G4VPX7_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession G4VPX7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 370 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	30.6	Very low	56.8	Low	235 Å²	235	132.2 Å²	132.2	100%	1.158	64%	0.639	S	S	*	*				0	90.3	0	-164	164.8	-172.2	0	0	105.3
2	F	41.4	Very low	59.3	Low	161 Å²	161	123.5 Å²	123.5	71%	0.706	60%	0.596	S	S	*	*			trans	-76.3	127.2	-177.8	-72.5	-82.4	0	0	0	107.5
3	P	46.9	Very low	61.1	Low	96 Å²	96	119.1 Å²	119.1	62%	0.623	57%	0.57	S	S	*	*			trans	-56.8	143.5	177.4	24	-30.6	0	0	0	109	D5	P3-D5 PolarHBondContact O-N 3.13Å
4	Y	45.2	Very low	62.8	Low	238 Å²	238	113.9 Å²	113.9	93%	0.933	55%	0.547	S	S	*	.			trans	-63.6	85.8	168.2	-95.5	-93.8	0	0	0	107.4	K6	Y4-K6 PolarHBondContact O-N 3.34Å
5	D	54.3	Low	64.4	Low	61 Å²	61	109.3 Å²	109.3	33%	0.326	53%	0.529	S	S	.	.			trans	-64	121.3	170.6	-73.3	-15.4	0	0	0	107.3	P3 I7 Y10 R126	P3-D5 PolarHBondContact O-N 3.13Å; D5-I7 PolarHBondContact O-N 2.89Å; D5-I7 VanDerWaalsContact O-N 3.14Å; D5-Y10 HydrophobicContact CB-CE2 4.05Å; D5-Y10 PolarHBondContact OD2-OH 3.43Å; D5-R126 IonicContact OD2-CZ 3.05Å; D5-R126 VanDerWaalsContact OD2-CZ 3.22Å; D5-R126 IonicContact OD2-NE 3.57Å; D5-R126 PolarHBondContact OD2-NE 2.95Å; D5-R126 IonicContact OD2-NH2 3.35Å; D5-R126 PolarHBondContact OD2-NH2 3.44Å
6	K	57.8	Low	65.7	Low	143 Å²	143	104.2 Å²	104.2	62%	0.622	51%	0.507	S	S	*	.			trans	-67.2	113.4	174.9	-75.4	-178.4	-179.5	175.8	0	108.1	Y4 D8 E9	Y4-K6 PolarHBondContact O-N 3.34Å; K6-D8 PolarHBondContact O-N 2.99Å; K6-D8 VanDerWaalsContact O-N 3.14Å; K6-E9 HydrophobicContact CB-CG 4.42Å; K6-E9 PolarHBondContact O-N 3.3Å
7	I	61.1	Low	66.8	Low	77 Å²	77	101.8 Å²	101.8	40%	0.395	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-56.9	-31	-178.5	-61.5	165.2	0	0	0	111.3	D5 E9 Y10 F12 S124 W196	D5-I7 PolarHBondContact O-N 2.89Å; D5-I7 VanDerWaalsContact O-N 3.14Å; I7-E9 PolarHBondContact O-N 3.37Å; I7-E9 VanDerWaalsContact O-N 3.1Å; I7-Y10 PolarHBondContact O-N 3.1Å; I7-Y10 VanDerWaalsContact O-N 3.1Å; I7-F12 HydrophobicContact CG2-CE2 4.3Å; I7-S124 WeakPolarHBondContact CD1-O 3.34Å; I7-W196 HydrophobicContact CG1-CH2 4.4Å
8	D	61.1	Low	67.8	Low	161 Å²	161	99.4 Å²	99.4	86%	0.861	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-63.8	-13.6	-177.9	-56	-34.5	0	0	0	114.4	K6	K6-D8 PolarHBondContact O-N 2.99Å; K6-D8 VanDerWaalsContact O-N 3.14Å
9	E	67.4	Low	68.7	Low	150 Å²	150	94.8 Å²	94.8	70%	0.701	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-85.4	-12.1	177.1	-67.1	176.5	-166.8	0	0	112.9	K6 I7	K6-E9 HydrophobicContact CB-CG 4.42Å; K6-E9 PolarHBondContact O-N 3.3Å; I7-E9 PolarHBondContact O-N 3.37Å; I7-E9 VanDerWaalsContact O-N 3.1Å
10	Y	75.9	Confident	69.5	Low	46 Å²	46	92.4 Å²	92.4	18%	0.18	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-97.3	122.6	-175.6	-65.6	-81.9	0	0	0	112.1	D5 I7 F12 R126 W196 H203	D5-Y10 HydrophobicContact CB-CE2 4.05Å; D5-Y10 PolarHBondContact OD2-OH 3.43Å; I7-Y10 PolarHBondContact O-N 3.1Å; I7-Y10 VanDerWaalsContact O-N 3.1Å; Y10-F12 HydrophobicContact CG-CZ 4.45Å; Y10-R126 PolarHBondContact OH-NH2 3.39Å; Y10-R126 VanDerWaalsContact OH-NH2 3.14Å; Y10-W196 HydrophobicContact CD1-CE3 4.37Å; Y10-W196 HydrophobicContact CD2-CE3 4.36Å; Y10-W196 AromaticContact CD2-CZ3 3.78Å; Y10-W196 HydrophobicContact CD2-CZ3 3.78Å; Y10-W196 HydrophobicContact CE1-CE3 4.31Å; Y10-W196 HydrophobicContact CE2-CE3 4.29Å; Y10-W196 AromaticContact CE2-CZ3 3.8Å; Y10-W196 HydrophobicContact CE2-CZ3 3.8Å; Y10-W196 HydrophobicContact CG-CE3 4.4Å; Y10-W196 HydrophobicContact CG-CZ3 4.16Å; Y10-H203 HydrophobicContact CD1-CB 4.45Å; Y10-H203 AromaticContact CD1-CD2 3.51Å; Y10-H203 AromaticContact CD1-CE1 3.52Å; Y10-H203 AromaticContact CD1-CG 3.61Å; Y10-H203 AromaticContact CD1-ND1 3.62Å; Y10-H203 AromaticContact CD1-NE2 3.44Å; Y10-H203 WeakPolarHBondContact CD1-NE2 3.34Å; Y10-H203 AromaticContact CE1-CD2 3.77Å; Y10-H203 AromaticContact CE1-CE1 3.97Å; Y10-H203 AromaticContact CE1-NE2 3.5Å
11	V	82.6	Confident	70.2	Confident	86 Å²	86	90.1 Å²	90.1	52%	0.521	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-88.1	118.6	165.4	-168.1	0	0	0	0	107.9	F202 H203	V11-F202 HydrophobicContact CB-CD1 4.33Å; V11-F202 HydrophobicContact CG1-CD1 3.62Å; V11-F202 HydrophobicContact CG1-CE1 3.61Å; V11-F202 CarbonylContact O-C 3.44Å; V11-F202 VanDerWaalsContact O-CA 3.3Å; V11-F202 WeakPolarHBondContact O-CA 3.33Å; V11-H203 PolarHBondContact O-N 3.04Å
12	F	87.7	Confident	72.5	Confident	28 Å²	28	80.1 Å²	80.1	12%	0.123	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-93.2	149.7	-178.7	-68.3	-82.8	0	0	0	112.1	I7 Y10 N123 W196 F202 H203	I7-F12 HydrophobicContact CG2-CE2 4.3Å; Y10-F12 HydrophobicContact CG-CZ 4.45Å; F12-N123 WeakPolarHBondContact CB-ND2 3.22Å; F12-N123 HydrophobicContact CD1-CB 3.88Å; F12-N123 VanDerWaalsContact CD1-CG 3.43Å; F12-N123 WeakPolarHBondContact CD1-OD1 3.41Å; F12-N123 HydrophobicContact CD2-CB 4Å; F12-N123 HydrophobicContact CE1-CB 3.87Å; F12-N123 HydrophobicContact CE2-CB 3.98Å; F12-N123 HydrophobicContact CG-CB 3.95Å; F12-N123 WeakPolarHBondContact CG-ND2 3.37Å; F12-N123 HydrophobicContact CZ-CB 3.92Å; F12-W196 HydrophobicContact CE1-CD2 4.15Å; F12-W196 AromaticContact CE1-CE2 3.89Å; F12-W196 HydrophobicContact CE1-CH2 4.42Å; F12-W196 HydrophobicContact CE1-CZ2 4.04Å; F12-W196 HydrophobicContact CZ-CD2 4.45Å; F12-W196 HydrophobicContact CZ-CE3 4.46Å; F12-W196 AromaticContact CZ-CH2 3.84Å; F12-W196 HydrophobicContact CZ-CH2 3.84Å; F12-W196 AromaticContact CZ-CZ2 3.8Å; F12-W196 HydrophobicContact CZ-CZ2 3.8Å; F12-W196 HydrophobicContact CZ-CZ3 4.18Å; F12-F202 WeakPolarHBondContact O-CD1 3.27Å; F12-H203 WeakPolarHBondContact CA-O 3.47Å; F12-H203 HydrophobicContact CD1-CB 3.97Å; F12-H203 WeakPolarHBondContact CD1-O 3.38Å; F12-H203 HydrophobicContact CE1-CB 4.12Å
13	Y	82.8	Confident	74.4	Confident	66 Å²	66	73.7 Å²	73.7	26%	0.259	38%	0.377	S	S	.	.	S	Bend	trans	-67.6	-44.1	-179.5	-173.3	-90.8	0	0	0	112.3	T15 F202 H203 D306 K310	Y13-T15 PolarHBondContact O-N 3.15Å; Y13-F202 HydrophobicContact CD2-CB 4.08Å; Y13-F202 HydrophobicContact CD2-CD2 4.31Å; Y13-F202 HydrophobicContact CD2-CG 4.31Å; Y13-H203 PolarHBondContact N-O 2.83Å; Y13-D306 PolarHBondContact OH-OD1 3.37Å; Y13-K310 WeakPolarHBondContact OH-CE 3.25Å
14	D	84.4	Confident	75.9	Confident	47 Å²	47	71.4 Å²	71.4	25%	0.251	37%	0.371	S	S	.	.			trans	-73.8	123.4	176.3	-65.8	-37.6	0	0	0	110	F120	D14-F120 HydrophobicContact CB-CD1 4.14Å; D14-F120 HydrophobicContact CB-CE1 3.9Å; D14-F120 HydrophobicContact CB-CZ 4.47Å
15	T	86.3	Confident	77.2	Confident	45 Å²	45	65.5 Å²	65.5	28%	0.276	35%	0.352	S	S	.	.			trans	-116.9	150	177	87.5	0	0	0	0	111.5	Y13 T17 D18	Y13-T15 PolarHBondContact O-N 3.15Å; T15-T17 PolarHBondContact O-N 3.31Å; T15-T17 VanDerWaalsContact O-N 3.07Å; T15-T17 PolarHBondContact OG1-N 2.96Å; T15-T17 PolarHBondContact OG1-OG1 3.08Å; T15-D18 WeakPolarHBondContact CB-OD1 3.4Å; T15-D18 PolarHBondContact N-OD2 3.16Å; T15-D18 VanDerWaalsContact O-CG 3.22Å; T15-D18 PolarHBondContact O-N 3.23Å; T15-D18 VanDerWaalsContact OG1-CG 3.3Å; T15-D18 PolarHBondContact OG1-N 3.12Å; T15-D18 PolarHBondContact OG1-OD1 3.07Å
16	P	85.7	Confident	78.4	Confident	27 Å²	27	64.6 Å²	64.6	18%	0.175	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-12.5	177.3	29.7	-37.4	0	0	0	113.2	P110 Y118 F120	P16-P110 HydrophobicContact CB-CB 4.05Å; P16-P110 WeakPolarHBondContact O-CB 3.25Å; P16-Y118 HydrophobicContact CB-CD1 3.4Å; P16-Y118 VanDerWaalsContact CB-CD1 3.4Å; P16-Y118 HydrophobicContact CB-CD2 4.11Å; P16-Y118 HydrophobicContact CB-CE1 3.9Å; P16-Y118 HydrophobicContact CB-CG 3.52Å; P16-Y118 HydrophobicContact CG-CD1 3.75Å; P16-Y118 HydrophobicContact CG-CD2 4.39Å; P16-Y118 HydrophobicContact CG-CE1 3.67Å; P16-Y118 HydrophobicContact CG-CE2 4.31Å; P16-Y118 HydrophobicContact CG-CG 4.12Å; P16-F120 HydrophobicContact CB-CE2 4.38Å
17	T	85.1	Confident	79	Confident	64 Å²	64	65.2 Å²	65.2	39%	0.393	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-7.1	179.9	47.1	0	0	0	0	113.8	T15 L19 V20 S21	T15-T17 PolarHBondContact O-N 3.31Å; T15-T17 VanDerWaalsContact O-N 3.07Å; T15-T17 PolarHBondContact OG1-N 2.96Å; T15-T17 PolarHBondContact OG1-OG1 3.08Å; T17-L19 PolarHBondContact O-N 3.48Å; T17-L19 VanDerWaalsContact O-N 3.07Å; T17-V20 PolarHBondContact O-N 3.28Å; T17-S21 WeakPolarHBondContact O-CB 3.19Å; T17-S21 PolarHBondContact O-N 3.31Å; T17-S21 PolarHBondContact O-OG 2.93Å; T17-S21 VanDerWaalsContact O-OG 3.04Å
18	D	84.9	Confident	79.4	Confident	58 Å²	58	68 Å²	68	31%	0.31	38%	0.377	S	S	.	.	H	α-helix	trans	-54.9	-35.6	-170.6	-69.6	-17	0	0	0	113.8	T15 I22	T15-D18 WeakPolarHBondContact CB-OD1 3.4Å; T15-D18 PolarHBondContact N-OD2 3.16Å; T15-D18 VanDerWaalsContact O-CG 3.22Å; T15-D18 PolarHBondContact O-N 3.23Å; T15-D18 VanDerWaalsContact OG1-CG 3.3Å; T15-D18 PolarHBondContact OG1-N 3.12Å; T15-D18 PolarHBondContact OG1-OD1 3.07Å; D18-I22 WeakPolarHBondContact O-CD1 3.47Å; D18-I22 WeakPolarHBondContact O-CG1 3.46Å
19	L	84.6	Confident	79.8	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.063	36%	0.357	C	S	.	.	H	α-helix	trans	-82.3	-16.3	179.6	-66.3	170.4	0	0	0	114.1	T17 T41 L44 K107 Y111	T17-L19 PolarHBondContact O-N 3.48Å; T17-L19 VanDerWaalsContact O-N 3.07Å; L19-T41 HydrophobicContact CD2-CG2 3.91Å; L19-L44 HydrophobicContact CD2-CD2 4.01Å; L19-L44 HydrophobicContact CD2-CG 4.33Å; L19-K107 HydrophobicContact CD1-CB 3.61Å; L19-K107 HydrophobicContact CD1-CG 4Å; L19-K107 WeakPolarHBondContact CD1-O 3.48Å; L19-Y111 HydrophobicContact CB-CD2 4.34Å
20	V	85	Confident	80.1	Confident	47 Å²	47	61 Å²	61	29%	0.285	35%	0.351	S	S	.	.	H	α-helix	trans	-108.3	-41.6	-172.5	-177.1	0	0	0	0	111.2	T17 I22 C23 G24 Y111	T17-V20 PolarHBondContact O-N 3.28Å; V20-I22 VanDerWaalsContact C-N 3.33Å; V20-I22 PolarHBondContact O-N 2.96Å; V20-C23 PolarHBondContact O-N 3.37Å; V20-G24 PolarHBondContact O-N 2.98Å; V20-Y111 HydrophobicContact CG2-CD2 4.43Å
21	S	82.9	Confident	80.5	Confident	44 Å²	44	60.5 Å²	60.5	31%	0.308	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-38.8	-175.2	60.6	0	0	0	0	112.5	T17 C23 G24 Q25	T17-S21 WeakPolarHBondContact O-CB 3.19Å; T17-S21 PolarHBondContact O-N 3.31Å; T17-S21 PolarHBondContact O-OG 2.93Å; T17-S21 VanDerWaalsContact O-OG 3.04Å; S21-C23 VanDerWaalsContact C-N 3.29Å; S21-C23 PolarHBondContact O-N 3.38Å; S21-G24 PolarHBondContact O-N 3.18Å; S21-Q25 WeakPolarHBondContact O-CG 3.21Å; S21-Q25 PolarHBondContact O-N 3Å
22	I	79.1	Confident	80.6	Confident	26 Å²	26	63.1 Å²	63.1	13%	0.133	36%	0.36	C	S	.	.	H	α-helix	trans	-59.9	-40	-177.3	-63.5	171.9	0	0	0	111.6	D18 V20 Q25 Q37 T41	D18-I22 WeakPolarHBondContact O-CD1 3.47Å; D18-I22 WeakPolarHBondContact O-CG1 3.46Å; V20-I22 VanDerWaalsContact C-N 3.33Å; V20-I22 PolarHBondContact O-N 2.96Å; I22-Q25 PolarHBondContact O-N 3.46Å; I22-Q37 HydrophobicContact CD1-CG 3.92Å; I22-Q37 HydrophobicContact CG2-CB 4.26Å; I22-Q37 HydrophobicContact CG2-CG 3.75Å; I22-T41 HydrophobicContact CD1-CG2 4.1Å
23	C	82.5	Confident	80.5	Confident	25 Å²	25	62.1 Å²	62.1	17%	0.169	36%	0.357	C	S	.	.	H	α-helix	trans	-72	-30	177.3	-70.9	0	0	0	0	112.9	V20 S21 Q25 L26 C38	V20-C23 PolarHBondContact O-N 3.37Å; S21-C23 VanDerWaalsContact C-N 3.29Å; S21-C23 PolarHBondContact O-N 3.38Å; C23-Q25 VanDerWaalsContact C-N 3.33Å; C23-L26 WeakPolarHBondContact O-CB 3.48Å; C23-C38 VanDerWaalsContact CA-SG 3.57Å; C23-C38 HydrophobicContact CB-CB 4.1Å; C23-C38 WeakPolarHBondContact CB-SG 3.2Å; C23-C38 WeakPolarHBondContact SG-CA 3.33Å; C23-C38 WeakPolarHBondContact SG-CB 3.39Å; C23-C38 PolarHBondContact SG-O 2.96Å; C23-C38 CovalentContact SG-SG 2.04Å; C23-C38 PolarHBondContact SG-SG 3.19Å
24	G	78.1	Confident	80.6	Confident	49 Å²	49	59.9 Å²	59.9	51%	0.505	35%	0.349	S	S	.	.	H	α-helix	trans	-71.4	-27.9	174.2	0	0	0	0	0	112.9	V20 S21 L26	V20-G24 PolarHBondContact O-N 2.98Å; S21-G24 PolarHBondContact O-N 3.18Å; G24-L26 VanDerWaalsContact C-N 3.26Å; G24-L26 PolarHBondContact O-N 3.36Å
25	Q	72.7	Confident	80.9	Confident	113 Å²	113	62.7 Å²	62.7	53%	0.528	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-75.9	-9.1	177.5	-71.5	176.9	-10.9	0	0	114.1	S21 I22 C23 D27 V28 N29	S21-Q25 WeakPolarHBondContact O-CG 3.21Å; S21-Q25 PolarHBondContact O-N 3Å; I22-Q25 PolarHBondContact O-N 3.46Å; C23-Q25 VanDerWaalsContact C-N 3.33Å; Q25-D27 PolarHBondContact O-N 3.43Å; Q25-V28 PolarHBondContact O-N 2.99Å; Q25-N29 PolarHBondContact O-N 2.81Å
26	L	77.8	Confident	81.1	Confident	42 Å²	42	62.9 Å²	62.9	22%	0.22	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-61.2	-26.5	176.9	-75.7	173.2	0	0	0	113.3	C23 G24 V28 N34 K35 C38	C23-L26 WeakPolarHBondContact O-CB 3.48Å; G24-L26 VanDerWaalsContact C-N 3.26Å; G24-L26 PolarHBondContact O-N 3.36Å; L26-V28 PolarHBondContact O-N 3.2Å; L26-N34 HydrophobicContact CD2-CB 3.82Å; L26-K35 HydrophobicContact CD2-CB 4.48Å; L26-K35 HydrophobicContact CD2-CG 3.81Å; L26-C38 HydrophobicContact CD1-CB 3.68Å; L26-C38 HydrophobicContact CG-CB 4.43Å
27	D	70.6	Confident	81.3	Confident	157 Å²	157	61.6 Å²	61.6	84%	0.84	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-68.3	-22.9	175.2	-66.4	-23.5	0	0	0	112	Q25	Q25-D27 PolarHBondContact O-N 3.43Å
28	V	69.8	Low	81.6	Confident	135 Å²	135	58.9 Å²	58.9	82%	0.818	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-43.8	-178.1	-176.1	0	0	0	0	111.6	Q25 L26	Q25-V28 PolarHBondContact O-N 2.99Å; L26-V28 PolarHBondContact O-N 3.2Å
29	N	70.1	Confident	82	Confident	82 Å²	82	61.3 Å²	61.3	44%	0.439	35%	0.347	S	S	.	.			trans	-132.5	97.1	-177.6	-168.7	-4.8	0	0	0	111.6	Q25 S31 N34	Q25-N29 PolarHBondContact O-N 2.81Å; N29-S31 VanDerWaalsContact C-N 3.25Å; N29-S31 PolarHBondContact O-N 2.9Å; N29-N34 PolarHBondContact O-ND2 3.01Å
30	S	73.9	Confident	82.5	Confident	81 Å²	81	61.5 Å²	61.5	57%	0.566	35%	0.349	S	S	*	.			trans	-86	23.9	-171.7	69.4	0	0	0	0	115.1	K35	S30-K35 VanDerWaalsContact O-CE 3.31Å; S30-K35 WeakPolarHBondContact O-CE 3.36Å; S30-K35 PolarHBondContact O-NZ 3.28Å
31	S	83.4	Confident	82.9	Confident	37 Å²	37	59.2 Å²	59.2	26%	0.259	34%	0.335	S	S	.	.			trans	-54.1	150.4	178.3	81.6	0	0	0	0	111.9	N29 V33 N34 K35	N29-S31 VanDerWaalsContact C-N 3.25Å; N29-S31 PolarHBondContact O-N 2.9Å; S31-V33 PolarHBondContact O-N 3.44Å; S31-N34 PolarHBondContact O-N 3.3Å; S31-N34 WeakPolarHBondContact OG-CB 3.22Å; S31-N34 PolarHBondContact OG-N 3.45Å; S31-N34 PolarHBondContact OG-ND2 3.33Å; S31-K35 PolarHBondContact O-N 2.89Å
32	H	85.3	Confident	83.4	Confident	140 Å²	140	62.2 Å²	62.2	65%	0.648	34%	0.342	S	S	*	.	H	α-helix	trans	-59.5	-38.3	179.6	-179	-90.6	0	0	0	111.6	K35 V36	H32-K35 WeakPolarHBondContact O-CB 3.42Å; H32-K35 PolarHBondContact O-N 3.07Å; H32-V36 WeakPolarHBondContact O-CG2 3.46Å; H32-V36 PolarHBondContact O-N 3.25Å; H32-V36 VanDerWaalsContact O-N 3.12Å
33	V	85.3	Confident	84.2	Confident	7 Å²	7	64 Å²	64	4%	0.042	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-44.3	-179.8	-168	0	0	0	0	111.1	S31 K35 V36 Q37 E304 V307 W308	S31-V33 PolarHBondContact O-N 3.44Å; V33-K35 VanDerWaalsContact C-N 3.29Å; V33-K35 PolarHBondContact O-N 3.02Å; V33-V36 PolarHBondContact O-N 3.24Å; V33-Q37 WeakPolarHBondContact O-CB 3.37Å; V33-Q37 PolarHBondContact O-N 2.9Å; V33-E304 HydrophobicContact CG2-CG 4.44Å; V33-V307 HydrophobicContact CB-CG1 4.45Å; V33-V307 HydrophobicContact CG1-CB 4.3Å; V33-V307 HydrophobicContact CG1-CG1 3.64Å; V33-W308 HydrophobicContact CB-CZ2 4.35Å; V33-W308 HydrophobicContact CG1-CD2 3.84Å; V33-W308 HydrophobicContact CG1-CE3 4.38Å; V33-W308 HydrophobicContact CG1-CG 4.15Å; V33-W308 HydrophobicContact CG1-CZ2 4Å; V33-W308 HydrophobicContact CG2-CH2 4.46Å; V33-W308 HydrophobicContact CG2-CZ2 3.5Å; V33-W308 VanDerWaalsContact CG2-CZ2 3.5Å
34	N	86.3	Confident	84.8	Confident	19 Å²	19	62.8 Å²	62.8	10%	0.102	35%	0.346	C	S	.	.	H	α-helix	trans	-62	-37	177.3	-71	-15.5	0	0	0	112	L26 N29 S31 Q37 C38	L26-N34 HydrophobicContact CD2-CB 3.82Å; N29-N34 PolarHBondContact O-ND2 3.01Å; S31-N34 PolarHBondContact O-N 3.3Å; S31-N34 WeakPolarHBondContact OG-CB 3.22Å; S31-N34 PolarHBondContact OG-N 3.45Å; S31-N34 PolarHBondContact OG-ND2 3.33Å; N34-Q37 PolarHBondContact O-N 2.95Å; N34-C38 WeakPolarHBondContact O-CB 3.43Å; N34-C38 PolarHBondContact O-N 3.07Å
35	K	88.9	Confident	85.6	Confident	107 Å²	107	60.4 Å²	60.4	47%	0.465	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-47.4	175.7	-70.4	173.8	-179.1	166.6	0	111.6	L26 S30 S31 H32 V33 Q37 C38 I39	L26-K35 HydrophobicContact CD2-CB 4.48Å; L26-K35 HydrophobicContact CD2-CG 3.81Å; S30-K35 VanDerWaalsContact O-CE 3.31Å; S30-K35 WeakPolarHBondContact O-CE 3.36Å; S30-K35 PolarHBondContact O-NZ 3.28Å; S31-K35 PolarHBondContact O-N 2.89Å; H32-K35 WeakPolarHBondContact O-CB 3.42Å; H32-K35 PolarHBondContact O-N 3.07Å; V33-K35 VanDerWaalsContact C-N 3.29Å; V33-K35 PolarHBondContact O-N 3.02Å; K35-Q37 VanDerWaalsContact C-N 3.34Å; K35-C38 PolarHBondContact O-N 3.39Å; K35-I39 WeakPolarHBondContact O-CG1 3.42Å; K35-I39 PolarHBondContact O-N 3.37Å; K35-I39 VanDerWaalsContact O-N 3.13Å
36	V	91.2	Very high	86.8	Confident	48 Å²	48	58 Å²	58	29%	0.291	32%	0.315	S	S	.	.	H	α-helix	trans	-62	-44.9	176.7	175.1	0	0	0	0	110.4	H32 V33 C38 I39 V40 L311	H32-V36 WeakPolarHBondContact O-CG2 3.46Å; H32-V36 PolarHBondContact O-N 3.25Å; H32-V36 VanDerWaalsContact O-N 3.12Å; V33-V36 PolarHBondContact O-N 3.24Å; V36-C38 VanDerWaalsContact C-N 3.34Å; V36-C38 PolarHBondContact O-N 3.21Å; V36-I39 PolarHBondContact O-N 3.46Å; V36-I39 VanDerWaalsContact O-N 3.13Å; V36-V40 HydrophobicContact CG1-CG2 4.39Å; V36-V40 WeakPolarHBondContact O-CG2 3.22Å; V36-V40 PolarHBondContact O-N 3.17Å; V36-L311 HydrophobicContact CG1-CD1 4.08Å; V36-L311 HydrophobicContact CG1-CD2 4.04Å
37	Q	90.4	Very high	87.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-61	-41.1	178.2	-177.1	68.6	-30.1	0	0	112.3	I22 V33 N34 K35 I39 V40 T41 V307 L311 N314	I22-Q37 HydrophobicContact CD1-CG 3.92Å; I22-Q37 HydrophobicContact CG2-CB 4.26Å; I22-Q37 HydrophobicContact CG2-CG 3.75Å; V33-Q37 WeakPolarHBondContact O-CB 3.37Å; V33-Q37 PolarHBondContact O-N 2.9Å; N34-Q37 PolarHBondContact O-N 2.95Å; K35-Q37 VanDerWaalsContact C-N 3.34Å; Q37-I39 PolarHBondContact O-N 3.48Å; Q37-V40 PolarHBondContact O-N 2.89Å; Q37-T41 HydrophobicContact CG-CG2 4.37Å; Q37-T41 WeakPolarHBondContact O-CB 3.41Å; Q37-T41 VanDerWaalsContact O-CG2 3.25Å; Q37-T41 WeakPolarHBondContact O-CG2 3.37Å; Q37-T41 PolarHBondContact O-N 3.32Å; Q37-T41 PolarHBondContact O-OG1 3.11Å; Q37-V307 HydrophobicContact CB-CG1 4.24Å; Q37-V307 HydrophobicContact CG-CG1 4.3Å; Q37-L311 VanDerWaalsContact OE1-CB 3.24Å; Q37-N314 PolarHBondContact NE2-ND2 3.44Å
38	C	91.5	Very high	88.9	Confident	7 Å²	7	51.1 Å²	51.1	5%	0.047	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-40.4	174.1	173.2	0	0	0	0	112.5	C23 L26 N34 K35 V36 T41 K42	C23-C38 VanDerWaalsContact CA-SG 3.57Å; C23-C38 HydrophobicContact CB-CB 4.1Å; C23-C38 WeakPolarHBondContact CB-SG 3.2Å; C23-C38 WeakPolarHBondContact SG-CA 3.33Å; C23-C38 WeakPolarHBondContact SG-CB 3.39Å; C23-C38 PolarHBondContact SG-O 2.96Å; C23-C38 CovalentContact SG-SG 2.04Å; C23-C38 PolarHBondContact SG-SG 3.19Å; L26-C38 HydrophobicContact CD1-CB 3.68Å; L26-C38 HydrophobicContact CG-CB 4.43Å; N34-C38 WeakPolarHBondContact O-CB 3.43Å; N34-C38 PolarHBondContact O-N 3.07Å; K35-C38 PolarHBondContact O-N 3.39Å; V36-C38 VanDerWaalsContact C-N 3.34Å; V36-C38 PolarHBondContact O-N 3.21Å; C38-T41 WeakPolarHBondContact CA-OG1 3.39Å; C38-T41 PolarHBondContact O-OG1 2.75Å; C38-K42 WeakPolarHBondContact O-CB 3.26Å; C38-K42 WeakPolarHBondContact O-CG 3.4Å; C38-K42 PolarHBondContact O-N 2.88Å
39	I	93	Very high	90.1	Very high	109 Å²	109	45.1 Å²	45.1	56%	0.559	24%	0.239	S	C	*	.	H	α-helix	trans	-63.7	-48.6	176.1	-66.3	167.1	0	0	0	110.3	K35 V36 Q37 T41 K42 V43	K35-I39 WeakPolarHBondContact O-CG1 3.42Å; K35-I39 PolarHBondContact O-N 3.37Å; K35-I39 VanDerWaalsContact O-N 3.13Å; V36-I39 PolarHBondContact O-N 3.46Å; V36-I39 VanDerWaalsContact O-N 3.13Å; Q37-I39 PolarHBondContact O-N 3.48Å; I39-T41 PolarHBondContact O-N 3.11Å; I39-K42 PolarHBondContact O-N 3.05Å; I39-V43 HydrophobicContact CG2-CG2 4.48Å; I39-V43 WeakPolarHBondContact O-CG2 3.31Å; I39-V43 PolarHBondContact O-N 3.41Å
40	V	94.3	Very high	91.4	Very high	15 Å²	15	47.5 Å²	47.5	9%	0.091	24%	0.243	C	C	.	.	H	α-helix	trans	-61.7	-45.7	-178.7	168.2	0	0	0	0	111.5	V36 Q37 V43 L44 L311 N314 L315 I318	V36-V40 HydrophobicContact CG1-CG2 4.39Å; V36-V40 WeakPolarHBondContact O-CG2 3.22Å; V36-V40 PolarHBondContact O-N 3.17Å; Q37-V40 PolarHBondContact O-N 2.89Å; V40-V43 PolarHBondContact O-N 3.3Å; V40-L44 WeakPolarHBondContact O-CB 3.49Å; V40-L44 PolarHBondContact O-N 3.29Å; V40-L311 HydrophobicContact CB-CD1 3.88Å; V40-L311 HydrophobicContact CG1-CD1 4.02Å; V40-L311 HydrophobicContact CG2-CD1 3.66Å; V40-N314 HydrophobicContact CG1-CB 3.69Å; V40-L315 HydrophobicContact CG1-CD2 4.1Å; V40-L315 HydrophobicContact CG1-CG 4.22Å; V40-L315 HydrophobicContact CG2-CD2 3.92Å; V40-L315 HydrophobicContact CG2-CG 4.49Å; V40-I318 HydrophobicContact CG1-CD1 3.79Å
41	T	93.4	Very high	92.4	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-38.2	177.8	50.3	0	0	0	0	112.5	L19 I22 Q37 C38 I39 L44 G45 N314	L19-T41 HydrophobicContact CD2-CG2 3.91Å; I22-T41 HydrophobicContact CD1-CG2 4.1Å; Q37-T41 HydrophobicContact CG-CG2 4.37Å; Q37-T41 WeakPolarHBondContact O-CB 3.41Å; Q37-T41 VanDerWaalsContact O-CG2 3.25Å; Q37-T41 WeakPolarHBondContact O-CG2 3.37Å; Q37-T41 PolarHBondContact O-N 3.32Å; Q37-T41 PolarHBondContact O-OG1 3.11Å; C38-T41 WeakPolarHBondContact CA-OG1 3.39Å; C38-T41 PolarHBondContact O-OG1 2.75Å; I39-T41 PolarHBondContact O-N 3.11Å; T41-L44 PolarHBondContact O-N 2.84Å; T41-G45 PolarHBondContact O-N 3.47Å; T41-N314 WeakPolarHBondContact CG2-ND2 3.49Å
42	K	93.8	Very high	93	Very high	107 Å²	107	46 Å²	46	47%	0.465	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-46.6	171.3	-79.3	-177.7	177.1	178.4	0	112.3	C38 I39 L44 G45 V46	C38-K42 WeakPolarHBondContact O-CB 3.26Å; C38-K42 WeakPolarHBondContact O-CG 3.4Å; C38-K42 PolarHBondContact O-N 2.88Å; I39-K42 PolarHBondContact O-N 3.05Å; K42-L44 VanDerWaalsContact C-N 3.35Å; K42-G45 PolarHBondContact O-N 2.93Å; K42-V46 WeakPolarHBondContact O-CB 3.38Å; K42-V46 WeakPolarHBondContact O-CG2 3.46Å; K42-V46 PolarHBondContact O-N 3.15Å
43	V	96	Very high	93.5	Very high	62 Å²	62	40.6 Å²	40.6	38%	0.376	20%	0.202	S	C	.	.	H	α-helix	trans	-60.4	-47.6	177.5	170.5	0	0	0	0	110.3	I39 V40 G45 V46 W47 I318	I39-V43 HydrophobicContact CG2-CG2 4.48Å; I39-V43 WeakPolarHBondContact O-CG2 3.31Å; I39-V43 PolarHBondContact O-N 3.41Å; V40-V43 PolarHBondContact O-N 3.3Å; V43-G45 PolarHBondContact O-N 3.29Å; V43-V46 PolarHBondContact O-N 2.89Å; V43-W47 HydrophobicContact CG1-CE3 4.32Å; V43-W47 VanDerWaalsContact O-CB 3.3Å; V43-W47 WeakPolarHBondContact O-CB 3.15Å; V43-W47 PolarHBondContact O-N 3.39Å; V43-I318 HydrophobicContact CB-CD1 4.3Å; V43-I318 HydrophobicContact CG1-CD1 3.98Å
44	L	95.9	Very high	94	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.7	-44	177.9	179.2	56.6	0	0	0	112	L19 V40 T41 K42 S48 K107 N314 D317 I318 N321	L19-L44 HydrophobicContact CD2-CD2 4.01Å; L19-L44 HydrophobicContact CD2-CG 4.33Å; V40-L44 WeakPolarHBondContact O-CB 3.49Å; V40-L44 PolarHBondContact O-N 3.29Å; T41-L44 PolarHBondContact O-N 2.84Å; K42-L44 VanDerWaalsContact C-N 3.35Å; L44-S48 WeakPolarHBondContact O-CB 3.42Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 3.48Å; L44-K107 HydrophobicContact CD2-CD 4.08Å; L44-K107 HydrophobicContact CG-CD 4.34Å; L44-N314 HydrophobicContact CD2-CB 4Å; L44-D317 HydrophobicContact CD1-CB 3.73Å; L44-D317 HydrophobicContact CD2-CB 3.88Å; L44-D317 HydrophobicContact CG-CB 4.5Å; L44-I318 HydrophobicContact CB-CD1 4.3Å; L44-I318 HydrophobicContact CB-CG1 3.93Å; L44-I318 HydrophobicContact CD1-CG1 4.01Å; L44-I318 HydrophobicContact CG-CG1 4.47Å; L44-N321 WeakPolarHBondContact CD1-ND2 3.2Å
45	G	95.2	Very high	94.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-52.8	177.3	0	0	0	0	0	112.3	T41 K42 V43 W47 S48 A49 Y111	T41-G45 PolarHBondContact O-N 3.47Å; K42-G45 PolarHBondContact O-N 2.93Å; V43-G45 PolarHBondContact O-N 3.29Å; G45-W47 VanDerWaalsContact C-N 3.35Å; G45-W47 PolarHBondContact O-N 2.9Å; G45-S48 PolarHBondContact O-N 3.43Å; G45-A49 WeakPolarHBondContact O-CB 3.48Å; G45-A49 PolarHBondContact O-N 3.19Å; G45-Y111 VanDerWaalsContact C-CD1 3.43Å
46	V	96	Very high	94.8	Very high	62 Å²	62	39.5 Å²	39.5	38%	0.376	20%	0.204	S	C	.	.	H	α-helix	trans	-59.1	-45.5	177.7	170.6	0	0	0	0	111.3	K42 V43 Y50 Y111	K42-V46 WeakPolarHBondContact O-CB 3.38Å; K42-V46 WeakPolarHBondContact O-CG2 3.46Å; K42-V46 PolarHBondContact O-N 3.15Å; V43-V46 PolarHBondContact O-N 2.89Å; V46-Y50 HydrophobicContact CG1-CD2 4.15Å; V46-Y50 WeakPolarHBondContact O-CD2 3.48Å; V46-Y50 PolarHBondContact O-N 3.22Å; V46-Y111 HydrophobicContact CG2-CE1 3.72Å
47	W	96.8	Very high	95	Very high	54 Å²	54	38.1 Å²	38.1	21%	0.205	20%	0.2	C	C	.	.	I	π-helix	trans	-64.9	-50.1	-179	-155	-45.7	0	0	0	111.1	V43 G45 A49 L51 L52 N321 L322 T325	V43-W47 HydrophobicContact CG1-CE3 4.32Å; V43-W47 VanDerWaalsContact O-CB 3.3Å; V43-W47 WeakPolarHBondContact O-CB 3.15Å; V43-W47 PolarHBondContact O-N 3.39Å; G45-W47 VanDerWaalsContact C-N 3.35Å; G45-W47 PolarHBondContact O-N 2.9Å; W47-A49 VanDerWaalsContact C-N 3.29Å; W47-A49 PolarHBondContact O-N 3.16Å; W47-L51 HydrophobicContact CD2-CD1 4.13Å; W47-L51 HydrophobicContact CG-CB 4.31Å; W47-L51 HydrophobicContact CG-CD1 4.01Å; W47-L51 PolarHBondContact O-N 2.86Å; W47-L51 VanDerWaalsContact O-N 3.12Å; W47-L52 WeakPolarHBondContact O-CB 3.24Å; W47-L52 PolarHBondContact O-N 2.78Å; W47-N321 HydrophobicContact CD2-CB 4Å; W47-N321 HydrophobicContact CG-CB 3.84Å; W47-L322 HydrophobicContact CH2-CD1 4.39Å; W47-T325 VanDerWaalsContact CZ2-OG1 3.3Å; W47-T325 WeakPolarHBondContact CZ2-OG1 3.33Å
48	S	96.5	Very high	95.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.219	C	C	.	.	I	π-helix	trans	-66.5	-31.9	-178.3	-53.7	0	0	0	0	112	L44 G45 F104 N321	L44-S48 WeakPolarHBondContact O-CB 3.42Å; L44-S48 PolarHBondContact O-N 2.91Å; L44-S48 PolarHBondContact O-OG 3.48Å; G45-S48 PolarHBondContact O-N 3.43Å; S48-F104 WeakPolarHBondContact O-CD2 3.36Å; S48-N321 PolarHBondContact OG-ND2 2.99Å
49	A	95.8	Very high	95.3	Very high	9 Å²	9	41.7 Å²	41.7	7%	0.074	22%	0.219	C	C	.	.	I	π-helix	trans	-76.6	-49	-179.8	0	0	0	0	0	114	G45 W47 P53 Y111 T112	G45-A49 WeakPolarHBondContact O-CB 3.48Å; G45-A49 PolarHBondContact O-N 3.19Å; W47-A49 VanDerWaalsContact C-N 3.29Å; W47-A49 PolarHBondContact O-N 3.16Å; A49-P53 WeakPolarHBondContact O-CG 3.28Å; A49-Y111 HydrophobicContact CB-CD1 4.26Å; A49-T112 HydrophobicContact CB-CG2 3.35Å
50	Y	96.2	Very high	95.4	Very high	133 Å²	133	38.3 Å²	38.3	52%	0.522	20%	0.202	S	C	.	.	I	π-helix	trans	-112.3	-41.3	-164.4	-58.1	-67.6	0	0	0	113.1	V46 T112	V46-Y50 HydrophobicContact CG1-CD2 4.15Å; V46-Y50 WeakPolarHBondContact O-CD2 3.48Å; V46-Y50 PolarHBondContact O-N 3.22Å; Y50-T112 HydrophobicContact CE1-CG2 3.87Å; Y50-T112 HydrophobicContact CE2-CG2 4.23Å
51	L	95.7	Very high	95.4	Very high	86 Å²	86	42.5 Å²	42.5	45%	0.45	22%	0.223	S	C	.	.	I	π-helix	trans	-83.2	-46.1	-177	-64	177.8	0	0	0	111.3	W47 V54 I55	W47-L51 HydrophobicContact CD2-CD1 4.13Å; W47-L51 HydrophobicContact CG-CB 4.31Å; W47-L51 HydrophobicContact CG-CD1 4.01Å; W47-L51 PolarHBondContact O-N 2.86Å; W47-L51 VanDerWaalsContact O-N 3.12Å; L51-V54 PolarHBondContact O-N 3.38Å; L51-I55 HydrophobicContact CB-CD1 4.14Å; L51-I55 WeakPolarHBondContact O-CB 3.23Å; L51-I55 VanDerWaalsContact O-CG1 3.26Å; L51-I55 WeakPolarHBondContact O-CG1 3.44Å; L51-I55 PolarHBondContact O-N 3.39Å
52	L	96.2	Very high	95.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-57.2	-47.8	-174.5	-176.5	73.8	0	0	0	112.7	W47 V54 I55 C56 A99 L103 F104 F324	W47-L52 WeakPolarHBondContact O-CB 3.24Å; W47-L52 PolarHBondContact O-N 2.78Å; L52-V54 VanDerWaalsContact C-N 3.3Å; L52-V54 PolarHBondContact O-N 3.34Å; L52-I55 PolarHBondContact O-N 3.47Å; L52-C56 WeakPolarHBondContact CD1-SG 3.37Å; L52-C56 WeakPolarHBondContact O-CB 3.21Å; L52-C56 PolarHBondContact O-N 3.09Å; L52-A99 HydrophobicContact CD1-CB 4.05Å; L52-A99 HydrophobicContact CD2-CB 4.17Å; L52-A99 HydrophobicContact CG-CB 4.13Å; L52-L103 HydrophobicContact CD2-CB 3.61Å; L52-L103 HydrophobicContact CD2-CD1 4.3Å; L52-F104 HydrophobicContact CD2-CB 4.37Å; L52-F324 HydrophobicContact CD1-CB 3.95Å; L52-F324 HydrophobicContact CD1-CD2 3.59Å; L52-F324 HydrophobicContact CD1-CE2 4.45Å; L52-F324 HydrophobicContact CD1-CG 3.94Å
53	P	96	Very high	95.4	Very high	25 Å²	25	38.2 Å²	38.2	16%	0.162	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-36.4	-178.9	-23.8	36.6	0	0	0	113	A49 G57 W100 F104	A49-P53 WeakPolarHBondContact O-CG 3.28Å; P53-G57 WeakPolarHBondContact O-CA 3.42Å; P53-G57 PolarHBondContact O-N 3.37Å; P53-W100 HydrophobicContact CB-CH2 4.04Å; P53-F104 HydrophobicContact CB-CE2 4.4Å; P53-F104 HydrophobicContact CG-CD2 3.38Å; P53-F104 HydrophobicContact CG-CE2 3.36Å; P53-F104 HydrophobicContact CG-CG 4.09Å; P53-F104 HydrophobicContact CG-CZ 4.06Å
54	V	95.5	Very high	95.3	Very high	94 Å²	94	37.8 Å²	37.8	57%	0.57	21%	0.205	S	C	*	.	H	α-helix	trans	-69.4	-49.7	178.2	178.8	0	0	0	0	110.2	L51 L52 L58	L51-V54 PolarHBondContact O-N 3.38Å; L52-V54 VanDerWaalsContact C-N 3.3Å; L52-V54 PolarHBondContact O-N 3.34Å; V54-L58 HydrophobicContact CG1-CD1 4.32Å; V54-L58 WeakPolarHBondContact O-CG 3.28Å; V54-L58 PolarHBondContact O-N 3.24Å
55	I	95.4	Very high	95.1	Very high	16 Å²	16	40 Å²	40	8%	0.082	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-53.6	-179.2	-68	172.6	0	0	0	110.3	L51 L52 G57 L58 G59 F324 T325 L328	L51-I55 HydrophobicContact CB-CD1 4.14Å; L51-I55 WeakPolarHBondContact O-CB 3.23Å; L51-I55 VanDerWaalsContact O-CG1 3.26Å; L51-I55 WeakPolarHBondContact O-CG1 3.44Å; L51-I55 PolarHBondContact O-N 3.39Å; L52-I55 PolarHBondContact O-N 3.47Å; I55-G57 VanDerWaalsContact C-N 3.34Å; I55-G57 PolarHBondContact O-N 3.37Å; I55-L58 PolarHBondContact O-N 3.33Å; I55-G59 PolarHBondContact O-N 3.01Å; I55-F324 HydrophobicContact CG2-CB 4.49Å; I55-F324 VanDerWaalsContact CG2-O 3.27Å; I55-F324 WeakPolarHBondContact CG2-O 3.47Å; I55-T325 HydrophobicContact CD1-CG2 4.34Å; I55-L328 HydrophobicContact CD1-CD1 4.41Å; I55-L328 HydrophobicContact CG1-CD1 4.11Å; I55-L328 HydrophobicContact CG1-CG 4.46Å; I55-L328 HydrophobicContact CG2-CD2 4.4Å; I55-L328 HydrophobicContact CG2-CG 4.19Å
56	C	96	Very high	94.9	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-33.7	-177.7	-71.6	0	0	0	0	112.1	L52 G59 L60 N95 A99	L52-C56 WeakPolarHBondContact CD1-SG 3.37Å; L52-C56 WeakPolarHBondContact O-CB 3.21Å; L52-C56 PolarHBondContact O-N 3.09Å; C56-G59 PolarHBondContact O-N 3.49Å; C56-L60 WeakPolarHBondContact O-CG 3.4Å; C56-L60 PolarHBondContact O-N 3.42Å; C56-N95 WeakPolarHBondContact CA-ND2 3.43Å; C56-N95 WeakPolarHBondContact CB-ND2 3.32Å; C56-N95 WeakPolarHBondContact CB-OD1 3.47Å; C56-N95 PolarHBondContact O-ND2 3.24Å; C56-N95 VanDerWaalsContact O-ND2 3.11Å; C56-A99 HydrophobicContact CB-CB 3.86Å; C56-A99 WeakPolarHBondContact SG-CB 3.4Å
57	G	95.8	Very high	94.8	Very high	20 Å²	20	38.5 Å²	38.5	21%	0.206	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-46.4	171.5	0	0	0	0	0	112.3	P53 I55 G59 L60 I61	P53-G57 WeakPolarHBondContact O-CA 3.42Å; P53-G57 PolarHBondContact O-N 3.37Å; I55-G57 VanDerWaalsContact C-N 3.34Å; I55-G57 PolarHBondContact O-N 3.37Å; G57-G59 VanDerWaalsContact C-N 3.34Å; G57-L60 PolarHBondContact O-N 3.06Å; G57-I61 WeakPolarHBondContact O-CG1 3.29Å; G57-I61 PolarHBondContact O-N 3.43Å
58	L	94	Very high	94.6	Very high	79 Å²	79	38.9 Å²	38.9	41%	0.414	22%	0.215	S	C	.	.	H	α-helix	trans	-64.3	-38.5	173.8	-71.3	173.9	0	0	0	112.2	V54 I55 I61 T62 L328	V54-L58 HydrophobicContact CG1-CD1 4.32Å; V54-L58 WeakPolarHBondContact O-CG 3.28Å; V54-L58 PolarHBondContact O-N 3.24Å; I55-L58 PolarHBondContact O-N 3.33Å; L58-I61 PolarHBondContact O-N 2.89Å; L58-T62 VanDerWaalsContact O-CB 3.32Å; L58-T62 WeakPolarHBondContact O-CB 3.41Å; L58-T62 PolarHBondContact O-N 3.32Å; L58-T62 PolarHBondContact O-OG1 3.33Å; L58-L328 HydrophobicContact CD1-CD2 4.37Å
59	G	94.4	Very high	94.2	Very high	4 Å²	4	39 Å²	39	4%	0.041	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-49.3	175.1	0	0	0	0	0	112.6	I55 C56 G57 I61 T62 H63 E327	I55-G59 PolarHBondContact O-N 3.01Å; C56-G59 PolarHBondContact O-N 3.49Å; G57-G59 VanDerWaalsContact C-N 3.34Å; G59-I61 PolarHBondContact O-N 3.24Å; G59-T62 PolarHBondContact O-N 3.43Å; G59-H63 WeakPolarHBondContact O-CB 3.5Å; G59-H63 PolarHBondContact O-CD2 2.97Å; G59-H63 VanDerWaalsContact O-CD2 3.28Å; G59-H63 PolarHBondContact O-N 3.28Å; G59-E327 WeakPolarHBondContact CA-OE2 3.45Å
60	L	95.6	Very high	93.9	Very high	38 Å²	38	38.6 Å²	38.6	20%	0.199	21%	0.212	C	C	.	.	H	α-helix	trans	-58.4	-46.1	176.9	-73.2	177.5	0	0	0	112.3	C56 G57 T62 S64 I92 N95 I96	C56-L60 WeakPolarHBondContact O-CG 3.4Å; C56-L60 PolarHBondContact O-N 3.42Å; G57-L60 PolarHBondContact O-N 3.06Å; L60-T62 VanDerWaalsContact C-N 3.34Å; L60-T62 PolarHBondContact O-N 3.43Å; L60-S64 VanDerWaalsContact O-CB 3.22Å; L60-S64 WeakPolarHBondContact O-CB 3.17Å; L60-S64 PolarHBondContact O-N 3.31Å; L60-S64 PolarHBondContact O-OG 3.48Å; L60-I92 HydrophobicContact CD2-CB 4.33Å; L60-I92 HydrophobicContact CD2-CG1 4.26Å; L60-I92 HydrophobicContact CD2-CG2 3.95Å; L60-N95 HydrophobicContact CD2-CB 4.12Å; L60-I96 HydrophobicContact CD2-CD1 4.45Å; L60-I96 HydrophobicContact CD2-CG1 3.98Å
61	I	93.6	Very high	93.6	Very high	103 Å²	103	35.3 Å²	35.3	53%	0.528	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-47.5	177.1	-66.1	167.2	0	0	0	109.9	G57 L58 G59 S64 L65	G57-I61 WeakPolarHBondContact O-CG1 3.29Å; G57-I61 PolarHBondContact O-N 3.43Å; L58-I61 PolarHBondContact O-N 2.89Å; G59-I61 PolarHBondContact O-N 3.24Å; I61-S64 PolarHBondContact O-N 2.94Å; I61-L65 HydrophobicContact CG2-CD1 4.11Å; I61-L65 WeakPolarHBondContact O-CG 3.24Å; I61-L65 PolarHBondContact O-N 2.92Å
62	T	91.7	Very high	93.3	Very high	14 Å²	14	39.6 Å²	39.6	9%	0.086	22%	0.215	C	C	.	.	H	α-helix	trans	-64.3	-51.6	-176.2	-59.4	0	0	0	0	111.7	L58 G59 L60 S64 L65 V66 L331 Y334	L58-T62 VanDerWaalsContact O-CB 3.32Å; L58-T62 WeakPolarHBondContact O-CB 3.41Å; L58-T62 PolarHBondContact O-N 3.32Å; L58-T62 PolarHBondContact O-OG1 3.33Å; G59-T62 PolarHBondContact O-N 3.43Å; L60-T62 VanDerWaalsContact C-N 3.34Å; L60-T62 PolarHBondContact O-N 3.43Å; T62-S64 VanDerWaalsContact C-N 3.3Å; T62-S64 PolarHBondContact O-N 2.87Å; T62-L65 PolarHBondContact O-N 3.25Å; T62-V66 HydrophobicContact CG2-CG2 4.45Å; T62-V66 VanDerWaalsContact O-CG2 3.31Å; T62-V66 WeakPolarHBondContact O-CG2 3.44Å; T62-V66 PolarHBondContact O-N 2.87Å; T62-L331 HydrophobicContact CG2-CB 4.06Å; T62-L331 HydrophobicContact CG2-CD1 3.51Å; T62-L331 HydrophobicContact CG2-CG 4.35Å; T62-Y334 HydrophobicContact CG2-CD2 4.12Å
63	H	94.4	Very high	92.8	Very high	2 Å²	2	43 Å²	43	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-38.2	179.2	-76	-60.1	0	0	0	111.6	G59 L65 V66 I67 S88 N91 I92 Y334	G59-H63 WeakPolarHBondContact O-CB 3.5Å; G59-H63 PolarHBondContact O-CD2 2.97Å; G59-H63 VanDerWaalsContact O-CD2 3.28Å; G59-H63 PolarHBondContact O-N 3.28Å; H63-L65 PolarHBondContact O-N 2.93Å; H63-V66 PolarHBondContact O-N 2.93Å; H63-I67 WeakPolarHBondContact O-CB 3.45Å; H63-I67 WeakPolarHBondContact O-CD1 3.33Å; H63-I67 WeakPolarHBondContact O-CG1 3.26Å; H63-I67 PolarHBondContact O-N 2.89Å; H63-S88 WeakPolarHBondContact ND1-CB 3.3Å; H63-S88 PolarHBondContact ND1-OG 3.48Å; H63-N91 PolarHBondContact CE1-ND2 3.48Å; H63-N91 VanDerWaalsContact CE1-ND2 3.26Å; H63-N91 PolarHBondContact NE2-ND2 3.01Å; H63-I92 HydrophobicContact CB-CD1 3.82Å; H63-I92 HydrophobicContact CB-CG1 3.58Å; H63-Y334 AromaticContact CE1-CE2 3.72Å; H63-Y334 AromaticContact ND1-CE2 3.88Å
64	S	94.7	Very high	92.2	Very high	54 Å²	54	44 Å²	44	38%	0.378	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-41.7	175.3	-61.4	0	0	0	0	112.2	L60 I61 T62 T68	L60-S64 VanDerWaalsContact O-CB 3.22Å; L60-S64 WeakPolarHBondContact O-CB 3.17Å; L60-S64 PolarHBondContact O-N 3.31Å; L60-S64 PolarHBondContact O-OG 3.48Å; I61-S64 PolarHBondContact O-N 2.94Å; T62-S64 VanDerWaalsContact C-N 3.3Å; T62-S64 PolarHBondContact O-N 2.87Å; S64-T68 WeakPolarHBondContact O-CB 3.32Å; S64-T68 PolarHBondContact O-N 2.92Å; S64-T68 PolarHBondContact O-OG1 2.97Å
65	L	91.9	Very high	91.4	Very high	45 Å²	45	48.1 Å²	48.1	24%	0.236	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-43.4	174.5	-72.5	174	0	0	0	111.6	I61 T62 H63 T68 I69 L341 L345	I61-L65 HydrophobicContact CG2-CD1 4.11Å; I61-L65 WeakPolarHBondContact O-CG 3.24Å; I61-L65 PolarHBondContact O-N 2.92Å; T62-L65 PolarHBondContact O-N 3.25Å; H63-L65 PolarHBondContact O-N 2.93Å; L65-T68 PolarHBondContact O-N 3.39Å; L65-I69 WeakPolarHBondContact O-CB 3.36Å; L65-I69 WeakPolarHBondContact O-CD1 3.34Å; L65-I69 WeakPolarHBondContact O-CG1 3.5Å; L65-I69 PolarHBondContact O-N 3.23Å; L65-L341 HydrophobicContact CB-CD1 4.18Å; L65-L345 HydrophobicContact CD1-CD2 4.48Å
66	V	91.6	Very high	90.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-48.5	178.3	169.2	0	0	0	0	110.9	T62 H63 T68 I69 I70 T84 Y334 L338 L341	T62-V66 HydrophobicContact CG2-CG2 4.45Å; T62-V66 VanDerWaalsContact O-CG2 3.31Å; T62-V66 WeakPolarHBondContact O-CG2 3.44Å; T62-V66 PolarHBondContact O-N 2.87Å; H63-V66 PolarHBondContact O-N 2.93Å; V66-T68 VanDerWaalsContact C-N 3.34Å; V66-T68 PolarHBondContact O-N 2.88Å; V66-I69 PolarHBondContact O-N 2.86Å; V66-I70 HydrophobicContact CG1-CD1 3.56Å; V66-I70 HydrophobicContact CG1-CG1 4.39Å; V66-I70 WeakPolarHBondContact O-CB 3.1Å; V66-I70 VanDerWaalsContact O-CG1 3.26Å; V66-I70 WeakPolarHBondContact O-CG1 3.45Å; V66-I70 PolarHBondContact O-N 3.2Å; V66-T84 HydrophobicContact CG1-CG2 4.35Å; V66-Y334 HydrophobicContact CG2-CD2 3.67Å; V66-Y334 HydrophobicContact CG2-CE2 4.13Å; V66-Y334 HydrophobicContact CG2-CG 3.92Å; V66-L338 HydrophobicContact CG1-CD1 4.13Å; V66-L338 HydrophobicContact CG2-CD1 4.07Å; V66-L341 HydrophobicContact CG2-CD2 4.21Å
67	I	93.5	Very high	90.1	Very high	32 Å²	32	57.2 Å²	57.2	16%	0.164	30%	0.296	C	S	.	.	H	α-helix	trans	-57	-49	175.5	-69.8	165.3	0	0	0	110.4	H63 I69 I70 F71 C89 I92	H63-I67 WeakPolarHBondContact O-CB 3.45Å; H63-I67 WeakPolarHBondContact O-CD1 3.33Å; H63-I67 WeakPolarHBondContact O-CG1 3.26Å; H63-I67 PolarHBondContact O-N 2.89Å; I67-I69 PolarHBondContact O-N 3.32Å; I67-I70 PolarHBondContact O-N 3.28Å; I67-F71 HydrophobicContact CB-CD2 4.44Å; I67-F71 HydrophobicContact CG2-CD2 3.73Å; I67-F71 HydrophobicContact CG2-CE2 4.16Å; I67-F71 WeakPolarHBondContact O-CD2 3.47Å; I67-F71 PolarHBondContact O-N 3.45Å; I67-C89 HydrophobicContact CD1-CB 4.39Å; I67-C89 VanDerWaalsContact CD1-SG 3.6Å; I67-I92 HydrophobicContact CD1-CD1 3.42Å; I67-I92 VanDerWaalsContact CD1-CD1 3.42Å
68	T	91.7	Very high	89.4	Confident	62 Å²	62	58.6 Å²	58.6	38%	0.38	30%	0.301	S	S	.	.	H	α-helix	trans	-60.2	-46	-179.9	-61.2	0	0	0	0	111.3	S64 L65 V66 K72 C73	S64-T68 WeakPolarHBondContact O-CB 3.32Å; S64-T68 PolarHBondContact O-N 2.92Å; S64-T68 PolarHBondContact O-OG1 2.97Å; L65-T68 PolarHBondContact O-N 3.39Å; V66-T68 VanDerWaalsContact C-N 3.34Å; V66-T68 PolarHBondContact O-N 2.88Å; T68-K72 HydrophobicContact CG2-CD 4.37Å; T68-K72 WeakPolarHBondContact O-CA 3.21Å; T68-K72 VanDerWaalsContact O-CB 3.25Å; T68-K72 WeakPolarHBondContact O-CB 3.37Å; T68-K72 PolarHBondContact O-N 3.01Å; T68-C73 PolarHBondContact O-N 2.8Å
69	I	89.5	Confident	89.1	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.01	29%	0.286	C	S	.	.	I	π-helix	trans	-63.8	-46.6	179.4	-71.2	164.3	0	0	0	110.7	L65 V66 I67 C73 L74 P340 L341 I344	L65-I69 WeakPolarHBondContact O-CB 3.36Å; L65-I69 WeakPolarHBondContact O-CD1 3.34Å; L65-I69 WeakPolarHBondContact O-CG1 3.5Å; L65-I69 PolarHBondContact O-N 3.23Å; V66-I69 PolarHBondContact O-N 2.86Å; I67-I69 PolarHBondContact O-N 3.32Å; I69-C73 WeakPolarHBondContact O-CA 3.49Å; I69-C73 WeakPolarHBondContact O-CB 3.09Å; I69-C73 PolarHBondContact O-N 3.3Å; I69-C73 VanDerWaalsContact O-N 3.13Å; I69-L74 WeakPolarHBondContact O-CG 3.4Å; I69-L74 PolarHBondContact O-N 2.92Å; I69-L74 VanDerWaalsContact O-N 3.1Å; I69-P340 HydrophobicContact CG2-CB 3.92Å; I69-L341 HydrophobicContact CD1-CB 3.65Å; I69-L341 HydrophobicContact CD1-CD1 3.47Å; I69-L341 VanDerWaalsContact CD1-CD1 3.47Å; I69-L341 HydrophobicContact CD1-CG 4.16Å; I69-I344 HydrophobicContact CD1-CD1 3.78Å; I69-I344 HydrophobicContact CG1-CD1 3.76Å
70	I	89	Confident	88.7	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-66.3	-51.1	-176.3	-69.8	171.6	0	0	0	110.8	V66 I67 I77 L81 T84	V66-I70 HydrophobicContact CG1-CD1 3.56Å; V66-I70 HydrophobicContact CG1-CG1 4.39Å; V66-I70 WeakPolarHBondContact O-CB 3.1Å; V66-I70 VanDerWaalsContact O-CG1 3.26Å; V66-I70 WeakPolarHBondContact O-CG1 3.45Å; V66-I70 PolarHBondContact O-N 3.2Å; I67-I70 PolarHBondContact O-N 3.28Å; I70-I77 HydrophobicContact CG2-CD1 4.38Å; I70-I77 HydrophobicContact CG2-CG2 3.97Å; I70-I77 WeakPolarHBondContact O-CD1 3.46Å; I70-I77 WeakPolarHBondContact O-CG1 3.22Å; I70-L81 HydrophobicContact CD1-CD2 3.97Å; I70-L81 HydrophobicContact CG1-CD2 4.29Å; I70-L81 HydrophobicContact CG2-CB 4.44Å; I70-T84 HydrophobicContact CD1-CG2 4.16Å
71	F	90.7	Very high	88.3	Confident	64 Å²	64	55.1 Å²	55.1	28%	0.281	28%	0.279	S	S	.	.	I	π-helix	trans	-91.1	-23.3	-170.5	-62	-56.3	0	0	0	114.5	I67 I77 W173	I67-F71 HydrophobicContact CB-CD2 4.44Å; I67-F71 HydrophobicContact CG2-CD2 3.73Å; I67-F71 HydrophobicContact CG2-CE2 4.16Å; I67-F71 WeakPolarHBondContact O-CD2 3.47Å; I67-F71 PolarHBondContact O-N 3.45Å; F71-I77 HydrophobicContact CD1-CD1 4.16Å; F71-W173 AromaticContact CD1-CH2 3.88Å; F71-W173 HydrophobicContact CD1-CH2 3.88Å; F71-W173 AromaticContact CD1-CZ2 3.81Å; F71-W173 HydrophobicContact CD1-CZ2 3.81Å; F71-W173 AromaticContact CE1-CH2 3.3Å; F71-W173 HydrophobicContact CE1-CH2 3.3Å; F71-W173 AromaticContact CE1-CZ2 3.43Å; F71-W173 HydrophobicContact CE1-CZ2 3.43Å; F71-W173 VanDerWaalsContact CE1-CZ2 3.43Å; F71-W173 HydrophobicContact CE1-CZ3 4.42Å; F71-W173 AromaticContact CZ-CH2 3.9Å; F71-W173 HydrophobicContact CZ-CH2 3.9Å; F71-W173 HydrophobicContact CZ-CZ2 4.42Å
72	K	88.5	Confident	88.2	Confident	176 Å²	176	50.2 Å²	50.2	77%	0.765	25%	0.254	S	S	*	.	I	π-helix	trans	-107.3	-35.1	179.2	-58.5	-170.1	177.5	-179.6	0	113.8	T68	T68-K72 HydrophobicContact CG2-CD 4.37Å; T68-K72 WeakPolarHBondContact O-CA 3.21Å; T68-K72 VanDerWaalsContact O-CB 3.25Å; T68-K72 WeakPolarHBondContact O-CB 3.37Å; T68-K72 PolarHBondContact O-N 3.01Å
73	C	85.2	Confident	88.2	Confident	74 Å²	74	49.8 Å²	49.8	50%	0.5	25%	0.251	S	S	.	.	I	π-helix	trans	-96.3	-24.7	-172.2	-55.8	0	0	0	0	114.3	T68 I69	T68-C73 PolarHBondContact O-N 2.8Å; I69-C73 WeakPolarHBondContact O-CA 3.49Å; I69-C73 WeakPolarHBondContact O-CB 3.09Å; I69-C73 PolarHBondContact O-N 3.3Å; I69-C73 VanDerWaalsContact O-N 3.13Å
74	L	84	Confident	88.1	Confident	45 Å²	45	49.9 Å²	49.9	24%	0.236	25%	0.252	C	S	.	.			trans	-90.9	113.4	-179.5	-66.7	-179.1	0	0	0	111.3	I69 F76 I77 L81 P340	I69-L74 WeakPolarHBondContact O-CG 3.4Å; I69-L74 PolarHBondContact O-N 2.92Å; I69-L74 VanDerWaalsContact O-N 3.1Å; L74-F76 VanDerWaalsContact C-N 3.35Å; L74-I77 HydrophobicContact CB-CG1 4.11Å; L74-L81 HydrophobicContact CD1-CD1 3.78Å; L74-P340 HydrophobicContact CD2-CG 4.06Å
75	Q	78.9	Confident	88	Confident	181 Å²	181	47.3 Å²	47.3	85%	0.846	23%	0.234	S	C	*	.	S	Bend	trans	-67	-33.8	175	-69.3	-178.3	-24.2	0	0	113
76	F	81.1	Confident	88.1	Confident	177 Å²	177	46.3 Å²	46.3	78%	0.776	23%	0.231	S	C	*	.	S	Bend	trans	-124.5	104.4	176.2	-63.7	-78.1	0	0	0	109.5	L74 P78	L74-F76 VanDerWaalsContact C-N 3.35Å; F76-P78 WeakPolarHBondContact O-CD 3.35Å
77	I	82.2	Confident	88.3	Confident	30 Å²	30	46.9 Å²	46.9	15%	0.154	23%	0.234	C	C	.	.			trans	-89.3	115.6	-178.9	-49.5	174.4	0	0	0	109.1	I70 F71 L74 L81 I82 N169	I70-I77 HydrophobicContact CG2-CD1 4.38Å; I70-I77 HydrophobicContact CG2-CG2 3.97Å; I70-I77 WeakPolarHBondContact O-CD1 3.46Å; I70-I77 WeakPolarHBondContact O-CG1 3.22Å; F71-I77 HydrophobicContact CD1-CD1 4.16Å; L74-I77 HydrophobicContact CB-CG1 4.11Å; I77-L81 HydrophobicContact CG2-CB 3.75Å; I77-I82 HydrophobicContact CB-CG1 4.34Å; I77-I82 HydrophobicContact CG2-CG1 3.66Å; I77-N169 VanDerWaalsContact O-CG 3.25Å; I77-N169 PolarHBondContact O-ND2 3.5Å
78	P	82.4	Confident	88.3	Confident	48 Å²	48	45.4 Å²	45.4	31%	0.312	23%	0.226	S	C	.	.			trans	-59.7	145.6	168.6	-19.7	32.3	0	0	0	111.3	F76 Q80 L81 I82	F76-P78 WeakPolarHBondContact O-CD 3.35Å; P78-Q80 VanDerWaalsContact C-N 3.28Å; P78-Q80 PolarHBondContact O-N 2.71Å; P78-Q80 VanDerWaalsContact O-N 3.11Å; P78-L81 HydrophobicContact CG-CD1 3.98Å; P78-L81 WeakPolarHBondContact O-CB 3.42Å; P78-L81 PolarHBondContact O-N 3.49Å; P78-I82 PolarHBondContact O-N 2.94Å
79	R	85.7	Confident	88.5	Confident	29 Å²	29	45.2 Å²	45.2	11%	0.109	23%	0.226	C	C	.	.	H	α-helix	trans	-43.5	-48.3	178.7	-162.8	175	67.2	-142	0.4	114.3	L81 I82 Y83 D153 S157 F164 N169 A172	R79-L81 VanDerWaalsContact C-N 3.3Å; R79-L81 PolarHBondContact O-N 2.85Å; R79-I82 WeakPolarHBondContact O-CB 3.5Å; R79-I82 PolarHBondContact O-N 3.02Å; R79-I82 VanDerWaalsContact O-N 3.17Å; R79-Y83 HydrophobicContact CG-CE2 4.23Å; R79-D153 IonicContact CZ-OD1 3.3Å; R79-D153 VanDerWaalsContact CZ-OD1 3.22Å; R79-D153 IonicContact CZ-OD2 3.63Å; R79-D153 VanDerWaalsContact CZ-OD2 3.3Å; R79-D153 IonicContact NE-OD1 2.88Å; R79-D153 PolarHBondContact NE-OD1 3.03Å; R79-D153 IonicContact NE-OD2 3.11Å; R79-D153 PolarHBondContact NE-OD2 2.9Å; R79-D153 VanDerWaalsContact NH2-CG 3.33Å; R79-D153 IonicContact NH2-OD1 2.84Å; R79-D153 PolarHBondContact NH2-OD1 3Å; R79-D153 VanDerWaalsContact NH2-OD1 3.11Å; R79-D153 IonicContact NH2-OD2 3.22Å; R79-D153 PolarHBondContact NH2-OD2 3.39Å; R79-S157 PolarHBondContact NH2-OG 3.31Å; R79-F164 PolarHBondContact NH1-O 3.25Å; R79-F164 VanDerWaalsContact NH1-O 3.16Å; R79-N169 PolarHBondContact N-OD1 2.9Å; R79-A172 HydrophobicContact CG-CB 3.47Å; R79-A172 VanDerWaalsContact CG-CB 3.47Å
80	Q	86	Confident	88.8	Confident	9 Å²	9	45.2 Å²	45.2	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-32.7	-179.9	-66.1	-57.9	-21.2	0	0	114.1	P78 I82 Y83 T84 S150 D153 I266 L270	P78-Q80 VanDerWaalsContact C-N 3.28Å; P78-Q80 PolarHBondContact O-N 2.71Å; P78-Q80 VanDerWaalsContact O-N 3.11Å; Q80-I82 VanDerWaalsContact C-N 3.3Å; Q80-I82 PolarHBondContact O-N 3.37Å; Q80-Y83 PolarHBondContact O-N 3.42Å; Q80-T84 PolarHBondContact O-N 3.08Å; Q80-T84 VanDerWaalsContact O-N 3.13Å; Q80-T84 PolarHBondContact O-OG1 2.9Å; Q80-T84 VanDerWaalsContact O-OG1 3.12Å; Q80-S150 PolarHBondContact OE1-OG 2.96Å; Q80-D153 PolarHBondContact NE2-OD2 3.14Å; Q80-I266 HydrophobicContact CB-CG2 4.04Å; Q80-I266 HydrophobicContact CG-CG2 4.05Å; Q80-L270 HydrophobicContact CB-CD1 3.82Å; Q80-L270 HydrophobicContact CG-CD1 3.89Å
81	L	88.2	Confident	89.1	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.052	23%	0.227	C	C	.	.	H	α-helix	trans	-73	-24.1	178.9	-79.1	177	0	0	0	112.5	I70 L74 I77 P78 R79 T84 G85 Y337 L338	I70-L81 HydrophobicContact CD1-CD2 3.97Å; I70-L81 HydrophobicContact CG1-CD2 4.29Å; I70-L81 HydrophobicContact CG2-CB 4.44Å; L74-L81 HydrophobicContact CD1-CD1 3.78Å; I77-L81 HydrophobicContact CG2-CB 3.75Å; P78-L81 HydrophobicContact CG-CD1 3.98Å; P78-L81 WeakPolarHBondContact O-CB 3.42Å; P78-L81 PolarHBondContact O-N 3.49Å; R79-L81 VanDerWaalsContact C-N 3.3Å; R79-L81 PolarHBondContact O-N 2.85Å; L81-T84 PolarHBondContact O-N 3.47Å; L81-G85 PolarHBondContact O-N 3.42Å; L81-Y337 HydrophobicContact CD2-CD1 4.4Å; L81-Y337 HydrophobicContact CD2-CE1 3.48Å; L81-Y337 VanDerWaalsContact CD2-CE1 3.48Å; L81-Y337 HydrophobicContact CG-CE1 4.27Å; L81-L338 HydrophobicContact CD1-CD2 4.23Å; L81-L338 HydrophobicContact CD2-CD2 3.63Å
82	I	91.4	Very high	89.3	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-48	172	-60.8	169.8	0	0	0	109.3	I77 P78 R79 Q80 T84 G85 C86 N169 A172 W173	I77-I82 HydrophobicContact CB-CG1 4.34Å; I77-I82 HydrophobicContact CG2-CG1 3.66Å; P78-I82 PolarHBondContact O-N 2.94Å; R79-I82 WeakPolarHBondContact O-CB 3.5Å; R79-I82 PolarHBondContact O-N 3.02Å; R79-I82 VanDerWaalsContact O-N 3.17Å; Q80-I82 VanDerWaalsContact C-N 3.3Å; Q80-I82 PolarHBondContact O-N 3.37Å; I82-T84 VanDerWaalsContact C-N 3.33Å; I82-T84 PolarHBondContact O-N 3.18Å; I82-G85 PolarHBondContact O-N 3.2Å; I82-C86 PolarHBondContact O-N 3.41Å; I82-C86 PolarHBondContact O-SG 3.36Å; I82-C86 VanDerWaalsContact O-SG 3.39Å; I82-N169 HydrophobicContact CD1-CB 4.2Å; I82-N169 WeakPolarHBondContact CD1-O 3.27Å; I82-A172 HydrophobicContact CB-CB 4.05Å; I82-A172 HydrophobicContact CD1-CB 3.84Å; I82-A172 HydrophobicContact CG2-CB 4.1Å; I82-W173 HydrophobicContact CG2-CD2 3.94Å; I82-W173 HydrophobicContact CG2-CE3 4.31Å; I82-W173 HydrophobicContact CG2-CG 4.28Å; I82-W173 HydrophobicContact CG2-CZ2 4.34Å
83	Y	92.4	Very high	89.7	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.016	20%	0.201	C	C	.	.	H	α-helix	trans	-58.5	-44.6	174.4	-64	-67.7	0	0	0	111.9	R79 Q80 G85 C86 L87 D153 A172 I175	R79-Y83 HydrophobicContact CG-CE2 4.23Å; Q80-Y83 PolarHBondContact O-N 3.42Å; Y83-G85 VanDerWaalsContact C-N 3.32Å; Y83-G85 PolarHBondContact O-N 2.88Å; Y83-C86 PolarHBondContact O-N 3.13Å; Y83-L87 WeakPolarHBondContact O-CB 3.49Å; Y83-L87 PolarHBondContact O-N 3.19Å; Y83-D153 HydrophobicContact CE2-CB 4.24Å; Y83-A172 HydrophobicContact CE2-CB 4.15Å; Y83-I175 HydrophobicContact CE1-CB 4.34Å; Y83-I175 HydrophobicContact CE1-CG2 3.83Å; Y83-I175 WeakPolarHBondContact OH-CD1 3.46Å
84	T	90.9	Very high	90.1	Very high	5 Å²	5	35 Å²	35	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-60.8	-39.8	177.2	-54.3	0	0	0	0	112.8	V66 I70 Q80 L81 I82 S88 Y334	V66-T84 HydrophobicContact CG1-CG2 4.35Å; I70-T84 HydrophobicContact CD1-CG2 4.16Å; Q80-T84 PolarHBondContact O-N 3.08Å; Q80-T84 VanDerWaalsContact O-N 3.13Å; Q80-T84 PolarHBondContact O-OG1 2.9Å; Q80-T84 VanDerWaalsContact O-OG1 3.12Å; L81-T84 PolarHBondContact O-N 3.47Å; I82-T84 VanDerWaalsContact C-N 3.33Å; I82-T84 PolarHBondContact O-N 3.18Å; T84-S88 WeakPolarHBondContact O-CB 3.44Å; T84-S88 PolarHBondContact O-N 3.19Å; T84-S88 PolarHBondContact O-OG 3.43Å; T84-Y334 HydrophobicContact CG2-CD1 4.31Å; T84-Y334 HydrophobicContact CG2-CE1 3.44Å; T84-Y334 VanDerWaalsContact CG2-CE1 3.44Å
85	G	92.8	Very high	90.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-65.1	-50	176.5	0	0	0	0	0	112	L81 I82 Y83 L87 S88 C89	L81-G85 PolarHBondContact O-N 3.42Å; I82-G85 PolarHBondContact O-N 3.2Å; Y83-G85 VanDerWaalsContact C-N 3.32Å; Y83-G85 PolarHBondContact O-N 2.88Å; G85-L87 VanDerWaalsContact C-N 3.32Å; G85-L87 PolarHBondContact O-N 2.96Å; G85-S88 WeakPolarHBondContact O-CB 3.43Å; G85-S88 PolarHBondContact O-N 3.39Å; G85-C89 PolarHBondContact O-N 3.36Å; G85-C89 VanDerWaalsContact O-N 3.08Å; G85-C89 PolarHBondContact O-SG 2.85Å; G85-C89 VanDerWaalsContact O-SG 3.37Å
86	C	95.4	Very high	91.4	Very high	24 Å²	24	27.6 Å²	27.6	16%	0.162	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-40.8	176.8	-65.3	0	0	0	0	112.1	I82 Y83 S88 C89 S90 L146 C176	I82-C86 PolarHBondContact O-N 3.41Å; I82-C86 PolarHBondContact O-SG 3.36Å; I82-C86 VanDerWaalsContact O-SG 3.39Å; Y83-C86 PolarHBondContact O-N 3.13Å; C86-S88 VanDerWaalsContact C-N 3.32Å; C86-S88 PolarHBondContact O-N 3.44Å; C86-C89 WeakPolarHBondContact O-CB 3.37Å; C86-C89 PolarHBondContact O-N 2.93Å; C86-S90 PolarHBondContact O-N 3.12Å; C86-L146 HydrophobicContact CB-CD1 4Å; C86-L146 HydrophobicContact CB-CD2 4.3Å; C86-C176 VanDerWaalsContact SG-SG 3.65Å
87	L	94.4	Very high	92.1	Very high	12 Å²	12	20.4 Å²	20.4	6%	0.063	11%	0.113	C	C	.	.	H	α-helix	trans	-63.6	-39	176.3	-176.3	60.8	0	0	0	111.9	Y83 G85 C89 S90 N91 T143 L146 I147 F273	Y83-L87 WeakPolarHBondContact O-CB 3.49Å; Y83-L87 PolarHBondContact O-N 3.19Å; G85-L87 VanDerWaalsContact C-N 3.32Å; G85-L87 PolarHBondContact O-N 2.96Å; L87-C89 VanDerWaalsContact C-N 3.32Å; L87-C89 PolarHBondContact O-N 3.04Å; L87-S90 WeakPolarHBondContact O-CB 3.27Å; L87-S90 PolarHBondContact O-N 3.02Å; L87-N91 PolarHBondContact O-N 3.42Å; L87-N91 PolarHBondContact O-OD1 2.68Å; L87-T143 HydrophobicContact CD1-CG2 3.69Å; L87-L146 HydrophobicContact CD1-CB 4.25Å; L87-I147 HydrophobicContact CD1-CD1 4.16Å; L87-I147 HydrophobicContact CD1-CG1 3.8Å; L87-I147 HydrophobicContact CD2-CD1 4.41Å; L87-I147 HydrophobicContact CD2-CG1 3.8Å; L87-I147 HydrophobicContact CG-CG1 4.48Å; L87-F273 HydrophobicContact CD2-CD1 4.3Å; L87-F273 HydrophobicContact CD2-CE1 3.32Å; L87-F273 HydrophobicContact CD2-CE2 4.37Å; L87-F273 HydrophobicContact CD2-CZ 3.35Å; L87-F273 HydrophobicContact CG-CE1 4.49Å; L87-F273 HydrophobicContact CG-CZ 4.22Å
88	S	94.3	Very high	92.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63.8	-37.4	174	-63.6	0	0	0	0	111.9	H63 T84 G85 C86 S90 N91 I92	H63-S88 WeakPolarHBondContact ND1-CB 3.3Å; H63-S88 PolarHBondContact ND1-OG 3.48Å; T84-S88 WeakPolarHBondContact O-CB 3.44Å; T84-S88 PolarHBondContact O-N 3.19Å; T84-S88 PolarHBondContact O-OG 3.43Å; G85-S88 WeakPolarHBondContact O-CB 3.43Å; G85-S88 PolarHBondContact O-N 3.39Å; C86-S88 VanDerWaalsContact C-N 3.32Å; C86-S88 PolarHBondContact O-N 3.44Å; S88-S90 VanDerWaalsContact C-N 3.34Å; S88-N91 PolarHBondContact O-N 2.7Å; S88-I92 WeakPolarHBondContact O-CG1 3.46Å; S88-I92 PolarHBondContact O-N 2.68Å
89	C	95.6	Very high	93.1	Very high	58 Å²	58	16.9 Å²	16.9	39%	0.392	9%	0.092	S	C	.	.	H	α-helix	trans	-62.1	-43.9	173.2	-61.3	0	0	0	0	111.3	I67 G85 C86 L87 I92 L93	I67-C89 HydrophobicContact CD1-CB 4.39Å; I67-C89 VanDerWaalsContact CD1-SG 3.6Å; G85-C89 PolarHBondContact O-N 3.36Å; G85-C89 VanDerWaalsContact O-N 3.08Å; G85-C89 PolarHBondContact O-SG 2.85Å; G85-C89 VanDerWaalsContact O-SG 3.37Å; C86-C89 WeakPolarHBondContact O-CB 3.37Å; C86-C89 PolarHBondContact O-N 2.93Å; L87-C89 VanDerWaalsContact C-N 3.32Å; L87-C89 PolarHBondContact O-N 3.04Å; C89-I92 PolarHBondContact O-N 3.37Å; C89-L93 PolarHBondContact O-N 3.43Å; C89-L93 VanDerWaalsContact O-N 3.14Å
90	S	95.5	Very high	93.6	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-62.8	-45.2	177.8	-155.4	0	0	0	0	111.8	C86 L87 S88 I92 L93 T94 S139 L142 T143	C86-S90 PolarHBondContact O-N 3.12Å; L87-S90 WeakPolarHBondContact O-CB 3.27Å; L87-S90 PolarHBondContact O-N 3.02Å; S88-S90 VanDerWaalsContact C-N 3.34Å; S90-I92 PolarHBondContact O-N 3.32Å; S90-L93 WeakPolarHBondContact O-CB 3.38Å; S90-L93 PolarHBondContact O-N 2.95Å; S90-L93 VanDerWaalsContact O-N 3.15Å; S90-T94 PolarHBondContact O-N 3.39Å; S90-T94 PolarHBondContact O-OG1 3.39Å; S90-S139 PolarHBondContact OG-O 2.99Å; S90-L142 WeakPolarHBondContact OG-CG 3.36Å; S90-T143 VanDerWaalsContact CB-OG1 3.23Å; S90-T143 WeakPolarHBondContact CB-OG1 3.15Å; S90-T143 PolarHBondContact OG-N 3.08Å; S90-T143 PolarHBondContact OG-OG1 3.34Å
91	N	94.5	Very high	94	Very high	3 Å²	3	22 Å²	22	2%	0.016	12%	0.115	C	C	.	.	H	α-helix	trans	-62.3	-40.3	176.8	-71.8	-2.5	0	0	0	112.4	H63 L87 S88 L93 T94 N95 T143	H63-N91 PolarHBondContact CE1-ND2 3.48Å; H63-N91 VanDerWaalsContact CE1-ND2 3.26Å; H63-N91 PolarHBondContact NE2-ND2 3.01Å; L87-N91 PolarHBondContact O-N 3.42Å; L87-N91 PolarHBondContact O-OD1 2.68Å; S88-N91 PolarHBondContact O-N 2.7Å; N91-L93 VanDerWaalsContact C-N 3.29Å; N91-L93 PolarHBondContact O-N 3.01Å; N91-T94 PolarHBondContact O-N 3.37Å; N91-N95 WeakPolarHBondContact O-CB 3.32Å; N91-N95 PolarHBondContact O-N 2.85Å; N91-T143 WeakPolarHBondContact OD1-CG2 3.41Å
92	I	96.1	Very high	94.2	Very high	30 Å²	30	22.8 Å²	22.8	15%	0.154	12%	0.117	C	C	.	.	H	α-helix	trans	-58.2	-46.2	174	-73.7	174.5	0	0	0	110.3	L60 H63 I67 S88 C89 S90 N95 I96	L60-I92 HydrophobicContact CD2-CB 4.33Å; L60-I92 HydrophobicContact CD2-CG1 4.26Å; L60-I92 HydrophobicContact CD2-CG2 3.95Å; H63-I92 HydrophobicContact CB-CD1 3.82Å; H63-I92 HydrophobicContact CB-CG1 3.58Å; I67-I92 HydrophobicContact CD1-CD1 3.42Å; I67-I92 VanDerWaalsContact CD1-CD1 3.42Å; S88-I92 WeakPolarHBondContact O-CG1 3.46Å; S88-I92 PolarHBondContact O-N 2.68Å; C89-I92 PolarHBondContact O-N 3.37Å; S90-I92 PolarHBondContact O-N 3.32Å; I92-N95 PolarHBondContact O-N 3.06Å; I92-I96 HydrophobicContact CG2-CD1 3.79Å; I92-I96 HydrophobicContact CG2-CG1 4.49Å; I92-I96 WeakPolarHBondContact O-CG1 3.46Å; I92-I96 PolarHBondContact O-N 3.34Å
93	L	95.7	Very high	94.4	Very high	64 Å²	64	22.8 Å²	22.8	34%	0.335	12%	0.117	S	C	.	.	H	α-helix	trans	-62.5	-47.2	179.5	-176.4	60.8	0	0	0	111.3	C89 S90 N91 N95 I96 L97 T135	C89-L93 PolarHBondContact O-N 3.43Å; C89-L93 VanDerWaalsContact O-N 3.14Å; S90-L93 WeakPolarHBondContact O-CB 3.38Å; S90-L93 PolarHBondContact O-N 2.95Å; S90-L93 VanDerWaalsContact O-N 3.15Å; N91-L93 VanDerWaalsContact C-N 3.29Å; N91-L93 PolarHBondContact O-N 3.01Å; L93-N95 PolarHBondContact O-N 3.3Å; L93-I96 PolarHBondContact O-N 3.48Å; L93-L97 HydrophobicContact CD1-CD1 3.73Å; L93-L97 HydrophobicContact CD1-CG 4.19Å; L93-L97 HydrophobicContact CG-CD1 3.77Å; L93-L97 WeakPolarHBondContact O-CB 3.44Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.32Å; L93-L97 PolarHBondContact O-N 3.35Å; L93-T135 HydrophobicContact CD1-CG2 4.15Å; L93-T135 HydrophobicContact CD2-CG2 4.14Å; L93-T135 HydrophobicContact CG-CG2 4.43Å
94	T	94.8	Very high	94.5	Very high	4 Å²	4	24.6 Å²	24.6	3%	0.025	13%	0.125	C	C	.	.	H	α-helix	trans	-59.5	-46.3	175.6	-58.4	0	0	0	0	111.3	S90 N91 I96 L97 F98 S139 T140 W320 F324	S90-T94 PolarHBondContact O-N 3.39Å; S90-T94 PolarHBondContact O-OG1 3.39Å; N91-T94 PolarHBondContact O-N 3.37Å; T94-I96 PolarHBondContact O-N 2.86Å; T94-L97 PolarHBondContact O-N 3.2Å; T94-F98 HydrophobicContact CG2-CD2 3.84Å; T94-F98 HydrophobicContact CG2-CE2 4.32Å; T94-F98 WeakPolarHBondContact O-CB 3.5Å; T94-F98 PolarHBondContact O-N 3.29Å; T94-S139 WeakPolarHBondContact OG1-CB 3.49Å; T94-S139 PolarHBondContact OG1-OG 2.87Å; T94-T140 HydrophobicContact CG2-CG2 3.72Å; T94-W320 HydrophobicContact CG2-CZ3 4.2Å; T94-F324 HydrophobicContact CG2-CE1 4.4Å; T94-F324 HydrophobicContact CG2-CZ 4.4Å
95	N	95.2	Very high	94.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-61.2	-45.3	-180	-178.8	-45.3	0	0	0	111.6	C56 L60 N91 I92 L93 A99 W100 F324 E327	C56-N95 WeakPolarHBondContact CA-ND2 3.43Å; C56-N95 WeakPolarHBondContact CB-ND2 3.32Å; C56-N95 WeakPolarHBondContact CB-OD1 3.47Å; C56-N95 PolarHBondContact O-ND2 3.24Å; C56-N95 VanDerWaalsContact O-ND2 3.11Å; L60-N95 HydrophobicContact CD2-CB 4.12Å; N91-N95 WeakPolarHBondContact O-CB 3.32Å; N91-N95 PolarHBondContact O-N 2.85Å; I92-N95 PolarHBondContact O-N 3.06Å; L93-N95 PolarHBondContact O-N 3.3Å; N95-A99 WeakPolarHBondContact O-CA 3.22Å; N95-A99 WeakPolarHBondContact O-CB 3.34Å; N95-A99 PolarHBondContact O-N 3.09Å; N95-W100 PolarHBondContact O-N 2.96Å; N95-W100 PolarHBondContact OD1-NE1 3.13Å; N95-F324 HydrophobicContact CB-CE1 4.37Å; N95-E327 PolarHBondContact ND2-OE1 3.25Å; N95-E327 PolarHBondContact ND2-OE2 3.43Å
96	I	95.8	Very high	94.8	Very high	69 Å²	69	25.3 Å²	25.3	35%	0.354	13%	0.131	S	C	.	.	I	π-helix	trans	-61.7	-50.3	175.6	-67.4	169	0	0	0	110.8	L60 I92 L93 T94 W100 L101	L60-I96 HydrophobicContact CD2-CD1 4.45Å; L60-I96 HydrophobicContact CD2-CG1 3.98Å; I92-I96 HydrophobicContact CG2-CD1 3.79Å; I92-I96 HydrophobicContact CG2-CG1 4.49Å; I92-I96 WeakPolarHBondContact O-CG1 3.46Å; I92-I96 PolarHBondContact O-N 3.34Å; L93-I96 PolarHBondContact O-N 3.48Å; T94-I96 PolarHBondContact O-N 2.86Å; I96-W100 WeakPolarHBondContact O-CB 3.38Å; I96-W100 PolarHBondContact O-N 2.85Å; I96-L101 HydrophobicContact CG2-CD1 4.05Å; I96-L101 HydrophobicContact CG2-CG 4.38Å; I96-L101 WeakPolarHBondContact O-CB 3.41Å; I96-L101 WeakPolarHBondContact O-CG 3.32Å; I96-L101 PolarHBondContact O-N 3.29Å
97	L	94	Very high	94.7	Very high	27 Å²	27	25.4 Å²	25.4	14%	0.141	13%	0.128	C	C	.	.	I	π-helix	trans	-69.3	-43	-174	-67.6	168.3	0	0	0	113.1	L93 T94 L101 W102 T135	L93-L97 HydrophobicContact CD1-CD1 3.73Å; L93-L97 HydrophobicContact CD1-CG 4.19Å; L93-L97 HydrophobicContact CG-CD1 3.77Å; L93-L97 WeakPolarHBondContact O-CB 3.44Å; L93-L97 VanDerWaalsContact O-CG 3.27Å; L93-L97 WeakPolarHBondContact O-CG 3.32Å; L93-L97 PolarHBondContact O-N 3.35Å; T94-L97 PolarHBondContact O-N 3.2Å; L97-L101 HydrophobicContact CD2-CD1 4.18Å; L97-W102 PolarHBondContact O-N 2.84Å; L97-T135 HydrophobicContact CD1-CG2 3.57Å
98	F	92.1	Very high	94.8	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	13%	0.125	C	C	.	.	I	π-helix	trans	-86.2	-55.4	-178.9	-98.1	-88.5	0	0	0	113.4	T94 W102 L103 Y136 T140 W320 F324	T94-F98 HydrophobicContact CG2-CD2 3.84Å; T94-F98 HydrophobicContact CG2-CE2 4.32Å; T94-F98 WeakPolarHBondContact O-CB 3.5Å; T94-F98 PolarHBondContact O-N 3.29Å; F98-W102 AromaticContact CD1-CE3 3.46Å; F98-W102 HydrophobicContact CD1-CE3 3.46Å; F98-W102 VanDerWaalsContact CD1-CE3 3.46Å; F98-W102 AromaticContact CD1-CZ3 3.69Å; F98-W102 HydrophobicContact CD1-CZ3 3.69Å; F98-W102 AromaticContact CE1-CE3 3.59Å; F98-W102 HydrophobicContact CE1-CE3 3.59Å; F98-W102 AromaticContact CE1-CZ3 3.3Å; F98-W102 HydrophobicContact CE1-CZ3 3.3Å; F98-W102 HydrophobicContact CG-CE3 4.39Å; F98-W102 HydrophobicContact CZ-CZ3 4.24Å; F98-W102 CarbonylContact O-C 3.53Å; F98-W102 WeakPolarHBondContact O-CB 3.31Å; F98-W102 PolarHBondContact O-N 3.14Å; F98-L103 HydrophobicContact CD1-CD1 4.45Å; F98-L103 PolarHBondContact O-N 3.34Å; F98-Y136 AromaticContact CD2-CD2 3.8Å; F98-Y136 HydrophobicContact CD2-CD2 3.8Å; F98-Y136 HydrophobicContact CD2-CE2 4.19Å; F98-Y136 HydrophobicContact CE1-CE2 4.29Å; F98-Y136 AromaticContact CE2-CD2 2.91Å; F98-Y136 HydrophobicContact CE2-CD2 2.91Å; F98-Y136 AromaticContact CE2-CE2 2.95Å; F98-Y136 HydrophobicContact CE2-CE2 2.95Å; F98-Y136 AromaticContact CE2-CG 3.9Å; F98-Y136 HydrophobicContact CE2-CG 3.9Å; F98-Y136 AromaticContact CE2-CZ 3.85Å; F98-Y136 AromaticContact CZ-CD2 3.39Å; F98-Y136 HydrophobicContact CZ-CD2 3.39Å; F98-Y136 HydrophobicContact CZ-CE1 4.22Å; F98-Y136 AromaticContact CZ-CE2 2.98Å; F98-Y136 HydrophobicContact CZ-CE2 2.98Å; F98-Y136 HydrophobicContact CZ-CG 4.2Å; F98-Y136 AromaticContact CZ-CZ 3.39Å; F98-T140 HydrophobicContact CE2-CG2 3.86Å; F98-W320 HydrophobicContact CD1-CD2 4.02Å; F98-W320 HydrophobicContact CD1-CE3 4.25Å; F98-W320 HydrophobicContact CD1-CG 4.31Å; F98-W320 HydrophobicContact CD2-CH2 4.31Å; F98-W320 HydrophobicContact CD2-CZ3 4.25Å; F98-W320 AromaticContact CE1-CD1 3.81Å; F98-W320 AromaticContact CE1-CD2 3.51Å; F98-W320 HydrophobicContact CE1-CD2 3.51Å; F98-W320 AromaticContact CE1-CE2 3.31Å; F98-W320 HydrophobicContact CE1-CE3 4.06Å; F98-W320 AromaticContact CE1-CG 3.87Å; F98-W320 HydrophobicContact CE1-CG 3.87Å; F98-W320 HydrophobicContact CE1-CH2 4.27Å; F98-W320 AromaticContact CE1-CZ2 3.75Å; F98-W320 HydrophobicContact CE1-CZ2 3.75Å; F98-W320 HydrophobicContact CE1-CZ3 4.39Å; F98-W320 AromaticContact CE1-NE1 3.45Å; F98-W320 HydrophobicContact CE2-CD2 4.39Å; F98-W320 HydrophobicContact CE2-CE3 4.29Å; F98-W320 AromaticContact CE2-CH2 3.48Å; F98-W320 HydrophobicContact CE2-CH2 3.48Å; F98-W320 VanDerWaalsContact CE2-CH2 3.48Å; F98-W320 AromaticContact CE2-CZ2 3.58Å; F98-W320 HydrophobicContact CE2-CZ2 3.58Å; F98-W320 AromaticContact CE2-CZ3 3.84Å; F98-W320 HydrophobicContact CE2-CZ3 3.84Å; F98-W320 HydrophobicContact CG-CE3 4.48Å; F98-W320 AromaticContact CZ-CD2 3.75Å; F98-W320 HydrophobicContact CZ-CD2 3.75Å; F98-W320 AromaticContact CZ-CE2 3.18Å; F98-W320 HydrophobicContact CZ-CE3 4.11Å; F98-W320 AromaticContact CZ-CH2 3.51Å; F98-W320 HydrophobicContact CZ-CH2 3.51Å; F98-W320 AromaticContact CZ-CZ2 3.08Å; F98-W320 HydrophobicContact CZ-CZ2 3.08Å; F98-W320 AromaticContact CZ-CZ3 3.99Å; F98-W320 HydrophobicContact CZ-CZ3 3.99Å; F98-W320 AromaticContact CZ-NE1 3.64Å; F98-F324 HydrophobicContact CB-CE2 3.89Å; F98-F324 HydrophobicContact CB-CZ 3.46Å; F98-F324 VanDerWaalsContact CB-CZ 3.46Å; F98-F324 HydrophobicContact CG-CZ 4.17Å
99	A	94.5	Very high	94.8	Very high	1 Å²	1	27 Å²	27	1%	0.008	14%	0.136	C	C	.	.	I	π-helix	trans	-74.9	-53.6	-169.5	0	0	0	0	0	109.1	L52 C56 N95 F104 F324	L52-A99 HydrophobicContact CD1-CB 4.05Å; L52-A99 HydrophobicContact CD2-CB 4.17Å; L52-A99 HydrophobicContact CG-CB 4.13Å; C56-A99 HydrophobicContact CB-CB 3.86Å; C56-A99 WeakPolarHBondContact SG-CB 3.4Å; N95-A99 WeakPolarHBondContact O-CA 3.22Å; N95-A99 WeakPolarHBondContact O-CB 3.34Å; N95-A99 PolarHBondContact O-N 3.09Å; A99-F104 WeakPolarHBondContact O-CB 3.48Å; A99-F104 PolarHBondContact O-N 2.78Å; A99-F324 HydrophobicContact CB-CE2 4.3Å; A99-F324 HydrophobicContact CB-CZ 4.32Å
100	W	95.5	Very high	94.7	Very high	86 Å²	86	24.3 Å²	24.3	33%	0.326	12%	0.119	S	C	.	.	I	π-helix	trans	-82.8	-33.1	-171.9	-71.7	100.3	0	0	0	115	P53 N95 I96 F104 P105	P53-W100 HydrophobicContact CB-CH2 4.04Å; N95-W100 PolarHBondContact O-N 2.96Å; N95-W100 PolarHBondContact OD1-NE1 3.13Å; I96-W100 WeakPolarHBondContact O-CB 3.38Å; I96-W100 PolarHBondContact O-N 2.85Å; W100-F104 HydrophobicContact CE3-CD1 4.21Å; W100-F104 HydrophobicContact CZ3-CD1 4.22Å; W100-F104 HydrophobicContact CZ3-CE1 4.3Å; W100-P105 VanDerWaalsContact O-CD 3.22Å; W100-P105 WeakPolarHBondContact O-CD 3.36Å; W100-P105 WeakPolarHBondContact O-CG 3.36Å
101	L	94.2	Very high	94.6	Very high	60 Å²	60	26.6 Å²	26.6	31%	0.314	13%	0.127	S	C	.	.	I	π-helix	trans	-98.1	-17.6	-178	-67.1	177	0	0	0	114	I96 L97 I121	I96-L101 HydrophobicContact CG2-CD1 4.05Å; I96-L101 HydrophobicContact CG2-CG 4.38Å; I96-L101 WeakPolarHBondContact O-CB 3.41Å; I96-L101 WeakPolarHBondContact O-CG 3.32Å; I96-L101 PolarHBondContact O-N 3.29Å; L97-L101 HydrophobicContact CD2-CD1 4.18Å; L101-I121 HydrophobicContact CB-CD1 3.99Å; L101-I121 HydrophobicContact CD1-CD1 4.01Å; L101-I121 HydrophobicContact CD2-CD1 4.22Å; L101-I121 HydrophobicContact CG-CD1 4.3Å; L101-I121 WeakPolarHBondContact O-CG2 3.31Å
102	W	93.6	Very high	94.6	Very high	27 Å²	27	29 Å²	29	10%	0.102	14%	0.142	C	C	.	.	I	π-helix	trans	-121.7	-75.3	-178.6	-177.5	33.4	0	0	0	114	L97 F98 F104 P105 A106 F122	L97-W102 PolarHBondContact O-N 2.84Å; F98-W102 AromaticContact CD1-CE3 3.46Å; F98-W102 HydrophobicContact CD1-CE3 3.46Å; F98-W102 VanDerWaalsContact CD1-CE3 3.46Å; F98-W102 AromaticContact CD1-CZ3 3.69Å; F98-W102 HydrophobicContact CD1-CZ3 3.69Å; F98-W102 AromaticContact CE1-CE3 3.59Å; F98-W102 HydrophobicContact CE1-CE3 3.59Å; F98-W102 AromaticContact CE1-CZ3 3.3Å; F98-W102 HydrophobicContact CE1-CZ3 3.3Å; F98-W102 HydrophobicContact CG-CE3 4.39Å; F98-W102 HydrophobicContact CZ-CZ3 4.24Å; F98-W102 CarbonylContact O-C 3.53Å; F98-W102 WeakPolarHBondContact O-CB 3.31Å; F98-W102 PolarHBondContact O-N 3.14Å; W102-F104 PolarHBondContact O-N 3.14Å; W102-P105 WeakPolarHBondContact O-CD 3.37Å; W102-A106 WeakPolarHBondContact O-CA 3.33Å; W102-A106 WeakPolarHBondContact O-CB 3.45Å; W102-A106 PolarHBondContact O-N 3.4Å; W102-F122 HydrophobicContact CB-CE2 4.48Å; W102-F122 HydrophobicContact CB-CZ 4.47Å; W102-F122 AromaticContact CD1-CE2 3.6Å; W102-F122 AromaticContact CD2-CE2 3.69Å; W102-F122 HydrophobicContact CD2-CE2 3.69Å; W102-F122 HydrophobicContact CD2-CZ 4.12Å; W102-F122 AromaticContact CE2-CE2 3.68Å; W102-F122 HydrophobicContact CE3-CE2 4.32Å; W102-F122 HydrophobicContact CE3-CZ 4.43Å; W102-F122 AromaticContact CG-CE2 3.7Å; W102-F122 HydrophobicContact CG-CE2 3.7Å; W102-F122 HydrophobicContact CG-CZ 4.09Å; W102-F122 HydrophobicContact CZ2-CE2 4.35Å; W102-F122 AromaticContact NE1-CE2 3.58Å
103	L	94.4	Very high	94.5	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-59.5	-46.3	-171.9	-71.9	173.4	0	0	0	112.7	L52 F98 K107 G108 D317 W320 F324	L52-L103 HydrophobicContact CD2-CB 3.61Å; L52-L103 HydrophobicContact CD2-CD1 4.3Å; F98-L103 HydrophobicContact CD1-CD1 4.45Å; F98-L103 PolarHBondContact O-N 3.34Å; L103-K107 HydrophobicContact CD2-CD 3.9Å; L103-K107 WeakPolarHBondContact O-CA 3.45Å; L103-K107 VanDerWaalsContact O-CB 3.22Å; L103-K107 WeakPolarHBondContact O-CB 3.47Å; L103-K107 PolarHBondContact O-N 3.37Å; L103-G108 PolarHBondContact O-N 3.22Å; L103-G108 VanDerWaalsContact O-N 3.08Å; L103-D317 HydrophobicContact CD2-CB 4.41Å; L103-W320 HydrophobicContact CD1-CB 4.07Å; L103-F324 HydrophobicContact CD1-CD2 4.41Å; L103-F324 HydrophobicContact CD1-CE2 3.96Å
104	F	96	Very high	94.2	Very high	43 Å²	43	31.9 Å²	31.9	19%	0.189	16%	0.159	C	C	.	.	I	π-helix	trans	-66	-52.4	-179.8	176.9	-116.8	0	0	0	112.1	S48 L52 P53 A99 W100 W102 G108 L109	S48-F104 WeakPolarHBondContact O-CD2 3.36Å; L52-F104 HydrophobicContact CD2-CB 4.37Å; P53-F104 HydrophobicContact CB-CE2 4.4Å; P53-F104 HydrophobicContact CG-CD2 3.38Å; P53-F104 HydrophobicContact CG-CE2 3.36Å; P53-F104 HydrophobicContact CG-CG 4.09Å; P53-F104 HydrophobicContact CG-CZ 4.06Å; A99-F104 WeakPolarHBondContact O-CB 3.48Å; A99-F104 PolarHBondContact O-N 2.78Å; W100-F104 HydrophobicContact CE3-CD1 4.21Å; W100-F104 HydrophobicContact CZ3-CD1 4.22Å; W100-F104 HydrophobicContact CZ3-CE1 4.3Å; W102-F104 PolarHBondContact O-N 3.14Å; F104-G108 CarbonylContact O-C 3.59Å; F104-G108 VanDerWaalsContact O-CA 3.24Å; F104-G108 WeakPolarHBondContact O-CA 3.14Å; F104-G108 PolarHBondContact O-N 3.11Å; F104-L109 HydrophobicContact CD1-CG 4.46Å; F104-L109 HydrophobicContact CE1-CD1 4.34Å; F104-L109 HydrophobicContact CE1-CD2 3.96Å; F104-L109 HydrophobicContact CE1-CG 4.07Å; F104-L109 HydrophobicContact CE2-CD2 3.99Å; F104-L109 HydrophobicContact CE2-CG 4.28Å; F104-L109 HydrophobicContact CZ-CD2 3.51Å; F104-L109 HydrophobicContact CZ-CG 3.98Å; F104-L109 PolarHBondContact O-N 3.43Å
105	P	95.3	Very high	93.9	Very high	13 Å²	13	32.3 Å²	32.3	8%	0.084	17%	0.165	C	C	.	.	I	π-helix	trans	-75.3	-28.6	-177.6	-16.8	32.4	0	0	0	114.9	W100 W102 L109 P110 Y119	W100-P105 VanDerWaalsContact O-CD 3.22Å; W100-P105 WeakPolarHBondContact O-CD 3.36Å; W100-P105 WeakPolarHBondContact O-CG 3.36Å; W102-P105 WeakPolarHBondContact O-CD 3.37Å; P105-L109 HydrophobicContact CB-CD1 4.3Å; P105-P110 WeakPolarHBondContact O-CD 3.25Å; P105-Y119 CarbonylContact C-O 3.48Å; P105-Y119 HydrophobicContact CB-CD1 4.47Å; P105-Y119 PolarHBondContact O-N 2.85Å; P105-Y119 VanDerWaalsContact O-N 3.08Å
106	A	93.5	Very high	93.7	Very high	7 Å²	7	42.7 Å²	42.7	6%	0.058	20%	0.204	C	C	.	.	I	π-helix	trans	-89.2	-24.1	-178.5	0	0	0	0	0	113.3	W102 P110 Y119 F120	W102-A106 WeakPolarHBondContact O-CA 3.33Å; W102-A106 WeakPolarHBondContact O-CB 3.45Å; W102-A106 PolarHBondContact O-N 3.4Å; A106-P110 VanDerWaalsContact C-CG 3.45Å; A106-P110 WeakPolarHBondContact O-CG 3.4Å; A106-Y119 PolarHBondContact N-O 3.31Å; A106-F120 HydrophobicContact CB-CD1 3.59Å; A106-F120 HydrophobicContact CB-CE1 3.61Å
107	K	94	Very high	93.5	Very high	26 Å²	26	44.2 Å²	44.2	11%	0.113	21%	0.211	C	C	.	.	I	π-helix	trans	-124.6	-48.5	-176	-61.9	-176	-179.1	167.1	0	112.8	L19 L44 L103 Y111 D317	L19-K107 HydrophobicContact CD1-CB 3.61Å; L19-K107 HydrophobicContact CD1-CG 4Å; L19-K107 WeakPolarHBondContact CD1-O 3.48Å; L44-K107 HydrophobicContact CD2-CD 4.08Å; L44-K107 HydrophobicContact CG-CD 4.34Å; L103-K107 HydrophobicContact CD2-CD 3.9Å; L103-K107 WeakPolarHBondContact O-CA 3.45Å; L103-K107 VanDerWaalsContact O-CB 3.22Å; L103-K107 WeakPolarHBondContact O-CB 3.47Å; L103-K107 PolarHBondContact O-N 3.37Å; K107-Y111 WeakPolarHBondContact O-CB 3.39Å; K107-Y111 PolarHBondContact O-N 3.42Å; K107-D317 IonicContact NZ-OD1 3.24Å; K107-D317 PolarHBondContact NZ-OD1 2.99Å; K107-D317 VanDerWaalsContact NZ-OD1 3.08Å; K107-D317 IonicContact NZ-OD2 2.7Å; K107-D317 PolarHBondContact NZ-OD2 3.44Å
108	G	95.4	Very high	93.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.227	C	C	.	.	I	π-helix	trans	-64.4	-58.3	-179.2	0	0	0	0	0	113.5	L103 F104 Y111 T112	L103-G108 PolarHBondContact O-N 3.22Å; L103-G108 VanDerWaalsContact O-N 3.08Å; F104-G108 CarbonylContact O-C 3.59Å; F104-G108 VanDerWaalsContact O-CA 3.24Å; F104-G108 WeakPolarHBondContact O-CA 3.14Å; F104-G108 PolarHBondContact O-N 3.11Å; G108-Y111 PolarHBondContact O-N 2.75Å; G108-T112 WeakPolarHBondContact O-CG2 3.44Å; G108-T112 PolarHBondContact O-N 3.39Å; G108-T112 VanDerWaalsContact O-N 3.07Å; G108-T112 PolarHBondContact O-OG1 3.19Å
109	L	95.2	Very high	93.5	Very high	44 Å²	44	53.7 Å²	53.7	23%	0.23	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-51.8	-179.5	-69.1	-177.9	0	0	0	113	F104 P105 Y111 T112 T113 I117	F104-L109 HydrophobicContact CD1-CG 4.46Å; F104-L109 HydrophobicContact CE1-CD1 4.34Å; F104-L109 HydrophobicContact CE1-CD2 3.96Å; F104-L109 HydrophobicContact CE1-CG 4.07Å; F104-L109 HydrophobicContact CE2-CD2 3.99Å; F104-L109 HydrophobicContact CE2-CG 4.28Å; F104-L109 HydrophobicContact CZ-CD2 3.51Å; F104-L109 HydrophobicContact CZ-CG 3.98Å; F104-L109 PolarHBondContact O-N 3.43Å; P105-L109 HydrophobicContact CB-CD1 4.3Å; L109-Y111 VanDerWaalsContact C-N 3.26Å; L109-Y111 PolarHBondContact O-N 2.9Å; L109-T112 PolarHBondContact O-N 2.93Å; L109-T112 PolarHBondContact O-OG1 3.49Å; L109-T113 WeakPolarHBondContact O-CB 3.48Å; L109-T113 WeakPolarHBondContact O-CG2 3.23Å; L109-T113 PolarHBondContact O-N 3.43Å; L109-T113 PolarHBondContact O-OG1 3.46Å; L109-I117 CarbonylContact C-O 3.51Å; L109-I117 HydrophobicContact CB-CG2 4.5Å; L109-I117 WeakPolarHBondContact CB-O 3.4Å; L109-I117 HydrophobicContact CD1-CG2 4.16Å
110	P	93.9	Very high	93.4	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-60.7	-35.8	178	7.1	-17.7	0	0	0	112.5	P16 P105 A106 T113 N114 G115 I117	P16-P110 HydrophobicContact CB-CB 4.05Å; P16-P110 WeakPolarHBondContact O-CB 3.25Å; P105-P110 WeakPolarHBondContact O-CD 3.25Å; A106-P110 VanDerWaalsContact C-CG 3.45Å; A106-P110 WeakPolarHBondContact O-CG 3.4Å; P110-T113 PolarHBondContact O-N 2.89Å; P110-N114 CarbonylContact O-C 3.54Å; P110-N114 WeakPolarHBondContact O-CA 3.28Å; P110-N114 PolarHBondContact O-N 3.26Å; P110-G115 PolarHBondContact O-N 3.2Å; P110-I117 WeakPolarHBondContact CA-O 3.48Å; P110-I117 WeakPolarHBondContact CD-O 3.42Å; P110-I117 VanDerWaalsContact N-O 3.07Å
111	Y	93.5	Very high	93.3	Very high	49 Å²	49	51.6 Å²	51.6	19%	0.192	24%	0.241	C	C	.	.	H	α-helix	trans	-62.1	-47.7	174.8	-177.5	-99.5	0	0	0	112.6	L19 V20 G45 V46 A49 K107 G108 L109 T113	L19-Y111 HydrophobicContact CB-CD2 4.34Å; V20-Y111 HydrophobicContact CG2-CD2 4.43Å; G45-Y111 VanDerWaalsContact C-CD1 3.43Å; V46-Y111 HydrophobicContact CG2-CE1 3.72Å; A49-Y111 HydrophobicContact CB-CD1 4.26Å; K107-Y111 WeakPolarHBondContact O-CB 3.39Å; K107-Y111 PolarHBondContact O-N 3.42Å; G108-Y111 PolarHBondContact O-N 2.75Å; L109-Y111 VanDerWaalsContact C-N 3.26Å; L109-Y111 PolarHBondContact O-N 2.9Å; Y111-T113 VanDerWaalsContact C-N 3.29Å; Y111-T113 PolarHBondContact O-N 3.33Å
112	T	93.5	Very high	93.2	Very high	54 Å²	54	49.1 Å²	49.1	33%	0.331	23%	0.228	S	C	.	.	H	α-helix	trans	-68.9	-26.7	-179.8	58.1	0	0	0	0	114.1	A49 Y50 G108 L109	A49-T112 HydrophobicContact CB-CG2 3.35Å; Y50-T112 HydrophobicContact CE1-CG2 3.87Å; Y50-T112 HydrophobicContact CE2-CG2 4.23Å; G108-T112 WeakPolarHBondContact O-CG2 3.44Å; G108-T112 PolarHBondContact O-N 3.39Å; G108-T112 VanDerWaalsContact O-N 3.07Å; G108-T112 PolarHBondContact O-OG1 3.19Å; L109-T112 PolarHBondContact O-N 2.93Å; L109-T112 PolarHBondContact O-OG1 3.49Å
113	T	93.5	Very high	93	Very high	33 Å²	33	48.7 Å²	48.7	20%	0.202	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	10.1	-173.6	63.1	0	0	0	0	113.2	L109 P110 Y111 G115 R116 I117	L109-T113 WeakPolarHBondContact O-CB 3.48Å; L109-T113 WeakPolarHBondContact O-CG2 3.23Å; L109-T113 PolarHBondContact O-N 3.43Å; L109-T113 PolarHBondContact O-OG1 3.46Å; P110-T113 PolarHBondContact O-N 2.89Å; Y111-T113 VanDerWaalsContact C-N 3.29Å; Y111-T113 PolarHBondContact O-N 3.33Å; T113-G115 VanDerWaalsContact C-N 3.26Å; T113-G115 PolarHBondContact O-N 3.34Å; T113-R116 WeakPolarHBondContact O-CB 3.45Å; T113-R116 VanDerWaalsContact O-CG 3.25Å; T113-R116 WeakPolarHBondContact O-CG 3.25Å; T113-R116 PolarHBondContact O-N 3.05Å; T113-R116 PolarHBondContact OG1-N 3.3Å; T113-I117 HydrophobicContact CG2-CB 3.94Å; T113-I117 HydrophobicContact CG2-CD1 4Å; T113-I117 HydrophobicContact CG2-CG1 3.96Å; T113-I117 PolarHBondContact OG1-N 2.79Å; T113-I117 PolarHBondContact OG1-O 3.36Å
114	N	90.4	Very high	92.8	Very high	121 Å²	121	51 Å²	51	65%	0.647	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.9	46.1	-173.7	-66.8	-33.8	0	0	0	112.4	P110 R116	P110-N114 CarbonylContact O-C 3.54Å; P110-N114 WeakPolarHBondContact O-CA 3.28Å; P110-N114 PolarHBondContact O-N 3.26Å; N114-R116 VanDerWaalsContact C-N 3.35Å; N114-R116 PolarHBondContact O-N 3.28Å
115	G	87.9	Confident	92.6	Very high	13 Å²	13	50.9 Å²	50.9	13%	0.134	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	3.6	177.4	0	0	0	0	0	115.5	P110 T113 Y118	P110-G115 PolarHBondContact O-N 3.2Å; T113-G115 VanDerWaalsContact C-N 3.26Å; T113-G115 PolarHBondContact O-N 3.34Å; G115-Y118 WeakPolarHBondContact O-CD1 3.36Å
116	R	90.8	Very high	92.4	Very high	219 Å²	219	54.1 Å²	54.1	83%	0.826	26%	0.258	S	S	*	.	S	Bend	trans	-76.6	-37.3	-177.3	-66.4	176.5	179.9	-174.8	0.3	114	T113 N114	T113-R116 WeakPolarHBondContact O-CB 3.45Å; T113-R116 VanDerWaalsContact O-CG 3.25Å; T113-R116 WeakPolarHBondContact O-CG 3.25Å; T113-R116 PolarHBondContact O-N 3.05Å; T113-R116 PolarHBondContact OG1-N 3.3Å; N114-R116 VanDerWaalsContact C-N 3.35Å; N114-R116 PolarHBondContact O-N 3.28Å
117	I	92.9	Very high	92.4	Very high	100 Å²	100	59 Å²	59	51%	0.513	28%	0.283	S	S	.	.	S	Bend	trans	-118.3	119.5	179.7	-54.8	-176.9	0	0	0	107.9	L109 P110 T113	L109-I117 CarbonylContact C-O 3.51Å; L109-I117 HydrophobicContact CB-CG2 4.5Å; L109-I117 WeakPolarHBondContact CB-O 3.4Å; L109-I117 HydrophobicContact CD1-CG2 4.16Å; P110-I117 WeakPolarHBondContact CA-O 3.48Å; P110-I117 WeakPolarHBondContact CD-O 3.42Å; P110-I117 VanDerWaalsContact N-O 3.07Å; T113-I117 HydrophobicContact CG2-CB 3.94Å; T113-I117 HydrophobicContact CG2-CD1 4Å; T113-I117 HydrophobicContact CG2-CG1 3.96Å; T113-I117 PolarHBondContact OG1-N 2.79Å; T113-I117 PolarHBondContact OG1-O 3.36Å
118	Y	92.8	Very high	92.3	Very high	119 Å²	119	58.8 Å²	58.8	47%	0.467	29%	0.286	S	S	.	.			trans	-153.5	157.8	-179.9	61.5	-89.2	0	0	0	110.5	P16 G115 F120	P16-Y118 HydrophobicContact CB-CD1 3.4Å; P16-Y118 VanDerWaalsContact CB-CD1 3.4Å; P16-Y118 HydrophobicContact CB-CD2 4.11Å; P16-Y118 HydrophobicContact CB-CE1 3.9Å; P16-Y118 HydrophobicContact CB-CG 3.52Å; P16-Y118 HydrophobicContact CG-CD1 3.75Å; P16-Y118 HydrophobicContact CG-CD2 4.39Å; P16-Y118 HydrophobicContact CG-CE1 3.67Å; P16-Y118 HydrophobicContact CG-CE2 4.31Å; P16-Y118 HydrophobicContact CG-CG 4.12Å; G115-Y118 WeakPolarHBondContact O-CD1 3.36Å; Y118-F120 AromaticContact CD2-CD2 3.59Å; Y118-F120 HydrophobicContact CD2-CD2 3.59Å; Y118-F120 AromaticContact CD2-CE2 3.36Å; Y118-F120 HydrophobicContact CD2-CE2 3.36Å; Y118-F120 HydrophobicContact CD2-CZ 4.48Å; Y118-F120 HydrophobicContact CE2-CD2 4.1Å; Y118-F120 AromaticContact CE2-CE2 3.96Å; Y118-F120 HydrophobicContact CE2-CE2 3.96Å; Y118-F120 HydrophobicContact CG-CE2 4.09Å
119	Y	93.1	Very high	92.2	Very high	110 Å²	110	58.8 Å²	58.8	43%	0.431	29%	0.286	S	S	.	.			trans	-149.8	125.8	170.3	-178.2	-108	0	0	0	110.5	P105 A106 I121	P105-Y119 CarbonylContact C-O 3.48Å; P105-Y119 HydrophobicContact CB-CD1 4.47Å; P105-Y119 PolarHBondContact O-N 2.85Å; P105-Y119 VanDerWaalsContact O-N 3.08Å; A106-Y119 PolarHBondContact N-O 3.31Å; Y119-I121 HydrophobicContact CE1-CB 3.89Å; Y119-I121 HydrophobicContact CE1-CG1 4.28Å
120	F	92.5	Very high	92.2	Very high	24 Å²	24	59.5 Å²	59.5	11%	0.105	29%	0.285	C	S	.	.			trans	-112.1	96.8	178	-62.1	-79.3	0	0	0	109.3	D14 P16 A106 Y118 F122 N123 S124	D14-F120 HydrophobicContact CB-CD1 4.14Å; D14-F120 HydrophobicContact CB-CE1 3.9Å; D14-F120 HydrophobicContact CB-CZ 4.47Å; P16-F120 HydrophobicContact CB-CE2 4.38Å; A106-F120 HydrophobicContact CB-CD1 3.59Å; A106-F120 HydrophobicContact CB-CE1 3.61Å; Y118-F120 AromaticContact CD2-CD2 3.59Å; Y118-F120 HydrophobicContact CD2-CD2 3.59Å; Y118-F120 AromaticContact CD2-CE2 3.36Å; Y118-F120 HydrophobicContact CD2-CE2 3.36Å; Y118-F120 HydrophobicContact CD2-CZ 4.48Å; Y118-F120 HydrophobicContact CE2-CD2 4.1Å; Y118-F120 AromaticContact CE2-CE2 3.96Å; Y118-F120 HydrophobicContact CE2-CE2 3.96Å; Y118-F120 HydrophobicContact CG-CE2 4.09Å; F120-F122 PolarHBondContact O-N 3.13Å; F120-F122 VanDerWaalsContact O-N 3.15Å; F120-N123 HydrophobicContact CB-CB 3.93Å; F120-N123 PolarHBondContact O-N 3.46Å; F120-S124 PolarHBondContact O-N 3.01Å
121	I	92	Very high	92.2	Very high	19 Å²	19	63.3 Å²	63.3	10%	0.097	30%	0.304	C	S	.	.	H	α-helix	trans	-57.7	-32.1	-178.6	-168.2	164.3	0	0	0	112.9	L101 Y119 N123 S124 C132	L101-I121 HydrophobicContact CB-CD1 3.99Å; L101-I121 HydrophobicContact CD1-CD1 4.01Å; L101-I121 HydrophobicContact CD2-CD1 4.22Å; L101-I121 HydrophobicContact CG-CD1 4.3Å; L101-I121 WeakPolarHBondContact O-CG2 3.31Å; Y119-I121 HydrophobicContact CE1-CB 3.89Å; Y119-I121 HydrophobicContact CE1-CG1 4.28Å; I121-N123 VanDerWaalsContact C-N 3.27Å; I121-N123 PolarHBondContact O-N 3.17Å; I121-S124 WeakPolarHBondContact O-CB 3.38Å; I121-S124 PolarHBondContact O-N 3.43Å; I121-C132 WeakPolarHBondContact CD1-SG 3.12Å
122	F	91.9	Very high	92.2	Very high	8 Å²	8	61.9 Å²	61.9	4%	0.035	30%	0.301	C	S	.	.	H	α-helix	trans	-71.1	-21.7	178.6	-57.4	-41.1	0	0	0	113.9	W102 F120 C129 C132 R133 W196 C205	W102-F122 HydrophobicContact CB-CE2 4.48Å; W102-F122 HydrophobicContact CB-CZ 4.47Å; W102-F122 AromaticContact CD1-CE2 3.6Å; W102-F122 AromaticContact CD2-CE2 3.69Å; W102-F122 HydrophobicContact CD2-CE2 3.69Å; W102-F122 HydrophobicContact CD2-CZ 4.12Å; W102-F122 AromaticContact CE2-CE2 3.68Å; W102-F122 HydrophobicContact CE3-CE2 4.32Å; W102-F122 HydrophobicContact CE3-CZ 4.43Å; W102-F122 AromaticContact CG-CE2 3.7Å; W102-F122 HydrophobicContact CG-CE2 3.7Å; W102-F122 HydrophobicContact CG-CZ 4.09Å; W102-F122 HydrophobicContact CZ2-CE2 4.35Å; W102-F122 AromaticContact NE1-CE2 3.58Å; F120-F122 PolarHBondContact O-N 3.13Å; F120-F122 VanDerWaalsContact O-N 3.15Å; F122-C129 WeakPolarHBondContact O-CB 3.19Å; F122-C132 HydrophobicContact CD1-CB 4.07Å; F122-C132 HydrophobicContact CE1-CB 3.7Å; F122-R133 HydrophobicContact CD1-CG 4.17Å; F122-R133 HydrophobicContact CE1-CG 3.96Å; F122-W196 PolarHBondContact O-NE1 3.15Å; F122-C205 HydrophobicContact CB-CB 3.7Å; F122-C205 HydrophobicContact CG-CB 4.41Å
123	N	91	Very high	92.2	Very high	17 Å²	17	60 Å²	60	9%	0.091	29%	0.288	C	S	.	.	H	α-helix	trans	-97	-6.3	-179.9	-56.9	-4.1	0	0	0	111.3	F12 F120 I121	F12-N123 WeakPolarHBondContact CB-ND2 3.22Å; F12-N123 HydrophobicContact CD1-CB 3.88Å; F12-N123 VanDerWaalsContact CD1-CG 3.43Å; F12-N123 WeakPolarHBondContact CD1-OD1 3.41Å; F12-N123 HydrophobicContact CD2-CB 4Å; F12-N123 HydrophobicContact CE1-CB 3.87Å; F12-N123 HydrophobicContact CE2-CB 3.98Å; F12-N123 HydrophobicContact CG-CB 3.95Å; F12-N123 WeakPolarHBondContact CG-ND2 3.37Å; F12-N123 HydrophobicContact CZ-CB 3.92Å; F120-N123 HydrophobicContact CB-CB 3.93Å; F120-N123 PolarHBondContact O-N 3.46Å; I121-N123 VanDerWaalsContact C-N 3.27Å; I121-N123 PolarHBondContact O-N 3.17Å
124	S	89.9	Confident	92.3	Very high	48 Å²	48	60 Å²	60	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-68.5	-39.4	-178.6	175.1	0	0	0	0	113	I7 F120 I121	I7-S124 WeakPolarHBondContact CD1-O 3.34Å; F120-S124 PolarHBondContact O-N 3.01Å; I121-S124 WeakPolarHBondContact O-CB 3.38Å; I121-S124 PolarHBondContact O-N 3.43Å
125	S	91.9	Very high	92.5	Very high	42 Å²	42	55.8 Å²	55.8	29%	0.294	26%	0.264	S	S	.	.			trans	-167	159.5	171.6	62.1	0	0	0	0	110.4	I127 A128 C129 W196	S125-I127 VanDerWaalsContact C-N 3.26Å; S125-I127 PolarHBondContact O-N 3.14Å; S125-A128 PolarHBondContact O-N 2.87Å; S125-A128 WeakPolarHBondContact OG-CB 3.19Å; S125-A128 PolarHBondContact OG-N 3.47Å; S125-C129 WeakPolarHBondContact O-CB 3.47Å; S125-C129 PolarHBondContact O-N 3.22Å; S125-W196 VanDerWaalsContact C-CZ2 3.42Å
126	R	91.3	Very high	92.7	Very high	80 Å²	80	55.5 Å²	55.5	30%	0.302	26%	0.259	S	S	.	.	H	α-helix	trans	-57.1	-38.6	172.8	-63.9	-174.1	-168.9	-149.7	9.8	112.7	D5 Y10 C129 R130 D195 W196	D5-R126 IonicContact OD2-CZ 3.05Å; D5-R126 VanDerWaalsContact OD2-CZ 3.22Å; D5-R126 IonicContact OD2-NE 3.57Å; D5-R126 PolarHBondContact OD2-NE 2.95Å; D5-R126 IonicContact OD2-NH2 3.35Å; D5-R126 PolarHBondContact OD2-NH2 3.44Å; Y10-R126 PolarHBondContact OH-NH2 3.39Å; Y10-R126 VanDerWaalsContact OH-NH2 3.14Å; R126-C129 WeakPolarHBondContact O-CB 3.48Å; R126-C129 PolarHBondContact O-N 3.05Å; R126-R130 WeakPolarHBondContact O-CG 3.37Å; R126-R130 PolarHBondContact O-N 3.36Å; R126-D195 IonicContact NH1-OD2 2.55Å; R126-W196 HydrophobicContact CG-CB 4.48Å; R126-W196 HydrophobicContact CG-CD2 3.52Å; R126-W196 HydrophobicContact CG-CE3 3.57Å; R126-W196 HydrophobicContact CG-CG 3.94Å; R126-W196 HydrophobicContact CG-CH2 4.4Å; R126-W196 HydrophobicContact CG-CZ2 4.37Å; R126-W196 HydrophobicContact CG-CZ3 4.03Å
127	I	92.7	Very high	92.9	Very high	111 Å²	111	45.1 Å²	45.1	57%	0.569	22%	0.22	S	C	*	.	H	α-helix	trans	-67.5	-45.3	178	-62.9	169.1	0	0	0	110.5	S125 C129 R130 I131	S125-I127 VanDerWaalsContact C-N 3.26Å; S125-I127 PolarHBondContact O-N 3.14Å; I127-C129 VanDerWaalsContact C-N 3.34Å; I127-C129 PolarHBondContact O-N 3.41Å; I127-R130 PolarHBondContact O-N 3.02Å; I127-I131 HydrophobicContact CG2-CD1 3.59Å; I127-I131 HydrophobicContact CG2-CG1 4.26Å; I127-I131 WeakPolarHBondContact O-CB 3.47Å; I127-I131 WeakPolarHBondContact O-CG1 3.36Å; I127-I131 PolarHBondContact O-N 3.46Å
128	A	92.8	Very high	93	Very high	21 Å²	21	41.4 Å²	41.4	17%	0.174	20%	0.201	C	C	.	.	H	α-helix	trans	-61.6	-44	176.2	0	0	0	0	0	111.3	S125 R130 C132	S125-A128 PolarHBondContact O-N 2.87Å; S125-A128 WeakPolarHBondContact OG-CB 3.19Å; S125-A128 PolarHBondContact OG-N 3.47Å; A128-R130 PolarHBondContact O-N 3.46Å; A128-C132 WeakPolarHBondContact O-CB 3.47Å; A128-C132 PolarHBondContact O-N 2.95Å; A128-C132 PolarHBondContact O-SG 3.47Å
129	C	93.4	Very high	93.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-50.2	-57.5	172.1	162.5	0	0	0	0	111.6	F122 S125 R126 I127 R133 C205	F122-C129 WeakPolarHBondContact O-CB 3.19Å; S125-C129 WeakPolarHBondContact O-CB 3.47Å; S125-C129 PolarHBondContact O-N 3.22Å; R126-C129 WeakPolarHBondContact O-CB 3.48Å; R126-C129 PolarHBondContact O-N 3.05Å; I127-C129 VanDerWaalsContact C-N 3.34Å; I127-C129 PolarHBondContact O-N 3.41Å; C129-R133 WeakPolarHBondContact O-CB 3.39Å; C129-R133 VanDerWaalsContact O-CG 3.29Å; C129-R133 WeakPolarHBondContact O-CG 3.36Å; C129-R133 PolarHBondContact O-N 3.09Å; C129-C205 WeakPolarHBondContact CA-SG 3.46Å; C129-C205 HydrophobicContact CB-CB 3.87Å; C129-C205 WeakPolarHBondContact CB-SG 3.43Å; C129-C205 VanDerWaalsContact SG-CA 3.59Å; C129-C205 WeakPolarHBondContact SG-CB 3.19Å; C129-C205 CovalentContact SG-SG 2.01Å; C129-C205 PolarHBondContact SG-SG 3.04Å
130	R	94.7	Very high	93.3	Very high	58 Å²	58	30.6 Å²	30.6	22%	0.219	16%	0.159	C	C	.	.	H	α-helix	trans	-58.2	-54.7	-179.8	-74.7	175.4	-169.1	-159.3	5.7	112.9	R126 I127 A128 C132 R133 F134 I194 D195	R126-R130 WeakPolarHBondContact O-CG 3.37Å; R126-R130 PolarHBondContact O-N 3.36Å; I127-R130 PolarHBondContact O-N 3.02Å; A128-R130 PolarHBondContact O-N 3.46Å; R130-C132 PolarHBondContact O-N 2.92Å; R130-R133 PolarHBondContact O-N 2.97Å; R130-F134 VanDerWaalsContact O-CB 3.24Å; R130-F134 WeakPolarHBondContact O-CB 3.47Å; R130-F134 PolarHBondContact O-N 2.98Å; R130-I194 WeakPolarHBondContact CG-O 3.26Å; R130-I194 PolarHBondContact NE-O 2.8Å; R130-D195 IonicContact CZ-OD1 3.08Å; R130-D195 IonicContact CZ-OD2 2.71Å; R130-D195 IonicContact NE-OD1 3.85Å; R130-D195 IonicContact NH2-OD1 2.67Å; R130-D195 PolarHBondContact NH2-OD1 2.99Å; R130-D195 IonicContact NH2-OD2 3.23Å; R130-D195 PolarHBondContact NH2-OD2 2.98Å
131	I	94.2	Very high	93.5	Very high	83 Å²	83	29.4 Å²	29.4	43%	0.426	15%	0.154	S	C	.	.	H	α-helix	trans	-64.8	-43.9	-175.7	-67.1	176	0	0	0	110.5	I127 T135	I127-I131 HydrophobicContact CG2-CD1 3.59Å; I127-I131 HydrophobicContact CG2-CG1 4.26Å; I127-I131 WeakPolarHBondContact O-CB 3.47Å; I127-I131 WeakPolarHBondContact O-CG1 3.36Å; I127-I131 PolarHBondContact O-N 3.46Å; I131-T135 VanDerWaalsContact O-CB 3.27Å; I131-T135 WeakPolarHBondContact O-CB 3.45Å; I131-T135 PolarHBondContact O-N 3.18Å; I131-T135 PolarHBondContact O-OG1 2.9Å
132	C	93.7	Very high	93.7	Very high	19 Å²	19	29.6 Å²	29.6	13%	0.128	16%	0.155	C	C	.	.	H	α-helix	trans	-67.1	-45	-178.2	-65.8	0	0	0	0	111	I121 F122 A128 R130 Y136	I121-C132 WeakPolarHBondContact CD1-SG 3.12Å; F122-C132 HydrophobicContact CD1-CB 4.07Å; F122-C132 HydrophobicContact CE1-CB 3.7Å; A128-C132 WeakPolarHBondContact O-CB 3.47Å; A128-C132 PolarHBondContact O-N 2.95Å; A128-C132 PolarHBondContact O-SG 3.47Å; R130-C132 PolarHBondContact O-N 2.92Å; C132-Y136 WeakPolarHBondContact O-CB 3.38Å; C132-Y136 PolarHBondContact O-N 2.78Å
133	R	93.5	Very high	93.9	Very high	14 Å²	14	29.4 Å²	29.4	5%	0.053	15%	0.154	C	C	.	.	H	α-helix	trans	-65.8	-39.6	177.3	-71.1	-69.5	-161.2	-179.5	4.7	112.8	F122 C129 R130 Y136 S137 I194 C205 W206	F122-R133 HydrophobicContact CD1-CG 4.17Å; F122-R133 HydrophobicContact CE1-CG 3.96Å; C129-R133 WeakPolarHBondContact O-CB 3.39Å; C129-R133 VanDerWaalsContact O-CG 3.29Å; C129-R133 WeakPolarHBondContact O-CG 3.36Å; C129-R133 PolarHBondContact O-N 3.09Å; R130-R133 PolarHBondContact O-N 2.97Å; R133-Y136 WeakPolarHBondContact O-CB 3.41Å; R133-Y136 WeakPolarHBondContact O-CD1 3.35Å; R133-S137 WeakPolarHBondContact O-CB 3.25Å; R133-S137 PolarHBondContact O-N 3.27Å; R133-S137 PolarHBondContact O-OG 3.27Å; R133-I194 HydrophobicContact CB-CD1 3.49Å; R133-I194 VanDerWaalsContact CB-CD1 3.49Å; R133-I194 HydrophobicContact CB-CG2 4.14Å; R133-I194 HydrophobicContact CG-CD1 4.23Å; R133-I194 HydrophobicContact CG-CG2 4.14Å; R133-C205 PolarHBondContact NE-O 3.02Å; R133-C205 PolarHBondContact NH2-O 3.48Å; R133-C205 VanDerWaalsContact NH2-O 3.12Å; R133-W206 VanDerWaalsContact CZ-CZ3 3.48Å
134	F	94.8	Very high	94.1	Very high	34 Å²	34	28.6 Å²	28.6	15%	0.149	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-53.5	174.3	165.8	-103.8	0	0	0	111.5	R130 Y136 S137 L138 M187 L191	R130-F134 VanDerWaalsContact O-CB 3.24Å; R130-F134 WeakPolarHBondContact O-CB 3.47Å; R130-F134 PolarHBondContact O-N 2.98Å; F134-Y136 PolarHBondContact O-N 2.84Å; F134-S137 PolarHBondContact O-N 3.43Å; F134-L138 HydrophobicContact CE1-CD2 4.05Å; F134-L138 HydrophobicContact CZ-CD2 3.93Å; F134-L138 WeakPolarHBondContact O-CB 3.45Å; F134-L138 PolarHBondContact O-N 3.01Å; F134-M187 HydrophobicContact CD2-CB 4.31Å; F134-M187 WeakPolarHBondContact CD2-O 3.33Å; F134-M187 HydrophobicContact CE2-CB 4.01Å; F134-M187 WeakPolarHBondContact CE2-O 3.43Å; F134-L191 HydrophobicContact CB-CB 4.22Å; F134-L191 HydrophobicContact CB-CD1 3.93Å; F134-L191 HydrophobicContact CD1-CD1 4.07Å; F134-L191 HydrophobicContact CD2-CB 3.8Å; F134-L191 HydrophobicContact CE2-CB 4.35Å; F134-L191 HydrophobicContact CG-CB 3.95Å; F134-L191 HydrophobicContact CG-CD1 3.95Å; F134-L191 HydrophobicContact CG-CG 4.43Å
135	T	94.5	Very high	94.5	Very high	32 Å²	32	27.2 Å²	27.2	20%	0.196	14%	0.138	C	C	.	.	H	α-helix	trans	-64.9	-35.1	-176	-46.9	0	0	0	0	110.7	L93 L97 I131 S139	L93-T135 HydrophobicContact CD1-CG2 4.15Å; L93-T135 HydrophobicContact CD2-CG2 4.14Å; L93-T135 HydrophobicContact CG-CG2 4.43Å; L97-T135 HydrophobicContact CD1-CG2 3.57Å; I131-T135 VanDerWaalsContact O-CB 3.27Å; I131-T135 WeakPolarHBondContact O-CB 3.45Å; I131-T135 PolarHBondContact O-N 3.18Å; I131-T135 PolarHBondContact O-OG1 2.9Å; T135-S139 WeakPolarHBondContact O-CB 3.42Å; T135-S139 PolarHBondContact O-N 3.5Å; T135-S139 PolarHBondContact O-OG 3.2Å
136	Y	91.9	Very high	94.7	Very high	8 Å²	8	25.4 Å²	25.4	3%	0.031	13%	0.125	C	C	.	.	H	α-helix	trans	-51.5	-65.1	166.7	148	-135.9	0	0	0	109.6	F98 C132 R133 F134 L138 S139 T140 H218 N223 W320	F98-Y136 AromaticContact CD2-CD2 3.8Å; F98-Y136 HydrophobicContact CD2-CD2 3.8Å; F98-Y136 HydrophobicContact CD2-CE2 4.19Å; F98-Y136 HydrophobicContact CE1-CE2 4.29Å; F98-Y136 AromaticContact CE2-CD2 2.91Å; F98-Y136 HydrophobicContact CE2-CD2 2.91Å; F98-Y136 AromaticContact CE2-CE2 2.95Å; F98-Y136 HydrophobicContact CE2-CE2 2.95Å; F98-Y136 AromaticContact CE2-CG 3.9Å; F98-Y136 HydrophobicContact CE2-CG 3.9Å; F98-Y136 AromaticContact CE2-CZ 3.85Å; F98-Y136 AromaticContact CZ-CD2 3.39Å; F98-Y136 HydrophobicContact CZ-CD2 3.39Å; F98-Y136 HydrophobicContact CZ-CE1 4.22Å; F98-Y136 AromaticContact CZ-CE2 2.98Å; F98-Y136 HydrophobicContact CZ-CE2 2.98Å; F98-Y136 HydrophobicContact CZ-CG 4.2Å; F98-Y136 AromaticContact CZ-CZ 3.39Å; C132-Y136 WeakPolarHBondContact O-CB 3.38Å; C132-Y136 PolarHBondContact O-N 2.78Å; R133-Y136 WeakPolarHBondContact O-CB 3.41Å; R133-Y136 WeakPolarHBondContact O-CD1 3.35Å; F134-Y136 PolarHBondContact O-N 2.84Å; Y136-L138 PolarHBondContact O-N 3.27Å; Y136-S139 PolarHBondContact O-N 3.13Å; Y136-S139 PolarHBondContact O-OG 2.89Å; Y136-T140 HydrophobicContact CD2-CG2 3.99Å; Y136-T140 HydrophobicContact CE2-CG2 3.85Å; Y136-T140 PolarHBondContact O-N 3.26Å; Y136-T140 VanDerWaalsContact O-N 3.13Å; Y136-T140 PolarHBondContact O-OG1 3.04Å; Y136-H218 AromaticContact CE1-CE1 3.7Å; Y136-H218 AromaticContact CE1-NE2 3.8Å; Y136-H218 AromaticContact CZ-CE1 3.85Å; Y136-N223 PolarHBondContact OH-OD1 3.38Å; Y136-N223 VanDerWaalsContact OH-OD1 3.06Å; Y136-W320 HydrophobicContact CE2-CZ2 4.17Å
137	S	94.9	Very high	94.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-57.6	-39.7	-172.7	-57.3	0	0	0	0	111	R133 F134 T140 T141 H218	R133-S137 WeakPolarHBondContact O-CB 3.25Å; R133-S137 PolarHBondContact O-N 3.27Å; R133-S137 PolarHBondContact O-OG 3.27Å; F134-S137 PolarHBondContact O-N 3.43Å; S137-T140 PolarHBondContact O-OG1 2.84Å; S137-T140 VanDerWaalsContact O-OG1 3.12Å; S137-T141 VanDerWaalsContact O-CB 3.3Å; S137-T141 WeakPolarHBondContact O-CB 3.29Å; S137-T141 PolarHBondContact O-N 2.9Å; S137-T141 PolarHBondContact O-OG1 3.28Å; S137-H218 PolarHBondContact OG-NE2 3.15Å
138	L	96.3	Very high	95	Very high	23 Å²	23	17.7 Å²	17.7	12%	0.12	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-48.9	173.7	178.8	57.9	0	0	0	112.5	F134 Y136 T140 L142 M187	F134-L138 HydrophobicContact CE1-CD2 4.05Å; F134-L138 HydrophobicContact CZ-CD2 3.93Å; F134-L138 WeakPolarHBondContact O-CB 3.45Å; F134-L138 PolarHBondContact O-N 3.01Å; Y136-L138 PolarHBondContact O-N 3.27Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.42Å; L138-L142 WeakPolarHBondContact O-CB 3.36Å; L138-L142 PolarHBondContact O-N 3.38Å; L138-M187 HydrophobicContact CB-CB 4.47Å
139	S	95.8	Very high	95.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-61.4	-40.5	-177.5	74.1	0	0	0	0	112	S90 T94 T135 Y136 L142 T143	S90-S139 PolarHBondContact OG-O 2.99Å; T94-S139 WeakPolarHBondContact OG1-CB 3.49Å; T94-S139 PolarHBondContact OG1-OG 2.87Å; T135-S139 WeakPolarHBondContact O-CB 3.42Å; T135-S139 PolarHBondContact O-N 3.5Å; T135-S139 PolarHBondContact O-OG 3.2Å; Y136-S139 PolarHBondContact O-N 3.13Å; Y136-S139 PolarHBondContact O-OG 2.89Å; S139-L142 PolarHBondContact O-N 3.22Å; S139-T143 WeakPolarHBondContact O-CB 3.37Å; S139-T143 PolarHBondContact O-N 2.84Å; S139-T143 PolarHBondContact O-OG1 2.95Å
140	T	95.2	Very high	95.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-79.2	-38.2	-177.2	48.1	0	0	0	0	112.2	T94 F98 Y136 S137 L138 L142 T143 S144 A222 W320	T94-T140 HydrophobicContact CG2-CG2 3.72Å; F98-T140 HydrophobicContact CE2-CG2 3.86Å; Y136-T140 HydrophobicContact CD2-CG2 3.99Å; Y136-T140 HydrophobicContact CE2-CG2 3.85Å; Y136-T140 PolarHBondContact O-N 3.26Å; Y136-T140 VanDerWaalsContact O-N 3.13Å; Y136-T140 PolarHBondContact O-OG1 3.04Å; S137-T140 PolarHBondContact O-OG1 2.84Å; S137-T140 VanDerWaalsContact O-OG1 3.12Å; L138-T140 VanDerWaalsContact C-N 3.31Å; L138-T140 PolarHBondContact O-N 3.42Å; T140-L142 VanDerWaalsContact C-N 3.32Å; T140-T143 PolarHBondContact O-N 2.94Å; T140-S144 PolarHBondContact O-N 3.34Å; T140-S144 PolarHBondContact O-OG 2.86Å; T140-A222 WeakPolarHBondContact CB-O 3.42Å; T140-A222 PolarHBondContact OG1-O 3.33Å; T140-W320 HydrophobicContact CG2-CH2 3.53Å; T140-W320 HydrophobicContact CG2-CZ2 4.37Å; T140-W320 HydrophobicContact CG2-CZ3 4.29Å
141	T	96.5	Very high	95	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.4	-41.4	168.5	-64.3	0	0	0	0	111.5	S137 S144 N145 M186 M187 F221 A222	S137-T141 VanDerWaalsContact O-CB 3.3Å; S137-T141 WeakPolarHBondContact O-CB 3.29Å; S137-T141 PolarHBondContact O-N 2.9Å; S137-T141 PolarHBondContact O-OG1 3.28Å; T141-S144 PolarHBondContact O-N 2.9Å; T141-S144 PolarHBondContact O-OG 3.35Å; T141-N145 VanDerWaalsContact CG2-ND2 3.34Å; T141-N145 WeakPolarHBondContact CG2-ND2 3.45Å; T141-N145 WeakPolarHBondContact O-CB 3.23Å; T141-N145 PolarHBondContact O-N 2.88Å; T141-N145 PolarHBondContact O-ND2 2.85Å; T141-M186 HydrophobicContact CG2-CE 4.35Å; T141-M186 HydrophobicContact CG2-SD 4.28Å; T141-M187 HydrophobicContact CG2-CE 4.3Å; T141-M187 HydrophobicContact CG2-CG 4.38Å; T141-M187 WeakPolarHBondContact OG1-CE 3.08Å; T141-M187 PolarHBondContact OG1-SD 2.86Å; T141-F221 PolarHBondContact OG1-O 3.14Å; T141-A222 VanDerWaalsContact OG1-CA 3.29Å; T141-A222 WeakPolarHBondContact OG1-CA 3.38Å
142	L	96.9	Very high	95	Very high	23 Å²	23	15.1 Å²	15.1	12%	0.12	8%	0.082	C	C	.	.	H	α-helix	trans	-62.6	-46.1	176.9	178.7	60.5	0	0	0	110.9	S90 L138 S139 T140 L146 V179 L180	S90-L142 WeakPolarHBondContact OG-CG 3.36Å; L138-L142 WeakPolarHBondContact O-CB 3.36Å; L138-L142 PolarHBondContact O-N 3.38Å; S139-L142 PolarHBondContact O-N 3.22Å; T140-L142 VanDerWaalsContact C-N 3.32Å; L142-L146 HydrophobicContact CD1-CD1 3.9Å; L142-L146 HydrophobicContact CD1-CG 4.02Å; L142-L146 HydrophobicContact CG-CD1 3.89Å; L142-L146 HydrophobicContact CG-CG 4.42Å; L142-L146 VanDerWaalsContact O-CB 3.28Å; L142-L146 WeakPolarHBondContact O-CB 3.15Å; L142-L146 WeakPolarHBondContact O-CG 3.14Å; L142-L146 PolarHBondContact O-N 2.97Å; L142-V179 HydrophobicContact CD1-CG1 3.99Å; L142-L180 HydrophobicContact CD1-CB 4.35Å; L142-L180 HydrophobicContact CD1-CD1 4.16Å; L142-L180 HydrophobicContact CD2-CD1 3.83Å
143	T	95.6	Very high	94.9	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.018	8%	0.079	C	C	.	.	H	α-helix	trans	-56.8	-52.8	175.4	-65.4	0	0	0	0	111.2	L87 S90 N91 S139 T140 N145 L146 I147 Y277	L87-T143 HydrophobicContact CD1-CG2 3.69Å; S90-T143 VanDerWaalsContact CB-OG1 3.23Å; S90-T143 WeakPolarHBondContact CB-OG1 3.15Å; S90-T143 PolarHBondContact OG-N 3.08Å; S90-T143 PolarHBondContact OG-OG1 3.34Å; N91-T143 WeakPolarHBondContact OD1-CG2 3.41Å; S139-T143 WeakPolarHBondContact O-CB 3.37Å; S139-T143 PolarHBondContact O-N 2.84Å; S139-T143 PolarHBondContact O-OG1 2.95Å; T140-T143 PolarHBondContact O-N 2.94Å; T143-N145 PolarHBondContact O-N 3.25Å; T143-L146 PolarHBondContact O-N 2.74Å; T143-I147 HydrophobicContact CG2-CD1 4.07Å; T143-I147 VanDerWaalsContact O-CG1 3.29Å; T143-I147 WeakPolarHBondContact O-CG1 3.47Å; T143-I147 PolarHBondContact O-N 3.46Å; T143-Y277 HydrophobicContact CG2-CE2 3.88Å
144	S	95.8	Very high	94.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-64.8	-42	-177.5	68.6	0	0	0	0	112.3	T140 T141 I147 L148 Q228 Y277	T140-S144 PolarHBondContact O-N 3.34Å; T140-S144 PolarHBondContact O-OG 2.86Å; T141-S144 PolarHBondContact O-N 2.9Å; T141-S144 PolarHBondContact O-OG 3.35Å; S144-I147 PolarHBondContact O-N 2.88Å; S144-L148 WeakPolarHBondContact O-CB 3.38Å; S144-L148 PolarHBondContact O-N 3.37Å; S144-Q228 PolarHBondContact OG-NE2 3.18Å; S144-Y277 WeakPolarHBondContact CB-OH 3.37Å
145	N	97.1	Very high	94.4	Very high	19 Å²	19	13.1 Å²	13.1	10%	0.102	7%	0.073	C	C	.	.	H	α-helix	trans	-66.8	-39.4	177	-71.7	-17.5	0	0	0	112.1	T141 T143 L148 C149 V179 S183 Q228	T141-N145 VanDerWaalsContact CG2-ND2 3.34Å; T141-N145 WeakPolarHBondContact CG2-ND2 3.45Å; T141-N145 WeakPolarHBondContact O-CB 3.23Å; T141-N145 PolarHBondContact O-N 2.88Å; T141-N145 PolarHBondContact O-ND2 2.85Å; T143-N145 PolarHBondContact O-N 3.25Å; N145-L148 PolarHBondContact O-N 2.66Å; N145-C149 WeakPolarHBondContact O-CB 3.34Å; N145-C149 PolarHBondContact O-N 2.96Å; N145-C149 PolarHBondContact O-SG 3.42Å; N145-C149 VanDerWaalsContact O-SG 3.34Å; N145-V179 HydrophobicContact CB-CG1 3.63Å; N145-S183 PolarHBondContact ND2-OG 3.48Å; N145-Q228 WeakPolarHBondContact OD1-CG 3.44Å; N145-Q228 PolarHBondContact OD1-NE2 3.21Å
146	L	96.2	Very high	94.2	Very high	4 Å²	4	14.5 Å²	14.5	2%	0.021	8%	0.079	C	C	.	.	H	α-helix	trans	-64.2	-40.4	175.6	-76.9	171.9	0	0	0	111.9	C86 L87 L142 T143 S150 C176 V179	C86-L146 HydrophobicContact CB-CD1 4Å; C86-L146 HydrophobicContact CB-CD2 4.3Å; L87-L146 HydrophobicContact CD1-CB 4.25Å; L142-L146 HydrophobicContact CD1-CD1 3.9Å; L142-L146 HydrophobicContact CD1-CG 4.02Å; L142-L146 HydrophobicContact CG-CD1 3.89Å; L142-L146 HydrophobicContact CG-CG 4.42Å; L142-L146 VanDerWaalsContact O-CB 3.28Å; L142-L146 WeakPolarHBondContact O-CB 3.15Å; L142-L146 WeakPolarHBondContact O-CG 3.14Å; L142-L146 PolarHBondContact O-N 2.97Å; T143-L146 PolarHBondContact O-N 2.74Å; L146-S150 WeakPolarHBondContact O-CB 3.49Å; L146-S150 PolarHBondContact O-N 3.08Å; L146-C176 HydrophobicContact CD2-CB 4.48Å; L146-V179 HydrophobicContact CD2-CB 4.35Å; L146-V179 HydrophobicContact CD2-CG1 3.97Å; L146-V179 HydrophobicContact CG-CG1 4.02Å
147	I	95.1	Very high	93.8	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-64.2	-45.8	175.3	-67.1	169.6	0	0	0	110.3	L87 T143 S144 S150 A151 I232 F273 Y277	L87-I147 HydrophobicContact CD1-CD1 4.16Å; L87-I147 HydrophobicContact CD1-CG1 3.8Å; L87-I147 HydrophobicContact CD2-CD1 4.41Å; L87-I147 HydrophobicContact CD2-CG1 3.8Å; L87-I147 HydrophobicContact CG-CG1 4.48Å; T143-I147 HydrophobicContact CG2-CD1 4.07Å; T143-I147 VanDerWaalsContact O-CG1 3.29Å; T143-I147 WeakPolarHBondContact O-CG1 3.47Å; T143-I147 PolarHBondContact O-N 3.46Å; S144-I147 PolarHBondContact O-N 2.88Å; I147-S150 PolarHBondContact O-N 3.43Å; I147-A151 WeakPolarHBondContact O-CB 3.17Å; I147-A151 PolarHBondContact O-N 3.22Å; I147-I232 HydrophobicContact CB-CD1 4.15Å; I147-I232 HydrophobicContact CG2-CD1 3.64Å; I147-I232 HydrophobicContact CG2-CG1 4.27Å; I147-F273 HydrophobicContact CD1-CE1 3.88Å; I147-F273 HydrophobicContact CG1-CE1 4.01Å; I147-Y277 HydrophobicContact CD1-CD1 4.08Å; I147-Y277 HydrophobicContact CD1-CD2 3.24Å; I147-Y277 HydrophobicContact CD1-CE1 4.44Å; I147-Y277 HydrophobicContact CD1-CE2 3.66Å; I147-Y277 HydrophobicContact CD1-CG 3.49Å; I147-Y277 VanDerWaalsContact CD1-CG 3.49Å
148	L	96	Very high	93.3	Very high	25 Å²	25	15.7 Å²	15.7	13%	0.131	9%	0.087	C	C	.	.	H	α-helix	trans	-59.4	-48.7	177.1	175.4	58	0	0	0	111.4	S144 N145 S150 A151 I152 Q228 V231 I232 V235	S144-L148 WeakPolarHBondContact O-CB 3.38Å; S144-L148 PolarHBondContact O-N 3.37Å; N145-L148 PolarHBondContact O-N 2.66Å; L148-S150 VanDerWaalsContact C-N 3.33Å; L148-S150 PolarHBondContact O-N 2.86Å; L148-A151 WeakPolarHBondContact O-CB 3.43Å; L148-A151 PolarHBondContact O-N 2.85Å; L148-A151 VanDerWaalsContact O-N 3.13Å; L148-I152 HydrophobicContact CD1-CD1 3.9Å; L148-I152 HydrophobicContact CD1-CG1 4.18Å; L148-I152 HydrophobicContact CG-CD1 4Å; L148-I152 WeakPolarHBondContact O-CG1 3.48Å; L148-I152 PolarHBondContact O-N 2.91Å; L148-Q228 HydrophobicContact CD2-CG 4.42Å; L148-V231 HydrophobicContact CD1-CB 4.07Å; L148-V231 HydrophobicContact CD1-CG1 3.51Å; L148-V231 HydrophobicContact CD2-CG1 4.31Å; L148-I232 HydrophobicContact CB-CD1 4.28Å; L148-I232 HydrophobicContact CB-CG1 3.96Å; L148-I232 HydrophobicContact CD1-CG1 3.98Å; L148-V235 HydrophobicContact CD1-CG2 4.47Å
149	C	95	Very high	92.7	Very high	33 Å²	33	18.5 Å²	18.5	22%	0.223	10%	0.096	C	C	.	.	H	α-helix	trans	-61.5	-40.6	176.6	-72.8	0	0	0	0	112.3	N145 A151 I152 D153 I175 V179	N145-C149 WeakPolarHBondContact O-CB 3.34Å; N145-C149 PolarHBondContact O-N 2.96Å; N145-C149 PolarHBondContact O-SG 3.42Å; N145-C149 VanDerWaalsContact O-SG 3.34Å; C149-A151 VanDerWaalsContact C-N 3.34Å; C149-A151 PolarHBondContact O-N 3.31Å; C149-I152 PolarHBondContact O-N 3.02Å; C149-D153 WeakPolarHBondContact O-CB 3.33Å; C149-D153 PolarHBondContact O-N 2.91Å; C149-I175 HydrophobicContact CB-CG2 4.32Å; C149-V179 HydrophobicContact CB-CG2 4.28Å; C149-V179 WeakPolarHBondContact SG-CG2 3.37Å
150	S	92.8	Very high	92.2	Very high	9 Å²	9	23.1 Å²	23.1	6%	0.063	12%	0.117	C	C	.	.	H	α-helix	trans	-64.1	-38.1	174	178.1	0	0	0	0	112	Q80 L146 I147 L148 R154	Q80-S150 PolarHBondContact OE1-OG 2.96Å; L146-S150 WeakPolarHBondContact O-CB 3.49Å; L146-S150 PolarHBondContact O-N 3.08Å; I147-S150 PolarHBondContact O-N 3.43Å; L148-S150 VanDerWaalsContact C-N 3.33Å; L148-S150 PolarHBondContact O-N 2.86Å; S150-R154 WeakPolarHBondContact O-CB 3.5Å; S150-R154 VanDerWaalsContact O-CG 3.25Å; S150-R154 WeakPolarHBondContact O-CG 3.48Å; S150-R154 PolarHBondContact O-N 3.49Å; S150-R154 VanDerWaalsContact O-N 3.08Å; S150-R154 PolarHBondContact O-NE 2.89Å
151	A	94	Very high	91.3	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-64.8	-44.8	175	0	0	0	0	0	111.8	I147 L148 C149 R154 C155 V235	I147-A151 WeakPolarHBondContact O-CB 3.17Å; I147-A151 PolarHBondContact O-N 3.22Å; L148-A151 WeakPolarHBondContact O-CB 3.43Å; L148-A151 PolarHBondContact O-N 2.85Å; L148-A151 VanDerWaalsContact O-N 3.13Å; C149-A151 VanDerWaalsContact C-N 3.34Å; C149-A151 PolarHBondContact O-N 3.31Å; A151-R154 PolarHBondContact O-N 3.16Å; A151-C155 WeakPolarHBondContact O-CB 3.14Å; A151-C155 PolarHBondContact O-N 3.25Å; A151-V235 HydrophobicContact CB-CB 4.45Å; A151-V235 HydrophobicContact CB-CG1 3.8Å; A151-V235 WeakPolarHBondContact O-CG1 3.33Å
152	I	93.4	Very high	90.3	Very high	66 Å²	66	31.5 Å²	31.5	34%	0.338	17%	0.169	S	C	.	.	H	α-helix	trans	-63	-47.4	176.7	-67.1	168.5	0	0	0	110.6	L148 C149 R154 C155 L156 V235	L148-I152 HydrophobicContact CD1-CD1 3.9Å; L148-I152 HydrophobicContact CD1-CG1 4.18Å; L148-I152 HydrophobicContact CG-CD1 4Å; L148-I152 WeakPolarHBondContact O-CG1 3.48Å; L148-I152 PolarHBondContact O-N 2.91Å; C149-I152 PolarHBondContact O-N 3.02Å; I152-R154 VanDerWaalsContact C-N 3.3Å; I152-R154 PolarHBondContact O-N 3.42Å; I152-C155 WeakPolarHBondContact O-CB 3.46Å; I152-C155 PolarHBondContact O-N 3.46Å; I152-C155 VanDerWaalsContact O-N 3.14Å; I152-L156 HydrophobicContact CG2-CD1 3.67Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.42Å; I152-L156 WeakPolarHBondContact O-CG 3.3Å; I152-L156 PolarHBondContact O-N 3.45Å; I152-V235 HydrophobicContact CG1-CG1 4.34Å; I152-V235 HydrophobicContact CG1-CG2 4.1Å
153	D	90.7	Very high	89.3	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-58.9	-41.6	179.2	-177.6	69.9	0	0	0	111.9	R79 Q80 Y83 C149 S157	R79-D153 IonicContact CZ-OD1 3.3Å; R79-D153 VanDerWaalsContact CZ-OD1 3.22Å; R79-D153 IonicContact CZ-OD2 3.63Å; R79-D153 VanDerWaalsContact CZ-OD2 3.3Å; R79-D153 IonicContact NE-OD1 2.88Å; R79-D153 PolarHBondContact NE-OD1 3.03Å; R79-D153 IonicContact NE-OD2 3.11Å; R79-D153 PolarHBondContact NE-OD2 2.9Å; R79-D153 VanDerWaalsContact NH2-CG 3.33Å; R79-D153 IonicContact NH2-OD1 2.84Å; R79-D153 PolarHBondContact NH2-OD1 3Å; R79-D153 VanDerWaalsContact NH2-OD1 3.11Å; R79-D153 IonicContact NH2-OD2 3.22Å; R79-D153 PolarHBondContact NH2-OD2 3.39Å; Q80-D153 PolarHBondContact NE2-OD2 3.14Å; Y83-D153 HydrophobicContact CE2-CB 4.24Å; C149-D153 WeakPolarHBondContact O-CB 3.33Å; C149-D153 PolarHBondContact O-N 2.91Å; D153-S157 WeakPolarHBondContact O-CB 3.23Å; D153-S157 PolarHBondContact O-N 3.43Å; D153-S157 PolarHBondContact O-OG 2.7Å
154	R	88.8	Confident	88.3	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-44.5	174.4	-72.7	-178.4	-63.1	137.2	-2.7	112.4	S150 A151 I152 S157 I158 F239 S267 L270 S274	S150-R154 WeakPolarHBondContact O-CB 3.5Å; S150-R154 VanDerWaalsContact O-CG 3.25Å; S150-R154 WeakPolarHBondContact O-CG 3.48Å; S150-R154 PolarHBondContact O-N 3.49Å; S150-R154 VanDerWaalsContact O-N 3.08Å; S150-R154 PolarHBondContact O-NE 2.89Å; A151-R154 PolarHBondContact O-N 3.16Å; I152-R154 VanDerWaalsContact C-N 3.3Å; I152-R154 PolarHBondContact O-N 3.42Å; R154-S157 PolarHBondContact O-N 2.91Å; R154-I158 PolarHBondContact O-N 3.4Å; R154-F239 HydrophobicContact CB-CD2 4.41Å; R154-F239 HydrophobicContact CB-CE2 4.26Å; R154-S267 PolarHBondContact NH1-O 3.25Å; R154-S267 VanDerWaalsContact NH1-O 3.09Å; R154-L270 HydrophobicContact CG-CD1 4.46Å; R154-L270 PolarHBondContact NH2-O 3.33Å; R154-S274 PolarHBondContact NH2-OG 3.32Å
155	C	90	Very high	87.1	Confident	13 Å²	13	46.2 Å²	46.2	9%	0.088	24%	0.238	C	C	.	.	H	α-helix	trans	-59.2	-52.4	177.4	-168.8	0	0	0	0	110.7	A151 I152 S157 I158 Y159 V235 F239	A151-C155 WeakPolarHBondContact O-CB 3.14Å; A151-C155 PolarHBondContact O-N 3.25Å; I152-C155 WeakPolarHBondContact O-CB 3.46Å; I152-C155 PolarHBondContact O-N 3.46Å; I152-C155 VanDerWaalsContact O-N 3.14Å; C155-S157 VanDerWaalsContact C-N 3.28Å; C155-S157 PolarHBondContact O-N 2.91Å; C155-I158 PolarHBondContact O-N 3.24Å; C155-Y159 WeakPolarHBondContact O-CD2 3.42Å; C155-Y159 PolarHBondContact O-N 2.98Å; C155-Y159 VanDerWaalsContact O-N 3.09Å; C155-V235 HydrophobicContact CB-CG1 3.91Å; C155-F239 HydrophobicContact CB-CB 4.5Å
156	L	89.2	Confident	85.8	Confident	61 Å²	61	52.7 Å²	52.7	32%	0.319	27%	0.267	S	S	.	.	H	α-helix	trans	-62.6	-33.7	179.5	-65.9	175.4	0	0	0	113	I152 I158 Y159 F160 F164	I152-L156 HydrophobicContact CG2-CD1 3.67Å; I152-L156 HydrophobicContact CG2-CG 4.12Å; I152-L156 WeakPolarHBondContact O-CB 3.42Å; I152-L156 WeakPolarHBondContact O-CG 3.3Å; I152-L156 PolarHBondContact O-N 3.45Å; L156-I158 PolarHBondContact O-N 3.34Å; L156-Y159 PolarHBondContact O-N 3.11Å; L156-F160 HydrophobicContact CD2-CD2 4.37Å; L156-F160 HydrophobicContact CD2-CE2 4.4Å; L156-F160 PolarHBondContact O-N 2.95Å; L156-F164 HydrophobicContact CB-CD1 4.27Å; L156-F164 HydrophobicContact CB-CD2 4.26Å; L156-F164 HydrophobicContact CB-CE1 3.71Å; L156-F164 HydrophobicContact CB-CE2 3.68Å; L156-F164 HydrophobicContact CB-CZ 3.41Å; L156-F164 VanDerWaalsContact CB-CZ 3.41Å; L156-F164 HydrophobicContact CD1-CE1 4.19Å; L156-F164 HydrophobicContact CD1-CE2 4.37Å; L156-F164 HydrophobicContact CD1-CZ 3.6Å; L156-F164 HydrophobicContact CG-CZ 4.09Å
157	S	85.2	Confident	84.9	Confident	11 Å²	11	55.1 Å²	55.1	8%	0.077	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-28.4	175.7	-60.8	0	0	0	0	113.5	R79 D153 R154 C155 P161	R79-S157 PolarHBondContact NH2-OG 3.31Å; D153-S157 WeakPolarHBondContact O-CB 3.23Å; D153-S157 PolarHBondContact O-N 3.43Å; D153-S157 PolarHBondContact O-OG 2.7Å; R154-S157 PolarHBondContact O-N 2.91Å; C155-S157 VanDerWaalsContact C-N 3.28Å; C155-S157 PolarHBondContact O-N 2.91Å; S157-P161 WeakPolarHBondContact O-CA 3.31Å
158	I	83.6	Confident	84.2	Confident	22 Å²	22	57.5 Å²	57.5	11%	0.113	30%	0.297	C	S	.	.	H	α-helix	trans	-81.4	-41.2	173.8	-71.1	-162.4	0	0	0	111.3	R154 C155 L156 F239 R242 F243	R154-I158 PolarHBondContact O-N 3.4Å; C155-I158 PolarHBondContact O-N 3.24Å; L156-I158 PolarHBondContact O-N 3.34Å; I158-F239 HydrophobicContact CD1-CD2 3.64Å; I158-F239 HydrophobicContact CD1-CE2 3.07Å; I158-F239 HydrophobicContact CD1-CZ 3.58Å; I158-F239 HydrophobicContact CG1-CD2 4.25Å; I158-F239 HydrophobicContact CG1-CE2 3.81Å; I158-R242 HydrophobicContact CG2-CB 4.05Å; I158-F243 HydrophobicContact CD1-CB 4.22Å; I158-F243 HydrophobicContact CD1-CD2 3.91Å
159	Y	83.9	Confident	83.6	Confident	82 Å²	82	59.8 Å²	59.8	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-68.8	-39	-179.7	-88.5	-99	0	0	0	112.9	C155 L156 T238 R242	C155-Y159 WeakPolarHBondContact O-CD2 3.42Å; C155-Y159 PolarHBondContact O-N 2.98Å; C155-Y159 VanDerWaalsContact O-N 3.09Å; L156-Y159 PolarHBondContact O-N 3.11Å; Y159-T238 HydrophobicContact CE2-CG2 3.79Å; Y159-T238 WeakPolarHBondContact OH-CG2 3.4Å; Y159-R242 HydrophobicContact CD2-CG 4.08Å; Y159-R242 HydrophobicContact CE1-CG 3.88Å; Y159-R242 HydrophobicContact CE2-CB 4.08Å; Y159-R242 HydrophobicContact CE2-CG 3.31Å; Y159-R242 WeakPolarHBondContact OH-CG 3.21Å; Y159-R242 PolarHBondContact OH-NE 3.05Å
160	F	84.3	Confident	83.3	Confident	98 Å²	98	67 Å²	67	43%	0.43	33%	0.332	S	S	.	.			trans	-131.3	63.3	-174	-55.6	-70.7	0	0	0	111.5	L156 V162 K163 F164	L156-F160 HydrophobicContact CD2-CD2 4.37Å; L156-F160 HydrophobicContact CD2-CE2 4.4Å; L156-F160 PolarHBondContact O-N 2.95Å; F160-V162 VanDerWaalsContact C-N 3.27Å; F160-V162 PolarHBondContact O-N 2.88Å; F160-K163 HydrophobicContact CB-CB 4.21Å; F160-K163 PolarHBondContact O-N 3.23Å; F160-F164 HydrophobicContact CB-CD2 4.07Å; F160-F164 PolarHBondContact O-N 3.35Å
161	P	77.5	Confident	83.2	Confident	69 Å²	69	70.3 Å²	70.3	45%	0.448	35%	0.346	S	S	.	.	H	α-helix	trans	-58.3	-39.4	-173.9	23.6	-33.8	0	0	0	112.1	S157 F164 L165	S157-P161 WeakPolarHBondContact O-CA 3.31Å; P161-F164 PolarHBondContact O-N 2.95Å; P161-L165 WeakPolarHBondContact O-CB 3.33Å; P161-L165 PolarHBondContact O-N 3.15Å
162	V	74.5	Confident	83.1	Confident	108 Å²	108	70.2 Å²	70.2	66%	0.655	35%	0.346	S	S	*	.	H	α-helix	trans	-64.5	-45.4	-179.8	-176.8	0	0	0	0	111.7	F160 H166	F160-V162 VanDerWaalsContact C-N 3.27Å; F160-V162 PolarHBondContact O-N 2.88Å; V162-H166 PolarHBondContact O-CD2 3.02Å; V162-H166 VanDerWaalsContact O-CD2 3.28Å
163	K	76.6	Confident	83.1	Confident	154 Å²	154	72.9 Å²	72.9	67%	0.67	35%	0.352	S	S	*	.	H	α-helix	trans	-69.4	-39.7	179.6	-66.9	-175.1	177.4	-178	0	111.7	F160	F160-K163 HydrophobicContact CB-CB 4.21Å; F160-K163 PolarHBondContact O-N 3.23Å
164	F	75.3	Confident	83.3	Confident	41 Å²	41	79.2 Å²	79.2	18%	0.18	38%	0.376	C	S	.	.	H	α-helix	trans	-82.6	-14.7	-176.4	-86.1	-104.4	0	0	0	114.2	R79 L156 F160 P161 H166 L167	R79-F164 PolarHBondContact NH1-O 3.25Å; R79-F164 VanDerWaalsContact NH1-O 3.16Å; L156-F164 HydrophobicContact CB-CD1 4.27Å; L156-F164 HydrophobicContact CB-CD2 4.26Å; L156-F164 HydrophobicContact CB-CE1 3.71Å; L156-F164 HydrophobicContact CB-CE2 3.68Å; L156-F164 HydrophobicContact CB-CZ 3.41Å; L156-F164 VanDerWaalsContact CB-CZ 3.41Å; L156-F164 HydrophobicContact CD1-CE1 4.19Å; L156-F164 HydrophobicContact CD1-CE2 4.37Å; L156-F164 HydrophobicContact CD1-CZ 3.6Å; L156-F164 HydrophobicContact CG-CZ 4.09Å; F160-F164 HydrophobicContact CB-CD2 4.07Å; F160-F164 PolarHBondContact O-N 3.35Å; P161-F164 PolarHBondContact O-N 2.95Å; F164-H166 VanDerWaalsContact C-N 3.3Å; F164-L167 HydrophobicContact CB-CD1 4.33Å; F164-L167 HydrophobicContact CD1-CD1 3.28Å; F164-L167 HydrophobicContact CD2-CD1 4.39Å; F164-L167 HydrophobicContact CE1-CD1 3.41Å; F164-L167 VanDerWaalsContact CE1-CD1 3.41Å; F164-L167 HydrophobicContact CE2-CD1 4.49Å; F164-L167 HydrophobicContact CG-CD1 3.79Å; F164-L167 HydrophobicContact CZ-CD1 4.02Å; F164-L167 PolarHBondContact O-N 3.33Å
165	L	69.5	Low	83.6	Confident	140 Å²	140	81.8 Å²	81.8	73%	0.733	39%	0.389	S	S	*	.	H	α-helix	trans	-64.7	-35.2	172.4	-174.9	68.9	0	0	0	112	P161	P161-L165 WeakPolarHBondContact O-CB 3.33Å; P161-L165 PolarHBondContact O-N 3.15Å
166	H	70.1	Confident	83.9	Confident	154 Å²	154	81.6 Å²	81.6	71%	0.713	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-8.7	-178.3	-67.2	-64.7	0	0	0	114.2	V162 F164 S168	V162-H166 PolarHBondContact O-CD2 3.02Å; V162-H166 VanDerWaalsContact O-CD2 3.28Å; F164-H166 VanDerWaalsContact C-N 3.3Å; H166-S168 PolarHBondContact O-N 3.41Å; H166-S168 VanDerWaalsContact O-N 3.12Å
167	L	76.8	Confident	84.3	Confident	56 Å²	56	83.2 Å²	83.2	29%	0.293	40%	0.396	S	S	.	.			trans	-69.3	113.3	178.9	-73	173.8	0	0	0	110.3	F164	F164-L167 HydrophobicContact CB-CD1 4.33Å; F164-L167 HydrophobicContact CD1-CD1 3.28Å; F164-L167 HydrophobicContact CD2-CD1 4.39Å; F164-L167 HydrophobicContact CE1-CD1 3.41Å; F164-L167 VanDerWaalsContact CE1-CD1 3.41Å; F164-L167 HydrophobicContact CE2-CD1 4.49Å; F164-L167 HydrophobicContact CG-CD1 3.79Å; F164-L167 HydrophobicContact CZ-CD1 4.02Å; F164-L167 PolarHBondContact O-N 3.33Å
168	S	81.1	Confident	84.9	Confident	54 Å²	54	87 Å²	87	38%	0.378	42%	0.415	S	S	.	.			trans	-64.6	154.3	177.1	77.3	0	0	0	0	111.8	H166 R170 H171	H166-S168 PolarHBondContact O-N 3.41Å; H166-S168 VanDerWaalsContact O-N 3.12Å; S168-R170 PolarHBondContact O-N 2.8Å; S168-R170 VanDerWaalsContact O-N 3.07Å; S168-H171 PolarHBondContact N-ND1 2.95Å; S168-H171 WeakPolarHBondContact O-CB 3.45Å; S168-H171 PolarHBondContact O-N 3.4Å; S168-H171 PolarHBondContact O-ND1 2.98Å; S168-H171 VanDerWaalsContact O-ND1 3.08Å; S168-H171 PolarHBondContact OG-CE1 3.43Å; S168-H171 VanDerWaalsContact OG-CE1 3.31Å; S168-H171 PolarHBondContact OG-ND1 2.97Å
169	N	83.8	Confident	85.5	Confident	73 Å²	73	86.4 Å²	86.4	39%	0.39	41%	0.412	S	S	.	.	H	α-helix	trans	-58.9	-21.2	176.2	-64.3	-26.8	0	0	0	113.3	I77 R79 I82 H171 A172	I77-N169 VanDerWaalsContact O-CG 3.25Å; I77-N169 PolarHBondContact O-ND2 3.5Å; R79-N169 PolarHBondContact N-OD1 2.9Å; I82-N169 HydrophobicContact CD1-CB 4.2Å; I82-N169 WeakPolarHBondContact CD1-O 3.27Å; N169-H171 PolarHBondContact O-N 3.48Å; N169-A172 PolarHBondContact O-N 3.24Å
170	R	88.6	Confident	86.1	Confident	183 Å²	183	85.9 Å²	85.9	69%	0.691	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-31.9	175.3	-65.9	-175.6	179.7	174.5	-0.3	112.1	S168 A172 W173 Y174	S168-R170 PolarHBondContact O-N 2.8Å; S168-R170 VanDerWaalsContact O-N 3.07Å; R170-A172 VanDerWaalsContact C-N 3.31Å; R170-A172 PolarHBondContact O-N 3.48Å; R170-W173 WeakPolarHBondContact O-CB 3.46Å; R170-W173 PolarHBondContact O-N 2.84Å; R170-W173 VanDerWaalsContact O-N 3.16Å; R170-Y174 HydrophobicContact CB-CE2 4.15Å; R170-Y174 WeakPolarHBondContact O-CD2 3.44Å; R170-Y174 PolarHBondContact O-N 3.35Å; R170-Y174 VanDerWaalsContact O-N 3.15Å
171	H	89.8	Confident	86.8	Confident	79 Å²	79	85.3 Å²	85.3	37%	0.366	42%	0.415	S	S	.	.	H	α-helix	trans	-62	-36.8	177.9	-64.2	90.9	0	0	0	112.6	S168 N169 W173 Y174 I175	S168-H171 PolarHBondContact N-ND1 2.95Å; S168-H171 WeakPolarHBondContact O-CB 3.45Å; S168-H171 PolarHBondContact O-N 3.4Å; S168-H171 PolarHBondContact O-ND1 2.98Å; S168-H171 VanDerWaalsContact O-ND1 3.08Å; S168-H171 PolarHBondContact OG-CE1 3.43Å; S168-H171 VanDerWaalsContact OG-CE1 3.31Å; S168-H171 PolarHBondContact OG-ND1 2.97Å; N169-H171 PolarHBondContact O-N 3.48Å; H171-W173 VanDerWaalsContact C-N 3.31Å; H171-W173 PolarHBondContact O-N 3.38Å; H171-Y174 PolarHBondContact O-N 2.78Å; H171-I175 VanDerWaalsContact O-CG1 3.28Å; H171-I175 WeakPolarHBondContact O-CG1 3.33Å; H171-I175 PolarHBondContact O-N 3.17Å
172	A	91.4	Very high	87.7	Confident	0 Å²	0	86 Å²	86	0%	0	41%	0.414	C	S	.	.	H	α-helix	trans	-65.2	-35.8	176.4	0	0	0	0	0	112.5	R79 I82 Y83 N169 R170 I175 C176	R79-A172 HydrophobicContact CG-CB 3.47Å; R79-A172 VanDerWaalsContact CG-CB 3.47Å; I82-A172 HydrophobicContact CB-CB 4.05Å; I82-A172 HydrophobicContact CD1-CB 3.84Å; I82-A172 HydrophobicContact CG2-CB 4.1Å; Y83-A172 HydrophobicContact CE2-CB 4.15Å; N169-A172 PolarHBondContact O-N 3.24Å; R170-A172 VanDerWaalsContact C-N 3.31Å; R170-A172 PolarHBondContact O-N 3.48Å; A172-I175 PolarHBondContact O-N 3.25Å; A172-C176 WeakPolarHBondContact O-CB 3.37Å; A172-C176 PolarHBondContact O-N 3.4Å; A172-C176 PolarHBondContact O-SG 3.39Å
173	W	94	Very high	88.8	Confident	122 Å²	122	80.9 Å²	80.9	46%	0.462	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-44.9	173.9	-79.9	110.5	0	0	0	111.9	F71 I82 R170 H171 I175 C176 L177	F71-W173 AromaticContact CD1-CH2 3.88Å; F71-W173 HydrophobicContact CD1-CH2 3.88Å; F71-W173 AromaticContact CD1-CZ2 3.81Å; F71-W173 HydrophobicContact CD1-CZ2 3.81Å; F71-W173 AromaticContact CE1-CH2 3.3Å; F71-W173 HydrophobicContact CE1-CH2 3.3Å; F71-W173 AromaticContact CE1-CZ2 3.43Å; F71-W173 HydrophobicContact CE1-CZ2 3.43Å; F71-W173 VanDerWaalsContact CE1-CZ2 3.43Å; F71-W173 HydrophobicContact CE1-CZ3 4.42Å; F71-W173 AromaticContact CZ-CH2 3.9Å; F71-W173 HydrophobicContact CZ-CH2 3.9Å; F71-W173 HydrophobicContact CZ-CZ2 4.42Å; I82-W173 HydrophobicContact CG2-CD2 3.94Å; I82-W173 HydrophobicContact CG2-CE3 4.31Å; I82-W173 HydrophobicContact CG2-CG 4.28Å; I82-W173 HydrophobicContact CG2-CZ2 4.34Å; R170-W173 WeakPolarHBondContact O-CB 3.46Å; R170-W173 PolarHBondContact O-N 2.84Å; R170-W173 VanDerWaalsContact O-N 3.16Å; H171-W173 VanDerWaalsContact C-N 3.31Å; H171-W173 PolarHBondContact O-N 3.38Å; W173-I175 VanDerWaalsContact C-N 3.34Å; W173-I175 PolarHBondContact O-N 2.87Å; W173-C176 PolarHBondContact O-N 2.86Å; W173-L177 WeakPolarHBondContact O-CB 3.29Å; W173-L177 PolarHBondContact O-N 3.41Å
174	Y	95.2	Very high	89.8	Confident	142 Å²	142	75.5 Å²	75.5	56%	0.557	36%	0.364	S	S	*	.	H	α-helix	trans	-61.5	-42.5	174.9	-64.5	-52.7	0	0	0	111.9	R170 H171 L177 I178	R170-Y174 HydrophobicContact CB-CE2 4.15Å; R170-Y174 WeakPolarHBondContact O-CD2 3.44Å; R170-Y174 PolarHBondContact O-N 3.35Å; R170-Y174 VanDerWaalsContact O-N 3.15Å; H171-Y174 PolarHBondContact O-N 2.78Å; Y174-L177 PolarHBondContact O-N 2.92Å; Y174-I178 WeakPolarHBondContact O-CB 3.49Å; Y174-I178 VanDerWaalsContact O-CG1 3.23Å; Y174-I178 WeakPolarHBondContact O-CG1 3.48Å; Y174-I178 PolarHBondContact O-N 3.09Å
175	I	95.1	Very high	90.8	Very high	56 Å²	56	78.8 Å²	78.8	29%	0.287	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-45.4	176.2	-67.2	165.1	0	0	0	110.6	Y83 C149 H171 A172 W173 L177 I178 V179	Y83-I175 HydrophobicContact CE1-CB 4.34Å; Y83-I175 HydrophobicContact CE1-CG2 3.83Å; Y83-I175 WeakPolarHBondContact OH-CD1 3.46Å; C149-I175 HydrophobicContact CB-CG2 4.32Å; H171-I175 VanDerWaalsContact O-CG1 3.28Å; H171-I175 WeakPolarHBondContact O-CG1 3.33Å; H171-I175 PolarHBondContact O-N 3.17Å; A172-I175 PolarHBondContact O-N 3.25Å; W173-I175 VanDerWaalsContact C-N 3.34Å; W173-I175 PolarHBondContact O-N 2.87Å; I175-L177 VanDerWaalsContact C-N 3.32Å; I175-L177 PolarHBondContact O-N 2.91Å; I175-I178 PolarHBondContact O-N 3.48Å; I175-V179 HydrophobicContact CG2-CG2 4.24Å; I175-V179 WeakPolarHBondContact O-CB 3.25Å; I175-V179 WeakPolarHBondContact O-CG2 3.39Å; I175-V179 PolarHBondContact O-N 2.96Å
176	C	96.4	Very high	92	Very high	9 Å²	9	73.9 Å²	73.9	6%	0.061	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-40.9	177.4	-67.3	0	0	0	0	112	C86 L146 A172 W173 V179 L180	C86-C176 VanDerWaalsContact SG-SG 3.65Å; L146-C176 HydrophobicContact CD2-CB 4.48Å; A172-C176 WeakPolarHBondContact O-CB 3.37Å; A172-C176 PolarHBondContact O-N 3.4Å; A172-C176 PolarHBondContact O-SG 3.39Å; W173-C176 PolarHBondContact O-N 2.86Å; C176-V179 PolarHBondContact O-N 3.41Å; C176-L180 WeakPolarHBondContact O-CB 3.3Å; C176-L180 PolarHBondContact O-N 3.47Å
177	L	96.9	Very high	93.3	Very high	94 Å²	94	66.6 Å²	66.6	49%	0.492	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-44.5	176.3	-179.1	62.9	0	0	0	111.8	W173 Y174 I175 V179 L180 I181	W173-L177 WeakPolarHBondContact O-CB 3.29Å; W173-L177 PolarHBondContact O-N 3.41Å; Y174-L177 PolarHBondContact O-N 2.92Å; I175-L177 VanDerWaalsContact C-N 3.32Å; I175-L177 PolarHBondContact O-N 2.91Å; L177-V179 VanDerWaalsContact C-N 3.33Å; L177-V179 PolarHBondContact O-N 2.73Å; L177-L180 WeakPolarHBondContact O-CB 3.47Å; L177-L180 PolarHBondContact O-N 3.48Å; L177-I181 HydrophobicContact CD1-CD1 4.3Å; L177-I181 HydrophobicContact CG-CD1 4.06Å; L177-I181 WeakPolarHBondContact O-CG1 3.27Å; L177-I181 PolarHBondContact O-N 3.35Å
178	I	97.7	Very high	94.1	Very high	92 Å²	92	66.5 Å²	66.5	47%	0.472	33%	0.327	S	S	.	.	H	α-helix	trans	-60.4	-45.1	175.7	-71	164.9	0	0	0	110.3	Y174 I175 L180 I181 I182	Y174-I178 WeakPolarHBondContact O-CB 3.49Å; Y174-I178 VanDerWaalsContact O-CG1 3.23Å; Y174-I178 WeakPolarHBondContact O-CG1 3.48Å; Y174-I178 PolarHBondContact O-N 3.09Å; I175-I178 PolarHBondContact O-N 3.48Å; I178-L180 VanDerWaalsContact C-N 3.32Å; I178-L180 PolarHBondContact O-N 3.49Å; I178-I181 PolarHBondContact O-N 3.38Å; I178-I182 HydrophobicContact CG2-CD1 3.6Å; I178-I182 HydrophobicContact CG2-CG1 4.25Å; I178-I182 WeakPolarHBondContact O-CB 3.48Å; I178-I182 VanDerWaalsContact O-CG1 3.32Å; I178-I182 WeakPolarHBondContact O-CG1 3.37Å; I178-I182 PolarHBondContact O-N 2.93Å
179	V	97.4	Very high	94.7	Very high	8 Å²	8	66 Å²	66	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-61.5	-40.9	177.3	170.2	0	0	0	0	111.3	L142 N145 L146 C149 I175 C176 L177 S183	L142-V179 HydrophobicContact CD1-CG1 3.99Å; N145-V179 HydrophobicContact CB-CG1 3.63Å; L146-V179 HydrophobicContact CD2-CB 4.35Å; L146-V179 HydrophobicContact CD2-CG1 3.97Å; L146-V179 HydrophobicContact CG-CG1 4.02Å; C149-V179 HydrophobicContact CB-CG2 4.28Å; C149-V179 WeakPolarHBondContact SG-CG2 3.37Å; I175-V179 HydrophobicContact CG2-CG2 4.24Å; I175-V179 WeakPolarHBondContact O-CB 3.25Å; I175-V179 WeakPolarHBondContact O-CG2 3.39Å; I175-V179 PolarHBondContact O-N 2.96Å; C176-V179 PolarHBondContact O-N 3.41Å; L177-V179 VanDerWaalsContact C-N 3.33Å; L177-V179 PolarHBondContact O-N 2.73Å; V179-S183 VanDerWaalsContact O-CB 3.26Å; V179-S183 WeakPolarHBondContact O-CB 3.42Å; V179-S183 PolarHBondContact O-N 3.43Å; V179-S183 PolarHBondContact O-OG 3.47Å
180	L	97.1	Very high	95.2	Very high	72 Å²	72	62.6 Å²	62.6	38%	0.377	30%	0.304	S	S	.	.	H	α-helix	trans	-61.4	-46.3	175	178.4	64.9	0	0	0	111.8	L142 C176 L177 I178 S183 S184	L142-L180 HydrophobicContact CD1-CB 4.35Å; L142-L180 HydrophobicContact CD1-CD1 4.16Å; L142-L180 HydrophobicContact CD2-CD1 3.83Å; C176-L180 WeakPolarHBondContact O-CB 3.3Å; C176-L180 PolarHBondContact O-N 3.47Å; L177-L180 WeakPolarHBondContact O-CB 3.47Å; L177-L180 PolarHBondContact O-N 3.48Å; I178-L180 VanDerWaalsContact C-N 3.32Å; I178-L180 PolarHBondContact O-N 3.49Å; L180-S183 PolarHBondContact O-N 3.5Å; L180-S184 WeakPolarHBondContact O-CB 3.42Å; L180-S184 PolarHBondContact O-N 2.86Å; L180-S184 PolarHBondContact O-OG 2.93Å
181	I	97.9	Very high	95.4	Very high	86 Å²	86	57.4 Å²	57.4	44%	0.441	29%	0.29	S	S	.	.	H	α-helix	trans	-62.8	-49.6	178.3	-67.9	166.1	0	0	0	110.4	L177 I178 S183 S184 I185	L177-I181 HydrophobicContact CD1-CD1 4.3Å; L177-I181 HydrophobicContact CG-CD1 4.06Å; L177-I181 WeakPolarHBondContact O-CG1 3.27Å; L177-I181 PolarHBondContact O-N 3.35Å; I178-I181 PolarHBondContact O-N 3.38Å; I181-S183 VanDerWaalsContact C-N 3.35Å; I181-S183 PolarHBondContact O-N 3.29Å; I181-S184 WeakPolarHBondContact O-CB 3.3Å; I181-S184 PolarHBondContact O-N 3.41Å; I181-I185 HydrophobicContact CG2-CD1 3.8Å; I181-I185 HydrophobicContact CG2-CG1 4.47Å; I181-I185 WeakPolarHBondContact O-CG1 3.47Å; I181-I185 PolarHBondContact O-N 3.34Å
182	I	97.4	Very high	95.5	Very high	83 Å²	83	59.9 Å²	59.9	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-59.6	-46.2	178.8	-69.6	172.4	0	0	0	110.6	I178 S184 I185 M186	I178-I182 HydrophobicContact CG2-CD1 3.6Å; I178-I182 HydrophobicContact CG2-CG1 4.25Å; I178-I182 WeakPolarHBondContact O-CB 3.48Å; I178-I182 VanDerWaalsContact O-CG1 3.32Å; I178-I182 WeakPolarHBondContact O-CG1 3.37Å; I178-I182 PolarHBondContact O-N 2.93Å; I182-S184 VanDerWaalsContact C-N 3.28Å; I182-S184 PolarHBondContact O-N 3.36Å; I182-I185 PolarHBondContact O-N 3.13Å; I182-M186 HydrophobicContact CG2-CG 4.22Å; I182-M186 HydrophobicContact CG2-SD 3.82Å; I182-M186 WeakPolarHBondContact O-CB 3.39Å; I182-M186 VanDerWaalsContact O-CG 3.25Å; I182-M186 WeakPolarHBondContact O-CG 3.3Å; I182-M186 PolarHBondContact O-N 2.9Å
183	S	97.4	Very high	95.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-38.1	178.9	-54.1	0	0	0	0	111.6	N145 V179 L180 I181 M187	N145-S183 PolarHBondContact ND2-OG 3.48Å; V179-S183 VanDerWaalsContact O-CB 3.26Å; V179-S183 WeakPolarHBondContact O-CB 3.42Å; V179-S183 PolarHBondContact O-N 3.43Å; V179-S183 PolarHBondContact O-OG 3.47Å; L180-S183 PolarHBondContact O-N 3.5Å; I181-S183 VanDerWaalsContact C-N 3.35Å; I181-S183 PolarHBondContact O-N 3.29Å; S183-M187 WeakPolarHBondContact O-CB 3.36Å; S183-M187 WeakPolarHBondContact O-CG 3.14Å; S183-M187 PolarHBondContact O-N 2.87Å; S183-M187 VanDerWaalsContact O-N 3.08Å
184	S	96.6	Very high	95.7	Very high	41 Å²	41	56.3 Å²	56.3	29%	0.287	30%	0.296	S	S	.	.	H	α-helix	trans	-65.9	-42.5	175.8	-55.9	0	0	0	0	112	L180 I181 I182 M187 S188	L180-S184 WeakPolarHBondContact O-CB 3.42Å; L180-S184 PolarHBondContact O-N 2.86Å; L180-S184 PolarHBondContact O-OG 2.93Å; I181-S184 WeakPolarHBondContact O-CB 3.3Å; I181-S184 PolarHBondContact O-N 3.41Å; I182-S184 VanDerWaalsContact C-N 3.28Å; I182-S184 PolarHBondContact O-N 3.36Å; S184-M187 PolarHBondContact O-N 3.12Å; S184-S188 WeakPolarHBondContact O-CB 3.38Å; S184-S188 PolarHBondContact O-N 3.45Å
185	I	96.6	Very high	95.6	Very high	111 Å²	111	51 Å²	51	57%	0.569	28%	0.277	S	S	*	.	H	α-helix	trans	-64	-48.9	176.1	-68	167.6	0	0	0	110.3	I181 I182 M187 S188	I181-I185 HydrophobicContact CG2-CD1 3.8Å; I181-I185 HydrophobicContact CG2-CG1 4.47Å; I181-I185 WeakPolarHBondContact O-CG1 3.47Å; I181-I185 PolarHBondContact O-N 3.34Å; I182-I185 PolarHBondContact O-N 3.13Å; I185-M187 PolarHBondContact O-N 3.22Å; I185-S188 WeakPolarHBondContact O-CB 3.24Å; I185-S188 PolarHBondContact O-N 3.49Å; I185-S188 PolarHBondContact O-OG 2.88Å
186	M	95.4	Very high	95.5	Very high	37 Å²	37	49.3 Å²	49.3	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-54.7	-40.2	178.6	-73.5	176	71.2	0	0	111.8	T141 I182 P189 Y217 F221	T141-M186 HydrophobicContact CG2-CE 4.35Å; T141-M186 HydrophobicContact CG2-SD 4.28Å; I182-M186 HydrophobicContact CG2-CG 4.22Å; I182-M186 HydrophobicContact CG2-SD 3.82Å; I182-M186 WeakPolarHBondContact O-CB 3.39Å; I182-M186 VanDerWaalsContact O-CG 3.25Å; I182-M186 WeakPolarHBondContact O-CG 3.3Å; I182-M186 PolarHBondContact O-N 2.9Å; M186-P189 WeakPolarHBondContact O-CD 3.35Å; M186-Y217 PolarHBondContact O-OH 3.03Å; M186-F221 HydrophobicContact CE-CB 3.83Å; M186-F221 HydrophobicContact CE-CD1 3.57Å; M186-F221 HydrophobicContact CE-CE1 4.34Å; M186-F221 HydrophobicContact CE-CG 3.85Å
187	M	96	Very high	95.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-92.5	-8.3	-175.4	-62.9	-60.4	111.4	0	0	114.3	F134 L138 T141 S183 S184 I185 P189 F190 Y217 F221 A222	F134-M187 HydrophobicContact CD2-CB 4.31Å; F134-M187 WeakPolarHBondContact CD2-O 3.33Å; F134-M187 HydrophobicContact CE2-CB 4.01Å; F134-M187 WeakPolarHBondContact CE2-O 3.43Å; L138-M187 HydrophobicContact CB-CB 4.47Å; T141-M187 HydrophobicContact CG2-CE 4.3Å; T141-M187 HydrophobicContact CG2-CG 4.38Å; T141-M187 WeakPolarHBondContact OG1-CE 3.08Å; T141-M187 PolarHBondContact OG1-SD 2.86Å; S183-M187 WeakPolarHBondContact O-CB 3.36Å; S183-M187 WeakPolarHBondContact O-CG 3.14Å; S183-M187 PolarHBondContact O-N 2.87Å; S183-M187 VanDerWaalsContact O-N 3.08Å; S184-M187 PolarHBondContact O-N 3.12Å; I185-M187 PolarHBondContact O-N 3.22Å; M187-P189 VanDerWaalsContact C-N 3.33Å; M187-F190 HydrophobicContact CB-CD2 4.42Å; M187-F190 HydrophobicContact CE-CE2 3.96Å; M187-F190 WeakPolarHBondContact O-CB 3.4Å; M187-F190 PolarHBondContact O-N 3.12Å; M187-F190 VanDerWaalsContact O-N 3.14Å; M187-F190 HydrophobicContact SD-CD2 3.75Å; M187-F190 HydrophobicContact SD-CE2 3.64Å; M187-Y217 HydrophobicContact CE-CE1 3.96Å; M187-F221 HydrophobicContact CE-CB 4.3Å; M187-A222 HydrophobicContact CE-CB 3.92Å; M187-A222 HydrophobicContact SD-CB 3.4Å; M187-A222 WeakPolarHBondContact SD-CB 3.39Å
188	S	94.9	Very high	94.8	Very high	54 Å²	54	51.5 Å²	51.5	38%	0.378	27%	0.274	S	S	.	.	H	α-helix	trans	-54.3	-35.6	-180	67.1	0	0	0	0	115.2	S184 I185 F190 L191	S184-S188 WeakPolarHBondContact O-CB 3.38Å; S184-S188 PolarHBondContact O-N 3.45Å; I185-S188 WeakPolarHBondContact O-CB 3.24Å; I185-S188 PolarHBondContact O-N 3.49Å; I185-S188 PolarHBondContact O-OG 2.88Å; S188-F190 PolarHBondContact O-N 3.33Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.66Å; S188-L191 VanDerWaalsContact O-N 3.15Å
189	P	94.1	Very high	94	Very high	45 Å²	45	49.4 Å²	49.4	29%	0.292	27%	0.266	S	S	.	.	H	α-helix	trans	-59.9	-34.1	178.6	-24.4	36.3	0	0	0	113	M186 M187 L191 I192 V193 L214	M186-P189 WeakPolarHBondContact O-CD 3.35Å; M187-P189 VanDerWaalsContact C-N 3.33Å; P189-L191 VanDerWaalsContact C-N 3.28Å; P189-L191 PolarHBondContact O-N 2.85Å; P189-I192 PolarHBondContact O-N 2.83Å; P189-I192 VanDerWaalsContact O-N 3.15Å; P189-V193 WeakPolarHBondContact O-CB 3.29Å; P189-V193 WeakPolarHBondContact O-CG2 3.49Å; P189-V193 PolarHBondContact O-N 2.97Å; P189-L214 HydrophobicContact CB-CD1 4.38Å
190	F	93.3	Very high	93.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-24.5	-178.7	-62.1	-68	0	0	0	113.4	M187 S188 I192 I194 I207 L214 Y217 H218	M187-F190 HydrophobicContact CB-CD2 4.42Å; M187-F190 HydrophobicContact CE-CE2 3.96Å; M187-F190 WeakPolarHBondContact O-CB 3.4Å; M187-F190 PolarHBondContact O-N 3.12Å; M187-F190 VanDerWaalsContact O-N 3.14Å; M187-F190 HydrophobicContact SD-CD2 3.75Å; M187-F190 HydrophobicContact SD-CE2 3.64Å; S188-F190 PolarHBondContact O-N 3.33Å; F190-I192 PolarHBondContact O-N 3.06Å; F190-I194 HydrophobicContact CB-CD1 3.75Å; F190-I194 HydrophobicContact CB-CG1 4.21Å; F190-I194 HydrophobicContact CD1-CD1 4.12Å; F190-I194 HydrophobicContact CD1-CG1 4.36Å; F190-I194 HydrophobicContact CG-CD1 4.35Å; F190-I194 VanDerWaalsContact O-CB 3.25Å; F190-I194 WeakPolarHBondContact O-CB 3.34Å; F190-I194 WeakPolarHBondContact O-CG1 3.36Å; F190-I194 PolarHBondContact O-N 2.92Å; F190-I207 HydrophobicContact CD1-CD1 3.66Å; F190-I207 HydrophobicContact CD1-CG1 4.31Å; F190-I207 HydrophobicContact CE1-CD1 3.42Å; F190-I207 VanDerWaalsContact CE1-CD1 3.42Å; F190-I207 HydrophobicContact CE1-CG1 4.5Å; F190-L214 HydrophobicContact CD1-CD2 4.48Å; F190-L214 HydrophobicContact CE1-CD1 4.22Å; F190-L214 HydrophobicContact CE1-CD2 4.24Å; F190-L214 HydrophobicContact CE1-CG 3.8Å; F190-L214 HydrophobicContact CZ-CD1 4.19Å; F190-L214 HydrophobicContact CZ-CG 4.24Å; F190-Y217 AromaticContact CE2-CD1 3.93Å; F190-Y217 HydrophobicContact CE2-CD1 3.93Å; F190-Y217 AromaticContact CE2-CE1 3.88Å; F190-Y217 HydrophobicContact CE2-CE1 3.88Å; F190-Y217 AromaticContact CZ-CD1 3.68Å; F190-Y217 HydrophobicContact CZ-CD1 3.68Å; F190-Y217 HydrophobicContact CZ-CE1 4.13Å; F190-H218 HydrophobicContact CE1-CB 3.66Å; F190-H218 AromaticContact CE1-CD2 3.64Å; F190-H218 HydrophobicContact CZ-CB 3.5Å; F190-H218 AromaticContact CZ-CD2 3.62Å; F190-H218 AromaticContact CZ-CG 3.98Å
191	L	93.1	Very high	92.5	Very high	74 Å²	74	55.7 Å²	55.7	39%	0.387	31%	0.308	S	S	.	.	H	α-helix	trans	-67.1	-30.5	174.4	-175.1	61.7	0	0	0	111.8	F134 S188 P189	F134-L191 HydrophobicContact CB-CB 4.22Å; F134-L191 HydrophobicContact CB-CD1 3.93Å; F134-L191 HydrophobicContact CD1-CD1 4.07Å; F134-L191 HydrophobicContact CD2-CB 3.8Å; F134-L191 HydrophobicContact CE2-CB 4.35Å; F134-L191 HydrophobicContact CG-CB 3.95Å; F134-L191 HydrophobicContact CG-CD1 3.95Å; F134-L191 HydrophobicContact CG-CG 4.43Å; S188-L191 WeakPolarHBondContact O-CB 3.49Å; S188-L191 PolarHBondContact O-N 2.66Å; S188-L191 VanDerWaalsContact O-N 3.15Å; P189-L191 VanDerWaalsContact C-N 3.28Å; P189-L191 PolarHBondContact O-N 2.85Å
192	I	92.8	Very high	92	Very high	132 Å²	132	55.7 Å²	55.7	68%	0.677	31%	0.305	S	S	*	.	H	α-helix	trans	-92.2	-45	-175	-57.6	173.6	0	0	0	110.6	P189 F190	P189-I192 PolarHBondContact O-N 2.83Å; P189-I192 VanDerWaalsContact O-N 3.15Å; F190-I192 PolarHBondContact O-N 3.06Å
193	V	94.3	Very high	91.6	Very high	47 Å²	47	53.2 Å²	53.2	29%	0.285	29%	0.292	S	S	.	.	H	α-helix	trans	-85.8	-30.7	-167.7	173.7	0	0	0	0	113.3	P189 D195 I207 L211 L214	P189-V193 WeakPolarHBondContact O-CB 3.29Å; P189-V193 WeakPolarHBondContact O-CG2 3.49Å; P189-V193 PolarHBondContact O-N 2.97Å; V193-D195 PolarHBondContact O-N 3.23Å; V193-I207 HydrophobicContact CG1-CG2 3.93Å; V193-L211 HydrophobicContact CG1-CD1 3.31Å; V193-L211 HydrophobicContact CG2-CD1 4.4Å; V193-L214 HydrophobicContact CB-CD2 4.15Å; V193-L214 HydrophobicContact CG1-CD2 3.9Å; V193-L214 HydrophobicContact CG2-CD2 4.19Å
194	I	94.1	Very high	91.3	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.301	C	S	.	.			trans	-66.9	133	-179.6	-67.6	-178.9	0	0	0	109.1	R130 R133 F190 I207	R130-I194 WeakPolarHBondContact CG-O 3.26Å; R130-I194 PolarHBondContact NE-O 2.8Å; R133-I194 HydrophobicContact CB-CD1 3.49Å; R133-I194 VanDerWaalsContact CB-CD1 3.49Å; R133-I194 HydrophobicContact CB-CG2 4.14Å; R133-I194 HydrophobicContact CG-CD1 4.23Å; R133-I194 HydrophobicContact CG-CG2 4.14Å; F190-I194 HydrophobicContact CB-CD1 3.75Å; F190-I194 HydrophobicContact CB-CG1 4.21Å; F190-I194 HydrophobicContact CD1-CD1 4.12Å; F190-I194 HydrophobicContact CD1-CG1 4.36Å; F190-I194 HydrophobicContact CG-CD1 4.35Å; F190-I194 VanDerWaalsContact O-CB 3.25Å; F190-I194 WeakPolarHBondContact O-CB 3.34Å; F190-I194 WeakPolarHBondContact O-CG1 3.36Å; F190-I194 PolarHBondContact O-N 2.92Å; I194-I207 HydrophobicContact CG1-CG1 3.83Å
195	D	93.9	Very high	91.1	Very high	30 Å²	30	53.1 Å²	53.1	16%	0.16	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	-177.5	171.4	-151.1	-1.2	0	0	0	110.8	R126 R130 V193 I197 W206	R126-D195 IonicContact NH1-OD2 2.55Å; R130-D195 IonicContact CZ-OD1 3.08Å; R130-D195 IonicContact CZ-OD2 2.71Å; R130-D195 IonicContact NE-OD1 3.85Å; R130-D195 IonicContact NH2-OD1 2.67Å; R130-D195 PolarHBondContact NH2-OD1 2.99Å; R130-D195 IonicContact NH2-OD2 3.23Å; R130-D195 PolarHBondContact NH2-OD2 2.98Å; V193-D195 PolarHBondContact O-N 3.23Å; D195-I197 PolarHBondContact O-N 3.12Å; D195-W206 PolarHBondContact N-O 2.96Å; D195-W206 VanDerWaalsContact N-O 3.14Å; D195-W206 PolarHBondContact O-N 3.45Å
196	W	93	Very high	91	Very high	21 Å²	21	48.7 Å²	48.7	8%	0.08	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	114.2	160.9	-66.6	-9.5	0	0	0	109.6	I7 Y10 F12 F122 S125 R126 I204	I7-W196 HydrophobicContact CG1-CH2 4.4Å; Y10-W196 HydrophobicContact CD1-CE3 4.37Å; Y10-W196 HydrophobicContact CD2-CE3 4.36Å; Y10-W196 AromaticContact CD2-CZ3 3.78Å; Y10-W196 HydrophobicContact CD2-CZ3 3.78Å; Y10-W196 HydrophobicContact CE1-CE3 4.31Å; Y10-W196 HydrophobicContact CE2-CE3 4.29Å; Y10-W196 AromaticContact CE2-CZ3 3.8Å; Y10-W196 HydrophobicContact CE2-CZ3 3.8Å; Y10-W196 HydrophobicContact CG-CE3 4.4Å; Y10-W196 HydrophobicContact CG-CZ3 4.16Å; F12-W196 HydrophobicContact CE1-CD2 4.15Å; F12-W196 AromaticContact CE1-CE2 3.89Å; F12-W196 HydrophobicContact CE1-CH2 4.42Å; F12-W196 HydrophobicContact CE1-CZ2 4.04Å; F12-W196 HydrophobicContact CZ-CD2 4.45Å; F12-W196 HydrophobicContact CZ-CE3 4.46Å; F12-W196 AromaticContact CZ-CH2 3.84Å; F12-W196 HydrophobicContact CZ-CH2 3.84Å; F12-W196 AromaticContact CZ-CZ2 3.8Å; F12-W196 HydrophobicContact CZ-CZ2 3.8Å; F12-W196 HydrophobicContact CZ-CZ3 4.18Å; F122-W196 PolarHBondContact O-NE1 3.15Å; S125-W196 VanDerWaalsContact C-CZ2 3.42Å; R126-W196 HydrophobicContact CG-CB 4.48Å; R126-W196 HydrophobicContact CG-CD2 3.52Å; R126-W196 HydrophobicContact CG-CE3 3.57Å; R126-W196 HydrophobicContact CG-CG 3.94Å; R126-W196 HydrophobicContact CG-CH2 4.4Å; R126-W196 HydrophobicContact CG-CZ2 4.37Å; R126-W196 HydrophobicContact CG-CZ3 4.03Å; W196-I204 WeakPolarHBondContact CA-O 3.45Å
197	I	91.3	Very high	90.8	Very high	23 Å²	23	47 Å²	47	12%	0.118	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	150.4	172.7	65.7	172.3	0	0	0	109.2	D195 V199 H203 I204 W206 I207 D208	D195-I197 PolarHBondContact O-N 3.12Å; I197-V199 HydrophobicContact CD1-CG2 4.42Å; I197-V199 HydrophobicContact CG1-CG2 4.49Å; I197-H203 WeakPolarHBondContact O-CA 3.26Å; I197-I204 HydrophobicContact CD1-CG2 3.98Å; I197-I204 HydrophobicContact CG1-CG2 3.52Å; I197-I204 PolarHBondContact N-O 2.91Å; I197-I204 PolarHBondContact O-N 3.35Å; I197-W206 HydrophobicContact CD1-CB 4.1Å; I197-I207 WeakPolarHBondContact CD1-O 3.35Å; I197-D208 HydrophobicContact CG2-CB 4.31Å
198	Q	86.8	Confident	90.5	Very high	125 Å²	125	50.4 Å²	50.4	58%	0.584	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.9	178.5	-175.5	177.2	-11.4	0	0	109.8	G200 F202	Q198-G200 WeakPolarHBondContact CG-O 3.4Å; Q198-G200 PolarHBondContact NE2-O 3.03Å; Q198-F202 CarbonylContact C-O 3.59Å; Q198-F202 WeakPolarHBondContact CA-O 3.21Å
199	V	81.1	Confident	90	Very high	48 Å²	48	53.9 Å²	53.9	29%	0.291	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	103	172.5	-178.3	0	0	0	0	107.5	I197 Q201 F202 I204	I197-V199 HydrophobicContact CD1-CG2 4.42Å; I197-V199 HydrophobicContact CG1-CG2 4.49Å; V199-Q201 PolarHBondContact O-N 3.15Å; V199-F202 PolarHBondContact N-O 3.38Å; V199-F202 PolarHBondContact O-N 3.13Å; V199-I204 HydrophobicContact CG2-CG2 3.89Å
200	G	80.4	Confident	89.7	Confident	58 Å²	58	56.3 Å²	56.3	60%	0.598	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	-116.9	-171.4	0	0	0	0	0	111.8	Q198	Q198-G200 WeakPolarHBondContact CG-O 3.4Å; Q198-G200 PolarHBondContact NE2-O 3.03Å
201	Q	82.4	Confident	89.6	Confident	154 Å²	154	59.8 Å²	59.8	72%	0.72	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-4.1	177.5	-60.3	-61.7	-35.8	0	0	113.1	V199	V199-Q201 PolarHBondContact O-N 3.15Å
202	F	87.4	Confident	89.5	Confident	87 Å²	87	57.7 Å²	57.7	38%	0.382	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	151.2	-171.1	-60.7	-76	0	0	0	111.9	V11 F12 Y13 Q198 V199	V11-F202 HydrophobicContact CB-CD1 4.33Å; V11-F202 HydrophobicContact CG1-CD1 3.62Å; V11-F202 HydrophobicContact CG1-CE1 3.61Å; V11-F202 CarbonylContact O-C 3.44Å; V11-F202 VanDerWaalsContact O-CA 3.3Å; V11-F202 WeakPolarHBondContact O-CA 3.33Å; F12-F202 WeakPolarHBondContact O-CD1 3.27Å; Y13-F202 HydrophobicContact CD2-CB 4.08Å; Y13-F202 HydrophobicContact CD2-CD2 4.31Å; Y13-F202 HydrophobicContact CD2-CG 4.31Å; Q198-F202 CarbonylContact C-O 3.59Å; Q198-F202 WeakPolarHBondContact CA-O 3.21Å; V199-F202 PolarHBondContact N-O 3.38Å; V199-F202 PolarHBondContact O-N 3.13Å
203	H	89.2	Confident	89.5	Confident	31 Å²	31	57.7 Å²	57.7	14%	0.144	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139	172.5	-68.5	73.7	0	0	0	110.8	Y10 V11 F12 Y13 I197	Y10-H203 HydrophobicContact CD1-CB 4.45Å; Y10-H203 AromaticContact CD1-CD2 3.51Å; Y10-H203 AromaticContact CD1-CE1 3.52Å; Y10-H203 AromaticContact CD1-CG 3.61Å; Y10-H203 AromaticContact CD1-ND1 3.62Å; Y10-H203 AromaticContact CD1-NE2 3.44Å; Y10-H203 WeakPolarHBondContact CD1-NE2 3.34Å; Y10-H203 AromaticContact CE1-CD2 3.77Å; Y10-H203 AromaticContact CE1-CE1 3.97Å; Y10-H203 AromaticContact CE1-NE2 3.5Å; V11-H203 PolarHBondContact O-N 3.04Å; F12-H203 WeakPolarHBondContact CA-O 3.47Å; F12-H203 HydrophobicContact CD1-CB 3.97Å; F12-H203 WeakPolarHBondContact CD1-O 3.38Å; F12-H203 HydrophobicContact CE1-CB 4.12Å; Y13-H203 PolarHBondContact N-O 2.83Å; I197-H203 WeakPolarHBondContact O-CA 3.26Å
204	I	90.8	Very high	89.4	Confident	37 Å²	37	57 Å²	57	19%	0.19	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.9	174.2	-171	170.5	0	0	0	110.1	W196 I197 V199 W206	W196-I204 WeakPolarHBondContact CA-O 3.45Å; I197-I204 HydrophobicContact CD1-CG2 3.98Å; I197-I204 HydrophobicContact CG1-CG2 3.52Å; I197-I204 PolarHBondContact N-O 2.91Å; I197-I204 PolarHBondContact O-N 3.35Å; V199-I204 HydrophobicContact CG2-CG2 3.89Å; I204-W206 HydrophobicContact CG1-CB 4.43Å; I204-W206 HydrophobicContact CG2-CB 4.31Å; I204-W206 PolarHBondContact O-N 3.31Å
205	C	92.9	Very high	89.3	Confident	2 Å²	2	57.8 Å²	57.8	1%	0.014	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	92.4	172.4	171.3	0	0	0	0	110.1	F122 C129 R133	F122-C205 HydrophobicContact CB-CB 3.7Å; F122-C205 HydrophobicContact CG-CB 4.41Å; C129-C205 WeakPolarHBondContact CA-SG 3.46Å; C129-C205 HydrophobicContact CB-CB 3.87Å; C129-C205 WeakPolarHBondContact CB-SG 3.43Å; C129-C205 VanDerWaalsContact SG-CA 3.59Å; C129-C205 WeakPolarHBondContact SG-CB 3.19Å; C129-C205 CovalentContact SG-SG 2.01Å; C129-C205 PolarHBondContact SG-SG 3.04Å; R133-C205 PolarHBondContact NE-O 3.02Å; R133-C205 PolarHBondContact NH2-O 3.48Å; R133-C205 VanDerWaalsContact NH2-O 3.12Å
206	W	93.2	Very high	89.2	Confident	18 Å²	18	58.3 Å²	58.3	7%	0.068	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	-172.9	-177.4	-156.3	-117.5	0	0	0	113.4	R133 D195 I197 I204 H218 Y288 F292	R133-W206 VanDerWaalsContact CZ-CZ3 3.48Å; D195-W206 PolarHBondContact N-O 2.96Å; D195-W206 VanDerWaalsContact N-O 3.14Å; D195-W206 PolarHBondContact O-N 3.45Å; I197-W206 HydrophobicContact CD1-CB 4.1Å; I204-W206 HydrophobicContact CG1-CB 4.43Å; I204-W206 HydrophobicContact CG2-CB 4.31Å; I204-W206 PolarHBondContact O-N 3.31Å; W206-H218 AromaticContact CH2-CE1 3.94Å; W206-H218 AromaticContact CH2-ND1 3.93Å; W206-Y288 VanDerWaalsContact CH2-OH 3.28Å; W206-Y288 WeakPolarHBondContact CH2-OH 3.04Å; W206-F292 AromaticContact CE2-CZ 3.77Å; W206-F292 HydrophobicContact CH2-CZ 4.2Å; W206-F292 HydrophobicContact CZ2-CE1 4.02Å; W206-F292 HydrophobicContact CZ2-CE2 4.14Å; W206-F292 AromaticContact CZ2-CZ 3.3Å; W206-F292 HydrophobicContact CZ2-CZ 3.3Å; W206-F292 AromaticContact NE1-CE1 3.65Å; W206-F292 AromaticContact NE1-CZ 3.88Å
207	I	92.2	Very high	89.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.318	C	S	.	.			trans	-89	134.2	175.9	-59.1	162.4	0	0	0	108.1	F190 V193 I194 I197 L211 L214 Q215	F190-I207 HydrophobicContact CD1-CD1 3.66Å; F190-I207 HydrophobicContact CD1-CG1 4.31Å; F190-I207 HydrophobicContact CE1-CD1 3.42Å; F190-I207 VanDerWaalsContact CE1-CD1 3.42Å; F190-I207 HydrophobicContact CE1-CG1 4.5Å; V193-I207 HydrophobicContact CG1-CG2 3.93Å; I194-I207 HydrophobicContact CG1-CG1 3.83Å; I197-I207 WeakPolarHBondContact CD1-O 3.35Å; I207-L211 HydrophobicContact CG2-CB 3.76Å; I207-L211 HydrophobicContact CG2-CD1 4.48Å; I207-L214 HydrophobicContact CD1-CG 4.43Å; I207-L214 HydrophobicContact CG2-CD2 4.35Å; I207-Q215 HydrophobicContact CB-CG 4.02Å; I207-Q215 HydrophobicContact CD1-CG 4.21Å; I207-Q215 HydrophobicContact CG2-CG 4.04Å; I207-Q215 PolarHBondContact O-NE2 2.91Å
208	D	89.2	Confident	89.5	Confident	73 Å²	73	59.2 Å²	59.2	39%	0.39	31%	0.313	S	S	.	.			trans	-51.4	143.7	175.6	-167.3	-79.5	0	0	0	112.7	I197 S210 L211 Q215	I197-D208 HydrophobicContact CG2-CB 4.31Å; D208-S210 PolarHBondContact O-N 3.39Å; D208-S210 WeakPolarHBondContact OD1-CB 3.31Å; D208-S210 PolarHBondContact OD1-N 2.94Å; D208-S210 PolarHBondContact OD1-OG 2.74Å; D208-L211 PolarHBondContact O-N 3.4Å; D208-Q215 PolarHBondContact O-NE2 3.43Å
209	E	84.5	Confident	89.7	Confident	126 Å²	126	53.3 Å²	53.3	59%	0.589	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-61.7	-29.9	-178	-66.9	-176.8	177	0	0	112.7	L211 F212	E209-L211 PolarHBondContact O-N 2.97Å; E209-L211 VanDerWaalsContact O-N 3.1Å; E209-F212 PolarHBondContact O-N 3.38Å
210	S	87.7	Confident	90.4	Very high	96 Å²	96	53.2 Å²	53.2	67%	0.671	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-60.2	-20.5	174.5	63.1	0	0	0	0	113.3	D208	D208-S210 PolarHBondContact O-N 3.39Å; D208-S210 WeakPolarHBondContact OD1-CB 3.31Å; D208-S210 PolarHBondContact OD1-N 2.94Å; D208-S210 PolarHBondContact OD1-OG 2.74Å
211	L	91.8	Very high	91.1	Very high	73 Å²	73	53 Å²	53	38%	0.382	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-105.5	37.7	-180	-61	175.3	0	0	0	112	V193 I207 D208 E209 N213 L214 Q215	V193-L211 HydrophobicContact CG1-CD1 3.31Å; V193-L211 HydrophobicContact CG2-CD1 4.4Å; I207-L211 HydrophobicContact CG2-CB 3.76Å; I207-L211 HydrophobicContact CG2-CD1 4.48Å; D208-L211 PolarHBondContact O-N 3.4Å; E209-L211 PolarHBondContact O-N 2.97Å; E209-L211 VanDerWaalsContact O-N 3.1Å; L211-N213 PolarHBondContact O-N 3.47Å; L211-N213 VanDerWaalsContact O-N 3.15Å; L211-L214 HydrophobicContact CB-CB 4.31Å; L211-L214 WeakPolarHBondContact O-CA 2.97Å; L211-L214 VanDerWaalsContact O-CB 3.31Å; L211-L214 WeakPolarHBondContact O-CB 3.22Å; L211-L214 PolarHBondContact O-N 2.84Å; L211-Q215 PolarHBondContact O-N 2.9Å
212	F	89.9	Confident	91.5	Very high	30 Å²	30	45.6 Å²	45.6	13%	0.132	23%	0.231	C	C	.	.	H	α-helix	trans	-49.2	-40.9	178.7	-179	-114.5	0	0	0	114	E209 L214 Q215 I216 L293 H296	E209-F212 PolarHBondContact O-N 3.38Å; F212-L214 PolarHBondContact O-N 3.23Å; F212-Q215 WeakPolarHBondContact O-CA 3.02Å; F212-Q215 WeakPolarHBondContact O-CB 3.39Å; F212-Q215 PolarHBondContact O-N 3.34Å; F212-I216 HydrophobicContact CD1-CD1 4Å; F212-I216 HydrophobicContact CE1-CD1 3.4Å; F212-I216 VanDerWaalsContact CE1-CD1 3.4Å; F212-I216 HydrophobicContact CE1-CG1 4.11Å; F212-I216 HydrophobicContact CE2-CG1 4.41Å; F212-I216 HydrophobicContact CZ-CD1 3.73Å; F212-I216 HydrophobicContact CZ-CG1 4.03Å; F212-I216 PolarHBondContact O-N 2.98Å; F212-L293 HydrophobicContact CZ-CD2 4.16Å; F212-H296 AromaticContact CD1-CD2 3.62Å; F212-H296 AromaticContact CD1-NE2 3.67Å; F212-H296 HydrophobicContact CD2-CB 3.85Å; F212-H296 AromaticContact CD2-CG 3.62Å; F212-H296 AromaticContact CD2-ND1 3.76Å; F212-H296 HydrophobicContact CE1-CB 4.32Å; F212-H296 AromaticContact CE1-CD2 3.39Å; F212-H296 WeakPolarHBondContact CE1-CD2 3.27Å; F212-H296 AromaticContact CE1-CG 3.88Å; F212-H296 AromaticContact CE1-NE2 3.92Å; F212-H296 HydrophobicContact CE2-CB 3.28Å; F212-H296 AromaticContact CE2-CD2 3.9Å; F212-H296 AromaticContact CE2-CG 3.48Å; F212-H296 VanDerWaalsContact CE2-CG 3.48Å; F212-H296 AromaticContact CG-CD2 3.93Å; F212-H296 AromaticContact CG-CE1 3.91Å; F212-H296 AromaticContact CG-CG 3.9Å; F212-H296 AromaticContact CG-ND1 3.89Å; F212-H296 AromaticContact CG-NE2 3.93Å; F212-H296 HydrophobicContact CZ-CB 3.54Å; F212-H296 AromaticContact CZ-CD2 3.54Å; F212-H296 AromaticContact CZ-CG 3.59Å
213	N	92.8	Very high	91.7	Very high	133 Å²	133	41.5 Å²	41.5	71%	0.711	21%	0.213	S	C	*	.	H	α-helix	trans	-56.9	-35	176	-70.5	-29.5	0	0	0	112.8	L211 Y217	L211-N213 PolarHBondContact O-N 3.47Å; L211-N213 VanDerWaalsContact O-N 3.15Å; N213-Y217 WeakPolarHBondContact O-CB 3.1Å; N213-Y217 PolarHBondContact O-N 3.2Å
214	L	93.3	Very high	91.8	Very high	32 Å²	32	40.1 Å²	40.1	17%	0.168	21%	0.206	C	C	.	.	H	α-helix	trans	-75	-29.4	178	-167.6	66.3	0	0	0	111.8	P189 F190 V193 I207 L211 F212 Y217 H218	P189-L214 HydrophobicContact CB-CD1 4.38Å; F190-L214 HydrophobicContact CD1-CD2 4.48Å; F190-L214 HydrophobicContact CE1-CD1 4.22Å; F190-L214 HydrophobicContact CE1-CD2 4.24Å; F190-L214 HydrophobicContact CE1-CG 3.8Å; F190-L214 HydrophobicContact CZ-CD1 4.19Å; F190-L214 HydrophobicContact CZ-CG 4.24Å; V193-L214 HydrophobicContact CB-CD2 4.15Å; V193-L214 HydrophobicContact CG1-CD2 3.9Å; V193-L214 HydrophobicContact CG2-CD2 4.19Å; I207-L214 HydrophobicContact CD1-CG 4.43Å; I207-L214 HydrophobicContact CG2-CD2 4.35Å; L211-L214 HydrophobicContact CB-CB 4.31Å; L211-L214 WeakPolarHBondContact O-CA 2.97Å; L211-L214 VanDerWaalsContact O-CB 3.31Å; L211-L214 WeakPolarHBondContact O-CB 3.22Å; L211-L214 PolarHBondContact O-N 2.84Å; F212-L214 PolarHBondContact O-N 3.23Å; L214-Y217 HydrophobicContact CD1-CD1 3.96Å; L214-Y217 HydrophobicContact CD1-CG 4.47Å; L214-Y217 WeakPolarHBondContact O-CB 3.35Å; L214-Y217 PolarHBondContact O-N 3.42Å; L214-H218 PolarHBondContact O-N 3.38Å
215	Q	91.3	Very high	91.9	Very high	17 Å²	17	38.3 Å²	38.3	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-67.1	-43	172.3	-56.6	-177	8.1	0	0	111.3	I207 D208 L211 F212 Y217 H218 T219	I207-Q215 HydrophobicContact CB-CG 4.02Å; I207-Q215 HydrophobicContact CD1-CG 4.21Å; I207-Q215 HydrophobicContact CG2-CG 4.04Å; I207-Q215 PolarHBondContact O-NE2 2.91Å; D208-Q215 PolarHBondContact O-NE2 3.43Å; L211-Q215 PolarHBondContact O-N 2.9Å; F212-Q215 WeakPolarHBondContact O-CA 3.02Å; F212-Q215 WeakPolarHBondContact O-CB 3.39Å; F212-Q215 PolarHBondContact O-N 3.34Å; Q215-Y217 VanDerWaalsContact C-N 3.35Å; Q215-H218 WeakPolarHBondContact O-CB 3.33Å; Q215-H218 PolarHBondContact O-N 2.93Å; Q215-T219 PolarHBondContact O-N 3.35Å; Q215-T219 VanDerWaalsContact O-N 3.17Å; Q215-T219 PolarHBondContact O-OG1 2.73Å
216	I	93.1	Very high	92.1	Very high	40 Å²	40	39.2 Å²	39.2	21%	0.205	20%	0.202	C	C	.	.	H	α-helix	trans	-60.2	-48.2	171.5	-65.5	177.4	0	0	0	109.6	F212 H218 T219 L220 L289 L293	F212-I216 HydrophobicContact CD1-CD1 4Å; F212-I216 HydrophobicContact CE1-CD1 3.4Å; F212-I216 VanDerWaalsContact CE1-CD1 3.4Å; F212-I216 HydrophobicContact CE1-CG1 4.11Å; F212-I216 HydrophobicContact CE2-CG1 4.41Å; F212-I216 HydrophobicContact CZ-CD1 3.73Å; F212-I216 HydrophobicContact CZ-CG1 4.03Å; F212-I216 PolarHBondContact O-N 2.98Å; I216-H218 VanDerWaalsContact C-N 3.29Å; I216-H218 PolarHBondContact O-N 3.15Å; I216-T219 PolarHBondContact O-N 3.23Å; I216-L220 HydrophobicContact CG2-CD1 3.82Å; I216-L220 HydrophobicContact CG2-CG 4.06Å; I216-L220 WeakPolarHBondContact O-CG 3.45Å; I216-L220 PolarHBondContact O-N 3.21Å; I216-L289 HydrophobicContact CG2-CD1 4.41Å; I216-L293 HydrophobicContact CD1-CD2 4.24Å
217	Y	95	Very high	92.2	Very high	64 Å²	64	40.8 Å²	40.8	25%	0.251	21%	0.213	S	C	.	.	H	α-helix	trans	-55.3	-43.2	177.3	176.1	-96.5	0	0	0	112.6	M186 M187 F190 N213 L214 Q215 T219 L220 F221	M186-Y217 PolarHBondContact O-OH 3.03Å; M187-Y217 HydrophobicContact CE-CE1 3.96Å; F190-Y217 AromaticContact CE2-CD1 3.93Å; F190-Y217 HydrophobicContact CE2-CD1 3.93Å; F190-Y217 AromaticContact CE2-CE1 3.88Å; F190-Y217 HydrophobicContact CE2-CE1 3.88Å; F190-Y217 AromaticContact CZ-CD1 3.68Å; F190-Y217 HydrophobicContact CZ-CD1 3.68Å; F190-Y217 HydrophobicContact CZ-CE1 4.13Å; N213-Y217 WeakPolarHBondContact O-CB 3.1Å; N213-Y217 PolarHBondContact O-N 3.2Å; L214-Y217 HydrophobicContact CD1-CD1 3.96Å; L214-Y217 HydrophobicContact CD1-CG 4.47Å; L214-Y217 WeakPolarHBondContact O-CB 3.35Å; L214-Y217 PolarHBondContact O-N 3.42Å; Q215-Y217 VanDerWaalsContact C-N 3.35Å; Y217-T219 VanDerWaalsContact C-N 3.31Å; Y217-T219 PolarHBondContact O-N 3.05Å; Y217-L220 PolarHBondContact O-N 3.43Å; Y217-F221 AromaticContact CD2-CD2 3.4Å; Y217-F221 HydrophobicContact CD2-CD2 3.4Å; Y217-F221 VanDerWaalsContact CD2-CD2 3.4Å; Y217-F221 AromaticContact CD2-CE2 3.64Å; Y217-F221 HydrophobicContact CD2-CE2 3.64Å; Y217-F221 AromaticContact CE2-CD2 3.29Å; Y217-F221 HydrophobicContact CE2-CD2 3.29Å; Y217-F221 AromaticContact CE2-CE2 3.59Å; Y217-F221 HydrophobicContact CE2-CE2 3.59Å; Y217-F221 HydrophobicContact CE2-CG 4.08Å; Y217-F221 HydrophobicContact CG-CD2 4.16Å; Y217-F221 AromaticContact CZ-CD2 3.98Å; Y217-F221 PolarHBondContact O-N 3.24Å; Y217-F221 VanDerWaalsContact O-N 3.07Å
218	H	94	Very high	92.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.7	-46.4	174.9	-175.5	-87.4	0	0	0	111.6	Y136 S137 F190 W206 L214 Q215 I216 L220 A222 N223	Y136-H218 AromaticContact CE1-CE1 3.7Å; Y136-H218 AromaticContact CE1-NE2 3.8Å; Y136-H218 AromaticContact CZ-CE1 3.85Å; S137-H218 PolarHBondContact OG-NE2 3.15Å; F190-H218 HydrophobicContact CE1-CB 3.66Å; F190-H218 AromaticContact CE1-CD2 3.64Å; F190-H218 HydrophobicContact CZ-CB 3.5Å; F190-H218 AromaticContact CZ-CD2 3.62Å; F190-H218 AromaticContact CZ-CG 3.98Å; W206-H218 AromaticContact CH2-CE1 3.94Å; W206-H218 AromaticContact CH2-ND1 3.93Å; L214-H218 PolarHBondContact O-N 3.38Å; Q215-H218 WeakPolarHBondContact O-CB 3.33Å; Q215-H218 PolarHBondContact O-N 2.93Å; I216-H218 VanDerWaalsContact C-N 3.29Å; I216-H218 PolarHBondContact O-N 3.15Å; H218-L220 PolarHBondContact O-N 3.14Å; H218-A222 VanDerWaalsContact O-CA 3.28Å; H218-A222 WeakPolarHBondContact O-CA 3.45Å; H218-A222 WeakPolarHBondContact O-CB 3.45Å; H218-A222 PolarHBondContact O-N 2.82Å; H218-N223 PolarHBondContact O-N 2.95Å
219	T	92.4	Very high	92.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.1	-38.7	179.8	-55.7	0	0	0	0	112.3	Q215 I216 Y217 F221 Y288 L289 F292	Q215-T219 PolarHBondContact O-N 3.35Å; Q215-T219 VanDerWaalsContact O-N 3.17Å; Q215-T219 PolarHBondContact O-OG1 2.73Å; I216-T219 PolarHBondContact O-N 3.23Å; Y217-T219 VanDerWaalsContact C-N 3.31Å; Y217-T219 PolarHBondContact O-N 3.05Å; T219-F221 PolarHBondContact O-N 3.36Å; T219-Y288 HydrophobicContact CG2-CD1 3.94Å; T219-L289 HydrophobicContact CG2-CB 3.7Å; T219-L289 HydrophobicContact CG2-CD1 4.17Å; T219-L289 HydrophobicContact CG2-CG 4.48Å; T219-F292 VanDerWaalsContact OG1-CD2 3.24Å; T219-F292 WeakPolarHBondContact OG1-CD2 3.48Å; T219-F292 WeakPolarHBondContact OG1-CE2 3.25Å
220	L	95	Very high	93.3	Very high	47 Å²	47	35.5 Å²	35.5	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-66.5	-35.9	-178.7	-70	-178.4	0	0	0	113	I216 Y217 H218 G225 L226 V227 Q228	I216-L220 HydrophobicContact CG2-CD1 3.82Å; I216-L220 HydrophobicContact CG2-CG 4.06Å; I216-L220 WeakPolarHBondContact O-CG 3.45Å; I216-L220 PolarHBondContact O-N 3.21Å; Y217-L220 PolarHBondContact O-N 3.43Å; H218-L220 PolarHBondContact O-N 3.14Å; L220-G225 CarbonylContact O-C 3.57Å; L220-L226 HydrophobicContact CD2-CB 4.5Å; L220-L226 HydrophobicContact CD2-CD2 3.91Å; L220-L226 PolarHBondContact O-N 3.16Å; L220-V227 HydrophobicContact CB-CG2 4.01Å; L220-V227 HydrophobicContact CD2-CG2 4.3Å; L220-V227 PolarHBondContact O-N 2.9Å; L220-Q228 PolarHBondContact O-OE1 3.5Å
221	F	94.5	Very high	93.7	Very high	52 Å²	52	33.5 Å²	33.5	23%	0.228	17%	0.172	C	C	.	.	H	α-helix	trans	-122.4	-24.1	-169.3	-66	-78.2	0	0	0	115.9	T141 M186 M187 Y217 T219 V227 Q228	T141-F221 PolarHBondContact OG1-O 3.14Å; M186-F221 HydrophobicContact CE-CB 3.83Å; M186-F221 HydrophobicContact CE-CD1 3.57Å; M186-F221 HydrophobicContact CE-CE1 4.34Å; M186-F221 HydrophobicContact CE-CG 3.85Å; M187-F221 HydrophobicContact CE-CB 4.3Å; Y217-F221 AromaticContact CD2-CD2 3.4Å; Y217-F221 HydrophobicContact CD2-CD2 3.4Å; Y217-F221 VanDerWaalsContact CD2-CD2 3.4Å; Y217-F221 AromaticContact CD2-CE2 3.64Å; Y217-F221 HydrophobicContact CD2-CE2 3.64Å; Y217-F221 AromaticContact CE2-CD2 3.29Å; Y217-F221 HydrophobicContact CE2-CD2 3.29Å; Y217-F221 AromaticContact CE2-CE2 3.59Å; Y217-F221 HydrophobicContact CE2-CE2 3.59Å; Y217-F221 HydrophobicContact CE2-CG 4.08Å; Y217-F221 HydrophobicContact CG-CD2 4.16Å; Y217-F221 AromaticContact CZ-CD2 3.98Å; Y217-F221 PolarHBondContact O-N 3.24Å; Y217-F221 VanDerWaalsContact O-N 3.07Å; T219-F221 PolarHBondContact O-N 3.36Å; F221-V227 HydrophobicContact CD1-CB 4.26Å; F221-V227 HydrophobicContact CE1-CB 3.89Å; F221-V227 HydrophobicContact CE1-CG1 3.88Å; F221-V227 HydrophobicContact CE1-CG2 4.07Å; F221-V227 HydrophobicContact CZ-CB 4.36Å; F221-V227 HydrophobicContact CZ-CG1 4.38Å; F221-V227 HydrophobicContact CZ-CG2 4.04Å; F221-Q228 PolarHBondContact O-NE2 3.32Å
222	A	91.4	Very high	94	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-51.3	-169.6	0	0	0	0	0	113.9	T140 T141 M187 H218 L224	T140-A222 WeakPolarHBondContact CB-O 3.42Å; T140-A222 PolarHBondContact OG1-O 3.33Å; T141-A222 VanDerWaalsContact OG1-CA 3.29Å; T141-A222 WeakPolarHBondContact OG1-CA 3.38Å; M187-A222 HydrophobicContact CE-CB 3.92Å; M187-A222 HydrophobicContact SD-CB 3.4Å; M187-A222 WeakPolarHBondContact SD-CB 3.39Å; H218-A222 VanDerWaalsContact O-CA 3.28Å; H218-A222 WeakPolarHBondContact O-CA 3.45Å; H218-A222 WeakPolarHBondContact O-CB 3.45Å; H218-A222 PolarHBondContact O-N 2.82Å; A222-L224 PolarHBondContact O-N 3.31Å
223	N	91.1	Very high	94.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	S	Bend	trans	-73.1	89.2	177.6	-179.1	46.8	0	0	0	109.2	Y136 H218 G225 Q284 T285 Y288 W320	Y136-N223 PolarHBondContact OH-OD1 3.38Å; Y136-N223 VanDerWaalsContact OH-OD1 3.06Å; H218-N223 PolarHBondContact O-N 2.95Å; N223-G225 PolarHBondContact O-N 3.24Å; N223-Q284 PolarHBondContact ND2-NE2 3.39Å; N223-Q284 PolarHBondContact ND2-OE1 2.98Å; N223-Q284 PolarHBondContact OD1-NE2 3.31Å; N223-T285 WeakPolarHBondContact O-CG2 3.25Å; N223-Y288 HydrophobicContact CB-CD1 4.29Å; N223-Y288 HydrophobicContact CB-CE1 4.31Å; N223-Y288 WeakPolarHBondContact ND2-CB 3.34Å; N223-Y288 WeakPolarHBondContact ND2-CD1 3.37Å; N223-Y288 VanDerWaalsContact ND2-CG 3.27Å; N223-W320 VanDerWaalsContact OD1-CZ2 3.25Å; N223-W320 WeakPolarHBondContact OD1-CZ2 3.33Å; N223-W320 PolarHBondContact OD1-NE1 3.19Å; N223-W320 VanDerWaalsContact OD1-NE1 3.12Å
224	L	92.5	Very high	94.5	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.149	C	C	.	.	S	Bend	trans	54.3	-2.1	-172.1	-64.2	-179.1	0	0	0	117.3	A222 Y277 A281 Q284 T285 W320 H323	A222-L224 PolarHBondContact O-N 3.31Å; L224-Y277 HydrophobicContact CD2-CE2 4.28Å; L224-Y277 PolarHBondContact O-OH 2.98Å; L224-A281 HydrophobicContact CB-CB 3.88Å; L224-A281 HydrophobicContact CD1-CB 4.1Å; L224-Q284 HydrophobicContact CD1-CB 4.23Å; L224-Q284 HydrophobicContact CD1-CG 4.18Å; L224-T285 HydrophobicContact CB-CG2 3.76Å; L224-W320 HydrophobicContact CD1-CE3 4.37Å; L224-W320 HydrophobicContact CD1-CH2 4.06Å; L224-W320 HydrophobicContact CD1-CZ2 4.24Å; L224-W320 HydrophobicContact CD1-CZ3 4.15Å; L224-W320 HydrophobicContact CD2-CE3 4.42Å; L224-W320 HydrophobicContact CD2-CH2 3.24Å; L224-W320 HydrophobicContact CD2-CZ2 4.09Å; L224-W320 HydrophobicContact CD2-CZ3 3.47Å; L224-W320 VanDerWaalsContact CD2-CZ3 3.47Å; L224-W320 HydrophobicContact CG-CE3 4.48Å; L224-W320 HydrophobicContact CG-CH2 3.32Å; L224-W320 HydrophobicContact CG-CZ2 3.62Å; L224-W320 HydrophobicContact CG-CZ3 3.82Å; L224-H323 HydrophobicContact CD1-CB 4.15Å
225	G	93.1	Very high	94.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.146	C	C	.	.			trans	65	84.7	172.6	0	0	0	0	0	113.4	L220 N223 V227 Q228 S229	L220-G225 CarbonylContact O-C 3.57Å; N223-G225 PolarHBondContact O-N 3.24Å; G225-V227 VanDerWaalsContact C-N 3.35Å; G225-V227 PolarHBondContact O-N 2.87Å; G225-Q228 PolarHBondContact O-N 3.15Å; G225-S229 VanDerWaalsContact O-CB 3.32Å; G225-S229 WeakPolarHBondContact O-CB 3.34Å; G225-S229 PolarHBondContact O-N 3.11Å; G225-S229 PolarHBondContact O-OG 3.02Å
226	L	95.2	Very high	94.8	Very high	20 Å²	20	27.5 Å²	27.5	11%	0.105	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-47.1	175.6	-179.5	61.8	0	0	0	111.4	L220 S229 I230 L282 T285 L289	L220-L226 HydrophobicContact CD2-CB 4.5Å; L220-L226 HydrophobicContact CD2-CD2 3.91Å; L220-L226 PolarHBondContact O-N 3.16Å; L226-S229 PolarHBondContact O-N 3.35Å; L226-I230 HydrophobicContact CD1-CD1 4.17Å; L226-I230 HydrophobicContact CD1-CG1 4.48Å; L226-I230 HydrophobicContact CG-CD1 4.09Å; L226-I230 WeakPolarHBondContact O-CG1 3.13Å; L226-I230 PolarHBondContact O-N 2.98Å; L226-L282 HydrophobicContact CD1-CD2 3.7Å; L226-T285 WeakPolarHBondContact CD1-OG1 3.49Å; L226-L289 HydrophobicContact CD2-CD2 3.97Å
227	V	96.2	Very high	94.9	Very high	51 Å²	51	30.2 Å²	30.2	31%	0.309	16%	0.157	S	C	.	.	H	α-helix	trans	-62.5	-47.5	179.9	174.7	0	0	0	0	110.1	L220 F221 G225 S229 I230 V231	L220-V227 HydrophobicContact CB-CG2 4.01Å; L220-V227 HydrophobicContact CD2-CG2 4.3Å; L220-V227 PolarHBondContact O-N 2.9Å; F221-V227 HydrophobicContact CD1-CB 4.26Å; F221-V227 HydrophobicContact CE1-CB 3.89Å; F221-V227 HydrophobicContact CE1-CG1 3.88Å; F221-V227 HydrophobicContact CE1-CG2 4.07Å; F221-V227 HydrophobicContact CZ-CB 4.36Å; F221-V227 HydrophobicContact CZ-CG1 4.38Å; F221-V227 HydrophobicContact CZ-CG2 4.04Å; G225-V227 VanDerWaalsContact C-N 3.35Å; G225-V227 PolarHBondContact O-N 2.87Å; V227-S229 VanDerWaalsContact C-N 3.3Å; V227-S229 PolarHBondContact O-N 2.75Å; V227-I230 PolarHBondContact O-N 2.86Å; V227-V231 HydrophobicContact CG1-CG2 4.48Å; V227-V231 VanDerWaalsContact O-CG2 3.3Å; V227-V231 WeakPolarHBondContact O-CG2 3.5Å; V227-V231 PolarHBondContact O-N 3.44Å
228	Q	96.5	Very high	94.8	Very high	5 Å²	5	29.3 Å²	29.3	2%	0.023	16%	0.158	C	C	.	.	H	α-helix	trans	-59.6	-42.9	176.9	-65.7	91.1	-30.1	0	0	111.2	S144 N145 L148 L220 F221 G225 I230 V231 I232	S144-Q228 PolarHBondContact OG-NE2 3.18Å; N145-Q228 WeakPolarHBondContact OD1-CG 3.44Å; N145-Q228 PolarHBondContact OD1-NE2 3.21Å; L148-Q228 HydrophobicContact CD2-CG 4.42Å; L220-Q228 PolarHBondContact O-OE1 3.5Å; F221-Q228 PolarHBondContact O-NE2 3.32Å; G225-Q228 PolarHBondContact O-N 3.15Å; Q228-I230 PolarHBondContact O-N 3.42Å; Q228-V231 PolarHBondContact O-N 3.21Å; Q228-I232 WeakPolarHBondContact O-CB 3.2Å; Q228-I232 WeakPolarHBondContact O-CD1 3.14Å; Q228-I232 WeakPolarHBondContact O-CG1 3.4Å; Q228-I232 PolarHBondContact O-N 3.22Å
229	S	95.8	Very high	94.7	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.8	-44.5	179.2	-63.2	0	0	0	0	112	G225 L226 V227 I232 V233	G225-S229 VanDerWaalsContact O-CB 3.32Å; G225-S229 WeakPolarHBondContact O-CB 3.34Å; G225-S229 PolarHBondContact O-N 3.11Å; G225-S229 PolarHBondContact O-OG 3.02Å; L226-S229 PolarHBondContact O-N 3.35Å; V227-S229 VanDerWaalsContact C-N 3.3Å; V227-S229 PolarHBondContact O-N 2.75Å; S229-I232 PolarHBondContact O-N 2.92Å; S229-V233 WeakPolarHBondContact O-CG2 3.29Å; S229-V233 PolarHBondContact O-N 3.25Å
230	I	96.3	Very high	94.8	Very high	83 Å²	83	32.5 Å²	32.5	43%	0.426	17%	0.174	S	C	.	.	H	α-helix	trans	-62.4	-45.8	175.5	-67.1	167.5	0	0	0	110.7	L226 V227 Q228 I232 V233 I234 L282	L226-I230 HydrophobicContact CD1-CD1 4.17Å; L226-I230 HydrophobicContact CD1-CG1 4.48Å; L226-I230 HydrophobicContact CG-CD1 4.09Å; L226-I230 WeakPolarHBondContact O-CG1 3.13Å; L226-I230 PolarHBondContact O-N 2.98Å; V227-I230 PolarHBondContact O-N 2.86Å; Q228-I230 PolarHBondContact O-N 3.42Å; I230-I232 VanDerWaalsContact C-N 3.33Å; I230-I232 PolarHBondContact O-N 3.5Å; I230-V233 WeakPolarHBondContact O-CB 3.34Å; I230-V233 PolarHBondContact O-N 3.37Å; I230-I234 HydrophobicContact CG2-CD1 4.19Å; I230-I234 WeakPolarHBondContact O-CG1 3.32Å; I230-I234 PolarHBondContact O-N 3.27Å; I230-I234 VanDerWaalsContact O-N 3.1Å; I230-L282 HydrophobicContact CG1-CD2 4.23Å
231	V	97	Very high	94.6	Very high	54 Å²	54	33.6 Å²	33.6	33%	0.327	18%	0.183	S	C	.	.	H	α-helix	trans	-64.4	-39	178.5	-179.5	0	0	0	0	111	L148 V227 Q228 V233 I234 V235	L148-V231 HydrophobicContact CD1-CB 4.07Å; L148-V231 HydrophobicContact CD1-CG1 3.51Å; L148-V231 HydrophobicContact CD2-CG1 4.31Å; V227-V231 HydrophobicContact CG1-CG2 4.48Å; V227-V231 VanDerWaalsContact O-CG2 3.3Å; V227-V231 WeakPolarHBondContact O-CG2 3.5Å; V227-V231 PolarHBondContact O-N 3.44Å; Q228-V231 PolarHBondContact O-N 3.21Å; V231-V233 VanDerWaalsContact C-N 3.3Å; V231-V233 PolarHBondContact O-N 2.91Å; V231-I234 PolarHBondContact O-N 3.36Å; V231-V235 HydrophobicContact CG1-CG2 4.21Å; V231-V235 VanDerWaalsContact O-CG2 3.3Å; V231-V235 WeakPolarHBondContact O-CG2 3.43Å; V231-V235 PolarHBondContact O-N 3.41Å
232	I	96.8	Very high	94.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-58.5	-42.8	174.3	-71.5	159.3	0	0	0	110.6	I147 L148 Q228 S229 I230 V235 N236 Y277 V278	I147-I232 HydrophobicContact CB-CD1 4.15Å; I147-I232 HydrophobicContact CG2-CD1 3.64Å; I147-I232 HydrophobicContact CG2-CG1 4.27Å; L148-I232 HydrophobicContact CB-CD1 4.28Å; L148-I232 HydrophobicContact CB-CG1 3.96Å; L148-I232 HydrophobicContact CD1-CG1 3.98Å; Q228-I232 WeakPolarHBondContact O-CB 3.2Å; Q228-I232 WeakPolarHBondContact O-CD1 3.14Å; Q228-I232 WeakPolarHBondContact O-CG1 3.4Å; Q228-I232 PolarHBondContact O-N 3.22Å; S229-I232 PolarHBondContact O-N 2.92Å; I230-I232 VanDerWaalsContact C-N 3.33Å; I230-I232 PolarHBondContact O-N 3.5Å; I232-V235 PolarHBondContact O-N 2.64Å; I232-N236 WeakPolarHBondContact CG2-ND2 3.39Å; I232-N236 VanDerWaalsContact O-CB 3.25Å; I232-N236 WeakPolarHBondContact O-CB 3.43Å; I232-N236 VanDerWaalsContact O-CG 3.26Å; I232-N236 PolarHBondContact O-N 3.11Å; I232-N236 PolarHBondContact O-ND2 3.47Å; I232-Y277 HydrophobicContact CD1-CD1 4.49Å; I232-V278 HydrophobicContact CB-CG2 4.02Å; I232-V278 HydrophobicContact CG2-CG2 3.6Å
233	V	96.5	Very high	94.3	Very high	41 Å²	41	38.5 Å²	38.5	25%	0.248	20%	0.202	C	C	.	.	H	α-helix	trans	-58.5	-50	175.4	171.3	0	0	0	0	110.9	S229 I230 V231 V235 N236 I237 V278 L282	S229-V233 WeakPolarHBondContact O-CG2 3.29Å; S229-V233 PolarHBondContact O-N 3.25Å; I230-V233 WeakPolarHBondContact O-CB 3.34Å; I230-V233 PolarHBondContact O-N 3.37Å; V231-V233 VanDerWaalsContact C-N 3.3Å; V231-V233 PolarHBondContact O-N 2.91Å; V233-V235 VanDerWaalsContact C-N 3.34Å; V233-V235 PolarHBondContact O-N 2.86Å; V233-N236 PolarHBondContact O-N 3.42Å; V233-I237 HydrophobicContact CG1-CD1 3.67Å; V233-I237 HydrophobicContact CG1-CG1 4.33Å; V233-I237 VanDerWaalsContact O-CG1 3.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.48Å; V233-I237 PolarHBondContact O-N 3.33Å; V233-V278 HydrophobicContact CG2-CB 4.42Å; V233-V278 HydrophobicContact CG2-CG1 3.41Å; V233-V278 VanDerWaalsContact CG2-CG1 3.41Å; V233-V278 HydrophobicContact CG2-CG2 4.21Å; V233-L282 HydrophobicContact CG2-CD1 4.45Å
234	I	96.7	Very high	94.2	Very high	98 Å²	98	42.1 Å²	42.1	50%	0.503	22%	0.22	S	C	.	.	H	α-helix	trans	-59.1	-47.1	179.9	-64.4	167.7	0	0	0	110.5	I230 V231 N236 I237 T238	I230-I234 HydrophobicContact CG2-CD1 4.19Å; I230-I234 WeakPolarHBondContact O-CG1 3.32Å; I230-I234 PolarHBondContact O-N 3.27Å; I230-I234 VanDerWaalsContact O-N 3.1Å; V231-I234 PolarHBondContact O-N 3.36Å; I234-N236 PolarHBondContact O-N 2.88Å; I234-I237 PolarHBondContact O-N 2.99Å; I234-T238 WeakPolarHBondContact O-CB 3.16Å; I234-T238 PolarHBondContact O-N 3.49Å; I234-T238 PolarHBondContact O-OG1 3.5Å
235	V	96.1	Very high	94.1	Very high	19 Å²	19	46.1 Å²	46.1	12%	0.115	24%	0.24	C	C	.	.	H	α-helix	trans	-63.6	-41	179.1	174	0	0	0	0	111.4	L148 A151 I152 C155 V231 I232 V233 T238 F239	L148-V235 HydrophobicContact CD1-CG2 4.47Å; A151-V235 HydrophobicContact CB-CB 4.45Å; A151-V235 HydrophobicContact CB-CG1 3.8Å; A151-V235 WeakPolarHBondContact O-CG1 3.33Å; I152-V235 HydrophobicContact CG1-CG1 4.34Å; I152-V235 HydrophobicContact CG1-CG2 4.1Å; C155-V235 HydrophobicContact CB-CG1 3.91Å; V231-V235 HydrophobicContact CG1-CG2 4.21Å; V231-V235 VanDerWaalsContact O-CG2 3.3Å; V231-V235 WeakPolarHBondContact O-CG2 3.43Å; V231-V235 PolarHBondContact O-N 3.41Å; I232-V235 PolarHBondContact O-N 2.64Å; V233-V235 VanDerWaalsContact C-N 3.34Å; V233-V235 PolarHBondContact O-N 2.86Å; V235-T238 WeakPolarHBondContact O-CB 3.32Å; V235-T238 PolarHBondContact O-N 2.72Å; V235-F239 WeakPolarHBondContact O-CB 3.46Å; V235-F239 PolarHBondContact O-N 2.94Å
236	N	95	Very high	93.7	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-42.7	178.1	-79.7	-17.7	0	0	0	112.2	I232 V233 I234 T238 F239 I240 L271 S274 M275	I232-N236 WeakPolarHBondContact CG2-ND2 3.39Å; I232-N236 VanDerWaalsContact O-CB 3.25Å; I232-N236 WeakPolarHBondContact O-CB 3.43Å; I232-N236 VanDerWaalsContact O-CG 3.26Å; I232-N236 PolarHBondContact O-N 3.11Å; I232-N236 PolarHBondContact O-ND2 3.47Å; V233-N236 PolarHBondContact O-N 3.42Å; I234-N236 PolarHBondContact O-N 2.88Å; N236-T238 VanDerWaalsContact C-N 3.31Å; N236-T238 PolarHBondContact O-N 2.8Å; N236-F239 WeakPolarHBondContact O-CB 3.33Å; N236-F239 PolarHBondContact O-N 3.07Å; N236-I240 WeakPolarHBondContact O-CB 3.09Å; N236-I240 VanDerWaalsContact O-CG1 3.23Å; N236-I240 WeakPolarHBondContact O-CG1 3.36Å; N236-I240 PolarHBondContact O-N 2.87Å; N236-L271 HydrophobicContact CB-CD1 3.73Å; N236-L271 VanDerWaalsContact CG-CD1 3.44Å; N236-L271 WeakPolarHBondContact OD1-CD1 3.28Å; N236-S274 PolarHBondContact ND2-OG 3.28Å; N236-S274 PolarHBondContact OD1-OG 3.14Å; N236-M275 HydrophobicContact CB-SD 4.1Å; N236-M275 PolarHBondContact ND2-SD 3.5Å; N236-M275 VanDerWaalsContact ND2-SD 3.43Å
237	I	94.9	Very high	93.1	Very high	98 Å²	98	51.2 Å²	51.2	50%	0.503	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-45	173.6	-69.4	169.3	0	0	0	110.3	V233 I234 F239 I240 T241	V233-I237 HydrophobicContact CG1-CD1 3.67Å; V233-I237 HydrophobicContact CG1-CG1 4.33Å; V233-I237 VanDerWaalsContact O-CG1 3.32Å; V233-I237 WeakPolarHBondContact O-CG1 3.48Å; V233-I237 PolarHBondContact O-N 3.33Å; I234-I237 PolarHBondContact O-N 2.99Å; I237-F239 PolarHBondContact O-N 2.58Å; I237-I240 PolarHBondContact O-N 3.48Å; I237-T241 WeakPolarHBondContact O-CB 3.03Å; I237-T241 PolarHBondContact O-N 3.39Å; I237-T241 PolarHBondContact O-OG1 2.85Å
238	T	94.3	Very high	92.6	Very high	45 Å²	45	55.3 Å²	55.3	28%	0.276	28%	0.281	S	S	.	.	H	α-helix	trans	-59.9	-46	177	-56.1	0	0	0	0	111.3	Y159 I234 V235 N236 R242	Y159-T238 HydrophobicContact CE2-CG2 3.79Å; Y159-T238 WeakPolarHBondContact OH-CG2 3.4Å; I234-T238 WeakPolarHBondContact O-CB 3.16Å; I234-T238 PolarHBondContact O-N 3.49Å; I234-T238 PolarHBondContact O-OG1 3.5Å; V235-T238 WeakPolarHBondContact O-CB 3.32Å; V235-T238 PolarHBondContact O-N 2.72Å; N236-T238 VanDerWaalsContact C-N 3.31Å; N236-T238 PolarHBondContact O-N 2.8Å; T238-R242 PolarHBondContact O-N 2.79Å; T238-R242 VanDerWaalsContact O-N 3.12Å
239	F	92.3	Very high	92	Very high	3 Å²	3	65 Å²	65	1%	0.013	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-50.3	175.1	170.5	-88.9	0	0	0	112.1	R154 C155 I158 V235 N236 I237 T241 R242 F243 L271	R154-F239 HydrophobicContact CB-CD2 4.41Å; R154-F239 HydrophobicContact CB-CE2 4.26Å; C155-F239 HydrophobicContact CB-CB 4.5Å; I158-F239 HydrophobicContact CD1-CD2 3.64Å; I158-F239 HydrophobicContact CD1-CE2 3.07Å; I158-F239 HydrophobicContact CD1-CZ 3.58Å; I158-F239 HydrophobicContact CG1-CD2 4.25Å; I158-F239 HydrophobicContact CG1-CE2 3.81Å; V235-F239 WeakPolarHBondContact O-CB 3.46Å; V235-F239 PolarHBondContact O-N 2.94Å; N236-F239 WeakPolarHBondContact O-CB 3.33Å; N236-F239 PolarHBondContact O-N 3.07Å; I237-F239 PolarHBondContact O-N 2.58Å; F239-T241 PolarHBondContact O-N 2.82Å; F239-R242 PolarHBondContact O-N 3.5Å; F239-F243 VanDerWaalsContact O-CB 3.25Å; F239-F243 WeakPolarHBondContact O-CB 3.25Å; F239-F243 PolarHBondContact O-N 3.33Å; F239-L271 HydrophobicContact CD1-CD1 4.3Å; F239-L271 HydrophobicContact CD1-CD2 4.2Å; F239-L271 HydrophobicContact CE1-CD2 4.06Å
240	I	92.7	Very high	91.1	Very high	63 Å²	63	66.4 Å²	66.4	32%	0.323	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-47.4	-179.4	-70.3	164.3	0	0	0	110.3	N236 I237 R242 F243 I244 L271	N236-I240 WeakPolarHBondContact O-CB 3.09Å; N236-I240 VanDerWaalsContact O-CG1 3.23Å; N236-I240 WeakPolarHBondContact O-CG1 3.36Å; N236-I240 PolarHBondContact O-N 2.87Å; I237-I240 PolarHBondContact O-N 3.48Å; I240-R242 VanDerWaalsContact C-N 3.35Å; I240-R242 PolarHBondContact O-N 2.97Å; I240-F243 PolarHBondContact O-N 3.24Å; I240-I244 HydrophobicContact CG2-CD1 3.72Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.28Å; I240-I244 PolarHBondContact O-N 2.81Å; I240-L271 HydrophobicContact CD1-CD1 4.25Å; I240-L271 HydrophobicContact CD1-CD2 3.98Å; I240-L271 HydrophobicContact CG1-CD1 4.32Å; I240-L271 HydrophobicContact CG1-CD2 3.67Å
241	T	92.5	Very high	89.9	Confident	70 Å²	70	72.3 Å²	72.3	43%	0.429	34%	0.342	S	S	.	.	H	α-helix	trans	-58.1	-48.2	-179.1	-57.8	0	0	0	0	110.8	I237 F239 I244 I245	I237-T241 WeakPolarHBondContact O-CB 3.03Å; I237-T241 PolarHBondContact O-N 3.39Å; I237-T241 PolarHBondContact O-OG1 2.85Å; F239-T241 PolarHBondContact O-N 2.82Å; T241-I244 PolarHBondContact O-N 3.29Å; T241-I245 HydrophobicContact CG2-CD1 4.11Å; T241-I245 VanDerWaalsContact O-CG1 3.3Å; T241-I245 WeakPolarHBondContact O-CG1 3.3Å; T241-I245 PolarHBondContact O-N 3.1Å; T241-I245 VanDerWaalsContact O-N 3.13Å
242	R	89.6	Confident	88.3	Confident	112 Å²	112	78.1 Å²	78.1	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-67.7	-39.9	176.4	-76.6	-53	-173.4	174.5	-3.5	113.7	I158 Y159 T238 F239 I240 I244 I245 Q246	I158-R242 HydrophobicContact CG2-CB 4.05Å; Y159-R242 HydrophobicContact CD2-CG 4.08Å; Y159-R242 HydrophobicContact CE1-CG 3.88Å; Y159-R242 HydrophobicContact CE2-CB 4.08Å; Y159-R242 HydrophobicContact CE2-CG 3.31Å; Y159-R242 WeakPolarHBondContact OH-CG 3.21Å; Y159-R242 PolarHBondContact OH-NE 3.05Å; T238-R242 PolarHBondContact O-N 2.79Å; T238-R242 VanDerWaalsContact O-N 3.12Å; F239-R242 PolarHBondContact O-N 3.5Å; I240-R242 VanDerWaalsContact C-N 3.35Å; I240-R242 PolarHBondContact O-N 2.97Å; R242-I244 VanDerWaalsContact C-N 3.29Å; R242-I244 PolarHBondContact O-N 3.21Å; R242-I245 PolarHBondContact O-N 3.31Å; R242-Q246 WeakPolarHBondContact O-CB 3.42Å; R242-Q246 PolarHBondContact O-N 3.4Å
243	F	88.9	Confident	86.5	Confident	44 Å²	44	83.6 Å²	83.6	19%	0.193	40%	0.399	C	S	.	.	H	α-helix	trans	-58.8	-43.2	177.2	-179	-103.4	0	0	0	111.2	I158 F239 I240 Q246 T247 I264 I268	I158-F243 HydrophobicContact CD1-CB 4.22Å; I158-F243 HydrophobicContact CD1-CD2 3.91Å; F239-F243 VanDerWaalsContact O-CB 3.25Å; F239-F243 WeakPolarHBondContact O-CB 3.25Å; F239-F243 PolarHBondContact O-N 3.33Å; I240-F243 PolarHBondContact O-N 3.24Å; F243-Q246 PolarHBondContact O-N 3.38Å; F243-T247 HydrophobicContact CD1-CG2 4.32Å; F243-T247 HydrophobicContact CD2-CG2 4.29Å; F243-T247 HydrophobicContact CE1-CG2 3.94Å; F243-T247 HydrophobicContact CE2-CG2 3.9Å; F243-T247 HydrophobicContact CG-CG2 4.49Å; F243-T247 HydrophobicContact CZ-CG2 3.71Å; F243-T247 WeakPolarHBondContact O-CB 3.37Å; F243-T247 VanDerWaalsContact O-CG2 3.25Å; F243-T247 WeakPolarHBondContact O-CG2 3.4Å; F243-T247 PolarHBondContact O-N 3.18Å; F243-T247 PolarHBondContact O-OG1 3.44Å; F243-I264 HydrophobicContact CE2-CG1 4.28Å; F243-I264 HydrophobicContact CE2-CG2 3.76Å; F243-I264 HydrophobicContact CZ-CG2 3.66Å; F243-I268 HydrophobicContact CZ-CD1 4.29Å
244	I	89.6	Confident	84.4	Confident	76 Å²	76	85.9 Å²	85.9	39%	0.39	41%	0.408	S	S	.	.	H	α-helix	trans	-63.2	-45.3	175.5	-67.2	167.6	0	0	0	111.2	I240 T241 R242 T247 K248	I240-I244 HydrophobicContact CG2-CD1 3.72Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.28Å; I240-I244 PolarHBondContact O-N 2.81Å; T241-I244 PolarHBondContact O-N 3.29Å; R242-I244 VanDerWaalsContact C-N 3.29Å; R242-I244 PolarHBondContact O-N 3.21Å; I244-T247 WeakPolarHBondContact CA-OG1 3.4Å; I244-T247 PolarHBondContact O-OG1 2.99Å; I244-K248 HydrophobicContact CG2-CD 4.23Å; I244-K248 WeakPolarHBondContact O-CB 3.49Å; I244-K248 WeakPolarHBondContact O-CG 3.15Å; I244-K248 PolarHBondContact O-N 2.79Å
245	I	89.2	Confident	82.7	Confident	85 Å²	85	84.8 Å²	84.8	44%	0.436	42%	0.421	S	S	.	.	H	α-helix	trans	-62	-46.4	179.1	-67.8	165.2	0	0	0	110.9	T241 R242 K248 R249	T241-I245 HydrophobicContact CG2-CD1 4.11Å; T241-I245 VanDerWaalsContact O-CG1 3.3Å; T241-I245 WeakPolarHBondContact O-CG1 3.3Å; T241-I245 PolarHBondContact O-N 3.1Å; T241-I245 VanDerWaalsContact O-N 3.13Å; R242-I245 PolarHBondContact O-N 3.31Å; I245-K248 PolarHBondContact O-N 3.28Å; I245-R249 PolarHBondContact O-N 2.89Å
246	Q	85	Confident	80.9	Confident	84 Å²	84	88.5 Å²	88.5	39%	0.393	44%	0.437	S	S	.	.	H	α-helix	trans	-67	-43.4	-178.6	-174.7	177	2.2	0	0	111.8	R242 F243 K248 R249 T250	R242-Q246 WeakPolarHBondContact O-CB 3.42Å; R242-Q246 PolarHBondContact O-N 3.4Å; F243-Q246 PolarHBondContact O-N 3.38Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 3.01Å; Q246-R249 PolarHBondContact O-N 2.78Å; Q246-T250 VanDerWaalsContact O-CB 3.27Å; Q246-T250 WeakPolarHBondContact O-CB 3.24Å; Q246-T250 PolarHBondContact O-N 3.07Å; Q246-T250 PolarHBondContact O-OG1 3.01Å
247	T	83.4	Confident	79.9	Confident	44 Å²	44	93.8 Å²	93.8	27%	0.27	47%	0.465	S	S	.	.	H	α-helix	trans	-62.9	-41.1	177	49.9	0	0	0	0	111.4	F243 I244 T250 R251	F243-T247 HydrophobicContact CD1-CG2 4.32Å; F243-T247 HydrophobicContact CD2-CG2 4.29Å; F243-T247 HydrophobicContact CE1-CG2 3.94Å; F243-T247 HydrophobicContact CE2-CG2 3.9Å; F243-T247 HydrophobicContact CG-CG2 4.49Å; F243-T247 HydrophobicContact CZ-CG2 3.71Å; F243-T247 WeakPolarHBondContact O-CB 3.37Å; F243-T247 VanDerWaalsContact O-CG2 3.25Å; F243-T247 WeakPolarHBondContact O-CG2 3.4Å; F243-T247 PolarHBondContact O-N 3.18Å; F243-T247 PolarHBondContact O-OG1 3.44Å; I244-T247 WeakPolarHBondContact CA-OG1 3.4Å; I244-T247 PolarHBondContact O-OG1 2.99Å; T247-T250 PolarHBondContact O-N 3.47Å; T247-R251 WeakPolarHBondContact O-CG 3.43Å; T247-R251 PolarHBondContact O-N 2.69Å
248	K	86.5	Confident	78.8	Confident	137 Å²	137	98.4 Å²	98.4	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-44.9	173.2	-75.6	-178.8	179.2	-175.4	0	112.4	I244 I245 Q246 T250	I244-K248 HydrophobicContact CG2-CD 4.23Å; I244-K248 WeakPolarHBondContact O-CB 3.49Å; I244-K248 WeakPolarHBondContact O-CG 3.15Å; I244-K248 PolarHBondContact O-N 2.79Å; I245-K248 PolarHBondContact O-N 3.28Å; Q246-K248 VanDerWaalsContact C-N 3.34Å; Q246-K248 PolarHBondContact O-N 3.01Å; K248-T250 VanDerWaalsContact C-N 3.32Å; K248-T250 PolarHBondContact O-N 3.24Å
249	R	83.2	Confident	77.6	Confident	209 Å²	209	105.1 Å²	105.1	79%	0.789	51%	0.507	S	S	*	.	H	α-helix	trans	-65.7	-35	179.1	-170.3	174.9	-178.6	175.8	0.9	112.8	I245 Q246	I245-R249 PolarHBondContact O-N 2.89Å; Q246-R249 PolarHBondContact O-N 2.78Å
250	T	77.4	Confident	76.6	Confident	29 Å²	29	108.2 Å²	108.2	18%	0.178	52%	0.521	C	S	.	.	H	α-helix	trans	-91.6	-15.7	-172	-47.5	0	0	0	0	113.1	Q246 T247 K248 H252 T253 M254	Q246-T250 VanDerWaalsContact O-CB 3.27Å; Q246-T250 WeakPolarHBondContact O-CB 3.24Å; Q246-T250 PolarHBondContact O-N 3.07Å; Q246-T250 PolarHBondContact O-OG1 3.01Å; T247-T250 PolarHBondContact O-N 3.47Å; K248-T250 VanDerWaalsContact C-N 3.32Å; K248-T250 PolarHBondContact O-N 3.24Å; T250-H252 PolarHBondContact O-N 3.39Å; T250-T253 PolarHBondContact O-N 3.33Å; T250-M254 HydrophobicContact CG2-CB 3.8Å; T250-M254 HydrophobicContact CG2-CG 3.56Å; T250-M254 HydrophobicContact CG2-SD 3.24Å; T250-M254 WeakPolarHBondContact CG2-SD 3.12Å; T250-M254 PolarHBondContact O-N 3.5Å
251	R	70.7	Confident	75.8	Confident	206 Å²	206	110.2 Å²	110.2	78%	0.777	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-29.3	177	-96.5	-179.2	-172.7	-171	1.6	113.5	T247	T247-R251 WeakPolarHBondContact O-CG 3.43Å; T247-R251 PolarHBondContact O-N 2.69Å
252	H	62.1	Low	74.9	Confident	177 Å²	177	113.4 Å²	113.4	82%	0.819	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-9.1	-179.2	-65.2	-72.9	0	0	0	114.3	T250	T250-H252 PolarHBondContact O-N 3.39Å
253	T	60.8	Low	74.2	Confident	115 Å²	115	111.8 Å²	111.8	71%	0.706	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	-3.8	-164.3	0.9	0	0	0	0	116.6	T250	T250-T253 PolarHBondContact O-N 3.33Å
254	M	51.2	Low	73.7	Confident	89 Å²	89	111.5 Å²	111.5	44%	0.438	54%	0.538	S	S	.	.			trans	-130.4	120.1	-176.5	-78.9	-176.8	129.6	0	0	114.7	T250 H256 E260	T250-M254 HydrophobicContact CG2-CB 3.8Å; T250-M254 HydrophobicContact CG2-CG 3.56Å; T250-M254 HydrophobicContact CG2-SD 3.24Å; T250-M254 WeakPolarHBondContact CG2-SD 3.12Å; T250-M254 PolarHBondContact O-N 3.5Å; M254-H256 PolarHBondContact O-N 3.17Å; M254-E260 WeakPolarHBondContact CE-OE1 3.01Å; M254-E260 WeakPolarHBondContact CE-OE2 3.48Å
255	G	60.7	Low	73.3	Confident	75 Å²	75	110.8 Å²	110.8	77%	0.773	54%	0.539	S	S	*	.			trans	-65.5	103.2	141.6	0	0	0	0	0	107.8	N257	G255-N257 PolarHBondContact O-N 3.33Å
256	H	59.7	Low	72.9	Confident	96 Å²	96	107.4 Å²	107.4	44%	0.444	52%	0.522	S	S	.	.			trans	-58.5	116.6	-178.9	-82.3	-39.5	0	0	0	110.9	M254 E260	M254-H256 PolarHBondContact O-N 3.17Å; H256-E260 IonicContact ND1-OE2 3.75Å
257	N	73.1	Confident	72.8	Confident	112 Å²	112	103.5 Å²	103.5	60%	0.599	50%	0.504	S	S	*	.			trans	-60.8	140.2	170.7	-88.5	-32.2	0	0	0	109.5	G255 K259 E260 L261	G255-N257 PolarHBondContact O-N 3.33Å; N257-K259 PolarHBondContact O-N 2.96Å; N257-E260 HydrophobicContact CB-CG 4.36Å; N257-E260 PolarHBondContact O-N 3.01Å; N257-L261 PolarHBondContact O-N 2.83Å
258	K	72.5	Confident	72.8	Confident	196 Å²	196	105.2 Å²	105.2	85%	0.852	51%	0.51	S	S	*	.	H	α-helix	trans	-51	-30.1	-179.8	-71.1	-178.2	-179.7	174.2	0	113.6	K262	K258-K262 PolarHBondContact O-N 3.12Å
259	K	68.6	Low	72.7	Confident	186 Å²	186	99.7 Å²	99.7	81%	0.809	49%	0.487	S	S	*	.	H	α-helix	trans	-69.4	-41.4	177	-69.8	-176.6	-179.9	177.1	0	112.6	N257 K262 H263	N257-K259 PolarHBondContact O-N 2.96Å; K259-K262 WeakPolarHBondContact O-CB 3.22Å; K259-K262 PolarHBondContact O-N 3.39Å; K259-H263 PolarHBondContact O-N 2.97Å
260	E	71.4	Confident	72.8	Confident	67 Å²	67	90.5 Å²	90.5	31%	0.313	45%	0.454	S	S	.	.	H	α-helix	trans	-68.4	-45.1	179.1	-65.3	-177.3	160.4	0	0	111.2	M254 H256 N257 K262 H263 I264	M254-E260 WeakPolarHBondContact CE-OE1 3.01Å; M254-E260 WeakPolarHBondContact CE-OE2 3.48Å; H256-E260 IonicContact ND1-OE2 3.75Å; N257-E260 HydrophobicContact CB-CG 4.36Å; N257-E260 PolarHBondContact O-N 3.01Å; E260-K262 PolarHBondContact O-N 2.85Å; E260-H263 WeakPolarHBondContact O-CA 3.42Å; E260-H263 WeakPolarHBondContact O-CB 3.3Å; E260-H263 PolarHBondContact O-N 2.87Å; E260-I264 WeakPolarHBondContact O-CG1 3.4Å; E260-I264 PolarHBondContact O-N 3.39Å
261	L	75.4	Confident	73.5	Confident	105 Å²	105	90.4 Å²	90.4	55%	0.55	45%	0.452	S	S	.	.	H	α-helix	trans	-58.5	-38.6	176.3	-173.4	67.2	0	0	0	111.4	N257 I264 S265	N257-L261 PolarHBondContact O-N 2.83Å; L261-I264 PolarHBondContact O-N 2.9Å; L261-S265 WeakPolarHBondContact O-CB 3.4Å; L261-S265 PolarHBondContact O-N 3.4Å
262	K	74.7	Confident	74.4	Confident	137 Å²	137	82.3 Å²	82.3	60%	0.596	43%	0.429	S	S	*	.	H	α-helix	trans	-62.9	-45.7	173.9	-170.4	-177	178.2	-172.6	0	111.2	K258 K259 E260 S265 I266	K258-K262 PolarHBondContact O-N 3.12Å; K259-K262 WeakPolarHBondContact O-CB 3.22Å; K259-K262 PolarHBondContact O-N 3.39Å; E260-K262 PolarHBondContact O-N 2.85Å; K262-S265 PolarHBondContact O-N 3.3Å; K262-I266 HydrophobicContact CG-CD1 4.11Å; K262-I266 VanDerWaalsContact O-CD1 3.31Å; K262-I266 WeakPolarHBondContact O-CD1 3.46Å; K262-I266 WeakPolarHBondContact O-CG1 3.41Å; K262-I266 PolarHBondContact O-N 3.49Å
263	H	74.9	Confident	75.7	Confident	78 Å²	78	74.3 Å²	74.3	36%	0.361	39%	0.392	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.6	-170.2	-87.7	0	0	0	112.6	K259 E260 I266 S267	K259-H263 PolarHBondContact O-N 2.97Å; E260-H263 WeakPolarHBondContact O-CA 3.42Å; E260-H263 WeakPolarHBondContact O-CB 3.3Å; E260-H263 PolarHBondContact O-N 2.87Å; H263-I266 WeakPolarHBondContact O-CB 3.37Å; H263-I266 PolarHBondContact O-N 3.08Å; H263-S267 PolarHBondContact O-N 2.97Å; H263-S267 PolarHBondContact O-OG 2.88Å
264	I	78.4	Confident	77.3	Confident	39 Å²	39	68.9 Å²	68.9	20%	0.2	36%	0.359	C	S	.	.	H	α-helix	trans	-61.4	-47.6	175.9	-68.8	170.4	0	0	0	110.7	F243 E260 L261 I266 S267 I268	F243-I264 HydrophobicContact CE2-CG1 4.28Å; F243-I264 HydrophobicContact CE2-CG2 3.76Å; F243-I264 HydrophobicContact CZ-CG2 3.66Å; E260-I264 WeakPolarHBondContact O-CG1 3.4Å; E260-I264 PolarHBondContact O-N 3.39Å; L261-I264 PolarHBondContact O-N 2.9Å; I264-I266 VanDerWaalsContact C-N 3.31Å; I264-I266 PolarHBondContact O-N 2.86Å; I264-S267 PolarHBondContact O-N 2.85Å; I264-I268 HydrophobicContact CG2-CD1 3.76Å; I264-I268 HydrophobicContact CG2-CG1 4.44Å; I264-I268 WeakPolarHBondContact O-CG1 3.27Å; I264-I268 PolarHBondContact O-N 3.41Å
265	S	80.9	Confident	79.3	Confident	60 Å²	60	67.8 Å²	67.8	42%	0.42	35%	0.353	S	S	.	.	H	α-helix	trans	-59.3	-41.3	177.2	175.7	0	0	0	0	112.1	L261 K262 I268 I269	L261-S265 WeakPolarHBondContact O-CB 3.4Å; L261-S265 PolarHBondContact O-N 3.4Å; K262-S265 PolarHBondContact O-N 3.3Å; S265-I268 PolarHBondContact O-N 3.45Å; S265-I269 WeakPolarHBondContact O-CG1 3.43Å; S265-I269 PolarHBondContact O-N 3.36Å; S265-I269 VanDerWaalsContact O-N 3.13Å
266	I	79.9	Confident	80.9	Confident	14 Å²	14	64.9 Å²	64.9	7%	0.072	32%	0.321	C	S	.	.	H	α-helix	trans	-56.9	-51.3	173.6	-66.6	160.7	0	0	0	110.7	Q80 K262 H263 I264 I268 I269 L270 Y337	Q80-I266 HydrophobicContact CB-CG2 4.04Å; Q80-I266 HydrophobicContact CG-CG2 4.05Å; K262-I266 HydrophobicContact CG-CD1 4.11Å; K262-I266 VanDerWaalsContact O-CD1 3.31Å; K262-I266 WeakPolarHBondContact O-CD1 3.46Å; K262-I266 WeakPolarHBondContact O-CG1 3.41Å; K262-I266 PolarHBondContact O-N 3.49Å; H263-I266 WeakPolarHBondContact O-CB 3.37Å; H263-I266 PolarHBondContact O-N 3.08Å; I264-I266 VanDerWaalsContact C-N 3.31Å; I264-I266 PolarHBondContact O-N 2.86Å; I266-I268 VanDerWaalsContact C-N 3.33Å; I266-I268 PolarHBondContact O-N 2.96Å; I266-I269 PolarHBondContact O-N 3.03Å; I266-L270 HydrophobicContact CG2-CD1 3.71Å; I266-L270 WeakPolarHBondContact O-CG 3.49Å; I266-L270 PolarHBondContact O-N 3.32Å; I266-Y337 HydrophobicContact CB-CE2 4.1Å; I266-Y337 HydrophobicContact CD1-CE2 4.38Å; I266-Y337 HydrophobicContact CG1-CD2 4.48Å; I266-Y337 HydrophobicContact CG1-CE2 3.35Å; I266-Y337 WeakPolarHBondContact CG1-OH 3.34Å; I266-Y337 HydrophobicContact CG2-CE2 4.28Å; I266-Y337 WeakPolarHBondContact CG2-OH 3.07Å
267	S	82.5	Confident	82.5	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-35.2	-175.3	-62.4	0	0	0	0	113	R154 H263 I264 L271	R154-S267 PolarHBondContact NH1-O 3.25Å; R154-S267 VanDerWaalsContact NH1-O 3.09Å; H263-S267 PolarHBondContact O-N 2.97Å; H263-S267 PolarHBondContact O-OG 2.88Å; I264-S267 PolarHBondContact O-N 2.85Å; S267-L271 WeakPolarHBondContact O-CB 3.17Å; S267-L271 PolarHBondContact O-N 3.11Å
268	I	84.5	Confident	83.6	Confident	79 Å²	79	55.2 Å²	55.2	41%	0.405	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-43.4	175.8	-68	169	0	0	0	111.1	F243 I264 S265 I266 L271 A272	F243-I268 HydrophobicContact CZ-CD1 4.29Å; I264-I268 HydrophobicContact CG2-CD1 3.76Å; I264-I268 HydrophobicContact CG2-CG1 4.44Å; I264-I268 WeakPolarHBondContact O-CG1 3.27Å; I264-I268 PolarHBondContact O-N 3.41Å; S265-I268 PolarHBondContact O-N 3.45Å; I266-I268 VanDerWaalsContact C-N 3.33Å; I266-I268 PolarHBondContact O-N 2.96Å; I268-L271 WeakPolarHBondContact O-CB 3.37Å; I268-L271 PolarHBondContact O-N 3.12Å; I268-L271 VanDerWaalsContact O-N 3.15Å; I268-A272 PolarHBondContact O-N 3.04Å
269	I	84.7	Confident	84.6	Confident	22 Å²	22	51.6 Å²	51.6	11%	0.113	26%	0.262	C	S	.	.	H	α-helix	trans	-64.6	-43.7	178.7	-69	168.9	0	0	0	110.6	S265 I266 L271 A272 F273 M333 I336 Y337	S265-I269 WeakPolarHBondContact O-CG1 3.43Å; S265-I269 PolarHBondContact O-N 3.36Å; S265-I269 VanDerWaalsContact O-N 3.13Å; I266-I269 PolarHBondContact O-N 3.03Å; I269-L271 PolarHBondContact O-N 3.19Å; I269-A272 PolarHBondContact O-N 3.27Å; I269-F273 WeakPolarHBondContact O-CB 3.29Å; I269-F273 PolarHBondContact O-N 3.09Å; I269-M333 HydrophobicContact CG2-CB 4.17Å; I269-M333 HydrophobicContact CG2-SD 4.11Å; I269-I336 HydrophobicContact CD1-CG2 4.35Å; I269-Y337 HydrophobicContact CD1-CD2 3.8Å; I269-Y337 HydrophobicContact CD1-CG 4.12Å; I269-Y337 HydrophobicContact CG2-CG 4.45Å
270	L	85.7	Confident	85.9	Confident	16 Å²	16	43.3 Å²	43.3	8%	0.084	23%	0.227	C	C	.	.	H	α-helix	trans	-64.9	-29.1	175	-71.3	164.7	0	0	0	112.4	Q80 R154 I266 S274	Q80-L270 HydrophobicContact CB-CD1 3.82Å; Q80-L270 HydrophobicContact CG-CD1 3.89Å; R154-L270 HydrophobicContact CG-CD1 4.46Å; R154-L270 PolarHBondContact NH2-O 3.33Å; I266-L270 HydrophobicContact CG2-CD1 3.71Å; I266-L270 WeakPolarHBondContact O-CG 3.49Å; I266-L270 PolarHBondContact O-N 3.32Å; L270-S274 WeakPolarHBondContact O-CB 3.48Å; L270-S274 PolarHBondContact O-N 3.37Å; L270-S274 PolarHBondContact O-OG 2.98Å; L270-S274 VanDerWaalsContact O-OG 3.09Å
271	L	90.6	Very high	87	Confident	26 Å²	26	40.1 Å²	40.1	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-50.2	174	175.5	67	0	0	0	109.1	N236 F239 I240 S267 I268 I269 F273 S274 M275	N236-L271 HydrophobicContact CB-CD1 3.73Å; N236-L271 VanDerWaalsContact CG-CD1 3.44Å; N236-L271 WeakPolarHBondContact OD1-CD1 3.28Å; F239-L271 HydrophobicContact CD1-CD1 4.3Å; F239-L271 HydrophobicContact CD1-CD2 4.2Å; F239-L271 HydrophobicContact CE1-CD2 4.06Å; I240-L271 HydrophobicContact CD1-CD1 4.25Å; I240-L271 HydrophobicContact CD1-CD2 3.98Å; I240-L271 HydrophobicContact CG1-CD1 4.32Å; I240-L271 HydrophobicContact CG1-CD2 3.67Å; S267-L271 WeakPolarHBondContact O-CB 3.17Å; S267-L271 PolarHBondContact O-N 3.11Å; I268-L271 WeakPolarHBondContact O-CB 3.37Å; I268-L271 PolarHBondContact O-N 3.12Å; I268-L271 VanDerWaalsContact O-N 3.15Å; I269-L271 PolarHBondContact O-N 3.19Å; L271-F273 VanDerWaalsContact C-N 3.31Å; L271-F273 PolarHBondContact O-N 3Å; L271-S274 WeakPolarHBondContact CA-OG 3.46Å; L271-S274 PolarHBondContact O-N 2.77Å; L271-S274 VanDerWaalsContact O-N 3.17Å; L271-S274 PolarHBondContact O-OG 3.15Å; L271-M275 HydrophobicContact CD1-CG 4.2Å; L271-M275 HydrophobicContact CG-CG 4.43Å; L271-M275 WeakPolarHBondContact O-CB 2.99Å; L271-M275 WeakPolarHBondContact O-CG 3Å; L271-M275 PolarHBondContact O-N 3.12Å
272	A	90.4	Very high	87.9	Confident	36 Å²	36	37.3 Å²	37.3	30%	0.298	20%	0.198	S	C	.	.	H	α-helix	trans	-58.7	-42.5	176.8	0	0	0	0	0	112	I268 I269 M275 S276 M333	I268-A272 PolarHBondContact O-N 3.04Å; I269-A272 PolarHBondContact O-N 3.27Å; A272-M275 PolarHBondContact O-N 3.4Å; A272-S276 VanDerWaalsContact O-CB 3.3Å; A272-S276 WeakPolarHBondContact O-CB 3.02Å; A272-S276 PolarHBondContact O-N 2.96Å; A272-M333 HydrophobicContact CB-CE 3.38Å; A272-M333 HydrophobicContact CB-SD 4.43Å
273	F	89.9	Confident	88.8	Confident	10 Å²	10	34.1 Å²	34.1	4%	0.044	19%	0.191	C	C	.	.	H	α-helix	trans	-57.3	-51.9	173	-178.4	-78.6	0	0	0	111.6	L87 I147 I269 L271 M275 S276 Y277 R326 D330	L87-F273 HydrophobicContact CD2-CD1 4.3Å; L87-F273 HydrophobicContact CD2-CE1 3.32Å; L87-F273 HydrophobicContact CD2-CE2 4.37Å; L87-F273 HydrophobicContact CD2-CZ 3.35Å; L87-F273 HydrophobicContact CG-CE1 4.49Å; L87-F273 HydrophobicContact CG-CZ 4.22Å; I147-F273 HydrophobicContact CD1-CE1 3.88Å; I147-F273 HydrophobicContact CG1-CE1 4.01Å; I269-F273 WeakPolarHBondContact O-CB 3.29Å; I269-F273 PolarHBondContact O-N 3.09Å; L271-F273 VanDerWaalsContact C-N 3.31Å; L271-F273 PolarHBondContact O-N 3Å; F273-M275 VanDerWaalsContact C-N 3.33Å; F273-M275 PolarHBondContact O-N 2.92Å; F273-S276 PolarHBondContact O-N 3.5Å; F273-Y277 PolarHBondContact O-N 2.94Å; F273-R326 VanDerWaalsContact CZ-NH1 3.35Å; F273-D330 HydrophobicContact CD2-CB 4.43Å; F273-D330 WeakPolarHBondContact CD2-OD1 3.29Å; F273-D330 HydrophobicContact CE2-CB 4.07Å; F273-D330 WeakPolarHBondContact CE2-OD1 3.39Å; F273-D330 WeakPolarHBondContact CE2-OD2 3.26Å
274	S	93.2	Very high	89.8	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-35.1	-179.6	61.8	0	0	0	0	113.1	R154 N236 L270 L271 Y277 V278	R154-S274 PolarHBondContact NH2-OG 3.32Å; N236-S274 PolarHBondContact ND2-OG 3.28Å; N236-S274 PolarHBondContact OD1-OG 3.14Å; L270-S274 WeakPolarHBondContact O-CB 3.48Å; L270-S274 PolarHBondContact O-N 3.37Å; L270-S274 PolarHBondContact O-OG 2.98Å; L270-S274 VanDerWaalsContact O-OG 3.09Å; L271-S274 WeakPolarHBondContact CA-OG 3.46Å; L271-S274 PolarHBondContact O-N 2.77Å; L271-S274 VanDerWaalsContact O-N 3.17Å; L271-S274 PolarHBondContact O-OG 3.15Å; S274-Y277 WeakPolarHBondContact O-CB 3.45Å; S274-Y277 PolarHBondContact O-N 3.12Å; S274-V278 WeakPolarHBondContact O-CG2 3.43Å; S274-V278 PolarHBondContact O-N 3.04Å; S274-V278 VanDerWaalsContact O-N 3.11Å
275	M	93.4	Very high	90.5	Very high	66 Å²	66	28.7 Å²	28.7	33%	0.325	17%	0.165	S	C	.	.	H	α-helix	trans	-69.8	-40.6	175.1	-70.4	-56.7	-60.9	0	0	111.4	N236 L271 A272 F273 Y277 V278 L279	N236-M275 HydrophobicContact CB-SD 4.1Å; N236-M275 PolarHBondContact ND2-SD 3.5Å; N236-M275 VanDerWaalsContact ND2-SD 3.43Å; L271-M275 HydrophobicContact CD1-CG 4.2Å; L271-M275 HydrophobicContact CG-CG 4.43Å; L271-M275 WeakPolarHBondContact O-CB 2.99Å; L271-M275 WeakPolarHBondContact O-CG 3Å; L271-M275 PolarHBondContact O-N 3.12Å; A272-M275 PolarHBondContact O-N 3.4Å; F273-M275 VanDerWaalsContact C-N 3.33Å; F273-M275 PolarHBondContact O-N 2.92Å; M275-Y277 VanDerWaalsContact C-N 3.3Å; M275-Y277 PolarHBondContact O-N 3.3Å; M275-V278 PolarHBondContact O-N 3.14Å; M275-L279 WeakPolarHBondContact O-CB 3.44Å; M275-L279 VanDerWaalsContact O-CG 3.25Å; M275-L279 WeakPolarHBondContact O-CG 2.87Å; M275-L279 PolarHBondContact O-N 3.05Å
276	S	93.4	Very high	91.2	Very high	14 Å²	14	28.9 Å²	28.9	10%	0.098	16%	0.163	C	C	.	.	H	α-helix	trans	-61.8	-40	175.7	-168.3	0	0	0	0	111.6	A272 F273 T280 R326	A272-S276 VanDerWaalsContact O-CB 3.3Å; A272-S276 WeakPolarHBondContact O-CB 3.02Å; A272-S276 PolarHBondContact O-N 2.96Å; F273-S276 PolarHBondContact O-N 3.5Å; S276-T280 PolarHBondContact O-N 2.01Å; S276-T280 PolarHBondContact O-OG1 2.93Å; S276-R326 VanDerWaalsContact OG-CG 3.31Å; S276-R326 WeakPolarHBondContact OG-CG 3.37Å
277	Y	94.3	Very high	91.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.6	-56.8	170.8	179.7	-86.9	0	0	0	111.5	T143 S144 I147 L224 I232 F273 S274 M275 L279 T280 A281 H323	T143-Y277 HydrophobicContact CG2-CE2 3.88Å; S144-Y277 WeakPolarHBondContact CB-OH 3.37Å; I147-Y277 HydrophobicContact CD1-CD1 4.08Å; I147-Y277 HydrophobicContact CD1-CD2 3.24Å; I147-Y277 HydrophobicContact CD1-CE1 4.44Å; I147-Y277 HydrophobicContact CD1-CE2 3.66Å; I147-Y277 HydrophobicContact CD1-CG 3.49Å; I147-Y277 VanDerWaalsContact CD1-CG 3.49Å; L224-Y277 HydrophobicContact CD2-CE2 4.28Å; L224-Y277 PolarHBondContact O-OH 2.98Å; I232-Y277 HydrophobicContact CD1-CD1 4.49Å; F273-Y277 PolarHBondContact O-N 2.94Å; S274-Y277 WeakPolarHBondContact O-CB 3.45Å; S274-Y277 PolarHBondContact O-N 3.12Å; M275-Y277 VanDerWaalsContact C-N 3.3Å; M275-Y277 PolarHBondContact O-N 3.3Å; Y277-L279 VanDerWaalsContact C-N 3.32Å; Y277-L279 PolarHBondContact O-N 3.21Å; Y277-T280 PolarHBondContact O-N 3.35Å; Y277-T280 VanDerWaalsContact O-N 3.09Å; Y277-T280 PolarHBondContact O-OG1 3.29Å; Y277-A281 HydrophobicContact CD1-CB 4.09Å; Y277-A281 HydrophobicContact CE1-CB 3.72Å; Y277-A281 WeakPolarHBondContact O-CB 3.24Å; Y277-A281 PolarHBondContact O-N 3.06Å; Y277-H323 AromaticContact CD2-CE1 3.55Å; Y277-H323 AromaticContact CE2-CE1 3.54Å
278	V	95.5	Very high	92.4	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.03	17%	0.173	C	C	.	.	H	α-helix	trans	-57	-43.1	-178	166.9	0	0	0	0	112.2	I232 V233 S274 M275 T280 A281 L282	I232-V278 HydrophobicContact CB-CG2 4.02Å; I232-V278 HydrophobicContact CG2-CG2 3.6Å; V233-V278 HydrophobicContact CG2-CB 4.42Å; V233-V278 HydrophobicContact CG2-CG1 3.41Å; V233-V278 VanDerWaalsContact CG2-CG1 3.41Å; V233-V278 HydrophobicContact CG2-CG2 4.21Å; S274-V278 WeakPolarHBondContact O-CG2 3.43Å; S274-V278 PolarHBondContact O-N 3.04Å; S274-V278 VanDerWaalsContact O-N 3.11Å; M275-V278 PolarHBondContact O-N 3.14Å; V278-T280 PolarHBondContact O-N 3.5Å; V278-A281 PolarHBondContact O-N 3.17Å; V278-L282 HydrophobicContact CG1-CD1 3.48Å; V278-L282 VanDerWaalsContact CG1-CD1 3.48Å; V278-L282 HydrophobicContact CG1-CG 3.88Å; V278-L282 WeakPolarHBondContact O-CB 3.31Å; V278-L282 PolarHBondContact O-N 3.14Å
279	L	94.7	Very high	92.8	Very high	119 Å²	119	28.3 Å²	28.3	62%	0.623	16%	0.161	S	C	*	.	H	α-helix	trans	-60.6	-31.8	-179.9	-75.1	170.2	0	0	0	112.6	M275 Y277 P283	M275-L279 WeakPolarHBondContact O-CB 3.44Å; M275-L279 VanDerWaalsContact O-CG 3.25Å; M275-L279 WeakPolarHBondContact O-CG 2.87Å; M275-L279 PolarHBondContact O-N 3.05Å; Y277-L279 VanDerWaalsContact C-N 3.32Å; Y277-L279 PolarHBondContact O-N 3.21Å; L279-P283 WeakPolarHBondContact O-CD 3.22Å; L279-P283 WeakPolarHBondContact O-CG 3.39Å
280	T	94.5	Very high	93.2	Very high	12 Å²	12	31.3 Å²	31.3	7%	0.074	18%	0.177	C	C	.	.	H	α-helix	trans	-88.8	-35.2	175.8	62.1	0	0	0	0	113.1	S276 Y277 V278 L322 H323 R326	S276-T280 PolarHBondContact O-N 2.01Å; S276-T280 PolarHBondContact O-OG1 2.93Å; Y277-T280 PolarHBondContact O-N 3.35Å; Y277-T280 VanDerWaalsContact O-N 3.09Å; Y277-T280 PolarHBondContact O-OG1 3.29Å; V278-T280 PolarHBondContact O-N 3.5Å; T280-L322 HydrophobicContact CG2-CG 4.06Å; T280-H323 PolarHBondContact OG1-ND1 2.89Å; T280-R326 HydrophobicContact CG2-CB 4.32Å
281	A	94.7	Very high	93.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-74.4	-44.2	-176.1	0	0	0	0	0	112.9	L224 Y277 V278 Q284 T285	L224-A281 HydrophobicContact CB-CB 3.88Å; L224-A281 HydrophobicContact CD1-CB 4.1Å; Y277-A281 HydrophobicContact CD1-CB 4.09Å; Y277-A281 HydrophobicContact CE1-CB 3.72Å; Y277-A281 WeakPolarHBondContact O-CB 3.24Å; Y277-A281 PolarHBondContact O-N 3.06Å; V278-A281 PolarHBondContact O-N 3.17Å; A281-Q284 PolarHBondContact O-N 3.06Å; A281-T285 WeakPolarHBondContact O-CB 3.49Å; A281-T285 VanDerWaalsContact O-CG2 3.29Å; A281-T285 WeakPolarHBondContact O-CG2 3.48Å; A281-T285 PolarHBondContact O-N 3.06Å; A281-T285 PolarHBondContact O-OG1 3.31Å
282	L	94.6	Very high	93.3	Very high	47 Å²	47	29.6 Å²	29.6	25%	0.246	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-49.3	-175.3	-73	179.2	0	0	0	113.3	L226 I230 V233 V278 Q284 T285 T286	L226-L282 HydrophobicContact CD1-CD2 3.7Å; I230-L282 HydrophobicContact CG1-CD2 4.23Å; V233-L282 HydrophobicContact CG2-CD1 4.45Å; V278-L282 HydrophobicContact CG1-CD1 3.48Å; V278-L282 VanDerWaalsContact CG1-CD1 3.48Å; V278-L282 HydrophobicContact CG1-CG 3.88Å; V278-L282 WeakPolarHBondContact O-CB 3.31Å; V278-L282 PolarHBondContact O-N 3.14Å; L282-Q284 VanDerWaalsContact C-N 3.34Å; L282-Q284 PolarHBondContact O-N 2.98Å; L282-T285 PolarHBondContact O-N 2.86Å; L282-T285 PolarHBondContact O-OG1 2.71Å; L282-T285 VanDerWaalsContact O-OG1 3.1Å; L282-T286 VanDerWaalsContact O-CB 3.28Å; L282-T286 WeakPolarHBondContact O-CB 3.46Å; L282-T286 PolarHBondContact O-N 3.23Å; L282-T286 PolarHBondContact O-OG1 3.39Å
283	P	94.3	Very high	93.3	Very high	70 Å²	70	31.1 Å²	31.1	46%	0.455	17%	0.17	S	C	.	.	H	α-helix	trans	-61.9	-43.4	178.4	-22.6	34.8	0	0	0	111.9	L279 T286 V287	L279-P283 WeakPolarHBondContact O-CD 3.22Å; L279-P283 WeakPolarHBondContact O-CG 3.39Å; P283-T286 PolarHBondContact O-N 3.14Å; P283-V287 VanDerWaalsContact O-CG2 3.31Å; P283-V287 WeakPolarHBondContact O-CG2 3.45Å; P283-V287 PolarHBondContact O-N 3.4Å
284	Q	94.5	Very high	93.1	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.009	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-50.2	-179.7	-175.8	-83.7	-25.3	0	0	111.9	N223 L224 A281 L282 V287 Y288 A316	N223-Q284 PolarHBondContact ND2-NE2 3.39Å; N223-Q284 PolarHBondContact ND2-OE1 2.98Å; N223-Q284 PolarHBondContact OD1-NE2 3.31Å; L224-Q284 HydrophobicContact CD1-CB 4.23Å; L224-Q284 HydrophobicContact CD1-CG 4.18Å; A281-Q284 PolarHBondContact O-N 3.06Å; L282-Q284 VanDerWaalsContact C-N 3.34Å; L282-Q284 PolarHBondContact O-N 2.98Å; Q284-V287 PolarHBondContact O-N 3.34Å; Q284-Y288 WeakPolarHBondContact O-CB 3.33Å; Q284-Y288 PolarHBondContact O-N 2.88Å; Q284-A316 VanDerWaalsContact CG-O 3.27Å; Q284-A316 WeakPolarHBondContact CG-O 3.37Å
285	T	95	Very high	92.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-36.6	-178.7	50.4	0	0	0	0	112.9	N223 L224 L226 A281 L282 Y288 L289	N223-T285 WeakPolarHBondContact O-CG2 3.25Å; L224-T285 HydrophobicContact CB-CG2 3.76Å; L226-T285 WeakPolarHBondContact CD1-OG1 3.49Å; A281-T285 WeakPolarHBondContact O-CB 3.49Å; A281-T285 VanDerWaalsContact O-CG2 3.29Å; A281-T285 WeakPolarHBondContact O-CG2 3.48Å; A281-T285 PolarHBondContact O-N 3.06Å; A281-T285 PolarHBondContact O-OG1 3.31Å; L282-T285 PolarHBondContact O-N 2.86Å; L282-T285 PolarHBondContact O-OG1 2.71Å; L282-T285 VanDerWaalsContact O-OG1 3.1Å; T285-Y288 PolarHBondContact O-N 2.94Å; T285-L289 WeakPolarHBondContact O-CB 3.5Å; T285-L289 PolarHBondContact O-N 3.43Å
286	T	94.3	Very high	92.2	Very high	64 Å²	64	41.4 Å²	41.4	39%	0.393	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-47.7	177.3	-56.4	0	0	0	0	110.7	L282 P283 Y288 L289 L290	L282-T286 VanDerWaalsContact O-CB 3.28Å; L282-T286 WeakPolarHBondContact O-CB 3.46Å; L282-T286 PolarHBondContact O-N 3.23Å; L282-T286 PolarHBondContact O-OG1 3.39Å; P283-T286 PolarHBondContact O-N 3.14Å; T286-Y288 VanDerWaalsContact C-N 3.33Å; T286-Y288 PolarHBondContact O-N 3.43Å; T286-L289 PolarHBondContact O-N 3.02Å; T286-L290 HydrophobicContact CG2-CD1 4.2Å; T286-L290 VanDerWaalsContact O-CG 3.3Å; T286-L290 WeakPolarHBondContact O-CG 3.5Å; T286-L290 PolarHBondContact O-N 3.15Å
287	V	94.8	Very high	91.7	Very high	34 Å²	34	45.6 Å²	45.6	21%	0.206	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-41.6	177.4	173.5	0	0	0	0	111.1	P283 Q284 L290 A291 M312 L315 A316	P283-V287 VanDerWaalsContact O-CG2 3.31Å; P283-V287 WeakPolarHBondContact O-CG2 3.45Å; P283-V287 PolarHBondContact O-N 3.4Å; Q284-V287 PolarHBondContact O-N 3.34Å; V287-L290 PolarHBondContact O-N 3.31Å; V287-A291 PolarHBondContact O-N 2.91Å; V287-M312 HydrophobicContact CG1-CB 4.33Å; V287-M312 WeakPolarHBondContact CG1-O 3.4Å; V287-M312 HydrophobicContact CG1-SD 4.14Å; V287-L315 HydrophobicContact CG1-CB 3.8Å; V287-A316 HydrophobicContact CG1-CB 4.23Å
288	Y	93.3	Very high	90.4	Very high	20 Å²	20	49 Å²	49	8%	0.078	26%	0.259	C	S	.	.	H	α-helix	trans	-64.7	-40.2	177.8	-161.3	-111.2	0	0	0	112.6	W206 T219 N223 Q284 T285 T286 A291 F292 Y313 A316	W206-Y288 VanDerWaalsContact CH2-OH 3.28Å; W206-Y288 WeakPolarHBondContact CH2-OH 3.04Å; T219-Y288 HydrophobicContact CG2-CD1 3.94Å; N223-Y288 HydrophobicContact CB-CD1 4.29Å; N223-Y288 HydrophobicContact CB-CE1 4.31Å; N223-Y288 WeakPolarHBondContact ND2-CB 3.34Å; N223-Y288 WeakPolarHBondContact ND2-CD1 3.37Å; N223-Y288 VanDerWaalsContact ND2-CG 3.27Å; Q284-Y288 WeakPolarHBondContact O-CB 3.33Å; Q284-Y288 PolarHBondContact O-N 2.88Å; T285-Y288 PolarHBondContact O-N 2.94Å; T286-Y288 VanDerWaalsContact C-N 3.33Å; T286-Y288 PolarHBondContact O-N 3.43Å; Y288-A291 WeakPolarHBondContact O-CB 3.42Å; Y288-A291 PolarHBondContact O-N 2.79Å; Y288-F292 HydrophobicContact CD1-CD2 4.07Å; Y288-F292 AromaticContact CD1-CE2 3.5Å; Y288-F292 HydrophobicContact CD1-CE2 3.5Å; Y288-F292 VanDerWaalsContact CD1-CE2 3.5Å; Y288-F292 HydrophobicContact CD1-CZ 4.31Å; Y288-F292 HydrophobicContact CE1-CD2 4.12Å; Y288-F292 AromaticContact CE1-CE2 3.12Å; Y288-F292 HydrophobicContact CE1-CE2 3.12Å; Y288-F292 AromaticContact CE1-CZ 3.58Å; Y288-F292 HydrophobicContact CE1-CZ 3.58Å; Y288-F292 HydrophobicContact CE2-CZ 4.47Å; Y288-F292 HydrophobicContact CG-CE2 4.41Å; Y288-F292 AromaticContact CZ-CE2 3.66Å; Y288-F292 AromaticContact CZ-CZ 3.61Å; Y288-F292 PolarHBondContact O-N 3.38Å; Y288-Y313 AromaticContact CD2-CD1 3.92Å; Y288-Y313 HydrophobicContact CD2-CD1 3.92Å; Y288-Y313 HydrophobicContact CD2-CE1 4.05Å; Y288-Y313 AromaticContact CE2-CD1 3.64Å; Y288-Y313 HydrophobicContact CE2-CD1 3.64Å; Y288-Y313 AromaticContact CE2-CE1 3.64Å; Y288-Y313 HydrophobicContact CE2-CE1 3.64Å; Y288-A316 HydrophobicContact CD2-CB 3.73Å; Y288-A316 HydrophobicContact CG-CB 4.36Å
289	L	93.7	Very high	88.9	Confident	31 Å²	31	58.4 Å²	58.4	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-63.8	-44.3	175	-177.8	60	0	0	0	111.2	I216 T219 L226 T285 T286 A291 F292 L293	I216-L289 HydrophobicContact CG2-CD1 4.41Å; T219-L289 HydrophobicContact CG2-CB 3.7Å; T219-L289 HydrophobicContact CG2-CD1 4.17Å; T219-L289 HydrophobicContact CG2-CG 4.48Å; L226-L289 HydrophobicContact CD2-CD2 3.97Å; T285-L289 WeakPolarHBondContact O-CB 3.5Å; T285-L289 PolarHBondContact O-N 3.43Å; T286-L289 PolarHBondContact O-N 3.02Å; L289-A291 VanDerWaalsContact C-N 3.29Å; L289-A291 PolarHBondContact O-N 3.48Å; L289-F292 PolarHBondContact O-N 3.07Å; L289-L293 HydrophobicContact CD1-CD1 4.36Å; L289-L293 HydrophobicContact CD1-CG 4.3Å; L289-L293 HydrophobicContact CG-CD1 4.01Å; L289-L293 HydrophobicContact CG-CG 4.37Å; L289-L293 WeakPolarHBondContact O-CG 3.48Å; L289-L293 PolarHBondContact O-N 3.42Å
290	L	92.4	Very high	87.5	Confident	84 Å²	84	58 Å²	58	44%	0.44	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-40.1	175.9	-70.7	172.2	0	0	0	111.2	T286 V287 F292 L293 W294	T286-L290 HydrophobicContact CG2-CD1 4.2Å; T286-L290 VanDerWaalsContact O-CG 3.3Å; T286-L290 WeakPolarHBondContact O-CG 3.5Å; T286-L290 PolarHBondContact O-N 3.15Å; V287-L290 PolarHBondContact O-N 3.31Å; L290-F292 PolarHBondContact O-N 2.88Å; L290-L293 PolarHBondContact O-N 3.45Å; L290-W294 WeakPolarHBondContact O-CB 3.34Å; L290-W294 PolarHBondContact O-N 3.17Å
291	A	90.1	Very high	86.1	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.6	-45.8	175.5	0	0	0	0	0	112.1	V287 Y288 L289 S295 M312 Y313	V287-A291 PolarHBondContact O-N 2.91Å; Y288-A291 WeakPolarHBondContact O-CB 3.42Å; Y288-A291 PolarHBondContact O-N 2.79Å; L289-A291 VanDerWaalsContact C-N 3.29Å; L289-A291 PolarHBondContact O-N 3.48Å; A291-S295 VanDerWaalsContact O-CB 3.26Å; A291-S295 WeakPolarHBondContact O-CB 3.17Å; A291-S295 PolarHBondContact O-N 3.19Å; A291-M312 HydrophobicContact CB-CB 3.69Å; A291-Y313 HydrophobicContact CB-CD1 4.04Å; A291-Y313 HydrophobicContact CB-CD2 4.42Å; A291-Y313 HydrophobicContact CB-CE1 3.81Å; A291-Y313 HydrophobicContact CB-CE2 4.23Å; A291-Y313 HydrophobicContact CB-CG 4.34Å
292	F	87.8	Confident	85.3	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.026	35%	0.354	C	S	.	.	H	α-helix	trans	-67.4	-45.9	177	-76.9	-51.5	0	0	0	113.5	W206 T219 Y288 L289 L290 W294 S295 H296 Y313	W206-F292 AromaticContact CE2-CZ 3.77Å; W206-F292 HydrophobicContact CH2-CZ 4.2Å; W206-F292 HydrophobicContact CZ2-CE1 4.02Å; W206-F292 HydrophobicContact CZ2-CE2 4.14Å; W206-F292 AromaticContact CZ2-CZ 3.3Å; W206-F292 HydrophobicContact CZ2-CZ 3.3Å; W206-F292 AromaticContact NE1-CE1 3.65Å; W206-F292 AromaticContact NE1-CZ 3.88Å; T219-F292 VanDerWaalsContact OG1-CD2 3.24Å; T219-F292 WeakPolarHBondContact OG1-CD2 3.48Å; T219-F292 WeakPolarHBondContact OG1-CE2 3.25Å; Y288-F292 HydrophobicContact CD1-CD2 4.07Å; Y288-F292 AromaticContact CD1-CE2 3.5Å; Y288-F292 HydrophobicContact CD1-CE2 3.5Å; Y288-F292 VanDerWaalsContact CD1-CE2 3.5Å; Y288-F292 HydrophobicContact CD1-CZ 4.31Å; Y288-F292 HydrophobicContact CE1-CD2 4.12Å; Y288-F292 AromaticContact CE1-CE2 3.12Å; Y288-F292 HydrophobicContact CE1-CE2 3.12Å; Y288-F292 AromaticContact CE1-CZ 3.58Å; Y288-F292 HydrophobicContact CE1-CZ 3.58Å; Y288-F292 HydrophobicContact CE2-CZ 4.47Å; Y288-F292 HydrophobicContact CG-CE2 4.41Å; Y288-F292 AromaticContact CZ-CE2 3.66Å; Y288-F292 AromaticContact CZ-CZ 3.61Å; Y288-F292 PolarHBondContact O-N 3.38Å; L289-F292 PolarHBondContact O-N 3.07Å; L290-F292 PolarHBondContact O-N 2.88Å; F292-W294 VanDerWaalsContact C-N 3.26Å; F292-W294 PolarHBondContact O-N 2.91Å; F292-S295 PolarHBondContact O-N 3.49Å; F292-H296 PolarHBondContact O-N 2.95Å; F292-H296 VanDerWaalsContact O-N 3.09Å; F292-Y313 WeakPolarHBondContact CD1-OH 3.36Å; F292-Y313 HydrophobicContact CE1-CE1 4.26Å; F292-Y313 WeakPolarHBondContact CE1-OH 3.34Å; F292-Y313 HydrophobicContact CZ-CE1 4.38Å
293	L	90	Very high	84.5	Confident	68 Å²	68	72.8 Å²	72.8	36%	0.356	38%	0.378	S	S	.	.	H	α-helix	trans	-59.3	-44.7	179.1	-68.9	175.1	0	0	0	110	F212 I216 L289 L290 H296 T297	F212-L293 HydrophobicContact CZ-CD2 4.16Å; I216-L293 HydrophobicContact CD1-CD2 4.24Å; L289-L293 HydrophobicContact CD1-CD1 4.36Å; L289-L293 HydrophobicContact CD1-CG 4.3Å; L289-L293 HydrophobicContact CG-CD1 4.01Å; L289-L293 HydrophobicContact CG-CG 4.37Å; L289-L293 WeakPolarHBondContact O-CG 3.48Å; L289-L293 PolarHBondContact O-N 3.42Å; L290-L293 PolarHBondContact O-N 3.45Å; L293-H296 PolarHBondContact O-N 2.73Å; L293-T297 VanDerWaalsContact O-CG2 3.3Å; L293-T297 WeakPolarHBondContact O-CG2 3.18Å; L293-T297 PolarHBondContact O-N 3.3Å; L293-T297 VanDerWaalsContact O-N 3.13Å; L293-T297 PolarHBondContact O-OG1 3.28Å; L293-T297 VanDerWaalsContact O-OG1 3.11Å
294	W	86.3	Confident	83.7	Confident	129 Å²	129	74.6 Å²	74.6	49%	0.489	38%	0.38	S	S	.	.	H	α-helix	trans	-65.7	-41.5	179.1	-153.7	-84.4	0	0	0	112.7	L290 F292 H296 T297 Y305	L290-W294 WeakPolarHBondContact O-CB 3.34Å; L290-W294 PolarHBondContact O-N 3.17Å; F292-W294 VanDerWaalsContact C-N 3.26Å; F292-W294 PolarHBondContact O-N 2.91Å; W294-H296 PolarHBondContact O-N 3.08Å; W294-T297 PolarHBondContact O-OG1 3.36Å; W294-T297 VanDerWaalsContact O-OG1 3.1Å; W294-Y305 AromaticContact NE1-CD1 3.89Å
295	S	84.8	Confident	83.1	Confident	57 Å²	57	78.3 Å²	78.3	40%	0.399	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-28.5	177.4	-174.6	0	0	0	0	113.1	A291 F292	A291-S295 VanDerWaalsContact O-CB 3.26Å; A291-S295 WeakPolarHBondContact O-CB 3.17Å; A291-S295 PolarHBondContact O-N 3.19Å; F292-S295 PolarHBondContact O-N 3.49Å
296	H	84.2	Confident	82.6	Confident	107 Å²	107	80.4 Å²	80.4	50%	0.495	41%	0.406	S	S	.	.	H	α-helix	trans	-91	-29.6	-177.7	-174.6	66.6	0	0	0	113.5	F212 F292 L293 W294 Q298	F212-H296 AromaticContact CD1-CD2 3.62Å; F212-H296 AromaticContact CD1-NE2 3.67Å; F212-H296 HydrophobicContact CD2-CB 3.85Å; F212-H296 AromaticContact CD2-CG 3.62Å; F212-H296 AromaticContact CD2-ND1 3.76Å; F212-H296 HydrophobicContact CE1-CB 4.32Å; F212-H296 AromaticContact CE1-CD2 3.39Å; F212-H296 WeakPolarHBondContact CE1-CD2 3.27Å; F212-H296 AromaticContact CE1-CG 3.88Å; F212-H296 AromaticContact CE1-NE2 3.92Å; F212-H296 HydrophobicContact CE2-CB 3.28Å; F212-H296 AromaticContact CE2-CD2 3.9Å; F212-H296 AromaticContact CE2-CG 3.48Å; F212-H296 VanDerWaalsContact CE2-CG 3.48Å; F212-H296 AromaticContact CG-CD2 3.93Å; F212-H296 AromaticContact CG-CE1 3.91Å; F212-H296 AromaticContact CG-CG 3.9Å; F212-H296 AromaticContact CG-ND1 3.89Å; F212-H296 AromaticContact CG-NE2 3.93Å; F212-H296 HydrophobicContact CZ-CB 3.54Å; F212-H296 AromaticContact CZ-CD2 3.54Å; F212-H296 AromaticContact CZ-CG 3.59Å; F292-H296 PolarHBondContact O-N 2.95Å; F292-H296 VanDerWaalsContact O-N 3.09Å; L293-H296 PolarHBondContact O-N 2.73Å; W294-H296 PolarHBondContact O-N 3.08Å; H296-Q298 PolarHBondContact O-N 3.42Å; H296-Q298 VanDerWaalsContact O-N 3.14Å
297	T	81.3	Confident	82.1	Confident	102 Å²	102	78.8 Å²	78.8	63%	0.626	40%	0.395	S	S	*	.	S	Bend	trans	-69	-9.7	-172.7	41.7	0	0	0	0	115.4	L293 W294	L293-T297 VanDerWaalsContact O-CG2 3.3Å; L293-T297 WeakPolarHBondContact O-CG2 3.18Å; L293-T297 PolarHBondContact O-N 3.3Å; L293-T297 VanDerWaalsContact O-N 3.13Å; L293-T297 PolarHBondContact O-OG1 3.28Å; L293-T297 VanDerWaalsContact O-OG1 3.11Å; W294-T297 PolarHBondContact O-OG1 3.36Å; W294-T297 VanDerWaalsContact O-OG1 3.1Å
298	Q	68	Low	81.8	Confident	71 Å²	71	81.5 Å²	81.5	33%	0.332	40%	0.402	S	S	.	.			trans	-132	113.8	-167.3	-159.7	149.7	-27.8	0	0	112.9	H296 V300 Y305	H296-Q298 PolarHBondContact O-N 3.42Å; H296-Q298 VanDerWaalsContact O-N 3.14Å; Q298-V300 VanDerWaalsContact C-N 3.34Å; Q298-V300 PolarHBondContact O-N 2.9Å; Q298-Y305 VanDerWaalsContact CD-CE1 3.44Å; Q298-Y305 PolarHBondContact NE2-OH 2.96Å
299	E	63.3	Low	81.6	Confident	204 Å²	204	81.4 Å²	81.4	95%	0.953	40%	0.403	S	S	*	.	S	Bend	trans	-71	-24.9	-178.1	-68.5	-177.7	169.9	0	0	113.6
300	V	65.6	Low	81.3	Confident	111 Å²	111	83.3 Å²	83.3	67%	0.673	41%	0.41	S	S	*	.	S	Bend	trans	-112.5	107.3	179.6	-175.4	0	0	0	0	109.4	Q298 D302	Q298-V300 VanDerWaalsContact C-N 3.34Å; Q298-V300 PolarHBondContact O-N 2.9Å; V300-D302 PolarHBondContact O-N 3.48Å
301	I	65.4	Low	81.3	Confident	120 Å²	120	79.5 Å²	79.5	62%	0.615	39%	0.39	S	S	*	.			trans	-80.8	96.5	174.4	-54.4	172.9	0	0	0	107.6	D306	I301-D306 HydrophobicContact CG2-CB 3.94Å
302	D	77.3	Confident	81.4	Confident	91 Å²	91	82.1 Å²	82.1	49%	0.487	40%	0.403	S	S	.	.			trans	-75.7	152.5	163.7	179	21	0	0	0	109.5	V300 E304 Y305 D306	V300-D302 PolarHBondContact O-N 3.48Å; D302-E304 PolarHBondContact O-N 3.28Å; D302-Y305 HydrophobicContact CB-CD2 3.81Å; D302-Y305 HydrophobicContact CB-CE2 4.34Å; D302-Y305 WeakPolarHBondContact O-CB 3.1Å; D302-Y305 PolarHBondContact O-N 3.49Å; D302-D306 PolarHBondContact O-N 3.11Å
303	E	77.1	Confident	81.6	Confident	158 Å²	158	84.7 Å²	84.7	74%	0.738	41%	0.413	S	S	*	.	H	α-helix	trans	-56.8	-38.2	-172.2	-72.4	-173.8	174.4	0	0	111.8	Y305 D306 V307	E303-Y305 VanDerWaalsContact C-N 3.27Å; E303-Y305 PolarHBondContact O-N 2.98Å; E303-D306 PolarHBondContact O-N 3.46Å; E303-V307 WeakPolarHBondContact O-CG2 3.21Å; E303-V307 PolarHBondContact O-N 3.36Å
304	E	79	Confident	81.8	Confident	107 Å²	107	82.4 Å²	82.4	50%	0.5	40%	0.401	S	S	.	.	H	α-helix	trans	-63.1	-34.1	177.2	-170.7	174.5	174.2	0	0	112.2	V33 D302 V307 W308	V33-E304 HydrophobicContact CG2-CG 4.44Å; D302-E304 PolarHBondContact O-N 3.28Å; E304-V307 PolarHBondContact O-N 3.08Å; E304-W308 PolarHBondContact O-N 3.48Å
305	Y	82.4	Confident	82.2	Confident	81 Å²	81	79.4 Å²	79.4	32%	0.318	39%	0.394	S	S	.	.	H	α-helix	trans	-71.7	-39.8	-179.3	-76.8	-96.9	0	0	0	112.4	W294 Q298 D302 E303 V307 W308 I309	W294-Y305 AromaticContact NE1-CD1 3.89Å; Q298-Y305 VanDerWaalsContact CD-CE1 3.44Å; Q298-Y305 PolarHBondContact NE2-OH 2.96Å; D302-Y305 HydrophobicContact CB-CD2 3.81Å; D302-Y305 HydrophobicContact CB-CE2 4.34Å; D302-Y305 WeakPolarHBondContact O-CB 3.1Å; D302-Y305 PolarHBondContact O-N 3.49Å; E303-Y305 VanDerWaalsContact C-N 3.27Å; E303-Y305 PolarHBondContact O-N 2.98Å; Y305-V307 PolarHBondContact O-N 2.92Å; Y305-W308 PolarHBondContact O-N 3.44Å; Y305-W308 VanDerWaalsContact O-N 3.17Å; Y305-I309 WeakPolarHBondContact O-CG1 3.21Å; Y305-I309 PolarHBondContact O-N 3.05Å
306	D	83	Confident	82.7	Confident	44 Å²	44	76.7 Å²	76.7	24%	0.235	38%	0.375	C	S	.	.	H	α-helix	trans	-59.8	-38.6	174.6	-178.9	57.5	0	0	0	111	Y13 I301 D302 E303 W308 I309 K310	Y13-D306 PolarHBondContact OH-OD1 3.37Å; I301-D306 HydrophobicContact CG2-CB 3.94Å; D302-D306 PolarHBondContact O-N 3.11Å; E303-D306 PolarHBondContact O-N 3.46Å; D306-W308 PolarHBondContact O-N 2.55Å; D306-I309 PolarHBondContact O-N 3.08Å; D306-K310 WeakPolarHBondContact O-CB 3.3Å; D306-K310 WeakPolarHBondContact O-CG 3.33Å; D306-K310 PolarHBondContact O-N 2.93Å; D306-K310 IonicContact OD1-NZ 2.69Å; D306-K310 WeakPolarHBondContact OD2-CE 3.43Å; D306-K310 IonicContact OD2-NZ 3.73Å; D306-K310 PolarHBondContact OD2-NZ 3.46Å
307	V	85.2	Confident	83.2	Confident	29 Å²	29	72.2 Å²	72.2	18%	0.176	36%	0.355	C	S	.	.	H	α-helix	trans	-63.2	-42.9	175.4	-177.5	0	0	0	0	111.5	V33 Q37 E303 E304 Y305 K310 L311	V33-V307 HydrophobicContact CB-CG1 4.45Å; V33-V307 HydrophobicContact CG1-CB 4.3Å; V33-V307 HydrophobicContact CG1-CG1 3.64Å; Q37-V307 HydrophobicContact CB-CG1 4.24Å; Q37-V307 HydrophobicContact CG-CG1 4.3Å; E303-V307 WeakPolarHBondContact O-CG2 3.21Å; E303-V307 PolarHBondContact O-N 3.36Å; E304-V307 PolarHBondContact O-N 3.08Å; Y305-V307 PolarHBondContact O-N 2.92Å; V307-K310 PolarHBondContact O-N 3.02Å; V307-L311 WeakPolarHBondContact O-CB 3.49Å; V307-L311 PolarHBondContact O-N 2.7Å
308	W	88.1	Confident	83.9	Confident	92 Å²	92	68.8 Å²	68.8	35%	0.348	33%	0.332	S	S	.	.	H	α-helix	trans	-63.6	-41.5	176.7	-82	111.1	0	0	0	112.9	V33 E304 Y305 D306 L311 M312	V33-W308 HydrophobicContact CB-CZ2 4.35Å; V33-W308 HydrophobicContact CG1-CD2 3.84Å; V33-W308 HydrophobicContact CG1-CE3 4.38Å; V33-W308 HydrophobicContact CG1-CG 4.15Å; V33-W308 HydrophobicContact CG1-CZ2 4Å; V33-W308 HydrophobicContact CG2-CH2 4.46Å; V33-W308 HydrophobicContact CG2-CZ2 3.5Å; V33-W308 VanDerWaalsContact CG2-CZ2 3.5Å; E304-W308 PolarHBondContact O-N 3.48Å; Y305-W308 PolarHBondContact O-N 3.44Å; Y305-W308 VanDerWaalsContact O-N 3.17Å; D306-W308 PolarHBondContact O-N 2.55Å; W308-L311 HydrophobicContact CE3-CD2 3.65Å; W308-L311 HydrophobicContact CZ3-CD2 3.58Å; W308-L311 WeakPolarHBondContact O-CB 3.46Å; W308-L311 PolarHBondContact O-N 2.98Å; W308-M312 WeakPolarHBondContact O-CG 3.47Å; W308-M312 PolarHBondContact O-N 3.1Å
309	I	88.3	Confident	85.2	Confident	17 Å²	17	65.8 Å²	65.8	9%	0.087	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-48.6	177.5	-68.5	166.5	0	0	0	110	Y305 D306 L311 M312 Y313	Y305-I309 WeakPolarHBondContact O-CG1 3.21Å; Y305-I309 PolarHBondContact O-N 3.05Å; D306-I309 PolarHBondContact O-N 3.08Å; I309-L311 VanDerWaalsContact C-N 3.27Å; I309-L311 PolarHBondContact O-N 3.1Å; I309-M312 PolarHBondContact O-N 3.19Å; I309-M312 VanDerWaalsContact O-N 3.16Å; I309-Y313 HydrophobicContact CG2-CD2 3.8Å; I309-Y313 HydrophobicContact CG2-CE2 3.48Å; I309-Y313 VanDerWaalsContact CG2-CE2 3.48Å; I309-Y313 VanDerWaalsContact O-CD2 3.29Å; I309-Y313 WeakPolarHBondContact O-CD2 3.31Å; I309-Y313 PolarHBondContact O-N 3.1Å; I309-Y313 VanDerWaalsContact O-N 3.08Å
310	K	88.7	Confident	86.8	Confident	71 Å²	71	56.3 Å²	56.3	31%	0.309	28%	0.276	S	S	.	.	H	α-helix	trans	-59	-38.6	175.4	-73.3	173.2	176.6	165.8	0	112.1	Y13 D306 V307 Y313 N314	Y13-K310 WeakPolarHBondContact OH-CE 3.25Å; D306-K310 WeakPolarHBondContact O-CB 3.3Å; D306-K310 WeakPolarHBondContact O-CG 3.33Å; D306-K310 PolarHBondContact O-N 2.93Å; D306-K310 IonicContact OD1-NZ 2.69Å; D306-K310 WeakPolarHBondContact OD2-CE 3.43Å; D306-K310 IonicContact OD2-NZ 3.73Å; D306-K310 PolarHBondContact OD2-NZ 3.46Å; V307-K310 PolarHBondContact O-N 3.02Å; K310-Y313 PolarHBondContact O-N 2.93Å; K310-N314 WeakPolarHBondContact O-CB 3.28Å; K310-N314 VanDerWaalsContact O-CG 3.3Å; K310-N314 PolarHBondContact O-N 3.3Å; K310-N314 PolarHBondContact O-ND2 2.95Å
311	L	91.2	Very high	88.2	Confident	4 Å²	4	51 Å²	51	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-60.9	-45.3	175.8	173.8	64.9	0	0	0	112	V36 Q37 V40 V307 W308 I309 N314 L315	V36-L311 HydrophobicContact CG1-CD1 4.08Å; V36-L311 HydrophobicContact CG1-CD2 4.04Å; Q37-L311 VanDerWaalsContact OE1-CB 3.24Å; V40-L311 HydrophobicContact CB-CD1 3.88Å; V40-L311 HydrophobicContact CG1-CD1 4.02Å; V40-L311 HydrophobicContact CG2-CD1 3.66Å; V307-L311 WeakPolarHBondContact O-CB 3.49Å; V307-L311 PolarHBondContact O-N 2.7Å; W308-L311 HydrophobicContact CE3-CD2 3.65Å; W308-L311 HydrophobicContact CZ3-CD2 3.58Å; W308-L311 WeakPolarHBondContact O-CB 3.46Å; W308-L311 PolarHBondContact O-N 2.98Å; I309-L311 VanDerWaalsContact C-N 3.27Å; I309-L311 PolarHBondContact O-N 3.1Å; L311-N314 PolarHBondContact O-N 3.2Å; L311-L315 HydrophobicContact CD1-CD1 4.28Å; L311-L315 HydrophobicContact CD1-CG 4.31Å; L311-L315 HydrophobicContact CG-CD1 4.22Å; L311-L315 WeakPolarHBondContact O-CB 3.41Å; L311-L315 WeakPolarHBondContact O-CG 3.34Å; L311-L315 PolarHBondContact O-N 2.95Å
312	M	92.6	Very high	89.6	Confident	55 Å²	55	48.8 Å²	48.8	27%	0.271	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-41.8	177.9	-66.7	-63.6	-179.7	0	0	112	V287 A291 W308 I309 L315 A316	V287-M312 HydrophobicContact CG1-CB 4.33Å; V287-M312 WeakPolarHBondContact CG1-O 3.4Å; V287-M312 HydrophobicContact CG1-SD 4.14Å; A291-M312 HydrophobicContact CB-CB 3.69Å; W308-M312 WeakPolarHBondContact O-CG 3.47Å; W308-M312 PolarHBondContact O-N 3.1Å; I309-M312 PolarHBondContact O-N 3.19Å; I309-M312 VanDerWaalsContact O-N 3.16Å; M312-L315 PolarHBondContact O-N 2.93Å; M312-L315 HydrophobicContact SD-CD1 4.28Å; M312-A316 PolarHBondContact O-N 3.07Å
313	Y	92.5	Very high	90.4	Very high	61 Å²	61	44.7 Å²	44.7	24%	0.239	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-45.2	174.4	-75.3	-60.2	0	0	0	112.3	Y288 A291 F292 I309 K310 L315 A316 D317	Y288-Y313 AromaticContact CD2-CD1 3.92Å; Y288-Y313 HydrophobicContact CD2-CD1 3.92Å; Y288-Y313 HydrophobicContact CD2-CE1 4.05Å; Y288-Y313 AromaticContact CE2-CD1 3.64Å; Y288-Y313 HydrophobicContact CE2-CD1 3.64Å; Y288-Y313 AromaticContact CE2-CE1 3.64Å; Y288-Y313 HydrophobicContact CE2-CE1 3.64Å; A291-Y313 HydrophobicContact CB-CD1 4.04Å; A291-Y313 HydrophobicContact CB-CD2 4.42Å; A291-Y313 HydrophobicContact CB-CE1 3.81Å; A291-Y313 HydrophobicContact CB-CE2 4.23Å; A291-Y313 HydrophobicContact CB-CG 4.34Å; F292-Y313 WeakPolarHBondContact CD1-OH 3.36Å; F292-Y313 HydrophobicContact CE1-CE1 4.26Å; F292-Y313 WeakPolarHBondContact CE1-OH 3.34Å; F292-Y313 HydrophobicContact CZ-CE1 4.38Å; I309-Y313 HydrophobicContact CG2-CD2 3.8Å; I309-Y313 HydrophobicContact CG2-CE2 3.48Å; I309-Y313 VanDerWaalsContact CG2-CE2 3.48Å; I309-Y313 VanDerWaalsContact O-CD2 3.29Å; I309-Y313 WeakPolarHBondContact O-CD2 3.31Å; I309-Y313 PolarHBondContact O-N 3.1Å; I309-Y313 VanDerWaalsContact O-N 3.08Å; K310-Y313 PolarHBondContact O-N 2.93Å; Y313-L315 VanDerWaalsContact C-N 3.31Å; Y313-L315 PolarHBondContact O-N 3.31Å; Y313-A316 WeakPolarHBondContact O-CB 3.41Å; Y313-A316 PolarHBondContact O-N 2.89Å; Y313-A316 VanDerWaalsContact O-N 3.08Å; Y313-D317 PolarHBondContact O-N 3.02Å
314	N	93.9	Very high	91.3	Very high	20 Å²	20	37.2 Å²	37.2	11%	0.107	18%	0.176	C	C	.	.	H	α-helix	trans	-61.7	-38.2	176.4	-73.1	-32.5	0	0	0	112.5	Q37 V40 T41 L44 K310 L311 D317 I318	Q37-N314 PolarHBondContact NE2-ND2 3.44Å; V40-N314 HydrophobicContact CG1-CB 3.69Å; T41-N314 WeakPolarHBondContact CG2-ND2 3.49Å; L44-N314 HydrophobicContact CD2-CB 4Å; K310-N314 WeakPolarHBondContact O-CB 3.28Å; K310-N314 VanDerWaalsContact O-CG 3.3Å; K310-N314 PolarHBondContact O-N 3.3Å; K310-N314 PolarHBondContact O-ND2 2.95Å; L311-N314 PolarHBondContact O-N 3.2Å; N314-D317 PolarHBondContact O-N 3.45Å; N314-I318 WeakPolarHBondContact O-CG1 3.3Å; N314-I318 PolarHBondContact O-N 3.19Å
315	L	95.3	Very high	91.9	Very high	65 Å²	65	33.9 Å²	33.9	34%	0.34	16%	0.163	S	C	.	.	H	α-helix	trans	-64.6	-39.8	173.2	-75.2	172.1	0	0	0	111.9	V40 V287 L311 M312 Y313 D317 I318 G319	V40-L315 HydrophobicContact CG1-CD2 4.1Å; V40-L315 HydrophobicContact CG1-CG 4.22Å; V40-L315 HydrophobicContact CG2-CD2 3.92Å; V40-L315 HydrophobicContact CG2-CG 4.49Å; V287-L315 HydrophobicContact CG1-CB 3.8Å; L311-L315 HydrophobicContact CD1-CD1 4.28Å; L311-L315 HydrophobicContact CD1-CG 4.31Å; L311-L315 HydrophobicContact CG-CD1 4.22Å; L311-L315 WeakPolarHBondContact O-CB 3.41Å; L311-L315 WeakPolarHBondContact O-CG 3.34Å; L311-L315 PolarHBondContact O-N 2.95Å; M312-L315 PolarHBondContact O-N 2.93Å; M312-L315 HydrophobicContact SD-CD1 4.28Å; Y313-L315 VanDerWaalsContact C-N 3.31Å; Y313-L315 PolarHBondContact O-N 3.31Å; L315-D317 VanDerWaalsContact C-N 3.3Å; L315-D317 PolarHBondContact O-N 3.46Å; L315-I318 WeakPolarHBondContact O-CB 3.41Å; L315-I318 PolarHBondContact O-N 2.59Å; L315-G319 PolarHBondContact O-N 2.87Å
316	A	95	Very high	92.4	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-35.8	173.9	0	0	0	0	0	112	Q284 V287 Y288 M312 Y313 G319 W320	Q284-A316 VanDerWaalsContact CG-O 3.27Å; Q284-A316 WeakPolarHBondContact CG-O 3.37Å; V287-A316 HydrophobicContact CG1-CB 4.23Å; Y288-A316 HydrophobicContact CD2-CB 3.73Å; Y288-A316 HydrophobicContact CG-CB 4.36Å; M312-A316 PolarHBondContact O-N 3.07Å; Y313-A316 WeakPolarHBondContact O-CB 3.41Å; Y313-A316 PolarHBondContact O-N 2.89Å; Y313-A316 VanDerWaalsContact O-N 3.08Å; A316-G319 CarbonylContact O-C 3.47Å; A316-G319 WeakPolarHBondContact O-CA 3.36Å; A316-G319 PolarHBondContact O-N 3.1Å; A316-G319 VanDerWaalsContact O-N 3.11Å; A316-W320 PolarHBondContact O-N 3.21Å
317	D	94.7	Very high	92.7	Very high	12 Å²	12	28.3 Å²	28.3	6%	0.064	14%	0.139	C	C	.	.	H	α-helix	trans	-70	-34.1	174.4	-64.1	-57.8	0	0	0	113.3	L44 L103 K107 Y313 N314 L315 G319 W320 N321	L44-D317 HydrophobicContact CD1-CB 3.73Å; L44-D317 HydrophobicContact CD2-CB 3.88Å; L44-D317 HydrophobicContact CG-CB 4.5Å; L103-D317 HydrophobicContact CD2-CB 4.41Å; K107-D317 IonicContact NZ-OD1 3.24Å; K107-D317 PolarHBondContact NZ-OD1 2.99Å; K107-D317 VanDerWaalsContact NZ-OD1 3.08Å; K107-D317 IonicContact NZ-OD2 2.7Å; K107-D317 PolarHBondContact NZ-OD2 3.44Å; Y313-D317 PolarHBondContact O-N 3.02Å; N314-D317 PolarHBondContact O-N 3.45Å; L315-D317 VanDerWaalsContact C-N 3.3Å; L315-D317 PolarHBondContact O-N 3.46Å; D317-G319 PolarHBondContact O-N 3.28Å; D317-W320 WeakPolarHBondContact O-CB 3.44Å; D317-W320 PolarHBondContact O-N 3.03Å; D317-N321 PolarHBondContact O-N 3.35Å; D317-N321 PolarHBondContact O-ND2 3.46Å
318	I	95.9	Very high	92.9	Very high	30 Å²	30	29.8 Å²	29.8	15%	0.154	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-39.5	167.2	-68.4	174.7	0	0	0	109.5	V40 V43 L44 N314 L315 W320 N321 L322	V40-I318 HydrophobicContact CG1-CD1 3.79Å; V43-I318 HydrophobicContact CB-CD1 4.3Å; V43-I318 HydrophobicContact CG1-CD1 3.98Å; L44-I318 HydrophobicContact CB-CD1 4.3Å; L44-I318 HydrophobicContact CB-CG1 3.93Å; L44-I318 HydrophobicContact CD1-CG1 4.01Å; L44-I318 HydrophobicContact CG-CG1 4.47Å; N314-I318 WeakPolarHBondContact O-CG1 3.3Å; N314-I318 PolarHBondContact O-N 3.19Å; L315-I318 WeakPolarHBondContact O-CB 3.41Å; L315-I318 PolarHBondContact O-N 2.59Å; I318-W320 VanDerWaalsContact C-N 3.28Å; I318-W320 PolarHBondContact O-N 3.35Å; I318-N321 WeakPolarHBondContact O-CB 3.12Å; I318-N321 PolarHBondContact O-N 2.77Å; I318-N321 VanDerWaalsContact O-N 3.12Å; I318-L322 PolarHBondContact O-N 2.86Å
319	G	95.6	Very high	92.9	Very high	9 Å²	9	28.9 Å²	28.9	9%	0.093	15%	0.146	C	C	.	.	H	α-helix	trans	-55.8	-40.4	172.1	0	0	0	0	0	113.1	L315 A316 D317 L322 H323	L315-G319 PolarHBondContact O-N 2.87Å; A316-G319 CarbonylContact O-C 3.47Å; A316-G319 WeakPolarHBondContact O-CA 3.36Å; A316-G319 PolarHBondContact O-N 3.1Å; A316-G319 VanDerWaalsContact O-N 3.11Å; D317-G319 PolarHBondContact O-N 3.28Å; G319-L322 PolarHBondContact O-N 3.28Å; G319-H323 WeakPolarHBondContact O-CB 3.33Å; G319-H323 PolarHBondContact O-N 3.03Å
320	W	95	Very high	92.8	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.015	14%	0.142	C	C	.	.	H	α-helix	trans	-64.4	-44.3	172.4	-86.4	112.9	0	0	0	112.9	T94 F98 L103 Y136 T140 N223 L224 A316 D317 I318 L322 H323 F324	T94-W320 HydrophobicContact CG2-CZ3 4.2Å; F98-W320 HydrophobicContact CD1-CD2 4.02Å; F98-W320 HydrophobicContact CD1-CE3 4.25Å; F98-W320 HydrophobicContact CD1-CG 4.31Å; F98-W320 HydrophobicContact CD2-CH2 4.31Å; F98-W320 HydrophobicContact CD2-CZ3 4.25Å; F98-W320 AromaticContact CE1-CD1 3.81Å; F98-W320 AromaticContact CE1-CD2 3.51Å; F98-W320 HydrophobicContact CE1-CD2 3.51Å; F98-W320 AromaticContact CE1-CE2 3.31Å; F98-W320 HydrophobicContact CE1-CE3 4.06Å; F98-W320 AromaticContact CE1-CG 3.87Å; F98-W320 HydrophobicContact CE1-CG 3.87Å; F98-W320 HydrophobicContact CE1-CH2 4.27Å; F98-W320 AromaticContact CE1-CZ2 3.75Å; F98-W320 HydrophobicContact CE1-CZ2 3.75Å; F98-W320 HydrophobicContact CE1-CZ3 4.39Å; F98-W320 AromaticContact CE1-NE1 3.45Å; F98-W320 HydrophobicContact CE2-CD2 4.39Å; F98-W320 HydrophobicContact CE2-CE3 4.29Å; F98-W320 AromaticContact CE2-CH2 3.48Å; F98-W320 HydrophobicContact CE2-CH2 3.48Å; F98-W320 VanDerWaalsContact CE2-CH2 3.48Å; F98-W320 AromaticContact CE2-CZ2 3.58Å; F98-W320 HydrophobicContact CE2-CZ2 3.58Å; F98-W320 AromaticContact CE2-CZ3 3.84Å; F98-W320 HydrophobicContact CE2-CZ3 3.84Å; F98-W320 HydrophobicContact CG-CE3 4.48Å; F98-W320 AromaticContact CZ-CD2 3.75Å; F98-W320 HydrophobicContact CZ-CD2 3.75Å; F98-W320 AromaticContact CZ-CE2 3.18Å; F98-W320 HydrophobicContact CZ-CE3 4.11Å; F98-W320 AromaticContact CZ-CH2 3.51Å; F98-W320 HydrophobicContact CZ-CH2 3.51Å; F98-W320 AromaticContact CZ-CZ2 3.08Å; F98-W320 HydrophobicContact CZ-CZ2 3.08Å; F98-W320 AromaticContact CZ-CZ3 3.99Å; F98-W320 HydrophobicContact CZ-CZ3 3.99Å; F98-W320 AromaticContact CZ-NE1 3.64Å; L103-W320 HydrophobicContact CD1-CB 4.07Å; Y136-W320 HydrophobicContact CE2-CZ2 4.17Å; T140-W320 HydrophobicContact CG2-CH2 3.53Å; T140-W320 HydrophobicContact CG2-CZ2 4.37Å; T140-W320 HydrophobicContact CG2-CZ3 4.29Å; N223-W320 VanDerWaalsContact OD1-CZ2 3.25Å; N223-W320 WeakPolarHBondContact OD1-CZ2 3.33Å; N223-W320 PolarHBondContact OD1-NE1 3.19Å; N223-W320 VanDerWaalsContact OD1-NE1 3.12Å; L224-W320 HydrophobicContact CD1-CE3 4.37Å; L224-W320 HydrophobicContact CD1-CH2 4.06Å; L224-W320 HydrophobicContact CD1-CZ2 4.24Å; L224-W320 HydrophobicContact CD1-CZ3 4.15Å; L224-W320 HydrophobicContact CD2-CE3 4.42Å; L224-W320 HydrophobicContact CD2-CH2 3.24Å; L224-W320 HydrophobicContact CD2-CZ2 4.09Å; L224-W320 HydrophobicContact CD2-CZ3 3.47Å; L224-W320 VanDerWaalsContact CD2-CZ3 3.47Å; L224-W320 HydrophobicContact CG-CE3 4.48Å; L224-W320 HydrophobicContact CG-CH2 3.32Å; L224-W320 HydrophobicContact CG-CZ2 3.62Å; L224-W320 HydrophobicContact CG-CZ3 3.82Å; A316-W320 PolarHBondContact O-N 3.21Å; D317-W320 WeakPolarHBondContact O-CB 3.44Å; D317-W320 PolarHBondContact O-N 3.03Å; I318-W320 VanDerWaalsContact C-N 3.28Å; I318-W320 PolarHBondContact O-N 3.35Å; W320-L322 VanDerWaalsContact C-N 3.3Å; W320-L322 PolarHBondContact O-N 2.95Å; W320-H323 HydrophobicContact CE3-CB 4.41Å; W320-H323 CarbonylContact O-C 3.21Å; W320-H323 WeakPolarHBondContact O-CA 3.42Å; W320-H323 WeakPolarHBondContact O-CB 3.22Å; W320-H323 PolarHBondContact O-N 3.5Å; W320-H323 VanDerWaalsContact O-N 3.11Å; W320-F324 HydrophobicContact CB-CE2 4.49Å; W320-F324 HydrophobicContact CE3-CE2 4.07Å; W320-F324 HydrophobicContact CE3-CZ 4.13Å; W320-F324 HydrophobicContact CZ3-CZ 4.49Å; W320-F324 WeakPolarHBondContact O-CD2 3.25Å; W320-F324 PolarHBondContact O-N 2.96Å
321	N	95.6	Very high	92.6	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.3	-40	174.7	-81.1	-75.7	0	0	0	112.4	L44 W47 S48 D317 I318 H323 F324 T325	L44-N321 WeakPolarHBondContact CD1-ND2 3.2Å; W47-N321 HydrophobicContact CD2-CB 4Å; W47-N321 HydrophobicContact CG-CB 3.84Å; S48-N321 PolarHBondContact OG-ND2 2.99Å; D317-N321 PolarHBondContact O-N 3.35Å; D317-N321 PolarHBondContact O-ND2 3.46Å; I318-N321 WeakPolarHBondContact O-CB 3.12Å; I318-N321 PolarHBondContact O-N 2.77Å; I318-N321 VanDerWaalsContact O-N 3.12Å; N321-H323 VanDerWaalsContact C-N 3.34Å; N321-F324 PolarHBondContact O-N 2.82Å; N321-T325 PolarHBondContact O-N 3.07Å; N321-T325 PolarHBondContact O-OG1 3.4Å
322	L	94.9	Very high	92.4	Very high	74 Å²	74	31.9 Å²	31.9	39%	0.387	16%	0.164	S	C	.	.	H	α-helix	trans	-63.9	-41.4	173.2	-176.3	64.1	0	0	0	111.1	W47 T280 I318 G319 W320 F324 T325 R326	W47-L322 HydrophobicContact CH2-CD1 4.39Å; T280-L322 HydrophobicContact CG2-CG 4.06Å; I318-L322 PolarHBondContact O-N 2.86Å; G319-L322 PolarHBondContact O-N 3.28Å; W320-L322 VanDerWaalsContact C-N 3.3Å; W320-L322 PolarHBondContact O-N 2.95Å; L322-F324 VanDerWaalsContact C-N 3.33Å; L322-F324 PolarHBondContact O-N 3.33Å; L322-T325 WeakPolarHBondContact O-CB 3.45Å; L322-T325 PolarHBondContact O-N 3.2Å; L322-T325 VanDerWaalsContact O-N 3.16Å; L322-R326 PolarHBondContact O-N 3.04Å
323	H	94.5	Very high	92.1	Very high	5 Å²	5	31.1 Å²	31.1	2%	0.023	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-39	173.9	-175.4	76.7	0	0	0	112.6	L224 Y277 T280 G319 W320 N321 T325 R326	L224-H323 HydrophobicContact CD1-CB 4.15Å; Y277-H323 AromaticContact CD2-CE1 3.55Å; Y277-H323 AromaticContact CE2-CE1 3.54Å; T280-H323 PolarHBondContact OG1-ND1 2.89Å; G319-H323 WeakPolarHBondContact O-CB 3.33Å; G319-H323 PolarHBondContact O-N 3.03Å; W320-H323 HydrophobicContact CE3-CB 4.41Å; W320-H323 CarbonylContact O-C 3.21Å; W320-H323 WeakPolarHBondContact O-CA 3.42Å; W320-H323 WeakPolarHBondContact O-CB 3.22Å; W320-H323 PolarHBondContact O-N 3.5Å; W320-H323 VanDerWaalsContact O-N 3.11Å; N321-H323 VanDerWaalsContact C-N 3.34Å; H323-T325 VanDerWaalsContact C-N 3.35Å; H323-R326 PolarHBondContact CE1-NE 3.29Å; H323-R326 PolarHBondContact NE2-NH2 2.56Å; H323-R326 WeakPolarHBondContact O-CB 3.33Å; H323-R326 PolarHBondContact O-N 3.23Å
324	F	95	Very high	91.9	Very high	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-69.2	-33.7	173.9	-71.4	-59	0	0	0	112.7	L52 I55 T94 N95 F98 A99 L103 W320 N321 L322 R326 E327	L52-F324 HydrophobicContact CD1-CB 3.95Å; L52-F324 HydrophobicContact CD1-CD2 3.59Å; L52-F324 HydrophobicContact CD1-CE2 4.45Å; L52-F324 HydrophobicContact CD1-CG 3.94Å; I55-F324 HydrophobicContact CG2-CB 4.49Å; I55-F324 VanDerWaalsContact CG2-O 3.27Å; I55-F324 WeakPolarHBondContact CG2-O 3.47Å; T94-F324 HydrophobicContact CG2-CE1 4.4Å; T94-F324 HydrophobicContact CG2-CZ 4.4Å; N95-F324 HydrophobicContact CB-CE1 4.37Å; F98-F324 HydrophobicContact CB-CE2 3.89Å; F98-F324 HydrophobicContact CB-CZ 3.46Å; F98-F324 VanDerWaalsContact CB-CZ 3.46Å; F98-F324 HydrophobicContact CG-CZ 4.17Å; A99-F324 HydrophobicContact CB-CE2 4.3Å; A99-F324 HydrophobicContact CB-CZ 4.32Å; L103-F324 HydrophobicContact CD1-CD2 4.41Å; L103-F324 HydrophobicContact CD1-CE2 3.96Å; W320-F324 HydrophobicContact CB-CE2 4.49Å; W320-F324 HydrophobicContact CE3-CE2 4.07Å; W320-F324 HydrophobicContact CE3-CZ 4.13Å; W320-F324 HydrophobicContact CZ3-CZ 4.49Å; W320-F324 WeakPolarHBondContact O-CD2 3.25Å; W320-F324 PolarHBondContact O-N 2.96Å; N321-F324 PolarHBondContact O-N 2.82Å; L322-F324 VanDerWaalsContact C-N 3.33Å; L322-F324 PolarHBondContact O-N 3.33Å; F324-R326 PolarHBondContact O-N 3.36Å; F324-E327 VanDerWaalsContact O-CB 3.23Å; F324-E327 WeakPolarHBondContact O-CB 3.47Å; F324-E327 WeakPolarHBondContact O-CG 3.34Å; F324-E327 PolarHBondContact O-N 3.07Å
325	T	92.6	Very high	91.5	Very high	36 Å²	36	31.4 Å²	31.4	22%	0.221	16%	0.162	C	C	.	.	H	α-helix	trans	-61.9	-27.9	175.6	-55.1	0	0	0	0	112	W47 I55 N321 L322 H323 E327 L328	W47-T325 VanDerWaalsContact CZ2-OG1 3.3Å; W47-T325 WeakPolarHBondContact CZ2-OG1 3.33Å; I55-T325 HydrophobicContact CD1-CG2 4.34Å; N321-T325 PolarHBondContact O-N 3.07Å; N321-T325 PolarHBondContact O-OG1 3.4Å; L322-T325 WeakPolarHBondContact O-CB 3.45Å; L322-T325 PolarHBondContact O-N 3.2Å; L322-T325 VanDerWaalsContact O-N 3.16Å; H323-T325 VanDerWaalsContact C-N 3.35Å; T325-E327 PolarHBondContact O-N 3.46Å; T325-L328 HydrophobicContact CG2-CD1 4.43Å; T325-L328 WeakPolarHBondContact O-CB 3.49Å; T325-L328 PolarHBondContact O-N 2.82Å; T325-L328 VanDerWaalsContact O-N 3.11Å
326	R	92.5	Very high	90.9	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-53.5	-32.2	168.7	-167.8	-173	57.1	84.1	7.3	113.2	F273 S276 T280 L322 H323 F324 L328 I329 D330	F273-R326 VanDerWaalsContact CZ-NH1 3.35Å; S276-R326 VanDerWaalsContact OG-CG 3.31Å; S276-R326 WeakPolarHBondContact OG-CG 3.37Å; T280-R326 HydrophobicContact CG2-CB 4.32Å; L322-R326 PolarHBondContact O-N 3.04Å; H323-R326 PolarHBondContact CE1-NE 3.29Å; H323-R326 PolarHBondContact NE2-NH2 2.56Å; H323-R326 WeakPolarHBondContact O-CB 3.33Å; H323-R326 PolarHBondContact O-N 3.23Å; F324-R326 PolarHBondContact O-N 3.36Å; R326-L328 PolarHBondContact O-N 2.91Å; R326-L328 VanDerWaalsContact O-N 3.15Å; R326-I329 WeakPolarHBondContact O-CA 3.49Å; R326-I329 VanDerWaalsContact O-CB 3.27Å; R326-I329 WeakPolarHBondContact O-CB 3.35Å; R326-I329 PolarHBondContact O-N 3.3Å; R326-D330 IonicContact CZ-OD2 3.95Å; R326-D330 IonicContact NH1-OD1 3.22Å; R326-D330 PolarHBondContact NH1-OD1 3.43Å; R326-D330 IonicContact NH1-OD2 3.54Å; R326-D330 PolarHBondContact NH1-OD2 3.08Å; R326-D330 IonicContact NH2-OD2 3.5Å; R326-D330 PolarHBondContact O-N 3.34Å
327	E	88.8	Confident	90.1	Very high	7 Å²	7	34.9 Å²	34.9	3%	0.033	18%	0.177	C	C	.	.	H	α-helix	trans	-60.3	-26.6	179.9	-63.7	-174.7	171.4	0	0	112	G59 N95 F324 T325 D330 L331	G59-E327 WeakPolarHBondContact CA-OE2 3.45Å; N95-E327 PolarHBondContact ND2-OE1 3.25Å; N95-E327 PolarHBondContact ND2-OE2 3.43Å; F324-E327 VanDerWaalsContact O-CB 3.23Å; F324-E327 WeakPolarHBondContact O-CB 3.47Å; F324-E327 WeakPolarHBondContact O-CG 3.34Å; F324-E327 PolarHBondContact O-N 3.07Å; T325-E327 PolarHBondContact O-N 3.46Å; E327-D330 WeakPolarHBondContact O-CB 2.97Å; E327-D330 PolarHBondContact O-N 2.97Å; E327-L331 PolarHBondContact O-N 3.04Å
328	L	89.8	Confident	89.3	Confident	60 Å²	60	34.6 Å²	34.6	31%	0.314	18%	0.176	S	C	.	.	H	α-helix	trans	-67.6	-36.8	171.7	-59.4	-178.8	0	0	0	112	I55 L58 T325 R326 D330 L331 I332	I55-L328 HydrophobicContact CD1-CD1 4.41Å; I55-L328 HydrophobicContact CG1-CD1 4.11Å; I55-L328 HydrophobicContact CG1-CG 4.46Å; I55-L328 HydrophobicContact CG2-CD2 4.4Å; I55-L328 HydrophobicContact CG2-CG 4.19Å; L58-L328 HydrophobicContact CD1-CD2 4.37Å; T325-L328 HydrophobicContact CG2-CD1 4.43Å; T325-L328 WeakPolarHBondContact O-CB 3.49Å; T325-L328 PolarHBondContact O-N 2.82Å; T325-L328 VanDerWaalsContact O-N 3.11Å; R326-L328 PolarHBondContact O-N 2.91Å; R326-L328 VanDerWaalsContact O-N 3.15Å; L328-D330 VanDerWaalsContact C-N 3.34Å; L328-L331 WeakPolarHBondContact O-CB 3.2Å; L328-L331 PolarHBondContact O-N 3.16Å; L328-I332 WeakPolarHBondContact O-CG1 3.19Å; L328-I332 PolarHBondContact O-N 3.32Å; L328-I332 VanDerWaalsContact O-N 3.14Å
329	I	87.7	Confident	88.6	Confident	73 Å²	73	39.5 Å²	39.5	37%	0.374	20%	0.196	S	C	.	.	H	α-helix	trans	-66.5	-42.9	173.8	-56.3	174.3	0	0	0	109.1	R326 L331 I332 M333	R326-I329 WeakPolarHBondContact O-CA 3.49Å; R326-I329 VanDerWaalsContact O-CB 3.27Å; R326-I329 WeakPolarHBondContact O-CB 3.35Å; R326-I329 PolarHBondContact O-N 3.3Å; I329-L331 VanDerWaalsContact C-N 3.3Å; I329-L331 PolarHBondContact O-N 2.78Å; I329-I332 PolarHBondContact O-N 2.79Å; I329-I332 VanDerWaalsContact O-N 3.16Å; I329-M333 HydrophobicContact CG2-CE 4.46Å; I329-M333 HydrophobicContact CG2-CG 4.39Å; I329-M333 VanDerWaalsContact O-CG 3.29Å; I329-M333 WeakPolarHBondContact O-CG 3.3Å; I329-M333 PolarHBondContact O-N 3.2Å
330	D	86.9	Confident	87.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-59.4	-41.9	176.2	-65.5	-10.4	0	0	0	111.3	F273 R326 E327 L328 I332 M333 Y334	F273-D330 HydrophobicContact CD2-CB 4.43Å; F273-D330 WeakPolarHBondContact CD2-OD1 3.29Å; F273-D330 HydrophobicContact CE2-CB 4.07Å; F273-D330 WeakPolarHBondContact CE2-OD1 3.39Å; F273-D330 WeakPolarHBondContact CE2-OD2 3.26Å; R326-D330 IonicContact CZ-OD2 3.95Å; R326-D330 IonicContact NH1-OD1 3.22Å; R326-D330 PolarHBondContact NH1-OD1 3.43Å; R326-D330 IonicContact NH1-OD2 3.54Å; R326-D330 PolarHBondContact NH1-OD2 3.08Å; R326-D330 IonicContact NH2-OD2 3.5Å; R326-D330 PolarHBondContact O-N 3.34Å; E327-D330 WeakPolarHBondContact O-CB 2.97Å; E327-D330 PolarHBondContact O-N 2.97Å; L328-D330 VanDerWaalsContact C-N 3.34Å; D330-I332 PolarHBondContact O-N 3.06Å; D330-M333 PolarHBondContact O-N 3.31Å; D330-Y334 HydrophobicContact CB-CD2 4.45Å; D330-Y334 HydrophobicContact CB-CE2 4.02Å; D330-Y334 WeakPolarHBondContact O-CB 3.33Å; D330-Y334 WeakPolarHBondContact O-CD2 3.32Å; D330-Y334 PolarHBondContact O-N 3.09Å
331	L	85.7	Confident	86.7	Confident	49 Å²	49	41.1 Å²	41.1	26%	0.257	21%	0.205	S	C	.	.	H	α-helix	trans	-56.9	-49.2	173.2	168.2	62.7	0	0	0	111.9	T62 E327 L328 I329 M333 Y334 F335	T62-L331 HydrophobicContact CG2-CB 4.06Å; T62-L331 HydrophobicContact CG2-CD1 3.51Å; T62-L331 HydrophobicContact CG2-CG 4.35Å; E327-L331 PolarHBondContact O-N 3.04Å; L328-L331 WeakPolarHBondContact O-CB 3.2Å; L328-L331 PolarHBondContact O-N 3.16Å; I329-L331 VanDerWaalsContact C-N 3.3Å; I329-L331 PolarHBondContact O-N 2.78Å; L331-M333 VanDerWaalsContact C-N 3.3Å; L331-M333 PolarHBondContact O-N 3.34Å; L331-Y334 PolarHBondContact O-N 2.92Å; L331-F335 WeakPolarHBondContact O-CB 3.3Å; L331-F335 PolarHBondContact O-N 3.43Å
332	I	86.9	Confident	86.1	Confident	104 Å²	104	45.8 Å²	45.8	53%	0.533	22%	0.223	S	C	.	.	H	α-helix	trans	-59.9	-44.8	177.9	-66.2	166.5	0	0	0	110	L328 I329 D330 F335 I336	L328-I332 WeakPolarHBondContact O-CG1 3.19Å; L328-I332 PolarHBondContact O-N 3.32Å; L328-I332 VanDerWaalsContact O-N 3.14Å; I329-I332 PolarHBondContact O-N 2.79Å; I329-I332 VanDerWaalsContact O-N 3.16Å; D330-I332 PolarHBondContact O-N 3.06Å; I332-F335 PolarHBondContact O-N 2.95Å; I332-I336 HydrophobicContact CG2-CD1 3.94Å; I332-I336 WeakPolarHBondContact O-CG1 3.39Å; I332-I336 PolarHBondContact O-N 3.39Å
333	M	86.1	Confident	85.5	Confident	40 Å²	40	51.4 Å²	51.4	20%	0.197	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-46.1	178.3	-70.7	-64.1	-173.1	0	0	111.9	I269 A272 I329 D330 L331 F335 I336 Y337	I269-M333 HydrophobicContact CG2-CB 4.17Å; I269-M333 HydrophobicContact CG2-SD 4.11Å; A272-M333 HydrophobicContact CB-CE 3.38Å; A272-M333 HydrophobicContact CB-SD 4.43Å; I329-M333 HydrophobicContact CG2-CE 4.46Å; I329-M333 HydrophobicContact CG2-CG 4.39Å; I329-M333 VanDerWaalsContact O-CG 3.29Å; I329-M333 WeakPolarHBondContact O-CG 3.3Å; I329-M333 PolarHBondContact O-N 3.2Å; D330-M333 PolarHBondContact O-N 3.31Å; L331-M333 VanDerWaalsContact C-N 3.3Å; L331-M333 PolarHBondContact O-N 3.34Å; M333-F335 VanDerWaalsContact C-N 3.33Å; M333-F335 PolarHBondContact O-N 2.88Å; M333-I336 PolarHBondContact O-N 2.96Å; M333-Y337 WeakPolarHBondContact O-CB 3.35Å; M333-Y337 PolarHBondContact O-N 3.44Å
334	Y	86.8	Confident	84.8	Confident	9 Å²	9	54 Å²	54	4%	0.035	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-38.9	176.6	-65.8	-35.7	0	0	0	112	T62 H63 V66 T84 D330 L331 I336 Y337 L338	T62-Y334 HydrophobicContact CG2-CD2 4.12Å; H63-Y334 AromaticContact CE1-CE2 3.72Å; H63-Y334 AromaticContact ND1-CE2 3.88Å; V66-Y334 HydrophobicContact CG2-CD2 3.67Å; V66-Y334 HydrophobicContact CG2-CE2 4.13Å; V66-Y334 HydrophobicContact CG2-CG 3.92Å; T84-Y334 HydrophobicContact CG2-CD1 4.31Å; T84-Y334 HydrophobicContact CG2-CE1 3.44Å; T84-Y334 VanDerWaalsContact CG2-CE1 3.44Å; D330-Y334 HydrophobicContact CB-CD2 4.45Å; D330-Y334 HydrophobicContact CB-CE2 4.02Å; D330-Y334 WeakPolarHBondContact O-CB 3.33Å; D330-Y334 WeakPolarHBondContact O-CD2 3.32Å; D330-Y334 PolarHBondContact O-N 3.09Å; L331-Y334 PolarHBondContact O-N 2.92Å; Y334-I336 PolarHBondContact O-N 3.41Å; Y334-Y337 PolarHBondContact O-N 3.25Å; Y334-L338 WeakPolarHBondContact O-CB 3.41Å; Y334-L338 PolarHBondContact O-N 2.88Å
335	F	85.4	Confident	84	Confident	78 Å²	78	56.2 Å²	56.2	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-42.5	176.9	-177.6	-97.8	0	0	0	112.5	L331 I332 M333 R342 L345	L331-F335 WeakPolarHBondContact O-CB 3.3Å; L331-F335 PolarHBondContact O-N 3.43Å; I332-F335 PolarHBondContact O-N 2.95Å; M333-F335 VanDerWaalsContact C-N 3.33Å; M333-F335 PolarHBondContact O-N 2.88Å; F335-R342 HydrophobicContact CD2-CB 4.44Å; F335-R342 HydrophobicContact CD2-CG 4.42Å; F335-R342 HydrophobicContact CE1-CG 4.31Å; F335-R342 HydrophobicContact CE2-CB 4.23Å; F335-R342 HydrophobicContact CE2-CG 3.81Å; F335-R342 HydrophobicContact CZ-CG 3.75Å; F335-L345 HydrophobicContact CD2-CD1 3.74Å; F335-L345 HydrophobicContact CE2-CB 4.37Å; F335-L345 HydrophobicContact CE2-CD1 4.21Å
336	I	83	Confident	83.7	Confident	103 Å²	103	58.6 Å²	58.6	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-66.1	-42.6	175.8	-67.5	168.1	0	0	0	110.3	I269 I332 M333 Y334	I269-I336 HydrophobicContact CD1-CG2 4.35Å; I332-I336 HydrophobicContact CG2-CD1 3.94Å; I332-I336 WeakPolarHBondContact O-CG1 3.39Å; I332-I336 PolarHBondContact O-N 3.39Å; M333-I336 PolarHBondContact O-N 2.96Å; Y334-I336 PolarHBondContact O-N 3.41Å
337	Y	78.6	Confident	83.3	Confident	35 Å²	35	61.8 Å²	61.8	14%	0.137	30%	0.297	C	S	.	.	H	α-helix	trans	-81.5	-50.9	-169	-178.7	-131	0	0	0	114.4	L81 I266 I269 M333 Y334 K339	L81-Y337 HydrophobicContact CD2-CD1 4.4Å; L81-Y337 HydrophobicContact CD2-CE1 3.48Å; L81-Y337 VanDerWaalsContact CD2-CE1 3.48Å; L81-Y337 HydrophobicContact CG-CE1 4.27Å; I266-Y337 HydrophobicContact CB-CE2 4.1Å; I266-Y337 HydrophobicContact CD1-CE2 4.38Å; I266-Y337 HydrophobicContact CG1-CD2 4.48Å; I266-Y337 HydrophobicContact CG1-CE2 3.35Å; I266-Y337 WeakPolarHBondContact CG1-OH 3.34Å; I266-Y337 HydrophobicContact CG2-CE2 4.28Å; I266-Y337 WeakPolarHBondContact CG2-OH 3.07Å; I269-Y337 HydrophobicContact CD1-CD2 3.8Å; I269-Y337 HydrophobicContact CD1-CG 4.12Å; I269-Y337 HydrophobicContact CG2-CG 4.45Å; M333-Y337 WeakPolarHBondContact O-CB 3.35Å; M333-Y337 PolarHBondContact O-N 3.44Å; Y334-Y337 PolarHBondContact O-N 3.25Å; Y337-K339 PolarHBondContact O-N 3.32Å
338	L	79.1	Confident	82.9	Confident	6 Å²	6	67.5 Å²	67.5	3%	0.031	32%	0.322	C	S	.	.			trans	-87.1	90.9	-173.9	-68.8	174.7	0	0	0	110.1	V66 L81 Y334 P340 L341 R342	V66-L338 HydrophobicContact CG1-CD1 4.13Å; V66-L338 HydrophobicContact CG2-CD1 4.07Å; L81-L338 HydrophobicContact CD1-CD2 4.23Å; L81-L338 HydrophobicContact CD2-CD2 3.63Å; Y334-L338 WeakPolarHBondContact O-CB 3.41Å; Y334-L338 PolarHBondContact O-N 2.88Å; L338-P340 VanDerWaalsContact C-N 3.27Å; L338-L341 HydrophobicContact CB-CB 3.56Å; L338-L341 HydrophobicContact CB-CD2 4.34Å; L338-L341 HydrophobicContact CD1-CB 4.35Å; L338-L341 HydrophobicContact CD1-CD2 4.25Å; L338-L341 WeakPolarHBondContact O-CA 3.41Å; L338-L341 WeakPolarHBondContact O-CB 3.44Å; L338-L341 PolarHBondContact O-N 2.82Å; L338-R342 PolarHBondContact O-N 3.5Å
339	K	80	Confident	82.6	Confident	134 Å²	134	68.2 Å²	68.2	58%	0.583	33%	0.328	S	S	*	.	H	α-helix	trans	-48.9	-41.2	172.8	-66	-174.4	-178.7	-176.4	0	113.8	Y337 R342 R343	Y337-K339 PolarHBondContact O-N 3.32Å; K339-R342 PolarHBondContact O-N 3.11Å; K339-R343 WeakPolarHBondContact O-CG 3.43Å; K339-R343 PolarHBondContact O-N 3.38Å
340	P	75.8	Confident	82.5	Confident	44 Å²	44	71.2 Å²	71.2	29%	0.286	34%	0.339	S	S	.	.	H	α-helix	trans	-63.6	-42.4	175.5	-22.2	34.5	0	0	0	113	I69 L74 L338 R342 R343 I344	I69-P340 HydrophobicContact CG2-CB 3.92Å; L74-P340 HydrophobicContact CD2-CG 4.06Å; L338-P340 VanDerWaalsContact C-N 3.27Å; P340-R342 VanDerWaalsContact C-N 3.34Å; P340-R342 PolarHBondContact O-N 3.13Å; P340-R343 PolarHBondContact O-N 3.38Å; P340-I344 WeakPolarHBondContact O-CG1 3.2Å; P340-I344 PolarHBondContact O-N 2.78Å
341	L	75.9	Confident	82.4	Confident	2 Å²	2	75 Å²	75	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-58.5	-47.8	175	178.7	66	0	0	0	110.7	L65 V66 I69 L338 R343 I344 L345	L65-L341 HydrophobicContact CB-CD1 4.18Å; V66-L341 HydrophobicContact CG2-CD2 4.21Å; I69-L341 HydrophobicContact CD1-CB 3.65Å; I69-L341 HydrophobicContact CD1-CD1 3.47Å; I69-L341 VanDerWaalsContact CD1-CD1 3.47Å; I69-L341 HydrophobicContact CD1-CG 4.16Å; L338-L341 HydrophobicContact CB-CB 3.56Å; L338-L341 HydrophobicContact CB-CD2 4.34Å; L338-L341 HydrophobicContact CD1-CB 4.35Å; L338-L341 HydrophobicContact CD1-CD2 4.25Å; L338-L341 WeakPolarHBondContact O-CA 3.41Å; L338-L341 WeakPolarHBondContact O-CB 3.44Å; L338-L341 PolarHBondContact O-N 2.82Å; L341-R343 VanDerWaalsContact C-N 3.32Å; L341-R343 PolarHBondContact O-N 2.88Å; L341-I344 PolarHBondContact O-N 3.01Å; L341-L345 HydrophobicContact CD1-CD1 3.89Å; L341-L345 HydrophobicContact CD1-CG 4.16Å; L341-L345 HydrophobicContact CD2-CD1 4.43Å; L341-L345 HydrophobicContact CG-CD1 3.79Å; L341-L345 HydrophobicContact CG-CG 4.42Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 WeakPolarHBondContact O-CG 3.4Å; L341-L345 PolarHBondContact O-N 3.36Å
342	R	82.3	Confident	82.4	Confident	98 Å²	98	78.2 Å²	78.2	37%	0.37	38%	0.375	S	S	.	.	H	α-helix	trans	-57.4	-43.1	175.9	-175	174.3	69	-176.4	6.1	112.3	F335 L338 K339 P340 L346	F335-R342 HydrophobicContact CD2-CB 4.44Å; F335-R342 HydrophobicContact CD2-CG 4.42Å; F335-R342 HydrophobicContact CE1-CG 4.31Å; F335-R342 HydrophobicContact CE2-CB 4.23Å; F335-R342 HydrophobicContact CE2-CG 3.81Å; F335-R342 HydrophobicContact CZ-CG 3.75Å; L338-R342 PolarHBondContact O-N 3.5Å; K339-R342 PolarHBondContact O-N 3.11Å; P340-R342 VanDerWaalsContact C-N 3.34Å; P340-R342 PolarHBondContact O-N 3.13Å; R342-L346 HydrophobicContact CG-CD1 3.73Å; R342-L346 HydrophobicContact CG-CG 4.25Å; R342-L346 VanDerWaalsContact O-CB 3.24Å; R342-L346 WeakPolarHBondContact O-CB 3.36Å; R342-L346 WeakPolarHBondContact O-CG 3.46Å; R342-L346 PolarHBondContact O-N 2.94Å
343	R	83	Confident	82.4	Confident	193 Å²	193	77.4 Å²	77.4	73%	0.728	37%	0.371	S	S	*	.	H	α-helix	trans	-63.1	-44.5	176.9	-75.2	178.6	-179.5	179.7	-1	111.8	K339 P340 L341 C347	K339-R343 WeakPolarHBondContact O-CG 3.43Å; K339-R343 PolarHBondContact O-N 3.38Å; P340-R343 PolarHBondContact O-N 3.38Å; L341-R343 VanDerWaalsContact C-N 3.32Å; L341-R343 PolarHBondContact O-N 2.88Å; R343-C347 WeakPolarHBondContact O-CB 3.36Å; R343-C347 PolarHBondContact O-N 3.13Å
344	I	79	Confident	82.5	Confident	60 Å²	60	82 Å²	82	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-64.1	-48.5	179.5	-68.6	164.6	0	0	0	110.6	I69 P340 L341 C347 K348	I69-I344 HydrophobicContact CD1-CD1 3.78Å; I69-I344 HydrophobicContact CG1-CD1 3.76Å; P340-I344 WeakPolarHBondContact O-CG1 3.2Å; P340-I344 PolarHBondContact O-N 2.78Å; L341-I344 PolarHBondContact O-N 3.01Å; I344-C347 PolarHBondContact O-N 2.04Å; I344-K348 PolarHBondContact O-N 3.47Å
345	L	79.2	Confident	82.5	Confident	47 Å²	47	86.2 Å²	86.2	25%	0.246	41%	0.412	C	S	.	.	H	α-helix	trans	-62.7	-47.6	178.9	-72.9	170.6	0	0	0	111.6	L65 F335 L341 C347 K348 V349	L65-L345 HydrophobicContact CD1-CD2 4.48Å; F335-L345 HydrophobicContact CD2-CD1 3.74Å; F335-L345 HydrophobicContact CE2-CB 4.37Å; F335-L345 HydrophobicContact CE2-CD1 4.21Å; L341-L345 HydrophobicContact CD1-CD1 3.89Å; L341-L345 HydrophobicContact CD1-CG 4.16Å; L341-L345 HydrophobicContact CD2-CD1 4.43Å; L341-L345 HydrophobicContact CG-CD1 3.79Å; L341-L345 HydrophobicContact CG-CG 4.42Å; L341-L345 WeakPolarHBondContact O-CB 3.44Å; L341-L345 WeakPolarHBondContact O-CG 3.4Å; L341-L345 PolarHBondContact O-N 3.36Å; L345-C347 VanDerWaalsContact C-N 3.31Å; L345-C347 PolarHBondContact O-N 3.46Å; L345-K348 PolarHBondContact O-N 3.41Å; L345-V349 WeakPolarHBondContact O-CB 3.48Å; L345-V349 VanDerWaalsContact O-CG2 3.3Å; L345-V349 WeakPolarHBondContact O-CG2 3.25Å; L345-V349 PolarHBondContact O-N 2.89Å
346	L	85	Confident	82.5	Confident	86 Å²	86	84.9 Å²	84.9	45%	0.45	42%	0.416	S	S	.	.	H	α-helix	trans	-62.9	-36.4	177.1	-71.4	173.9	0	0	0	112.4	R342 K350	R342-L346 HydrophobicContact CG-CD1 3.73Å; R342-L346 HydrophobicContact CG-CG 4.25Å; R342-L346 VanDerWaalsContact O-CB 3.24Å; R342-L346 WeakPolarHBondContact O-CB 3.36Å; R342-L346 WeakPolarHBondContact O-CG 3.46Å; R342-L346 PolarHBondContact O-N 2.94Å; L346-K350 WeakPolarHBondContact O-CB 3.35Å; L346-K350 VanDerWaalsContact O-CG 3.26Å; L346-K350 WeakPolarHBondContact O-CG 3.43Å; L346-K350 PolarHBondContact O-N 2.91Å
347	C	84.3	Confident	82.8	Confident	69 Å²	69	85.3 Å²	85.3	47%	0.466	42%	0.416	S	S	.	.	H	α-helix	trans	-64.9	-46.5	176	-168.7	0	0	0	0	111.2	R343 I344 L345 K350 N351	R343-C347 WeakPolarHBondContact O-CB 3.36Å; R343-C347 PolarHBondContact O-N 3.13Å; I344-C347 PolarHBondContact O-N 2.04Å; L345-C347 VanDerWaalsContact C-N 3.31Å; L345-C347 PolarHBondContact O-N 3.46Å; C347-K350 PolarHBondContact O-N 3.13Å; C347-N351 VanDerWaalsContact O-CG 3.27Å; C347-N351 PolarHBondContact O-N 3.04Å
348	K	80.9	Confident	83.2	Confident	127 Å²	127	85.7 Å²	85.7	55%	0.552	43%	0.426	S	S	*	.	H	α-helix	trans	-62.7	-44.4	176.3	-74.8	-167.6	173	-169.1	0	112.5	I344 L345 N351 L352	I344-K348 PolarHBondContact O-N 3.47Å; L345-K348 PolarHBondContact O-N 3.41Å; K348-N351 PolarHBondContact O-N 3.28Å; K348-L352 WeakPolarHBondContact O-CG 3.42Å; K348-L352 PolarHBondContact O-N 3.46Å
349	V	83.5	Confident	83.3	Confident	74 Å²	74	91 Å²	91	45%	0.448	45%	0.452	S	S	.	.	H	α-helix	trans	-62	-45	176.7	171.2	0	0	0	0	110.9	L345 N351 L352 I353	L345-V349 WeakPolarHBondContact O-CB 3.48Å; L345-V349 VanDerWaalsContact O-CG2 3.3Å; L345-V349 WeakPolarHBondContact O-CG2 3.25Å; L345-V349 PolarHBondContact O-N 2.89Å; V349-N351 VanDerWaalsContact C-N 3.3Å; V349-N351 PolarHBondContact O-N 3.34Å; V349-L352 PolarHBondContact O-N 2.67Å; V349-I353 HydrophobicContact CG1-CD1 3.8Å; V349-I353 HydrophobicContact CG1-CG1 4.42Å; V349-I353 VanDerWaalsContact O-CG1 3.31Å; V349-I353 WeakPolarHBondContact O-CG1 3.43Å; V349-I353 PolarHBondContact O-N 2.99Å
350	K	85.7	Confident	83.5	Confident	137 Å²	137	90 Å²	90	60%	0.596	45%	0.453	S	S	*	.	H	α-helix	trans	-59.9	-40.3	175.2	-78.4	-178.9	178.3	-169.1	0	112.3	L346 C347 I353 K354	L346-K350 WeakPolarHBondContact O-CB 3.35Å; L346-K350 VanDerWaalsContact O-CG 3.26Å; L346-K350 WeakPolarHBondContact O-CG 3.43Å; L346-K350 PolarHBondContact O-N 2.91Å; C347-K350 PolarHBondContact O-N 3.13Å; K350-I353 PolarHBondContact O-N 3.37Å; K350-K354 WeakPolarHBondContact O-CG 3.49Å; K350-K354 PolarHBondContact O-N 3.01Å
351	N	84.6	Confident	83.6	Confident	79 Å²	79	94 Å²	94	42%	0.422	47%	0.468	S	S	.	.	H	α-helix	trans	-66.9	-41.3	177.2	-70.4	-9.3	0	0	0	111.8	C347 K348 V349 K354 I355	C347-N351 VanDerWaalsContact O-CG 3.27Å; C347-N351 PolarHBondContact O-N 3.04Å; K348-N351 PolarHBondContact O-N 3.28Å; V349-N351 VanDerWaalsContact C-N 3.3Å; V349-N351 PolarHBondContact O-N 3.34Å; N351-K354 PolarHBondContact O-N 3.34Å; N351-I355 VanDerWaalsContact O-CG1 3.29Å; N351-I355 WeakPolarHBondContact O-CG1 3.05Å; N351-I355 PolarHBondContact O-N 3.1Å
352	L	85.1	Confident	83.5	Confident	117 Å²	117	98.9 Å²	98.9	61%	0.613	49%	0.494	S	S	*	.	H	α-helix	trans	-63.1	-42.4	175	-73.2	169.9	0	0	0	112.2	K348 V349 K354 I355 A356	K348-L352 WeakPolarHBondContact O-CG 3.42Å; K348-L352 PolarHBondContact O-N 3.46Å; V349-L352 PolarHBondContact O-N 2.67Å; L352-K354 VanDerWaalsContact C-N 3.34Å; L352-K354 PolarHBondContact O-N 3.49Å; L352-I355 PolarHBondContact O-N 3.49Å; L352-A356 WeakPolarHBondContact O-CB 3.17Å; L352-A356 PolarHBondContact O-N 3.04Å
353	I	87.1	Confident	83.2	Confident	87 Å²	87	99.2 Å²	99.2	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-61.2	-44.1	175.3	-68.3	167	0	0	0	110.6	V349 K350 I355 A356 Q357	V349-I353 HydrophobicContact CG1-CD1 3.8Å; V349-I353 HydrophobicContact CG1-CG1 4.42Å; V349-I353 VanDerWaalsContact O-CG1 3.31Å; V349-I353 WeakPolarHBondContact O-CG1 3.43Å; V349-I353 PolarHBondContact O-N 2.99Å; K350-I353 PolarHBondContact O-N 3.37Å; I353-I355 PolarHBondContact O-N 3.14Å; I353-A356 PolarHBondContact O-N 3.39Å; I353-Q357 HydrophobicContact CG2-CG 4.35Å; I353-Q357 WeakPolarHBondContact O-CB 3.43Å; I353-Q357 VanDerWaalsContact O-CG 3.28Å; I353-Q357 WeakPolarHBondContact O-CG 3.49Å; I353-Q357 PolarHBondContact O-N 3.39Å
354	K	87.8	Confident	82.7	Confident	138 Å²	138	92.9 Å²	92.9	60%	0.6	49%	0.487	S	S	*	.	H	α-helix	trans	-61.2	-42.7	176.2	-75.8	179.8	176.8	-170.7	0	112.4	K350 N351 L352 Q357 A358	K350-K354 WeakPolarHBondContact O-CG 3.49Å; K350-K354 PolarHBondContact O-N 3.01Å; N351-K354 PolarHBondContact O-N 3.34Å; L352-K354 VanDerWaalsContact C-N 3.34Å; L352-K354 PolarHBondContact O-N 3.49Å; K354-Q357 PolarHBondContact O-N 3.03Å; K354-A358 WeakPolarHBondContact O-CB 3.48Å; K354-A358 PolarHBondContact O-N 3.43Å
355	I	87.7	Confident	82.3	Confident	96 Å²	96	94.7 Å²	94.7	49%	0.492	50%	0.497	S	S	.	.	H	α-helix	trans	-64.2	-45.9	176.9	-67.4	164.2	0	0	0	110.2	N351 L352 I353 Q357 A358 M359	N351-I355 VanDerWaalsContact O-CG1 3.29Å; N351-I355 WeakPolarHBondContact O-CG1 3.05Å; N351-I355 PolarHBondContact O-N 3.1Å; L352-I355 PolarHBondContact O-N 3.49Å; I353-I355 PolarHBondContact O-N 3.14Å; I355-Q357 VanDerWaalsContact C-N 3.33Å; I355-Q357 PolarHBondContact O-N 3.3Å; I355-A358 PolarHBondContact O-N 2.86Å; I355-M359 HydrophobicContact CG2-CG 4.48Å; I355-M359 HydrophobicContact CG2-SD 4.2Å; I355-M359 WeakPolarHBondContact O-CG 3.47Å; I355-M359 PolarHBondContact O-N 3.23Å
356	A	86.2	Confident	81.5	Confident	50 Å²	50	98.1 Å²	98.1	41%	0.413	52%	0.516	S	S	.	.	H	α-helix	trans	-62	-39.7	177.5	0	0	0	0	0	112.3	L352 I353 M359 N360	L352-A356 WeakPolarHBondContact O-CB 3.17Å; L352-A356 PolarHBondContact O-N 3.04Å; I353-A356 PolarHBondContact O-N 3.39Å; A356-M359 PolarHBondContact O-N 3.12Å; A356-N360 PolarHBondContact O-N 3.35Å
357	Q	89	Confident	80.7	Confident	113 Å²	113	98.6 Å²	98.6	53%	0.528	52%	0.523	S	S	.	.	H	α-helix	trans	-64.7	-43.1	174.3	-75.2	175	-25.5	0	0	112.1	I353 K354 I355 N360 Q361	I353-Q357 HydrophobicContact CG2-CG 4.35Å; I353-Q357 WeakPolarHBondContact O-CB 3.43Å; I353-Q357 VanDerWaalsContact O-CG 3.28Å; I353-Q357 WeakPolarHBondContact O-CG 3.49Å; I353-Q357 PolarHBondContact O-N 3.39Å; K354-Q357 PolarHBondContact O-N 3.03Å; I355-Q357 VanDerWaalsContact C-N 3.33Å; I355-Q357 PolarHBondContact O-N 3.3Å; Q357-N360 PolarHBondContact O-N 3.36Å; Q357-Q361 WeakPolarHBondContact O-CG 3.49Å; Q357-Q361 PolarHBondContact O-N 3.29Å
358	A	85.7	Confident	79.7	Confident	42 Å²	42	99.6 Å²	99.6	35%	0.347	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-38.5	176.1	0	0	0	0	0	112.2	K354 I355 Q361 N362	K354-A358 WeakPolarHBondContact O-CB 3.48Å; K354-A358 PolarHBondContact O-N 3.43Å; I355-A358 PolarHBondContact O-N 2.86Å; A358-Q361 PolarHBondContact O-N 3.24Å; A358-N362 PolarHBondContact O-N 3.37Å
359	M	82.8	Confident	78.6	Confident	118 Å²	118	99.5 Å²	99.5	58%	0.581	54%	0.54	S	S	*	.	H	α-helix	trans	-65.1	-41.8	174.4	-70.7	-178.2	80.7	0	0	111.8	I355 A356 Q361 N362 I363	I355-M359 HydrophobicContact CG2-CG 4.48Å; I355-M359 HydrophobicContact CG2-SD 4.2Å; I355-M359 WeakPolarHBondContact O-CG 3.47Å; I355-M359 PolarHBondContact O-N 3.23Å; A356-M359 PolarHBondContact O-N 3.12Å; M359-Q361 PolarHBondContact O-N 3.31Å; M359-N362 PolarHBondContact O-N 3.41Å; M359-I363 VanDerWaalsContact O-CG1 3.32Å; M359-I363 WeakPolarHBondContact O-CG1 3.45Å; M359-I363 PolarHBondContact O-N 3.44Å; M359-I363 VanDerWaalsContact O-N 3.11Å
360	N	83	Confident	77.1	Confident	114 Å²	114	107.7 Å²	107.7	61%	0.61	57%	0.57	S	S	*	*	H	α-helix	trans	-64.2	-37.9	176.2	-78.9	-5.5	0	0	0	112.5	A356 Q357 I363 S364	A356-N360 PolarHBondContact O-N 3.35Å; Q357-N360 PolarHBondContact O-N 3.36Å; N360-I363 PolarHBondContact O-N 3.32Å; N360-S364 PolarHBondContact O-N 3.36Å; N360-S364 VanDerWaalsContact O-N 3.14Å; N360-S364 PolarHBondContact O-OG 3.17Å
361	Q	77.1	Confident	76.6	Confident	128 Å²	128	106.3 Å²	106.3	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-65.4	-42.7	175.1	-75	179.5	-32.7	0	0	112.3	Q357 A358 M359 I363 S364 D365	Q357-Q361 WeakPolarHBondContact O-CG 3.49Å; Q357-Q361 PolarHBondContact O-N 3.29Å; A358-Q361 PolarHBondContact O-N 3.24Å; M359-Q361 PolarHBondContact O-N 3.31Å; Q361-I363 VanDerWaalsContact C-N 3.27Å; Q361-I363 PolarHBondContact O-N 3.24Å; Q361-S364 WeakPolarHBondContact CA-OG 3.38Å; Q361-S364 PolarHBondContact O-N 3.38Å; Q361-S364 PolarHBondContact O-OG 3.21Å; Q361-D365 PolarHBondContact O-N 2.93Å; Q361-D365 VanDerWaalsContact O-N 3.09Å
362	N	75.7	Confident	76.2	Confident	103 Å²	103	107.7 Å²	107.7	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-65.1	-30.5	177	-71.5	-10.2	0	0	0	112.9	A358 M359 N366	A358-N362 PolarHBondContact O-N 3.37Å; M359-N362 PolarHBondContact O-N 3.41Å; N362-N366 PolarHBondContact O-N 3.4Å; N362-N366 PolarHBondContact O-ND2 3.41Å
363	I	74.4	Confident	75.7	Confident	105 Å²	105	107.2 Å²	107.2	54%	0.538	57%	0.574	S	S	.	*	H	α-helix	trans	-71.4	-42.9	175.3	-67.4	165.8	0	0	0	110.5	M359 N360 Q361 D365 N366 T367	M359-I363 VanDerWaalsContact O-CG1 3.32Å; M359-I363 WeakPolarHBondContact O-CG1 3.45Å; M359-I363 PolarHBondContact O-N 3.44Å; M359-I363 VanDerWaalsContact O-N 3.11Å; N360-I363 PolarHBondContact O-N 3.32Å; Q361-I363 VanDerWaalsContact C-N 3.27Å; Q361-I363 PolarHBondContact O-N 3.24Å; I363-D365 VanDerWaalsContact C-N 3.34Å; I363-D365 PolarHBondContact O-N 3.21Å; I363-N366 PolarHBondContact O-N 3.22Å; I363-T367 PolarHBondContact O-N 2.97Å; I363-T367 VanDerWaalsContact O-N 3.13Å; I363-T367 PolarHBondContact O-OG1 3.21Å; I363-T367 VanDerWaalsContact O-OG1 3.14Å
364	S	72.1	Confident	75.1	Confident	60 Å²	60	108.4 Å²	108.4	42%	0.42	58%	0.582	S	S	.	*	H	α-helix	trans	-63	-39.5	178.1	50.2	0	0	0	0	112.8	N360 Q361 T367 S368	N360-S364 PolarHBondContact O-N 3.36Å; N360-S364 VanDerWaalsContact O-N 3.14Å; N360-S364 PolarHBondContact O-OG 3.17Å; Q361-S364 WeakPolarHBondContact CA-OG 3.38Å; Q361-S364 PolarHBondContact O-N 3.38Å; Q361-S364 PolarHBondContact O-OG 3.21Å; S364-T367 WeakPolarHBondContact CA-OG1 3.31Å; S364-T367 PolarHBondContact O-N 3.04Å; S364-T367 PolarHBondContact O-OG1 3.19Å; S364-S368 PolarHBondContact O-N 3.32Å
365	D	71	Confident	74.3	Confident	98 Å²	98	106.5 Å²	106.5	52%	0.524	58%	0.58	S	S	.	*	H	α-helix	trans	-65.2	-43	179	-69.4	-9.3	0	0	0	110.9	Q361 I363 T367 S368	Q361-D365 PolarHBondContact O-N 2.93Å; Q361-D365 VanDerWaalsContact O-N 3.09Å; I363-D365 VanDerWaalsContact C-N 3.34Å; I363-D365 PolarHBondContact O-N 3.21Å; D365-T367 VanDerWaalsContact C-N 3.34Å; D365-T367 PolarHBondContact O-N 2.96Å; D365-S368 PolarHBondContact O-N 3.2Å; D365-S368 PolarHBondContact O-OG 3.32Å
366	N	63.8	Low	73.4	Confident	120 Å²	120	107.2 Å²	107.2	64%	0.642	59%	0.586	S	S	*	*	H	α-helix	trans	-67.9	-27.5	177.6	-78.5	-25.9	0	0	0	114.4	N362 I363 S368	N362-N366 PolarHBondContact O-N 3.4Å; N362-N366 PolarHBondContact O-ND2 3.41Å; I363-N366 PolarHBondContact O-N 3.22Å; N366-S368 VanDerWaalsContact C-N 3.33Å
367	T	66.7	Low	72.4	Confident	96 Å²	96	111.3 Å²	111.3	59%	0.589	60%	0.599	S	S	*	*	H	α-helix	trans	-76.5	-18.2	174.2	41.7	0	0	0	0	113.9	I363 S364 D365	I363-T367 PolarHBondContact O-N 2.97Å; I363-T367 VanDerWaalsContact O-N 3.13Å; I363-T367 PolarHBondContact O-OG1 3.21Å; I363-T367 VanDerWaalsContact O-OG1 3.14Å; S364-T367 WeakPolarHBondContact CA-OG1 3.31Å; S364-T367 PolarHBondContact O-N 3.04Å; S364-T367 PolarHBondContact O-OG1 3.19Å; D365-T367 VanDerWaalsContact C-N 3.34Å; D365-T367 PolarHBondContact O-N 2.96Å
368	S	63.4	Low	71.2	Confident	89 Å²	89	111.2 Å²	111.2	62%	0.622	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-7	178.1	66	0	0	0	0	114.5	S364 D365 N366	S364-S368 PolarHBondContact O-N 3.32Å; D365-S368 PolarHBondContact O-N 3.2Å; D365-S368 PolarHBondContact O-OG 3.32Å; N366-S368 VanDerWaalsContact C-N 3.33Å
369	V	59.2	Low	70	Confident	125 Å²	125	116.9 Å²	116.9	76%	0.758	63%	0.626	S	S	*	*			trans	-101.6	-0.4	179.9	-177.2	0	0	0	0	112.2
370	K	50.4	Low	68.8	Low	247 Å²	247	116.8 Å²	116.8	100%	1.074	63%	0.63	S	S	*	*			trans	-105.8	0	167.7	-72.7	-173.4	178.9	-178	0	109.6

Retrieved 370 of 370 residues in 82.8 ms (Link to these results)

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