	Very low	35.4	Very low	37 Å²	37	69.4 Å²	69.4	15%	0.145	37%	0.367	C	S	.	.	H	α-helix	trans	-70.2	-46.3	169.9	177.1	-91.5	0	0	0	110.9	L228 T231 P305 R308 P309 M310 R315 L316	L228-Y312 HydrophobicContact CD2-CE2 3.99Å; T231-Y312 HydrophobicContact CG2-CE2 4.34Å; T231-Y312 PolarHBondContact OG1-OH 3.35Å; P305-Y312 HydrophobicContact CG-CE1 4.32Å; R308-Y312 HydrophobicContact CB-CD1 4.01Å; R308-Y312 HydrophobicContact CB-CG 4.02Å; R308-Y312 HydrophobicContact CG-CD1 4.2Å; R308-Y312 HydrophobicContact CG-CG 4.27Å; P309-Y312 VanDerWaalsContact O-CB 3.3Å; P309-Y312 WeakPolarHBondContact O-CB 3.44Å; P309-Y312 PolarHBondContact O-N 2.93Å; M310-Y312 PolarHBondContact O-N 3.14Å; Y312-R315 PolarHBondContact O-N 3.48Å; Y312-L316 HydrophobicContact CE1-CD2 3.99Å; Y312-L316 WeakPolarHBondContact O-CB 3.32Å; Y312-L316 PolarHBondContact O-N 3.4Å
313	F	38.1	Very low	35.7	Very low	31 Å²	31	69.3 Å²	69.3	14%	0.136	37%	0.37	C	S	.	.	H	α-helix	trans	-61.8	-48.9	176	-69.1	-106.4	0	0	0	110.3	F304 R308 M310 R315 L316 S317 F358	F304-F313 HydrophobicContact CB-CD1 4.19Å; F304-F313 HydrophobicContact CB-CE1 3.28Å; F304-F313 HydrophobicContact CB-CZ 3.64Å; F304-F313 AromaticContact CD1-CD1 3.63Å; F304-F313 HydrophobicContact CD1-CD1 3.63Å; F304-F313 AromaticContact CD1-CE1 3.64Å; F304-F313 HydrophobicContact CD1-CE1 3.64Å; F304-F313 HydrophobicContact CD1-CZ 4.47Å; F304-F313 HydrophobicContact CD2-CD1 4.26Å; F304-F313 AromaticContact CD2-CE1 3.87Å; F304-F313 HydrophobicContact CD2-CE1 3.87Å; F304-F313 AromaticContact CE1-CD1 3.98Å; F304-F313 HydrophobicContact CE1-CD1 3.98Å; F304-F313 HydrophobicContact CE1-CE1 4.38Å; F304-F313 AromaticContact CG-CD1 3.79Å; F304-F313 HydrophobicContact CG-CD1 3.79Å; F304-F313 AromaticContact CG-CE1 3.34Å; F304-F313 HydrophobicContact CG-CE1 3.34Å; F304-F313 HydrophobicContact CG-CZ 4.18Å; F304-F313 HydrophobicContact CZ-CD1 4.44Å; R308-F313 HydrophobicContact CB-CE2 4.18Å; M310-F313 WeakPolarHBondContact O-CB 3.21Å; M310-F313 PolarHBondContact O-N 2.86Å; M310-F313 VanDerWaalsContact O-N 3.1Å; M310-F313 HydrophobicContact SD-CD2 4.39Å; M310-F313 HydrophobicContact SD-CG 4.43Å; F313-R315 VanDerWaalsContact C-N 3.3Å; F313-R315 PolarHBondContact O-N 3.33Å; F313-L316 PolarHBondContact O-N 3.2Å; F313-S317 WeakPolarHBondContact O-CB 3.46Å; F313-S317 PolarHBondContact O-N 2.83Å; F313-S317 PolarHBondContact O-OG 3.01Å; F313-S317 VanDerWaalsContact O-OG 3.11Å; F313-F358 AromaticContact CD1-CE2 3.98Å; F313-F358 HydrophobicContact CD1-CE2 3.98Å; F313-F358 HydrophobicContact CE1-CD2 4.42Å; F313-F358 AromaticContact CE1-CE2 3.88Å; F313-F358 HydrophobicContact CE1-CE2 3.88Å
314	N	36.7	Very low	35.8	Very low	96 Å²	96	64.1 Å²	64.1	51%	0.513	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-38.1	177.6	-68.9	2.2	0	0	0	112.2	M310 V318	M310-N314 PolarHBondContact O-N 3.47Å; N314-V318 WeakPolarHBondContact O-CB 3.23Å; N314-V318 WeakPolarHBondContact O-CG2 3.37Å; N314-V318 PolarHBondContact O-N 3.17Å
315	R	40.4	Very low	35.8	Very low	165 Å²	165	62.9 Å²	62.9	62%	0.623	35%	0.352	S	S	*	.	H	α-helix	trans	-66.5	-48.1	173.2	-77.3	174.1	-168.4	-163.3	4.3	112.3	G311 Y312 F313 V318 S319	G311-R315 WeakPolarHBondContact O-CB 3.3Å; G311-R315 WeakPolarHBondContact O-CG 3.27Å; G311-R315 PolarHBondContact O-N 3.2Å; G311-R315 VanDerWaalsContact O-N 3.09Å; Y312-R315 PolarHBondContact O-N 3.48Å; F313-R315 VanDerWaalsContact C-N 3.3Å; F313-R315 PolarHBondContact O-N 3.33Å; R315-V318 PolarHBondContact O-N 2.83Å; R315-S319 WeakPolarHBondContact O-CB 3.2Å; R315-S319 PolarHBondContact O-N 2.9Å; R315-S319 PolarHBondContact O-OG 3.21Å
316	L	42.6	Very low	36.1	Very low	20 Å²	20	65.5 Å²	65.5	11%	0.105	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-43.5	-179.3	-177.7	51	0	0	0	111	T231 F304 Y312 F313 S319 L320	T231-L316 HydrophobicContact CG2-CD1 4.29Å; F304-L316 HydrophobicContact CD1-CD2 3.98Å; F304-L316 HydrophobicContact CE1-CD2 3.76Å; F304-L316 HydrophobicContact CE1-CG 4.3Å; Y312-L316 HydrophobicContact CE1-CD2 3.99Å; Y312-L316 WeakPolarHBondContact O-CB 3.32Å; Y312-L316 PolarHBondContact O-N 3.4Å; F313-L316 PolarHBondContact O-N 3.2Å; L316-S319 PolarHBondContact O-N 2.96Å; L316-L320 HydrophobicContact CD1-CD1 4.06Å; L316-L320 HydrophobicContact CD1-CG 4.17Å; L316-L320 HydrophobicContact CG-CD1 4.05Å; L316-L320 VanDerWaalsContact O-CB 3.3Å; L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 VanDerWaalsContact O-CG 3.22Å; L316-L320 WeakPolarHBondContact O-CG 3.25Å; L316-L320 PolarHBondContact O-N 3.19Å
317	S	39.8	Very low	36.3	Very low	36 Å²	36	67.5 Å²	67.5	25%	0.252	37%	0.372	S	S	.	.	H	α-helix	trans	-63.8	-42	173.3	-61.5	0	0	0	0	112.7	F313 C321	F313-S317 WeakPolarHBondContact O-CB 3.46Å; F313-S317 PolarHBondContact O-N 2.83Å; F313-S317 PolarHBondContact O-OG 3.01Å; F313-S317 VanDerWaalsContact O-OG 3.11Å; S317-C321 WeakPolarHBondContact O-CB 3.34Å; S317-C321 PolarHBondContact O-N 3.02Å; S317-C321 PolarHBondContact O-SG 3.37Å
318	V	39.9	Very low	36.4	Very low	55 Å²	55	68 Å²	68	33%	0.333	36%	0.358	S	S	.	.	H	α-helix	trans	-67.6	-38.2	175.6	164.6	0	0	0	0	111.7	N314 R315 K322 F330	N314-V318 WeakPolarHBondContact O-CB 3.23Å; N314-V318 WeakPolarHBondContact O-CG2 3.37Å; N314-V318 PolarHBondContact O-N 3.17Å; R315-V318 PolarHBondContact O-N 2.83Å; V318-K322 HydrophobicContact CG1-CD 3.89Å; V318-K322 HydrophobicContact CG1-CG 4.46Å; V318-K322 VanDerWaalsContact O-CB 3.3Å; V318-K322 WeakPolarHBondContact O-CB 3.4Å; V318-K322 WeakPolarHBondContact O-CG 3.43Å; V318-K322 PolarHBondContact O-N 3.47Å; V318-F330 HydrophobicContact CG1-CE2 4.46Å; V318-F330 HydrophobicContact CG1-CZ 3.95Å; V318-F330 HydrophobicContact CG2-CZ 4.39Å
319	S	40.9	Very low	36.3	Very low	42 Å²	42	68.8 Å²	68.8	29%	0.294	37%	0.365	S	S	.	.	H	α-helix	trans	-68.3	-44	175.3	-69.5	0	0	0	0	111.4	R315 L316 K322 V323	R315-S319 WeakPolarHBondContact O-CB 3.2Å; R315-S319 PolarHBondContact O-N 2.9Å; R315-S319 PolarHBondContact O-OG 3.21Å; L316-S319 PolarHBondContact O-N 2.96Å; S319-K322 PolarHBondContact O-N 3.2Å; S319-V323 WeakPolarHBondContact O-CB 3.42Å; S319-V323 VanDerWaalsContact O-CG2 3.27Å; S319-V323 WeakPolarHBondContact O-CG2 3.23Å; S319-V323 PolarHBondContact O-N 3.12Å
320	L	41	Very low	36.4	Very low	29 Å²	29	65.9 Å²	65.9	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-59.7	-49.2	172.9	-74.8	166.8	0	0	0	111	L316 K322 V323 I324	L316-L320 HydrophobicContact CD1-CD1 4.06Å; L316-L320 HydrophobicContact CD1-CG 4.17Å; L316-L320 HydrophobicContact CG-CD1 4.05Å; L316-L320 VanDerWaalsContact O-CB 3.3Å; L316-L320 WeakPolarHBondContact O-CB 3.46Å; L316-L320 VanDerWaalsContact O-CG 3.22Å; L316-L320 WeakPolarHBondContact O-CG 3.25Å; L316-L320 PolarHBondContact O-N 3.19Å; L320-K322 PolarHBondContact O-N 3.37Å; L320-V323 CarbonylContact O-C 3.49Å; L320-V323 PolarHBondContact O-N 3.29Å; L320-V323 VanDerWaalsContact O-N 3.12Å; L320-I324 HydrophobicContact CB-CD1 4.25Å; L320-I324 WeakPolarHBondContact O-CB 3.47Å; L320-I324 WeakPolarHBondContact O-CD1 3.5Å; L320-I324 WeakPolarHBondContact O-CG1 3.45Å; L320-I324 PolarHBondContact O-N 3.2Å
321	C	38.1	Very low	36.3	Very low	20 Å²	20	68.1 Å²	68.1	14%	0.135	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-37.5	177.9	-66	0	0	0	0	112.5	S317 V323 I324 C325 F330	S317-C321 WeakPolarHBondContact O-CB 3.34Å; S317-C321 PolarHBondContact O-N 3.02Å; S317-C321 PolarHBondContact O-SG 3.37Å; C321-V323 VanDerWaalsContact C-N 3.25Å; C321-V323 PolarHBondContact O-N 2.87Å; C321-I324 PolarHBondContact O-N 3.43Å; C321-C325 WeakPolarHBondContact O-CB 3.5Å; C321-C325 PolarHBondContact O-N 3.2Å; C321-C325 PolarHBondContact O-SG 2.93Å; C321-F330 HydrophobicContact CB-CD2 3.77Å; C321-F330 HydrophobicContact CB-CE2 3.68Å
322	K	40.4	Very low	36.2	Very low	96 Å²	96	73 Å²	73	42%	0.417	37%	0.367	S	S	.	.	H	α-helix	trans	-65	-27.3	173.7	-79.1	170.9	178.5	174.4	0	113.7	V318 S319 L320 F330	V318-K322 HydrophobicContact CG1-CD 3.89Å; V318-K322 HydrophobicContact CG1-CG 4.46Å; V318-K322 VanDerWaalsContact O-CB 3.3Å; V318-K322 WeakPolarHBondContact O-CB 3.4Å; V318-K322 WeakPolarHBondContact O-CG 3.43Å; V318-K322 PolarHBondContact O-N 3.47Å; S319-K322 PolarHBondContact O-N 3.2Å; L320-K322 PolarHBondContact O-N 3.37Å; K322-F330 HydrophobicContact CG-CD1 4.06Å; K322-F330 HydrophobicContact CG-CD2 3.88Å; K322-F330 HydrophobicContact CG-CE1 4.21Å; K322-F330 HydrophobicContact CG-CE2 4.04Å; K322-F330 HydrophobicContact CG-CG 3.9Å; K322-F330 HydrophobicContact CG-CZ 4.21Å
323	V	36.4	Very low	35.9	Very low	72 Å²	72	73 Å²	73	44%	0.436	37%	0.367	S	S	.	.	H	α-helix	trans	-88.8	-31.4	178	171.8	0	0	0	0	111.8	F268 S319 L320 C321	F268-V323 HydrophobicContact CB-CG1 3.8Å; F268-V323 HydrophobicContact CD1-CG1 4.01Å; F268-V323 HydrophobicContact CD2-CG1 3.24Å; F268-V323 HydrophobicContact CE1-CG1 4.41Å; F268-V323 HydrophobicContact CE2-CG1 3.68Å; F268-V323 HydrophobicContact CG-CG1 3.41Å; F268-V323 VanDerWaalsContact CG-CG1 3.41Å; F268-V323 HydrophobicContact CZ-CG1 4.26Å; S319-V323 WeakPolarHBondContact O-CB 3.42Å; S319-V323 VanDerWaalsContact O-CG2 3.27Å; S319-V323 WeakPolarHBondContact O-CG2 3.23Å; S319-V323 PolarHBondContact O-N 3.12Å; L320-V323 CarbonylContact O-C 3.49Å; L320-V323 PolarHBondContact O-N 3.29Å; L320-V323 VanDerWaalsContact O-N 3.12Å; C321-V323 VanDerWaalsContact C-N 3.25Å; C321-V323 PolarHBondContact O-N 2.87Å
324	I	35.1	Very low	35.5	Very low	74 Å²	74	75 Å²	75	38%	0.379	39%	0.385	S	S	.	.	H	α-helix	trans	-82.9	-41.4	179.9	-69.2	164.3	0	0	0	112.2	F268 L320 C321	F268-I324 HydrophobicContact CE1-CG1 4.04Å; F268-I324 HydrophobicContact CZ-CD1 4.45Å; F268-I324 HydrophobicContact CZ-CG1 3.67Å; L320-I324 HydrophobicContact CB-CD1 4.25Å; L320-I324 WeakPolarHBondContact O-CB 3.47Å; L320-I324 WeakPolarHBondContact O-CD1 3.5Å; L320-I324 WeakPolarHBondContact O-CG1 3.45Å; L320-I324 PolarHBondContact O-N 3.2Å; C321-I324 PolarHBondContact O-N 3.43Å
325	C	32.6	Very low	35.1	Very low	19 Å²	19	73.9 Å²	73.9	13%	0.128	40%	0.396	C	S	.	.	S	Bend	trans	-88.2	-11.1	-171.3	-58.8	0	0	0	0	114.2	C321 K329 F330	C321-C325 WeakPolarHBondContact O-CB 3.5Å; C321-C325 PolarHBondContact O-N 3.2Å; C321-C325 PolarHBondContact O-SG 2.93Å; C325-K329 HydrophobicContact CB-CB 4.39Å; C325-K329 WeakPolarHBondContact O-CB 3.1Å; C325-K329 WeakPolarHBondContact O-CD 3.28Å; C325-K329 WeakPolarHBondContact O-CG 3.43Å; C325-F330 HydrophobicContact CB-CB 4.36Å
326	D	34.4	Very low	34.6	Very low	72 Å²	72	69.6 Å²	69.6	39%	0.385	39%	0.391	S	S	.	.	H	α-helix	trans	64.3	155.6	-158.4	-156.3	-11.5	0	0	0	112.1	T328 K329 F330	D326-T328 PolarHBondContact O-N 3.08Å; D326-K329 PolarHBondContact O-N 2.91Å; D326-F330 PolarHBondContact O-N 3.14Å; D326-F330 VanDerWaalsContact O-N 3.12Å
327	Q	32	Very low	33.9	Very low	142 Å²	142	72.3 Å²	72.3	66%	0.664	41%	0.405	S	S	*	.	H	α-helix	trans	-64	-26.5	-173.6	-75.2	-158.2	-19.4	0	0	113.2
328	T	29.6	Very low	33.2	Very low	93 Å²	93	76 Å²	76	57%	0.571	43%	0.428	S	S	*	.	H	α-helix	trans	-72.2	-55.6	178	45.5	0	0	0	0	111.8	D326 F330 I331	D326-T328 PolarHBondContact O-N 3.08Å; T328-F330 VanDerWaalsContact C-N 3.3Å; T328-F330 PolarHBondContact O-N 3.26Å; T328-I331 WeakPolarHBondContact O-CB 3.28Å; T328-I331 PolarHBondContact O-N 2.68Å
329	K	32.9	Very low	32.5	Very low	128 Å²	128	76.5 Å²	76.5	56%	0.557	43%	0.429	S	S	*	.	H	α-helix	trans	-74.2	-19.9	-177	-39.1	178.4	-175.8	172.3	0	112.8	C325 D326 I331 E332 F333	C325-K329 HydrophobicContact CB-CB 4.39Å; C325-K329 WeakPolarHBondContact O-CB 3.1Å; C325-K329 WeakPolarHBondContact O-CD 3.28Å; C325-K329 WeakPolarHBondContact O-CG 3.43Å; D326-K329 PolarHBondContact O-N 2.91Å; K329-I331 PolarHBondContact O-N 2.63Å; K329-E332 PolarHBondContact O-N 3.01Å; K329-F333 WeakPolarHBondContact O-CB 3.21Å; K329-F333 PolarHBondContact O-N 3.18Å
330	F	30.6	Very low	31.8	Very low	36 Å²	36	81 Å²	81	16%	0.158	45%	0.449	C	S	.	.	H	α-helix	trans	-56.1	-31	170.4	-178.1	-97	0	0	0	112.3	V318 C321 K322 C325 D326 T328 C334	V318-F330 HydrophobicContact CG1-CE2 4.46Å; V318-F330 HydrophobicContact CG1-CZ 3.95Å; V318-F330 HydrophobicContact CG2-CZ 4.39Å; C321-F330 HydrophobicContact CB-CD2 3.77Å; C321-F330 HydrophobicContact CB-CE2 3.68Å; K322-F330 HydrophobicContact CG-CD1 4.06Å; K322-F330 HydrophobicContact CG-CD2 3.88Å; K322-F330 HydrophobicContact CG-CE1 4.21Å; K322-F330 HydrophobicContact CG-CE2 4.04Å; K322-F330 HydrophobicContact CG-CG 3.9Å; K322-F330 HydrophobicContact CG-CZ 4.21Å; C325-F330 HydrophobicContact CB-CB 4.36Å; D326-F330 PolarHBondContact O-N 3.14Å; D326-F330 VanDerWaalsContact O-N 3.12Å; T328-F330 VanDerWaalsContact C-N 3.3Å; T328-F330 PolarHBondContact O-N 3.26Å; F330-C334 VanDerWaalsContact CE1-SG 3.55Å; F330-C334 VanDerWaalsContact CZ-SG 3.54Å; F330-C334 PolarHBondContact O-N 3.14Å; F330-C334 PolarHBondContact O-SG 3.25Å
331	I	32	Very low	31	Very low	128 Å²	128	86.9 Å²	86.9	66%	0.656	47%	0.473	S	S	*	.	H	α-helix	trans	-72.3	-44.9	177.2	-60.4	172.7	0	0	0	110.7	T328 K329 F333 C334 G335	T328-I331 WeakPolarHBondContact O-CB 3.28Å; T328-I331 PolarHBondContact O-N 2.68Å; K329-I331 PolarHBondContact O-N 2.63Å; I331-F333 VanDerWaalsContact C-N 3.31Å; I331-F333 PolarHBondContact O-N 3.14Å; I331-C334 PolarHBondContact O-N 3.17Å; I331-G335 PolarHBondContact O-N 3.3Å
332	E	29.4	Very low	30.4	Very low	141 Å²	141	92.5 Å²	92.5	66%	0.659	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-36.7	175.6	-57.8	176.8	134.4	0	0	111.8	K329 G335 S336	K329-E332 PolarHBondContact O-N 3.01Å; E332-G335 PolarHBondContact O-N 2.85Å; E332-S336 PolarHBondContact O-N 3.49Å; E332-S336 PolarHBondContact O-OG 3.31Å
333	F	30.6	Very low	29.6	Very low	37 Å²	37	94.2 Å²	94.2	16%	0.162	51%	0.511	C	S	.	.	H	α-helix	trans	-68.1	-39.2	176.9	-164.8	-105.7	0	0	0	112.4	K329 I331 G335 S336 I337 I367	K329-F333 WeakPolarHBondContact O-CB 3.21Å; K329-F333 PolarHBondContact O-N 3.18Å; I331-F333 VanDerWaalsContact C-N 3.31Å; I331-F333 PolarHBondContact O-N 3.14Å; F333-G335 VanDerWaalsContact C-N 3.25Å; F333-G335 PolarHBondContact O-N 3.45Å; F333-S336 PolarHBondContact O-N 2.96Å; F333-S336 PolarHBondContact O-OG 3.21Å; F333-I337 HydrophobicContact CD1-CD1 3.97Å; F333-I337 HydrophobicContact CE1-CD1 3.51Å; F333-I337 HydrophobicContact CZ-CD1 3.87Å; F333-I367 HydrophobicContact CE1-CD1 4.03Å; F333-I367 HydrophobicContact CE1-CG1 4.46Å; F333-I367 HydrophobicContact CE2-CG1 4.32Å; F333-I367 HydrophobicContact CZ-CB 3.83Å; F333-I367 HydrophobicContact CZ-CD1 3.66Å; F333-I367 HydrophobicContact CZ-CG1 3.62Å
334	C	30.5	Very low	29.1	Very low	75 Å²	75	96.7 Å²	96.7	51%	0.507	52%	0.518	S	S	.	.	H	α-helix	trans	-67.3	-25.4	171.6	-70.1	0	0	0	0	113.1	F330 I331 S336	F330-C334 VanDerWaalsContact CE1-SG 3.55Å; F330-C334 VanDerWaalsContact CZ-SG 3.54Å; F330-C334 PolarHBondContact O-N 3.14Å; F330-C334 PolarHBondContact O-SG 3.25Å; I331-C334 PolarHBondContact O-N 3.17Å; C334-S336 VanDerWaalsContact C-N 3.31Å
335	G	28.6	Very low	28.6	Very low	72 Å²	72	99.4 Å²	99.4	74%	0.742	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-7.2	176.5	0	0	0	0	0	115.1	I331 E332 F333	I331-G335 PolarHBondContact O-N 3.3Å; E332-G335 PolarHBondContact O-N 2.85Å; F333-G335 VanDerWaalsContact C-N 3.25Å; F333-G335 PolarHBondContact O-N 3.45Å
336	S	28.7	Very low	28.1	Very low	75 Å²	75	103.8 Å²	103.8	52%	0.524	55%	0.548	S	S	.	.	S	Bend	trans	-122.2	0.7	-169.6	44.4	0	0	0	0	115	E332 F333 C334	E332-S336 PolarHBondContact O-N 3.49Å; E332-S336 PolarHBondContact O-OG 3.31Å; F333-S336 PolarHBondContact O-N 2.96Å; F333-S336 PolarHBondContact O-OG 3.21Å; C334-S336 VanDerWaalsContact C-N 3.31Å
337	I	28	Very low	27.6	Very low	77 Å²	77	102 Å²	102	40%	0.395	54%	0.54	S	S	.	.			trans	-100.9	113.6	174.1	-64.8	173.1	0	0	0	110.2	F333 D339	F333-I337 HydrophobicContact CD1-CD1 3.97Å; F333-I337 HydrophobicContact CE1-CD1 3.51Å; F333-I337 HydrophobicContact CZ-CD1 3.87Å; I337-D339 PolarHBondContact O-N 2.91Å
338	P	25.4	Very low	27.1	Very low	112 Å²	112	104 Å²	104	73%	0.727	55%	0.547	S	S	*	.			trans	-72.3	124.8	167.3	30.1	-32.2	0	0	0	110.1
339	D	25.4	Very low	26.9	Very low	66 Å²	66	106.8 Å²	106.8	35%	0.353	56%	0.558	S	S	.	*			trans	31.7	101.5	165.7	-77.7	-40.5	0	0	0	118.1	I337 K341 W437	I337-D339 PolarHBondContact O-N 2.91Å; D339-K341 HydrophobicContact CB-CB 4.02Å; D339-K341 HydrophobicContact CB-CD 3.82Å; D339-K341 HydrophobicContact CB-CG 3.89Å; D339-K341 PolarHBondContact O-N 3.46Å; D339-K341 VanDerWaalsContact OD2-CE 3.24Å; D339-K341 WeakPolarHBondContact OD2-CE 3.16Å; D339-K341 IonicContact OD2-NZ 2.65Å; D339-K341 PolarHBondContact OD2-NZ 2.91Å; D339-W437 WeakPolarHBondContact OD1-CH2 3.42Å
340	L	25.4	Very low	26.5	Very low	136 Å²	136	108 Å²	108	71%	0.712	57%	0.57	S	S	*	*			trans	-70	71.5	150.4	-88.4	166.2	0	0	0	109.7	Y342 L369	L340-Y342 PolarHBondContact O-N 3.05Å; L340-Y342 VanDerWaalsContact O-N 3.08Å; L340-L369 HydrophobicContact CD2-CD1 4.45Å
341	K	24.1	Very low	26.1	Very low	153 Å²	153	111.2 Å²	111.2	67%	0.665	60%	0.597	S	S	*	*			trans	-77.6	92.3	-173	-117.8	166.2	-174.9	150.6	0	111.6	D339 T343	D339-K341 HydrophobicContact CB-CB 4.02Å; D339-K341 HydrophobicContact CB-CD 3.82Å; D339-K341 HydrophobicContact CB-CG 3.89Å; D339-K341 PolarHBondContact O-N 3.46Å; D339-K341 VanDerWaalsContact OD2-CE 3.24Å; D339-K341 WeakPolarHBondContact OD2-CE 3.16Å; D339-K341 IonicContact OD2-NZ 2.65Å; D339-K341 PolarHBondContact OD2-NZ 2.91Å; K341-T343 PolarHBondContact O-N 2.82Å
342	Y	26.7	Very low	25.8	Very low	138 Å²	138	110 Å²	110	54%	0.541	59%	0.59	S	S	.	*			trans	-61.2	126.5	174.5	171.1	-103.2	0	0	0	112.4	M310 L340 E344	M310-Y342 HydrophobicContact CE-CD2 4.42Å; M310-Y342 HydrophobicContact CE-CE2 4.19Å; L340-Y342 PolarHBondContact O-N 3.05Å; L340-Y342 VanDerWaalsContact O-N 3.08Å; Y342-E344 HydrophobicContact CE1-CB 4Å; Y342-E344 HydrophobicContact CE2-CB 4.21Å; Y342-E344 PolarHBondContact OH-OE1 3.34Å; Y342-E344 PolarHBondContact OH-OE2 3.42Å
343	T	23.2	Very low	25.5	Very low	133 Å²	133	107.6 Å²	107.6	82%	0.816	59%	0.585	S	S	*	*			trans	-130.9	100.6	168.4	38.5	0	0	0	0	110.7	K341	K341-T343 PolarHBondContact O-N 2.82Å
344	E	25.3	Very low	25.4	Very low	123 Å²	123	110.7 Å²	110.7	58%	0.575	60%	0.598	S	S	*	*			trans	-80	132.7	176	-164.1	167.3	-111.8	0	0	111.8	Y342 I346	Y342-E344 HydrophobicContact CE1-CB 4Å; Y342-E344 HydrophobicContact CE2-CB 4.21Å; Y342-E344 PolarHBondContact OH-OE1 3.34Å; Y342-E344 PolarHBondContact OH-OE2 3.42Å; E344-I346 HydrophobicContact CG-CG1 3.99Å
345	K	24.2	Very low	25.2	Very low	132 Å²	132	111.7 Å²	111.7	57%	0.574	60%	0.596	S	S	*	*			trans	-116.5	84.7	171.4	-102.5	178.1	176.8	169.5	0	109.7
346	I	23	Very low	25.2	Very low	110 Å²	110	112.5 Å²	112.5	56%	0.564	58%	0.583	S	S	*	*			trans	-65.9	134.3	171.4	-56.6	-179.2	0	0	0	109	E344 F348	E344-I346 HydrophobicContact CG-CG1 3.99Å; I346-F348 HydrophobicContact CG2-CD2 4.05Å; I346-F348 HydrophobicContact CG2-CE2 3.57Å; I346-F348 HydrophobicContact CG2-CZ 4.24Å
347	V	23.7	Very low	25.1	Very low	35 Å²	35	111.4 Å²	111.4	21%	0.212	57%	0.573	C	S	.	*			trans	-139.3	122.9	178.4	178.5	0	0	0	0	108.6	C392 I393	V347-C392 VanDerWaalsContact CG1-C 3.44Å; V347-C392 HydrophobicContact CG2-CB 4.46Å; V347-I393 VanDerWaalsContact CG2-C 3.43Å; V347-I393 WeakPolarHBondContact CG2-O 3.4Å
348	F	21.9	Very low	25.2	Very low	184 Å²	184	109.7 Å²	109.7	81%	0.807	56%	0.563	S	S	*	*			trans	-97.6	116.9	169.7	-71	-86.5	0	0	0	109.4	I346	I346-F348 HydrophobicContact CG2-CD2 4.05Å; I346-F348 HydrophobicContact CG2-CE2 3.57Å; I346-F348 HydrophobicContact CG2-CZ 4.24Å
349	N	25.4	Very low	25.3	Very low	151 Å²	151	106.1 Å²	106.1	81%	0.807	54%	0.537	S	S	*	.			trans	-156.9	143.2	147.6	-109.4	-23.4	0	0	0	107
350	D	24.2	Very low	25.4	Very low	153 Å²	153	104.4 Å²	104.4	82%	0.818	53%	0.529	S	S	*	.	S	Bend	trans	-68.5	147.1	-167.9	-64.4	-65.2	0	0	0	112.5
351	S	23.5	Very low	25.4	Very low	104 Å²	104	100.3 Å²	100.3	73%	0.727	51%	0.509	S	S	*	.	S	Bend	trans	61.9	100.1	-176.1	70.3	0	0	0	0	116.4
352	M	24	Very low	25.5	Very low	103 Å²	103	99.3 Å²	99.3	51%	0.507	50%	0.502	S	S	.	.				167.9	162.2	125.6	-85.2	-115.9	178.7	0	0	112.3	Y388 I390	M352-Y388 HydrophobicContact CE-CD1 4.49Å; M352-I390 HydrophobicContact CB-CB 3.54Å; M352-I390 HydrophobicContact CB-CG2 3.82Å; M352-I390 HydrophobicContact CE-CD1 4.02Å; M352-I390 HydrophobicContact CG-CB 3.66Å; M352-I390 HydrophobicContact CG-CD1 4.19Å; M352-I390 HydrophobicContact CG-CG1 4.32Å; M352-I390 HydrophobicContact CG-CG2 3.96Å; M352-I390 HydrophobicContact SD-CB 3.94Å; M352-I390 HydrophobicContact SD-CD1 4.01Å; M352-I390 HydrophobicContact SD-CG1 4.09Å
353	V	24.7	Very low	25.4	Very low	90 Å²	90	97 Å²	97	55%	0.545	50%	0.5	S	S	.	.			trans	-89.9	164.3	178.1	-178.4	0	0	0	0	110.5	G389 I390	V353-G389 CarbonylContact O-C 3.57Å; V353-G389 WeakPolarHBondContact O-CA 3.29Å; V353-I390 PolarHBondContact O-N 3.02Å
354	K	26.5	Very low	25.5	Very low	102 Å²	102	98.6 Å²	98.6	44%	0.443	50%	0.498	S	S	.	.			trans	-138.9	156.2	172	-66.8	174.7	-174.9	161.6	0	110.6	I390 K391	K354-I390 WeakPolarHBondContact CE-O 3.5Å; K354-K391 WeakPolarHBondContact CE-O 3.31Å; K354-K391 PolarHBondContact NZ-O 3.25Å
355	H	27.2	Very low	25.5	Very low	97 Å²	97	100 Å²	100	45%	0.449	51%	0.507	S	S	.	.			trans	-120.1	148.4	174.2	-67.2	-101.3	0	0	0	110.2
356	N	28	Very low	25.5	Very low	88 Å²	88	99.3 Å²	99.3	47%	0.471	50%	0.504	S	S	.	.			trans	-117.6	130.2	167	-73.3	46.8	0	0	0	108	F358 E371	N356-F358 HydrophobicContact CB-CE2 4.43Å; N356-E371 PolarHBondContact ND2-OE1 3.07Å; N356-E371 VanDerWaalsContact ND2-OE1 3.15Å
357	T	28.1	Very low	25.8	Very low	52 Å²	52	95.7 Å²	95.7	32%	0.319	49%	0.486	S	S	.	.			trans	-115.4	132.8	172.6	-57.2	0	0	0	0	108.6	V372	T357-V372 PolarHBondContact O-N 3.23Å
358	F	28.8	Very low	25.9	Very low	41 Å²	41	97 Å²	97	18%	0.18	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.8	174.9	-65.2	-76.8	0	0	0	109.4	F304 F313 N356 L369 E370	F304-F358 HydrophobicContact CD2-CD2 4.29Å; F304-F358 HydrophobicContact CE2-CD2 4.23Å; F313-F358 AromaticContact CD1-CE2 3.98Å; F313-F358 HydrophobicContact CD1-CE2 3.98Å; F313-F358 HydrophobicContact CE1-CD2 4.42Å; F313-F358 AromaticContact CE1-CE2 3.88Å; F313-F358 HydrophobicContact CE1-CE2 3.88Å; N356-F358 HydrophobicContact CB-CE2 4.43Å; F358-L369 HydrophobicContact CB-CD2 4.36Å; F358-E370 WeakPolarHBondContact CA-O 3.46Å
359	I	27.3	Very low	26.2	Very low	38 Å²	38	91.8 Å²	91.8	20%	0.195	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	130.5	166.4	-63.8	179.5	0	0	0	107.8	T361 E370 V372	I359-T361 HydrophobicContact CG2-CG2 4.06Å; I359-E370 HydrophobicContact CB-CB 4.44Å; I359-E370 PolarHBondContact N-O 3.45Å; I359-E370 VanDerWaalsContact N-O 3.1Å; I359-E370 PolarHBondContact O-N 2.59Å; I359-V372 HydrophobicContact CD1-CG2 3.73Å; I359-V372 HydrophobicContact CG1-CG2 4.04Å
360	V	28.4	Very low	26.2	Very low	29 Å²	29	89.5 Å²	89.5	18%	0.176	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	84.8	172.9	-175.8	0	0	0	0	108.1	I302 I367 L369	I302-V360 HydrophobicContact CD1-CG2 4.23Å; I302-V360 HydrophobicContact CG1-CG2 4.48Å; V360-I367 HydrophobicContact CG1-CG2 3.94Å; V360-L369 HydrophobicContact CG2-CD2 4.07Å
361	T	26.2	Very low	26.4	Very low	50 Å²	50	87.8 Å²	87.8	31%	0.307	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	123.4	171.9	20.9	0	0	0	0	109.2	I359 I368	I359-T361 HydrophobicContact CG2-CG2 4.06Å; T361-I368 PolarHBondContact N-O 3.3Å; T361-I368 PolarHBondContact O-N 2.86Å; T361-I368 WeakPolarHBondContact OG1-CB 3.44Å
362	Y	24.9	Very low	26.5	Very low	132 Å²	132	85.8 Å²	85.8	52%	0.518	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	95.7	-179.8	-163.8	-78	0	0	0	108.9	I367	Y362-I367 HydrophobicContact CD2-CG1 4.35Å; Y362-I367 HydrophobicContact CE2-CG1 4.47Å
363	D	25.6	Very low	26.6	Very low	91 Å²	91	86.5 Å²	86.5	49%	0.487	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	151.7	158.4	-167.7	-6.5	0	0	0	107.5	I365 K366	D363-I365 PolarHBondContact O-N 3.38Å; D363-K366 HydrophobicContact CB-CB 4.31Å; D363-K366 PolarHBondContact N-O 2.99Å; D363-K366 PolarHBondContact O-N 2.84Å
364	H	25.1	Very low	26.6	Very low	166 Å²	166	88.1 Å²	88.1	77%	0.769	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.8	-171.1	-56.3	-83	0	0	0	114
365	I	24	Very low	26.5	Very low	151 Å²	151	90.4 Å²	90.4	77%	0.774	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-5	-177.9	-46.3	178.5	0	0	0	110.8	D363	D363-I365 PolarHBondContact O-N 3.38Å
366	K	25.9	Very low	26.3	Very low	119 Å²	119	89.3 Å²	89.3	52%	0.517	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	128.7	-167.3	-129.4	176.3	-174.1	178.3	0	113.6	D363 I368	D363-K366 HydrophobicContact CB-CB 4.31Å; D363-K366 PolarHBondContact N-O 2.99Å; D363-K366 PolarHBondContact O-N 2.84Å; K366-I368 HydrophobicContact CD-CG1 4.36Å
367	I	28.5	Very low	26	Very low	34 Å²	34	89.7 Å²	89.7	17%	0.174	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	123.9	156	-57	173.6	0	0	0	107.2	F333 V360 Y362	F333-I367 HydrophobicContact CE1-CD1 4.03Å; F333-I367 HydrophobicContact CE1-CG1 4.46Å; F333-I367 HydrophobicContact CE2-CG1 4.32Å; F333-I367 HydrophobicContact CZ-CB 3.83Å; F333-I367 HydrophobicContact CZ-CD1 3.66Å; F333-I367 HydrophobicContact CZ-CG1 3.62Å; V360-I367 HydrophobicContact CG1-CG2 3.94Å; Y362-I367 HydrophobicContact CD2-CG1 4.35Å; Y362-I367 HydrophobicContact CE2-CG1 4.47Å
368	I	26.1	Very low	25.7	Very low	61 Å²	61	95.6 Å²	95.6	31%	0.313	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.7	167.9	-64.5	171.9	0	0	0	107.6	T361 K366 E370	T361-I368 PolarHBondContact N-O 3.3Å; T361-I368 PolarHBondContact O-N 2.86Å; T361-I368 WeakPolarHBondContact OG1-CB 3.44Å; K366-I368 HydrophobicContact CD-CG1 4.36Å; I368-E370 HydrophobicContact CG2-CG 3.85Å
369	L	27.5	Very low	25.4	Very low	76 Å²	76	100.2 Å²	100.2	40%	0.398	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	99.9	172.2	-79.3	168.6	0	0	0	108.1	L340 F358 V360	L340-L369 HydrophobicContact CD2-CD1 4.45Å; F358-L369 HydrophobicContact CB-CD2 4.36Å; V360-L369 HydrophobicContact CG2-CD2 4.07Å
370	E	26.7	Very low	25.1	Very low	102 Å²	102	103.6 Å²	103.6	48%	0.477	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.3	121.1	175.4	-85.4	171.2	-166.9	0	0	110.7	F358 I359 I368	F358-E370 WeakPolarHBondContact CA-O 3.46Å; I359-E370 HydrophobicContact CB-CB 4.44Å; I359-E370 PolarHBondContact N-O 3.45Å; I359-E370 VanDerWaalsContact N-O 3.1Å; I359-E370 PolarHBondContact O-N 2.59Å; I368-E370 HydrophobicContact CG2-CG 3.85Å
371	E	27.4	Very low	25	Very low	118 Å²	118	105.3 Å²	105.3	55%	0.551	57%	0.571	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.2	111.6	169.4	179.6	179.2	-160.7	0	0	109.2	N356 T373	N356-E371 PolarHBondContact ND2-OE1 3.07Å; N356-E371 VanDerWaalsContact ND2-OE1 3.15Å; E371-T373 HydrophobicContact CG-CG2 4.31Å
372	V	26.1	Very low	24.8	Very low	61 Å²	61	107.8 Å²	107.8	37%	0.37	59%	0.59	S	S	.	*			trans	-98.9	98.7	-178.8	-174.4	0	0	0	0	110.5	T357 I359 V374	T357-V372 PolarHBondContact O-N 3.23Å; I359-V372 HydrophobicContact CD1-CG2 3.73Å; I359-V372 HydrophobicContact CG1-CG2 4.04Å; V372-V374 HydrophobicContact CG1-CG2 4.02Å
373	T	26	Very low	24.7	Very low	119 Å²	119	110.1 Å²	110.1	73%	0.73	61%	0.606	S	S	*	*			trans	-87.1	112.4	173.9	55	0	0	0	0	111.8	E371	E371-T373 HydrophobicContact CG-CG2 4.31Å
374	V	25.4	Very low	24.8	Very low	123 Å²	123	110.3 Å²	110.3	75%	0.745	61%	0.614	S	S	*	*			trans	-103	133.4	178.3	-173.1	0	0	0	0	110.8	V372	V372-V374 HydrophobicContact CG1-CG2 4.02Å
375	N	24.4	Very low	24.7	Very low	151 Å²	151	109.1 Å²	109.1	81%	0.807	61%	0.613	S	S	*	*			trans	-77.8	133.6	175.9	-82.5	-50.5	0	0	0	111.5	S377	N375-S377 PolarHBondContact O-N 3.13Å
376	G	22.5	Very low	24.5	Very low	73 Å²	73	105.8 Å²	105.8	75%	0.753	60%	0.596	S	S	*	*			trans	-75	75.3	-177.3	0	0	0	0	0	114.7
377	S	21.6	Very low	24.3	Very low	97 Å²	97	105.7 Å²	105.7	68%	0.678	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-88.7	138.2	160	51.3	0	0	0	0	110.2	N375 F379	N375-S377 PolarHBondContact O-N 3.13Å; S377-F379 PolarHBondContact O-N 2.72Å
378	L	21.8	Very low	24.1	Very low	176 Å²	176	113 Å²	113	92%	0.921	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.5	125.6	180	-78	81.9	0	0	0	111.1
379	F	22.8	Very low	23.9	Very low	138 Å²	138	111.4 Å²	111.4	61%	0.605	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-99.3	121.3	157.3	-118.9	-95.2	0	0	0	107.5	S377 L381 I386	S377-F379 PolarHBondContact O-N 2.72Å; F379-L381 HydrophobicContact CB-CG 4.44Å; F379-L381 HydrophobicContact CD1-CD2 4.29Å; F379-L381 HydrophobicContact CD1-CG 4.36Å; F379-L381 PolarHBondContact O-N 3.26Å; F379-I386 HydrophobicContact CB-CD1 3.47Å; F379-I386 VanDerWaalsContact CB-CD1 3.47Å; F379-I386 HydrophobicContact CB-CG2 4.06Å; F379-I386 HydrophobicContact CG-CD1 4.03Å
380	S	21.2	Very low	23.6	Very low	109 Å²	109	112.1 Å²	112.1	76%	0.762	63%	0.629	S	S	*	*			trans	-70.6	97.8	170.8	179.7	0	0	0	0	108.2
381	L	25.1	Very low	23.4	Very low	64 Å²	64	115.4 Å²	115.4	34%	0.335	64%	0.641	S	S	.	*			trans	-119.2	98.5	173.9	-79.4	-155.5	0	0	0	108.1	F379 C384 D385 I386	F379-L381 HydrophobicContact CB-CG 4.44Å; F379-L381 HydrophobicContact CD1-CD2 4.29Å; F379-L381 HydrophobicContact CD1-CG 4.36Å; F379-L381 PolarHBondContact O-N 3.26Å; L381-C384 CarbonylContact C-O 3.43Å; L381-C384 VanDerWaalsContact CA-O 3.32Å; L381-C384 WeakPolarHBondContact CA-O 3.41Å; L381-C384 VanDerWaalsContact CB-O 3.26Å; L381-C384 WeakPolarHBondContact CB-O 3.37Å; L381-C384 HydrophobicContact CD1-CB 4.48Å; L381-D385 VanDerWaalsContact CD1-O 3.27Å; L381-D385 WeakPolarHBondContact CD1-O 3.37Å; L381-I386 HydrophobicContact CB-CB 3.98Å; L381-I386 HydrophobicContact CD1-CB 3.76Å; L381-I386 HydrophobicContact CD1-CD1 3.86Å; L381-I386 HydrophobicContact CD1-CG1 3.81Å; L381-I386 HydrophobicContact CG-CB 4.01Å; L381-I386 HydrophobicContact CG-CD1 4.3Å; L381-I386 HydrophobicContact CG-CG1 4.45Å
382	S	22.9	Very low	23.2	Very low	102 Å²	102	112.7 Å²	112.7	71%	0.713	64%	0.635	S	S	*	*	S	Bend	trans	-125.7	15.1	163.1	60.9	0	0	0	0	111.3	C384	S382-C384 CarbonylContact C-O 3.51Å; S382-C384 WeakPolarHBondContact CA-O 3.27Å; S382-C384 PolarHBondContact N-O 3.47Å; S382-C384 VanDerWaalsContact N-O 3.07Å
383	E	23.1	Very low	23	Very low	181 Å²	181	115 Å²	115	85%	0.846	64%	0.644	S	S	*	*	S	Bend	trans	-140.3	64.7	-178.2	-62.5	-172.8	144.4	0	0	105
384	C	26.9	Very low	22.9	Very low	96 Å²	96	115.2 Å²	115.2	65%	0.649	64%	0.637	S	S	*	*	S	Bend	trans	82.8	171.8	-138.5	-63.8	0	0	0	0	113.3	L381 S382	L381-C384 CarbonylContact C-O 3.43Å; L381-C384 VanDerWaalsContact CA-O 3.32Å; L381-C384 WeakPolarHBondContact CA-O 3.41Å; L381-C384 VanDerWaalsContact CB-O 3.26Å; L381-C384 WeakPolarHBondContact CB-O 3.37Å; L381-C384 HydrophobicContact CD1-CB 4.48Å; S382-C384 CarbonylContact C-O 3.51Å; S382-C384 WeakPolarHBondContact CA-O 3.27Å; S382-C384 PolarHBondContact N-O 3.47Å; S382-C384 VanDerWaalsContact N-O 3.07Å
385	D	22.7	Very low	22.8	Very low	141 Å²	141	116.4 Å²	116.4	75%	0.754	63%	0.634	S	S	*	*			trans	-135.5	153.6	-161.9	-53.4	75.1	0	0	0	113.6	L381	L381-D385 VanDerWaalsContact CD1-O 3.27Å; L381-D385 WeakPolarHBondContact CD1-O 3.37Å
386	I	20.9	Very low	22.8	Very low	81 Å²	81	115.5 Å²	115.5	42%	0.415	63%	0.634	S	S	.	*			trans	-141.1	162.7	-177.9	-127.9	174.1	0	0	0	120.2	F379 L381	F379-I386 HydrophobicContact CB-CD1 3.47Å; F379-I386 VanDerWaalsContact CB-CD1 3.47Å; F379-I386 HydrophobicContact CB-CG2 4.06Å; F379-I386 HydrophobicContact CG-CD1 4.03Å; L381-I386 HydrophobicContact CB-CB 3.98Å; L381-I386 HydrophobicContact CD1-CB 3.76Å; L381-I386 HydrophobicContact CD1-CD1 3.86Å; L381-I386 HydrophobicContact CD1-CG1 3.81Å; L381-I386 HydrophobicContact CG-CB 4.01Å; L381-I386 HydrophobicContact CG-CD1 4.3Å; L381-I386 HydrophobicContact CG-CG1 4.45Å
387	L	21.8	Very low	22.9	Very low	116 Å²	116	121.7 Å²	121.7	61%	0.607	64%	0.64	S	S	*	*			trans	-27.3	153.6	167.7	-74.2	156.6	0	0	0	120.6
388	Y	22.4	Very low	23.2	Very low	189 Å²	189	126.5 Å²	126.5	74%	0.741	65%	0.652	S	S	*	*			trans	-138	141.2	157.7	-86.8	-89.5	0	0	0	111.8	M352	M352-Y388 HydrophobicContact CE-CD1 4.49Å
389	G	22.2	Very low	23.4	Very low	27 Å²	27	128 Å²	128	28%	0.278	65%	0.651	S	S	.	*			trans	171.4	154.8	169.6	0	0	0	0	0	115.7	V353	V353-G389 CarbonylContact O-C 3.57Å; V353-G389 WeakPolarHBondContact O-CA 3.29Å
390	I	22.4	Very low	23.7	Very low	90 Å²	90	126.9 Å²	126.9	46%	0.462	66%	0.661	S	S	.	*			trans	-147.2	130.1	-166.9	-94.1	178.6	0	0	0	116.7	M352 V353 K354	M352-I390 HydrophobicContact CB-CB 3.54Å; M352-I390 HydrophobicContact CB-CG2 3.82Å; M352-I390 HydrophobicContact CE-CD1 4.02Å; M352-I390 HydrophobicContact CG-CB 3.66Å; M352-I390 HydrophobicContact CG-CD1 4.19Å; M352-I390 HydrophobicContact CG-CG1 4.32Å; M352-I390 HydrophobicContact CG-CG2 3.96Å; M352-I390 HydrophobicContact SD-CB 3.94Å; M352-I390 HydrophobicContact SD-CD1 4.01Å; M352-I390 HydrophobicContact SD-CG1 4.09Å; V353-I390 PolarHBondContact O-N 3.02Å; K354-I390 WeakPolarHBondContact CE-O 3.5Å
391	K	21.6	Very low	24.1	Very low	171 Å²	171	130 Å²	130	74%	0.743	67%	0.665	S	S	*	*			trans	65.4	156.2	136.9	-142.8	154.6	-174.3	174.3	0	125.5	K354	K354-K391 WeakPolarHBondContact CE-O 3.31Å; K354-K391 PolarHBondContact NZ-O 3.25Å
392	C	23	Very low	24.5	Very low	61 Å²	61	131.7 Å²	131.7	41%	0.412	68%	0.68	S	S	.	*			trans	-129	173	-165.9	-155.3	0	0	0	0	110.7	V347	V347-C392 VanDerWaalsContact CG1-C 3.44Å; V347-C392 HydrophobicContact CG2-CB 4.46Å
393	I	22.7	Very low	25.2	Very low	111 Å²	111	132.4 Å²	132.4	57%	0.569	68%	0.681	S	S	*	*			cis	-148	167.5	35.8	-37	94.7	0	0	0	108.7	V347	V347-I393 VanDerWaalsContact CG2-C 3.43Å; V347-I393 WeakPolarHBondContact CG2-O 3.4Å
394	Q	23.5	Very low	25.8	Very low	122 Å²	122	130.5 Å²	130.5	57%	0.57	68%	0.676	S	S	*	*				-168.2	-113.3	59.1	-165.2	159.8	-7	0	0	119
395	Q	22.5	Very low	26.3	Very low	149 Å²	149	133.4 Å²	133.4	70%	0.696	69%	0.685	S	S	*	*			trans	-162.3	155.9	-152.7	-60.9	161.8	-66.1	0	0	117.1
396	T	25.4	Very low	27.1	Very low	132 Å²	132	132.2 Å²	132.2	81%	0.81	68%	0.683	S	S	*	*				-165.3	128.3	123.3	21.9	0	0	0	0	116
397	K	25.1	Very low	27.9	Very low	202 Å²	202	135 Å²	135	88%	0.878	69%	0.694	S	S	*	*			trans	33.7	117.7	148.8	-61.2	179.6	-179.8	177.7	0	121.8
398	Q	26.4	Very low	28.8	Very low	199 Å²	199	136.1 Å²	136.1	93%	0.93	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-101.3	160.1	146.3	-81.3	-176	-21.3	0	0	111
399	K	27.7	Very low	29.5	Very low	206 Å²	206	132.9 Å²	132.9	90%	0.896	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-98.3	143.5	167.9	-70.4	-179.4	177.2	178.9	0	109.9
400	S	28.9	Very low	30.1	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-85.1	155.8	155.1	51.2	0	0	0	0	110.5
401	M	28.8	Very low	30.4	Very low	173 Å²	173	141 Å²	141	85%	0.852	74%	0.737	S	S	*	*			trans	-120.4	138.3	157.7	-71.9	-174.3	86.8	0	0	108
402	P	33.7	Very low	31	Very low	100 Å²	100	137.2 Å²	137.2	65%	0.649	74%	0.739	S	S	*	*			trans	-76.1	146.7	-178.3	29.8	-33.6	0	0	0	112.1	D404	P402-D404 HydrophobicContact CB-CB 4.48Å; P402-D404 WeakPolarHBondContact CB-OD2 3.23Å
403	T	37.8	Very low	31.7	Very low	118 Å²	118	140.2 Å²	140.2	72%	0.724	75%	0.745	S	S	*	*			trans	-99.4	25.7	175.7	51.6	0	0	0	0	112.3	N405 V406	T403-N405 PolarHBondContact O-N 3.4Å; T403-V406 PolarHBondContact O-N 3.01Å
404	D	34.5	Very low	32.7	Very low	140 Å²	140	138.7 Å²	138.7	75%	0.749	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.9	-3.3	-163.8	-59.7	-11.9	0	0	0	115.4	P402	P402-D404 HydrophobicContact CB-CB 4.48Å; P402-D404 WeakPolarHBondContact CB-OD2 3.23Å
405	N	38.8	Very low	33.5	Very low	158 Å²	158	135.3 Å²	135.3	85%	0.845	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	2.3	-174.6	-74.7	-18.3	0	0	0	115.1	T403 Q407	T403-N405 PolarHBondContact O-N 3.4Å; N405-Q407 PolarHBondContact O-N 3.24Å
406	V	39.2	Very low	34.3	Very low	116 Å²	116	135.4 Å²	135.4	70%	0.703	73%	0.725	S	S	*	*			trans	-80.6	103.1	177.7	-174.7	0	0	0	0	109.7	T403	T403-V406 PolarHBondContact O-N 3.01Å
407	Q	37.9	Very low	35.2	Very low	139 Å²	139	134 Å²	134	65%	0.65	71%	0.709	S	S	*	*			trans	-73.5	136.5	177.9	-64.1	-167.4	6.5	0	0	110.8	N405 N409 D410	N405-Q407 PolarHBondContact O-N 3.24Å; Q407-N409 PolarHBondContact O-N 3.26Å; Q407-D410 PolarHBondContact O-N 3.06Å
408	T	40.5	Very low	36.3	Very low	140 Å²	140	130.3 Å²	130.3	86%	0.859	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	1.9	-177.6	49.6	0	0	0	0	115
409	N	37.3	Very low	37.2	Very low	121 Å²	121	124.6 Å²	124.6	65%	0.647	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	-1.1	-172.4	-62.4	7.2	0	0	0	112.9	Q407 I411	Q407-N409 PolarHBondContact O-N 3.26Å; N409-I411 PolarHBondContact O-N 3.07Å
410	D	33.7	Very low	38.1	Very low	121 Å²	121	118.7 Å²	118.7	65%	0.647	64%	0.639	S	S	*	*			trans	-74.7	72.7	170.7	-76.1	-32.3	0	0	0	110.6	Q407 A412 F413	Q407-D410 PolarHBondContact O-N 3.06Å; D410-A412 PolarHBondContact O-N 3.18Å; D410-F413 PolarHBondContact O-N 3.46Å
411	I	29.5	Very low	39.1	Very low	165 Å²	165	117 Å²	117	85%	0.846	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	127.6	172.5	-64	165.7	0	0	0	108.1	N409	N409-I411 PolarHBondContact O-N 3.07Å
412	A	35.3	Very low	40.1	Very low	93 Å²	93	110.2 Å²	110.2	77%	0.769	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.8	37	-171.4	0	0	0	0	0	116.9	D410 N414	D410-A412 PolarHBondContact O-N 3.18Å; A412-N414 PolarHBondContact O-N 3.18Å
413	F	37.1	Very low	40.7	Very low	124 Å²	124	107.8 Å²	107.8	54%	0.544	57%	0.572	S	S	.	*			trans	-56.4	103.6	147.9	178.7	-107.1	0	0	0	109.6	D410 P415 W418 F436	D410-F413 PolarHBondContact O-N 3.46Å; F413-P415 HydrophobicContact CD1-CB 4.45Å; F413-P415 HydrophobicContact CE1-CB 3.8Å; F413-P415 HydrophobicContact CZ-CB 4.38Å; F413-P415 WeakPolarHBondContact O-CD 3.42Å; F413-W418 HydrophobicContact CE2-CB 3.81Å; F413-W418 AromaticContact CE2-CG 3.86Å; F413-W418 HydrophobicContact CE2-CG 3.86Å; F413-W418 HydrophobicContact CZ-CB 4.07Å; F413-W418 HydrophobicContact CZ-CD2 4.49Å; F413-W418 HydrophobicContact CZ-CG 4.17Å; F413-F436 HydrophobicContact CZ-CE1 4.29Å
414	N	43.5	Very low	41.3	Very low	78 Å²	78	108.5 Å²	108.5	42%	0.417	57%	0.571	S	S	.	*			trans	-90.9	100.3	172.8	179.2	-4.9	0	0	0	108.8	A412 F416 Q417 W418	A412-N414 PolarHBondContact O-N 3.18Å; N414-F416 PolarHBondContact O-N 3.1Å; N414-F416 VanDerWaalsContact OD1-CB 3.27Å; N414-F416 WeakPolarHBondContact OD1-CB 3.2Å; N414-F416 PolarHBondContact OD1-N 2.78Å; N414-Q417 HydrophobicContact CB-CB 3.99Å; N414-Q417 PolarHBondContact O-N 3.3Å; N414-Q417 PolarHBondContact OD1-N 3.17Å; N414-W418 PolarHBondContact O-N 2.8Å
415	P	39.1	Very low	42.2	Very low	52 Å²	52	108.8 Å²	108.8	34%	0.338	57%	0.566	S	S	.	*	H	α-helix	trans	-59.2	-31.7	-179.2	23.1	-33.7	0	0	0	112	F413 W418 F419 F436	F413-P415 HydrophobicContact CD1-CB 4.45Å; F413-P415 HydrophobicContact CE1-CB 3.8Å; F413-P415 HydrophobicContact CZ-CB 4.38Å; F413-P415 WeakPolarHBondContact O-CD 3.42Å; P415-W418 PolarHBondContact O-N 2.63Å; P415-F419 VanDerWaalsContact O-CB 3.28Å; P415-F419 WeakPolarHBondContact O-CB 3.24Å; P415-F419 PolarHBondContact O-N 2.97Å; P415-F436 HydrophobicContact CB-CD1 3.4Å; P415-F436 HydrophobicContact CB-CD2 4.39Å; P415-F436 HydrophobicContact CB-CE1 3.5Å; P415-F436 VanDerWaalsContact CB-CE1 3.5Å; P415-F436 HydrophobicContact CB-CE2 4.47Å; P415-F436 HydrophobicContact CB-CG 3.87Å; P415-F436 HydrophobicContact CB-CZ 4.06Å; P415-F436 WeakPolarHBondContact O-CZ 3.39Å
416	F	40	Very low	42.4	Very low	150 Å²	150	104.9 Å²	104.9	66%	0.658	55%	0.545	S	S	*	.	H	α-helix	trans	-68.4	-35.5	178.8	-132.3	-84.7	0	0	0	112.3	N414 F419 I420	N414-F416 PolarHBondContact O-N 3.1Å; N414-F416 VanDerWaalsContact OD1-CB 3.27Å; N414-F416 WeakPolarHBondContact OD1-CB 3.2Å; N414-F416 PolarHBondContact OD1-N 2.78Å; F416-F419 WeakPolarHBondContact O-CB 3.49Å; F416-I420 HydrophobicContact CD1-CD1 4.17Å; F416-I420 WeakPolarHBondContact O-CD1 3.17Å; F416-I420 VanDerWaalsContact O-CG1 3.28Å; F416-I420 WeakPolarHBondContact O-CG1 3.27Å; F416-I420 PolarHBondContact O-N 3.15Å; F416-I420 VanDerWaalsContact O-N 3.14Å
417	Q	45.1	Very low	42.5	Very low	104 Å²	104	105.8 Å²	105.8	49%	0.486	55%	0.546	S	S	.	.	H	α-helix	trans	-76	-42	174.8	-175.8	170.1	-26.2	0	0	111.6	N414 F419 I420 E421	N414-Q417 HydrophobicContact CB-CB 3.99Å; N414-Q417 PolarHBondContact O-N 3.3Å; N414-Q417 PolarHBondContact OD1-N 3.17Å; Q417-F419 VanDerWaalsContact C-N 3.25Å; Q417-F419 PolarHBondContact O-N 2.93Å; Q417-I420 PolarHBondContact O-N 3.34Å; Q417-E421 HydrophobicContact CG-CG 4.43Å; Q417-E421 WeakPolarHBondContact CG-OE1 3.21Å; Q417-E421 PolarHBondContact NE2-OE1 3.06Å; Q417-E421 WeakPolarHBondContact O-CB 3.47Å; Q417-E421 WeakPolarHBondContact O-CG 3.33Å; Q417-E421 PolarHBondContact O-N 3.36Å
418	W	48.6	Very low	42.6	Very low	124 Å²	124	107.2 Å²	107.2	47%	0.47	56%	0.558	S	S	.	*	H	α-helix	trans	-61.4	-35.3	173.4	-173.5	90.9	0	0	0	111.9	F413 N414 P415 T422 V434 F436	F413-W418 HydrophobicContact CE2-CB 3.81Å; F413-W418 AromaticContact CE2-CG 3.86Å; F413-W418 HydrophobicContact CE2-CG 3.86Å; F413-W418 HydrophobicContact CZ-CB 4.07Å; F413-W418 HydrophobicContact CZ-CD2 4.49Å; F413-W418 HydrophobicContact CZ-CG 4.17Å; N414-W418 PolarHBondContact O-N 2.8Å; P415-W418 PolarHBondContact O-N 2.63Å; W418-T422 VanDerWaalsContact O-CB 3.23Å; W418-T422 WeakPolarHBondContact O-CB 3.49Å; W418-T422 PolarHBondContact O-N 3.42Å; W418-T422 PolarHBondContact O-OG1 3.25Å; W418-V434 HydrophobicContact CZ3-CG1 3.85Å; W418-F436 AromaticContact CE3-CE1 3.6Å; W418-F436 HydrophobicContact CE3-CE1 3.6Å; W418-F436 AromaticContact CE3-CZ 3.69Å; W418-F436 HydrophobicContact CE3-CZ 3.69Å; W418-F436 HydrophobicContact CZ3-CE1 4.03Å; W418-F436 HydrophobicContact CZ3-CZ 4.1Å
419	F	44.4	Very low	42.3	Very low	78 Å²	78	109.8 Å²	109.8	34%	0.342	56%	0.56	S	S	.	*	H	α-helix	trans	-59	-55.2	170.4	-178.6	-108	0	0	0	111.6	P415 F416 Q417 E421 T422 C423 V434 F436	P415-F419 VanDerWaalsContact O-CB 3.28Å; P415-F419 WeakPolarHBondContact O-CB 3.24Å; P415-F419 PolarHBondContact O-N 2.97Å; F416-F419 WeakPolarHBondContact O-CB 3.49Å; Q417-F419 VanDerWaalsContact C-N 3.25Å; Q417-F419 PolarHBondContact O-N 2.93Å; F419-E421 VanDerWaalsContact C-N 3.34Å; F419-E421 PolarHBondContact O-N 3.21Å; F419-T422 PolarHBondContact O-N 3.04Å; F419-T422 VanDerWaalsContact O-N 3.08Å; F419-C423 VanDerWaalsContact CZ-SG 3.57Å; F419-C423 PolarHBondContact O-N 2.92Å; F419-C423 PolarHBondContact O-SG 3.13Å; F419-V434 HydrophobicContact CD2-CB 3.86Å; F419-V434 HydrophobicContact CD2-CG1 4.12Å; F419-V434 HydrophobicContact CD2-CG2 4.03Å; F419-V434 HydrophobicContact CE2-CB 3.91Å; F419-V434 HydrophobicContact CE2-CG2 4Å; F419-F436 HydrophobicContact CB-CE2 3.85Å; F419-F436 HydrophobicContact CB-CZ 3.73Å; F419-F436 AromaticContact CD2-CE2 3.96Å; F419-F436 HydrophobicContact CD2-CE2 3.96Å; F419-F436 HydrophobicContact CD2-CZ 4.36Å; F419-F436 HydrophobicContact CG-CE2 4.23Å; F419-F436 HydrophobicContact CG-CZ 4.5Å
420	I	46.7	Very low	42.3	Very low	82 Å²	82	106.3 Å²	106.3	42%	0.421	55%	0.548	S	S	.	.	H	α-helix	trans	-59.2	-45.5	-179.7	-69.9	164.4	0	0	0	110.8	F416 Q417 T422 C423 N424	F416-I420 HydrophobicContact CD1-CD1 4.17Å; F416-I420 WeakPolarHBondContact O-CD1 3.17Å; F416-I420 VanDerWaalsContact O-CG1 3.28Å; F416-I420 WeakPolarHBondContact O-CG1 3.27Å; F416-I420 PolarHBondContact O-N 3.15Å; F416-I420 VanDerWaalsContact O-N 3.14Å; Q417-I420 PolarHBondContact O-N 3.34Å; I420-T422 VanDerWaalsContact C-N 3.28Å; I420-T422 PolarHBondContact O-N 3.31Å; I420-C423 PolarHBondContact O-N 2.84Å; I420-N424 VanDerWaalsContact O-CB 3.29Å; I420-N424 WeakPolarHBondContact O-CB 3.42Å; I420-N424 PolarHBondContact O-N 3.07Å; I420-N424 PolarHBondContact O-ND2 3.05Å
421	E	50.1	Low	42.3	Very low	80 Å²	80	109.9 Å²	109.9	37%	0.374	56%	0.561	S	S	.	*	H	α-helix	trans	-66.4	-26.6	176.9	-74	-174.3	-145.2	0	0	113.7	Q417 F419 K425	Q417-E421 HydrophobicContact CG-CG 4.43Å; Q417-E421 WeakPolarHBondContact CG-OE1 3.21Å; Q417-E421 PolarHBondContact NE2-OE1 3.06Å; Q417-E421 WeakPolarHBondContact O-CB 3.47Å; Q417-E421 WeakPolarHBondContact O-CG 3.33Å; Q417-E421 PolarHBondContact O-N 3.36Å; F419-E421 VanDerWaalsContact C-N 3.34Å; F419-E421 PolarHBondContact O-N 3.21Å; E421-K425 WeakPolarHBondContact O-CD 3.27Å; E421-K425 VanDerWaalsContact O-CE 3.3Å; E421-K425 WeakPolarHBondContact O-CE 3.45Å; E421-K425 WeakPolarHBondContact O-CG 3.36Å; E421-K425 IonicContact OE2-NZ 2.61Å
422	T	48.9	Very low	42.6	Very low	32 Å²	32	104.8 Å²	104.8	20%	0.196	55%	0.549	C	S	.	.	H	α-helix	trans	-79.7	-46.1	175.2	-61.3	0	0	0	0	110.6	W418 F419 I420 N424 K425 L426	W418-T422 VanDerWaalsContact O-CB 3.23Å; W418-T422 WeakPolarHBondContact O-CB 3.49Å; W418-T422 PolarHBondContact O-N 3.42Å; W418-T422 PolarHBondContact O-OG1 3.25Å; F419-T422 PolarHBondContact O-N 3.04Å; F419-T422 VanDerWaalsContact O-N 3.08Å; I420-T422 VanDerWaalsContact C-N 3.28Å; I420-T422 PolarHBondContact O-N 3.31Å; T422-N424 VanDerWaalsContact C-N 3.3Å; T422-N424 PolarHBondContact O-N 3.38Å; T422-K425 CarbonylContact O-C 3.56Å; T422-K425 PolarHBondContact O-N 3.44Å; T422-L426 HydrophobicContact CG2-CD1 4.48Å; T422-L426 WeakPolarHBondContact O-CG 3.31Å; T422-L426 PolarHBondContact O-N 2.94Å; T422-L426 VanDerWaalsContact O-N 3.16Å
423	C	46.4	Very low	42.5	Very low	49 Å²	49	107 Å²	107	33%	0.331	55%	0.547	S	S	.	.	H	α-helix	trans	-58.6	-40.7	173.6	-70.5	0	0	0	0	112	F419 I420 K425 L426	F419-C423 VanDerWaalsContact CZ-SG 3.57Å; F419-C423 PolarHBondContact O-N 2.92Å; F419-C423 PolarHBondContact O-SG 3.13Å; I420-C423 PolarHBondContact O-N 2.84Å; C423-K425 PolarHBondContact O-N 2.93Å; C423-L426 PolarHBondContact O-N 3.25Å
424	N	50.9	Low	42.2	Very low	132 Å²	132	103.2 Å²	103.2	71%	0.706	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-7.9	175.4	-68.4	-14.1	0	0	0	114.2	I420 T422	I420-N424 VanDerWaalsContact O-CB 3.29Å; I420-N424 WeakPolarHBondContact O-CB 3.42Å; I420-N424 PolarHBondContact O-N 3.07Å; I420-N424 PolarHBondContact O-ND2 3.05Å; T422-N424 VanDerWaalsContact C-N 3.3Å; T422-N424 PolarHBondContact O-N 3.38Å
425	K	52.4	Low	41.7	Very low	147 Å²	147	108.1 Å²	108.1	64%	0.639	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.2	-5.6	174.7	-69.2	165.8	-165.3	151.7	0	112.7	E421 T422 C423	E421-K425 WeakPolarHBondContact O-CD 3.27Å; E421-K425 VanDerWaalsContact O-CE 3.3Å; E421-K425 WeakPolarHBondContact O-CE 3.45Å; E421-K425 WeakPolarHBondContact O-CG 3.36Å; E421-K425 IonicContact OE2-NZ 2.61Å; T422-K425 CarbonylContact O-C 3.56Å; T422-K425 PolarHBondContact O-N 3.44Å; C423-K425 PolarHBondContact O-N 2.93Å
426	L	43.4	Very low	41.2	Very low	76 Å²	76	109.7 Å²	109.7	40%	0.398	55%	0.548	S	S	.	.	S	Bend	trans	-91	115.4	173.5	-70	171.2	0	0	0	108.8	T422 C423 A430	T422-L426 HydrophobicContact CG2-CD1 4.48Å; T422-L426 WeakPolarHBondContact O-CG 3.31Å; T422-L426 PolarHBondContact O-N 2.94Å; T422-L426 VanDerWaalsContact O-N 3.16Å; C423-L426 PolarHBondContact O-N 3.25Å; L426-A430 HydrophobicContact CB-CB 4.31Å; L426-A430 HydrophobicContact CD2-CB 3.96Å
427	N	40.8	Very low	40.8	Very low	135 Å²	135	111 Å²	111	72%	0.722	55%	0.549	S	S	*	.			trans	-59.7	152.1	169.2	-68.7	-10.4	0	0	0	110.2	E429 A430	N427-E429 PolarHBondContact O-N 2.71Å; N427-A430 PolarHBondContact O-N 3.36Å
428	D	41.1	Very low	40	Very low	169 Å²	169	111.7 Å²	111.7	90%	0.904	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-18	-171.2	-66.8	-60.4	0	0	0	116.2	A430	D428-A430 VanDerWaalsContact C-N 3.33Å
429	E	34.7	Very low	39.2	Very low	193 Å²	193	118.6 Å²	118.6	90%	0.902	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-15.4	177.1	-57.5	-174.1	143.3	0	0	113.6	N427 Q431	N427-E429 PolarHBondContact O-N 2.71Å; E429-Q431 PolarHBondContact O-N 3.45Å
430	A	36.9	Very low	39	Very low	49 Å²	49	120.6 Å²	120.6	41%	0.405	61%	0.611	S	S	.	*			trans	-100.8	74	-170.2	0	0	0	0	0	113.8	L426 N427 D428 G432	L426-A430 HydrophobicContact CB-CB 4.31Å; L426-A430 HydrophobicContact CD2-CB 3.96Å; N427-A430 PolarHBondContact O-N 3.36Å; D428-A430 VanDerWaalsContact C-N 3.33Å; A430-G432 PolarHBondContact O-N 2.85Å
431	Q	32.9	Very low	38.5	Very low	196 Å²	196	122.6 Å²	122.6	92%	0.916	62%	0.621	S	S	*	*			trans	-72.7	91	172.1	-66.5	-171.5	3.6	0	0	111.9	E429	E429-Q431 PolarHBondContact O-N 3.45Å
432	G	36.1	Very low	37.9	Very low	58 Å²	58	125 Å²	125	60%	0.598	64%	0.635	S	S	*	*			trans	-105.4	150.5	174.5	0	0	0	0	0	113.6	A430	A430-G432 PolarHBondContact O-N 2.85Å
433	I	33.5	Very low	37.3	Very low	140 Å²	140	130.5 Å²	130.5	72%	0.718	66%	0.661	S	S	*	*			trans	-98.4	117.2	166.9	-54.5	177.3	0	0	0	108.2	W435	I433-W435 HydrophobicContact CG2-CD2 4.44Å; I433-W435 HydrophobicContact CG2-CZ2 4.17Å
434	V	31.4	Very low	36.7	Very low	44 Å²	44	135.6 Å²	135.6	27%	0.267	68%	0.681	S	S	.	*			trans	-88.8	126.1	172.4	-178.5	0	0	0	0	108.9	W418 F419 F436	W418-V434 HydrophobicContact CZ3-CG1 3.85Å; F419-V434 HydrophobicContact CD2-CB 3.86Å; F419-V434 HydrophobicContact CD2-CG1 4.12Å; F419-V434 HydrophobicContact CD2-CG2 4.03Å; F419-V434 HydrophobicContact CE2-CB 3.91Å; F419-V434 HydrophobicContact CE2-CG2 4Å; V434-F436 HydrophobicContact CG1-CD2 4.29Å; V434-F436 HydrophobicContact CG1-CE1 4.39Å; V434-F436 HydrophobicContact CG1-CE2 3.66Å; V434-F436 HydrophobicContact CG1-CZ 3.71Å
435	W	32.5	Very low	35.7	Very low	181 Å²	181	135.8 Å²	135.8	69%	0.686	68%	0.68	S	S	*	*			trans	-109.5	123.9	175.2	-65.4	88	0	0	0	109.9	I433	I433-W435 HydrophobicContact CG2-CD2 4.44Å; I433-W435 HydrophobicContact CG2-CZ2 4.17Å
436	F	29.1	Very low	34.5	Very low	85 Å²	85	135 Å²	135	37%	0.373	68%	0.683	S	S	.	*			trans	-96.2	133.7	170.9	-68.1	-77.4	0	0	0	110.3	F413 P415 W418 F419 V434	F413-F436 HydrophobicContact CZ-CE1 4.29Å; P415-F436 HydrophobicContact CB-CD1 3.4Å; P415-F436 HydrophobicContact CB-CD2 4.39Å; P415-F436 HydrophobicContact CB-CE1 3.5Å; P415-F436 VanDerWaalsContact CB-CE1 3.5Å; P415-F436 HydrophobicContact CB-CE2 4.47Å; P415-F436 HydrophobicContact CB-CG 3.87Å; P415-F436 HydrophobicContact CB-CZ 4.06Å; P415-F436 WeakPolarHBondContact O-CZ 3.39Å; W418-F436 AromaticContact CE3-CE1 3.6Å; W418-F436 HydrophobicContact CE3-CE1 3.6Å; W418-F436 AromaticContact CE3-CZ 3.69Å; W418-F436 HydrophobicContact CE3-CZ 3.69Å; W418-F436 HydrophobicContact CZ3-CE1 4.03Å; W418-F436 HydrophobicContact CZ3-CZ 4.1Å; F419-F436 HydrophobicContact CB-CE2 3.85Å; F419-F436 HydrophobicContact CB-CZ 3.73Å; F419-F436 AromaticContact CD2-CE2 3.96Å; F419-F436 HydrophobicContact CD2-CE2 3.96Å; F419-F436 HydrophobicContact CD2-CZ 4.36Å; F419-F436 HydrophobicContact CG-CE2 4.23Å; F419-F436 HydrophobicContact CG-CZ 4.5Å; V434-F436 HydrophobicContact CG1-CD2 4.29Å; V434-F436 HydrophobicContact CG1-CE1 4.39Å; V434-F436 HydrophobicContact CG1-CE2 3.66Å; V434-F436 HydrophobicContact CG1-CZ 3.71Å
437	W	30.6	Very low	33.9	Very low	177 Å²	177	139.5 Å²	139.5	67%	0.67	70%	0.704	S	S	*	*			trans	-123.5	115.1	179.1	-63.8	77.8	0	0	0	107.7	D339	D339-W437 WeakPolarHBondContact OD1-CH2 3.42Å
438	S	28.7	Very low	33.3	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	70%	0.703	S	S	*	*			trans	-75.1	153.6	159.4	-169.1	0	0	0	0	108.9
439	K	32.1	Very low	32.6	Very low	268 Å²	268	137.3 Å²	137.3	100%	1.165	69%	0.685	S	S	*	*			trans	-75.6	0	152.7	-103	-178.6	169.2	177.1	0	110.7

Retrieved 439 of 439 residues in 597.9 ms (Link to these results)

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