A0A087XPH1_POEFO Loading...

Stress-activated protein kinase JNK

Responds to activation by environmental stress and pro-inflammatory cytokines by phosphorylating a number of transcription factors, and thus regulates transcriptional activity. Responds to activation by environmental stress and pro-inflammatory cytokines by phosphorylating a number of transcription factors, primarily components of AP-1 such as c-Jun and ATF2 and thus regulates AP-1 transcriptional activity. May play a role in the regulation of the circadian clock.

AlphaFold DB , UniProt , Accession A0A087XPH1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 420 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	66.3	Low	240 Å²	240	103.6 Å²	103.6	100%	1.182	55%	0.548	S	S	*	.				0	112.9	0	-88.8	171.7	170.8	0	0	106.4
2	N	35.5	Very low	68.5	Low	122 Å²	122	104.3 Å²	104.3	65%	0.652	55%	0.546	S	S	*	.			trans	-77.8	120.2	-168.5	-83.8	-22.3	0	0	0	110.8	A4 E5	N2-A4 PolarHBondContact O-N 3.37Å; N2-E5 PolarHBondContact O-N 3.25Å
3	E	41.3	Very low	70.1	Confident	189 Å²	189	97.5 Å²	97.5	88%	0.883	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-56.9	-17.4	178.3	-70.6	177.6	152.8	0	0	113.9
4	A	44.4	Very low	71	Confident	44 Å²	44	95 Å²	95	36%	0.364	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-82.2	-22.3	-177.4	0	0	0	0	0	115.6	N2 G6	N2-A4 PolarHBondContact O-N 3.37Å; A4-G6 PolarHBondContact O-N 3.19Å
5	E	46.8	Very low	71.8	Confident	156 Å²	156	100.3 Å²	100.3	73%	0.729	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-70.3	-12.3	172.8	-81.6	176.6	174.9	0	0	112.2	N2	N2-E5 PolarHBondContact O-N 3.25Å
6	G	62.3	Low	72.8	Confident	39 Å²	39	95.6 Å²	95.6	40%	0.402	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-85.7	-7.6	-178.6	0	0	0	0	0	116	A4 K22	A4-G6 PolarHBondContact O-N 3.19Å; G6-K22 VanDerWaalsContact O-CD 3.28Å; G6-K22 WeakPolarHBondContact O-CD 3.5Å; G6-K22 WeakPolarHBondContact O-CE 3.37Å; G6-K22 PolarHBondContact O-NZ 2.96Å
7	Q	86	Confident	74	Confident	115 Å²	115	93.5 Å²	93.5	54%	0.537	52%	0.516	S	S	.	.	S	Bend	trans	-96	-26.2	-169.4	-74.2	-173.2	-6.2	0	0	115.5	L21 K22	Q7-L21 HydrophobicContact CB-CD2 4.43Å; Q7-K22 WeakPolarHBondContact O-CG 3.35Å; Q7-K22 PolarHBondContact O-N 3.36Å
8	F	94.1	Very high	75.2	Confident	46 Å²	46	88.3 Å²	88.3	20%	0.202	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	159.4	-178.1	-65.3	-92.4	0	0	0	111.6	T19 V20 L21 F90 P92	F8-T19 HydrophobicContact CB-CG2 4.01Å; F8-V20 CarbonylContact C-O 3.55Å; F8-V20 VanDerWaalsContact CA-O 3.26Å; F8-V20 WeakPolarHBondContact CA-O 3.32Å; F8-V20 VanDerWaalsContact CD1-C 3.47Å; F8-L21 HydrophobicContact CD1-CD2 4.06Å; F8-L21 HydrophobicContact CD1-CG 4.29Å; F8-L21 HydrophobicContact CD2-CD2 4.43Å; F8-L21 HydrophobicContact CE1-CD2 3.51Å; F8-L21 HydrophobicContact CE1-CG 3.73Å; F8-L21 HydrophobicContact CE2-CD2 3.95Å; F8-L21 HydrophobicContact CG-CD2 4.49Å; F8-L21 HydrophobicContact CZ-CD2 3.45Å; F8-L21 VanDerWaalsContact CZ-CD2 3.45Å; F8-L21 HydrophobicContact CZ-CG 4.12Å; F8-F90 AromaticContact CE1-CD2 3.68Å; F8-F90 HydrophobicContact CE1-CD2 3.68Å; F8-F90 AromaticContact CE1-CE2 3.99Å; F8-F90 HydrophobicContact CE1-CE2 3.99Å; F8-F90 HydrophobicContact CZ-CD2 4.44Å; F8-P92 HydrophobicContact CD1-CB 3.94Å; F8-P92 HydrophobicContact CE1-CB 4.07Å; F8-P92 HydrophobicContact CG-CB 4.35Å
9	Y	95.3	Very high	76.2	Confident	65 Å²	65	85.4 Å²	85.4	26%	0.255	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.2	166.1	76.2	-72.2	0	0	0	109.6	V11 T19 V20 K22 Y24 L27	Y9-V11 HydrophobicContact CD2-CG2 3.71Å; Y9-V11 HydrophobicContact CE2-CG2 3.28Å; Y9-T19 WeakPolarHBondContact O-CA 3.32Å; Y9-V20 HydrophobicContact CD1-CG2 4.13Å; Y9-V20 WeakPolarHBondContact CD1-O 3.47Å; Y9-V20 HydrophobicContact CE1-CG2 3.55Å; Y9-V20 PolarHBondContact N-O 3.3Å; Y9-V20 PolarHBondContact O-N 3.25Å; Y9-K22 HydrophobicContact CD1-CB 4.49Å; Y9-K22 HydrophobicContact CD1-CG 4Å; Y9-Y24 VanDerWaalsContact CE1-O 3.28Å; Y9-Y24 WeakPolarHBondContact CE1-O 3.34Å; Y9-Y24 PolarHBondContact OH-O 3.43Å; Y9-L27 VanDerWaalsContact OH-CD1 3.28Å; Y9-L27 WeakPolarHBondContact OH-CD1 3.35Å
10	S	94.9	Very high	77.2	Confident	76 Å²	76	81.1 Å²	81.1	53%	0.531	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.9	-177.1	-59.1	0	0	0	0	111.4	F18 T19	S10-F18 CarbonylContact C-O 3.58Å; S10-F18 VanDerWaalsContact CA-O 3.22Å; S10-F18 WeakPolarHBondContact CA-O 3.44Å; S10-T19 PolarHBondContact OG-OG1 2.96Å
11	V	94.4	Very high	78.1	Confident	48 Å²	48	78.6 Å²	78.6	29%	0.291	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	138.8	175.3	177.5	0	0	0	0	109.1	Y9 V13 F18	Y9-V11 HydrophobicContact CD2-CG2 3.71Å; Y9-V11 HydrophobicContact CE2-CG2 3.28Å; V11-V13 HydrophobicContact CG1-CG2 4.25Å; V11-F18 PolarHBondContact N-O 3.23Å; V11-F18 PolarHBondContact O-N 3.29Å
12	Q	93.4	Very high	81	Confident	112 Å²	112	72.4 Å²	72.4	52%	0.523	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.8	173.2	-166.5	62.8	23.7	0	0	110	G14 S16 T17	Q12-G14 PolarHBondContact NE2-O 3Å; Q12-S16 PolarHBondContact NE2-O 3.44Å; Q12-T17 PolarHBondContact OE1-OG1 3.2Å
13	V	89.1	Confident	83.8	Confident	15 Å²	15	69.5 Å²	69.5	9%	0.091	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	98.9	178.7	-176.6	0	0	0	0	108.4	V11 D15 S16 F18 A29 I37	V11-V13 HydrophobicContact CG1-CG2 4.25Å; V13-D15 PolarHBondContact O-N 3.36Å; V13-S16 CarbonylContact C-O 3.56Å; V13-S16 PolarHBondContact N-O 3.27Å; V13-S16 PolarHBondContact O-N 3.33Å; V13-S16 VanDerWaalsContact O-N 3.12Å; V13-S16 VanDerWaalsContact O-O 3.12Å; V13-F18 HydrophobicContact CB-CD2 3.74Å; V13-F18 HydrophobicContact CB-CE2 4Å; V13-F18 HydrophobicContact CG1-CE2 4.35Å; V13-F18 HydrophobicContact CG2-CB 4.23Å; V13-F18 HydrophobicContact CG2-CD2 3.73Å; V13-F18 HydrophobicContact CG2-CE2 4.32Å; V13-F18 HydrophobicContact CG2-CG 4.03Å; V13-A29 HydrophobicContact CG1-CB 3.68Å; V13-I37 HydrophobicContact CG1-CG2 4.45Å
14	G	82.5	Confident	86.5	Confident	63 Å²	63	60.5 Å²	60.5	65%	0.649	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	-126.6	-169	0	0	0	0	0	110.6	Q12 S16	Q12-G14 PolarHBondContact NE2-O 3Å; G14-S16 VanDerWaalsContact C-N 3.32Å; G14-S16 PolarHBondContact O-N 3.48Å
15	D	83.1	Confident	88.9	Confident	174 Å²	174	62.6 Å²	62.6	93%	0.93	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	5.8	-179.7	-58.5	-32.3	0	0	0	113.8	V13	V13-D15 PolarHBondContact O-N 3.36Å
16	S	87.8	Confident	91.1	Very high	25 Å²	25	62.3 Å²	62.3	18%	0.175	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142	-178.4	-159.4	0	0	0	0	112.7	Q12 V13 G14	Q12-S16 PolarHBondContact NE2-O 3.44Å; V13-S16 CarbonylContact C-O 3.56Å; V13-S16 PolarHBondContact N-O 3.27Å; V13-S16 PolarHBondContact O-N 3.33Å; V13-S16 VanDerWaalsContact O-N 3.12Å; V13-S16 VanDerWaalsContact O-O 3.12Å; G14-S16 VanDerWaalsContact C-N 3.32Å; G14-S16 PolarHBondContact O-N 3.48Å
17	T	93.1	Very high	92.7	Very high	61 Å²	61	61.8 Å²	61.8	37%	0.374	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	122.8	172.9	-50.1	0	0	0	0	110	Q12 K54	Q12-T17 PolarHBondContact OE1-OG1 3.2Å; T17-K54 PolarHBondContact O-NZ 3.36Å
18	F	95.3	Very high	93.1	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.9	171.9	-86.8	-116	0	0	0	108.8	S10 V11 V13 V20 L27 I37 C39 K54 Y103	S10-F18 CarbonylContact C-O 3.58Å; S10-F18 VanDerWaalsContact CA-O 3.22Å; S10-F18 WeakPolarHBondContact CA-O 3.44Å; V11-F18 PolarHBondContact N-O 3.23Å; V11-F18 PolarHBondContact O-N 3.29Å; V13-F18 HydrophobicContact CB-CD2 3.74Å; V13-F18 HydrophobicContact CB-CE2 4Å; V13-F18 HydrophobicContact CG1-CE2 4.35Å; V13-F18 HydrophobicContact CG2-CB 4.23Å; V13-F18 HydrophobicContact CG2-CD2 3.73Å; V13-F18 HydrophobicContact CG2-CE2 4.32Å; V13-F18 HydrophobicContact CG2-CG 4.03Å; F18-V20 HydrophobicContact CB-CG1 4.22Å; F18-V20 HydrophobicContact CD1-CG1 4.18Å; F18-L27 HydrophobicContact CB-CD2 3.98Å; F18-L27 HydrophobicContact CD1-CD2 3.86Å; F18-L27 HydrophobicContact CG-CD2 4.2Å; F18-I37 HydrophobicContact CE2-CB 3.87Å; F18-I37 HydrophobicContact CE2-CD1 4.44Å; F18-I37 HydrophobicContact CE2-CG2 3.7Å; F18-I37 HydrophobicContact CZ-CB 3.71Å; F18-I37 HydrophobicContact CZ-CG2 3.63Å; F18-C39 HydrophobicContact CE1-CB 4.29Å; F18-K54 HydrophobicContact CD1-CB 4.43Å; F18-K54 HydrophobicContact CD2-CD 4.42Å; F18-K54 HydrophobicContact CE1-CB 3.74Å; F18-K54 HydrophobicContact CE2-CB 4.29Å; F18-K54 HydrophobicContact CE2-CD 4.31Å; F18-K54 HydrophobicContact CZ-CB 3.65Å; F18-K54 HydrophobicContact CZ-CD 4.49Å; F18-Y103 HydrophobicContact CD1-CD1 4.38Å; F18-Y103 AromaticContact CD1-CE1 3.8Å; F18-Y103 HydrophobicContact CD1-CE1 3.8Å; F18-Y103 HydrophobicContact CE1-CE1 4.26Å; F18-Y103 HydrophobicContact CG-CE1 4.29Å
19	T	95.5	Very high	92.9	Very high	32 Å²	32	65.8 Å²	65.8	20%	0.196	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	101.8	172.9	-58.5	0	0	0	0	107.9	F8 Y9 S10 P92 Y103	F8-T19 HydrophobicContact CB-CG2 4.01Å; Y9-T19 WeakPolarHBondContact O-CA 3.32Å; S10-T19 PolarHBondContact OG-OG1 2.96Å; T19-P92 HydrophobicContact CG2-CB 3.58Å; T19-P92 HydrophobicContact CG2-CG 4.21Å; T19-Y103 PolarHBondContact N-OH 3.18Å
20	V	95.9	Very high	92.5	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	159.6	-167.3	-59.4	0	0	0	0	111.8	F8 Y9 F18 L27 V52 F90 Y103	F8-V20 CarbonylContact C-O 3.55Å; F8-V20 VanDerWaalsContact CA-O 3.26Å; F8-V20 WeakPolarHBondContact CA-O 3.32Å; F8-V20 VanDerWaalsContact CD1-C 3.47Å; Y9-V20 HydrophobicContact CD1-CG2 4.13Å; Y9-V20 WeakPolarHBondContact CD1-O 3.47Å; Y9-V20 HydrophobicContact CE1-CG2 3.55Å; Y9-V20 PolarHBondContact N-O 3.3Å; Y9-V20 PolarHBondContact O-N 3.25Å; F18-V20 HydrophobicContact CB-CG1 4.22Å; F18-V20 HydrophobicContact CD1-CG1 4.18Å; V20-L27 HydrophobicContact CG1-CD2 4.09Å; V20-L27 HydrophobicContact CG2-CD1 4Å; V20-L27 HydrophobicContact CG2-CD2 3.98Å; V20-V52 HydrophobicContact CG1-CG1 4.34Å; V20-F90 HydrophobicContact CB-CE2 4.32Å; V20-F90 HydrophobicContact CB-CZ 3.94Å; V20-F90 HydrophobicContact CG1-CE2 4.39Å; V20-F90 HydrophobicContact CG1-CZ 3.97Å; V20-Y103 HydrophobicContact CG1-CD1 4.03Å; V20-Y103 HydrophobicContact CG1-CE1 3.88Å
21	L	95.4	Very high	91.7	Very high	29 Å²	29	64.9 Å²	64.9	15%	0.152	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	139.6	174.7	-68.6	169.5	0	0	0	110.7	Q7 F8 R23 Y24 F90	Q7-L21 HydrophobicContact CB-CD2 4.43Å; F8-L21 HydrophobicContact CD1-CD2 4.06Å; F8-L21 HydrophobicContact CD1-CG 4.29Å; F8-L21 HydrophobicContact CD2-CD2 4.43Å; F8-L21 HydrophobicContact CE1-CD2 3.51Å; F8-L21 HydrophobicContact CE1-CG 3.73Å; F8-L21 HydrophobicContact CE2-CD2 3.95Å; F8-L21 HydrophobicContact CG-CD2 4.49Å; F8-L21 HydrophobicContact CZ-CD2 3.45Å; F8-L21 VanDerWaalsContact CZ-CD2 3.45Å; F8-L21 HydrophobicContact CZ-CG 4.12Å; L21-R23 HydrophobicContact CB-CG 3.93Å; L21-R23 PolarHBondContact O-N 3.34Å; L21-Y24 HydrophobicContact CB-CD2 3.91Å; L21-Y24 HydrophobicContact CB-CE2 3.96Å; L21-Y24 HydrophobicContact CD1-CE2 4Å; L21-Y24 HydrophobicContact CG-CE2 4.43Å; L21-Y24 PolarHBondContact O-N 3.46Å; L21-F90 HydrophobicContact CD1-CB 4.41Å; L21-F90 HydrophobicContact CD1-CD1 4.06Å; L21-F90 HydrophobicContact CD1-CG 4.13Å; L21-F90 HydrophobicContact CG-CD2 4.4Å; L21-F90 HydrophobicContact CG-CG 4.34Å
22	K	94.8	Very high	90.7	Very high	110 Å²	110	67.5 Å²	67.5	48%	0.478	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-18.6	178.6	-76.2	-178.5	179.7	172.4	0	114.9	G6 Q7 Y9 Y24 Q25	G6-K22 VanDerWaalsContact O-CD 3.28Å; G6-K22 WeakPolarHBondContact O-CD 3.5Å; G6-K22 WeakPolarHBondContact O-CE 3.37Å; G6-K22 PolarHBondContact O-NZ 2.96Å; Q7-K22 WeakPolarHBondContact O-CG 3.35Å; Q7-K22 PolarHBondContact O-N 3.36Å; Y9-K22 HydrophobicContact CD1-CB 4.49Å; Y9-K22 HydrophobicContact CD1-CG 4Å; K22-Y24 VanDerWaalsContact C-N 3.27Å; K22-Y24 PolarHBondContact O-N 3.45Å; K22-Q25 PolarHBondContact O-NE2 3.03Å
23	R	95.3	Very high	89.4	Confident	60 Å²	60	64.3 Å²	64.3	23%	0.226	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-30	174.2	71.2	-177.1	-71.2	178.9	-6.2	112.8	L21 L42 D43 T44 V45	L21-R23 HydrophobicContact CB-CG 3.93Å; L21-R23 PolarHBondContact O-N 3.34Å; R23-L42 VanDerWaalsContact O-O 3.14Å; R23-D43 IonicContact CZ-OD1 3.77Å; R23-D43 IonicContact CZ-OD2 3.46Å; R23-D43 IonicContact NE-OD1 2.69Å; R23-D43 PolarHBondContact NE-OD1 3.5Å; R23-D43 IonicContact NE-OD2 3.26Å; R23-D43 PolarHBondContact NE-OD2 3.1Å; R23-D43 VanDerWaalsContact NH2-CG 3.29Å; R23-D43 IonicContact NH2-OD1 3.98Å; R23-D43 PolarHBondContact NH2-OD1 2.67Å; R23-D43 VanDerWaalsContact NH2-OD1 3.1Å; R23-D43 IonicContact NH2-OD2 2.77Å; R23-D43 PolarHBondContact NH2-OD2 2.86Å; R23-T44 WeakPolarHBondContact CA-OG1 2.98Å; R23-T44 PolarHBondContact O-N 3.06Å; R23-T44 PolarHBondContact O-OG1 2.84Å; R23-V45 HydrophobicContact CB-CG2 3.87Å
24	Y	96.8	Very high	88.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	108.8	179.9	-54.2	-57.6	0	0	0	108.9	Y9 L21 K22 L27 L42 D43 V50 V52 N88 F90 V105	Y9-Y24 VanDerWaalsContact CE1-O 3.28Å; Y9-Y24 WeakPolarHBondContact CE1-O 3.34Å; Y9-Y24 PolarHBondContact OH-O 3.43Å; L21-Y24 HydrophobicContact CB-CD2 3.91Å; L21-Y24 HydrophobicContact CB-CE2 3.96Å; L21-Y24 HydrophobicContact CD1-CE2 4Å; L21-Y24 HydrophobicContact CG-CE2 4.43Å; L21-Y24 PolarHBondContact O-N 3.46Å; K22-Y24 VanDerWaalsContact C-N 3.27Å; K22-Y24 PolarHBondContact O-N 3.45Å; Y24-L27 WeakPolarHBondContact O-CD1 3.4Å; Y24-L42 WeakPolarHBondContact CA-O 3.38Å; Y24-D43 HydrophobicContact CD1-CB 4.06Å; Y24-D43 HydrophobicContact CE1-CB 4.05Å; Y24-V50 HydrophobicContact CD1-CG2 3.91Å; Y24-V50 HydrophobicContact CE1-CG2 4.2Å; Y24-V52 HydrophobicContact CG-CG2 4.48Å; Y24-N88 WeakPolarHBondContact OH-CB 3.44Å; Y24-N88 PolarHBondContact OH-ND2 3.25Å; Y24-F90 HydrophobicContact CD2-CE1 4Å; Y24-F90 HydrophobicContact CD2-CZ 4.29Å; Y24-F90 HydrophobicContact CE2-CD1 4.08Å; Y24-F90 AromaticContact CE2-CE1 3.46Å; Y24-F90 HydrophobicContact CE2-CE1 3.46Å; Y24-F90 VanDerWaalsContact CE2-CE1 3.46Å; Y24-F90 HydrophobicContact CE2-CZ 4.18Å; Y24-V105 HydrophobicContact CE1-CG1 3.87Å; Y24-V105 HydrophobicContact CE1-CG2 4.34Å; Y24-V105 HydrophobicContact CE2-CG2 3.91Å
25	Q	95.1	Very high	87.4	Confident	89 Å²	89	68 Å²	68	42%	0.416	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	166.5	-175.7	-62.8	-172.3	0.7	0	0	111.2	K22 L27 A41 L42 T44	K22-Q25 PolarHBondContact O-NE2 3.03Å; Q25-L27 PolarHBondContact O-N 3.42Å; Q25-A41 CarbonylContact O-C 3.51Å; Q25-A41 WeakPolarHBondContact O-CA 3.28Å; Q25-A41 WeakPolarHBondContact O-CB 3.36Å; Q25-L42 PolarHBondContact N-O 2.77Å; Q25-L42 PolarHBondContact O-N 3.19Å; Q25-T44 HydrophobicContact CB-CG2 4.27Å; Q25-T44 HydrophobicContact CG-CG2 3.84Å
26	Q	94.1	Very high	87.1	Confident	150 Å²	150	59.9 Å²	59.9	70%	0.701	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.1	44.8	174.3	-55.8	175.4	-18.2	0	0	113.1	R28	Q26-R28 PolarHBondContact O-N 3.35Å
27	L	95.4	Very high	87	Confident	28 Å²	28	60 Å²	60	15%	0.147	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	124.9	179.4	-87.7	72.7	0	0	0	110.8	Y9 F18 V20 Y24 Q25 C39 S40 A41	Y9-L27 VanDerWaalsContact OH-CD1 3.28Å; Y9-L27 WeakPolarHBondContact OH-CD1 3.35Å; F18-L27 HydrophobicContact CB-CD2 3.98Å; F18-L27 HydrophobicContact CD1-CD2 3.86Å; F18-L27 HydrophobicContact CG-CD2 4.2Å; V20-L27 HydrophobicContact CG1-CD2 4.09Å; V20-L27 HydrophobicContact CG2-CD1 4Å; V20-L27 HydrophobicContact CG2-CD2 3.98Å; Y24-L27 WeakPolarHBondContact O-CD1 3.4Å; Q25-L27 PolarHBondContact O-N 3.42Å; L27-C39 HydrophobicContact CB-CB 4.38Å; L27-C39 HydrophobicContact CD2-CB 4.35Å; L27-C39 HydrophobicContact CG-CB 4.23Å; L27-S40 CarbonylContact C-O 3.53Å; L27-S40 VanDerWaalsContact CA-O 3.3Å; L27-S40 WeakPolarHBondContact CA-O 3.38Å; L27-A41 HydrophobicContact CD1-CB 3.92Å; L27-A41 HydrophobicContact CG-CB 4.19Å
28	R	93.5	Very high	86.9	Confident	187 Å²	187	58.7 Å²	58.7	71%	0.706	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.2	124.8	173.7	178.6	-178.3	-178	-178.6	1.2	109.7	Q26 I30 C39 S40	Q26-R28 PolarHBondContact O-N 3.35Å; R28-I30 PolarHBondContact O-N 2.98Å; R28-C39 CarbonylContact O-C 3.59Å; R28-C39 WeakPolarHBondContact O-CA 3.45Å; R28-S40 PolarHBondContact N-O 3.24Å; R28-S40 PolarHBondContact O-N 3.4Å; R28-S40 PolarHBondContact O-OG 2.75Å
29	A	90.6	Very high	86.9	Confident	57 Å²	57	58.7 Å²	58.7	47%	0.471	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	129.4	175.1	0	0	0	0	0	110.9	V13	V13-A29 HydrophobicContact CG1-CB 3.68Å
30	I	86.9	Confident	86.9	Confident	89 Å²	89	58.2 Å²	58.2	46%	0.456	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	-20.3	176.5	59.3	174.2	0	0	0	112.6	R28 V38 L108	R28-I30 PolarHBondContact O-N 2.98Å; I30-V38 HydrophobicContact CD1-CG1 3.9Å; I30-V38 HydrophobicContact CG1-CB 4.15Å; I30-V38 HydrophobicContact CG1-CG1 3.9Å; I30-V38 WeakPolarHBondContact CG1-O 3.37Å; I30-V38 PolarHBondContact N-O 3.47Å; I30-L108 HydrophobicContact CD1-CD1 3.58Å
31	G	77.6	Confident	86.9	Confident	33 Å²	33	58.5 Å²	58.5	34%	0.34	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	149.3	177.7	0	0	0	0	0	112.6	V38	G31-V38 PolarHBondContact N-O 3.17Å; G31-V38 PolarHBondContact O-N 3.31Å
32	S	73.5	Confident	87	Confident	104 Å²	104	60 Å²	60	73%	0.727	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.2	133.9	172.7	-179.7	0	0	0	0	108.3
33	G	66.9	Low	87.1	Confident	44 Å²	44	54.7 Å²	54.7	45%	0.454	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	178.2	179.5	0	0	0	0	0	112.4	Q35 G36	G33-Q35 PolarHBondContact O-N 3.35Å; G33-G36 PolarHBondContact N-O 2.99Å; G33-G36 PolarHBondContact O-N 3.43Å; G33-G36 VanDerWaalsContact O-N 3.15Å
34	A	63.2	Low	87.1	Confident	108 Å²	108	55 Å²	55	89%	0.893	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-23.2	-177.6	0	0	0	0	0	114
35	Q	65.5	Low	86.9	Confident	47 Å²	47	59.8 Å²	59.8	22%	0.22	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-18	-176	-60.8	167.8	25.8	0	0	113.4	G33 K53 L55 C56 D167	G33-Q35 PolarHBondContact O-N 3.35Å; Q35-K53 VanDerWaalsContact OE1-NZ 3.16Å; Q35-L55 WeakPolarHBondContact O-CA 3.47Å; Q35-C56 PolarHBondContact O-N 3.27Å; Q35-C56 VanDerWaalsContact O-N 3.07Å; Q35-D167 PolarHBondContact NE2-OD2 3.4Å; Q35-D167 PolarHBondContact OE1-OD1 2.95Å; Q35-D167 PolarHBondContact OE1-OD2 3.06Å
36	G	77.1	Confident	86.8	Confident	4 Å²	4	58.6 Å²	58.6	4%	0.041	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.2	171.7	-167.7	0	0	0	0	0	114.3	G33 K54 C56	G33-G36 PolarHBondContact N-O 2.99Å; G33-G36 PolarHBondContact O-N 3.43Å; G33-G36 VanDerWaalsContact O-N 3.15Å; G36-K54 CarbonylContact C-O 3.58Å; G36-K54 WeakPolarHBondContact CA-O 3.13Å; G36-C56 VanDerWaalsContact CA-SG 3.57Å
37	I	86.5	Confident	86.8	Confident	27 Å²	27	54.2 Å²	54.2	14%	0.138	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.1	170.9	-58.9	171.5	0	0	0	107.5	V13 F18 K53 K54	V13-I37 HydrophobicContact CG1-CG2 4.45Å; F18-I37 HydrophobicContact CE2-CB 3.87Å; F18-I37 HydrophobicContact CE2-CD1 4.44Å; F18-I37 HydrophobicContact CE2-CG2 3.7Å; F18-I37 HydrophobicContact CZ-CB 3.71Å; F18-I37 HydrophobicContact CZ-CG2 3.63Å; I37-K53 WeakPolarHBondContact O-CA 3.31Å; I37-K54 PolarHBondContact N-O 2.98Å; I37-K54 VanDerWaalsContact N-O 3.12Å; I37-K54 PolarHBondContact O-N 3.35Å
38	V	90.3	Very high	86.7	Confident	34 Å²	34	54.3 Å²	54.3	21%	0.206	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.8	-179.5	-168.8	0	0	0	0	109.4	I30 G31 A51 V52 K53	I30-V38 HydrophobicContact CD1-CG1 3.9Å; I30-V38 HydrophobicContact CG1-CB 4.15Å; I30-V38 HydrophobicContact CG1-CG1 3.9Å; I30-V38 WeakPolarHBondContact CG1-O 3.37Å; I30-V38 PolarHBondContact N-O 3.47Å; G31-V38 PolarHBondContact N-O 3.17Å; G31-V38 PolarHBondContact O-N 3.31Å; V38-A51 HydrophobicContact CG1-CB 4.13Å; V38-V52 WeakPolarHBondContact CA-O 3.5Å; V38-K53 HydrophobicContact CG2-CB 4.09Å; V38-K53 HydrophobicContact CG2-CG 4.02Å
39	C	94.4	Very high	86.8	Confident	0 Å²	0	49 Å²	49	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	139.5	171.8	-65.4	0	0	0	0	110.6	F18 L27 R28 A51 V52	F18-C39 HydrophobicContact CE1-CB 4.29Å; L27-C39 HydrophobicContact CB-CB 4.38Å; L27-C39 HydrophobicContact CD2-CB 4.35Å; L27-C39 HydrophobicContact CG-CB 4.23Å; R28-C39 CarbonylContact O-C 3.59Å; R28-C39 WeakPolarHBondContact O-CA 3.45Å; C39-A51 CarbonylContact O-C 3.6Å; C39-A51 WeakPolarHBondContact O-CA 3.49Å; C39-V52 PolarHBondContact N-O 2.77Å; C39-V52 PolarHBondContact O-N 3.19Å
40	S	95.4	Very high	87.1	Confident	22 Å²	22	46.3 Å²	46.3	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	145.3	155.9	61.4	0	0	0	0	109.5	L27 R28 V50	L27-S40 CarbonylContact C-O 3.53Å; L27-S40 VanDerWaalsContact CA-O 3.3Å; L27-S40 WeakPolarHBondContact CA-O 3.38Å; R28-S40 PolarHBondContact N-O 3.24Å; R28-S40 PolarHBondContact O-N 3.4Å; R28-S40 PolarHBondContact O-OG 2.75Å; S40-V50 CarbonylContact C-O 3.58Å; S40-V50 WeakPolarHBondContact CA-O 3.1Å
41	A	97.2	Very high	87.5	Confident	6 Å²	6	42.5 Å²	42.5	5%	0.05	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158.3	173.1	0	0	0	0	0	110	Q25 L27 P49 V50 V52	Q25-A41 CarbonylContact O-C 3.51Å; Q25-A41 WeakPolarHBondContact O-CA 3.28Å; Q25-A41 WeakPolarHBondContact O-CB 3.36Å; L27-A41 HydrophobicContact CD1-CB 3.92Å; L27-A41 HydrophobicContact CG-CB 4.19Å; A41-P49 WeakPolarHBondContact O-CA 3.28Å; A41-V50 HydrophobicContact CB-CG2 4.18Å; A41-V50 PolarHBondContact N-O 3.1Å; A41-V50 WeakPolarHBondContact O-CG2 3.41Å; A41-V50 PolarHBondContact O-N 3.29Å; A41-V52 HydrophobicContact CB-CG2 4.04Å
42	L	97.1	Very high	88.3	Confident	60 Å²	60	41 Å²	41	31%	0.314	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	122	167.7	179.1	64.7	0	0	0	109.1	R23 Y24 Q25 T44	R23-L42 VanDerWaalsContact O-O 3.14Å; Y24-L42 WeakPolarHBondContact CA-O 3.38Å; Q25-L42 PolarHBondContact N-O 2.77Å; Q25-L42 PolarHBondContact O-N 3.19Å; L42-T44 PolarHBondContact O-N 2.75Å
43	D	96.8	Very high	89.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	101.2	169	-173.1	-13.5	0	0	0	109.7	R23 Y24 V45 L46 G47 I48 V50	R23-D43 IonicContact CZ-OD1 3.77Å; R23-D43 IonicContact CZ-OD2 3.46Å; R23-D43 IonicContact NE-OD1 2.69Å; R23-D43 PolarHBondContact NE-OD1 3.5Å; R23-D43 IonicContact NE-OD2 3.26Å; R23-D43 PolarHBondContact NE-OD2 3.1Å; R23-D43 VanDerWaalsContact NH2-CG 3.29Å; R23-D43 IonicContact NH2-OD1 3.98Å; R23-D43 PolarHBondContact NH2-OD1 2.67Å; R23-D43 VanDerWaalsContact NH2-OD1 3.1Å; R23-D43 IonicContact NH2-OD2 2.77Å; R23-D43 PolarHBondContact NH2-OD2 2.86Å; Y24-D43 HydrophobicContact CD1-CB 4.06Å; Y24-D43 HydrophobicContact CE1-CB 4.05Å; D43-V45 PolarHBondContact O-N 3.33Å; D43-V45 PolarHBondContact OD1-N 3.33Å; D43-L46 HydrophobicContact CB-CB 4.34Å; D43-L46 PolarHBondContact O-N 2.87Å; D43-L46 PolarHBondContact OD1-N 3.31Å; D43-L46 WeakPolarHBondContact OD2-CD1 3.44Å; D43-G47 WeakPolarHBondContact O-CA 3.43Å; D43-G47 PolarHBondContact O-N 2.87Å; D43-I48 PolarHBondContact N-O 2.99Å; D43-V50 HydrophobicContact CB-CG1 3.91Å; D43-V50 HydrophobicContact CB-CG2 4.2Å
44	T	95.3	Very high	90.5	Very high	65 Å²	65	35.7 Å²	35.7	40%	0.399	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.5	-177.3	54.2	0	0	0	0	114.7	R23 Q25 L42	R23-T44 WeakPolarHBondContact CA-OG1 2.98Å; R23-T44 PolarHBondContact O-N 3.06Å; R23-T44 PolarHBondContact O-OG1 2.84Å; Q25-T44 HydrophobicContact CB-CG2 4.27Å; Q25-T44 HydrophobicContact CG-CG2 3.84Å; L42-T44 PolarHBondContact O-N 2.75Å
45	V	93.6	Very high	91.6	Very high	101 Å²	101	30.9 Å²	30.9	61%	0.612	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-39.8	176.3	173.3	0	0	0	0	111	R23 D43	R23-V45 HydrophobicContact CB-CG2 3.87Å; D43-V45 PolarHBondContact O-N 3.33Å; D43-V45 PolarHBondContact OD1-N 3.33Å
46	L	92	Very high	92.2	Very high	64 Å²	64	31.2 Å²	31.2	34%	0.335	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-17.6	178.8	-65.5	179.1	0	0	0	113	D43 I48 I87	D43-L46 HydrophobicContact CB-CB 4.34Å; D43-L46 PolarHBondContact O-N 2.87Å; D43-L46 PolarHBondContact OD1-N 3.31Å; D43-L46 WeakPolarHBondContact OD2-CD1 3.44Å; L46-I48 HydrophobicContact CB-CD1 4.15Å; L46-I48 HydrophobicContact CB-CG1 3.77Å; L46-I48 HydrophobicContact CD1-CD1 4.04Å; L46-I48 HydrophobicContact CD1-CG1 4.36Å; L46-I48 PolarHBondContact O-N 3.27Å; L46-I87 HydrophobicContact CD1-CG2 3.7Å
47	G	93.3	Very high	92.3	Very high	58 Å²	58	39.7 Å²	39.7	60%	0.598	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.4	14.1	-175.5	0	0	0	0	0	114.3	D43	D43-G47 WeakPolarHBondContact O-CA 3.43Å; D43-G47 PolarHBondContact O-N 2.87Å
48	I	93.6	Very high	92.2	Very high	31 Å²	31	38.6 Å²	38.6	16%	0.159	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	150.9	-175.2	66.1	177.9	0	0	0	112	D43 L46 V50 I87 V377	D43-I48 PolarHBondContact N-O 2.99Å; L46-I48 HydrophobicContact CB-CD1 4.15Å; L46-I48 HydrophobicContact CB-CG1 3.77Å; L46-I48 HydrophobicContact CD1-CD1 4.04Å; L46-I48 HydrophobicContact CD1-CG1 4.36Å; L46-I48 PolarHBondContact O-N 3.27Å; I48-V50 HydrophobicContact CG1-CG1 4.14Å; I48-I87 HydrophobicContact CD1-CD1 4.27Å; I48-V377 HydrophobicContact CD1-CG1 3.68Å
49	P	95.8	Very high	92.2	Very high	76 Å²	76	38.4 Å²	38.4	49%	0.494	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	141.8	169.7	30.6	-34.5	0	0	0	111.1	A41 L108	A41-P49 WeakPolarHBondContact O-CA 3.28Å; P49-L108 HydrophobicContact CB-CB 4.2Å; P49-L108 HydrophobicContact CB-CD2 3.75Å
50	V	96.6	Very high	91.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	156.6	-177.9	-61.9	0	0	0	0	111.4	Y24 S40 A41 D43 I48 V52 I87 V105 M106	Y24-V50 HydrophobicContact CD1-CG2 3.91Å; Y24-V50 HydrophobicContact CE1-CG2 4.2Å; S40-V50 CarbonylContact C-O 3.58Å; S40-V50 WeakPolarHBondContact CA-O 3.1Å; A41-V50 HydrophobicContact CB-CG2 4.18Å; A41-V50 PolarHBondContact N-O 3.1Å; A41-V50 WeakPolarHBondContact O-CG2 3.41Å; A41-V50 PolarHBondContact O-N 3.29Å; D43-V50 HydrophobicContact CB-CG1 3.91Å; D43-V50 HydrophobicContact CB-CG2 4.2Å; I48-V50 HydrophobicContact CG1-CG1 4.14Å; V50-V52 HydrophobicContact CG2-CG2 4.23Å; V50-I87 HydrophobicContact CG1-CD1 3.8Å; V50-V105 HydrophobicContact CB-CG1 3.77Å; V50-V105 HydrophobicContact CG1-CG1 4.19Å; V50-V105 HydrophobicContact CG2-CG1 3.82Å; V50-M106 CarbonylContact C-O 3.5Å; V50-M106 WeakPolarHBondContact CA-O 3.47Å; V50-M106 WeakPolarHBondContact CB-O 3.44Å
51	A	95.6	Very high	91.3	Very high	9 Å²	9	45.2 Å²	45.2	7%	0.074	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.1	170	0	0	0	0	0	109.9	V38 C39 V105 M106 L108	V38-A51 HydrophobicContact CG1-CB 4.13Å; C39-A51 CarbonylContact O-C 3.6Å; C39-A51 WeakPolarHBondContact O-CA 3.49Å; A51-V105 CarbonylContact O-C 3.59Å; A51-V105 WeakPolarHBondContact O-CA 3.3Å; A51-M106 PolarHBondContact N-O 3.31Å; A51-M106 PolarHBondContact O-N 2.94Å; A51-L108 HydrophobicContact CB-CD1 3.99Å
52	V	95.4	Very high	90.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	105.7	177.2	-175	0	0	0	0	109	V20 Y24 V38 C39 A41 V50 Y103 V105	V20-V52 HydrophobicContact CG1-CG1 4.34Å; Y24-V52 HydrophobicContact CG-CG2 4.48Å; V38-V52 WeakPolarHBondContact CA-O 3.5Å; C39-V52 PolarHBondContact N-O 2.77Å; C39-V52 PolarHBondContact O-N 3.19Å; A41-V52 HydrophobicContact CB-CG2 4.04Å; V50-V52 HydrophobicContact CG2-CG2 4.23Å; V52-Y103 HydrophobicContact CG1-CD1 4.03Å; V52-V105 HydrophobicContact CG1-CG2 4.46Å; V52-V105 HydrophobicContact CG2-CG1 4.44Å; V52-V105 HydrophobicContact CG2-CG2 4.27Å
53	K	92.6	Very high	90	Very high	19 Å²	19	51.9 Å²	51.9	8%	0.083	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	117.2	175.7	180	178.4	-176.3	-173.9	0	109.7	Q35 I37 V38 L55 E71 Y103 L104 M106	Q35-K53 VanDerWaalsContact OE1-NZ 3.16Å; I37-K53 WeakPolarHBondContact O-CA 3.31Å; V38-K53 HydrophobicContact CG2-CB 4.09Å; V38-K53 HydrophobicContact CG2-CG 4.02Å; K53-L55 HydrophobicContact CD-CD2 4.19Å; K53-L55 HydrophobicContact CG-CD2 4.29Å; K53-E71 IonicContact NZ-OE1 3.85Å; K53-E71 PolarHBondContact NZ-OE1 3.35Å; K53-E71 IonicContact NZ-OE2 2.6Å; K53-Y103 CarbonylContact O-C 3.53Å; K53-Y103 WeakPolarHBondContact O-CA 3.32Å; K53-L104 HydrophobicContact CB-CB 4.41Å; K53-L104 PolarHBondContact N-O 2.92Å; K53-L104 PolarHBondContact O-N 3.12Å; K53-M106 HydrophobicContact CB-CE 3.71Å; K53-M106 HydrophobicContact CD-CE 4.18Å
54	K	92.3	Very high	89.4	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.083	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.5	168	-175.7	-177.2	-175.2	178.4	0	109	T17 F18 G36 I37 D101 Y103	T17-K54 PolarHBondContact O-NZ 3.36Å; F18-K54 HydrophobicContact CD1-CB 4.43Å; F18-K54 HydrophobicContact CD2-CD 4.42Å; F18-K54 HydrophobicContact CE1-CB 3.74Å; F18-K54 HydrophobicContact CE2-CB 4.29Å; F18-K54 HydrophobicContact CE2-CD 4.31Å; F18-K54 HydrophobicContact CZ-CB 3.65Å; F18-K54 HydrophobicContact CZ-CD 4.49Å; G36-K54 CarbonylContact C-O 3.58Å; G36-K54 WeakPolarHBondContact CA-O 3.13Å; I37-K54 PolarHBondContact N-O 2.98Å; I37-K54 VanDerWaalsContact N-O 3.12Å; I37-K54 PolarHBondContact O-N 3.35Å; K54-D101 WeakPolarHBondContact CE-OD1 3.37Å; K54-D101 IonicContact NZ-OD1 2.67Å; K54-D101 PolarHBondContact NZ-OD1 2.9Å; K54-D101 IonicContact NZ-OD2 2.8Å; K54-Y103 HydrophobicContact CB-CD1 3.87Å; K54-Y103 HydrophobicContact CB-CE1 3.67Å; K54-Y103 HydrophobicContact CD-CE1 3.76Å; K54-Y103 WeakPolarHBondContact CD-OH 3.3Å; K54-Y103 VanDerWaalsContact CE-OH 3.28Å; K54-Y103 WeakPolarHBondContact CE-OH 3.39Å; K54-Y103 HydrophobicContact CG-CD1 4.11Å; K54-Y103 HydrophobicContact CG-CE1 3.61Å; K54-Y103 HydrophobicContact CG-CE2 4.46Å; K54-Y103 PolarHBondContact NZ-OH 2.62Å
55	L	87.5	Confident	89.1	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.037	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.7	175.3	-64.9	-169.1	0	0	0	111.3	Q35 K53 R57 P58 A68 L102 L104	Q35-L55 WeakPolarHBondContact O-CA 3.47Å; K53-L55 HydrophobicContact CD-CD2 4.19Å; K53-L55 HydrophobicContact CG-CD2 4.29Å; L55-R57 PolarHBondContact O-N 2.99Å; L55-P58 HydrophobicContact CB-CB 4.48Å; L55-P58 HydrophobicContact CB-CG 4.42Å; L55-P58 HydrophobicContact CD1-CB 4.48Å; L55-A68 HydrophobicContact CD1-CB 3.73Å; L55-L102 HydrophobicContact CB-CB 4.44Å; L55-L102 HydrophobicContact CD1-CB 4.3Å; L55-L102 HydrophobicContact CD1-CD2 3.79Å; L55-L102 HydrophobicContact CD1-CG 4.32Å; L55-L102 HydrophobicContact CG-CB 4.45Å; L55-L102 PolarHBondContact N-O 3.49Å; L55-L104 HydrophobicContact CD2-CD1 4.26Å; L55-L104 HydrophobicContact CG-CD1 4.44Å
56	C	77.4	Confident	88.7	Confident	53 Å²	53	49.4 Å²	49.4	36%	0.358	26%	0.262	S	S	.	.	S	Bend	trans	-82.8	109.8	179	-79	0	0	0	0	110.9	Q35 G36	Q35-C56 PolarHBondContact O-N 3.27Å; Q35-C56 VanDerWaalsContact O-N 3.07Å; G36-C56 VanDerWaalsContact CA-SG 3.57Å
57	R	79.6	Confident	88.2	Confident	182 Å²	182	49 Å²	49	69%	0.687	26%	0.256	S	S	*	.			trans	47.2	57.8	173.2	-49.3	-179.1	-147.4	157.8	3.8	113.2	L55 F59 Q60	L55-R57 PolarHBondContact O-N 2.99Å; R57-F59 PolarHBondContact O-N 3.15Å; R57-Q60 HydrophobicContact CB-CB 4.16Å; R57-Q60 WeakPolarHBondContact O-CB 3.12Å; R57-Q60 PolarHBondContact O-N 3.03Å; R57-Q60 VanDerWaalsContact O-N 3.12Å
58	P	85.3	Confident	87.9	Confident	4 Å²	4	46.4 Å²	46.4	3%	0.026	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-25.4	-176.8	24.1	-33.6	0	0	0	112.9	L55 H64 A65 A68	L55-P58 HydrophobicContact CB-CB 4.48Å; L55-P58 HydrophobicContact CB-CG 4.42Å; L55-P58 HydrophobicContact CD1-CB 4.48Å; P58-H64 CarbonylContact O-C 3.41Å; P58-H64 VanDerWaalsContact O-CB 3.3Å; P58-H64 WeakPolarHBondContact O-CB 3.41Å; P58-A65 WeakPolarHBondContact O-CA 3.46Å; P58-A65 PolarHBondContact O-N 3.46Å; P58-A68 HydrophobicContact CB-CB 3.69Å
59	F	89.1	Confident	87.7	Confident	31 Å²	31	45.6 Å²	45.6	14%	0.136	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	16	-177.9	-44.8	-61.1	0	0	0	114.4	R57 N61 A65 F99 I347 K351 I354	R57-F59 PolarHBondContact O-N 3.15Å; F59-N61 VanDerWaalsContact C-N 3.32Å; F59-N61 PolarHBondContact O-N 3.41Å; F59-A65 HydrophobicContact CD1-CB 4.4Å; F59-F99 HydrophobicContact CE1-CE1 4.14Å; F59-F99 AromaticContact CE2-CD1 3.98Å; F59-F99 HydrophobicContact CE2-CD1 3.98Å; F59-F99 HydrophobicContact CE2-CD2 4.48Å; F59-F99 AromaticContact CE2-CE1 3.84Å; F59-F99 HydrophobicContact CE2-CE1 3.84Å; F59-F99 HydrophobicContact CE2-CE2 4.33Å; F59-F99 HydrophobicContact CE2-CG 4.32Å; F59-F99 HydrophobicContact CE2-CZ 4.01Å; F59-F99 AromaticContact CZ-CD1 3.8Å; F59-F99 HydrophobicContact CZ-CD1 3.8Å; F59-F99 AromaticContact CZ-CE1 3.25Å; F59-F99 HydrophobicContact CZ-CE1 3.25Å; F59-F99 HydrophobicContact CZ-CE2 4.28Å; F59-F99 AromaticContact CZ-CZ 3.53Å; F59-F99 HydrophobicContact CZ-CZ 3.53Å; F59-I347 HydrophobicContact CB-CG2 3.93Å; F59-I347 VanDerWaalsContact O-CG2 3.28Å; F59-I347 WeakPolarHBondContact O-CG2 3.41Å; F59-K351 HydrophobicContact CD1-CB 3.88Å; F59-K351 HydrophobicContact CD1-CG 4.04Å; F59-K351 HydrophobicContact CD2-CG 4.35Å; F59-K351 HydrophobicContact CE1-CB 3.96Å; F59-K351 HydrophobicContact CE1-CG 3.94Å; F59-K351 HydrophobicContact CE2-CG 4.26Å; F59-K351 HydrophobicContact CG-CB 4.44Å; F59-K351 HydrophobicContact CG-CG 4.27Å; F59-K351 HydrophobicContact CZ-CG 4.08Å; F59-I354 HydrophobicContact CE1-CB 4.47Å; F59-I354 HydrophobicContact CE1-CD1 3.65Å; F59-I354 HydrophobicContact CZ-CD1 4.4Å; F59-I354 HydrophobicContact CZ-CG2 4.47Å
60	Q	85.9	Confident	87.2	Confident	112 Å²	112	42.4 Å²	42.4	52%	0.523	20%	0.202	S	C	.	.	S	Bend	trans	-65.1	-35.9	-178.2	-178	177.4	-11.3	0	0	113	R57	R57-Q60 HydrophobicContact CB-CB 4.16Å; R57-Q60 WeakPolarHBondContact O-CB 3.12Å; R57-Q60 PolarHBondContact O-N 3.03Å; R57-Q60 VanDerWaalsContact O-N 3.12Å
61	N	85.6	Confident	86.7	Confident	53 Å²	53	42.7 Å²	42.7	28%	0.283	20%	0.204	S	C	.	.	S	Bend	trans	-153.9	167.4	177.8	61.5	56.3	0	0	0	109.8	F59 T63 H64 A65	F59-N61 VanDerWaalsContact C-N 3.32Å; F59-N61 PolarHBondContact O-N 3.41Å; N61-T63 VanDerWaalsContact C-N 3.26Å; N61-T63 PolarHBondContact O-N 3.22Å; N61-T63 WeakPolarHBondContact OD1-CA 3.07Å; N61-T63 WeakPolarHBondContact OD1-CB 3.49Å; N61-T63 PolarHBondContact OD1-N 3.15Å; N61-T63 VanDerWaalsContact OD1-N 3.09Å; N61-H64 PolarHBondContact O-N 3.1Å; N61-H64 PolarHBondContact OD1-CD2 3.49Å; N61-H64 PolarHBondContact OD1-N 3.04Å; N61-A65 PolarHBondContact O-N 2.86Å
62	Q	85.5	Confident	86.4	Confident	104 Å²	104	42.3 Å²	42.3	49%	0.486	20%	0.2	S	C	.	.	H	α-helix	trans	-58.8	-35.9	-178.3	-67.4	179.1	10.8	0	0	112.9	A65 K66 I347	Q62-A65 PolarHBondContact O-N 3.19Å; Q62-K66 VanDerWaalsContact O-CB 3.26Å; Q62-K66 WeakPolarHBondContact O-CB 3.21Å; Q62-K66 PolarHBondContact O-N 3.2Å; Q62-I347 HydrophobicContact CG-CG1 3.82Å
63	T	82.3	Confident	85.9	Confident	101 Å²	101	42.3 Å²	42.3	62%	0.62	20%	0.2	S	C	*	.	H	α-helix	trans	-65.6	-44	179.2	-54.4	0	0	0	0	111.8	N61 R67	N61-T63 VanDerWaalsContact C-N 3.26Å; N61-T63 PolarHBondContact O-N 3.22Å; N61-T63 WeakPolarHBondContact OD1-CA 3.07Å; N61-T63 WeakPolarHBondContact OD1-CB 3.49Å; N61-T63 PolarHBondContact OD1-N 3.15Å; N61-T63 VanDerWaalsContact OD1-N 3.09Å; T63-R67 VanDerWaalsContact O-CB 3.24Å; T63-R67 WeakPolarHBondContact O-CB 3.26Å; T63-R67 PolarHBondContact O-N 2.95Å
64	H	83.3	Confident	85.5	Confident	72 Å²	72	41.6 Å²	41.6	33%	0.333	20%	0.198	S	C	.	.	H	α-helix	trans	-66.1	-41.4	176.6	-70	-170.7	0	0	0	111	P58 N61 R67 A68	P58-H64 CarbonylContact O-C 3.41Å; P58-H64 VanDerWaalsContact O-CB 3.3Å; P58-H64 WeakPolarHBondContact O-CB 3.41Å; N61-H64 PolarHBondContact O-N 3.1Å; N61-H64 PolarHBondContact OD1-CD2 3.49Å; N61-H64 PolarHBondContact OD1-N 3.04Å; H64-R67 WeakPolarHBondContact O-CB 3.25Å; H64-R67 PolarHBondContact O-N 2.91Å; H64-A68 WeakPolarHBondContact O-CB 3.36Å; H64-A68 PolarHBondContact O-N 2.6Å
65	A	88	Confident	85.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-67.8	-47.4	-177.9	0	0	0	0	0	111	P58 F59 N61 Q62 R67 A68 Y69 W350	P58-A65 WeakPolarHBondContact O-CA 3.46Å; P58-A65 PolarHBondContact O-N 3.46Å; F59-A65 HydrophobicContact CD1-CB 4.4Å; N61-A65 PolarHBondContact O-N 2.86Å; Q62-A65 PolarHBondContact O-N 3.19Å; A65-R67 VanDerWaalsContact C-N 3.27Å; A65-R67 PolarHBondContact O-N 3.47Å; A65-A68 PolarHBondContact O-N 2.6Å; A65-Y69 PolarHBondContact O-N 3.24Å; A65-W350 HydrophobicContact CB-CB 3.59Å; A65-W350 HydrophobicContact CB-CG 3.89Å
66	K	85.3	Confident	85.3	Confident	43 Å²	43	42.5 Å²	42.5	19%	0.187	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-39	173.4	-173.5	170.7	-170.4	173.1	0	111.9	Q62 R70 W350	Q62-K66 VanDerWaalsContact O-CB 3.26Å; Q62-K66 WeakPolarHBondContact O-CB 3.21Å; Q62-K66 PolarHBondContact O-N 3.2Å; K66-R70 WeakPolarHBondContact O-CB 3Å; K66-R70 VanDerWaalsContact O-CG 3.31Å; K66-R70 WeakPolarHBondContact O-CG 3.4Å; K66-R70 PolarHBondContact O-N 2.96Å; K66-W350 HydrophobicContact CB-CD2 4.46Å; K66-W350 HydrophobicContact CB-CZ2 3.86Å; K66-W350 HydrophobicContact CD-CZ2 3.9Å; K66-W350 HydrophobicContact CG-CH2 4.11Å; K66-W350 HydrophobicContact CG-CZ2 3.59Å
67	R	83.1	Confident	85.5	Confident	54 Å²	54	41.5 Å²	41.5	20%	0.204	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-48.4	176.3	176.5	173.1	-174.3	150	19.5	111.7	T63 H64 A65 R70 E71 D167 G169	T63-R67 VanDerWaalsContact O-CB 3.24Å; T63-R67 WeakPolarHBondContact O-CB 3.26Å; T63-R67 PolarHBondContact O-N 2.95Å; H64-R67 WeakPolarHBondContact O-CB 3.25Å; H64-R67 PolarHBondContact O-N 2.91Å; A65-R67 VanDerWaalsContact C-N 3.27Å; A65-R67 PolarHBondContact O-N 3.47Å; R67-R70 PolarHBondContact O-N 2.59Å; R67-E71 WeakPolarHBondContact O-CB 3.34Å; R67-E71 PolarHBondContact O-N 2.97Å; R67-D167 IonicContact CZ-OD1 3.51Å; R67-D167 VanDerWaalsContact NH2-CG 3.32Å; R67-D167 IonicContact NH2-OD1 2.88Å; R67-D167 PolarHBondContact NH2-OD1 2.92Å; R67-D167 IonicContact NH2-OD2 3.72Å; R67-D167 PolarHBondContact NH2-OD2 3.45Å; R67-G169 WeakPolarHBondContact CG-O 3.23Å
68	A	87.2	Confident	85.7	Confident	5 Å²	5	33.2 Å²	33.2	4%	0.041	16%	0.164	C	C	.	.	H	α-helix	trans	-62.2	-43.1	180	0	0	0	0	0	111.8	L55 P58 H64 A65 E71 L72 I354	L55-A68 HydrophobicContact CD1-CB 3.73Å; P58-A68 HydrophobicContact CB-CB 3.69Å; H64-A68 WeakPolarHBondContact O-CB 3.36Å; H64-A68 PolarHBondContact O-N 2.6Å; A65-A68 PolarHBondContact O-N 2.6Å; A68-E71 PolarHBondContact O-N 2.9Å; A68-L72 WeakPolarHBondContact O-CB 3.33Å; A68-L72 PolarHBondContact O-N 2.88Å; A68-I354 HydrophobicContact CB-CD1 4Å
69	Y	88.2	Confident	85.7	Confident	14 Å²	14	38.3 Å²	38.3	6%	0.055	19%	0.191	C	C	.	.	H	α-helix	trans	-62	-49.1	175.6	-178.1	-102.4	0	0	0	111.7	A65 E71 L72 V73 W350 L353 I354 E357	A65-Y69 PolarHBondContact O-N 3.24Å; Y69-E71 VanDerWaalsContact C-N 3.35Å; Y69-E71 PolarHBondContact O-N 3.47Å; Y69-L72 PolarHBondContact O-N 3.1Å; Y69-V73 HydrophobicContact CD1-CG2 4.1Å; Y69-V73 HydrophobicContact CD2-CG2 4.25Å; Y69-V73 HydrophobicContact CE1-CG2 3.68Å; Y69-V73 HydrophobicContact CE2-CG2 3.83Å; Y69-V73 HydrophobicContact CG-CG2 4.38Å; Y69-V73 WeakPolarHBondContact O-CG2 3.38Å; Y69-V73 PolarHBondContact O-N 3.18Å; Y69-W350 AromaticContact CD1-CE3 3.91Å; Y69-W350 HydrophobicContact CD1-CE3 3.91Å; Y69-W350 HydrophobicContact CD1-CH2 4.16Å; Y69-W350 AromaticContact CD1-CZ3 3.28Å; Y69-W350 HydrophobicContact CD1-CZ3 3.28Å; Y69-W350 HydrophobicContact CD2-CE3 4.42Å; Y69-W350 HydrophobicContact CD2-CZ3 4.47Å; Y69-W350 AromaticContact CE1-CZ3 3.78Å; Y69-W350 HydrophobicContact CE1-CZ3 3.78Å; Y69-W350 AromaticContact CG-CE3 3.78Å; Y69-W350 HydrophobicContact CG-CE3 3.78Å; Y69-W350 AromaticContact CG-CZ3 3.66Å; Y69-W350 HydrophobicContact CG-CZ3 3.66Å; Y69-L353 HydrophobicContact CD2-CB 3.98Å; Y69-L353 HydrophobicContact CE2-CB 3.67Å; Y69-I354 HydrophobicContact CD2-CG1 3.67Å; Y69-I354 HydrophobicContact CG-CG1 4.14Å; Y69-E357 HydrophobicContact CE2-CG 3.74Å
70	R	84.9	Confident	85.8	Confident	9 Å²	9	37.4 Å²	37.4	3%	0.034	19%	0.187	C	C	.	.	H	α-helix	trans	-59.6	-44.6	177.6	-77.8	-178.8	120	144.3	5	112.1	K66 R67 L72 V73 L74 R172 E342	K66-R70 WeakPolarHBondContact O-CB 3Å; K66-R70 VanDerWaalsContact O-CG 3.31Å; K66-R70 WeakPolarHBondContact O-CG 3.4Å; K66-R70 PolarHBondContact O-N 2.96Å; R67-R70 PolarHBondContact O-N 2.59Å; R70-L72 VanDerWaalsContact C-N 3.33Å; R70-L72 PolarHBondContact O-N 3.02Å; R70-V73 PolarHBondContact O-N 3.28Å; R70-L74 VanDerWaalsContact O-CB 3.26Å; R70-L74 WeakPolarHBondContact O-CB 3.43Å; R70-L74 WeakPolarHBondContact O-CG 3.43Å; R70-L74 PolarHBondContact O-N 2.95Å; R70-R172 VanDerWaalsContact CZ-CD 3.45Å; R70-R172 VanDerWaalsContact NH1-CZ 3.29Å; R70-R172 VanDerWaalsContact NH1-NE 3.15Å; R70-E342 IonicContact CZ-OE1 3.61Å; R70-E342 IonicContact NH1-OE1 3.53Å; R70-E342 PolarHBondContact NH1-OE1 2.63Å; R70-E342 IonicContact NH2-OE1 2.65Å; R70-E342 PolarHBondContact NH2-OE1 2.82Å
71	E	86.5	Confident	86.2	Confident	6 Å²	6	35.7 Å²	35.7	3%	0.028	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-45.8	177.3	-174.1	173.8	177.5	0	0	110.8	K53 R67 A68 Y69 L75 L104	K53-E71 IonicContact NZ-OE1 3.85Å; K53-E71 PolarHBondContact NZ-OE1 3.35Å; K53-E71 IonicContact NZ-OE2 2.6Å; R67-E71 WeakPolarHBondContact O-CB 3.34Å; R67-E71 PolarHBondContact O-N 2.97Å; A68-E71 PolarHBondContact O-N 2.9Å; Y69-E71 VanDerWaalsContact C-N 3.35Å; Y69-E71 PolarHBondContact O-N 3.47Å; E71-L75 HydrophobicContact CG-CD1 3.89Å; E71-L75 VanDerWaalsContact O-CB 3.24Å; E71-L75 WeakPolarHBondContact O-CB 2.94Å; E71-L75 WeakPolarHBondContact O-CD1 3.48Å; E71-L75 WeakPolarHBondContact O-CG 3.36Å; E71-L75 PolarHBondContact O-N 2.73Å; E71-L104 HydrophobicContact CG-CD1 4.36Å
72	L	88.7	Confident	86.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-50.8	177.6	177.9	58.4	0	0	0	112.6	A68 Y69 R70 L74 L75 K76 L86 V89 L104 I354 E357 V358	A68-L72 WeakPolarHBondContact O-CB 3.33Å; A68-L72 PolarHBondContact O-N 2.88Å; Y69-L72 PolarHBondContact O-N 3.1Å; R70-L72 VanDerWaalsContact C-N 3.33Å; R70-L72 PolarHBondContact O-N 3.02Å; L72-L74 PolarHBondContact O-N 3.25Å; L72-L75 PolarHBondContact O-N 2.99Å; L72-K76 HydrophobicContact CD1-CD 3.96Å; L72-K76 HydrophobicContact CD1-CG 4.28Å; L72-K76 HydrophobicContact CG-CD 4.12Å; L72-K76 VanDerWaalsContact O-CG 3.3Å; L72-K76 WeakPolarHBondContact O-CG 3.3Å; L72-K76 PolarHBondContact O-N 3Å; L72-L86 HydrophobicContact CD1-CD2 4.19Å; L72-V89 HydrophobicContact CD1-CB 4.16Å; L72-V89 HydrophobicContact CD1-CG1 4.12Å; L72-V89 HydrophobicContact CD1-CG2 3.88Å; L72-L104 HydrophobicContact CD1-CD2 4.02Å; L72-I354 HydrophobicContact CD2-CG2 4.26Å; L72-E357 HydrophobicContact CD2-CB 3.76Å; L72-V358 HydrophobicContact CD2-CG2 4.05Å
73	V	86.4	Confident	87.1	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-45.5	-178.6	171.5	0	0	0	0	110.9	Y69 R70 L75 K76 C77 Q339 L340	Y69-V73 HydrophobicContact CD1-CG2 4.1Å; Y69-V73 HydrophobicContact CD2-CG2 4.25Å; Y69-V73 HydrophobicContact CE1-CG2 3.68Å; Y69-V73 HydrophobicContact CE2-CG2 3.83Å; Y69-V73 HydrophobicContact CG-CG2 4.38Å; Y69-V73 WeakPolarHBondContact O-CG2 3.38Å; Y69-V73 PolarHBondContact O-N 3.18Å; R70-V73 PolarHBondContact O-N 3.28Å; V73-L75 PolarHBondContact O-N 3.17Å; V73-K76 PolarHBondContact O-N 2.77Å; V73-C77 PolarHBondContact O-N 3.49Å; V73-C77 PolarHBondContact O-SG 2.93Å; V73-C77 VanDerWaalsContact O-SG 3.35Å; V73-Q339 HydrophobicContact CG1-CB 4.19Å; V73-L340 HydrophobicContact CB-CD2 4.46Å; V73-L340 HydrophobicContact CG1-CD2 3.94Å; V73-L340 HydrophobicContact CG1-CG 4.47Å
74	L	84.8	Confident	87.6	Confident	4 Å²	4	23.9 Å²	23.9	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-42.9	179.8	-69.4	174	0	0	0	111.7	R70 L72 K76 C77 V78 I145 F168 A171 I335 L340	R70-L74 VanDerWaalsContact O-CB 3.26Å; R70-L74 WeakPolarHBondContact O-CB 3.43Å; R70-L74 WeakPolarHBondContact O-CG 3.43Å; R70-L74 PolarHBondContact O-N 2.95Å; L72-L74 PolarHBondContact O-N 3.25Å; L74-K76 PolarHBondContact O-N 3.09Å; L74-C77 PolarHBondContact O-N 2.85Å; L74-V78 WeakPolarHBondContact O-CB 3.29Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.92Å; L74-I145 HydrophobicContact CD2-CD1 3.45Å; L74-I145 VanDerWaalsContact CD2-CD1 3.45Å; L74-I145 HydrophobicContact CD2-CG1 3.91Å; L74-F168 HydrophobicContact CB-CB 4.02Å; L74-F168 HydrophobicContact CB-CD2 4.22Å; L74-F168 HydrophobicContact CB-CG 4.21Å; L74-F168 HydrophobicContact CD1-CB 3.5Å; L74-F168 HydrophobicContact CD1-CG 4.29Å; L74-F168 HydrophobicContact CG-CB 4.4Å; L74-A171 HydrophobicContact CD1-CB 3.93Å; L74-I335 HydrophobicContact CD2-CD1 4.38Å; L74-L340 HydrophobicContact CD2-CD1 3.68Å; L74-L340 HydrophobicContact CD2-CD2 4.17Å; L74-L340 HydrophobicContact CG-CD2 4.31Å
75	L	88.3	Confident	88	Confident	8 Å²	8	22.4 Å²	22.4	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-63.7	-26.6	175.6	-78	173.9	0	0	0	113.6	E71 L72 V73 I84 L86 L104 F168	E71-L75 HydrophobicContact CG-CD1 3.89Å; E71-L75 VanDerWaalsContact O-CB 3.24Å; E71-L75 WeakPolarHBondContact O-CB 2.94Å; E71-L75 WeakPolarHBondContact O-CD1 3.48Å; E71-L75 WeakPolarHBondContact O-CG 3.36Å; E71-L75 PolarHBondContact O-N 2.73Å; L72-L75 PolarHBondContact O-N 2.99Å; V73-L75 PolarHBondContact O-N 3.17Å; L75-I84 HydrophobicContact CD2-CG2 3.66Å; L75-L86 HydrophobicContact CB-CB 4.13Å; L75-L86 HydrophobicContact CB-CD2 4.33Å; L75-L86 HydrophobicContact CD1-CD1 4.48Å; L75-L104 HydrophobicContact CD1-CD1 4.03Å; L75-F168 HydrophobicContact CD2-CD2 4.15Å; L75-F168 HydrophobicContact CD2-CE2 3.99Å; L75-F168 HydrophobicContact CG-CD2 4.33Å
76	K	85.8	Confident	88.2	Confident	37 Å²	37	22.9 Å²	22.9	16%	0.161	11%	0.108	C	C	.	.	H	α-helix	trans	-79.7	-34.9	175.4	-72.9	174.1	64	165.3	0	112.7	L72 V73 L74 L86 E357 W361	L72-K76 HydrophobicContact CD1-CD 3.96Å; L72-K76 HydrophobicContact CD1-CG 4.28Å; L72-K76 HydrophobicContact CG-CD 4.12Å; L72-K76 VanDerWaalsContact O-CG 3.3Å; L72-K76 WeakPolarHBondContact O-CG 3.3Å; L72-K76 PolarHBondContact O-N 3Å; V73-K76 PolarHBondContact O-N 2.77Å; L74-K76 PolarHBondContact O-N 3.09Å; K76-L86 HydrophobicContact CG-CD2 3.84Å; K76-E357 WeakPolarHBondContact CE-OE2 3.26Å; K76-E357 PolarHBondContact NZ-O 3.11Å; K76-E357 IonicContact NZ-OE2 3.84Å; K76-E357 PolarHBondContact NZ-OE2 3.24Å; K76-W361 HydrophobicContact CB-CZ3 4.36Å; K76-W361 HydrophobicContact CD-CE3 4.08Å; K76-W361 HydrophobicContact CD-CZ3 4.41Å; K76-W361 HydrophobicContact CG-CE3 3.92Å; K76-W361 HydrophobicContact CG-CZ3 3.75Å
77	C	81.9	Confident	88.6	Confident	32 Å²	32	21.6 Å²	21.6	22%	0.216	10%	0.103	C	C	.	.	H	α-helix	trans	-86.5	-38.5	-174.9	-67	0	0	0	0	112.5	V73 L74 P333 I335	V73-C77 PolarHBondContact O-N 3.49Å; V73-C77 PolarHBondContact O-SG 2.93Å; V73-C77 VanDerWaalsContact O-SG 3.35Å; L74-C77 PolarHBondContact O-N 2.85Å; C77-P333 HydrophobicContact CB-CB 4.44Å; C77-P333 WeakPolarHBondContact O-CB 3.4Å; C77-I335 HydrophobicContact CB-CG1 3.84Å
78	V	84.3	Confident	89.1	Confident	7 Å²	7	19.5 Å²	19.5	4%	0.042	10%	0.096	C	C	.	.			trans	-83	123.6	-170.2	-177.7	0	0	0	0	110.8	L74 I83 L140 I145 P333	L74-V78 WeakPolarHBondContact O-CB 3.29Å; L74-V78 WeakPolarHBondContact O-CG2 3.3Å; L74-V78 PolarHBondContact O-N 2.92Å; V78-I83 HydrophobicContact CB-CG2 4.42Å; V78-I83 HydrophobicContact CG1-CB 4.17Å; V78-I83 HydrophobicContact CG1-CD1 3.37Å; V78-I83 HydrophobicContact CG1-CG1 4.34Å; V78-I83 HydrophobicContact CG1-CG2 3.68Å; V78-L140 HydrophobicContact CG1-CD2 4.31Å; V78-L140 HydrophobicContact CG2-CD2 4.31Å; V78-I145 HydrophobicContact CG2-CD1 3.98Å; V78-P333 HydrophobicContact CG2-CG 4.09Å
79	N	85.4	Confident	89.5	Confident	111 Å²	111	19.2 Å²	19.2	59%	0.594	9%	0.094	S	C	*	.			trans	-130.3	99	176.7	-174.6	24.5	0	0	0	110.4	H139	N79-H139 PolarHBondContact O-NE2 2.88Å
80	H	91.8	Very high	89.8	Confident	12 Å²	12	18.6 Å²	18.6	6%	0.056	9%	0.092	C	C	.	.			trans	-149.1	144.8	178.1	-175.8	-103.3	0	0	0	110.3	N82 I83 H139 E327	H80-N82 PolarHBondContact CE1-OD1 3.06Å; H80-N82 VanDerWaalsContact CE1-OD1 3.26Å; H80-N82 PolarHBondContact ND1-N 2.76Å; H80-N82 VanDerWaalsContact ND1-N 3.11Å; H80-N82 PolarHBondContact O-N 3.05Å; H80-I83 HydrophobicContact CB-CB 4.19Å; H80-I83 HydrophobicContact CB-CD1 3.95Å; H80-I83 HydrophobicContact CB-CG1 4.17Å; H80-I83 PolarHBondContact O-N 3.08Å; H80-H139 HydrophobicContact CB-CB 4.33Å; H80-H139 AromaticContact CD2-CG 3.9Å; H80-H139 AromaticContact CD2-ND1 3.83Å; H80-H139 AromaticContact CG-CG 3.82Å; H80-E327 PolarHBondContact NE2-O 3.32Å; H80-E327 VanDerWaalsContact NE2-O 3.08Å
81	K	93.6	Very high	90.3	Very high	77 Å²	77	18.4 Å²	18.4	34%	0.335	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-30.6	-176.2	68.5	171.7	-165.9	150.1	0	113.4	I83 K164 E327	K81-I83 VanDerWaalsContact C-N 3.34Å; K81-K164 WeakPolarHBondContact O-CE 3.33Å; K81-K164 WeakPolarHBondContact O-CG 3.42Å; K81-K164 PolarHBondContact O-NZ 3.28Å; K81-E327 HydrophobicContact CD-CG 4.38Å; K81-E327 WeakPolarHBondContact CE-OE1 3.47Å; K81-E327 WeakPolarHBondContact CE-OE2 3.41Å; K81-E327 IonicContact NZ-OE1 3.69Å; K81-E327 PolarHBondContact NZ-OE1 3.1Å; K81-E327 IonicContact NZ-OE2 2.67Å; K81-E327 PolarHBondContact NZ-OE2 3.48Å
82	N	96.1	Very high	90.6	Very high	2 Å²	2	19.2 Å²	19.2	1%	0.011	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	14.3	177.8	-55.6	114.9	0	0	0	114.3	H80 Q132 L163 K164 I165	H80-N82 PolarHBondContact CE1-OD1 3.06Å; H80-N82 VanDerWaalsContact CE1-OD1 3.26Å; H80-N82 PolarHBondContact ND1-N 2.76Å; H80-N82 VanDerWaalsContact ND1-N 3.11Å; H80-N82 PolarHBondContact O-N 3.05Å; N82-Q132 VanDerWaalsContact CB-O 3.28Å; N82-Q132 WeakPolarHBondContact CB-O 3.24Å; N82-Q132 WeakPolarHBondContact ND2-CB 3.26Å; N82-Q132 WeakPolarHBondContact ND2-CG 3.48Å; N82-Q132 PolarHBondContact ND2-OE1 3.14Å; N82-L163 VanDerWaalsContact CA-O 3.31Å; N82-L163 WeakPolarHBondContact CA-O 3.27Å; N82-L163 PolarHBondContact ND2-O 2.61Å; N82-K164 WeakPolarHBondContact O-CA 3.38Å; N82-I165 PolarHBondContact O-N 3.07Å
83	I	94	Very high	90.8	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.01	11%	0.105	C	C	.	.	B	Isolated β-bridge	trans	-122.2	142	173.7	-66.4	173.6	0	0	0	107.9	V78 H80 K81 R85 H139 L140 K164 F168	V78-I83 HydrophobicContact CB-CG2 4.42Å; V78-I83 HydrophobicContact CG1-CB 4.17Å; V78-I83 HydrophobicContact CG1-CD1 3.37Å; V78-I83 HydrophobicContact CG1-CG1 4.34Å; V78-I83 HydrophobicContact CG1-CG2 3.68Å; H80-I83 HydrophobicContact CB-CB 4.19Å; H80-I83 HydrophobicContact CB-CD1 3.95Å; H80-I83 HydrophobicContact CB-CG1 4.17Å; H80-I83 PolarHBondContact O-N 3.08Å; K81-I83 VanDerWaalsContact C-N 3.34Å; I83-R85 PolarHBondContact O-N 3.33Å; I83-H139 HydrophobicContact CD1-CB 4.4Å; I83-L140 HydrophobicContact CD1-CD1 4.38Å; I83-L140 HydrophobicContact CD1-CD2 3.76Å; I83-L140 HydrophobicContact CD1-CG 3.72Å; I83-K164 PolarHBondContact O-NZ 3.01Å; I83-F168 HydrophobicContact CG2-CE2 3.87Å; I83-F168 HydrophobicContact CG2-CZ 3.48Å; I83-F168 VanDerWaalsContact CG2-CZ 3.48Å
84	I	93.4	Very high	90.8	Very high	5 Å²	5	26.4 Å²	26.4	3%	0.026	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-64.9	130.1	179.9	-165.9	73.5	0	0	0	111.1	L75 M106 E107 M109 K164 I165 L166	L75-I84 HydrophobicContact CD2-CG2 3.66Å; I84-M106 HydrophobicContact CD1-CB 4.34Å; I84-M106 HydrophobicContact CG1-CB 3.9Å; I84-M106 HydrophobicContact CG1-CG 4.12Å; I84-M106 HydrophobicContact CG1-SD 3.97Å; I84-M106 HydrophobicContact CG2-SD 4.39Å; I84-E107 HydrophobicContact CD1-CG 3.36Å; I84-E107 HydrophobicContact CG1-CG 4.36Å; I84-M109 HydrophobicContact CD1-CG 4.33Å; I84-K164 HydrophobicContact CD1-CB 4.48Å; I84-K164 HydrophobicContact CD1-CD 4.28Å; I84-I165 WeakPolarHBondContact CB-O 3.48Å; I84-I165 WeakPolarHBondContact CG2-O 3.09Å; I84-I165 PolarHBondContact N-O 2.72Å; I84-L166 HydrophobicContact CB-CD2 3.59Å; I84-L166 HydrophobicContact CD1-CD2 3.85Å; I84-L166 HydrophobicContact CG1-CD2 3.63Å; I84-L166 HydrophobicContact CG2-CD2 3.75Å
85	R	91.3	Very high	91.2	Very high	41 Å²	41	27.8 Å²	27.8	16%	0.155	14%	0.139	C	C	.	.	P	Polyproline II helix	trans	-91.1	133.4	-179.6	-165.1	178.7	72.5	131.3	8.9	111.5	I83 I87 M106 E107 D373 V377	I83-R85 PolarHBondContact O-N 3.33Å; R85-I87 PolarHBondContact O-N 3.44Å; R85-M106 WeakPolarHBondContact O-CA 3.48Å; R85-E107 WeakPolarHBondContact CB-OE1 3.28Å; R85-E107 PolarHBondContact N-OE1 3.34Å; R85-D373 PolarHBondContact NH1-O 3.38Å; R85-V377 VanDerWaalsContact CZ-CG2 3.45Å
86	L	92.4	Very high	91.3	Very high	10 Å²	10	29.7 Å²	29.7	5%	0.052	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	119.7	167	-170.2	69.2	0	0	0	109.8	L72 L75 K76 N88 V89 L104 M106 W361	L72-L86 HydrophobicContact CD1-CD2 4.19Å; L75-L86 HydrophobicContact CB-CB 4.13Å; L75-L86 HydrophobicContact CB-CD2 4.33Å; L75-L86 HydrophobicContact CD1-CD1 4.48Å; K76-L86 HydrophobicContact CG-CD2 3.84Å; L86-N88 WeakPolarHBondContact CD1-O 3.42Å; L86-V89 HydrophobicContact CD2-CB 4.36Å; L86-V89 HydrophobicContact CD2-CG1 4.34Å; L86-L104 HydrophobicContact CD1-CB 4.16Å; L86-L104 HydrophobicContact CD1-CD2 4.19Å; L86-M106 HydrophobicContact CD1-CG 4.47Å; L86-W361 HydrophobicContact CD2-CH2 4.15Å; L86-W361 HydrophobicContact CD2-CZ2 4.32Å; L86-W361 HydrophobicContact CD2-CZ3 4.36Å; L86-W361 HydrophobicContact CG-CH2 4.49Å; L86-W361 HydrophobicContact CG-CZ2 4.43Å
87	I	92.9	Very high	91.6	Very high	16 Å²	16	35.1 Å²	35.1	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-42.4	175.1	-61.6	177.9	0	0	0	109.9	L46 I48 V50 R85 V105 E107	L46-I87 HydrophobicContact CD1-CG2 3.7Å; I48-I87 HydrophobicContact CD1-CD1 4.27Å; V50-I87 HydrophobicContact CG1-CD1 3.8Å; R85-I87 PolarHBondContact O-N 3.44Å; I87-V105 WeakPolarHBondContact CA-O 3.42Å; I87-V105 HydrophobicContact CB-CG1 4.37Å; I87-V105 PolarHBondContact N-O 2.96Å; I87-E107 HydrophobicContact CD1-CB 4.27Å
88	N	94.2	Very high	92	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.053	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	158.1	179.1	-159.5	8.9	0	0	0	111.6	Y24 L86 V105 W361	Y24-N88 WeakPolarHBondContact OH-CB 3.44Å; Y24-N88 PolarHBondContact OH-ND2 3.25Å; L86-N88 WeakPolarHBondContact CD1-O 3.42Å; N88-V105 HydrophobicContact CB-CB 3.91Å; N88-V105 HydrophobicContact CB-CG2 4.14Å; N88-V105 PolarHBondContact N-O 3.35Å; N88-V105 VanDerWaalsContact N-O 3.09Å; N88-V105 WeakPolarHBondContact O-CA 3.44Å; N88-V105 WeakPolarHBondContact O-CB 3.38Å; N88-V105 PolarHBondContact O-N 2.94Å; N88-W361 PolarHBondContact OD1-NE1 3.07Å; N88-W361 VanDerWaalsContact OD1-NE1 3.1Å
89	V	94.9	Very high	92.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.3	168.8	55.3	0	0	0	0	108.3	L72 L86 L102 Y103 L104 V358 W361	L72-V89 HydrophobicContact CD1-CB 4.16Å; L72-V89 HydrophobicContact CD1-CG1 4.12Å; L72-V89 HydrophobicContact CD1-CG2 3.88Å; L86-V89 HydrophobicContact CD2-CB 4.36Å; L86-V89 HydrophobicContact CD2-CG1 4.34Å; V89-L102 HydrophobicContact CG2-CD1 3.56Å; V89-L102 HydrophobicContact CG2-CG 4.46Å; V89-Y103 WeakPolarHBondContact CA-O 3.44Å; V89-L104 HydrophobicContact CB-CD2 4.24Å; V89-L104 HydrophobicContact CG2-CD2 3.8Å; V89-V358 HydrophobicContact CG2-CG1 4.33Å; V89-V358 HydrophobicContact CG2-CG2 3.84Å; V89-W361 HydrophobicContact CG1-CB 3.7Å; V89-W361 VanDerWaalsContact CG1-CD1 3.44Å; V89-W361 HydrophobicContact CG1-CD2 3.88Å; V89-W361 HydrophobicContact CG1-CG 3.4Å
90	F	94.5	Very high	92.6	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	164.3	178.1	65.3	-91.2	0	0	0	112.4	F8 V20 L21 Y24 Y103 V105	F8-F90 AromaticContact CE1-CD2 3.68Å; F8-F90 HydrophobicContact CE1-CD2 3.68Å; F8-F90 AromaticContact CE1-CE2 3.99Å; F8-F90 HydrophobicContact CE1-CE2 3.99Å; F8-F90 HydrophobicContact CZ-CD2 4.44Å; V20-F90 HydrophobicContact CB-CE2 4.32Å; V20-F90 HydrophobicContact CB-CZ 3.94Å; V20-F90 HydrophobicContact CG1-CE2 4.39Å; V20-F90 HydrophobicContact CG1-CZ 3.97Å; L21-F90 HydrophobicContact CD1-CB 4.41Å; L21-F90 HydrophobicContact CD1-CD1 4.06Å; L21-F90 HydrophobicContact CD1-CG 4.13Å; L21-F90 HydrophobicContact CG-CD2 4.4Å; L21-F90 HydrophobicContact CG-CG 4.34Å; Y24-F90 HydrophobicContact CD2-CE1 4Å; Y24-F90 HydrophobicContact CD2-CZ 4.29Å; Y24-F90 HydrophobicContact CE2-CD1 4.08Å; Y24-F90 AromaticContact CE2-CE1 3.46Å; Y24-F90 HydrophobicContact CE2-CE1 3.46Å; Y24-F90 VanDerWaalsContact CE2-CE1 3.46Å; Y24-F90 HydrophobicContact CE2-CZ 4.18Å; F90-Y103 HydrophobicContact CD2-CD2 4.07Å; F90-Y103 HydrophobicContact CD2-CG 4.24Å; F90-Y103 HydrophobicContact CE1-CG 4.43Å; F90-Y103 HydrophobicContact CE2-CD1 4.24Å; F90-Y103 AromaticContact CE2-CD2 3.61Å; F90-Y103 HydrophobicContact CE2-CD2 3.61Å; F90-Y103 HydrophobicContact CE2-CE2 4.35Å; F90-Y103 AromaticContact CE2-CG 3.54Å; F90-Y103 HydrophobicContact CE2-CG 3.54Å; F90-Y103 VanDerWaalsContact CZ-CB 3.41Å; F90-Y103 HydrophobicContact CZ-CD1 4.1Å; F90-Y103 HydrophobicContact CZ-CD2 4.23Å; F90-Y103 AromaticContact CZ-CG 3.67Å; F90-Y103 HydrophobicContact CZ-CG 3.67Å; F90-Y103 PolarHBondContact N-O 3.03Å; F90-Y103 VanDerWaalsContact N-O 3.07Å; F90-Y103 PolarHBondContact O-N 3.47Å; F90-V105 HydrophobicContact CD1-CG2 4.15Å; F90-V105 HydrophobicContact CE1-CG2 3.65Å
91	T	94.7	Very high	92.6	Very high	4 Å²	4	40.5 Å²	40.5	3%	0.025	19%	0.194	C	C	.	.			trans	-128.1	141	167	171.8	0	0	0	0	109.4	Q93 F99 D101 Y355 V358 M359	T91-Q93 VanDerWaalsContact C-N 3.27Å; T91-Q93 PolarHBondContact OG1-N 3.06Å; T91-Q93 PolarHBondContact OG1-OE1 3.3Å; T91-F99 HydrophobicContact CG2-CD2 4.2Å; T91-F99 HydrophobicContact CG2-CE2 4.25Å; T91-F99 WeakPolarHBondContact OG1-CD2 3.47Å; T91-D101 WeakPolarHBondContact CB-O 3.47Å; T91-D101 PolarHBondContact OG1-O 2.96Å; T91-Y355 HydrophobicContact CG2-CD2 4.47Å; T91-Y355 HydrophobicContact CG2-CE2 4.15Å; T91-V358 HydrophobicContact CG2-CG1 4.17Å; T91-M359 HydrophobicContact CG2-CE 3.81Å
92	P	92.9	Very high	92.6	Very high	24 Å²	24	36.8 Å²	36.8	16%	0.156	18%	0.178	C	C	.	.	S	Bend	trans	-77.4	-13.7	174	32.2	-35.1	0	0	0	113	F8 T19 D101 Y103	F8-P92 HydrophobicContact CD1-CB 3.94Å; F8-P92 HydrophobicContact CE1-CB 4.07Å; F8-P92 HydrophobicContact CG-CB 4.35Å; T19-P92 HydrophobicContact CG2-CB 3.58Å; T19-P92 HydrophobicContact CG2-CG 4.21Å; P92-D101 HydrophobicContact CG-CB 4.44Å; P92-Y103 HydrophobicContact CG-CE2 3.96Å
93	Q	92.8	Very high	92.5	Very high	35 Å²	35	36.7 Å²	36.7	16%	0.164	18%	0.177	C	C	.	.			trans	-85.8	142.3	-178.8	-64.7	100.6	19.4	0	0	111.6	T91 E98 Q100 D101	T91-Q93 VanDerWaalsContact C-N 3.27Å; T91-Q93 PolarHBondContact OG1-N 3.06Å; T91-Q93 PolarHBondContact OG1-OE1 3.3Å; Q93-E98 HydrophobicContact CB-CB 3.98Å; Q93-E98 HydrophobicContact CG-CB 4.2Å; Q93-E98 WeakPolarHBondContact CG-O 3.47Å; Q93-Q100 VanDerWaalsContact OE1-N 3.1Å; Q93-D101 PolarHBondContact NE2-OD2 3.07Å
94	K	87.8	Confident	92.5	Very high	117 Å²	117	36.6 Å²	36.6	51%	0.509	18%	0.177	S	C	.	.	S	Bend	trans	-94.1	-16.1	-168.5	-64.8	180	-176.4	169.2	0	114.7	Y355	K94-Y355 PolarHBondContact O-OH 3.33Å; K94-Y355 VanDerWaalsContact O-OH 3.07Å
95	S	91.8	Very high	92.6	Very high	33 Å²	33	36.4 Å²	36.4	23%	0.231	18%	0.176	C	C	.	.	S	Bend	trans	-134.2	158.1	-178.3	86.9	0	0	0	0	110.8	E97 E98 F99	S95-E97 WeakPolarHBondContact CB-OE2 3.28Å; S95-E97 PolarHBondContact O-N 3.18Å; S95-E97 PolarHBondContact OG-N 2.9Å; S95-E97 PolarHBondContact OG-OE2 3.35Å; S95-E98 PolarHBondContact O-N 3.11Å; S95-E98 PolarHBondContact OG-N 2.64Å; S95-F99 PolarHBondContact O-N 3.5Å
96	L	91.5	Very high	92.8	Very high	48 Å²	48	35.2 Å²	35.2	25%	0.251	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.3	177.6	175.7	65.3	0	0	0	111.7	E98 F99 K351 E352 Y355	L96-E98 VanDerWaalsContact C-N 3.34Å; L96-E98 PolarHBondContact O-N 2.95Å; L96-F99 PolarHBondContact O-N 3.22Å; L96-K351 HydrophobicContact CD1-CD 4.4Å; L96-K351 HydrophobicContact CD1-CG 4.07Å; L96-K351 WeakPolarHBondContact O-CE 3.21Å; L96-K351 PolarHBondContact O-NZ 3.12Å; L96-E352 HydrophobicContact CD1-CG 4.1Å; L96-E352 HydrophobicContact CD2-CG 3.47Å; L96-E352 VanDerWaalsContact CD2-CG 3.47Å; L96-E352 HydrophobicContact CG-CG 4.37Å; L96-Y355 HydrophobicContact CB-CD1 4.28Å; L96-Y355 HydrophobicContact CB-CE1 4.41Å; L96-Y355 HydrophobicContact CD1-CD1 4.3Å; L96-Y355 HydrophobicContact CD1-CG 4.04Å
97	E	90.9	Very high	92.8	Very high	150 Å²	150	35.6 Å²	35.6	70%	0.701	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-43.5	178.7	-58.2	80.2	-170.8	0	0	110.9	S95 K351	S95-E97 WeakPolarHBondContact CB-OE2 3.28Å; S95-E97 PolarHBondContact O-N 3.18Å; S95-E97 PolarHBondContact OG-N 2.9Å; S95-E97 PolarHBondContact OG-OE2 3.35Å; E97-K351 PolarHBondContact O-NZ 2.89Å; E97-K351 VanDerWaalsContact O-NZ 3.17Å
98	E	91.3	Very high	92.8	Very high	117 Å²	117	36.8 Å²	36.8	55%	0.547	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-19.9	-179	-65.2	-178.7	170.8	0	0	113.7	Q93 S95 L96 Q100	Q93-E98 HydrophobicContact CB-CB 3.98Å; Q93-E98 HydrophobicContact CG-CB 4.2Å; Q93-E98 WeakPolarHBondContact CG-O 3.47Å; S95-E98 PolarHBondContact O-N 3.11Å; S95-E98 PolarHBondContact OG-N 2.64Å; L96-E98 VanDerWaalsContact C-N 3.34Å; L96-E98 PolarHBondContact O-N 2.95Å; E98-Q100 WeakPolarHBondContact O-CG 3.29Å; E98-Q100 PolarHBondContact O-N 3.31Å
99	F	92.8	Very high	92.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.182	C	C	.	.			trans	-55.5	122.7	-173.5	175.7	-140.4	0	0	0	112.3	F59 T91 S95 L96 D101 L102 K351 I354 Y355	F59-F99 HydrophobicContact CE1-CE1 4.14Å; F59-F99 AromaticContact CE2-CD1 3.98Å; F59-F99 HydrophobicContact CE2-CD1 3.98Å; F59-F99 HydrophobicContact CE2-CD2 4.48Å; F59-F99 AromaticContact CE2-CE1 3.84Å; F59-F99 HydrophobicContact CE2-CE1 3.84Å; F59-F99 HydrophobicContact CE2-CE2 4.33Å; F59-F99 HydrophobicContact CE2-CG 4.32Å; F59-F99 HydrophobicContact CE2-CZ 4.01Å; F59-F99 AromaticContact CZ-CD1 3.8Å; F59-F99 HydrophobicContact CZ-CD1 3.8Å; F59-F99 AromaticContact CZ-CE1 3.25Å; F59-F99 HydrophobicContact CZ-CE1 3.25Å; F59-F99 HydrophobicContact CZ-CE2 4.28Å; F59-F99 AromaticContact CZ-CZ 3.53Å; F59-F99 HydrophobicContact CZ-CZ 3.53Å; T91-F99 HydrophobicContact CG2-CD2 4.2Å; T91-F99 HydrophobicContact CG2-CE2 4.25Å; T91-F99 WeakPolarHBondContact OG1-CD2 3.47Å; S95-F99 PolarHBondContact O-N 3.5Å; L96-F99 PolarHBondContact O-N 3.22Å; F99-D101 WeakPolarHBondContact CE2-O 3.46Å; F99-L102 HydrophobicContact CZ-CD1 4.48Å; F99-K351 HydrophobicContact CD1-CG 3.75Å; F99-K351 HydrophobicContact CE1-CG 4.3Å; F99-K351 WeakPolarHBondContact O-CE 3.27Å; F99-K351 PolarHBondContact O-NZ 2.86Å; F99-I354 HydrophobicContact CE1-CB 4.2Å; F99-I354 HydrophobicContact CE1-CG2 3.83Å; F99-I354 HydrophobicContact CZ-CG2 3.69Å; F99-Y355 HydrophobicContact CB-CD2 3.92Å; F99-Y355 HydrophobicContact CB-CE2 4.26Å; F99-Y355 AromaticContact CD1-CD2 3.68Å; F99-Y355 HydrophobicContact CD1-CD2 3.68Å; F99-Y355 HydrophobicContact CD1-CG 4.16Å; F99-Y355 HydrophobicContact CD2-CD2 4.23Å; F99-Y355 HydrophobicContact CE1-CD2 4.16Å; F99-Y355 AromaticContact CG-CD2 3.7Å; F99-Y355 HydrophobicContact CG-CD2 3.7Å; F99-Y355 HydrophobicContact CG-CE2 4.39Å
100	Q	89.9	Confident	92.6	Very high	126 Å²	126	42 Å²	42	59%	0.589	21%	0.208	S	C	*	.			trans	-143.6	-35.9	-179.3	-73.1	-177.5	18.5	0	0	112.4	Q93 E98	Q93-Q100 VanDerWaalsContact OE1-N 3.1Å; E98-Q100 WeakPolarHBondContact O-CG 3.29Å; E98-Q100 PolarHBondContact O-N 3.31Å
101	D	91.5	Very high	92.3	Very high	32 Å²	32	43.3 Å²	43.3	17%	0.171	22%	0.218	C	C	.	.			trans	-106.3	128.9	-174.6	-66.3	-47.5	0	0	0	110.9	K54 T91 P92 Q93 F99 Y103	K54-D101 WeakPolarHBondContact CE-OD1 3.37Å; K54-D101 IonicContact NZ-OD1 2.67Å; K54-D101 PolarHBondContact NZ-OD1 2.9Å; K54-D101 IonicContact NZ-OD2 2.8Å; T91-D101 WeakPolarHBondContact CB-O 3.47Å; T91-D101 PolarHBondContact OG1-O 2.96Å; P92-D101 HydrophobicContact CG-CB 4.44Å; Q93-D101 PolarHBondContact NE2-OD2 3.07Å; F99-D101 WeakPolarHBondContact CE2-O 3.46Å; D101-Y103 HydrophobicContact CB-CD2 4.35Å; D101-Y103 HydrophobicContact CB-CE2 3.62Å
102	L	93.2	Very high	92	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.227	C	C	.	.			trans	-113.6	126.5	172.1	-175.7	60.7	0	0	0	109.6	L55 V89 F99 L104 I354 V358	L55-L102 HydrophobicContact CB-CB 4.44Å; L55-L102 HydrophobicContact CD1-CB 4.3Å; L55-L102 HydrophobicContact CD1-CD2 3.79Å; L55-L102 HydrophobicContact CD1-CG 4.32Å; L55-L102 HydrophobicContact CG-CB 4.45Å; L55-L102 PolarHBondContact N-O 3.49Å; V89-L102 HydrophobicContact CG2-CD1 3.56Å; V89-L102 HydrophobicContact CG2-CG 4.46Å; F99-L102 HydrophobicContact CZ-CD1 4.48Å; L102-L104 HydrophobicContact CD2-CD2 4.4Å; L102-L104 HydrophobicContact CG-CD2 4.35Å; L102-I354 HydrophobicContact CD2-CG2 3.87Å; L102-V358 HydrophobicContact CD1-CG2 3.49Å; L102-V358 VanDerWaalsContact CD1-CG2 3.49Å
103	Y	94.5	Very high	92	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	176.4	-64.4	-97.7	0	0	0	110.2	F18 T19 V20 V52 K53 K54 V89 F90 P92 D101	F18-Y103 HydrophobicContact CD1-CD1 4.38Å; F18-Y103 AromaticContact CD1-CE1 3.8Å; F18-Y103 HydrophobicContact CD1-CE1 3.8Å; F18-Y103 HydrophobicContact CE1-CE1 4.26Å; F18-Y103 HydrophobicContact CG-CE1 4.29Å; T19-Y103 PolarHBondContact N-OH 3.18Å; V20-Y103 HydrophobicContact CG1-CD1 4.03Å; V20-Y103 HydrophobicContact CG1-CE1 3.88Å; V52-Y103 HydrophobicContact CG1-CD1 4.03Å; K53-Y103 CarbonylContact O-C 3.53Å; K53-Y103 WeakPolarHBondContact O-CA 3.32Å; K54-Y103 HydrophobicContact CB-CD1 3.87Å; K54-Y103 HydrophobicContact CB-CE1 3.67Å; K54-Y103 HydrophobicContact CD-CE1 3.76Å; K54-Y103 WeakPolarHBondContact CD-OH 3.3Å; K54-Y103 VanDerWaalsContact CE-OH 3.28Å; K54-Y103 WeakPolarHBondContact CE-OH 3.39Å; K54-Y103 HydrophobicContact CG-CD1 4.11Å; K54-Y103 HydrophobicContact CG-CE1 3.61Å; K54-Y103 HydrophobicContact CG-CE2 4.46Å; K54-Y103 PolarHBondContact NZ-OH 2.62Å; V89-Y103 WeakPolarHBondContact CA-O 3.44Å; F90-Y103 HydrophobicContact CD2-CD2 4.07Å; F90-Y103 HydrophobicContact CD2-CG 4.24Å; F90-Y103 HydrophobicContact CE1-CG 4.43Å; F90-Y103 HydrophobicContact CE2-CD1 4.24Å; F90-Y103 AromaticContact CE2-CD2 3.61Å; F90-Y103 HydrophobicContact CE2-CD2 3.61Å; F90-Y103 HydrophobicContact CE2-CE2 4.35Å; F90-Y103 AromaticContact CE2-CG 3.54Å; F90-Y103 HydrophobicContact CE2-CG 3.54Å; F90-Y103 VanDerWaalsContact CZ-CB 3.41Å; F90-Y103 HydrophobicContact CZ-CD1 4.1Å; F90-Y103 HydrophobicContact CZ-CD2 4.23Å; F90-Y103 AromaticContact CZ-CG 3.67Å; F90-Y103 HydrophobicContact CZ-CG 3.67Å; F90-Y103 PolarHBondContact N-O 3.03Å; F90-Y103 VanDerWaalsContact N-O 3.07Å; F90-Y103 PolarHBondContact O-N 3.47Å; P92-Y103 HydrophobicContact CG-CE2 3.96Å; D101-Y103 HydrophobicContact CB-CD2 4.35Å; D101-Y103 HydrophobicContact CB-CE2 3.62Å
104	L	93.9	Very high	91.7	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.1	174.5	-55	174.9	0	0	0	108.4	K53 L55 E71 L72 L75 L86 V89 L102	K53-L104 HydrophobicContact CB-CB 4.41Å; K53-L104 PolarHBondContact N-O 2.92Å; K53-L104 PolarHBondContact O-N 3.12Å; L55-L104 HydrophobicContact CD2-CD1 4.26Å; L55-L104 HydrophobicContact CG-CD1 4.44Å; E71-L104 HydrophobicContact CG-CD1 4.36Å; L72-L104 HydrophobicContact CD1-CD2 4.02Å; L75-L104 HydrophobicContact CD1-CD1 4.03Å; L86-L104 HydrophobicContact CD1-CB 4.16Å; L86-L104 HydrophobicContact CD1-CD2 4.19Å; V89-L104 HydrophobicContact CB-CD2 4.24Å; V89-L104 HydrophobicContact CG2-CD2 3.8Å; L102-L104 HydrophobicContact CD2-CD2 4.4Å; L102-L104 HydrophobicContact CG-CD2 4.35Å
105	V	95.4	Very high	91.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	121.1	177.7	-173.5	0	0	0	0	108.4	Y24 V50 A51 V52 I87 N88 F90	Y24-V105 HydrophobicContact CE1-CG1 3.87Å; Y24-V105 HydrophobicContact CE1-CG2 4.34Å; Y24-V105 HydrophobicContact CE2-CG2 3.91Å; V50-V105 HydrophobicContact CB-CG1 3.77Å; V50-V105 HydrophobicContact CG1-CG1 4.19Å; V50-V105 HydrophobicContact CG2-CG1 3.82Å; A51-V105 CarbonylContact O-C 3.59Å; A51-V105 WeakPolarHBondContact O-CA 3.3Å; V52-V105 HydrophobicContact CG1-CG2 4.46Å; V52-V105 HydrophobicContact CG2-CG1 4.44Å; V52-V105 HydrophobicContact CG2-CG2 4.27Å; I87-V105 WeakPolarHBondContact CA-O 3.42Å; I87-V105 HydrophobicContact CB-CG1 4.37Å; I87-V105 PolarHBondContact N-O 2.96Å; N88-V105 HydrophobicContact CB-CB 3.91Å; N88-V105 HydrophobicContact CB-CG2 4.14Å; N88-V105 PolarHBondContact N-O 3.35Å; N88-V105 VanDerWaalsContact N-O 3.09Å; N88-V105 WeakPolarHBondContact O-CA 3.44Å; N88-V105 WeakPolarHBondContact O-CB 3.38Å; N88-V105 PolarHBondContact O-N 2.94Å; F90-V105 HydrophobicContact CD1-CG2 4.15Å; F90-V105 HydrophobicContact CE1-CG2 3.65Å
106	M	94.6	Very high	91.4	Very high	16 Å²	16	42.8 Å²	42.8	8%	0.079	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	168.5	-176.5	-63.5	165	-68.2	0	0	109.5	V50 A51 K53 I84 R85 L86	V50-M106 CarbonylContact C-O 3.5Å; V50-M106 WeakPolarHBondContact CA-O 3.47Å; V50-M106 WeakPolarHBondContact CB-O 3.44Å; A51-M106 PolarHBondContact N-O 3.31Å; A51-M106 PolarHBondContact O-N 2.94Å; K53-M106 HydrophobicContact CB-CE 3.71Å; K53-M106 HydrophobicContact CD-CE 4.18Å; I84-M106 HydrophobicContact CD1-CB 4.34Å; I84-M106 HydrophobicContact CG1-CB 3.9Å; I84-M106 HydrophobicContact CG1-CG 4.12Å; I84-M106 HydrophobicContact CG1-SD 3.97Å; I84-M106 HydrophobicContact CG2-SD 4.39Å; R85-M106 WeakPolarHBondContact O-CA 3.48Å; L86-M106 HydrophobicContact CD1-CG 4.47Å
107	E	92.6	Very high	91.2	Very high	19 Å²	19	40.7 Å²	40.7	9%	0.089	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	142.1	168.7	61.8	-165.1	127.2	0	0	111.5	I84 R85 I87 M109 K164	I84-E107 HydrophobicContact CD1-CG 3.36Å; I84-E107 HydrophobicContact CG1-CG 4.36Å; R85-E107 WeakPolarHBondContact CB-OE1 3.28Å; R85-E107 PolarHBondContact N-OE1 3.34Å; I87-E107 HydrophobicContact CD1-CB 4.27Å; E107-M109 HydrophobicContact CG-SD 4.42Å; E107-K164 VanDerWaalsContact CD-NZ 3.33Å; E107-K164 HydrophobicContact CG-CD 4.19Å; E107-K164 WeakPolarHBondContact OE1-CD 3.34Å; E107-K164 WeakPolarHBondContact OE1-CE 3.37Å; E107-K164 IonicContact OE1-NZ 3.33Å; E107-K164 PolarHBondContact OE1-NZ 3.43Å; E107-K164 WeakPolarHBondContact OE2-CD 3.28Å; E107-K164 WeakPolarHBondContact OE2-CE 3.36Å; E107-K164 IonicContact OE2-NZ 3.54Å; E107-K164 PolarHBondContact OE2-NZ 3.1Å
108	L	93.4	Very high	90.7	Very high	40 Å²	40	40.3 Å²	40.3	21%	0.209	21%	0.207	C	C	.	.			trans	-81.7	136.6	174.2	-171.2	65.8	0	0	0	110.1	I30 P49 A51	I30-L108 HydrophobicContact CD1-CD1 3.58Å; P49-L108 HydrophobicContact CB-CB 4.2Å; P49-L108 HydrophobicContact CB-CD2 3.75Å; A51-L108 HydrophobicContact CB-CD1 3.99Å
109	M	93.6	Very high	90.5	Very high	21 Å²	21	40.4 Å²	40.4	10%	0.103	21%	0.209	C	C	.	.			trans	-118.8	158.1	175.7	-58.1	-68.6	-73.5	0	0	109	I84 E107 V156 K158 K164	I84-M109 HydrophobicContact CD1-CG 4.33Å; E107-M109 HydrophobicContact CG-SD 4.42Å; M109-V156 HydrophobicContact CB-CB 3.73Å; M109-V156 HydrophobicContact CB-CG2 3.9Å; M109-V156 HydrophobicContact CE-CG2 4.27Å; M109-V156 HydrophobicContact CG-CB 3.99Å; M109-V156 HydrophobicContact CG-CG2 3.55Å; M109-K158 HydrophobicContact CE-CD 4.49Å; M109-K158 HydrophobicContact CE-CG 3.75Å; M109-K158 HydrophobicContact SD-CD 4.16Å; M109-K158 WeakPolarHBondContact SD-CE 3.42Å; M109-K158 HydrophobicContact SD-CG 3.77Å; M109-K164 HydrophobicContact CE-CB 4.13Å; M109-K164 HydrophobicContact CE-CD 4.05Å; M109-K164 HydrophobicContact CE-CG 4.06Å; M109-K164 HydrophobicContact SD-CD 3.92Å
110	D	90.3	Very high	90.1	Very high	100 Å²	100	48.1 Å²	48.1	54%	0.535	25%	0.25	S	S	.	.	S	Bend	trans	-81.4	-41	-169.4	-63.6	-26.7	0	0	0	112.2	V157 K158 S159	D110-V157 PolarHBondContact N-O 3.37Å; D110-K158 WeakPolarHBondContact OD2-CA 3.34Å; D110-S159 WeakPolarHBondContact OD2-CB 3.18Å; D110-S159 PolarHBondContact OD2-N 3.5Å; D110-S159 PolarHBondContact OD2-OG 3.03Å
111	A	88.6	Confident	90	Very high	27 Å²	27	43 Å²	43	22%	0.223	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	160.5	-173.4	0	0	0	0	0	112.4	Q115 V156 V157	A111-Q115 HydrophobicContact CB-CB 4.49Å; A111-V156 CarbonylContact O-C 3.58Å; A111-V156 VanDerWaalsContact O-CA 3.26Å; A111-V156 WeakPolarHBondContact O-CA 3.2Å; A111-V157 HydrophobicContact CB-CG2 4.1Å; A111-V157 PolarHBondContact N-O 2.92Å; A111-V157 VanDerWaalsContact N-O 3.08Å; A111-V157 PolarHBondContact O-N 3.26Å
112	S	89.6	Confident	90.1	Very high	30 Å²	30	44.3 Å²	44.3	21%	0.21	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	155.8	165.4	64.2	0	0	0	0	110.6	C114 Q115 V116 I155	S112-C114 PolarHBondContact O-N 2.79Å; S112-C114 VanDerWaalsContact O-N 3.17Å; S112-Q115 WeakPolarHBondContact O-CB 3.42Å; S112-Q115 PolarHBondContact O-N 3.26Å; S112-Q115 PolarHBondContact OG-OE1 2.65Å; S112-V116 PolarHBondContact O-N 2.81Å; S112-I155 CarbonylContact C-O 3.09Å; S112-I155 WeakPolarHBondContact CA-O 3.09Å
113	L	91.2	Very high	90.2	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-23.9	176.5	-163.2	72.6	0	0	0	112.3	Q115 V116 I117 L129 I133 P152 I155 V157 L163 I212 M216	L113-Q115 PolarHBondContact O-N 3Å; L113-V116 HydrophobicContact CD1-CB 4.1Å; L113-V116 HydrophobicContact CD1-CG1 4.28Å; L113-V116 HydrophobicContact CD1-CG2 4.41Å; L113-V116 PolarHBondContact O-N 2.87Å; L113-V116 VanDerWaalsContact O-N 3.15Å; L113-I117 HydrophobicContact CG-CD1 4.38Å; L113-I117 HydrophobicContact CG-CG1 4.41Å; L113-I117 WeakPolarHBondContact O-CG1 3.31Å; L113-I117 PolarHBondContact O-N 3.23Å; L113-L129 HydrophobicContact CD1-CD1 4.34Å; L113-I133 HydrophobicContact CD2-CD1 4.43Å; L113-P152 HydrophobicContact CB-CB 4.04Å; L113-P152 WeakPolarHBondContact CB-O 3.35Å; L113-P152 HydrophobicContact CD2-CB 4.34Å; L113-P152 HydrophobicContact CG-CB 4.43Å; L113-P152 PolarHBondContact N-O 2.94Å; L113-I155 HydrophobicContact CB-CB 3.92Å; L113-I155 HydrophobicContact CB-CG2 3.98Å; L113-I155 HydrophobicContact CD1-CG2 4.45Å; L113-I155 HydrophobicContact CD2-CB 4.1Å; L113-I155 HydrophobicContact CD2-CD1 3.87Å; L113-I155 HydrophobicContact CD2-CG2 3.99Å; L113-I155 HydrophobicContact CG-CG2 4.39Å; L113-I155 PolarHBondContact N-O 3.29Å; L113-V157 HydrophobicContact CD1-CG1 4.09Å; L113-L163 HydrophobicContact CD1-CD1 4.5Å; L113-I212 HydrophobicContact CD2-CG2 3.56Å; L113-M216 HydrophobicContact CD1-CE 3.67Å; L113-M216 HydrophobicContact CD2-CE 3.63Å; L113-M216 HydrophobicContact CG-CE 3.93Å
114	C	87.8	Confident	90.2	Very high	44 Å²	44	49.6 Å²	49.6	30%	0.297	26%	0.258	S	S	.	.	H	α-helix	trans	-53.2	-38.4	170	-70.2	0	0	0	0	112.6	S112 H118 P152 S153	S112-C114 PolarHBondContact O-N 2.79Å; S112-C114 VanDerWaalsContact O-N 3.17Å; C114-H118 PolarHBondContact O-CE1 3.09Å; C114-H118 PolarHBondContact O-ND1 3Å; C114-P152 HydrophobicContact CB-CB 4.49Å; C114-S153 PolarHBondContact SG-N 2.97Å; C114-S153 VanDerWaalsContact SG-N 3.4Å
115	Q	85.9	Confident	90.3	Very high	116 Å²	116	55.3 Å²	55.3	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-77.3	-37.6	179.8	-67.3	162.4	-54.9	0	0	110.8	A111 S112 L113 H118	A111-Q115 HydrophobicContact CB-CB 4.49Å; S112-Q115 WeakPolarHBondContact O-CB 3.42Å; S112-Q115 PolarHBondContact O-N 3.26Å; S112-Q115 PolarHBondContact OG-OE1 2.65Å; L113-Q115 PolarHBondContact O-N 3Å; Q115-H118 PolarHBondContact O-N 2.99Å
116	V	87.6	Confident	90.3	Very high	13 Å²	13	55.5 Å²	55.5	8%	0.079	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-36.8	-179.2	-176	0	0	0	0	112.4	S112 L113 H118 M119 L121 L129 V157	S112-V116 PolarHBondContact O-N 2.81Å; L113-V116 HydrophobicContact CD1-CB 4.1Å; L113-V116 HydrophobicContact CD1-CG1 4.28Å; L113-V116 HydrophobicContact CD1-CG2 4.41Å; L113-V116 PolarHBondContact O-N 2.87Å; L113-V116 VanDerWaalsContact O-N 3.15Å; V116-H118 PolarHBondContact O-N 3.4Å; V116-H118 VanDerWaalsContact O-N 3.15Å; V116-M119 WeakPolarHBondContact O-CB 3.48Å; V116-M119 PolarHBondContact O-N 2.99Å; V116-L121 HydrophobicContact CG1-CD1 4.06Å; V116-L121 HydrophobicContact CG1-CD2 3.89Å; V116-L121 HydrophobicContact CG1-CG 4.47Å; V116-L129 HydrophobicContact CG1-CD1 4.09Å; V116-V157 HydrophobicContact CG2-CB 4.47Å; V116-V157 HydrophobicContact CG2-CG1 4.4Å; V116-V157 HydrophobicContact CG2-CG2 3.32Å
117	I	86.8	Confident	90.4	Very high	4 Å²	4	55 Å²	55	2%	0.021	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-26.6	178.8	-80.6	168.4	0	0	0	112.9	L113 M119 P152 E215 M216	L113-I117 HydrophobicContact CG-CD1 4.38Å; L113-I117 HydrophobicContact CG-CG1 4.41Å; L113-I117 WeakPolarHBondContact O-CG1 3.31Å; L113-I117 PolarHBondContact O-N 3.23Å; I117-M119 VanDerWaalsContact C-N 3.32Å; I117-P152 HydrophobicContact CD1-CB 3.62Å; I117-P152 HydrophobicContact CD1-CG 3.43Å; I117-P152 VanDerWaalsContact CD1-CG 3.43Å; I117-E215 HydrophobicContact CD1-CG 4.05Å; I117-E215 HydrophobicContact CG2-CG 3.71Å; I117-M216 HydrophobicContact CG1-CG 3.78Å
118	H	80.9	Confident	90.6	Very high	142 Å²	142	56.8 Å²	56.8	66%	0.657	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	2.4	179.1	-61.3	91.7	0	0	0	113	C114 Q115 V116	C114-H118 PolarHBondContact O-CE1 3.09Å; C114-H118 PolarHBondContact O-ND1 3Å; Q115-H118 PolarHBondContact O-N 2.99Å; V116-H118 PolarHBondContact O-N 3.4Å; V116-H118 VanDerWaalsContact O-N 3.15Å
119	M	86.6	Confident	90.8	Very high	119 Å²	119	55 Å²	55	59%	0.586	28%	0.276	S	S	*	.	S	Bend	trans	-94.5	154.3	175.3	-57.8	176.2	65	0	0	110	V116 I117 L121	V116-M119 WeakPolarHBondContact O-CB 3.48Å; V116-M119 PolarHBondContact O-N 2.99Å; I117-M119 VanDerWaalsContact C-N 3.32Å; M119-L121 PolarHBondContact O-N 3.26Å; M119-L121 VanDerWaalsContact O-N 3.09Å
120	D	83.2	Confident	91	Very high	162 Å²	162	54 Å²	54	87%	0.866	27%	0.271	S	S	*	.			trans	-72.4	104	171.7	-62.7	-39.7	0	0	0	109.5
121	L	89.6	Confident	91.4	Very high	19 Å²	19	49.3 Å²	49.3	10%	0.099	25%	0.246	C	C	.	.			trans	-99	120.8	178.4	-62.9	174.7	0	0	0	110	V116 M119 R125 L129 M216 P279	V116-L121 HydrophobicContact CG1-CD1 4.06Å; V116-L121 HydrophobicContact CG1-CD2 3.89Å; V116-L121 HydrophobicContact CG1-CG 4.47Å; M119-L121 PolarHBondContact O-N 3.26Å; M119-L121 VanDerWaalsContact O-N 3.09Å; L121-R125 HydrophobicContact CD2-CB 4.3Å; L121-L129 HydrophobicContact CD1-CD1 4.41Å; L121-M216 HydrophobicContact CD1-CG 4.38Å; L121-M216 HydrophobicContact CD1-SD 4.42Å; L121-P279 WeakPolarHBondContact O-CG 3.41Å
122	D	93.4	Very high	91.9	Very high	59 Å²	59	48.1 Å²	48.1	32%	0.316	24%	0.236	S	C	.	.			trans	-66.6	168.3	165.7	61.4	43	0	0	0	111.4	E124 R125 M126	D122-E124 PolarHBondContact O-N 3.48Å; D122-E124 WeakPolarHBondContact OD1-CA 3.36Å; D122-E124 WeakPolarHBondContact OD1-CB 3.47Å; D122-E124 PolarHBondContact OD1-N 3.01Å; D122-R125 WeakPolarHBondContact OD1-CB 3.39Å; D122-R125 WeakPolarHBondContact OD1-CG 3.22Å; D122-R125 PolarHBondContact OD1-N 3.2Å; D122-R125 IonicContact OD2-CZ 3.4Å; D122-R125 IonicContact OD2-NE 2.86Å; D122-M126 WeakPolarHBondContact O-CB 3.48Å; D122-M126 PolarHBondContact O-N 3.11Å
123	H	95	Very high	92.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-29.2	178.5	-75.8	-66	0	0	0	113.5	S127 F278 P279 D285 K288 T289 Y318	H123-S127 VanDerWaalsContact O-CB 3.23Å; H123-S127 WeakPolarHBondContact O-CB 3.45Å; H123-S127 PolarHBondContact O-N 3.19Å; H123-S127 PolarHBondContact O-OG 2.83Å; H123-F278 AromaticContact CE1-CD1 3.94Å; H123-P279 PolarHBondContact NE2-O 2.71Å; H123-P279 VanDerWaalsContact NE2-O 3.14Å; H123-D285 IonicContact CD2-OD1 3.82Å; H123-D285 PolarHBondContact NE2-O 3.43Å; H123-K288 HydrophobicContact CB-CB 4.12Å; H123-K288 HydrophobicContact CB-CD 3.49Å; H123-K288 VanDerWaalsContact CB-CD 3.49Å; H123-K288 HydrophobicContact CB-CG 4.45Å; H123-T289 PolarHBondContact NE2-OG1 2.75Å; H123-T289 VanDerWaalsContact NE2-OG1 3.14Å; H123-Y318 HydrophobicContact CB-CE2 4.27Å; H123-Y318 AromaticContact ND1-CE2 3.51Å; H123-Y318 AromaticContact ND1-CZ 3.63Å; H123-Y318 PolarHBondContact ND1-OH 2.88Å
124	E	94.7	Very high	92.6	Very high	110 Å²	110	46.7 Å²	46.7	51%	0.514	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-52.6	-178.1	-166.2	177.2	161.7	0	0	110.1	D122 S127 Y128 W322	D122-E124 PolarHBondContact O-N 3.48Å; D122-E124 WeakPolarHBondContact OD1-CA 3.36Å; D122-E124 WeakPolarHBondContact OD1-CB 3.47Å; D122-E124 PolarHBondContact OD1-N 3.01Å; E124-S127 PolarHBondContact O-N 3.02Å; E124-S127 PolarHBondContact O-OG 3.26Å; E124-Y128 VanDerWaalsContact O-CB 3.26Å; E124-Y128 WeakPolarHBondContact O-CB 3.49Å; E124-Y128 PolarHBondContact O-N 3.02Å; E124-W322 HydrophobicContact CB-CZ2 4.46Å; E124-W322 HydrophobicContact CG-CH2 3.6Å; E124-W322 HydrophobicContact CG-CZ2 3.39Å
125	R	94.8	Very high	93	Very high	121 Å²	121	44.6 Å²	44.6	46%	0.457	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-45.6	175.5	-68.2	171.8	177.5	164.5	3.7	111.5	L121 D122 Y128 L129	L121-R125 HydrophobicContact CD2-CB 4.3Å; D122-R125 WeakPolarHBondContact OD1-CB 3.39Å; D122-R125 WeakPolarHBondContact OD1-CG 3.22Å; D122-R125 PolarHBondContact OD1-N 3.2Å; D122-R125 IonicContact OD2-CZ 3.4Å; D122-R125 IonicContact OD2-NE 2.86Å; R125-Y128 PolarHBondContact O-N 3.4Å; R125-L129 WeakPolarHBondContact O-CB 3.36Å; R125-L129 VanDerWaalsContact O-CG 3.24Å; R125-L129 WeakPolarHBondContact O-CG 3.37Å; R125-L129 PolarHBondContact O-N 2.93Å
126	M	95.8	Very high	93.5	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.02	19%	0.186	C	C	.	.	H	α-helix	trans	-61.8	-49.4	-179.8	-171.6	-172.1	-60.7	0	0	111.6	D122 Y128 L129 L130 M216 V217 Y318	D122-M126 WeakPolarHBondContact O-CB 3.48Å; D122-M126 PolarHBondContact O-N 3.11Å; M126-Y128 VanDerWaalsContact C-N 3.34Å; M126-Y128 PolarHBondContact O-N 2.84Å; M126-L129 PolarHBondContact O-N 2.91Å; M126-L130 HydrophobicContact CG-CD1 4.25Å; M126-L130 VanDerWaalsContact O-CG 3.27Å; M126-L130 WeakPolarHBondContact O-CG 3.18Å; M126-L130 PolarHBondContact O-N 2.84Å; M126-M216 HydrophobicContact CE-CB 4.45Å; M126-M216 HydrophobicContact CG-SD 4.02Å; M126-V217 HydrophobicContact CE-CG2 3.98Å; M126-V217 HydrophobicContact SD-CG2 3.9Å; M126-Y318 PolarHBondContact SD-OH 3.38Å
127	S	97.2	Very high	93.8	Very high	4 Å²	4	38.5 Å²	38.5	3%	0.028	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-36.5	178.1	57.8	0	0	0	0	112.4	H123 E124 L130 Y131 Y318 W322	H123-S127 VanDerWaalsContact O-CB 3.23Å; H123-S127 WeakPolarHBondContact O-CB 3.45Å; H123-S127 PolarHBondContact O-N 3.19Å; H123-S127 PolarHBondContact O-OG 2.83Å; E124-S127 PolarHBondContact O-N 3.02Å; E124-S127 PolarHBondContact O-OG 3.26Å; S127-L130 PolarHBondContact O-N 3.5Å; S127-Y131 WeakPolarHBondContact O-CB 3.38Å; S127-Y131 PolarHBondContact O-N 3.06Å; S127-Y318 WeakPolarHBondContact CB-O 3.34Å; S127-W322 PolarHBondContact OG-NE1 3.17Å
128	Y	97.4	Very high	94.2	Very high	57 Å²	57	40 Å²	40	22%	0.224	19%	0.187	C	C	.	.	H	α-helix	trans	-69.5	-39.5	178	-174.2	-127.1	0	0	0	112.8	E124 R125 M126 Y131 Q132 C161 W322	E124-Y128 VanDerWaalsContact O-CB 3.26Å; E124-Y128 WeakPolarHBondContact O-CB 3.49Å; E124-Y128 PolarHBondContact O-N 3.02Å; R125-Y128 PolarHBondContact O-N 3.4Å; M126-Y128 VanDerWaalsContact C-N 3.34Å; M126-Y128 PolarHBondContact O-N 2.84Å; Y128-Y131 HydrophobicContact CD2-CD1 4.17Å; Y128-Y131 HydrophobicContact CE2-CD1 4.22Å; Y128-Y131 PolarHBondContact O-N 2.79Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.27Å; Y128-Q132 HydrophobicContact CE2-CG 4.19Å; Y128-Q132 VanDerWaalsContact O-CG 3.3Å; Y128-Q132 WeakPolarHBondContact O-CG 3.44Å; Y128-Q132 PolarHBondContact O-N 2.95Å; Y128-Q132 PolarHBondContact O-NE2 2.93Å; Y128-C161 HydrophobicContact CD1-CB 4.19Å; Y128-C161 HydrophobicContact CE1-CB 4.39Å; Y128-W322 HydrophobicContact CD2-CB 4.44Å; Y128-W322 AromaticContact CD2-CD2 3.72Å; Y128-W322 HydrophobicContact CD2-CD2 3.72Å; Y128-W322 AromaticContact CD2-CE3 3.89Å; Y128-W322 HydrophobicContact CD2-CE3 3.89Å; Y128-W322 AromaticContact CD2-CG 3.96Å; Y128-W322 HydrophobicContact CD2-CG 3.96Å; Y128-W322 HydrophobicContact CD2-CZ3 4.43Å; Y128-W322 HydrophobicContact CE2-CE3 4.39Å; Y128-W322 HydrophobicContact CG-CD2 4.36Å
129	L	97.4	Very high	94.7	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-43.1	173	-69.2	171.1	0	0	0	111	L113 V116 L121 R125 M126 Q132 I133 V157 L163 M216	L113-L129 HydrophobicContact CD1-CD1 4.34Å; V116-L129 HydrophobicContact CG1-CD1 4.09Å; L121-L129 HydrophobicContact CD1-CD1 4.41Å; R125-L129 WeakPolarHBondContact O-CB 3.36Å; R125-L129 VanDerWaalsContact O-CG 3.24Å; R125-L129 WeakPolarHBondContact O-CG 3.37Å; R125-L129 PolarHBondContact O-N 2.93Å; M126-L129 PolarHBondContact O-N 2.91Å; L129-Q132 PolarHBondContact O-N 3.33Å; L129-I133 VanDerWaalsContact O-CG1 3.27Å; L129-I133 WeakPolarHBondContact O-CG1 3.42Å; L129-I133 PolarHBondContact O-N 2.9Å; L129-V157 HydrophobicContact CD2-CG1 3.98Å; L129-L163 HydrophobicContact CB-CD1 4.28Å; L129-L163 HydrophobicContact CD2-CB 4.18Å; L129-L163 HydrophobicContact CD2-CD1 3.83Å; L129-M216 HydrophobicContact CB-CE 4.46Å; L129-M216 HydrophobicContact CD1-CE 4.43Å
130	L	97.9	Very high	94.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.8	-42.3	176.6	-69.4	168.3	0	0	0	112.3	M126 S127 Q132 I133 L134 V209 M213 Y318 I319	M126-L130 HydrophobicContact CG-CD1 4.25Å; M126-L130 VanDerWaalsContact O-CG 3.27Å; M126-L130 WeakPolarHBondContact O-CG 3.18Å; M126-L130 PolarHBondContact O-N 2.84Å; S127-L130 PolarHBondContact O-N 3.5Å; L130-Q132 VanDerWaalsContact C-N 3.35Å; L130-Q132 PolarHBondContact O-N 2.84Å; L130-I133 PolarHBondContact O-N 3.13Å; L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 VanDerWaalsContact O-CG 3.3Å; L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 3.46Å; L130-V209 HydrophobicContact CD2-CG1 3.86Å; L130-M213 HydrophobicContact CD1-CB 4.28Å; L130-M213 HydrophobicContact CD1-CE 4Å; L130-M213 HydrophobicContact CD1-CG 3.75Å; L130-M213 HydrophobicContact CD1-SD 3.57Å; L130-M213 VanDerWaalsContact CD1-SD 3.57Å; L130-M213 HydrophobicContact CD2-CB 3.87Å; L130-M213 HydrophobicContact CD2-CG 4.28Å; L130-Y318 HydrophobicContact CD1-CE1 4.07Å; L130-I319 HydrophobicContact CB-CD1 3.67Å; L130-I319 HydrophobicContact CD1-CD1 4.28Å
131	Y	98.4	Very high	95.3	Very high	1 Å²	1	20.7 Å²	20.7	0%	0.004	9%	0.091	C	C	.	.	H	α-helix	trans	-55	-50.6	173.8	170.3	-110.1	0	0	0	111.2	S127 Y128 I133 L134 C135 L314 I319 W322 D324 E327	S127-Y131 WeakPolarHBondContact O-CB 3.38Å; S127-Y131 PolarHBondContact O-N 3.06Å; Y128-Y131 HydrophobicContact CD2-CD1 4.17Å; Y128-Y131 HydrophobicContact CE2-CD1 4.22Å; Y128-Y131 PolarHBondContact O-N 2.79Å; Y131-I133 VanDerWaalsContact C-N 3.34Å; Y131-I133 PolarHBondContact O-N 3.3Å; Y131-L134 PolarHBondContact O-N 3.42Å; Y131-L134 VanDerWaalsContact O-N 3.11Å; Y131-C135 WeakPolarHBondContact CE2-SG 3.22Å; Y131-C135 PolarHBondContact O-N 2.98Å; Y131-C135 PolarHBondContact O-SG 3.14Å; Y131-L314 HydrophobicContact CD2-CD2 3.8Å; Y131-L314 HydrophobicContact CE2-CD2 3.88Å; Y131-I319 HydrophobicContact CD2-CG2 3.87Å; Y131-I319 HydrophobicContact CG-CG2 4.42Å; Y131-W322 HydrophobicContact CD1-CB 3.53Å; Y131-W322 HydrophobicContact CD1-CG 4.35Å; Y131-W322 HydrophobicContact CD2-CB 3.9Å; Y131-W322 HydrophobicContact CE1-CB 3.94Å; Y131-W322 VanDerWaalsContact CE1-O 3.3Å; Y131-W322 WeakPolarHBondContact CE1-O 3.22Å; Y131-W322 HydrophobicContact CE2-CB 4.31Å; Y131-W322 HydrophobicContact CG-CB 3.5Å; Y131-W322 HydrophobicContact CG-CG 4.29Å; Y131-W322 PolarHBondContact OH-O 3.24Å; Y131-D324 PolarHBondContact OH-N 3.35Å; Y131-D324 PolarHBondContact OH-O 2.79Å; Y131-E327 VanDerWaalsContact CE1-OE2 3.31Å; Y131-E327 WeakPolarHBondContact CE1-OE2 3.47Å; Y131-E327 PolarHBondContact OH-OE2 2.8Å
132	Q	98.1	Very high	95.3	Very high	2 Å²	2	22.6 Å²	22.6	1%	0.009	11%	0.106	C	C	.	.	H	α-helix	trans	-61.9	-39	178.7	-73.3	177.9	87.5	0	0	113.1	N82 Y128 L129 L130 G136 C161 L163	N82-Q132 VanDerWaalsContact CB-O 3.28Å; N82-Q132 WeakPolarHBondContact CB-O 3.24Å; N82-Q132 WeakPolarHBondContact ND2-CB 3.26Å; N82-Q132 WeakPolarHBondContact ND2-CG 3.48Å; N82-Q132 PolarHBondContact ND2-OE1 3.14Å; Y128-Q132 VanDerWaalsContact CD1-NE2 3.27Å; Y128-Q132 HydrophobicContact CE2-CG 4.19Å; Y128-Q132 VanDerWaalsContact O-CG 3.3Å; Y128-Q132 WeakPolarHBondContact O-CG 3.44Å; Y128-Q132 PolarHBondContact O-N 2.95Å; Y128-Q132 PolarHBondContact O-NE2 2.93Å; L129-Q132 PolarHBondContact O-N 3.33Å; L130-Q132 VanDerWaalsContact C-N 3.35Å; L130-Q132 PolarHBondContact O-N 2.84Å; Q132-G136 PolarHBondContact O-N 3Å; Q132-C161 PolarHBondContact NE2-O 2.9Å; Q132-L163 HydrophobicContact CB-CB 4.05Å; Q132-L163 HydrophobicContact CB-CD2 4.31Å
133	I	97.8	Very high	94.9	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.4	-47.4	173.1	-68.2	164.6	0	0	0	109.9	L113 L129 L130 Y131 C135 G136 I137 I155 L163 V209	L113-I133 HydrophobicContact CD2-CD1 4.43Å; L129-I133 VanDerWaalsContact O-CG1 3.27Å; L129-I133 WeakPolarHBondContact O-CG1 3.42Å; L129-I133 PolarHBondContact O-N 2.9Å; L130-I133 PolarHBondContact O-N 3.13Å; Y131-I133 VanDerWaalsContact C-N 3.34Å; Y131-I133 PolarHBondContact O-N 3.3Å; I133-C135 PolarHBondContact O-N 3.3Å; I133-G136 PolarHBondContact O-N 3.36Å; I133-I137 HydrophobicContact CG2-CD1 3.57Å; I133-I137 HydrophobicContact CG2-CG1 4.33Å; I133-I137 VanDerWaalsContact O-CG1 3.23Å; I133-I137 WeakPolarHBondContact O-CG1 3.47Å; I133-I137 PolarHBondContact O-N 3.5Å; I133-I155 HydrophobicContact CD1-CD1 3.97Å; I133-I155 HydrophobicContact CG1-CD1 4.22Å; I133-L163 HydrophobicContact CD1-CD1 3.93Å; I133-L163 HydrophobicContact CG1-CD1 3.61Å; I133-L163 HydrophobicContact CG1-CD2 3.71Å; I133-L163 HydrophobicContact CG1-CG 4.35Å; I133-V209 HydrophobicContact CG2-CG1 4.47Å; I133-V209 HydrophobicContact CG2-CG2 3.64Å
134	L	98.1	Very high	94.5	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-39.8	180	-70.2	167.9	0	0	0	112.3	L130 Y131 I137 R138 I206 M299 V310 A313 L314 I319	L130-L134 WeakPolarHBondContact O-CB 3.45Å; L130-L134 VanDerWaalsContact O-CG 3.3Å; L130-L134 WeakPolarHBondContact O-CG 3.46Å; L130-L134 PolarHBondContact O-N 3.46Å; Y131-L134 PolarHBondContact O-N 3.42Å; Y131-L134 VanDerWaalsContact O-N 3.11Å; L134-I137 PolarHBondContact O-N 2.77Å; L134-R138 VanDerWaalsContact O-CB 3.31Å; L134-R138 WeakPolarHBondContact O-CB 3.42Å; L134-R138 PolarHBondContact O-N 2.84Å; L134-I206 HydrophobicContact CD2-CD1 3.57Å; L134-M299 HydrophobicContact CD1-CE 4.36Å; L134-M299 HydrophobicContact CD2-CE 4.32Å; L134-V310 HydrophobicContact CD2-CG1 4.25Å; L134-A313 HydrophobicContact CD1-CB 3.96Å; L134-A313 HydrophobicContact CD2-CB 3.98Å; L134-L314 HydrophobicContact CB-CD2 3.61Å; L134-L314 HydrophobicContact CB-CG 3.94Å; L134-L314 HydrophobicContact CD1-CD2 4.4Å; L134-I319 HydrophobicContact CD1-CG1 4.19Å; L134-I319 HydrophobicContact CD1-CG2 4.01Å
135	C	97.1	Very high	94.1	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.5	-46.2	173.3	-71.1	0	0	0	0	111.9	Y131 I133 I137 R138 H139	Y131-C135 WeakPolarHBondContact CE2-SG 3.22Å; Y131-C135 PolarHBondContact O-N 2.98Å; Y131-C135 PolarHBondContact O-SG 3.14Å; I133-C135 PolarHBondContact O-N 3.3Å; C135-I137 VanDerWaalsContact C-N 3.33Å; C135-I137 PolarHBondContact O-N 3.47Å; C135-R138 PolarHBondContact O-N 2.86Å; C135-H139 WeakPolarHBondContact O-CB 3.44Å; C135-H139 PolarHBondContact O-N 3.44Å
136	G	95.3	Very high	93.8	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.4	-43.5	175.7	0	0	0	0	0	112.5	Q132 I133 H139 L140	Q132-G136 PolarHBondContact O-N 3Å; I133-G136 PolarHBondContact O-N 3.36Å; G136-H139 PolarHBondContact O-N 3.48Å; G136-L140 WeakPolarHBondContact O-CG 3.35Å; G136-L140 PolarHBondContact O-N 3.37Å; G136-L140 VanDerWaalsContact O-N 3.13Å
137	I	94.8	Very high	93.4	Very high	0 Å²	0	10.9 Å²	10.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-65.9	-45.1	177.2	-67.6	167.1	0	0	0	111.4	I133 L134 C135 H139 L140 H141 L150 I165 D205 V209 V310	I133-I137 HydrophobicContact CG2-CD1 3.57Å; I133-I137 HydrophobicContact CG2-CG1 4.33Å; I133-I137 VanDerWaalsContact O-CG1 3.23Å; I133-I137 WeakPolarHBondContact O-CG1 3.47Å; I133-I137 PolarHBondContact O-N 3.5Å; L134-I137 PolarHBondContact O-N 2.77Å; C135-I137 VanDerWaalsContact C-N 3.33Å; C135-I137 PolarHBondContact O-N 3.47Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.47Å; I137-L140 WeakPolarHBondContact O-CB 3.17Å; I137-L140 PolarHBondContact O-N 3.22Å; I137-L140 VanDerWaalsContact O-N 3.14Å; I137-H141 WeakPolarHBondContact CG2-CE1 3.09Å; I137-H141 WeakPolarHBondContact CG2-NE2 3.46Å; I137-H141 WeakPolarHBondContact O-CB 3.38Å; I137-H141 PolarHBondContact O-CD2 2.91Å; I137-H141 VanDerWaalsContact O-CG 3.29Å; I137-H141 PolarHBondContact O-N 2.96Å; I137-L150 HydrophobicContact CD1-CD1 3.34Å; I137-L150 HydrophobicContact CG1-CD1 3.78Å; I137-I165 HydrophobicContact CG1-CD1 4.12Å; I137-D205 HydrophobicContact CD1-CB 4.34Å; I137-D205 HydrophobicContact CG2-CB 4.04Å; I137-V209 HydrophobicContact CD1-CG2 3.39Å; I137-V310 HydrophobicContact CG2-CG1 4.49Å; I137-V310 HydrophobicContact CG2-CG2 3.9Å
138	R	94.4	Very high	92.8	Very high	35 Å²	35	11.4 Å²	11.4	13%	0.132	7%	0.066	C	C	.	.	H	α-helix	trans	-56.9	-44.5	176.8	178.5	166.4	177.6	132.7	14.4	111.3	L134 C135 L140 H141 S142 V310 E311 L314 A328 D329	L134-R138 VanDerWaalsContact O-CB 3.31Å; L134-R138 WeakPolarHBondContact O-CB 3.42Å; L134-R138 PolarHBondContact O-N 2.84Å; C135-R138 PolarHBondContact O-N 2.86Å; R138-L140 PolarHBondContact O-N 3.38Å; R138-H141 PolarHBondContact O-N 3Å; R138-S142 WeakPolarHBondContact O-CB 3.19Å; R138-S142 PolarHBondContact O-N 3.47Å; R138-S142 PolarHBondContact O-OG 3.42Å; R138-V310 HydrophobicContact CB-CG1 3.89Å; R138-E311 IonicContact CZ-OE1 3.73Å; R138-E311 VanDerWaalsContact CZ-OE1 3.3Å; R138-E311 IonicContact CZ-OE2 3.59Å; R138-E311 VanDerWaalsContact CZ-OE2 3.26Å; R138-E311 IonicContact NH1-OE1 2.96Å; R138-E311 PolarHBondContact NH1-OE1 3.29Å; R138-E311 IonicContact NH1-OE2 2.94Å; R138-E311 PolarHBondContact NH1-OE2 3.35Å; R138-E311 VanDerWaalsContact NH1-OE2 3.14Å; R138-E311 VanDerWaalsContact NH2-CD 3.28Å; R138-E311 IonicContact NH2-OE1 3.76Å; R138-E311 PolarHBondContact NH2-OE1 2.96Å; R138-E311 IonicContact NH2-OE2 3.26Å; R138-E311 PolarHBondContact NH2-OE2 2.92Å; R138-L314 HydrophobicContact CB-CD1 4.31Å; R138-L314 HydrophobicContact CG-CD1 4.46Å; R138-A328 WeakPolarHBondContact CD-O 3.35Å; R138-A328 WeakPolarHBondContact CG-O 3.16Å; R138-A328 PolarHBondContact NE-O 3.41Å; R138-D329 IonicContact CZ-OD1 3.21Å; R138-D329 IonicContact NE-OD1 2.82Å; R138-D329 PolarHBondContact NE-OD1 2.5Å; R138-D329 IonicContact NH2-OD1 3.73Å; R138-D329 PolarHBondContact NH2-OD1 3.41Å
139	H	92.6	Very high	92.2	Very high	3 Å²	3	9 Å²	9	1%	0.014	6%	0.056	C	C	.	.	H	α-helix	trans	-62.2	-42.2	177.1	-172.1	84.2	0	0	0	112	N79 H80 I83 C135 G136 I137 S142 A143 A330 P331 P333	N79-H139 PolarHBondContact O-NE2 2.88Å; H80-H139 HydrophobicContact CB-CB 4.33Å; H80-H139 AromaticContact CD2-CG 3.9Å; H80-H139 AromaticContact CD2-ND1 3.83Å; H80-H139 AromaticContact CG-CG 3.82Å; I83-H139 HydrophobicContact CD1-CB 4.4Å; C135-H139 WeakPolarHBondContact O-CB 3.44Å; C135-H139 PolarHBondContact O-N 3.44Å; G136-H139 PolarHBondContact O-N 3.48Å; I137-H139 VanDerWaalsContact C-N 3.29Å; I137-H139 PolarHBondContact O-N 3.47Å; H139-S142 PolarHBondContact O-N 3.22Å; H139-S142 PolarHBondContact O-OG 2.95Å; H139-A143 PolarHBondContact O-N 3.02Å; H139-A330 PolarHBondContact ND1-O 3.03Å; H139-P331 PolarHBondContact CE1-O 3.03Å; H139-P333 WeakPolarHBondContact NE2-CD 3.43Å
140	L	90.6	Very high	91.9	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.3	-47.5	173.8	-67.3	168.6	0	0	0	112.2	V78 I83 G136 I137 R138 S142 A143 G144 I145 H147 F168	V78-L140 HydrophobicContact CG1-CD2 4.31Å; V78-L140 HydrophobicContact CG2-CD2 4.31Å; I83-L140 HydrophobicContact CD1-CD1 4.38Å; I83-L140 HydrophobicContact CD1-CD2 3.76Å; I83-L140 HydrophobicContact CD1-CG 3.72Å; G136-L140 WeakPolarHBondContact O-CG 3.35Å; G136-L140 PolarHBondContact O-N 3.37Å; G136-L140 VanDerWaalsContact O-N 3.13Å; I137-L140 WeakPolarHBondContact O-CB 3.17Å; I137-L140 PolarHBondContact O-N 3.22Å; I137-L140 VanDerWaalsContact O-N 3.14Å; R138-L140 PolarHBondContact O-N 3.38Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.06Å; L140-A143 CarbonylContact O-C 3.45Å; L140-A143 WeakPolarHBondContact O-CA 3.46Å; L140-A143 PolarHBondContact O-N 3.47Å; L140-G144 PolarHBondContact O-N 3.42Å; L140-I145 CarbonylContact C-O 3.54Å; L140-I145 HydrophobicContact CB-CB 4.26Å; L140-I145 WeakPolarHBondContact CB-O 3.41Å; L140-I145 HydrophobicContact CD2-CB 4.42Å; L140-I145 HydrophobicContact CD2-CD1 4.13Å; L140-I145 HydrophobicContact CD2-CG2 4.29Å; L140-I145 WeakPolarHBondContact O-CB 3.22Å; L140-I145 PolarHBondContact O-N 2.78Å; L140-H147 HydrophobicContact CD1-CB 4.4Å; L140-F168 HydrophobicContact CD1-CD1 4.45Å; L140-F168 HydrophobicContact CD1-CE1 3.69Å; L140-F168 HydrophobicContact CD2-CD1 4.13Å; L140-F168 HydrophobicContact CD2-CE1 3.53Å; L140-F168 HydrophobicContact CD2-CZ 4.13Å; L140-F168 HydrophobicContact CG-CE1 4.23Å
141	H	91.3	Very high	91.6	Very high	15 Å²	15	9.5 Å²	9.5	7%	0.069	6%	0.059	C	C	.	.	H	α-helix	trans	-62.9	-38.2	-179.8	-68.2	179.4	0	0	0	111.6	I137 R138 A143 G144 I145 E202 D205	I137-H141 WeakPolarHBondContact CG2-CE1 3.09Å; I137-H141 WeakPolarHBondContact CG2-NE2 3.46Å; I137-H141 WeakPolarHBondContact O-CB 3.38Å; I137-H141 PolarHBondContact O-CD2 2.91Å; I137-H141 VanDerWaalsContact O-CG 3.29Å; I137-H141 PolarHBondContact O-N 2.96Å; R138-H141 PolarHBondContact O-N 3Å; H141-A143 PolarHBondContact O-N 2.91Å; H141-G144 WeakPolarHBondContact O-CA 3.5Å; H141-G144 PolarHBondContact O-N 2.94Å; H141-I145 PolarHBondContact CD2-O 3.36Å; H141-I145 VanDerWaalsContact CD2-O 3.29Å; H141-I145 PolarHBondContact N-O 3.19Å; H141-E202 HydrophobicContact CB-CG 4.01Å; H141-E202 VanDerWaalsContact CE1-C 3.48Å; H141-E202 PolarHBondContact CE1-O 2.83Å; H141-E202 WeakPolarHBondContact ND1-CB 3.45Å; H141-E202 PolarHBondContact NE2-O 3.33Å; H141-D205 IonicContact CD2-OD2 2.73Å; H141-D205 IonicContact CE1-OD2 2.6Å; H141-D205 IonicContact NE2-OD2 3.24Å; H141-D205 PolarHBondContact NE2-OD2 3.23Å
142	S	89.8	Confident	91.3	Very high	60 Å²	60	9.5 Å²	9.5	42%	0.42	6%	0.059	S	C	.	.	H	α-helix	trans	-63.3	-24	175	74.4	0	0	0	0	113.5	R138 H139 L140 G144 P332	R138-S142 WeakPolarHBondContact O-CB 3.19Å; R138-S142 PolarHBondContact O-N 3.47Å; R138-S142 PolarHBondContact O-OG 3.42Å; H139-S142 PolarHBondContact O-N 3.22Å; H139-S142 PolarHBondContact O-OG 2.95Å; L140-S142 VanDerWaalsContact C-N 3.31Å; L140-S142 PolarHBondContact O-N 3.06Å; S142-G144 VanDerWaalsContact C-N 3.34Å; S142-P332 WeakPolarHBondContact OG-CB 3.3Å
143	A	85.5	Confident	90.8	Very high	24 Å²	24	12.1 Å²	12.1	20%	0.198	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	9.2	170.6	0	0	0	0	0	113.6	H139 L140 H141 I145 P332 P333 I335	H139-A143 PolarHBondContact O-N 3.02Å; L140-A143 CarbonylContact O-C 3.45Å; L140-A143 WeakPolarHBondContact O-CA 3.46Å; L140-A143 PolarHBondContact O-N 3.47Å; H141-A143 PolarHBondContact O-N 2.91Å; A143-I145 HydrophobicContact CB-CD1 3.97Å; A143-I145 HydrophobicContact CB-CG1 4.35Å; A143-I145 PolarHBondContact O-N 3.42Å; A143-P332 HydrophobicContact CB-CB 4.29Å; A143-P333 HydrophobicContact CB-CG 3.62Å; A143-I335 HydrophobicContact CB-CD1 3.82Å
144	G	85.1	Confident	90.5	Very high	21 Å²	21	12.7 Å²	12.7	22%	0.216	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	13.1	-178.3	0	0	0	0	0	114.2	L140 H141 S142 T173 A174	L140-G144 PolarHBondContact O-N 3.42Å; H141-G144 WeakPolarHBondContact O-CA 3.5Å; H141-G144 PolarHBondContact O-N 2.94Å; S142-G144 VanDerWaalsContact C-N 3.34Å; G144-T173 CarbonylContact O-C 3.55Å; G144-T173 WeakPolarHBondContact O-CA 3.34Å; G144-A174 PolarHBondContact O-N 3.07Å
145	I	86.1	Confident	90.2	Very high	3 Å²	3	12.7 Å²	12.7	2%	0.015	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121	-178.8	-57.3	157	0	0	0	109.9	L74 V78 L140 H141 A143 A171 I335	L74-I145 HydrophobicContact CD2-CD1 3.45Å; L74-I145 VanDerWaalsContact CD2-CD1 3.45Å; L74-I145 HydrophobicContact CD2-CG1 3.91Å; V78-I145 HydrophobicContact CG2-CD1 3.98Å; L140-I145 CarbonylContact C-O 3.54Å; L140-I145 HydrophobicContact CB-CB 4.26Å; L140-I145 WeakPolarHBondContact CB-O 3.41Å; L140-I145 HydrophobicContact CD2-CB 4.42Å; L140-I145 HydrophobicContact CD2-CD1 4.13Å; L140-I145 HydrophobicContact CD2-CG2 4.29Å; L140-I145 WeakPolarHBondContact O-CB 3.22Å; L140-I145 PolarHBondContact O-N 2.78Å; H141-I145 PolarHBondContact CD2-O 3.36Å; H141-I145 VanDerWaalsContact CD2-O 3.29Å; H141-I145 PolarHBondContact N-O 3.19Å; A143-I145 HydrophobicContact CB-CD1 3.97Å; A143-I145 HydrophobicContact CB-CG1 4.35Å; A143-I145 PolarHBondContact O-N 3.42Å; I145-A171 HydrophobicContact CG2-CB 3.67Å; I145-I335 HydrophobicContact CD1-CD1 3.41Å; I145-I335 VanDerWaalsContact CD1-CD1 3.41Å; I145-I335 HydrophobicContact CG1-CD1 3.94Å
146	I	88.9	Confident	90.1	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131	170.3	-52.5	178.3	0	0	0	108.9	R148 A171 R172 A174 Y200 E202 V204 D205	I146-R148 HydrophobicContact CB-CG 4.19Å; I146-R148 HydrophobicContact CG2-CG 3.6Å; I146-A171 CarbonylContact O-C 3.59Å; I146-A171 WeakPolarHBondContact O-CA 3.22Å; I146-R172 PolarHBondContact N-O 2.74Å; I146-R172 PolarHBondContact O-N 2.79Å; I146-A174 HydrophobicContact CD1-CB 3.91Å; I146-A174 HydrophobicContact CG1-CB 4.27Å; I146-Y200 HydrophobicContact CD1-CD2 4.27Å; I146-Y200 HydrophobicContact CD1-CE2 4.21Å; I146-E202 HydrophobicContact CD1-CG 4.29Å; I146-E202 HydrophobicContact CG1-CG 4.11Å; I146-V204 HydrophobicContact CG2-CG1 3.33Å; I146-D205 WeakPolarHBondContact CG2-OD2 3.12Å
147	H	88.6	Confident	90	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.089	C	C	.	.			trans	-74.2	-51	-172.6	-171.4	-75.1	0	0	0	112.8	L140 D149 L150 L166 D167 F168 D205	L140-H147 HydrophobicContact CD1-CB 4.4Å; H147-D149 VanDerWaalsContact CE1-C 3.46Å; H147-D149 PolarHBondContact CE1-O 3.37Å; H147-D149 VanDerWaalsContact ND1-C 3.33Å; H147-D149 PolarHBondContact ND1-N 2.97Å; H147-D149 PolarHBondContact O-N 3.35Å; H147-L150 HydrophobicContact CB-CG 4.07Å; H147-L150 WeakPolarHBondContact ND1-CG 3.47Å; H147-L150 PolarHBondContact ND1-N 3.45Å; H147-L150 VanDerWaalsContact ND1-N 3.18Å; H147-L166 PolarHBondContact NE2-O 3.02Å; H147-L166 VanDerWaalsContact NE2-O 3.08Å; H147-D167 PolarHBondContact NE2-O 3.25Å; H147-F168 AromaticContact CD2-CE1 3.96Å; H147-D205 PolarHBondContact N-OD2 3.48Å
148	R	84.4	Confident	89.9	Confident	14 Å²	14	17.2 Å²	17.2	5%	0.053	10%	0.102	C	C	.	.			trans	66.3	-12.9	174.9	-49.2	-173.7	-55.1	153.5	11.7	118	I146 L170 Y200 V204 D205	I146-R148 HydrophobicContact CB-CG 4.19Å; I146-R148 HydrophobicContact CG2-CG 3.6Å; R148-L170 VanDerWaalsContact CZ-O 3.26Å; R148-L170 PolarHBondContact NE-O 3.17Å; R148-L170 PolarHBondContact NH2-O 2.86Å; R148-Y200 HydrophobicContact CG-CE2 4.42Å; R148-Y200 PolarHBondContact NH1-OH 3.28Å; R148-V204 HydrophobicContact CG-CG1 4.36Å; R148-D205 PolarHBondContact N-OD1 3.08Å
149	D	84.4	Confident	89.6	Confident	6 Å²	6	20.9 Å²	20.9	3%	0.032	13%	0.133	C	C	.	.			trans	-127.8	38.9	175.9	-159.6	50.2	0	0	0	112.2	H147 K151 N154 L170	H147-D149 VanDerWaalsContact CE1-C 3.46Å; H147-D149 PolarHBondContact CE1-O 3.37Å; H147-D149 VanDerWaalsContact ND1-C 3.33Å; H147-D149 PolarHBondContact ND1-N 2.97Å; H147-D149 PolarHBondContact O-N 3.35Å; D149-K151 PolarHBondContact O-N 3.43Å; D149-K151 IonicContact OD1-NZ 2.64Å; D149-K151 IonicContact OD2-NZ 3.06Å; D149-K151 PolarHBondContact OD2-NZ 2.89Å; D149-N154 PolarHBondContact O-ND2 2.93Å; D149-L170 HydrophobicContact CB-CB 4.07Å; D149-L170 HydrophobicContact CB-CD1 3.72Å; D149-L170 HydrophobicContact CB-CG 4.43Å
150	L	91.6	Very high	89.6	Confident	2 Å²	2	25.4 Å²	25.4	1%	0.01	16%	0.158	C	C	.	.			trans	-68	128	173	-78	174.7	0	0	0	109.7	I137 H147 I165 Y189 D205 V209	I137-L150 HydrophobicContact CD1-CD1 3.34Å; I137-L150 HydrophobicContact CG1-CD1 3.78Å; H147-L150 HydrophobicContact CB-CG 4.07Å; H147-L150 WeakPolarHBondContact ND1-CG 3.47Å; H147-L150 PolarHBondContact ND1-N 3.45Å; H147-L150 VanDerWaalsContact ND1-N 3.18Å; L150-I165 HydrophobicContact CD2-CD1 4.41Å; L150-I165 HydrophobicContact CD2-CG2 3.87Å; L150-Y189 VanDerWaalsContact O-CB 3.22Å; L150-Y189 WeakPolarHBondContact O-CB 3.21Å; L150-D205 HydrophobicContact CD1-CB 3.83Å; L150-V209 HydrophobicContact CD1-CG2 4.34Å
151	K	90.9	Very high	89.6	Confident	14 Å²	14	27.1 Å²	27.1	6%	0.061	17%	0.169	C	C	.	.			trans	-161.1	159.9	178.7	61.7	-168.9	178.3	-144.2	0	109.1	D149 S153 N154 Y189	D149-K151 PolarHBondContact O-N 3.43Å; D149-K151 IonicContact OD1-NZ 2.64Å; D149-K151 IonicContact OD2-NZ 3.06Å; D149-K151 PolarHBondContact OD2-NZ 2.89Å; K151-S153 VanDerWaalsContact CE-OG 3.29Å; K151-S153 WeakPolarHBondContact CE-OG 3.47Å; K151-S153 PolarHBondContact O-N 3Å; K151-S153 VanDerWaalsContact O-N 3.1Å; K151-N154 WeakPolarHBondContact CE-ND2 3.35Å; K151-N154 WeakPolarHBondContact CE-OD1 3.3Å; K151-N154 HydrophobicContact CG-CB 4.06Å; K151-N154 PolarHBondContact O-N 3.39Å; K151-Y189 HydrophobicContact CB-CD2 3.43Å; K151-Y189 VanDerWaalsContact CB-CD2 3.43Å; K151-Y189 HydrophobicContact CB-CE2 3.8Å; K151-Y189 HydrophobicContact CB-CG 3.95Å
152	P	92	Very high	89.7	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-58.1	-29.1	-176.1	-27	35.8	0	0	0	114.8	L113 C114 I117 N154 I155 Y189 I212	L113-P152 HydrophobicContact CB-CB 4.04Å; L113-P152 WeakPolarHBondContact CB-O 3.35Å; L113-P152 HydrophobicContact CD2-CB 4.34Å; L113-P152 HydrophobicContact CG-CB 4.43Å; L113-P152 PolarHBondContact N-O 2.94Å; C114-P152 HydrophobicContact CB-CB 4.49Å; I117-P152 HydrophobicContact CD1-CB 3.62Å; I117-P152 HydrophobicContact CD1-CG 3.43Å; I117-P152 VanDerWaalsContact CD1-CG 3.43Å; P152-N154 VanDerWaalsContact C-N 3.31Å; P152-N154 PolarHBondContact O-N 3.45Å; P152-I155 PolarHBondContact O-N 2.77Å; P152-Y189 VanDerWaalsContact CD-CE1 3.41Å; P152-Y189 WeakPolarHBondContact CD-OH 3.24Å; P152-Y189 HydrophobicContact CG-CE1 3.85Å; P152-Y189 WeakPolarHBondContact CG-OH 3.44Å; P152-I212 HydrophobicContact CG-CG1 4.1Å
153	S	87.4	Confident	90	Very high	56 Å²	56	25.5 Å²	25.5	39%	0.392	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-76.3	-16.4	177.2	59	0	0	0	0	114.6	C114 K151 I155	C114-S153 PolarHBondContact SG-N 2.97Å; C114-S153 VanDerWaalsContact SG-N 3.4Å; K151-S153 VanDerWaalsContact CE-OG 3.29Å; K151-S153 WeakPolarHBondContact CE-OG 3.47Å; K151-S153 PolarHBondContact O-N 3Å; K151-S153 VanDerWaalsContact O-N 3.1Å; S153-I155 VanDerWaalsContact C-N 3.34Å
154	N	90.9	Very high	90.5	Very high	13 Å²	13	25.6 Å²	25.6	7%	0.07	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-97.1	12.9	173.6	-74.9	3.3	0	0	0	111.8	D149 K151 P152 L166 D167	D149-N154 PolarHBondContact O-ND2 2.93Å; K151-N154 WeakPolarHBondContact CE-ND2 3.35Å; K151-N154 WeakPolarHBondContact CE-OD1 3.3Å; K151-N154 HydrophobicContact CG-CB 4.06Å; K151-N154 PolarHBondContact O-N 3.39Å; P152-N154 VanDerWaalsContact C-N 3.31Å; P152-N154 PolarHBondContact O-N 3.45Å; N154-L166 WeakPolarHBondContact O-CB 3.26Å; N154-L166 PolarHBondContact O-N 3.17Å; N154-D167 PolarHBondContact ND2-OD2 3.05Å
155	I	93.4	Very high	91	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	128.9	176.7	-62.4	170.6	0	0	0	107.3	S112 L113 I133 P152 S153 L163 I212	S112-I155 CarbonylContact C-O 3.09Å; S112-I155 WeakPolarHBondContact CA-O 3.09Å; L113-I155 HydrophobicContact CB-CB 3.92Å; L113-I155 HydrophobicContact CB-CG2 3.98Å; L113-I155 HydrophobicContact CD1-CG2 4.45Å; L113-I155 HydrophobicContact CD2-CB 4.1Å; L113-I155 HydrophobicContact CD2-CD1 3.87Å; L113-I155 HydrophobicContact CD2-CG2 3.99Å; L113-I155 HydrophobicContact CG-CG2 4.39Å; L113-I155 PolarHBondContact N-O 3.29Å; I133-I155 HydrophobicContact CD1-CD1 3.97Å; I133-I155 HydrophobicContact CG1-CD1 4.22Å; P152-I155 PolarHBondContact O-N 2.77Å; S153-I155 VanDerWaalsContact C-N 3.34Å; I155-L163 HydrophobicContact CG2-CD1 3.43Å; I155-L163 VanDerWaalsContact CG2-CD1 3.43Å; I155-L163 HydrophobicContact CG2-CD2 3.82Å; I155-L163 HydrophobicContact CG2-CG 3.52Å; I155-I212 HydrophobicContact CD1-CD1 3.72Å
156	V	93.4	Very high	91.1	Very high	19 Å²	19	26.3 Å²	26.3	12%	0.115	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	147.9	-179.7	-73.9	0	0	0	0	110.5	M109 A111 L163 K164 L166	M109-V156 HydrophobicContact CB-CB 3.73Å; M109-V156 HydrophobicContact CB-CG2 3.9Å; M109-V156 HydrophobicContact CE-CG2 4.27Å; M109-V156 HydrophobicContact CG-CB 3.99Å; M109-V156 HydrophobicContact CG-CG2 3.55Å; A111-V156 CarbonylContact O-C 3.58Å; A111-V156 VanDerWaalsContact O-CA 3.26Å; A111-V156 WeakPolarHBondContact O-CA 3.2Å; V156-L163 WeakPolarHBondContact O-CA 3.5Å; V156-K164 HydrophobicContact CG2-CB 4.23Å; V156-K164 WeakPolarHBondContact CG2-O 3.46Å; V156-K164 PolarHBondContact N-O 2.91Å; V156-K164 PolarHBondContact O-N 3.35Å; V156-L166 HydrophobicContact CB-CD1 4.43Å; V156-L166 HydrophobicContact CG1-CD1 3.55Å; V156-L166 HydrophobicContact CG1-CG 4.21Å; V156-L166 HydrophobicContact CG2-CD1 4.05Å; V156-L166 HydrophobicContact CG2-CD2 3.71Å; V156-L166 HydrophobicContact CG2-CG 3.81Å
157	V	94.7	Very high	90.4	Very high	9 Å²	9	26.7 Å²	26.7	6%	0.055	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	158.2	-176.2	-56.8	0	0	0	0	111.2	D110 A111 L113 V116 L129 T162 L163	D110-V157 PolarHBondContact N-O 3.37Å; A111-V157 HydrophobicContact CB-CG2 4.1Å; A111-V157 PolarHBondContact N-O 2.92Å; A111-V157 VanDerWaalsContact N-O 3.08Å; A111-V157 PolarHBondContact O-N 3.26Å; L113-V157 HydrophobicContact CD1-CG1 4.09Å; V116-V157 HydrophobicContact CG2-CB 4.47Å; V116-V157 HydrophobicContact CG2-CG1 4.4Å; V116-V157 HydrophobicContact CG2-CG2 3.32Å; L129-V157 HydrophobicContact CD2-CG1 3.98Å; V157-T162 CarbonylContact C-O 3.51Å; V157-T162 WeakPolarHBondContact CA-O 3.41Å; V157-L163 HydrophobicContact CG1-CB 4.22Å; V157-L163 HydrophobicContact CG1-CD1 4.13Å; V157-L163 HydrophobicContact CG1-CG 4.23Å
158	K	92.6	Very high	89.3	Confident	67 Å²	67	26.8 Å²	26.8	29%	0.291	16%	0.155	S	C	.	.			trans	-105.6	167.5	164.1	-68.9	-176.4	-176.5	179.1	0	111.2	M109 D110 D160 C161 T162	M109-K158 HydrophobicContact CE-CD 4.49Å; M109-K158 HydrophobicContact CE-CG 3.75Å; M109-K158 HydrophobicContact SD-CD 4.16Å; M109-K158 WeakPolarHBondContact SD-CE 3.42Å; M109-K158 HydrophobicContact SD-CG 3.77Å; D110-K158 WeakPolarHBondContact OD2-CA 3.34Å; K158-D160 WeakPolarHBondContact CB-OD1 3.26Å; K158-D160 PolarHBondContact O-N 2.83Å; K158-C161 PolarHBondContact O-N 2.77Å; K158-T162 WeakPolarHBondContact CB-OG1 3.3Å; K158-T162 PolarHBondContact N-O 3.36Å
159	S	88.7	Confident	88	Confident	111 Å²	111	26.1 Å²	26.1	78%	0.776	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.5	175.6	43	0	0	0	0	114.3	D110 C161	D110-S159 WeakPolarHBondContact OD2-CB 3.18Å; D110-S159 PolarHBondContact OD2-N 3.5Å; D110-S159 PolarHBondContact OD2-OG 3.03Å; S159-C161 PolarHBondContact O-N 2.93Å
160	D	90.7	Very high	86.7	Confident	99 Å²	99	27.4 Å²	27.4	53%	0.529	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	11	173.4	66.9	-2.2	0	0	0	113.8	K158 T162	K158-D160 WeakPolarHBondContact CB-OD1 3.26Å; K158-D160 PolarHBondContact O-N 2.83Å; D160-T162 PolarHBondContact O-N 3.08Å; D160-T162 VanDerWaalsContact OD1-CB 3.29Å; D160-T162 WeakPolarHBondContact OD1-CB 3.21Å; D160-T162 VanDerWaalsContact OD1-CG2 3.28Å; D160-T162 WeakPolarHBondContact OD1-CG2 3.15Å; D160-T162 PolarHBondContact OD1-N 3.02Å; D160-T162 PolarHBondContact OD1-OG1 3.19Å; D160-T162 WeakPolarHBondContact OD2-CG2 3.48Å
161	C	91.5	Very high	85	Confident	35 Å²	35	27.4 Å²	27.4	24%	0.236	16%	0.159	C	C	.	.	S	Bend	trans	63.8	16.5	-175.6	-60.5	0	0	0	0	114.8	Y128 Q132 K158 S159	Y128-C161 HydrophobicContact CD1-CB 4.19Å; Y128-C161 HydrophobicContact CE1-CB 4.39Å; Q132-C161 PolarHBondContact NE2-O 2.9Å; K158-C161 PolarHBondContact O-N 2.77Å; S159-C161 PolarHBondContact O-N 2.93Å
162	T	94.1	Very high	83.5	Confident	41 Å²	41	29 Å²	29	25%	0.252	17%	0.165	S	C	.	.			trans	-72.7	139.1	167.5	59.8	0	0	0	0	110.8	V157 K158 D160	V157-T162 CarbonylContact C-O 3.51Å; V157-T162 WeakPolarHBondContact CA-O 3.41Å; K158-T162 WeakPolarHBondContact CB-OG1 3.3Å; K158-T162 PolarHBondContact N-O 3.36Å; D160-T162 PolarHBondContact O-N 3.08Å; D160-T162 VanDerWaalsContact OD1-CB 3.29Å; D160-T162 WeakPolarHBondContact OD1-CB 3.21Å; D160-T162 VanDerWaalsContact OD1-CG2 3.28Å; D160-T162 WeakPolarHBondContact OD1-CG2 3.15Å; D160-T162 PolarHBondContact OD1-N 3.02Å; D160-T162 PolarHBondContact OD1-OG1 3.19Å; D160-T162 WeakPolarHBondContact OD2-CG2 3.48Å
163	L	95.8	Very high	81.5	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.6	-173.8	178.6	152.7	0	0	0	111.6	N82 L113 L129 Q132 I133 I155 V156 V157 I165	N82-L163 VanDerWaalsContact CA-O 3.31Å; N82-L163 WeakPolarHBondContact CA-O 3.27Å; N82-L163 PolarHBondContact ND2-O 2.61Å; L113-L163 HydrophobicContact CD1-CD1 4.5Å; L129-L163 HydrophobicContact CB-CD1 4.28Å; L129-L163 HydrophobicContact CD2-CB 4.18Å; L129-L163 HydrophobicContact CD2-CD1 3.83Å; Q132-L163 HydrophobicContact CB-CB 4.05Å; Q132-L163 HydrophobicContact CB-CD2 4.31Å; I133-L163 HydrophobicContact CD1-CD1 3.93Å; I133-L163 HydrophobicContact CG1-CD1 3.61Å; I133-L163 HydrophobicContact CG1-CD2 3.71Å; I133-L163 HydrophobicContact CG1-CG 4.35Å; I155-L163 HydrophobicContact CG2-CD1 3.43Å; I155-L163 VanDerWaalsContact CG2-CD1 3.43Å; I155-L163 HydrophobicContact CG2-CD2 3.82Å; I155-L163 HydrophobicContact CG2-CG 3.52Å; V156-L163 WeakPolarHBondContact O-CA 3.5Å; V157-L163 HydrophobicContact CG1-CB 4.22Å; V157-L163 HydrophobicContact CG1-CD1 4.13Å; V157-L163 HydrophobicContact CG1-CG 4.23Å; L163-I165 HydrophobicContact CD2-CG1 4.3Å
164	K	95.6	Very high	79.1	Confident	25 Å²	25	29.8 Å²	29.8	11%	0.109	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	137.8	173.5	-68.2	176.1	174.7	-100.6	0	112.6	K81 N82 I83 I84 E107 M109 V156	K81-K164 WeakPolarHBondContact O-CE 3.33Å; K81-K164 WeakPolarHBondContact O-CG 3.42Å; K81-K164 PolarHBondContact O-NZ 3.28Å; N82-K164 WeakPolarHBondContact O-CA 3.38Å; I83-K164 PolarHBondContact O-NZ 3.01Å; I84-K164 HydrophobicContact CD1-CB 4.48Å; I84-K164 HydrophobicContact CD1-CD 4.28Å; E107-K164 VanDerWaalsContact CD-NZ 3.33Å; E107-K164 HydrophobicContact CG-CD 4.19Å; E107-K164 WeakPolarHBondContact OE1-CD 3.34Å; E107-K164 WeakPolarHBondContact OE1-CE 3.37Å; E107-K164 IonicContact OE1-NZ 3.33Å; E107-K164 PolarHBondContact OE1-NZ 3.43Å; E107-K164 WeakPolarHBondContact OE2-CD 3.28Å; E107-K164 WeakPolarHBondContact OE2-CE 3.36Å; E107-K164 IonicContact OE2-NZ 3.54Å; E107-K164 PolarHBondContact OE2-NZ 3.1Å; M109-K164 HydrophobicContact CE-CB 4.13Å; M109-K164 HydrophobicContact CE-CD 4.05Å; M109-K164 HydrophobicContact CE-CG 4.06Å; M109-K164 HydrophobicContact SD-CD 3.92Å; V156-K164 HydrophobicContact CG2-CB 4.23Å; V156-K164 WeakPolarHBondContact CG2-O 3.46Å; V156-K164 PolarHBondContact N-O 2.91Å; V156-K164 PolarHBondContact O-N 3.35Å
165	I	94.9	Very high	76.3	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	136.1	175	-59	172.5	0	0	0	109.7	N82 I84 I137 L150 L163	N82-I165 PolarHBondContact O-N 3.07Å; I84-I165 WeakPolarHBondContact CB-O 3.48Å; I84-I165 WeakPolarHBondContact CG2-O 3.09Å; I84-I165 PolarHBondContact N-O 2.72Å; I137-I165 HydrophobicContact CG1-CD1 4.12Å; L150-I165 HydrophobicContact CD2-CD1 4.41Å; L150-I165 HydrophobicContact CD2-CG2 3.87Å; L163-I165 HydrophobicContact CD2-CG1 4.3Å
166	L	88.1	Confident	73.7	Confident	39 Å²	39	35.6 Å²	35.6	20%	0.204	21%	0.211	C	C	.	.			trans	-109.5	169.1	177.2	-56	-177.7	0	0	0	112.3	I84 H147 N154 V156	I84-L166 HydrophobicContact CB-CD2 3.59Å; I84-L166 HydrophobicContact CD1-CD2 3.85Å; I84-L166 HydrophobicContact CG1-CD2 3.63Å; I84-L166 HydrophobicContact CG2-CD2 3.75Å; H147-L166 PolarHBondContact NE2-O 3.02Å; H147-L166 VanDerWaalsContact NE2-O 3.08Å; N154-L166 WeakPolarHBondContact O-CB 3.26Å; N154-L166 PolarHBondContact O-N 3.17Å; V156-L166 HydrophobicContact CB-CD1 4.43Å; V156-L166 HydrophobicContact CG1-CD1 3.55Å; V156-L166 HydrophobicContact CG1-CG 4.21Å; V156-L166 HydrophobicContact CG2-CD1 4.05Å; V156-L166 HydrophobicContact CG2-CD2 3.71Å; V156-L166 HydrophobicContact CG2-CG 3.81Å
167	D	74.1	Confident	71.2	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.048	24%	0.235	C	C	.	.			trans	58.9	83.4	161.3	-176.4	20.1	0	0	0	116.1	Q35 R67 H147 N154 G169	Q35-D167 PolarHBondContact NE2-OD2 3.4Å; Q35-D167 PolarHBondContact OE1-OD1 2.95Å; Q35-D167 PolarHBondContact OE1-OD2 3.06Å; R67-D167 IonicContact CZ-OD1 3.51Å; R67-D167 VanDerWaalsContact NH2-CG 3.32Å; R67-D167 IonicContact NH2-OD1 2.88Å; R67-D167 PolarHBondContact NH2-OD1 2.92Å; R67-D167 IonicContact NH2-OD2 3.72Å; R67-D167 PolarHBondContact NH2-OD2 3.45Å; H147-D167 PolarHBondContact NE2-O 3.25Å; N154-D167 PolarHBondContact ND2-OD2 3.05Å; D167-G169 VanDerWaalsContact C-N 3.27Å; D167-G169 PolarHBondContact O-N 2.84Å; D167-G169 PolarHBondContact OD1-N 2.81Å; D167-G169 VanDerWaalsContact OD1-N 3.08Å
168	F	66.9	Low	68.4	Low	1 Å²	1	46.9 Å²	46.9	0%	0.004	26%	0.264	C	S	.	.			trans	-85.1	11.5	171.9	-54.3	-67.6	0	0	0	114.2	L74 L75 I83 L140 H147 L170 A171	L74-F168 HydrophobicContact CB-CB 4.02Å; L74-F168 HydrophobicContact CB-CD2 4.22Å; L74-F168 HydrophobicContact CB-CG 4.21Å; L74-F168 HydrophobicContact CD1-CB 3.5Å; L74-F168 HydrophobicContact CD1-CG 4.29Å; L74-F168 HydrophobicContact CG-CB 4.4Å; L75-F168 HydrophobicContact CD2-CD2 4.15Å; L75-F168 HydrophobicContact CD2-CE2 3.99Å; L75-F168 HydrophobicContact CG-CD2 4.33Å; I83-F168 HydrophobicContact CG2-CE2 3.87Å; I83-F168 HydrophobicContact CG2-CZ 3.48Å; I83-F168 VanDerWaalsContact CG2-CZ 3.48Å; L140-F168 HydrophobicContact CD1-CD1 4.45Å; L140-F168 HydrophobicContact CD1-CE1 3.69Å; L140-F168 HydrophobicContact CD2-CD1 4.13Å; L140-F168 HydrophobicContact CD2-CE1 3.53Å; L140-F168 HydrophobicContact CD2-CZ 4.13Å; L140-F168 HydrophobicContact CG-CE1 4.23Å; H147-F168 AromaticContact CD2-CE1 3.96Å; F168-L170 PolarHBondContact O-N 3.45Å; F168-L170 VanDerWaalsContact O-N 3.12Å; F168-A171 HydrophobicContact CB-CB 3.95Å; F168-A171 HydrophobicContact CD1-CB 4.41Å; F168-A171 WeakPolarHBondContact O-CB 3.31Å; F168-A171 PolarHBondContact O-N 3.47Å
169	G	55.7	Low	65.7	Low	1 Å²	1	49.1 Å²	49.1	1%	0.01	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.4	-172.5	0	0	0	0	0	114.5	R67 D167	R67-G169 WeakPolarHBondContact CG-O 3.23Å; D167-G169 VanDerWaalsContact C-N 3.27Å; D167-G169 PolarHBondContact O-N 2.84Å; D167-G169 PolarHBondContact OD1-N 2.81Å; D167-G169 VanDerWaalsContact OD1-N 3.08Å
170	L	59	Low	63.4	Low	33 Å²	33	46.4 Å²	46.4	17%	0.173	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	1.5	172	-64.7	179.6	0	0	0	113.2	R148 D149 F168	R148-L170 VanDerWaalsContact CZ-O 3.26Å; R148-L170 PolarHBondContact NE-O 3.17Å; R148-L170 PolarHBondContact NH2-O 2.86Å; D149-L170 HydrophobicContact CB-CB 4.07Å; D149-L170 HydrophobicContact CB-CD1 3.72Å; D149-L170 HydrophobicContact CB-CG 4.43Å; F168-L170 PolarHBondContact O-N 3.45Å; F168-L170 VanDerWaalsContact O-N 3.12Å
171	A	55.2	Low	60.7	Low	1 Å²	1	46.7 Å²	46.7	1%	0.008	26%	0.258	C	S	.	.			trans	-65.2	149.1	178.5	0	0	0	0	0	111.3	L74 I145 I146 F168	L74-A171 HydrophobicContact CD1-CB 3.93Å; I145-A171 HydrophobicContact CG2-CB 3.67Å; I146-A171 CarbonylContact O-C 3.59Å; I146-A171 WeakPolarHBondContact O-CA 3.22Å; F168-A171 HydrophobicContact CB-CB 3.95Å; F168-A171 HydrophobicContact CD1-CB 4.41Å; F168-A171 WeakPolarHBondContact O-CB 3.31Å; F168-A171 PolarHBondContact O-N 3.47Å
172	R	58.5	Low	57.9	Low	47 Å²	47	49.4 Å²	49.4	18%	0.177	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.5	-179.3	-67.2	-65.4	-179.5	-93.7	2.9	111.2	R70 I146 E342	R70-R172 VanDerWaalsContact CZ-CD 3.45Å; R70-R172 VanDerWaalsContact NH1-CZ 3.29Å; R70-R172 VanDerWaalsContact NH1-NE 3.15Å; I146-R172 PolarHBondContact N-O 2.74Å; I146-R172 PolarHBondContact O-N 2.79Å; R172-E342 WeakPolarHBondContact CD-OE1 3.5Å; R172-E342 IonicContact NE-OE1 2.73Å
173	T	51	Low	55.2	Low	32 Å²	32	56.7 Å²	56.7	20%	0.196	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	140.9	166.7	-40.3	0	0	0	0	109.7	G144 C175 T176	G144-T173 CarbonylContact O-C 3.55Å; G144-T173 WeakPolarHBondContact O-CA 3.34Å; T173-C175 PolarHBondContact O-N 2.86Å; T173-T176 PolarHBondContact O-N 2.89Å; T173-T176 PolarHBondContact O-OG1 3.36Å
174	A	37.1	Very low	52.6	Low	42 Å²	42	62.8 Å²	62.8	35%	0.347	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-16.3	-175.4	0	0	0	0	0	115.6	G144 I146	G144-A174 PolarHBondContact O-N 3.07Å; I146-A174 HydrophobicContact CD1-CB 3.91Å; I146-A174 HydrophobicContact CG1-CB 4.27Å
175	C	31.3	Very low	50.9	Low	117 Å²	117	64.5 Å²	64.5	79%	0.791	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	2.5	-176.1	-61.7	0	0	0	0	115.9	T173	T173-C175 PolarHBondContact O-N 2.86Å
176	T	39.6	Very low	49.5	Very low	18 Å²	18	67.3 Å²	67.3	11%	0.11	37%	0.366	C	S	.	.			trans	-103.8	119.7	-166.7	67.7	0	0	0	0	113.4	T173 Y200 E342	T173-T176 PolarHBondContact O-N 2.89Å; T173-T176 PolarHBondContact O-OG1 3.36Å; T176-Y200 PolarHBondContact O-OH 3.44Å; T176-E342 WeakPolarHBondContact CB-OE2 3.49Å; T176-E342 HydrophobicContact CG2-CG 3.83Å; T176-E342 VanDerWaalsContact CG2-OE2 3.26Å; T176-E342 WeakPolarHBondContact CG2-OE2 3Å
177	N	41.2	Very low	49.3	Very low	114 Å²	114	67.3 Å²	67.3	61%	0.61	36%	0.363	S	S	*	.			trans	-96.9	82.4	179.3	-74.1	-32.2	0	0	0	112.2	K199	N177-K199 WeakPolarHBondContact OD1-CG 3.28Å
178	F	36.3	Very low	50.2	Low	151 Å²	151	70.2 Å²	70.2	66%	0.662	37%	0.374	S	S	*	.			trans	-128.4	134	176.5	-151.6	-93.7	0	0	0	113.5
179	M	35.5	Very low	51.5	Low	114 Å²	114	71 Å²	71	56%	0.562	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-78.3	132.2	174.4	-66.9	-176	-72.8	0	0	110.3	M251	M179-M251 HydrophobicContact CE-CE 4.49Å; M179-M251 HydrophobicContact SD-CE 3.92Å; M179-M251 HydrophobicContact SD-SD 4.37Å
180	M	39.2	Very low	53.3	Low	54 Å²	54	71.6 Å²	71.6	27%	0.266	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-65.1	147	-179.3	-83.8	-166.7	166.6	0	0	112.7	R190 V194	M180-R190 PolarHBondContact SD-NH1 2.85Å; M180-R190 VanDerWaalsContact SD-NH1 3.38Å; M180-V194 HydrophobicContact CE-CG1 4.25Å; M180-V194 HydrophobicContact CG-CG1 4.47Å; M180-V194 HydrophobicContact SD-CG1 3.8Å
181	T	34.8	Very low	55	Low	106 Å²	106	70.1 Å²	70.1	65%	0.65	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-74.3	136.1	164.9	41.8	0	0	0	0	110.5	Y183	T181-Y183 PolarHBondContact O-N 2.81Å; T181-Y183 VanDerWaalsContact O-N 3.14Å
182	P	32.2	Very low	56.8	Low	92 Å²	92	70 Å²	70	60%	0.597	37%	0.371	S	S	*	.			trans	-79.3	96.2	178.6	30.4	-31.3	0	0	0	109.3
183	Y	37	Very low	58.4	Low	193 Å²	193	67.8 Å²	67.8	76%	0.757	36%	0.363	S	S	*	.			trans	-141.9	151.9	168.8	-115.4	-90.6	0	0	0	112.6	T181 V185	T181-Y183 PolarHBondContact O-N 2.81Å; T181-Y183 VanDerWaalsContact O-N 3.14Å; Y183-V185 PolarHBondContact O-N 2.83Å
184	V	41	Very low	60.3	Low	130 Å²	130	67.1 Å²	67.1	79%	0.788	36%	0.358	S	S	*	.	S	Bend	trans	-51.9	86.8	-169.1	-171.2	0	0	0	0	113.2
185	V	59.8	Low	62.7	Low	60 Å²	60	66.2 Å²	66.2	36%	0.364	35%	0.348	S	S	.	.	S	Bend	trans	-138.5	151.1	169.4	-176.5	0	0	0	0	107.5	Y183 R187	Y183-V185 PolarHBondContact O-N 2.83Å; V185-R187 PolarHBondContact O-N 3.08Å
186	T	66.6	Low	65.4	Low	60 Å²	60	61.6 Å²	61.6	37%	0.368	32%	0.315	S	S	.	.			trans	-49.7	111.5	173.9	-45.9	0	0	0	0	110.6	Y188 Y189	T186-Y188 HydrophobicContact CG2-CD2 3.48Å; T186-Y188 VanDerWaalsContact CG2-CD2 3.48Å; T186-Y188 HydrophobicContact CG2-CE2 3.97Å; T186-Y188 HydrophobicContact CG2-CG 4.08Å; T186-Y189 HydrophobicContact CG2-CD2 4.2Å; T186-Y189 HydrophobicContact CG2-CE2 3.85Å
187	R	83.9	Confident	67.6	Low	38 Å²	38	61.8 Å²	61.8	14%	0.143	32%	0.321	C	S	.	.			trans	-99.5	-5.6	-175.6	67	-177.4	66.4	84.2	-3.2	113.9	V185 Y189 R190 G225 T226 D227 Q231	V185-R187 PolarHBondContact O-N 3.08Å; R187-Y189 PolarHBondContact O-N 3.47Å; R187-Y189 VanDerWaalsContact O-N 3.12Å; R187-R190 WeakPolarHBondContact O-CB 3.42Å; R187-R190 PolarHBondContact O-N 3.39Å; R187-G225 PolarHBondContact NH1-O 3.42Å; R187-T226 PolarHBondContact NH1-O 3.18Å; R187-D227 WeakPolarHBondContact CD-O 3.45Å; R187-Q231 HydrophobicContact CG-CB 4.42Å; R187-Q231 HydrophobicContact CG-CG 4.27Å
188	Y	93.1	Very high	69.8	Low	71 Å²	71	57.6 Å²	57.6	28%	0.278	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.7	-168.1	-51.5	-36.3	0	0	0	114.7	T186 V221 F223 Q224 G225	T186-Y188 HydrophobicContact CG2-CD2 3.48Å; T186-Y188 VanDerWaalsContact CG2-CD2 3.48Å; T186-Y188 HydrophobicContact CG2-CE2 3.97Å; T186-Y188 HydrophobicContact CG2-CG 4.08Å; Y188-V221 VanDerWaalsContact CB-CG1 3.49Å; Y188-V221 HydrophobicContact CD2-CG1 3.76Å; Y188-V221 HydrophobicContact CD2-CG2 4.22Å; Y188-V221 HydrophobicContact CG-CG1 3.71Å; Y188-F223 WeakPolarHBondContact CB-O 2.95Å; Y188-F223 WeakPolarHBondContact CD1-O 3.49Å; Y188-Q224 HydrophobicContact CE1-CB 4.47Å; Y188-G225 WeakPolarHBondContact CE1-O 3.27Å
189	Y	94.4	Very high	72.1	Confident	17 Å²	17	57.9 Å²	57.9	7%	0.067	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	2.9	-178.2	-48.3	-86.5	0	0	0	113.1	L150 K151 P152 T186 R187 S208 C211 I212 E215	L150-Y189 VanDerWaalsContact O-CB 3.22Å; L150-Y189 WeakPolarHBondContact O-CB 3.21Å; K151-Y189 HydrophobicContact CB-CD2 3.43Å; K151-Y189 VanDerWaalsContact CB-CD2 3.43Å; K151-Y189 HydrophobicContact CB-CE2 3.8Å; K151-Y189 HydrophobicContact CB-CG 3.95Å; P152-Y189 VanDerWaalsContact CD-CE1 3.41Å; P152-Y189 WeakPolarHBondContact CD-OH 3.24Å; P152-Y189 HydrophobicContact CG-CE1 3.85Å; P152-Y189 WeakPolarHBondContact CG-OH 3.44Å; T186-Y189 HydrophobicContact CG2-CD2 4.2Å; T186-Y189 HydrophobicContact CG2-CE2 3.85Å; R187-Y189 PolarHBondContact O-N 3.47Å; R187-Y189 VanDerWaalsContact O-N 3.12Å; Y189-S208 WeakPolarHBondContact O-CA 3.26Å; Y189-S208 WeakPolarHBondContact O-CB 3.31Å; Y189-S208 PolarHBondContact O-OG 3.46Å; Y189-C211 HydrophobicContact CD1-CB 3.64Å; Y189-C211 HydrophobicContact CE1-CB 4.36Å; Y189-C211 HydrophobicContact CG-CB 4.48Å; Y189-I212 HydrophobicContact CD1-CG1 3.95Å; Y189-I212 HydrophobicContact CE1-CG1 4.16Å; Y189-E215 WeakPolarHBondContact CE1-OE2 3.48Å; Y189-E215 PolarHBondContact OH-OE1 3.37Å; Y189-E215 PolarHBondContact OH-OE2 3.02Å
190	R	92.3	Very high	74.5	Confident	14 Å²	14	53.8 Å²	53.8	5%	0.053	28%	0.277	C	S	.	.			trans	-78.8	136.1	-179.6	-66.4	-175.8	179.9	177.6	2.1	110.4	M180 R187 I195 W207	M180-R190 PolarHBondContact SD-NH1 2.85Å; M180-R190 VanDerWaalsContact SD-NH1 3.38Å; R187-R190 WeakPolarHBondContact O-CB 3.42Å; R187-R190 PolarHBondContact O-N 3.39Å; R190-I195 HydrophobicContact CB-CD1 4.34Å; R190-I195 HydrophobicContact CB-CG1 4.08Å; R190-I195 WeakPolarHBondContact O-CD1 3.41Å; R190-W207 PolarHBondContact O-NE1 3.43Å; R190-W207 VanDerWaalsContact O-NE1 3.08Å
191	A	94.3	Very high	76.9	Confident	1 Å²	1	58.5 Å²	58.5	1%	0.008	30%	0.296	C	S	.	.			trans	-67.4	153.6	178.4	0	0	0	0	0	112.8	E193 V194 I195 V204 W207	A191-E193 VanDerWaalsContact C-N 3.29Å; A191-E193 VanDerWaalsContact CB-CD 3.45Å; A191-E193 HydrophobicContact CB-CG 4.24Å; A191-E193 WeakPolarHBondContact CB-OE1 3.35Å; A191-E193 WeakPolarHBondContact CB-OE2 3.12Å; A191-E193 PolarHBondContact O-N 2.87Å; A191-V194 HydrophobicContact CB-CG2 4.37Å; A191-V194 WeakPolarHBondContact O-CB 3.49Å; A191-V194 PolarHBondContact O-N 3.39Å; A191-I195 PolarHBondContact O-N 3.01Å; A191-I195 VanDerWaalsContact O-N 3.08Å; A191-V204 HydrophobicContact CB-CG2 3.56Å; A191-W207 HydrophobicContact CB-CB 3.69Å; A191-W207 HydrophobicContact CB-CD2 4.39Å; A191-W207 HydrophobicContact CB-CG 3.69Å
192	P	94.2	Very high	79.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-49.7	-46.3	175.7	-34.3	41.2	0	0	0	114	V194 I195 L196 W207 W232 V235 I302	P192-V194 PolarHBondContact O-N 2.91Å; P192-I195 PolarHBondContact O-N 2.99Å; P192-I195 VanDerWaalsContact O-N 3.12Å; P192-L196 VanDerWaalsContact O-CB 3.31Å; P192-L196 WeakPolarHBondContact O-CB 3.44Å; P192-L196 VanDerWaalsContact O-CG 3.26Å; P192-L196 WeakPolarHBondContact O-CG 3.36Å; P192-L196 PolarHBondContact O-N 3.11Å; P192-W207 HydrophobicContact CG-CD2 4.44Å; P192-W207 HydrophobicContact CG-CE3 4.21Å; P192-W207 HydrophobicContact CG-CH2 3.78Å; P192-W207 HydrophobicContact CG-CZ2 4.03Å; P192-W207 HydrophobicContact CG-CZ3 3.88Å; P192-W232 HydrophobicContact CB-CZ3 3.9Å; P192-W232 HydrophobicContact CG-CZ3 4.39Å; P192-V235 HydrophobicContact CG-CG1 4.35Å; P192-I302 HydrophobicContact CB-CG2 4.11Å; P192-I302 HydrophobicContact CG-CB 4.5Å; P192-I302 HydrophobicContact CG-CG2 4.13Å
193	E	92.5	Very high	82.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-62.1	-29.7	179.8	60.5	-88.1	-156.3	0	0	112.7	A191 G197 M198 V204 R307	A191-E193 VanDerWaalsContact C-N 3.29Å; A191-E193 VanDerWaalsContact CB-CD 3.45Å; A191-E193 HydrophobicContact CB-CG 4.24Å; A191-E193 WeakPolarHBondContact CB-OE1 3.35Å; A191-E193 WeakPolarHBondContact CB-OE2 3.12Å; A191-E193 PolarHBondContact O-N 2.87Å; E193-G197 PolarHBondContact O-N 2.87Å; E193-M198 HydrophobicContact CB-CB 3.86Å; E193-M198 HydrophobicContact CB-CG 4.43Å; E193-M198 HydrophobicContact CB-SD 4.02Å; E193-M198 PolarHBondContact O-N 3Å; E193-V204 HydrophobicContact CG-CG2 4.3Å; E193-R307 IonicContact OE1-CZ 3.51Å; E193-R307 IonicContact OE1-NH1 3.3Å; E193-R307 PolarHBondContact OE1-NH1 3.45Å; E193-R307 IonicContact OE1-NH2 2.93Å; E193-R307 PolarHBondContact OE1-NH2 3.22Å; E193-R307 IonicContact OE2-CZ 2.79Å; E193-R307 IonicContact OE2-NH1 3.14Å; E193-R307 IonicContact OE2-NH2 3.26Å; E193-R307 PolarHBondContact OE2-NH2 3.24Å
194	V	89.2	Confident	85.2	Confident	17 Å²	17	45.1 Å²	45.1	10%	0.103	23%	0.226	C	C	.	.	H	α-helix	trans	-76	-41.8	174.5	179.7	0	0	0	0	110.9	M180 A191 P192 L196 G197 V204	M180-V194 HydrophobicContact CE-CG1 4.25Å; M180-V194 HydrophobicContact CG-CG1 4.47Å; M180-V194 HydrophobicContact SD-CG1 3.8Å; A191-V194 HydrophobicContact CB-CG2 4.37Å; A191-V194 WeakPolarHBondContact O-CB 3.49Å; A191-V194 PolarHBondContact O-N 3.39Å; P192-V194 PolarHBondContact O-N 2.91Å; V194-L196 VanDerWaalsContact C-N 3.35Å; V194-G197 PolarHBondContact O-N 3.27Å; V194-V204 HydrophobicContact CG2-CG2 3.39Å
195	I	88.4	Confident	87.8	Confident	24 Å²	24	38.9 Å²	38.9	12%	0.123	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-38.9	179.5	-64.1	161.8	0	0	0	110.9	R190 A191 P192 H228 Q231	R190-I195 HydrophobicContact CB-CD1 4.34Å; R190-I195 HydrophobicContact CB-CG1 4.08Å; R190-I195 WeakPolarHBondContact O-CD1 3.41Å; A191-I195 PolarHBondContact O-N 3.01Å; A191-I195 VanDerWaalsContact O-N 3.08Å; P192-I195 PolarHBondContact O-N 2.99Å; P192-I195 VanDerWaalsContact O-N 3.12Å; I195-H228 HydrophobicContact CG2-CB 4.37Å; I195-H228 WeakPolarHBondContact CG2-O 3.17Å; I195-Q231 HydrophobicContact CD1-CB 4.38Å; I195-Q231 HydrophobicContact CD1-CG 3.48Å; I195-Q231 VanDerWaalsContact CD1-CG 3.48Å; I195-Q231 HydrophobicContact CG1-CG 4.44Å
196	L	88.8	Confident	89.7	Confident	19 Å²	19	36 Å²	36	10%	0.099	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-1.1	-177.2	-61.4	175.2	0	0	0	113.5	P192 V194 M198 W232 F246 L250 V254 V258	P192-L196 VanDerWaalsContact O-CB 3.31Å; P192-L196 WeakPolarHBondContact O-CB 3.44Å; P192-L196 VanDerWaalsContact O-CG 3.26Å; P192-L196 WeakPolarHBondContact O-CG 3.36Å; P192-L196 PolarHBondContact O-N 3.11Å; V194-L196 VanDerWaalsContact C-N 3.35Å; L196-M198 HydrophobicContact CB-CG 4.21Å; L196-M198 HydrophobicContact CB-SD 4.45Å; L196-M198 HydrophobicContact CD1-SD 4.49Å; L196-M198 PolarHBondContact O-N 2.78Å; L196-W232 HydrophobicContact CD1-CD2 4.37Å; L196-W232 HydrophobicContact CD1-CE3 4Å; L196-W232 HydrophobicContact CD1-CH2 3.91Å; L196-W232 HydrophobicContact CD1-CZ2 4.27Å; L196-W232 HydrophobicContact CD1-CZ3 3.79Å; L196-W232 HydrophobicContact CD2-CD2 4.07Å; L196-W232 HydrophobicContact CD2-CE3 4.3Å; L196-W232 HydrophobicContact CD2-CG 4.29Å; L196-W232 HydrophobicContact CG-CE3 4.3Å; L196-F246 HydrophobicContact CD1-CE1 4.06Å; L196-F246 HydrophobicContact CD1-CZ 3.91Å; L196-L250 HydrophobicContact CB-CD2 4.09Å; L196-L250 HydrophobicContact CD1-CD2 3.81Å; L196-V254 HydrophobicContact CB-CG1 4.2Å; L196-V254 HydrophobicContact CD2-CG1 3.75Å; L196-V254 HydrophobicContact CG-CG1 4.49Å; L196-V258 HydrophobicContact CD2-CG2 4.33Å
197	G	84.9	Confident	91.2	Very high	23 Å²	23	33.2 Å²	33.2	24%	0.237	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.2	29.3	177.6	0	0	0	0	0	114.3	E193 V194	E193-G197 PolarHBondContact O-N 2.87Å; V194-G197 PolarHBondContact O-N 3.27Å
198	M	87.9	Confident	91.8	Very high	26 Å²	26	31.5 Å²	31.5	13%	0.128	15%	0.147	C	C	.	.			trans	-80	166.1	175.1	-58.8	171.2	75.6	0	0	111.2	E193 L196 F246 R249 L250	E193-M198 HydrophobicContact CB-CB 3.86Å; E193-M198 HydrophobicContact CB-CG 4.43Å; E193-M198 HydrophobicContact CB-SD 4.02Å; E193-M198 PolarHBondContact O-N 3Å; L196-M198 HydrophobicContact CB-CG 4.21Å; L196-M198 HydrophobicContact CB-SD 4.45Å; L196-M198 HydrophobicContact CD1-SD 4.49Å; L196-M198 PolarHBondContact O-N 2.78Å; M198-F246 HydrophobicContact CE-CD2 4.31Å; M198-F246 HydrophobicContact CE-CE2 3.84Å; M198-F246 HydrophobicContact CE-CZ 4.26Å; M198-F246 HydrophobicContact SD-CE2 3.8Å; M198-F246 HydrophobicContact SD-CZ 3.73Å; M198-R249 HydrophobicContact CE-CB 4.01Å; M198-L250 HydrophobicContact CE-CD2 4Å; M198-L250 HydrophobicContact CG-CD2 3.6Å; M198-L250 HydrophobicContact SD-CD2 3.34Å; M198-L250 WeakPolarHBondContact SD-CD2 3.19Å
199	K	84.9	Confident	92	Very high	157 Å²	157	28.1 Å²	28.1	68%	0.683	13%	0.134	S	C	*	.			trans	-67.1	141.4	163.1	-61.4	-173.4	179.8	177.3	0	109	N177	N177-K199 WeakPolarHBondContact OD1-CG 3.28Å
200	Y	85.8	Confident	92.2	Very high	28 Å²	28	27.3 Å²	27.3	11%	0.11	13%	0.131	C	C	.	.			trans	-130.5	163.1	-177.3	56.9	-97.7	0	0	0	110.6	I146 R148 T176 V204	I146-Y200 HydrophobicContact CD1-CD2 4.27Å; I146-Y200 HydrophobicContact CD1-CE2 4.21Å; R148-Y200 HydrophobicContact CG-CE2 4.42Å; R148-Y200 PolarHBondContact NH1-OH 3.28Å; T176-Y200 PolarHBondContact O-OH 3.44Å; Y200-V204 HydrophobicContact CD2-CG1 4.35Å
201	K	89.8	Confident	92.5	Very high	152 Å²	152	26.8 Å²	26.8	66%	0.661	13%	0.13	S	C	*	.			trans	-124.5	-176	175.6	-64.8	-176.9	-179.7	177.5	0	109.3	N203 V204	K201-N203 VanDerWaalsContact C-N 3.26Å; K201-N203 PolarHBondContact O-N 3.29Å; K201-V204 VanDerWaalsContact O-CB 3.28Å; K201-V204 WeakPolarHBondContact O-CB 3.31Å; K201-V204 WeakPolarHBondContact O-CG1 3.39Å; K201-V204 PolarHBondContact O-N 3.33Å; K201-V204 VanDerWaalsContact O-N 3.08Å
202	E	89.6	Confident	92.6	Very high	84 Å²	84	26.8 Å²	26.8	39%	0.393	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-40.4	177.1	-76.2	159.9	-175	0	0	114	H141 I146 V204 D205	H141-E202 HydrophobicContact CB-CG 4.01Å; H141-E202 VanDerWaalsContact CE1-C 3.48Å; H141-E202 PolarHBondContact CE1-O 2.83Å; H141-E202 WeakPolarHBondContact ND1-CB 3.45Å; H141-E202 PolarHBondContact NE2-O 3.33Å; I146-E202 HydrophobicContact CD1-CG 4.29Å; I146-E202 HydrophobicContact CG1-CG 4.11Å; E202-V204 PolarHBondContact O-N 2.96Å; E202-D205 PolarHBondContact O-N 2.84Å; E202-D205 VanDerWaalsContact O-N 3.09Å
203	N	93.5	Very high	92.8	Very high	24 Å²	24	26.8 Å²	26.8	13%	0.128	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	5.2	179.6	72.8	-19.3	0	0	0	114.9	K201 D205 I206 P304 R307	K201-N203 VanDerWaalsContact C-N 3.26Å; K201-N203 PolarHBondContact O-N 3.29Å; N203-D205 PolarHBondContact O-N 3.37Å; N203-I206 HydrophobicContact CB-CG1 4.37Å; N203-I206 WeakPolarHBondContact O-CB 2.81Å; N203-I206 PolarHBondContact O-N 2.69Å; N203-P304 PolarHBondContact ND2-O 3.48Å; N203-R307 PolarHBondContact ND2-O 3.46Å; N203-R307 WeakPolarHBondContact O-CD 3.49Å; N203-R307 PolarHBondContact O-NH1 3.01Å
204	V	94.8	Very high	93	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-60.1	-35.9	162.6	73.7	0	0	0	0	111.3	I146 R148 A191 E193 V194 Y200 K201 E202 I206 W207	I146-V204 HydrophobicContact CG2-CG1 3.33Å; R148-V204 HydrophobicContact CG-CG1 4.36Å; A191-V204 HydrophobicContact CB-CG2 3.56Å; E193-V204 HydrophobicContact CG-CG2 4.3Å; V194-V204 HydrophobicContact CG2-CG2 3.39Å; Y200-V204 HydrophobicContact CD2-CG1 4.35Å; K201-V204 VanDerWaalsContact O-CB 3.28Å; K201-V204 WeakPolarHBondContact O-CB 3.31Å; K201-V204 WeakPolarHBondContact O-CG1 3.39Å; K201-V204 PolarHBondContact O-N 3.33Å; K201-V204 VanDerWaalsContact O-N 3.08Å; E202-V204 PolarHBondContact O-N 2.96Å; V204-I206 VanDerWaalsContact C-N 3.3Å; V204-I206 PolarHBondContact O-N 2.93Å; V204-W207 WeakPolarHBondContact O-CB 3.41Å; V204-W207 PolarHBondContact O-N 3.21Å
205	D	96.1	Very high	93.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-71.4	-28	-180	-71.3	-32.3	0	0	0	111.1	I137 H141 I146 H147 R148 L150 E202 N203 W207 S208 V209	I137-D205 HydrophobicContact CD1-CB 4.34Å; I137-D205 HydrophobicContact CG2-CB 4.04Å; H141-D205 IonicContact CD2-OD2 2.73Å; H141-D205 IonicContact CE1-OD2 2.6Å; H141-D205 IonicContact NE2-OD2 3.24Å; H141-D205 PolarHBondContact NE2-OD2 3.23Å; I146-D205 WeakPolarHBondContact CG2-OD2 3.12Å; H147-D205 PolarHBondContact N-OD2 3.48Å; R148-D205 PolarHBondContact N-OD1 3.08Å; L150-D205 HydrophobicContact CD1-CB 3.83Å; E202-D205 PolarHBondContact O-N 2.84Å; E202-D205 VanDerWaalsContact O-N 3.09Å; N203-D205 PolarHBondContact O-N 3.37Å; D205-W207 VanDerWaalsContact C-N 3.3Å; D205-W207 PolarHBondContact O-N 3.39Å; D205-S208 WeakPolarHBondContact O-CB 3.48Å; D205-S208 PolarHBondContact O-N 2.92Å; D205-S208 VanDerWaalsContact O-N 3.13Å; D205-V209 WeakPolarHBondContact O-CG2 3.26Å; D205-V209 PolarHBondContact O-N 3.38Å
206	I	98.3	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-35.9	175.1	-70.3	-62.6	0	0	0	112	L134 N203 V204 S208 V209 G210 M299 R307 I308 V310 A313	L134-I206 HydrophobicContact CD2-CD1 3.57Å; N203-I206 HydrophobicContact CB-CG1 4.37Å; N203-I206 WeakPolarHBondContact O-CB 2.81Å; N203-I206 PolarHBondContact O-N 2.69Å; V204-I206 VanDerWaalsContact C-N 3.3Å; V204-I206 PolarHBondContact O-N 2.93Å; I206-S208 VanDerWaalsContact C-N 3.32Å; I206-S208 PolarHBondContact O-N 3.48Å; I206-V209 PolarHBondContact O-N 3.2Å; I206-G210 PolarHBondContact O-N 2.82Å; I206-M299 HydrophobicContact CG2-CB 3.97Å; I206-M299 HydrophobicContact CG2-CG 3.81Å; I206-R307 HydrophobicContact CG2-CG 3.98Å; I206-I308 HydrophobicContact CG2-CG2 3.77Å; I206-V310 HydrophobicContact CD1-CB 4.34Å; I206-V310 HydrophobicContact CD1-CG2 3.75Å; I206-V310 HydrophobicContact CG1-CG2 3.87Å; I206-A313 HydrophobicContact CD1-CB 4.36Å
207	W	98.1	Very high	93.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-45.8	173.3	174.1	-84.4	0	0	0	111.1	R190 A191 P192 V204 D205 V209 G210 C211 F223 V235 L239 L300	R190-W207 PolarHBondContact O-NE1 3.43Å; R190-W207 VanDerWaalsContact O-NE1 3.08Å; A191-W207 HydrophobicContact CB-CB 3.69Å; A191-W207 HydrophobicContact CB-CD2 4.39Å; A191-W207 HydrophobicContact CB-CG 3.69Å; P192-W207 HydrophobicContact CG-CD2 4.44Å; P192-W207 HydrophobicContact CG-CE3 4.21Å; P192-W207 HydrophobicContact CG-CH2 3.78Å; P192-W207 HydrophobicContact CG-CZ2 4.03Å; P192-W207 HydrophobicContact CG-CZ3 3.88Å; V204-W207 WeakPolarHBondContact O-CB 3.41Å; V204-W207 PolarHBondContact O-N 3.21Å; D205-W207 VanDerWaalsContact C-N 3.3Å; D205-W207 PolarHBondContact O-N 3.39Å; W207-V209 VanDerWaalsContact C-N 3.31Å; W207-V209 PolarHBondContact O-N 3.21Å; W207-G210 PolarHBondContact O-N 3.42Å; W207-G210 VanDerWaalsContact O-N 3.15Å; W207-C211 PolarHBondContact NE1-SG 2.93Å; W207-C211 VanDerWaalsContact NE1-SG 3.41Å; W207-C211 PolarHBondContact O-N 3.43Å; W207-F223 HydrophobicContact CH2-CE2 4.13Å; W207-F223 HydrophobicContact CH2-CZ 4.21Å; W207-F223 HydrophobicContact CZ2-CD2 4.06Å; W207-F223 AromaticContact CZ2-CE2 3.64Å; W207-F223 HydrophobicContact CZ2-CE2 3.64Å; W207-F223 HydrophobicContact CZ2-CZ 4.14Å; W207-V235 HydrophobicContact CH2-CG1 3.8Å; W207-V235 HydrophobicContact CH2-CG2 4.29Å; W207-V235 HydrophobicContact CZ2-CG1 4.26Å; W207-V235 HydrophobicContact CZ2-CG2 3.92Å; W207-L239 HydrophobicContact CH2-CD1 3.51Å; W207-L239 HydrophobicContact CZ3-CD1 3.8Å; W207-L300 HydrophobicContact CE3-CD2 4.5Å
208	S	97.1	Very high	94.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.014	13%	0.129	C	C	.	.	H	α-helix	trans	-61.3	-41.2	177.9	-55.8	0	0	0	0	111.6	Y189 D205 I206 C211 I212	Y189-S208 WeakPolarHBondContact O-CA 3.26Å; Y189-S208 WeakPolarHBondContact O-CB 3.31Å; Y189-S208 PolarHBondContact O-OG 3.46Å; D205-S208 WeakPolarHBondContact O-CB 3.48Å; D205-S208 PolarHBondContact O-N 2.92Å; D205-S208 VanDerWaalsContact O-N 3.13Å; I206-S208 VanDerWaalsContact C-N 3.32Å; I206-S208 PolarHBondContact O-N 3.48Å; S208-C211 PolarHBondContact O-N 3.29Å; S208-I212 WeakPolarHBondContact O-CD1 3.43Å; S208-I212 VanDerWaalsContact O-CG1 3.25Å; S208-I212 WeakPolarHBondContact O-CG1 3.38Å; S208-I212 PolarHBondContact O-N 3.39Å
209	V	98.2	Very high	94.3	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-43.1	173.3	-179.8	0	0	0	0	111.3	L130 I133 I137 L150 D205 I206 W207 C211 I212 M213 M299	L130-V209 HydrophobicContact CD2-CG1 3.86Å; I133-V209 HydrophobicContact CG2-CG1 4.47Å; I133-V209 HydrophobicContact CG2-CG2 3.64Å; I137-V209 HydrophobicContact CD1-CG2 3.39Å; L150-V209 HydrophobicContact CD1-CG2 4.34Å; D205-V209 WeakPolarHBondContact O-CG2 3.26Å; D205-V209 PolarHBondContact O-N 3.38Å; I206-V209 PolarHBondContact O-N 3.2Å; W207-V209 VanDerWaalsContact C-N 3.31Å; W207-V209 PolarHBondContact O-N 3.21Å; V209-C211 VanDerWaalsContact C-N 3.35Å; V209-C211 PolarHBondContact O-N 2.69Å; V209-I212 PolarHBondContact O-N 3Å; V209-M213 WeakPolarHBondContact O-CB 3.49Å; V209-M213 PolarHBondContact O-N 3.12Å; V209-M299 HydrophobicContact CB-SD 4.4Å; V209-M299 HydrophobicContact CG1-CE 3.96Å; V209-M299 HydrophobicContact CG1-SD 3.95Å
210	G	98.3	Very high	94.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.2	-42	175	0	0	0	0	0	112.8	I206 W207 M213 G214	I206-G210 PolarHBondContact O-N 2.82Å; W207-G210 PolarHBondContact O-N 3.42Å; W207-G210 VanDerWaalsContact O-N 3.15Å; G210-M213 PolarHBondContact O-N 2.88Å; G210-G214 PolarHBondContact O-N 3.01Å
211	C	98	Very high	95.1	Very high	4 Å²	4	24 Å²	24	3%	0.027	13%	0.128	C	C	.	.	H	α-helix	trans	-63.4	-42.9	174.4	-71.4	0	0	0	0	112.1	Y189 W207 S208 V209 E215	Y189-C211 HydrophobicContact CD1-CB 3.64Å; Y189-C211 HydrophobicContact CE1-CB 4.36Å; Y189-C211 HydrophobicContact CG-CB 4.48Å; W207-C211 PolarHBondContact NE1-SG 2.93Å; W207-C211 VanDerWaalsContact NE1-SG 3.41Å; W207-C211 PolarHBondContact O-N 3.43Å; S208-C211 PolarHBondContact O-N 3.29Å; V209-C211 VanDerWaalsContact C-N 3.35Å; V209-C211 PolarHBondContact O-N 2.69Å; C211-E215 WeakPolarHBondContact O-CB 3.39Å; C211-E215 PolarHBondContact O-N 3.45Å
212	I	97.1	Very high	95.3	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63	-47.8	177	-69.6	162.1	0	0	0	110.3	L113 P152 I155 Y189 S208 V209 G214 E215 M216	L113-I212 HydrophobicContact CD2-CG2 3.56Å; P152-I212 HydrophobicContact CG-CG1 4.1Å; I155-I212 HydrophobicContact CD1-CD1 3.72Å; Y189-I212 HydrophobicContact CD1-CG1 3.95Å; Y189-I212 HydrophobicContact CE1-CG1 4.16Å; S208-I212 WeakPolarHBondContact O-CD1 3.43Å; S208-I212 VanDerWaalsContact O-CG1 3.25Å; S208-I212 WeakPolarHBondContact O-CG1 3.38Å; S208-I212 PolarHBondContact O-N 3.39Å; V209-I212 PolarHBondContact O-N 3Å; I212-G214 PolarHBondContact O-N 2.9Å; I212-E215 PolarHBondContact O-N 3.08Å; I212-M216 HydrophobicContact CG2-CE 3.77Å; I212-M216 WeakPolarHBondContact O-CG 3.23Å; I212-M216 PolarHBondContact O-N 3.28Å
213	M	97.6	Very high	95.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.4	-46.5	178.3	-178.8	175.7	179.4	0	0	111.4	L130 V209 G210 E215 M216 V217 A292 L295 L296 Y318	L130-M213 HydrophobicContact CD1-CB 4.28Å; L130-M213 HydrophobicContact CD1-CE 4Å; L130-M213 HydrophobicContact CD1-CG 3.75Å; L130-M213 HydrophobicContact CD1-SD 3.57Å; L130-M213 VanDerWaalsContact CD1-SD 3.57Å; L130-M213 HydrophobicContact CD2-CB 3.87Å; L130-M213 HydrophobicContact CD2-CG 4.28Å; V209-M213 WeakPolarHBondContact O-CB 3.49Å; V209-M213 PolarHBondContact O-N 3.12Å; G210-M213 PolarHBondContact O-N 2.88Å; M213-E215 VanDerWaalsContact C-N 3.27Å; M213-E215 PolarHBondContact O-N 3.39Å; M213-M216 WeakPolarHBondContact O-CB 3.49Å; M213-M216 PolarHBondContact O-N 3.21Å; M213-V217 WeakPolarHBondContact O-CG2 3.34Å; M213-V217 PolarHBondContact O-N 2.81Å; M213-V217 VanDerWaalsContact O-N 3.11Å; M213-A292 HydrophobicContact CE-CB 3.74Å; M213-A292 VanDerWaalsContact CE-O 3.24Å; M213-A292 WeakPolarHBondContact CE-O 3.33Å; M213-L295 HydrophobicContact CE-CB 4.4Å; M213-L295 HydrophobicContact CE-CD2 4.32Å; M213-L295 HydrophobicContact SD-CD2 4.08Å; M213-L295 HydrophobicContact SD-CG 4.29Å; M213-L296 HydrophobicContact CB-CD2 3.87Å; M213-L296 HydrophobicContact CE-CD1 4.22Å; M213-L296 HydrophobicContact CE-CG 3.91Å; M213-L296 HydrophobicContact CG-CD1 4.4Å; M213-L296 HydrophobicContact CG-CD2 3.71Å; M213-L296 HydrophobicContact CG-CG 3.98Å; M213-L296 HydrophobicContact SD-CD2 3.92Å; M213-L296 HydrophobicContact SD-CG 3.74Å; M213-Y318 HydrophobicContact CE-CD1 4.06Å; M213-Y318 HydrophobicContact CE-CE1 3.76Å
214	G	96.7	Very high	95.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-70	-27.6	-179.9	0	0	0	0	0	112.4	G210 I212 V217 K218 F273	G210-G214 PolarHBondContact O-N 3.01Å; I212-G214 PolarHBondContact O-N 2.9Å; G214-V217 PolarHBondContact O-N 3.01Å; G214-K218 WeakPolarHBondContact O-CB 3.4Å; G214-K218 WeakPolarHBondContact O-CG 3.35Å; G214-K218 PolarHBondContact O-N 2.97Å; G214-F273 VanDerWaalsContact CA-CE1 3.47Å
215	E	95.8	Very high	95.4	Very high	13 Å²	13	17.4 Å²	17.4	6%	0.061	10%	0.099	C	C	.	.	H	α-helix	trans	-70.7	-39	170	-177.6	176.2	170.3	0	0	112.2	I117 Y189 C211 I212 M213 V217 K218 G219	I117-E215 HydrophobicContact CD1-CG 4.05Å; I117-E215 HydrophobicContact CG2-CG 3.71Å; Y189-E215 WeakPolarHBondContact CE1-OE2 3.48Å; Y189-E215 PolarHBondContact OH-OE1 3.37Å; Y189-E215 PolarHBondContact OH-OE2 3.02Å; C211-E215 WeakPolarHBondContact O-CB 3.39Å; C211-E215 PolarHBondContact O-N 3.45Å; I212-E215 PolarHBondContact O-N 3.08Å; M213-E215 VanDerWaalsContact C-N 3.27Å; M213-E215 PolarHBondContact O-N 3.39Å; E215-V217 PolarHBondContact O-N 3.33Å; E215-K218 PolarHBondContact O-N 3.23Å; E215-G219 VanDerWaalsContact O-CA 3.3Å; E215-G219 WeakPolarHBondContact O-CA 3.35Å; E215-G219 PolarHBondContact O-N 2.9Å
216	M	94.6	Very high	95	Very high	13 Å²	13	22.5 Å²	22.5	6%	0.064	13%	0.13	C	C	.	.	H	α-helix	trans	-57.9	-36.6	171.7	-69.7	177	178.3	0	0	112	L113 I117 L121 M126 L129 I212 M213	L113-M216 HydrophobicContact CD1-CE 3.67Å; L113-M216 HydrophobicContact CD2-CE 3.63Å; L113-M216 HydrophobicContact CG-CE 3.93Å; I117-M216 HydrophobicContact CG1-CG 3.78Å; L121-M216 HydrophobicContact CD1-CG 4.38Å; L121-M216 HydrophobicContact CD1-SD 4.42Å; M126-M216 HydrophobicContact CE-CB 4.45Å; M126-M216 HydrophobicContact CG-SD 4.02Å; L129-M216 HydrophobicContact CB-CE 4.46Å; L129-M216 HydrophobicContact CD1-CE 4.43Å; I212-M216 HydrophobicContact CG2-CE 3.77Å; I212-M216 WeakPolarHBondContact O-CG 3.23Å; I212-M216 PolarHBondContact O-N 3.28Å; M213-M216 WeakPolarHBondContact O-CB 3.49Å; M213-M216 PolarHBondContact O-N 3.21Å
217	V	94.2	Very high	94.5	Very high	12 Å²	12	25.9 Å²	25.9	7%	0.073	15%	0.148	C	C	.	.	H	α-helix	trans	-77.5	-42	178.8	174.2	0	0	0	0	111.7	M126 M213 G214 E215 F273 A277 F278 L296	M126-V217 HydrophobicContact CE-CG2 3.98Å; M126-V217 HydrophobicContact SD-CG2 3.9Å; M213-V217 WeakPolarHBondContact O-CG2 3.34Å; M213-V217 PolarHBondContact O-N 2.81Å; M213-V217 VanDerWaalsContact O-N 3.11Å; G214-V217 PolarHBondContact O-N 3.01Å; E215-V217 PolarHBondContact O-N 3.33Å; V217-F273 HydrophobicContact CB-CD1 4.31Å; V217-F273 HydrophobicContact CG1-CD1 3.94Å; V217-A277 HydrophobicContact CG1-CB 3.89Å; V217-F278 HydrophobicContact CB-CE1 4.27Å; V217-F278 HydrophobicContact CG1-CD1 3.98Å; V217-F278 HydrophobicContact CG1-CD2 4.25Å; V217-F278 HydrophobicContact CG1-CE1 3.68Å; V217-F278 HydrophobicContact CG1-CE2 3.97Å; V217-F278 HydrophobicContact CG1-CG 4.27Å; V217-F278 HydrophobicContact CG1-CZ 3.68Å; V217-F278 HydrophobicContact CG2-CD1 3.98Å; V217-F278 HydrophobicContact CG2-CE1 3.49Å; V217-F278 VanDerWaalsContact CG2-CE1 3.49Å; V217-F278 HydrophobicContact CG2-CZ 4.15Å; V217-L296 HydrophobicContact CG2-CD1 4.46Å
218	K	92	Very high	93.9	Very high	84 Å²	84	28.4 Å²	28.4	37%	0.365	16%	0.16	S	C	.	.	H	α-helix	trans	-89.1	-11	-175.1	-68.6	-174	67.1	155	0	114.4	G214 E215 S220 F273	G214-K218 WeakPolarHBondContact O-CB 3.4Å; G214-K218 WeakPolarHBondContact O-CG 3.35Å; G214-K218 PolarHBondContact O-N 2.97Å; E215-K218 PolarHBondContact O-N 3.23Å; K218-S220 PolarHBondContact O-N 2.83Å; K218-S220 VanDerWaalsContact O-N 3.1Å; K218-S220 PolarHBondContact O-OG 3.22Å; K218-F273 HydrophobicContact CD-CD1 3.98Å; K218-F273 HydrophobicContact CD-CE1 3.69Å; K218-F273 HydrophobicContact CG-CD1 3.85Å; K218-F273 HydrophobicContact CG-CE1 3.84Å
219	G	90.8	Very high	93.4	Very high	34 Å²	34	32.6 Å²	32.6	35%	0.351	18%	0.181	S	C	.	.	S	Bend	trans	61.9	10.3	-169.8	0	0	0	0	0	114.4	E215	E215-G219 VanDerWaalsContact O-CA 3.3Å; E215-G219 WeakPolarHBondContact O-CA 3.35Å; E215-G219 PolarHBondContact O-N 2.9Å
220	S	91.8	Very high	93.1	Very high	54 Å²	54	34.1 Å²	34.1	38%	0.378	19%	0.189	S	C	.	.	S	Bend	trans	-152.6	147.8	-176	57.7	0	0	0	0	111.8	K218 I222	K218-S220 PolarHBondContact O-N 2.83Å; K218-S220 VanDerWaalsContact O-N 3.1Å; K218-S220 PolarHBondContact O-OG 3.22Å; S220-I222 PolarHBondContact O-N 2.91Å
221	V	94.1	Very high	92.9	Very high	27 Å²	27	34.1 Å²	34.1	16%	0.164	19%	0.189	C	C	.	.			trans	-58.7	130.7	-179.5	177.3	0	0	0	0	110.7	Y188 Q224	Y188-V221 VanDerWaalsContact CB-CG1 3.49Å; Y188-V221 HydrophobicContact CD2-CG1 3.76Å; Y188-V221 HydrophobicContact CD2-CG2 4.22Å; Y188-V221 HydrophobicContact CG-CG1 3.71Å; V221-Q224 HydrophobicContact CB-CG 3.59Å; V221-Q224 HydrophobicContact CG1-CG 3.55Å; V221-Q224 PolarHBondContact O-NE2 3.33Å
222	I	95	Very high	92.7	Very high	17 Å²	17	34 Å²	34	9%	0.087	19%	0.188	C	C	.	.	S	Bend	trans	-72.6	-46.5	-175.6	-48	169.6	0	0	0	112	S220 I238 F273 L300	S220-I222 PolarHBondContact O-N 2.91Å; I222-I238 HydrophobicContact CG2-CD1 4.18Å; I222-I238 WeakPolarHBondContact O-CD1 3.47Å; I222-F273 HydrophobicContact CD1-CE1 4.45Å; I222-F273 HydrophobicContact CD1-CZ 4.07Å; I222-L300 HydrophobicContact CD1-CD1 3.97Å
223	F	95.5	Very high	92.5	Very high	1 Å²	1	35 Å²	35	0%	0.004	19%	0.194	C	C	.	.			trans	-117.2	85.8	-173.4	-50	-67.2	0	0	0	110.6	Y188 W207 G225 Q231 K234 V235 I238 L239 L300	Y188-F223 WeakPolarHBondContact CB-O 2.95Å; Y188-F223 WeakPolarHBondContact CD1-O 3.49Å; W207-F223 HydrophobicContact CH2-CE2 4.13Å; W207-F223 HydrophobicContact CH2-CZ 4.21Å; W207-F223 HydrophobicContact CZ2-CD2 4.06Å; W207-F223 AromaticContact CZ2-CE2 3.64Å; W207-F223 HydrophobicContact CZ2-CE2 3.64Å; W207-F223 HydrophobicContact CZ2-CZ 4.14Å; F223-G225 PolarHBondContact O-N 3.26Å; F223-Q231 PolarHBondContact O-NE2 3.35Å; F223-Q231 PolarHBondContact O-OE1 2.94Å; F223-Q231 VanDerWaalsContact O-OE1 3.12Å; F223-K234 HydrophobicContact CB-CB 4.46Å; F223-V235 HydrophobicContact CB-CG2 4.34Å; F223-V235 HydrophobicContact CD1-CB 4.45Å; F223-V235 HydrophobicContact CD1-CG2 3.86Å; F223-V235 HydrophobicContact CD2-CG2 4.4Å; F223-V235 HydrophobicContact CE1-CG2 4.24Å; F223-V235 HydrophobicContact CG-CG2 3.96Å; F223-I238 HydrophobicContact CD1-CD1 3.91Å; F223-I238 HydrophobicContact CE1-CB 4.05Å; F223-I238 HydrophobicContact CE1-CD1 3.95Å; F223-I238 HydrophobicContact CE1-CG2 4.12Å; F223-L239 HydrophobicContact CE1-CD1 4.47Å; F223-L239 HydrophobicContact CE1-CG 4.31Å; F223-L239 HydrophobicContact CZ-CD1 3.99Å; F223-L239 HydrophobicContact CZ-CG 4.18Å; F223-L300 HydrophobicContact CE2-CD2 4.07Å
224	Q	93.4	Very high	92.4	Very high	105 Å²	105	38.3 Å²	38.3	49%	0.491	21%	0.208	S	C	.	.			trans	-94.2	76.2	-176.4	-64.7	-179.2	34.1	0	0	112.1	Y188 V221	Y188-Q224 HydrophobicContact CE1-CB 4.47Å; V221-Q224 HydrophobicContact CB-CG 3.59Å; V221-Q224 HydrophobicContact CG1-CG 3.55Å; V221-Q224 PolarHBondContact O-NE2 3.33Å
225	G	91	Very high	92.4	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.			trans	-87.6	129	177.3	0	0	0	0	0	114.2	R187 Y188 F223 D227 Q231	R187-G225 PolarHBondContact NH1-O 3.42Å; Y188-G225 WeakPolarHBondContact CE1-O 3.27Å; F223-G225 PolarHBondContact O-N 3.26Å; G225-D227 VanDerWaalsContact C-N 3.31Å; G225-D227 PolarHBondContact O-N 2.91Å; G225-Q231 VanDerWaalsContact CA-OE1 3.22Å
226	T	88.3	Confident	92.4	Very high	106 Å²	106	37.8 Å²	37.8	65%	0.65	21%	0.205	S	C	*	.	S	Bend	trans	-66.7	-30.3	177.1	54.1	0	0	0	0	113.3	R187 D230	R187-T226 PolarHBondContact NH1-O 3.18Å; T226-D230 WeakPolarHBondContact CB-OD2 3.42Å; T226-D230 PolarHBondContact N-OD2 3.29Å; T226-D230 WeakPolarHBondContact OG1-CB 3.34Å; T226-D230 PolarHBondContact OG1-OD2 3.36Å
227	D	86.6	Confident	92.4	Very high	72 Å²	72	40.6 Å²	40.6	39%	0.385	22%	0.219	S	C	.	.	S	Bend	trans	-144.8	-172.1	172.7	65.3	35.9	0	0	0	111.7	R187 G225 I229 D230 Q231	R187-D227 WeakPolarHBondContact CD-O 3.45Å; G225-D227 VanDerWaalsContact C-N 3.31Å; G225-D227 PolarHBondContact O-N 2.91Å; D227-I229 VanDerWaalsContact C-N 3.33Å; D227-I229 PolarHBondContact O-N 2.88Å; D227-I229 WeakPolarHBondContact OD1-CA 3.34Å; D227-I229 WeakPolarHBondContact OD1-CB 3.42Å; D227-I229 PolarHBondContact OD1-N 3.37Å; D227-D230 WeakPolarHBondContact OD1-CB 3.32Å; D227-D230 PolarHBondContact OD1-N 3Å; D227-Q231 WeakPolarHBondContact O-CB 3.4Å; D227-Q231 PolarHBondContact O-N 3.39Å
228	H	85	Confident	92.5	Very high	53 Å²	53	41.5 Å²	41.5	25%	0.245	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-34.2	-179.7	-69.6	-71.9	0	0	0	113.6	I195 W232	I195-H228 HydrophobicContact CG2-CB 4.37Å; I195-H228 WeakPolarHBondContact CG2-O 3.17Å; H228-W232 PolarHBondContact O-N 3.43Å
229	I	87.9	Confident	92.8	Very high	89 Å²	89	39.1 Å²	39.1	46%	0.456	21%	0.214	S	C	.	.	H	α-helix	trans	-72.8	-48.3	-179.9	-81.2	165.4	0	0	0	109.4	D227 Q231 W232 N233 Y257	D227-I229 VanDerWaalsContact C-N 3.33Å; D227-I229 PolarHBondContact O-N 2.88Å; D227-I229 WeakPolarHBondContact OD1-CA 3.34Å; D227-I229 WeakPolarHBondContact OD1-CB 3.42Å; D227-I229 PolarHBondContact OD1-N 3.37Å; I229-Q231 VanDerWaalsContact C-N 3.34Å; I229-W232 PolarHBondContact O-N 3.4Å; I229-N233 VanDerWaalsContact O-CG 3.29Å; I229-N233 PolarHBondContact O-N 2.66Å; I229-N233 PolarHBondContact O-ND2 3.14Å; I229-Y257 WeakPolarHBondContact CG2-OH 3.33Å
230	D	91.4	Very high	93	Very high	32 Å²	32	37.7 Å²	37.7	17%	0.171	20%	0.199	C	C	.	.	H	α-helix	trans	-65.4	-39.6	178.4	-171	39.1	0	0	0	111	T226 D227 W232 N233 K234	T226-D230 WeakPolarHBondContact CB-OD2 3.42Å; T226-D230 PolarHBondContact N-OD2 3.29Å; T226-D230 WeakPolarHBondContact OG1-CB 3.34Å; T226-D230 PolarHBondContact OG1-OD2 3.36Å; D227-D230 WeakPolarHBondContact OD1-CB 3.32Å; D227-D230 PolarHBondContact OD1-N 3Å; D230-W232 VanDerWaalsContact C-N 3.29Å; D230-W232 PolarHBondContact O-N 3.32Å; D230-N233 WeakPolarHBondContact O-CB 3.49Å; D230-N233 PolarHBondContact O-N 3.2Å; D230-N233 VanDerWaalsContact O-N 3.09Å; D230-K234 WeakPolarHBondContact O-CG 3.43Å; D230-K234 PolarHBondContact O-N 2.76Å
231	Q	93.5	Very high	93.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.3	-45.4	173.1	-172.4	67	31.3	0	0	111.9	R187 I195 F223 G225 D227 I229 K234 V235	R187-Q231 HydrophobicContact CG-CB 4.42Å; R187-Q231 HydrophobicContact CG-CG 4.27Å; I195-Q231 HydrophobicContact CD1-CB 4.38Å; I195-Q231 HydrophobicContact CD1-CG 3.48Å; I195-Q231 VanDerWaalsContact CD1-CG 3.48Å; I195-Q231 HydrophobicContact CG1-CG 4.44Å; F223-Q231 PolarHBondContact O-NE2 3.35Å; F223-Q231 PolarHBondContact O-OE1 2.94Å; F223-Q231 VanDerWaalsContact O-OE1 3.12Å; G225-Q231 VanDerWaalsContact CA-OE1 3.22Å; D227-Q231 WeakPolarHBondContact O-CB 3.4Å; D227-Q231 PolarHBondContact O-N 3.39Å; I229-Q231 VanDerWaalsContact C-N 3.34Å; Q231-K234 PolarHBondContact O-N 3.08Å; Q231-V235 WeakPolarHBondContact O-CG2 3.46Å; Q231-V235 PolarHBondContact O-N 3.04Å
232	W	93.9	Very high	93.1	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-63.7	-42.7	175.8	174.2	-109.3	0	0	0	112.2	P192 L196 H228 I229 D230 K234 V235 I236 P242 F246 V258 I302	P192-W232 HydrophobicContact CB-CZ3 3.9Å; P192-W232 HydrophobicContact CG-CZ3 4.39Å; L196-W232 HydrophobicContact CD1-CD2 4.37Å; L196-W232 HydrophobicContact CD1-CE3 4Å; L196-W232 HydrophobicContact CD1-CH2 3.91Å; L196-W232 HydrophobicContact CD1-CZ2 4.27Å; L196-W232 HydrophobicContact CD1-CZ3 3.79Å; L196-W232 HydrophobicContact CD2-CD2 4.07Å; L196-W232 HydrophobicContact CD2-CE3 4.3Å; L196-W232 HydrophobicContact CD2-CG 4.29Å; L196-W232 HydrophobicContact CG-CE3 4.3Å; H228-W232 PolarHBondContact O-N 3.43Å; I229-W232 PolarHBondContact O-N 3.4Å; D230-W232 VanDerWaalsContact C-N 3.29Å; D230-W232 PolarHBondContact O-N 3.32Å; W232-K234 VanDerWaalsContact C-N 3.34Å; W232-K234 PolarHBondContact O-N 3.49Å; W232-V235 HydrophobicContact CE3-CB 4.47Å; W232-V235 HydrophobicContact CE3-CG1 4.46Å; W232-V235 HydrophobicContact CZ3-CG1 4.25Å; W232-V235 WeakPolarHBondContact O-CB 3.46Å; W232-V235 PolarHBondContact O-N 3.07Å; W232-V235 VanDerWaalsContact O-N 3.15Å; W232-I236 HydrophobicContact CD2-CG2 4.11Å; W232-I236 HydrophobicContact CE3-CG2 4.33Å; W232-I236 HydrophobicContact CH2-CG2 3.62Å; W232-I236 HydrophobicContact CZ2-CG2 3.34Å; W232-I236 HydrophobicContact CZ3-CG2 4.07Å; W232-I236 PolarHBondContact O-N 3.29Å; W232-I236 VanDerWaalsContact O-N 3.11Å; W232-P242 HydrophobicContact CH2-CG 3.99Å; W232-P242 HydrophobicContact CZ2-CG 4.13Å; W232-F246 HydrophobicContact CH2-CE1 4.06Å; W232-V258 HydrophobicContact CZ2-CG1 3.73Å; W232-V258 HydrophobicContact CZ2-CG2 4.08Å; W232-I302 HydrophobicContact CH2-CG2 4Å; W232-I302 HydrophobicContact CZ3-CG2 4.14Å
233	N	93.5	Very high	93.1	Very high	22 Å²	22	37.9 Å²	37.9	12%	0.118	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-45.9	176.9	-61	-36.9	0	0	0	111.2	I229 D230 V235 I236 E237 K261	I229-N233 VanDerWaalsContact O-CG 3.29Å; I229-N233 PolarHBondContact O-N 2.66Å; I229-N233 PolarHBondContact O-ND2 3.14Å; D230-N233 WeakPolarHBondContact O-CB 3.49Å; D230-N233 PolarHBondContact O-N 3.2Å; D230-N233 VanDerWaalsContact O-N 3.09Å; N233-V235 PolarHBondContact O-N 3.24Å; N233-I236 WeakPolarHBondContact O-CG1 3.19Å; N233-I236 PolarHBondContact O-N 3.29Å; N233-E237 VanDerWaalsContact O-CB 3.32Å; N233-E237 WeakPolarHBondContact O-CB 3.28Å; N233-E237 WeakPolarHBondContact O-CG 3.38Å; N233-E237 PolarHBondContact O-N 2.89Å; N233-K261 WeakPolarHBondContact OD1-CE 3.5Å; N233-K261 PolarHBondContact OD1-NZ 2.85Å
234	K	95.5	Very high	92.9	Very high	68 Å²	68	42 Å²	42	30%	0.296	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-35.9	176.8	-64.1	-58.7	169.1	-159.3	0	113	F223 D230 Q231 W232 E237 I238	F223-K234 HydrophobicContact CB-CB 4.46Å; D230-K234 WeakPolarHBondContact O-CG 3.43Å; D230-K234 PolarHBondContact O-N 2.76Å; Q231-K234 PolarHBondContact O-N 3.08Å; W232-K234 VanDerWaalsContact C-N 3.34Å; W232-K234 PolarHBondContact O-N 3.49Å; K234-E237 IonicContact NZ-OE2 3.4Å; K234-E237 PolarHBondContact NZ-OE2 2.67Å; K234-I238 WeakPolarHBondContact O-CG1 3.5Å; K234-I238 PolarHBondContact O-N 2.92Å
235	V	96.6	Very high	92.9	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66	-51.7	176.6	169.1	0	0	0	0	111.2	P192 W207 F223 Q231 W232 N233 I238 L239 I302	P192-V235 HydrophobicContact CG-CG1 4.35Å; W207-V235 HydrophobicContact CH2-CG1 3.8Å; W207-V235 HydrophobicContact CH2-CG2 4.29Å; W207-V235 HydrophobicContact CZ2-CG1 4.26Å; W207-V235 HydrophobicContact CZ2-CG2 3.92Å; F223-V235 HydrophobicContact CB-CG2 4.34Å; F223-V235 HydrophobicContact CD1-CB 4.45Å; F223-V235 HydrophobicContact CD1-CG2 3.86Å; F223-V235 HydrophobicContact CD2-CG2 4.4Å; F223-V235 HydrophobicContact CE1-CG2 4.24Å; F223-V235 HydrophobicContact CG-CG2 3.96Å; Q231-V235 WeakPolarHBondContact O-CG2 3.46Å; Q231-V235 PolarHBondContact O-N 3.04Å; W232-V235 HydrophobicContact CE3-CB 4.47Å; W232-V235 HydrophobicContact CE3-CG1 4.46Å; W232-V235 HydrophobicContact CZ3-CG1 4.25Å; W232-V235 WeakPolarHBondContact O-CB 3.46Å; W232-V235 PolarHBondContact O-N 3.07Å; W232-V235 VanDerWaalsContact O-N 3.15Å; N233-V235 PolarHBondContact O-N 3.24Å; V235-I238 PolarHBondContact O-N 3.02Å; V235-L239 HydrophobicContact CG1-CD1 4.26Å; V235-L239 WeakPolarHBondContact O-CB 3.47Å; V235-L239 PolarHBondContact O-N 3.03Å; V235-I302 HydrophobicContact CG1-CD1 3.96Å; V235-I302 HydrophobicContact CG1-CG1 3.92Å
236	I	95.7	Very high	93	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-74.4	-28.3	-176.6	62.6	174.7	0	0	0	113.5	W232 N233 I238 G240 K261 Y264 I302	W232-I236 HydrophobicContact CD2-CG2 4.11Å; W232-I236 HydrophobicContact CE3-CG2 4.33Å; W232-I236 HydrophobicContact CH2-CG2 3.62Å; W232-I236 HydrophobicContact CZ2-CG2 3.34Å; W232-I236 HydrophobicContact CZ3-CG2 4.07Å; W232-I236 PolarHBondContact O-N 3.29Å; W232-I236 VanDerWaalsContact O-N 3.11Å; N233-I236 WeakPolarHBondContact O-CG1 3.19Å; N233-I236 PolarHBondContact O-N 3.29Å; I236-I238 PolarHBondContact O-N 3.4Å; I236-G240 CarbonylContact O-C 3.35Å; I236-G240 WeakPolarHBondContact O-CA 3.24Å; I236-G240 PolarHBondContact O-N 3.25Å; I236-K261 HydrophobicContact CD1-CB 4.24Å; I236-K261 HydrophobicContact CD1-CG 4.43Å; I236-Y264 HydrophobicContact CB-CD2 4.38Å; I236-Y264 HydrophobicContact CD1-CD2 4.03Å; I236-Y264 HydrophobicContact CD1-CE2 3.98Å; I236-Y264 HydrophobicContact CG1-CD2 3.96Å; I236-Y264 HydrophobicContact CG1-CE2 4.13Å; I236-Y264 VanDerWaalsContact O-CB 3.27Å; I236-Y264 WeakPolarHBondContact O-CB 3.46Å; I236-I302 HydrophobicContact CG2-CD1 4.31Å
237	E	95.3	Very high	93.2	Very high	73 Å²	73	39.6 Å²	39.6	34%	0.341	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-35.7	173.1	-78.6	168.6	-167.5	0	0	111.1	N233 K234 Y264	N233-E237 VanDerWaalsContact O-CB 3.32Å; N233-E237 WeakPolarHBondContact O-CB 3.28Å; N233-E237 WeakPolarHBondContact O-CG 3.38Å; N233-E237 PolarHBondContact O-N 2.89Å; K234-E237 IonicContact NZ-OE2 3.4Å; K234-E237 PolarHBondContact NZ-OE2 2.67Å; E237-Y264 HydrophobicContact CG-CD1 4.48Å; E237-Y264 HydrophobicContact CG-CE1 4.07Å; E237-Y264 HydrophobicContact CG-CE2 4.2Å
238	I	96	Very high	93.5	Very high	31 Å²	31	40.2 Å²	40.2	16%	0.159	21%	0.212	C	C	.	.	H	α-helix	trans	-91.4	-49.8	-177.5	-66.4	174.9	0	0	0	111.8	I222 F223 K234 V235 I236 G266 V267 L272	I222-I238 HydrophobicContact CG2-CD1 4.18Å; I222-I238 WeakPolarHBondContact O-CD1 3.47Å; F223-I238 HydrophobicContact CD1-CD1 3.91Å; F223-I238 HydrophobicContact CE1-CB 4.05Å; F223-I238 HydrophobicContact CE1-CD1 3.95Å; F223-I238 HydrophobicContact CE1-CG2 4.12Å; K234-I238 WeakPolarHBondContact O-CG1 3.5Å; K234-I238 PolarHBondContact O-N 2.92Å; V235-I238 PolarHBondContact O-N 3.02Å; I236-I238 PolarHBondContact O-N 3.4Å; I238-G266 WeakPolarHBondContact O-CA 3.42Å; I238-V267 PolarHBondContact O-N 2.95Å; I238-L272 HydrophobicContact CG2-CD1 3.74Å; I238-L272 HydrophobicContact CG2-CD2 3.54Å; I238-L272 HydrophobicContact CG2-CG 4.29Å
239	L	97.1	Very high	93.9	Very high	34 Å²	34	42.1 Å²	42.1	18%	0.178	22%	0.216	C	C	.	.	H	α-helix	trans	-93.2	-7.3	-173.4	-60.5	-178.4	0	0	0	113.6	W207 F223 V235 F269 L300 I302	W207-L239 HydrophobicContact CH2-CD1 3.51Å; W207-L239 HydrophobicContact CZ3-CD1 3.8Å; F223-L239 HydrophobicContact CE1-CD1 4.47Å; F223-L239 HydrophobicContact CE1-CG 4.31Å; F223-L239 HydrophobicContact CZ-CD1 3.99Å; F223-L239 HydrophobicContact CZ-CG 4.18Å; V235-L239 HydrophobicContact CG1-CD1 4.26Å; V235-L239 WeakPolarHBondContact O-CB 3.47Å; V235-L239 PolarHBondContact O-N 3.03Å; L239-F269 HydrophobicContact CD2-CE2 4.22Å; L239-F269 HydrophobicContact CD2-CZ 3.89Å; L239-L300 HydrophobicContact CD1-CB 4.48Å; L239-L300 WeakPolarHBondContact CD1-O 3.3Å; L239-L300 HydrophobicContact CD2-CB 4.49Å; L239-I302 HydrophobicContact CB-CD1 4.03Å; L239-I302 HydrophobicContact CB-CG1 4.25Å; L239-I302 HydrophobicContact CD1-CG1 3.99Å
240	G	95.9	Very high	94	Very high	4 Å²	4	38 Å²	38	4%	0.041	20%	0.196	C	C	.	.			trans	90.2	167.6	-177.3	0	0	0	0	0	113.5	I236 Y264 G266 I302	I236-G240 CarbonylContact O-C 3.35Å; I236-G240 WeakPolarHBondContact O-CA 3.24Å; I236-G240 PolarHBondContact O-N 3.25Å; G240-Y264 CarbonylContact C-O 3.49Å; G240-Y264 VanDerWaalsContact CA-O 3.23Å; G240-Y264 WeakPolarHBondContact CA-O 3.41Å; G240-G266 VanDerWaalsContact CA-CA 3.48Å; G240-G266 VanDerWaalsContact N-CA 3.34Å; G240-I302 WeakPolarHBondContact O-CD1 3.45Å
241	T	94.6	Very high	93.9	Very high	27 Å²	27	41.4 Å²	41.4	17%	0.166	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-72.6	130	176.7	-57.3	0	0	0	0	109.9	P262 Q263 Y264	T241-P262 PolarHBondContact OG1-O 3.48Å; T241-Q263 VanDerWaalsContact CB-OE1 3.29Å; T241-Q263 VanDerWaalsContact CG2-OE1 3.22Å; T241-Q263 WeakPolarHBondContact OG1-CA 3.3Å; T241-Y264 PolarHBondContact N-O 3.35Å; T241-Y264 PolarHBondContact OG1-N 3.5Å
242	P	94.1	Very high	93.7	Very high	16 Å²	16	48.5 Å²	48.5	10%	0.104	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-68.4	166.2	-176.8	30.3	-39	0	0	0	113	W232 F246 M247 I302	W232-P242 HydrophobicContact CH2-CG 3.99Å; W232-P242 HydrophobicContact CZ2-CG 4.13Å; P242-F246 HydrophobicContact CB-CB 4.15Å; P242-F246 HydrophobicContact CB-CD1 3.48Å; P242-F246 VanDerWaalsContact CB-CD1 3.48Å; P242-F246 HydrophobicContact CB-CE1 4.11Å; P242-F246 HydrophobicContact CB-CG 3.95Å; P242-F246 HydrophobicContact CG-CD1 3.53Å; P242-F246 HydrophobicContact CG-CE1 3.87Å; P242-F246 HydrophobicContact CG-CG 4.47Å; P242-M247 HydrophobicContact CG-CG 4.26Å; P242-I302 HydrophobicContact CB-CD1 4.47Å; P242-I302 HydrophobicContact CB-CG2 3.97Å; P242-I302 HydrophobicContact CG-CG2 4.44Å
243	S	93.8	Very high	93.5	Very high	58 Å²	58	53.7 Å²	53.7	41%	0.406	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-61.9	157.6	179	72.6	0	0	0	0	112.8	E245 F246 M247	S243-E245 PolarHBondContact O-N 3.31Å; S243-F246 WeakPolarHBondContact O-CB 3.44Å; S243-F246 PolarHBondContact O-N 3.17Å; S243-F246 PolarHBondContact OG-N 2.85Å; S243-M247 PolarHBondContact O-N 3.31Å; S243-M247 VanDerWaalsContact O-N 3.11Å
244	V	91.3	Very high	93.2	Very high	89 Å²	89	54.2 Å²	54.2	54%	0.539	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-33.2	174.3	179.6	0	0	0	0	111.4	M247 N248	V244-M247 HydrophobicContact CB-CE 4.44Å; V244-M247 HydrophobicContact CG2-CE 4.03Å; V244-M247 PolarHBondContact O-N 3.12Å; V244-N248 WeakPolarHBondContact O-CB 3.49Å; V244-N248 PolarHBondContact O-N 3.2Å; V244-N248 PolarHBondContact O-ND2 2.81Å
245	E	93.2	Very high	93	Very high	151 Å²	151	54.3 Å²	54.3	71%	0.706	28%	0.279	S	S	*	.	H	α-helix	trans	-62	-44.3	176.2	-66	171	176	0	0	111.9	S243 N248	S243-E245 PolarHBondContact O-N 3.31Å; E245-N248 PolarHBondContact O-N 2.97Å
246	F	94	Very high	92.7	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-50.3	171.8	173.4	-94.6	0	0	0	111.2	L196 M198 W232 P242 S243 N248 R249 L250 I302 D303	L196-F246 HydrophobicContact CD1-CE1 4.06Å; L196-F246 HydrophobicContact CD1-CZ 3.91Å; M198-F246 HydrophobicContact CE-CD2 4.31Å; M198-F246 HydrophobicContact CE-CE2 3.84Å; M198-F246 HydrophobicContact CE-CZ 4.26Å; M198-F246 HydrophobicContact SD-CE2 3.8Å; M198-F246 HydrophobicContact SD-CZ 3.73Å; W232-F246 HydrophobicContact CH2-CE1 4.06Å; P242-F246 HydrophobicContact CB-CB 4.15Å; P242-F246 HydrophobicContact CB-CD1 3.48Å; P242-F246 VanDerWaalsContact CB-CD1 3.48Å; P242-F246 HydrophobicContact CB-CE1 4.11Å; P242-F246 HydrophobicContact CB-CG 3.95Å; P242-F246 HydrophobicContact CG-CD1 3.53Å; P242-F246 HydrophobicContact CG-CE1 3.87Å; P242-F246 HydrophobicContact CG-CG 4.47Å; S243-F246 WeakPolarHBondContact O-CB 3.44Å; S243-F246 PolarHBondContact O-N 3.17Å; S243-F246 PolarHBondContact OG-N 2.85Å; F246-N248 PolarHBondContact O-N 3.21Å; F246-R249 PolarHBondContact O-N 2.93Å; F246-L250 HydrophobicContact CE1-CD1 4.35Å; F246-L250 HydrophobicContact CE1-CD2 4.3Å; F246-L250 HydrophobicContact CZ-CD2 4.41Å; F246-I302 HydrophobicContact CD1-CG2 4.48Å; F246-I302 HydrophobicContact CD2-CG2 4.49Å; F246-I302 HydrophobicContact CE1-CG2 4.02Å; F246-I302 HydrophobicContact CE2-CG2 4.03Å; F246-I302 HydrophobicContact CZ-CG2 3.77Å; F246-D303 HydrophobicContact CD2-CB 4.1Å
247	M	92.3	Very high	92.3	Very high	9 Å²	9	61.8 Å²	61.8	4%	0.044	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-31.7	-178.1	-67.8	-172.7	-78.7	0	0	112.6	P242 S243 V244 R249 L250 R255 V258 M259	P242-M247 HydrophobicContact CG-CG 4.26Å; S243-M247 PolarHBondContact O-N 3.31Å; S243-M247 VanDerWaalsContact O-N 3.11Å; V244-M247 HydrophobicContact CB-CE 4.44Å; V244-M247 HydrophobicContact CG2-CE 4.03Å; V244-M247 PolarHBondContact O-N 3.12Å; M247-R249 PolarHBondContact O-N 3.47Å; M247-L250 HydrophobicContact CB-CD1 4.4Å; M247-L250 HydrophobicContact CG-CD1 4.44Å; M247-L250 VanDerWaalsContact O-CB 3.31Å; M247-L250 WeakPolarHBondContact O-CB 3.47Å; M247-L250 PolarHBondContact O-N 2.84Å; M247-L250 VanDerWaalsContact O-N 3.14Å; M247-R255 HydrophobicContact CB-CG 4.49Å; M247-R255 WeakPolarHBondContact O-CG 3.28Å; M247-R255 PolarHBondContact O-NE 2.96Å; M247-V258 HydrophobicContact CG-CG1 4.1Å; M247-V258 HydrophobicContact SD-CG1 3.84Å; M247-M259 HydrophobicContact CB-CE 3.83Å; M247-M259 HydrophobicContact CE-CE 4.43Å; M247-M259 HydrophobicContact CE-CG 4.46Å; M247-M259 HydrophobicContact SD-CE 4.32Å; M247-M259 HydrophobicContact SD-CG 3.65Å
248	N	92.3	Very high	91.9	Very high	85 Å²	85	58.4 Å²	58.4	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-68.1	-15.5	176.4	-75.2	-20.7	0	0	0	114	V244 E245 F246 R255	V244-N248 WeakPolarHBondContact O-CB 3.49Å; V244-N248 PolarHBondContact O-N 3.2Å; V244-N248 PolarHBondContact O-ND2 2.81Å; E245-N248 PolarHBondContact O-N 2.97Å; F246-N248 PolarHBondContact O-N 3.21Å; N248-R255 PolarHBondContact O-NH2 3.33Å
249	R	93.4	Very high	91.6	Very high	92 Å²	92	60.3 Å²	60.3	35%	0.347	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-7.4	173.3	-67	-175.8	-68.8	148.9	3.5	113.5	M198 F246 M247 D303 E305	M198-R249 HydrophobicContact CE-CB 4.01Å; F246-R249 PolarHBondContact O-N 2.93Å; M247-R249 PolarHBondContact O-N 3.47Å; R249-D303 IonicContact CZ-OD1 3.71Å; R249-D303 IonicContact CZ-OD2 3.95Å; R249-D303 IonicContact NH1-OD1 2.9Å; R249-D303 IonicContact NH2-OD1 2.63Å; R249-D303 PolarHBondContact NH2-OD1 3.44Å; R249-D303 IonicContact NH2-OD2 2.77Å; R249-D303 PolarHBondContact NH2-OD2 3.39Å; R249-E305 IonicContact CZ-OE1 3.97Å; R249-E305 IonicContact CZ-OE2 3.53Å; R249-E305 VanDerWaalsContact NH1-CG 3.31Å; R249-E305 IonicContact NH1-OE1 3.56Å; R249-E305 PolarHBondContact NH1-OE1 2.96Å; R249-E305 IonicContact NH1-OE2 2.71Å
250	L	91	Very high	91.3	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.021	33%	0.334	C	S	.	.	S	Bend	trans	-75.1	154	175.8	-58.6	174.8	0	0	0	111.9	L196 M198 F246 M247 V254 R255 V258	L196-L250 HydrophobicContact CB-CD2 4.09Å; L196-L250 HydrophobicContact CD1-CD2 3.81Å; M198-L250 HydrophobicContact CE-CD2 4Å; M198-L250 HydrophobicContact CG-CD2 3.6Å; M198-L250 HydrophobicContact SD-CD2 3.34Å; M198-L250 WeakPolarHBondContact SD-CD2 3.19Å; F246-L250 HydrophobicContact CE1-CD1 4.35Å; F246-L250 HydrophobicContact CE1-CD2 4.3Å; F246-L250 HydrophobicContact CZ-CD2 4.41Å; M247-L250 HydrophobicContact CB-CD1 4.4Å; M247-L250 HydrophobicContact CG-CD1 4.44Å; M247-L250 VanDerWaalsContact O-CB 3.31Å; M247-L250 WeakPolarHBondContact O-CB 3.47Å; M247-L250 PolarHBondContact O-N 2.84Å; M247-L250 VanDerWaalsContact O-N 3.14Å; L250-V254 HydrophobicContact CD1-CG1 4.41Å; L250-V254 HydrophobicContact CD2-CG1 4.45Å; L250-R255 HydrophobicContact CB-CB 4.03Å; L250-R255 PolarHBondContact O-NH2 3.1Å; L250-V258 HydrophobicContact CD1-CB 4.18Å; L250-V258 HydrophobicContact CD1-CG1 4.47Å; L250-V258 HydrophobicContact CD1-CG2 3.92Å
251	M	88.7	Confident	90.9	Very high	103 Å²	103	67.6 Å²	67.6	51%	0.507	34%	0.343	S	S	.	.			trans	-60	147.4	165.5	-69.3	-171.2	-179.9	0	0	110.5	M179 T253 V254 R255	M179-M251 HydrophobicContact CE-CE 4.49Å; M179-M251 HydrophobicContact SD-CE 3.92Å; M179-M251 HydrophobicContact SD-SD 4.37Å; M251-T253 VanDerWaalsContact C-N 3.34Å; M251-T253 PolarHBondContact O-N 2.94Å; M251-V254 HydrophobicContact CB-CG2 4.34Å; M251-V254 PolarHBondContact O-N 2.83Å; M251-V254 VanDerWaalsContact O-N 3.07Å; M251-R255 WeakPolarHBondContact O-CB 3.46Å; M251-R255 PolarHBondContact O-N 3.12Å
252	E	89.3	Confident	90.8	Very high	148 Å²	148	69.9 Å²	69.9	69%	0.692	36%	0.358	S	S	*	.	H	α-helix	trans	-54.1	-45	-172.5	-175.4	173.3	-159.6	0	0	113.6	V254 R255 N256	E252-V254 PolarHBondContact O-N 2.98Å; E252-R255 PolarHBondContact O-N 3.13Å; E252-N256 WeakPolarHBondContact O-CB 3.46Å; E252-N256 VanDerWaalsContact O-CG 3.24Å; E252-N256 PolarHBondContact O-N 3.18Å; E252-N256 PolarHBondContact O-ND2 3.46Å
253	T	89.1	Confident	90.7	Very high	111 Å²	111	75.3 Å²	75.3	68%	0.681	38%	0.382	S	S	*	.	H	α-helix	trans	-62.1	-43.6	178.3	51.1	0	0	0	0	112.3	M251 Y257	M251-T253 VanDerWaalsContact C-N 3.34Å; M251-T253 PolarHBondContact O-N 2.94Å; T253-Y257 PolarHBondContact O-N 3.42Å
254	V	88.1	Confident	90.7	Very high	33 Å²	33	75.9 Å²	75.9	20%	0.2	38%	0.376	C	S	.	.	H	α-helix	trans	-71	-41.3	178.9	-176.6	0	0	0	0	110.7	L196 L250 M251 E252 N256 Y257 V258	L196-V254 HydrophobicContact CB-CG1 4.2Å; L196-V254 HydrophobicContact CD2-CG1 3.75Å; L196-V254 HydrophobicContact CG-CG1 4.49Å; L250-V254 HydrophobicContact CD1-CG1 4.41Å; L250-V254 HydrophobicContact CD2-CG1 4.45Å; M251-V254 HydrophobicContact CB-CG2 4.34Å; M251-V254 PolarHBondContact O-N 2.83Å; M251-V254 VanDerWaalsContact O-N 3.07Å; E252-V254 PolarHBondContact O-N 2.98Å; V254-N256 PolarHBondContact O-N 2.82Å; V254-Y257 WeakPolarHBondContact O-CB 3.49Å; V254-Y257 PolarHBondContact O-N 3Å; V254-V258 HydrophobicContact CG1-CG2 4.34Å; V254-V258 WeakPolarHBondContact O-CG2 3.48Å; V254-V258 PolarHBondContact O-N 3.42Å
255	R	91	Very high	90.8	Very high	70 Å²	70	78.1 Å²	78.1	26%	0.264	39%	0.392	S	S	.	.	H	α-helix	trans	-57.7	-49	176.3	-173.7	-175.6	-56.4	160.9	9.5	111.4	M247 N248 L250 M251 E252 Y257 V258 M259	M247-R255 HydrophobicContact CB-CG 4.49Å; M247-R255 WeakPolarHBondContact O-CG 3.28Å; M247-R255 PolarHBondContact O-NE 2.96Å; N248-R255 PolarHBondContact O-NH2 3.33Å; L250-R255 HydrophobicContact CB-CB 4.03Å; L250-R255 PolarHBondContact O-NH2 3.1Å; M251-R255 WeakPolarHBondContact O-CB 3.46Å; M251-R255 PolarHBondContact O-N 3.12Å; E252-R255 PolarHBondContact O-N 3.13Å; R255-Y257 VanDerWaalsContact C-N 3.26Å; R255-Y257 PolarHBondContact O-N 3.4Å; R255-V258 PolarHBondContact O-N 3.18Å; R255-M259 HydrophobicContact CG-CE 3.76Å; R255-M259 HydrophobicContact CG-CG 4.21Å; R255-M259 HydrophobicContact CG-SD 3.82Å; R255-M259 WeakPolarHBondContact O-CB 3.47Å; R255-M259 WeakPolarHBondContact O-CG 3.31Å; R255-M259 PolarHBondContact O-N 3.34Å
256	N	89.9	Confident	90.8	Very high	82 Å²	82	72 Å²	72	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-60.7	-39	178.8	-70.6	-19.7	0	0	0	111.3	E252 V254 N260	E252-N256 WeakPolarHBondContact O-CB 3.46Å; E252-N256 VanDerWaalsContact O-CG 3.24Å; E252-N256 PolarHBondContact O-N 3.18Å; E252-N256 PolarHBondContact O-ND2 3.46Å; V254-N256 PolarHBondContact O-N 2.82Å; N256-N260 WeakPolarHBondContact O-CB 3.38Å; N256-N260 VanDerWaalsContact O-CG 3.22Å; N256-N260 PolarHBondContact O-N 3.34Å; N256-N260 PolarHBondContact O-ND2 3.07Å
257	Y	88.1	Confident	90.9	Very high	78 Å²	78	74.2 Å²	74.2	31%	0.306	38%	0.384	S	S	.	.	H	α-helix	trans	-62.2	-48.5	173.9	176.6	-93.9	0	0	0	112.3	I229 T253 V254 R255 N260 K261	I229-Y257 WeakPolarHBondContact CG2-OH 3.33Å; T253-Y257 PolarHBondContact O-N 3.42Å; V254-Y257 WeakPolarHBondContact O-CB 3.49Å; V254-Y257 PolarHBondContact O-N 3Å; R255-Y257 VanDerWaalsContact C-N 3.26Å; R255-Y257 PolarHBondContact O-N 3.4Å; Y257-N260 PolarHBondContact O-N 3.15Å; Y257-K261 WeakPolarHBondContact OH-CE 3.4Å; Y257-K261 PolarHBondContact OH-NZ 3.13Å
258	V	87.3	Confident	91.1	Very high	1 Å²	1	77 Å²	77	1%	0.006	40%	0.404	C	S	.	.	H	α-helix	trans	-66.7	-43	-178.2	175.5	0	0	0	0	111.8	L196 W232 M247 L250 V254 R255 N260 K261	L196-V258 HydrophobicContact CD2-CG2 4.33Å; W232-V258 HydrophobicContact CZ2-CG1 3.73Å; W232-V258 HydrophobicContact CZ2-CG2 4.08Å; M247-V258 HydrophobicContact CG-CG1 4.1Å; M247-V258 HydrophobicContact SD-CG1 3.84Å; L250-V258 HydrophobicContact CD1-CB 4.18Å; L250-V258 HydrophobicContact CD1-CG1 4.47Å; L250-V258 HydrophobicContact CD1-CG2 3.92Å; V254-V258 HydrophobicContact CG1-CG2 4.34Å; V254-V258 WeakPolarHBondContact O-CG2 3.48Å; V254-V258 PolarHBondContact O-N 3.42Å; R255-V258 PolarHBondContact O-N 3.18Å; V258-N260 VanDerWaalsContact C-N 3.3Å; V258-N260 PolarHBondContact O-N 3.21Å; V258-K261 WeakPolarHBondContact O-CB 3.02Å; V258-K261 PolarHBondContact O-N 3.02Å
259	M	89.1	Confident	91.3	Very high	71 Å²	71	74.9 Å²	74.9	35%	0.35	39%	0.391	S	S	.	.	H	α-helix	trans	-67.5	-27.7	-179.3	-74.4	-175.2	169.2	0	0	113.4	M247 R255 K261	M247-M259 HydrophobicContact CB-CE 3.83Å; M247-M259 HydrophobicContact CE-CE 4.43Å; M247-M259 HydrophobicContact CE-CG 4.46Å; M247-M259 HydrophobicContact SD-CE 4.32Å; M247-M259 HydrophobicContact SD-CG 3.65Å; R255-M259 HydrophobicContact CG-CE 3.76Å; R255-M259 HydrophobicContact CG-CG 4.21Å; R255-M259 HydrophobicContact CG-SD 3.82Å; R255-M259 WeakPolarHBondContact O-CB 3.47Å; R255-M259 WeakPolarHBondContact O-CG 3.31Å; R255-M259 PolarHBondContact O-N 3.34Å; M259-K261 VanDerWaalsContact C-N 3.26Å; M259-K261 PolarHBondContact O-N 2.7Å
260	N	90.1	Very high	91.4	Very high	140 Å²	140	74.4 Å²	74.4	75%	0.749	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.3	178.4	-75.1	-34.3	0	0	0	113.7	N256 Y257 V258	N256-N260 WeakPolarHBondContact O-CB 3.38Å; N256-N260 VanDerWaalsContact O-CG 3.22Å; N256-N260 PolarHBondContact O-N 3.34Å; N256-N260 PolarHBondContact O-ND2 3.07Å; Y257-N260 PolarHBondContact O-N 3.15Å; V258-N260 VanDerWaalsContact C-N 3.3Å; V258-N260 PolarHBondContact O-N 3.21Å
261	K	88.9	Confident	91.6	Very high	51 Å²	51	80.6 Å²	80.6	22%	0.222	43%	0.427	C	S	.	.	S	Bend	trans	-79.5	156.3	176.5	-71.1	-74.5	179.1	161.2	0	111.7	N233 I236 Y257 V258 M259	N233-K261 WeakPolarHBondContact OD1-CE 3.5Å; N233-K261 PolarHBondContact OD1-NZ 2.85Å; I236-K261 HydrophobicContact CD1-CB 4.24Å; I236-K261 HydrophobicContact CD1-CG 4.43Å; Y257-K261 WeakPolarHBondContact OH-CE 3.4Å; Y257-K261 PolarHBondContact OH-NZ 3.13Å; V258-K261 WeakPolarHBondContact O-CB 3.02Å; V258-K261 PolarHBondContact O-N 3.02Å; M259-K261 VanDerWaalsContact C-N 3.26Å; M259-K261 PolarHBondContact O-N 2.7Å
262	P	91.4	Very high	91.9	Very high	75 Å²	75	76.3 Å²	76.3	49%	0.487	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-53.2	143.9	168.3	-23.4	33.8	0	0	0	111.1	T241 Y264	T241-P262 PolarHBondContact OG1-O 3.48Å; P262-Y264 HydrophobicContact CB-CE1 4.39Å; P262-Y264 HydrophobicContact CB-CE2 4.01Å; P262-Y264 VanDerWaalsContact O-CD2 3.26Å; P262-Y264 WeakPolarHBondContact O-CD2 3.31Å; P262-Y264 WeakPolarHBondContact O-CE2 3.41Å
263	Q	92.8	Very high	92.2	Very high	130 Å²	130	69.2 Å²	69.2	61%	0.607	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-79.9	121.5	173.9	-66.4	-66.3	-35.4	0	0	108.8	T241	T241-Q263 VanDerWaalsContact CB-OE1 3.29Å; T241-Q263 VanDerWaalsContact CG2-OE1 3.22Å; T241-Q263 WeakPolarHBondContact OG1-CA 3.3Å
264	Y	94.4	Very high	92.5	Very high	71 Å²	71	65.1 Å²	65.1	28%	0.278	35%	0.348	S	S	.	.			trans	-106.6	129.7	177.2	-63	-76	0	0	0	109.2	I236 E237 G240 T241 P262 G266	I236-Y264 HydrophobicContact CB-CD2 4.38Å; I236-Y264 HydrophobicContact CD1-CD2 4.03Å; I236-Y264 HydrophobicContact CD1-CE2 3.98Å; I236-Y264 HydrophobicContact CG1-CD2 3.96Å; I236-Y264 HydrophobicContact CG1-CE2 4.13Å; I236-Y264 VanDerWaalsContact O-CB 3.27Å; I236-Y264 WeakPolarHBondContact O-CB 3.46Å; E237-Y264 HydrophobicContact CG-CD1 4.48Å; E237-Y264 HydrophobicContact CG-CE1 4.07Å; E237-Y264 HydrophobicContact CG-CE2 4.2Å; G240-Y264 CarbonylContact C-O 3.49Å; G240-Y264 VanDerWaalsContact CA-O 3.23Å; G240-Y264 WeakPolarHBondContact CA-O 3.41Å; T241-Y264 PolarHBondContact N-O 3.35Å; T241-Y264 PolarHBondContact OG1-N 3.5Å; P262-Y264 HydrophobicContact CB-CE1 4.39Å; P262-Y264 HydrophobicContact CB-CE2 4.01Å; P262-Y264 VanDerWaalsContact O-CD2 3.26Å; P262-Y264 WeakPolarHBondContact O-CD2 3.31Å; P262-Y264 WeakPolarHBondContact O-CE2 3.41Å; Y264-G266 PolarHBondContact O-N 3.46Å
265	P	92.9	Very high	92.7	Very high	135 Å²	135	68.1 Å²	68.1	88%	0.877	36%	0.363	S	S	*	.			trans	-71	-16.1	177.9	29.2	-34.9	0	0	0	113
266	G	93.6	Very high	92.7	Very high	24 Å²	24	75.1 Å²	75.1	25%	0.247	39%	0.389	C	S	.	.			trans	80.1	159.9	-170.7	0	0	0	0	0	112.5	I238 G240 Y264	I238-G266 WeakPolarHBondContact O-CA 3.42Å; G240-G266 VanDerWaalsContact CA-CA 3.48Å; G240-G266 VanDerWaalsContact N-CA 3.34Å; Y264-G266 PolarHBondContact O-N 3.46Å
267	V	94.8	Very high	92.8	Very high	46 Å²	46	72.1 Å²	72.1	28%	0.279	38%	0.376	S	S	.	.			trans	-98.4	138.4	176.2	-179.9	0	0	0	0	108.2	I238 E271 L272	I238-V267 PolarHBondContact O-N 2.95Å; V267-E271 HydrophobicContact CG1-CB 3.7Å; V267-E271 HydrophobicContact CG1-CG 3.67Å; V267-L272 HydrophobicContact CG1-CB 4.26Å
268	S	96.6	Very high	93	Very high	66 Å²	66	68.9 Å²	68.9	46%	0.462	36%	0.363	S	S	.	.			trans	-64.8	146.7	176.6	74.8	0	0	0	0	111	T270 E271 L272	S268-T270 PolarHBondContact O-N 2.79Å; S268-T270 VanDerWaalsContact O-N 3.17Å; S268-E271 PolarHBondContact O-N 3.09Å; S268-E271 WeakPolarHBondContact OG-CB 3.39Å; S268-E271 PolarHBondContact OG-N 3.31Å; S268-L272 PolarHBondContact O-N 3.5Å
269	F	96.6	Very high	92.9	Very high	42 Å²	42	70.5 Å²	70.5	18%	0.184	37%	0.374	C	S	.	.	H	α-helix	trans	-62.8	-24.3	178.2	-85.8	-99.4	0	0	0	113.2	L239 F273 R293 L296 S297 L300	L239-F269 HydrophobicContact CD2-CE2 4.22Å; L239-F269 HydrophobicContact CD2-CZ 3.89Å; F269-F273 AromaticContact CD1-CD2 3.75Å; F269-F273 HydrophobicContact CD1-CD2 3.75Å; F269-F273 AromaticContact CD1-CE2 3.68Å; F269-F273 HydrophobicContact CD1-CE2 3.68Å; F269-F273 HydrophobicContact CE1-CD2 4.37Å; F269-F273 AromaticContact CE1-CE2 3.83Å; F269-F273 HydrophobicContact CE1-CE2 3.83Å; F269-F273 WeakPolarHBondContact O-CA 3.33Å; F269-F273 WeakPolarHBondContact O-CB 3.35Å; F269-F273 PolarHBondContact O-N 3.01Å; F269-R293 HydrophobicContact CB-CG 3.96Å; F269-L296 HydrophobicContact CD1-CB 4.11Å; F269-L296 HydrophobicContact CE1-CB 4.11Å; F269-L296 WeakPolarHBondContact CE1-O 3.44Å; F269-S297 VanDerWaalsContact CE1-CA 3.44Å; F269-L300 HydrophobicContact CE1-CB 4.07Å; F269-L300 HydrophobicContact CE1-CD1 4.2Å; F269-L300 HydrophobicContact CZ-CB 3.87Å
270	T	95.6	Very high	92.5	Very high	81 Å²	81	70.1 Å²	70.1	50%	0.497	38%	0.378	S	S	.	.	H	α-helix	trans	-70.6	-33.7	172.8	-51	0	0	0	0	112.1	S268 F273 P274	S268-T270 PolarHBondContact O-N 2.79Å; S268-T270 VanDerWaalsContact O-N 3.17Å; T270-F273 CarbonylContact O-C 3.21Å; T270-P274 WeakPolarHBondContact O-CA 3.46Å
271	E	95.4	Very high	91.9	Very high	135 Å²	135	72.6 Å²	72.6	63%	0.631	39%	0.385	S	S	*	.	H	α-helix	trans	-80	-38.3	174.6	-178.2	-179.2	170.5	0	0	111.5	V267 S268	V267-E271 HydrophobicContact CG1-CB 3.7Å; V267-E271 HydrophobicContact CG1-CG 3.67Å; S268-E271 PolarHBondContact O-N 3.09Å; S268-E271 WeakPolarHBondContact OG-CB 3.39Å; S268-E271 PolarHBondContact OG-N 3.31Å
272	L	95.4	Very high	91.6	Very high	12 Å²	12	72.5 Å²	72.5	6%	0.063	39%	0.391	C	S	.	.	H	α-helix	trans	-68.5	-38	178.4	-175.4	59.5	0	0	0	112.4	I238 V267 S268	I238-L272 HydrophobicContact CG2-CD1 3.74Å; I238-L272 HydrophobicContact CG2-CD2 3.54Å; I238-L272 HydrophobicContact CG2-CG 4.29Å; V267-L272 HydrophobicContact CG1-CB 4.26Å; S268-L272 PolarHBondContact O-N 3.5Å
273	F	95.9	Very high	91.2	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.398	C	S	.	.	S	Bend	trans	-128.4	79	177	-52.9	-76.8	0	0	0	109.6	G214 V217 K218 I222 F269 T270 F278 R293 L296 L300	G214-F273 VanDerWaalsContact CA-CE1 3.47Å; V217-F273 HydrophobicContact CB-CD1 4.31Å; V217-F273 HydrophobicContact CG1-CD1 3.94Å; K218-F273 HydrophobicContact CD-CD1 3.98Å; K218-F273 HydrophobicContact CD-CE1 3.69Å; K218-F273 HydrophobicContact CG-CD1 3.85Å; K218-F273 HydrophobicContact CG-CE1 3.84Å; I222-F273 HydrophobicContact CD1-CE1 4.45Å; I222-F273 HydrophobicContact CD1-CZ 4.07Å; F269-F273 AromaticContact CD1-CD2 3.75Å; F269-F273 HydrophobicContact CD1-CD2 3.75Å; F269-F273 AromaticContact CD1-CE2 3.68Å; F269-F273 HydrophobicContact CD1-CE2 3.68Å; F269-F273 HydrophobicContact CE1-CD2 4.37Å; F269-F273 AromaticContact CE1-CE2 3.83Å; F269-F273 HydrophobicContact CE1-CE2 3.83Å; F269-F273 WeakPolarHBondContact O-CA 3.33Å; F269-F273 WeakPolarHBondContact O-CB 3.35Å; F269-F273 PolarHBondContact O-N 3.01Å; T270-F273 CarbonylContact O-C 3.21Å; F273-F278 HydrophobicContact CB-CE2 3.68Å; F273-F278 HydrophobicContact CB-CZ 3.81Å; F273-F278 WeakPolarHBondContact O-CE2 3.38Å; F273-R293 VanDerWaalsContact O-CZ 3.31Å; F273-R293 PolarHBondContact O-NE 3.35Å; F273-R293 PolarHBondContact O-NH2 2.77Å; F273-L296 HydrophobicContact CD1-CD1 4.06Å; F273-L296 HydrophobicContact CD2-CD1 3.9Å; F273-L296 HydrophobicContact CE1-CD1 4.12Å; F273-L296 HydrophobicContact CE2-CB 4.27Å; F273-L296 HydrophobicContact CE2-CD1 3.94Å; F273-L296 HydrophobicContact CE2-CD2 4.34Å; F273-L296 HydrophobicContact CE2-CG 4.42Å; F273-L296 HydrophobicContact CG-CD1 3.94Å; F273-L296 HydrophobicContact CZ-CD1 4.05Å; F273-L296 HydrophobicContact CZ-CD2 4.11Å; F273-L300 HydrophobicContact CE2-CD1 4.22Å; F273-L300 HydrophobicContact CZ-CD1 4.04Å
274	P	94.6	Very high	90.8	Very high	25 Å²	25	75 Å²	75	16%	0.162	40%	0.396	C	S	.	.			trans	-68.6	159.2	-180	30.2	-35.7	0	0	0	111.8	T270 W276 A277 F278	T270-P274 WeakPolarHBondContact O-CA 3.46Å; P274-W276 HydrophobicContact CB-CG 4.39Å; P274-W276 HydrophobicContact CB-CZ2 4.49Å; P274-W276 HydrophobicContact CG-CD2 3.9Å; P274-W276 HydrophobicContact CG-CG 4.28Å; P274-W276 HydrophobicContact CG-CH2 4.21Å; P274-W276 HydrophobicContact CG-CZ2 3.39Å; P274-W276 PolarHBondContact O-N 2.8Å; P274-A277 HydrophobicContact CG-CB 4.22Å; P274-A277 WeakPolarHBondContact O-CB 3.48Å; P274-A277 PolarHBondContact O-N 3Å; P274-F278 WeakPolarHBondContact O-CD2 3.24Å
275	D	92.4	Very high	90.5	Very high	95 Å²	95	73 Å²	73	51%	0.508	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-56.4	-35.6	-175.3	-65.5	-24.6	0	0	0	112.9	A277 F278 R293	D275-A277 PolarHBondContact O-N 2.69Å; D275-F278 PolarHBondContact O-N 2.94Å; D275-F278 VanDerWaalsContact O-N 3.13Å; D275-R293 IonicContact OD1-CZ 3.31Å; D275-R293 VanDerWaalsContact OD1-CZ 3.31Å; D275-R293 IonicContact OD1-NH1 3.06Å; D275-R293 PolarHBondContact OD1-NH1 3.08Å; D275-R293 IonicContact OD1-NH2 2.66Å; D275-R293 PolarHBondContact OD1-NH2 3.25Å
276	W	91.3	Very high	90.4	Very high	218 Å²	218	71.3 Å²	71.3	83%	0.826	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-67.9	-16.7	178.9	62.1	-103.8	0	0	0	114.2	P274	P274-W276 HydrophobicContact CB-CG 4.39Å; P274-W276 HydrophobicContact CB-CZ2 4.49Å; P274-W276 HydrophobicContact CG-CD2 3.9Å; P274-W276 HydrophobicContact CG-CG 4.28Å; P274-W276 HydrophobicContact CG-CH2 4.21Å; P274-W276 HydrophobicContact CG-CZ2 3.39Å; P274-W276 PolarHBondContact O-N 2.8Å
277	A	91.9	Very high	90.4	Very high	18 Å²	18	73.6 Å²	73.6	15%	0.149	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-80.2	-10.5	176.1	0	0	0	0	0	112.2	V217 P274 D275	V217-A277 HydrophobicContact CG1-CB 3.89Å; P274-A277 HydrophobicContact CG-CB 4.22Å; P274-A277 WeakPolarHBondContact O-CB 3.48Å; P274-A277 PolarHBondContact O-N 3Å; D275-A277 PolarHBondContact O-N 2.69Å
278	F	92.1	Very high	90.4	Very high	11 Å²	11	73.9 Å²	73.9	5%	0.048	38%	0.376	C	S	.	.	S	Bend	trans	-103.5	154.5	176.3	-64.3	-88.9	0	0	0	111	H123 V217 F273 P274 D275 S280 T289 A292 R293 L296	H123-F278 AromaticContact CE1-CD1 3.94Å; V217-F278 HydrophobicContact CB-CE1 4.27Å; V217-F278 HydrophobicContact CG1-CD1 3.98Å; V217-F278 HydrophobicContact CG1-CD2 4.25Å; V217-F278 HydrophobicContact CG1-CE1 3.68Å; V217-F278 HydrophobicContact CG1-CE2 3.97Å; V217-F278 HydrophobicContact CG1-CG 4.27Å; V217-F278 HydrophobicContact CG1-CZ 3.68Å; V217-F278 HydrophobicContact CG2-CD1 3.98Å; V217-F278 HydrophobicContact CG2-CE1 3.49Å; V217-F278 VanDerWaalsContact CG2-CE1 3.49Å; V217-F278 HydrophobicContact CG2-CZ 4.15Å; F273-F278 HydrophobicContact CB-CE2 3.68Å; F273-F278 HydrophobicContact CB-CZ 3.81Å; F273-F278 WeakPolarHBondContact O-CE2 3.38Å; P274-F278 WeakPolarHBondContact O-CD2 3.24Å; D275-F278 PolarHBondContact O-N 2.94Å; D275-F278 VanDerWaalsContact O-N 3.13Å; F278-S280 PolarHBondContact O-N 3.42Å; F278-T289 HydrophobicContact CB-CG2 3.93Å; F278-T289 VanDerWaalsContact CB-OG1 3.31Å; F278-T289 WeakPolarHBondContact CB-OG1 3.22Å; F278-T289 HydrophobicContact CD2-CG2 3.58Å; F278-T289 HydrophobicContact CE2-CG2 4.16Å; F278-T289 HydrophobicContact CG-CG2 3.76Å; F278-A292 HydrophobicContact CD1-CB 4.21Å; F278-A292 HydrophobicContact CE1-CB 3.68Å; F278-A292 HydrophobicContact CZ-CB 4.47Å; F278-R293 HydrophobicContact CZ-CB 4.37Å; F278-L296 HydrophobicContact CZ-CD1 4.23Å
279	P	85.9	Confident	90.3	Very high	35 Å²	35	71 Å²	71	23%	0.227	36%	0.355	C	S	.	.			trans	-59.1	127.2	166.1	-18.3	31.1	0	0	0	109.8	L121 H123	L121-P279 WeakPolarHBondContact O-CG 3.41Å; H123-P279 PolarHBondContact NE2-O 2.71Å; H123-P279 VanDerWaalsContact NE2-O 3.14Å
280	S	79.6	Confident	90.3	Very high	63 Å²	63	73.2 Å²	73.2	44%	0.441	37%	0.372	S	S	.	.			trans	-146.2	65.7	-177.4	174.5	0	0	0	0	111.2	F278	F278-S280 PolarHBondContact O-N 3.42Å
281	E	76.7	Confident	90.4	Very high	192 Å²	192	71.9 Å²	71.9	90%	0.897	36%	0.36	S	S	*	.	S	Bend	trans	-91.2	-25.6	178	-60.9	-170.5	172.7	0	0	112.5
282	S	84.3	Confident	90.5	Very high	49 Å²	49	65.5 Å²	65.5	34%	0.343	33%	0.33	S	S	.	.	S	Bend	trans	-130.8	165.2	-176.9	74.6	0	0	0	0	113.9	Q284 D285 K286	S282-Q284 PolarHBondContact O-N 3.06Å; S282-Q284 PolarHBondContact OG-N 3.43Å; S282-D285 WeakPolarHBondContact CB-OD2 3.45Å; S282-D285 PolarHBondContact N-OD2 3.04Å; S282-D285 WeakPolarHBondContact O-CB 3.5Å; S282-D285 PolarHBondContact O-N 3.26Å; S282-D285 VanDerWaalsContact O-N 3.14Å; S282-D285 PolarHBondContact OG-N 3.09Å; S282-D285 PolarHBondContact OG-OD2 2.67Å; S282-K286 PolarHBondContact O-N 3.06Å
283	E	82.9	Confident	90.6	Very high	137 Å²	137	66.1 Å²	66.1	64%	0.64	33%	0.332	S	S	*	.	H	α-helix	trans	-61.8	-30.8	171.8	-68.8	-57.6	127.2	0	0	112.5	D285 K286 V287	E283-D285 VanDerWaalsContact C-N 3.3Å; E283-D285 PolarHBondContact O-N 2.9Å; E283-K286 WeakPolarHBondContact O-CB 3.25Å; E283-K286 PolarHBondContact O-N 2.82Å; E283-K286 WeakPolarHBondContact OE1-CE 3.38Å; E283-K286 IonicContact OE1-NZ 3.44Å; E283-K286 PolarHBondContact OE1-NZ 3.12Å; E283-K286 IonicContact OE2-NZ 3.64Å; E283-V287 PolarHBondContact O-N 3.23Å
284	Q	84.4	Confident	90.7	Very high	121 Å²	121	69.1 Å²	69.1	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-66.3	-35.7	175.5	-169.3	65.8	17.8	0	0	111.1	S282 K286 V287 K288	S282-Q284 PolarHBondContact O-N 3.06Å; S282-Q284 PolarHBondContact OG-N 3.43Å; Q284-K286 VanDerWaalsContact C-N 3.32Å; Q284-V287 PolarHBondContact O-N 2.75Å; Q284-K288 WeakPolarHBondContact O-CG 3.48Å; Q284-K288 PolarHBondContact O-N 3.17Å; Q284-K288 VanDerWaalsContact O-N 3.07Å
285	D	88.2	Confident	90.9	Very high	28 Å²	28	67.9 Å²	67.9	15%	0.15	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-30.6	177.4	-60.9	-41.8	0	0	0	112.2	H123 S282 E283 V287 K288 T289	H123-D285 IonicContact CD2-OD1 3.82Å; H123-D285 PolarHBondContact NE2-O 3.43Å; S282-D285 WeakPolarHBondContact CB-OD2 3.45Å; S282-D285 PolarHBondContact N-OD2 3.04Å; S282-D285 WeakPolarHBondContact O-CB 3.5Å; S282-D285 PolarHBondContact O-N 3.26Å; S282-D285 VanDerWaalsContact O-N 3.14Å; S282-D285 PolarHBondContact OG-N 3.09Å; S282-D285 PolarHBondContact OG-OD2 2.67Å; E283-D285 VanDerWaalsContact C-N 3.3Å; E283-D285 PolarHBondContact O-N 2.9Å; D285-V287 VanDerWaalsContact C-N 3.33Å; D285-V287 PolarHBondContact O-N 3.14Å; D285-K288 CarbonylContact O-C 3.57Å; D285-K288 PolarHBondContact O-N 3.38Å; D285-T289 WeakPolarHBondContact O-CB 3.44Å; D285-T289 PolarHBondContact O-N 3.02Å; D285-T289 PolarHBondContact O-OG1 3.43Å
286	K	89.9	Confident	91.2	Very high	100 Å²	100	63.4 Å²	63.4	44%	0.435	32%	0.316	S	S	.	.	H	α-helix	trans	-62.4	-41.6	172.2	-65.1	178.5	-177.8	170.5	0	111.8	S282 E283 Q284 T289 V290	S282-K286 PolarHBondContact O-N 3.06Å; E283-K286 WeakPolarHBondContact O-CB 3.25Å; E283-K286 PolarHBondContact O-N 2.82Å; E283-K286 WeakPolarHBondContact OE1-CE 3.38Å; E283-K286 IonicContact OE1-NZ 3.44Å; E283-K286 PolarHBondContact OE1-NZ 3.12Å; E283-K286 IonicContact OE2-NZ 3.64Å; Q284-K286 VanDerWaalsContact C-N 3.32Å; K286-T289 WeakPolarHBondContact O-CB 3.29Å; K286-T289 PolarHBondContact O-N 3.3Å; K286-V290 WeakPolarHBondContact O-CG2 3.37Å; K286-V290 PolarHBondContact O-N 3.34Å; K286-V290 VanDerWaalsContact O-N 3.17Å
287	V	92.9	Very high	91.5	Very high	71 Å²	71	54.8 Å²	54.8	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-45.6	174.5	178.4	0	0	0	0	110.3	E283 Q284 D285 T289 V290 Q291	E283-V287 PolarHBondContact O-N 3.23Å; Q284-V287 PolarHBondContact O-N 2.75Å; D285-V287 VanDerWaalsContact C-N 3.33Å; D285-V287 PolarHBondContact O-N 3.14Å; V287-T289 VanDerWaalsContact C-N 3.32Å; V287-T289 PolarHBondContact O-N 3.14Å; V287-V290 PolarHBondContact O-N 3.09Å; V287-Q291 WeakPolarHBondContact O-CG 3.45Å; V287-Q291 PolarHBondContact O-N 3.46Å
288	K	94.9	Very high	91.8	Very high	53 Å²	53	57.7 Å²	57.7	23%	0.23	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-35.8	177.2	-71.3	-173.3	-175.4	176.8	0	112.7	H123 Q284 D285 Q291 A292 Y318	H123-K288 HydrophobicContact CB-CB 4.12Å; H123-K288 HydrophobicContact CB-CD 3.49Å; H123-K288 VanDerWaalsContact CB-CD 3.49Å; H123-K288 HydrophobicContact CB-CG 4.45Å; Q284-K288 WeakPolarHBondContact O-CG 3.48Å; Q284-K288 PolarHBondContact O-N 3.17Å; Q284-K288 VanDerWaalsContact O-N 3.07Å; D285-K288 CarbonylContact O-C 3.57Å; D285-K288 PolarHBondContact O-N 3.38Å; K288-Q291 PolarHBondContact O-N 2.96Å; K288-A292 VanDerWaalsContact O-CB 3.31Å; K288-A292 WeakPolarHBondContact O-CB 3.37Å; K288-A292 PolarHBondContact O-N 3.38Å; K288-Y318 HydrophobicContact CB-CD2 4.49Å; K288-Y318 HydrophobicContact CB-CE2 4.12Å; K288-Y318 WeakPolarHBondContact O-CE2 3.15Å
289	T	95.6	Very high	92.2	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-60.2	-46.5	173.9	-71.7	0	0	0	0	111.3	H123 F278 D285 K286 V287 Q291 A292 R293	H123-T289 PolarHBondContact NE2-OG1 2.75Å; H123-T289 VanDerWaalsContact NE2-OG1 3.14Å; F278-T289 HydrophobicContact CB-CG2 3.93Å; F278-T289 VanDerWaalsContact CB-OG1 3.31Å; F278-T289 WeakPolarHBondContact CB-OG1 3.22Å; F278-T289 HydrophobicContact CD2-CG2 3.58Å; F278-T289 HydrophobicContact CE2-CG2 4.16Å; F278-T289 HydrophobicContact CG-CG2 3.76Å; D285-T289 WeakPolarHBondContact O-CB 3.44Å; D285-T289 PolarHBondContact O-N 3.02Å; D285-T289 PolarHBondContact O-OG1 3.43Å; K286-T289 WeakPolarHBondContact O-CB 3.29Å; K286-T289 PolarHBondContact O-N 3.3Å; V287-T289 VanDerWaalsContact C-N 3.32Å; V287-T289 PolarHBondContact O-N 3.14Å; T289-Q291 VanDerWaalsContact C-N 3.34Å; T289-Q291 PolarHBondContact O-N 3.15Å; T289-A292 PolarHBondContact O-N 2.94Å; T289-R293 WeakPolarHBondContact O-CB 3.48Å; T289-R293 PolarHBondContact O-N 3.15Å
290	V	95.9	Very high	92.7	Very high	90 Å²	90	55.7 Å²	55.7	55%	0.545	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-43.5	175.9	175.8	0	0	0	0	110.9	K286 V287 R293 D294	K286-V290 WeakPolarHBondContact O-CG2 3.37Å; K286-V290 PolarHBondContact O-N 3.34Å; K286-V290 VanDerWaalsContact O-N 3.17Å; V287-V290 PolarHBondContact O-N 3.09Å; V290-R293 PolarHBondContact O-N 3.47Å; V290-D294 WeakPolarHBondContact O-CB 3.37Å; V290-D294 PolarHBondContact O-N 3.3Å
291	Q	97.5	Very high	93.6	Very high	53 Å²	53	54.3 Å²	54.3	25%	0.248	28%	0.275	C	S	.	.	H	α-helix	trans	-65	-40.8	177.2	-66.7	172.9	-10.8	0	0	112.4	V287 K288 T289 D294 L295 H316 P317 Y318	V287-Q291 WeakPolarHBondContact O-CG 3.45Å; V287-Q291 PolarHBondContact O-N 3.46Å; K288-Q291 PolarHBondContact O-N 2.96Å; T289-Q291 VanDerWaalsContact C-N 3.34Å; T289-Q291 PolarHBondContact O-N 3.15Å; Q291-D294 PolarHBondContact O-N 3.47Å; Q291-L295 PolarHBondContact O-N 2.89Å; Q291-H316 PolarHBondContact O-CE1 2.79Å; Q291-P317 HydrophobicContact CG-CB 4.36Å; Q291-Y318 HydrophobicContact CB-CD2 4.02Å; Q291-Y318 HydrophobicContact CB-CG 4.39Å
292	A	97.7	Very high	94.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-44.6	177.7	0	0	0	0	0	111.2	M213 F278 K288 T289 L295 L296 Y318	M213-A292 HydrophobicContact CE-CB 3.74Å; M213-A292 VanDerWaalsContact CE-O 3.24Å; M213-A292 WeakPolarHBondContact CE-O 3.33Å; F278-A292 HydrophobicContact CD1-CB 4.21Å; F278-A292 HydrophobicContact CE1-CB 3.68Å; F278-A292 HydrophobicContact CZ-CB 4.47Å; K288-A292 VanDerWaalsContact O-CB 3.31Å; K288-A292 WeakPolarHBondContact O-CB 3.37Å; K288-A292 PolarHBondContact O-N 3.38Å; T289-A292 PolarHBondContact O-N 2.94Å; A292-L295 PolarHBondContact O-N 3.25Å; A292-L296 PolarHBondContact O-N 3.4Å; A292-Y318 HydrophobicContact CB-CD1 4.32Å; A292-Y318 HydrophobicContact CB-CD2 4.04Å; A292-Y318 HydrophobicContact CB-CE1 3.96Å; A292-Y318 HydrophobicContact CB-CE2 3.68Å; A292-Y318 HydrophobicContact CB-CG 4.35Å
293	R	97.8	Very high	95.2	Very high	26 Å²	26	44.3 Å²	44.3	10%	0.098	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-40.3	176.3	-172.8	-176.5	-65.1	126.2	5.6	112.1	F269 F273 D275 F278 T289 V290 L296 S297	F269-R293 HydrophobicContact CB-CG 3.96Å; F273-R293 VanDerWaalsContact O-CZ 3.31Å; F273-R293 PolarHBondContact O-NE 3.35Å; F273-R293 PolarHBondContact O-NH2 2.77Å; D275-R293 IonicContact OD1-CZ 3.31Å; D275-R293 VanDerWaalsContact OD1-CZ 3.31Å; D275-R293 IonicContact OD1-NH1 3.06Å; D275-R293 PolarHBondContact OD1-NH1 3.08Å; D275-R293 IonicContact OD1-NH2 2.66Å; D275-R293 PolarHBondContact OD1-NH2 3.25Å; F278-R293 HydrophobicContact CZ-CB 4.37Å; T289-R293 WeakPolarHBondContact O-CB 3.48Å; T289-R293 PolarHBondContact O-N 3.15Å; V290-R293 PolarHBondContact O-N 3.47Å; R293-L296 WeakPolarHBondContact O-CB 3.47Å; R293-L296 PolarHBondContact O-N 3.46Å; R293-S297 PolarHBondContact O-N 2.97Å
294	D	98.5	Very high	95.8	Very high	62 Å²	62	38.5 Å²	38.5	33%	0.332	20%	0.198	S	C	.	.	H	α-helix	trans	-61.6	-45.8	174.6	-178.2	54.7	0	0	0	111.3	V290 Q291 L296 S297 K298 H316	V290-D294 WeakPolarHBondContact O-CB 3.37Å; V290-D294 PolarHBondContact O-N 3.3Å; Q291-D294 PolarHBondContact O-N 3.47Å; D294-L296 PolarHBondContact O-N 3.27Å; D294-S297 PolarHBondContact O-N 2.94Å; D294-S297 VanDerWaalsContact O-N 3.13Å; D294-S297 PolarHBondContact O-OG 3.11Å; D294-K298 WeakPolarHBondContact O-CG 3.41Å; D294-K298 PolarHBondContact O-N 3.4Å; D294-K298 VanDerWaalsContact O-N 3.13Å; D294-K298 WeakPolarHBondContact OD1-CE 3.46Å; D294-K298 IonicContact OD1-NZ 3.74Å; D294-K298 WeakPolarHBondContact OD2-CE 3.3Å; D294-K298 IonicContact OD2-NZ 2.69Å; D294-K298 PolarHBondContact OD2-NZ 3.22Å; D294-H316 IonicContact OD2-CE1 2.61Å; D294-H316 IonicContact OD2-NE2 3.04Å; D294-H316 PolarHBondContact OD2-NE2 2.88Å
295	L	98.7	Very high	96.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-45.8	175.3	-173.5	57	0	0	0	111.9	M213 Q291 A292 S297 K298 M299 I308 H316 Y318 I319	M213-L295 HydrophobicContact CE-CB 4.4Å; M213-L295 HydrophobicContact CE-CD2 4.32Å; M213-L295 HydrophobicContact SD-CD2 4.08Å; M213-L295 HydrophobicContact SD-CG 4.29Å; Q291-L295 PolarHBondContact O-N 2.89Å; A292-L295 PolarHBondContact O-N 3.25Å; L295-S297 VanDerWaalsContact C-N 3.28Å; L295-S297 PolarHBondContact O-N 3.49Å; L295-K298 PolarHBondContact O-N 2.91Å; L295-K298 VanDerWaalsContact O-N 3.11Å; L295-M299 HydrophobicContact CD1-CE 3.74Å; L295-M299 HydrophobicContact CD1-CG 4.27Å; L295-M299 HydrophobicContact CD1-SD 4.42Å; L295-M299 HydrophobicContact CD2-CE 3.99Å; L295-M299 HydrophobicContact CG-CE 3.82Å; L295-M299 HydrophobicContact CG-CG 4.38Å; L295-M299 HydrophobicContact CG-SD 4.12Å; L295-M299 WeakPolarHBondContact O-CG 3.35Å; L295-M299 PolarHBondContact O-N 2.96Å; L295-I308 HydrophobicContact CD1-CD1 4.36Å; L295-H316 HydrophobicContact CD1-CB 3.92Å; L295-Y318 HydrophobicContact CD2-CD1 3.99Å; L295-I319 HydrophobicContact CD2-CD1 3.88Å; L295-I319 HydrophobicContact CD2-CG1 3.62Å
296	L	98.4	Very high	96.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-55.5	-43.7	174.4	-83	164.7	0	0	0	111.7	M213 V217 F269 F273 F278 A292 R293 D294 K298 M299 L300	M213-L296 HydrophobicContact CB-CD2 3.87Å; M213-L296 HydrophobicContact CE-CD1 4.22Å; M213-L296 HydrophobicContact CE-CG 3.91Å; M213-L296 HydrophobicContact CG-CD1 4.4Å; M213-L296 HydrophobicContact CG-CD2 3.71Å; M213-L296 HydrophobicContact CG-CG 3.98Å; M213-L296 HydrophobicContact SD-CD2 3.92Å; M213-L296 HydrophobicContact SD-CG 3.74Å; V217-L296 HydrophobicContact CG2-CD1 4.46Å; F269-L296 HydrophobicContact CD1-CB 4.11Å; F269-L296 HydrophobicContact CE1-CB 4.11Å; F269-L296 WeakPolarHBondContact CE1-O 3.44Å; F273-L296 HydrophobicContact CD1-CD1 4.06Å; F273-L296 HydrophobicContact CD2-CD1 3.9Å; F273-L296 HydrophobicContact CE1-CD1 4.12Å; F273-L296 HydrophobicContact CE2-CB 4.27Å; F273-L296 HydrophobicContact CE2-CD1 3.94Å; F273-L296 HydrophobicContact CE2-CD2 4.34Å; F273-L296 HydrophobicContact CE2-CG 4.42Å; F273-L296 HydrophobicContact CG-CD1 3.94Å; F273-L296 HydrophobicContact CZ-CD1 4.05Å; F273-L296 HydrophobicContact CZ-CD2 4.11Å; F278-L296 HydrophobicContact CZ-CD1 4.23Å; A292-L296 PolarHBondContact O-N 3.4Å; R293-L296 WeakPolarHBondContact O-CB 3.47Å; R293-L296 PolarHBondContact O-N 3.46Å; D294-L296 PolarHBondContact O-N 3.27Å; L296-K298 PolarHBondContact O-N 2.65Å; L296-M299 PolarHBondContact O-N 3.36Å; L296-L300 HydrophobicContact CD2-CD1 4.12Å; L296-L300 WeakPolarHBondContact O-CB 3.44Å; L296-L300 PolarHBondContact O-N 2.69Å
297	S	98.3	Very high	97.1	Very high	38 Å²	38	38.3 Å²	38.3	27%	0.266	21%	0.207	S	C	.	.	H	α-helix	trans	-64.9	-27.7	179.5	80.6	0	0	0	0	113.8	F269 R293 D294 L295 V301	F269-S297 VanDerWaalsContact CE1-CA 3.44Å; R293-S297 PolarHBondContact O-N 2.97Å; D294-S297 PolarHBondContact O-N 2.94Å; D294-S297 VanDerWaalsContact O-N 3.13Å; D294-S297 PolarHBondContact O-OG 3.11Å; L295-S297 VanDerWaalsContact C-N 3.28Å; L295-S297 PolarHBondContact O-N 3.49Å; S297-V301 WeakPolarHBondContact O-CG2 3.34Å
298	K	98.6	Very high	97.3	Very high	79 Å²	79	35.7 Å²	35.7	34%	0.343	19%	0.19	S	C	.	.	H	α-helix	trans	-86.3	-28	177.9	-70.5	172.3	-179.9	166	0	113	D294 L295 L296 V301 I308	D294-K298 WeakPolarHBondContact O-CG 3.41Å; D294-K298 PolarHBondContact O-N 3.4Å; D294-K298 VanDerWaalsContact O-N 3.13Å; D294-K298 WeakPolarHBondContact OD1-CE 3.46Å; D294-K298 IonicContact OD1-NZ 3.74Å; D294-K298 WeakPolarHBondContact OD2-CE 3.3Å; D294-K298 IonicContact OD2-NZ 2.69Å; D294-K298 PolarHBondContact OD2-NZ 3.22Å; L295-K298 PolarHBondContact O-N 2.91Å; L295-K298 VanDerWaalsContact O-N 3.11Å; L296-K298 PolarHBondContact O-N 2.65Å; K298-V301 WeakPolarHBondContact O-CG2 3.49Å; K298-I308 HydrophobicContact CB-CB 4.02Å; K298-I308 HydrophobicContact CB-CD1 4.16Å; K298-I308 HydrophobicContact CB-CG2 4.08Å; K298-I308 HydrophobicContact CD-CD1 4.2Å; K298-I308 VanDerWaalsContact O-CG2 3.32Å; K298-I308 WeakPolarHBondContact O-CG2 3.34Å; K298-I308 PolarHBondContact O-N 3.33Å; K298-I308 VanDerWaalsContact O-N 3.13Å
299	M	98.5	Very high	97.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-83.8	-44.5	176.6	-67.2	-174.1	166.3	0	0	112.8	L134 I206 V209 L295 L296 V301 R307 I308 A313	L134-M299 HydrophobicContact CD1-CE 4.36Å; L134-M299 HydrophobicContact CD2-CE 4.32Å; I206-M299 HydrophobicContact CG2-CB 3.97Å; I206-M299 HydrophobicContact CG2-CG 3.81Å; V209-M299 HydrophobicContact CB-SD 4.4Å; V209-M299 HydrophobicContact CG1-CE 3.96Å; V209-M299 HydrophobicContact CG1-SD 3.95Å; L295-M299 HydrophobicContact CD1-CE 3.74Å; L295-M299 HydrophobicContact CD1-CG 4.27Å; L295-M299 HydrophobicContact CD1-SD 4.42Å; L295-M299 HydrophobicContact CD2-CE 3.99Å; L295-M299 HydrophobicContact CG-CE 3.82Å; L295-M299 HydrophobicContact CG-CG 4.38Å; L295-M299 HydrophobicContact CG-SD 4.12Å; L295-M299 WeakPolarHBondContact O-CG 3.35Å; L295-M299 PolarHBondContact O-N 2.96Å; L296-M299 PolarHBondContact O-N 3.36Å; M299-V301 PolarHBondContact O-N 3.13Å; M299-R307 WeakPolarHBondContact O-CD 3.41Å; M299-R307 WeakPolarHBondContact O-CG 3.1Å; M299-I308 HydrophobicContact CG-CG2 3.89Å; M299-A313 HydrophobicContact CE-CB 3.98Å
300	L	98.4	Very high	97.5	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	20%	0.195	C	C	.	.	S	Bend	trans	-85.1	58.3	-178.4	-66.8	-179.6	0	0	0	111.4	W207 I222 F223 L239 F269 F273 L296	W207-L300 HydrophobicContact CE3-CD2 4.5Å; I222-L300 HydrophobicContact CD1-CD1 3.97Å; F223-L300 HydrophobicContact CE2-CD2 4.07Å; L239-L300 HydrophobicContact CD1-CB 4.48Å; L239-L300 WeakPolarHBondContact CD1-O 3.3Å; L239-L300 HydrophobicContact CD2-CB 4.49Å; F269-L300 HydrophobicContact CE1-CB 4.07Å; F269-L300 HydrophobicContact CE1-CD1 4.2Å; F269-L300 HydrophobicContact CZ-CB 3.87Å; F273-L300 HydrophobicContact CE2-CD1 4.22Å; F273-L300 HydrophobicContact CZ-CD1 4.04Å; L296-L300 HydrophobicContact CD2-CD1 4.12Å; L296-L300 WeakPolarHBondContact O-CB 3.44Å; L296-L300 PolarHBondContact O-N 2.69Å
301	V	98.1	Very high	97.5	Very high	34 Å²	34	35.5 Å²	35.5	21%	0.206	19%	0.189	C	C	.	.			trans	-109.5	126.1	177.2	-179.1	0	0	0	0	109.1	S297 K298 M299 C306 R307	S297-V301 WeakPolarHBondContact O-CG2 3.34Å; K298-V301 WeakPolarHBondContact O-CG2 3.49Å; M299-V301 PolarHBondContact O-N 3.13Å; V301-C306 HydrophobicContact CG1-CB 3.91Å; V301-R307 HydrophobicContact CB-CB 4.09Å; V301-R307 HydrophobicContact CB-CG 4.25Å; V301-R307 PolarHBondContact O-NE 2.81Å; V301-R307 PolarHBondContact O-NH2 3.13Å
302	I	97.3	Very high	97.5	Very high	13 Å²	13	38.3 Å²	38.3	7%	0.067	20%	0.202	C	C	.	.	S	Bend	trans	-61.8	-47.5	-178.4	-65.6	175.8	0	0	0	110.6	P192 W232 V235 I236 L239 G240 P242 F246 P304 R307	P192-I302 HydrophobicContact CB-CG2 4.11Å; P192-I302 HydrophobicContact CG-CB 4.5Å; P192-I302 HydrophobicContact CG-CG2 4.13Å; W232-I302 HydrophobicContact CH2-CG2 4Å; W232-I302 HydrophobicContact CZ3-CG2 4.14Å; V235-I302 HydrophobicContact CG1-CD1 3.96Å; V235-I302 HydrophobicContact CG1-CG1 3.92Å; I236-I302 HydrophobicContact CG2-CD1 4.31Å; L239-I302 HydrophobicContact CB-CD1 4.03Å; L239-I302 HydrophobicContact CB-CG1 4.25Å; L239-I302 HydrophobicContact CD1-CG1 3.99Å; G240-I302 WeakPolarHBondContact O-CD1 3.45Å; P242-I302 HydrophobicContact CB-CD1 4.47Å; P242-I302 HydrophobicContact CB-CG2 3.97Å; P242-I302 HydrophobicContact CG-CG2 4.44Å; F246-I302 HydrophobicContact CD1-CG2 4.48Å; F246-I302 HydrophobicContact CD2-CG2 4.49Å; F246-I302 HydrophobicContact CE1-CG2 4.02Å; F246-I302 HydrophobicContact CE2-CG2 4.03Å; F246-I302 HydrophobicContact CZ-CG2 3.77Å; I302-P304 VanDerWaalsContact O-CD 3.3Å; I302-P304 WeakPolarHBondContact O-CD 3.41Å; I302-R307 PolarHBondContact O-NH2 2.96Å
303	D	96.6	Very high	97.5	Very high	18 Å²	18	38.3 Å²	38.3	10%	0.096	20%	0.202	C	C	.	.	S	Bend	trans	-75.1	115.3	-179.3	-165.5	-36.4	0	0	0	110.9	F246 R249 E305 C306 R307	F246-D303 HydrophobicContact CD2-CB 4.1Å; R249-D303 IonicContact CZ-OD1 3.71Å; R249-D303 IonicContact CZ-OD2 3.95Å; R249-D303 IonicContact NH1-OD1 2.9Å; R249-D303 IonicContact NH2-OD1 2.63Å; R249-D303 PolarHBondContact NH2-OD1 3.44Å; R249-D303 IonicContact NH2-OD2 2.77Å; R249-D303 PolarHBondContact NH2-OD2 3.39Å; D303-E305 PolarHBondContact O-N 2.98Å; D303-E305 WeakPolarHBondContact OD1-CB 3.35Å; D303-E305 PolarHBondContact OD1-N 3.38Å; D303-C306 HydrophobicContact CB-CB 4.35Å; D303-C306 PolarHBondContact O-N 2.92Å; D303-C306 VanDerWaalsContact O-N 3.11Å; D303-R307 PolarHBondContact O-N 3.49Å; D303-R307 VanDerWaalsContact O-N 3.15Å
304	P	95.9	Very high	97.5	Very high	15 Å²	15	37 Å²	37	10%	0.097	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-16.8	178.7	28.9	-36.1	0	0	0	113.5	N203 I302 C306	N203-P304 PolarHBondContact ND2-O 3.48Å; I302-P304 VanDerWaalsContact O-CD 3.3Å; I302-P304 WeakPolarHBondContact O-CD 3.41Å; P304-C306 VanDerWaalsContact C-N 3.32Å
305	E	95	Very high	97.5	Very high	139 Å²	139	38.1 Å²	38.1	65%	0.65	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.3	174.1	-73.8	177	-171	0	0	112.7	R249 D303	R249-E305 IonicContact CZ-OE1 3.97Å; R249-E305 IonicContact CZ-OE2 3.53Å; R249-E305 VanDerWaalsContact NH1-CG 3.31Å; R249-E305 IonicContact NH1-OE1 3.56Å; R249-E305 PolarHBondContact NH1-OE1 2.96Å; R249-E305 IonicContact NH1-OE2 2.71Å; D303-E305 PolarHBondContact O-N 2.98Å; D303-E305 WeakPolarHBondContact OD1-CB 3.35Å; D303-E305 PolarHBondContact OD1-N 3.38Å
306	C	96.2	Very high	97.5	Very high	96 Å²	96	38.4 Å²	38.4	65%	0.649	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-7.7	177	-57.5	0	0	0	0	113.1	V301 D303 P304	V301-C306 HydrophobicContact CG1-CB 3.91Å; D303-C306 HydrophobicContact CB-CB 4.35Å; D303-C306 PolarHBondContact O-N 2.92Å; D303-C306 VanDerWaalsContact O-N 3.11Å; P304-C306 VanDerWaalsContact C-N 3.32Å
307	R	98.1	Very high	97.5	Very high	10 Å²	10	41.9 Å²	41.9	4%	0.038	22%	0.224	C	C	.	.	S	Bend	trans	-76.9	135.3	-179.7	-166.6	-176	-55.7	141.5	4	110.4	E193 N203 I206 M299 V301 I302 D303	E193-R307 IonicContact OE1-CZ 3.51Å; E193-R307 IonicContact OE1-NH1 3.3Å; E193-R307 PolarHBondContact OE1-NH1 3.45Å; E193-R307 IonicContact OE1-NH2 2.93Å; E193-R307 PolarHBondContact OE1-NH2 3.22Å; E193-R307 IonicContact OE2-CZ 2.79Å; E193-R307 IonicContact OE2-NH1 3.14Å; E193-R307 IonicContact OE2-NH2 3.26Å; E193-R307 PolarHBondContact OE2-NH2 3.24Å; N203-R307 PolarHBondContact ND2-O 3.46Å; N203-R307 WeakPolarHBondContact O-CD 3.49Å; N203-R307 PolarHBondContact O-NH1 3.01Å; I206-R307 HydrophobicContact CG2-CG 3.98Å; M299-R307 WeakPolarHBondContact O-CD 3.41Å; M299-R307 WeakPolarHBondContact O-CG 3.1Å; V301-R307 HydrophobicContact CB-CB 4.09Å; V301-R307 HydrophobicContact CB-CG 4.25Å; V301-R307 PolarHBondContact O-NE 2.81Å; V301-R307 PolarHBondContact O-NH2 3.13Å; I302-R307 PolarHBondContact O-NH2 2.96Å; D303-R307 PolarHBondContact O-N 3.49Å; D303-R307 VanDerWaalsContact O-N 3.15Å
308	I	98.4	Very high	97.5	Very high	16 Å²	16	40.3 Å²	40.3	8%	0.082	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-52.9	141.4	178	-164.3	172.6	0	0	0	111.7	I206 L295 K298 M299 E312 A313	I206-I308 HydrophobicContact CG2-CG2 3.77Å; L295-I308 HydrophobicContact CD1-CD1 4.36Å; K298-I308 HydrophobicContact CB-CB 4.02Å; K298-I308 HydrophobicContact CB-CD1 4.16Å; K298-I308 HydrophobicContact CB-CG2 4.08Å; K298-I308 HydrophobicContact CD-CD1 4.2Å; K298-I308 VanDerWaalsContact O-CG2 3.32Å; K298-I308 WeakPolarHBondContact O-CG2 3.34Å; K298-I308 PolarHBondContact O-N 3.33Å; K298-I308 VanDerWaalsContact O-N 3.13Å; M299-I308 HydrophobicContact CG-CG2 3.89Å; I308-E312 HydrophobicContact CD1-CB 3.88Å; I308-E312 HydrophobicContact CG1-CB 3.41Å; I308-E312 VanDerWaalsContact CG1-CB 3.41Å; I308-A313 HydrophobicContact CD1-CB 4.15Å; I308-A313 HydrophobicContact CG1-CB 4.46Å
309	S	97.5	Very high	97.5	Very high	39 Å²	39	36.5 Å²	36.5	27%	0.273	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-78.3	165.9	172.8	65.1	0	0	0	0	112	E311 E312 A313	S309-E311 VanDerWaalsContact C-N 3.29Å; S309-E311 PolarHBondContact O-N 2.87Å; S309-E312 WeakPolarHBondContact CB-OE2 3.19Å; S309-E312 PolarHBondContact N-OE2 2.88Å; S309-E312 PolarHBondContact O-N 3.29Å; S309-E312 WeakPolarHBondContact OG-CB 3.43Å; S309-E312 WeakPolarHBondContact OG-CG 3.46Å; S309-E312 PolarHBondContact OG-N 3.15Å; S309-E312 PolarHBondContact OG-OE2 3.11Å; S309-A313 WeakPolarHBondContact O-CB 3.37Å; S309-A313 PolarHBondContact O-N 3.43Å
310	V	96.5	Very high	97.4	Very high	13 Å²	13	40.8 Å²	40.8	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-41.2	174	-175.6	0	0	0	0	111.1	L134 I137 R138 I206 A313 L314	L134-V310 HydrophobicContact CD2-CG1 4.25Å; I137-V310 HydrophobicContact CG2-CG1 4.49Å; I137-V310 HydrophobicContact CG2-CG2 3.9Å; R138-V310 HydrophobicContact CB-CG1 3.89Å; I206-V310 HydrophobicContact CD1-CB 4.34Å; I206-V310 HydrophobicContact CD1-CG2 3.75Å; I206-V310 HydrophobicContact CG1-CG2 3.87Å; V310-A313 PolarHBondContact O-N 3.3Å; V310-L314 HydrophobicContact CG1-CD1 4.22Å; V310-L314 WeakPolarHBondContact O-CG 3.42Å; V310-L314 PolarHBondContact O-N 2.73Å
311	E	95.6	Very high	97.3	Very high	90 Å²	90	45.6 Å²	45.6	42%	0.421	25%	0.245	S	C	.	.	H	α-helix	trans	-57.4	-51.7	176.9	-171.3	82.3	-130.3	0	0	111.6	R138 S309 A313 L314 H315	R138-E311 IonicContact CZ-OE1 3.73Å; R138-E311 VanDerWaalsContact CZ-OE1 3.3Å; R138-E311 IonicContact CZ-OE2 3.59Å; R138-E311 VanDerWaalsContact CZ-OE2 3.26Å; R138-E311 IonicContact NH1-OE1 2.96Å; R138-E311 PolarHBondContact NH1-OE1 3.29Å; R138-E311 IonicContact NH1-OE2 2.94Å; R138-E311 PolarHBondContact NH1-OE2 3.35Å; R138-E311 VanDerWaalsContact NH1-OE2 3.14Å; R138-E311 VanDerWaalsContact NH2-CD 3.28Å; R138-E311 IonicContact NH2-OE1 3.76Å; R138-E311 PolarHBondContact NH2-OE1 2.96Å; R138-E311 IonicContact NH2-OE2 3.26Å; R138-E311 PolarHBondContact NH2-OE2 2.92Å; S309-E311 VanDerWaalsContact C-N 3.29Å; S309-E311 PolarHBondContact O-N 2.87Å; E311-A313 VanDerWaalsContact C-N 3.33Å; E311-A313 PolarHBondContact O-N 3.48Å; E311-L314 PolarHBondContact O-N 3.02Å; E311-H315 PolarHBondContact O-N 3Å; E311-H315 PolarHBondContact O-ND1 2.69Å; E311-H315 IonicContact OE1-CE1 3.1Å
312	E	97.7	Very high	97.3	Very high	112 Å²	112	47.5 Å²	47.5	52%	0.523	25%	0.248	S	C	.	.	H	α-helix	trans	-67.6	-35.1	-179.8	-69.6	162.7	141.8	0	0	111.7	I308 S309 H315 H316	I308-E312 HydrophobicContact CD1-CB 3.88Å; I308-E312 HydrophobicContact CG1-CB 3.41Å; I308-E312 VanDerWaalsContact CG1-CB 3.41Å; S309-E312 WeakPolarHBondContact CB-OE2 3.19Å; S309-E312 PolarHBondContact N-OE2 2.88Å; S309-E312 PolarHBondContact O-N 3.29Å; S309-E312 WeakPolarHBondContact OG-CB 3.43Å; S309-E312 WeakPolarHBondContact OG-CG 3.46Å; S309-E312 PolarHBondContact OG-N 3.15Å; S309-E312 PolarHBondContact OG-OE2 3.11Å; E312-H315 CarbonylContact O-C 3.58Å; E312-H315 PolarHBondContact O-N 2.91Å; E312-H316 PolarHBondContact O-N 3.11Å; E312-H316 VanDerWaalsContact O-N 3.08Å
313	A	98.3	Very high	97.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66	-38.2	176.6	0	0	0	0	0	112.3	L134 I206 M299 I308 S309 V310 E311 H315 H316 I319	L134-A313 HydrophobicContact CD1-CB 3.96Å; L134-A313 HydrophobicContact CD2-CB 3.98Å; I206-A313 HydrophobicContact CD1-CB 4.36Å; M299-A313 HydrophobicContact CE-CB 3.98Å; I308-A313 HydrophobicContact CD1-CB 4.15Å; I308-A313 HydrophobicContact CG1-CB 4.46Å; S309-A313 WeakPolarHBondContact O-CB 3.37Å; S309-A313 PolarHBondContact O-N 3.43Å; V310-A313 PolarHBondContact O-N 3.3Å; E311-A313 VanDerWaalsContact C-N 3.33Å; E311-A313 PolarHBondContact O-N 3.48Å; A313-H315 VanDerWaalsContact C-N 3.27Å; A313-H315 PolarHBondContact O-N 3.34Å; A313-H316 WeakPolarHBondContact O-CB 3.26Å; A313-H316 PolarHBondContact O-N 3.15Å; A313-I319 WeakPolarHBondContact O-CB 3.47Å
314	L	97.8	Very high	97.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-65.3	-30.9	174.3	-77.3	164.7	0	0	0	112.8	Y131 L134 R138 V310 E311 H316 I319 Y323 A328	Y131-L314 HydrophobicContact CD2-CD2 3.8Å; Y131-L314 HydrophobicContact CE2-CD2 3.88Å; L134-L314 HydrophobicContact CB-CD2 3.61Å; L134-L314 HydrophobicContact CB-CG 3.94Å; L134-L314 HydrophobicContact CD1-CD2 4.4Å; R138-L314 HydrophobicContact CB-CD1 4.31Å; R138-L314 HydrophobicContact CG-CD1 4.46Å; V310-L314 HydrophobicContact CG1-CD1 4.22Å; V310-L314 WeakPolarHBondContact O-CG 3.42Å; V310-L314 PolarHBondContact O-N 2.73Å; E311-L314 PolarHBondContact O-N 3.02Å; L314-H316 VanDerWaalsContact C-N 3.33Å; L314-I319 HydrophobicContact CD2-CG2 4.4Å; L314-Y323 HydrophobicContact CB-CD2 4.27Å; L314-Y323 HydrophobicContact CB-CE2 4.4Å; L314-A328 HydrophobicContact CD1-CB 4.32Å
315	H	97.8	Very high	97.1	Very high	84 Å²	84	54.4 Å²	54.4	39%	0.389	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	1.2	175.7	-68.6	90.7	0	0	0	113.5	E311 E312 A313	E311-H315 PolarHBondContact O-N 3Å; E311-H315 PolarHBondContact O-ND1 2.69Å; E311-H315 IonicContact OE1-CE1 3.1Å; E312-H315 CarbonylContact O-C 3.58Å; E312-H315 PolarHBondContact O-N 2.91Å; A313-H315 VanDerWaalsContact C-N 3.27Å; A313-H315 PolarHBondContact O-N 3.34Å
316	H	98.6	Very high	96.9	Very high	7 Å²	7	51.3 Å²	51.3	3%	0.032	28%	0.283	C	S	.	.	S	Bend	trans	-66.8	138.5	177.7	-169.1	-91.1	0	0	0	110.6	Q291 D294 L295 E312 A313 L314 Y318 I319 H320	Q291-H316 PolarHBondContact O-CE1 2.79Å; D294-H316 IonicContact OD2-CE1 2.61Å; D294-H316 IonicContact OD2-NE2 3.04Å; D294-H316 PolarHBondContact OD2-NE2 2.88Å; L295-H316 HydrophobicContact CD1-CB 3.92Å; E312-H316 PolarHBondContact O-N 3.11Å; E312-H316 VanDerWaalsContact O-N 3.08Å; A313-H316 WeakPolarHBondContact O-CB 3.26Å; A313-H316 PolarHBondContact O-N 3.15Å; L314-H316 VanDerWaalsContact C-N 3.33Å; H316-Y318 WeakPolarHBondContact ND1-CB 3.31Å; H316-Y318 PolarHBondContact ND1-N 2.69Å; H316-Y318 PolarHBondContact O-N 3.27Å; H316-I319 PolarHBondContact O-N 3.23Å; H316-H320 WeakPolarHBondContact O-CB 3.39Å; H316-H320 PolarHBondContact O-N 3.38Å
317	P	98	Very high	96.8	Very high	72 Å²	72	48.9 Å²	48.9	47%	0.468	26%	0.262	S	S	.	.	H	α-helix	trans	-52.9	-33.1	-176.5	-30	35.6	0	0	0	115.3	Q291 I319	Q291-P317 HydrophobicContact CG-CB 4.36Å; P317-I319 VanDerWaalsContact C-N 3.29Å; P317-I319 PolarHBondContact O-N 3.44Å
318	Y	98.1	Very high	96.4	Very high	5 Å²	5	48.5 Å²	48.5	2%	0.02	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-27.3	176.5	-165.5	-117.1	0	0	0	113.9	H123 M126 S127 L130 M213 K288 Q291 A292 L295 H316	H123-Y318 HydrophobicContact CB-CE2 4.27Å; H123-Y318 AromaticContact ND1-CE2 3.51Å; H123-Y318 AromaticContact ND1-CZ 3.63Å; H123-Y318 PolarHBondContact ND1-OH 2.88Å; M126-Y318 PolarHBondContact SD-OH 3.38Å; S127-Y318 WeakPolarHBondContact CB-O 3.34Å; L130-Y318 HydrophobicContact CD1-CE1 4.07Å; M213-Y318 HydrophobicContact CE-CD1 4.06Å; M213-Y318 HydrophobicContact CE-CE1 3.76Å; K288-Y318 HydrophobicContact CB-CD2 4.49Å; K288-Y318 HydrophobicContact CB-CE2 4.12Å; K288-Y318 WeakPolarHBondContact O-CE2 3.15Å; Q291-Y318 HydrophobicContact CB-CD2 4.02Å; Q291-Y318 HydrophobicContact CB-CG 4.39Å; A292-Y318 HydrophobicContact CB-CD1 4.32Å; A292-Y318 HydrophobicContact CB-CD2 4.04Å; A292-Y318 HydrophobicContact CB-CE1 3.96Å; A292-Y318 HydrophobicContact CB-CE2 3.68Å; A292-Y318 HydrophobicContact CB-CG 4.35Å; L295-Y318 HydrophobicContact CD2-CD1 3.99Å; H316-Y318 WeakPolarHBondContact ND1-CB 3.31Å; H316-Y318 PolarHBondContact ND1-N 2.69Å; H316-Y318 PolarHBondContact O-N 3.27Å
319	I	98.2	Very high	96	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-107.9	-36.2	-173.6	-58.8	-57.9	0	0	0	111.4	L130 Y131 L134 L295 A313 L314 H316 P317 V321 W322	L130-I319 HydrophobicContact CB-CD1 3.67Å; L130-I319 HydrophobicContact CD1-CD1 4.28Å; Y131-I319 HydrophobicContact CD2-CG2 3.87Å; Y131-I319 HydrophobicContact CG-CG2 4.42Å; L134-I319 HydrophobicContact CD1-CG1 4.19Å; L134-I319 HydrophobicContact CD1-CG2 4.01Å; L295-I319 HydrophobicContact CD2-CD1 3.88Å; L295-I319 HydrophobicContact CD2-CG1 3.62Å; A313-I319 WeakPolarHBondContact O-CB 3.47Å; L314-I319 HydrophobicContact CD2-CG2 4.4Å; H316-I319 PolarHBondContact O-N 3.23Å; P317-I319 VanDerWaalsContact C-N 3.29Å; P317-I319 PolarHBondContact O-N 3.44Å; I319-V321 PolarHBondContact O-N 3.06Å; I319-W322 PolarHBondContact O-N 3.13Å
320	H	97.2	Very high	95.5	Very high	90 Å²	90	50.3 Å²	50.3	42%	0.417	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-21.9	-171.4	-173.6	66.7	0	0	0	114	H316 W322 Y323	H316-H320 WeakPolarHBondContact O-CB 3.39Å; H316-H320 PolarHBondContact O-N 3.38Å; H320-W322 PolarHBondContact O-N 2.71Å; H320-W322 VanDerWaalsContact O-N 3.09Å; H320-Y323 VanDerWaalsContact O-CB 3.32Å; H320-Y323 WeakPolarHBondContact O-CB 3.48Å; H320-Y323 PolarHBondContact O-N 2.66Å
321	V	96.8	Very high	94.9	Very high	105 Å²	105	54.9 Å²	54.9	64%	0.636	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-23.6	174.2	-58.2	0	0	0	0	113.3	I319	I319-V321 PolarHBondContact O-N 3.06Å
322	W	97.3	Very high	94.2	Very high	74 Å²	74	53.7 Å²	53.7	28%	0.28	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-1.7	178.7	-56.1	114.7	0	0	0	113.7	E124 S127 Y128 Y131 I319 H320 D324	E124-W322 HydrophobicContact CB-CZ2 4.46Å; E124-W322 HydrophobicContact CG-CH2 3.6Å; E124-W322 HydrophobicContact CG-CZ2 3.39Å; S127-W322 PolarHBondContact OG-NE1 3.17Å; Y128-W322 HydrophobicContact CD2-CB 4.44Å; Y128-W322 AromaticContact CD2-CD2 3.72Å; Y128-W322 HydrophobicContact CD2-CD2 3.72Å; Y128-W322 AromaticContact CD2-CE3 3.89Å; Y128-W322 HydrophobicContact CD2-CE3 3.89Å; Y128-W322 AromaticContact CD2-CG 3.96Å; Y128-W322 HydrophobicContact CD2-CG 3.96Å; Y128-W322 HydrophobicContact CD2-CZ3 4.43Å; Y128-W322 HydrophobicContact CE2-CE3 4.39Å; Y128-W322 HydrophobicContact CG-CD2 4.36Å; Y131-W322 HydrophobicContact CD1-CB 3.53Å; Y131-W322 HydrophobicContact CD1-CG 4.35Å; Y131-W322 HydrophobicContact CD2-CB 3.9Å; Y131-W322 HydrophobicContact CE1-CB 3.94Å; Y131-W322 VanDerWaalsContact CE1-O 3.3Å; Y131-W322 WeakPolarHBondContact CE1-O 3.22Å; Y131-W322 HydrophobicContact CE2-CB 4.31Å; Y131-W322 HydrophobicContact CG-CB 3.5Å; Y131-W322 HydrophobicContact CG-CG 4.29Å; Y131-W322 PolarHBondContact OH-O 3.24Å; I319-W322 PolarHBondContact O-N 3.13Å; H320-W322 PolarHBondContact O-N 2.71Å; H320-W322 VanDerWaalsContact O-N 3.09Å; W322-D324 PolarHBondContact O-N 2.97Å
323	Y	96.8	Very high	93	Very high	54 Å²	54	49.3 Å²	49.3	21%	0.212	28%	0.282	C	S	.	.			trans	-65.7	108.7	-168.2	-177.4	-93.7	0	0	0	111.7	L314 H320 P325 A328 D329	L314-Y323 HydrophobicContact CB-CD2 4.27Å; L314-Y323 HydrophobicContact CB-CE2 4.4Å; H320-Y323 VanDerWaalsContact O-CB 3.32Å; H320-Y323 WeakPolarHBondContact O-CB 3.48Å; H320-Y323 PolarHBondContact O-N 2.66Å; Y323-P325 HydrophobicContact CD1-CG 4.45Å; Y323-P325 HydrophobicContact CE1-CG 3.85Å; Y323-A328 HydrophobicContact CD2-CB 4.13Å; Y323-A328 HydrophobicContact CE2-CB 3.57Å; Y323-D329 PolarHBondContact OH-OD2 3.12Å
324	D	95.9	Very high	91.5	Very high	65 Å²	65	58.5 Å²	58.5	35%	0.348	33%	0.325	S	S	.	.			trans	-110.4	119.9	166.3	-173.3	-13.3	0	0	0	110	Y131 W322 A326 E327 A328	Y131-D324 PolarHBondContact OH-N 3.35Å; Y131-D324 PolarHBondContact OH-O 2.79Å; W322-D324 PolarHBondContact O-N 2.97Å; D324-A326 PolarHBondContact O-N 3.35Å; D324-A326 WeakPolarHBondContact OD1-CB 3.38Å; D324-A326 PolarHBondContact OD1-N 2.93Å; D324-E327 HydrophobicContact CB-CB 4.24Å; D324-E327 HydrophobicContact CB-CG 3.83Å; D324-E327 PolarHBondContact O-N 2.87Å; D324-E327 VanDerWaalsContact O-N 3.1Å; D324-A328 WeakPolarHBondContact O-CB 3.38Å; D324-A328 PolarHBondContact O-N 2.93Å
325	P	93.2	Very high	90	Very high	71 Å²	71	60.1 Å²	60.1	46%	0.461	33%	0.333	S	S	.	.	H	α-helix	trans	-56.6	-33.7	173.5	-23	31.7	0	0	0	113.8	Y323 E327 D329	Y323-P325 HydrophobicContact CD1-CG 4.45Å; Y323-P325 HydrophobicContact CE1-CG 3.85Å; P325-E327 PolarHBondContact O-N 3.46Å; P325-D329 WeakPolarHBondContact O-CA 3.44Å; P325-D329 VanDerWaalsContact O-CB 3.25Å; P325-D329 WeakPolarHBondContact O-CB 3.46Å; P325-D329 PolarHBondContact O-N 2.97Å
326	A	91.9	Very high	88.1	Confident	75 Å²	75	58.9 Å²	58.9	62%	0.62	33%	0.334	S	S	*	.	H	α-helix	trans	-63.7	-23.9	179.3	0	0	0	0	0	112.2	D324	D324-A326 PolarHBondContact O-N 3.35Å; D324-A326 WeakPolarHBondContact OD1-CB 3.38Å; D324-A326 PolarHBondContact OD1-N 2.93Å
327	E	92.3	Very high	85.9	Confident	44 Å²	44	64.3 Å²	64.3	21%	0.206	36%	0.364	C	S	.	.	H	α-helix	trans	-99.5	-48	-178.7	-53.6	-176.3	159.4	0	0	111.3	H80 K81 Y131 D324 P325	H80-E327 PolarHBondContact NE2-O 3.32Å; H80-E327 VanDerWaalsContact NE2-O 3.08Å; K81-E327 HydrophobicContact CD-CG 4.38Å; K81-E327 WeakPolarHBondContact CE-OE1 3.47Å; K81-E327 WeakPolarHBondContact CE-OE2 3.41Å; K81-E327 IonicContact NZ-OE1 3.69Å; K81-E327 PolarHBondContact NZ-OE1 3.1Å; K81-E327 IonicContact NZ-OE2 2.67Å; K81-E327 PolarHBondContact NZ-OE2 3.48Å; Y131-E327 VanDerWaalsContact CE1-OE2 3.31Å; Y131-E327 WeakPolarHBondContact CE1-OE2 3.47Å; Y131-E327 PolarHBondContact OH-OE2 2.8Å; D324-E327 HydrophobicContact CB-CB 4.24Å; D324-E327 HydrophobicContact CB-CG 3.83Å; D324-E327 PolarHBondContact O-N 2.87Å; D324-E327 VanDerWaalsContact O-N 3.1Å; P325-E327 PolarHBondContact O-N 3.46Å
328	A	90.5	Very high	83.9	Confident	3 Å²	3	68.5 Å²	68.5	3%	0.025	37%	0.374	C	S	.	.	H	α-helix	trans	-69.3	-36.4	179.9	0	0	0	0	0	112.4	R138 L314 Y323 D324	R138-A328 WeakPolarHBondContact CD-O 3.35Å; R138-A328 WeakPolarHBondContact CG-O 3.16Å; R138-A328 PolarHBondContact NE-O 3.41Å; L314-A328 HydrophobicContact CD1-CB 4.32Å; Y323-A328 HydrophobicContact CD2-CB 4.13Å; Y323-A328 HydrophobicContact CE2-CB 3.57Å; D324-A328 WeakPolarHBondContact O-CB 3.38Å; D324-A328 PolarHBondContact O-N 2.93Å
329	D	89.1	Confident	81.9	Confident	73 Å²	73	71.2 Å²	71.2	39%	0.39	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	24.1	-175.1	-59.9	-56.8	0	0	0	112.9	R138 Y323 P325	R138-D329 IonicContact CZ-OD1 3.21Å; R138-D329 IonicContact NE-OD1 2.82Å; R138-D329 PolarHBondContact NE-OD1 2.5Å; R138-D329 IonicContact NH2-OD1 3.73Å; R138-D329 PolarHBondContact NH2-OD1 3.41Å; Y323-D329 PolarHBondContact OH-OD2 3.12Å; P325-D329 WeakPolarHBondContact O-CA 3.44Å; P325-D329 VanDerWaalsContact O-CB 3.25Å; P325-D329 WeakPolarHBondContact O-CB 3.46Å; P325-D329 PolarHBondContact O-N 2.97Å
330	A	88	Confident	80.1	Confident	20 Å²	20	71.8 Å²	71.8	17%	0.165	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-54.2	131.1	173.9	0	0	0	0	0	110.3	H139	H139-A330 PolarHBondContact ND1-O 3.03Å
331	P	84.9	Confident	78.2	Confident	108 Å²	108	71.8 Å²	71.8	70%	0.701	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-59.5	138.5	-170.5	23.2	-33.6	0	0	0	111.4	H139	H139-P331 PolarHBondContact CE1-O 3.03Å
332	P	79.9	Confident	76.5	Confident	66 Å²	66	70.5 Å²	70.5	43%	0.429	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-62.8	149.2	-178.7	23.2	-32.1	0	0	0	111.3	S142 A143	S142-P332 WeakPolarHBondContact OG-CB 3.3Å; A143-P332 HydrophobicContact CB-CB 4.29Å
333	P	72.3	Confident	75.2	Confident	20 Å²	20	73 Å²	73	13%	0.13	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-64.3	138.4	170.6	28.8	-35.8	0	0	0	110.1	C77 V78 H139 A143 I335	C77-P333 HydrophobicContact CB-CB 4.44Å; C77-P333 WeakPolarHBondContact O-CB 3.4Å; V78-P333 HydrophobicContact CG2-CG 4.09Å; H139-P333 WeakPolarHBondContact NE2-CD 3.43Å; A143-P333 HydrophobicContact CB-CG 3.62Å; P333-I335 VanDerWaalsContact C-N 3.29Å; P333-I335 HydrophobicContact CB-CG1 4.38Å; P333-I335 HydrophobicContact CG-CD1 4.22Å; P333-I335 HydrophobicContact CG-CG1 4.23Å; P333-I335 PolarHBondContact O-N 3.05Å
334	Q	67.3	Low	74.2	Confident	193 Å²	193	78.8 Å²	78.8	90%	0.902	42%	0.416	S	S	*	.			trans	-74.3	86.1	173	-68.8	-170.2	0.7	0	0	109.4	S336	Q334-S336 PolarHBondContact O-N 3.08Å
335	I	66.7	Low	73.7	Confident	33 Å²	33	77.7 Å²	77.7	17%	0.169	41%	0.409	C	S	.	.			trans	-83	117.6	173.4	-56.1	166.7	0	0	0	107.7	L74 C77 A143 I145 P333 D337 L340	L74-I335 HydrophobicContact CD2-CD1 4.38Å; C77-I335 HydrophobicContact CB-CG1 3.84Å; A143-I335 HydrophobicContact CB-CD1 3.82Å; I145-I335 HydrophobicContact CD1-CD1 3.41Å; I145-I335 VanDerWaalsContact CD1-CD1 3.41Å; I145-I335 HydrophobicContact CG1-CD1 3.94Å; P333-I335 VanDerWaalsContact C-N 3.29Å; P333-I335 HydrophobicContact CB-CG1 4.38Å; P333-I335 HydrophobicContact CG-CD1 4.22Å; P333-I335 HydrophobicContact CG-CG1 4.23Å; P333-I335 PolarHBondContact O-N 3.05Å; I335-D337 PolarHBondContact O-N 3.12Å; I335-D337 VanDerWaalsContact O-N 3.12Å; I335-L340 HydrophobicContact CD1-CD1 4.12Å; I335-L340 HydrophobicContact CG2-CD1 3.48Å; I335-L340 VanDerWaalsContact CG2-CD1 3.48Å; I335-L340 HydrophobicContact CG2-CG 3.81Å
336	S	57.6	Low	73.7	Confident	59 Å²	59	77 Å²	77	41%	0.413	40%	0.403	S	S	.	.			trans	-65.4	116.6	172.2	79.9	0	0	0	0	108.4	Q334 K338 Q339	Q334-S336 PolarHBondContact O-N 3.08Å; S336-K338 PolarHBondContact O-N 2.92Å; S336-Q339 PolarHBondContact O-N 3.25Å; S336-Q339 WeakPolarHBondContact OG-CG 3.31Å; S336-Q339 PolarHBondContact OG-OE1 3.29Å
337	D	52.3	Low	73.7	Confident	121 Å²	121	75.6 Å²	75.6	65%	0.647	39%	0.385	S	S	*	.	H	α-helix	trans	-50.2	-31.5	-173.2	-138.1	-7.6	0	0	0	112.2	I335 Q339 L340 E341	I335-D337 PolarHBondContact O-N 3.12Å; I335-D337 VanDerWaalsContact O-N 3.12Å; D337-Q339 PolarHBondContact O-N 3Å; D337-L340 PolarHBondContact O-N 2.84Å; D337-E341 WeakPolarHBondContact O-CG 3.42Å; D337-E341 PolarHBondContact O-N 3.08Å; D337-E341 VanDerWaalsContact O-N 3.1Å
338	K	54.9	Low	73.6	Confident	159 Å²	159	79 Å²	79	69%	0.691	40%	0.401	S	S	*	.	H	α-helix	trans	-64.4	-28	178.9	-65.1	-177	-179	177.9	0	115.4	S336	S336-K338 PolarHBondContact O-N 2.92Å
339	Q	56.8	Low	73.7	Confident	62 Å²	62	82.8 Å²	82.8	29%	0.29	42%	0.418	S	S	.	.	H	α-helix	trans	-82	-23.3	-177.7	-76.6	175.4	-55.2	0	0	112.8	V73 S336 D337 E357	V73-Q339 HydrophobicContact CG1-CB 4.19Å; S336-Q339 PolarHBondContact O-N 3.25Å; S336-Q339 WeakPolarHBondContact OG-CG 3.31Å; S336-Q339 PolarHBondContact OG-OE1 3.29Å; D337-Q339 PolarHBondContact O-N 3Å; Q339-E357 PolarHBondContact NE2-OE1 3.26Å
340	L	59.9	Low	73.9	Confident	13 Å²	13	79.8 Å²	79.8	7%	0.068	40%	0.401	C	S	.	.	H	α-helix	trans	-108	-5.2	179	-66.8	-174.9	0	0	0	113.9	V73 L74 I335 D337 E342	V73-L340 HydrophobicContact CB-CD2 4.46Å; V73-L340 HydrophobicContact CG1-CD2 3.94Å; V73-L340 HydrophobicContact CG1-CG 4.47Å; L74-L340 HydrophobicContact CD2-CD1 3.68Å; L74-L340 HydrophobicContact CD2-CD2 4.17Å; L74-L340 HydrophobicContact CG-CD2 4.31Å; I335-L340 HydrophobicContact CD1-CD1 4.12Å; I335-L340 HydrophobicContact CG2-CD1 3.48Å; I335-L340 VanDerWaalsContact CG2-CD1 3.48Å; I335-L340 HydrophobicContact CG2-CG 3.81Å; D337-L340 PolarHBondContact O-N 2.84Å; L340-E342 PolarHBondContact O-N 3.49Å
341	E	58	Low	74.1	Confident	89 Å²	89	80.6 Å²	80.6	42%	0.416	40%	0.401	S	S	.	.	S	Bend	trans	-47.6	131	168.9	-93.8	176.4	-166.5	0	0	110.4	D337 R343	D337-E341 WeakPolarHBondContact O-CG 3.42Å; D337-E341 PolarHBondContact O-N 3.08Å; D337-E341 VanDerWaalsContact O-N 3.1Å; E341-R343 PolarHBondContact O-N 3.14Å; E341-R343 IonicContact OE2-CZ 3.77Å; E341-R343 IonicContact OE2-NE 3.02Å; E341-R343 PolarHBondContact OE2-NE 2.77Å; E341-R343 IonicContact OE2-NH2 3.33Å; E341-R343 PolarHBondContact OE2-NH2 3.48Å
342	E	61	Low	74.5	Confident	79 Å²	79	79.7 Å²	79.7	37%	0.369	39%	0.387	S	S	.	.			trans	-76.5	65.8	-175.9	-61.5	-153	128.9	0	0	112.2	R70 R172 T176 L340	R70-E342 IonicContact CZ-OE1 3.61Å; R70-E342 IonicContact NH1-OE1 3.53Å; R70-E342 PolarHBondContact NH1-OE1 2.63Å; R70-E342 IonicContact NH2-OE1 2.65Å; R70-E342 PolarHBondContact NH2-OE1 2.82Å; R172-E342 WeakPolarHBondContact CD-OE1 3.5Å; R172-E342 IonicContact NE-OE1 2.73Å; T176-E342 WeakPolarHBondContact CB-OE2 3.49Å; T176-E342 HydrophobicContact CG2-CG 3.83Å; T176-E342 VanDerWaalsContact CG2-OE2 3.26Å; T176-E342 WeakPolarHBondContact CG2-OE2 3Å; L340-E342 PolarHBondContact O-N 3.49Å
343	R	69.3	Low	75.1	Confident	125 Å²	125	78.7 Å²	78.7	47%	0.472	38%	0.378	S	S	.	.			trans	-75.6	137.7	169.3	-63.6	178.5	-170.3	-174	3.1	109.4	E341 H345	E341-R343 PolarHBondContact O-N 3.14Å; E341-R343 IonicContact OE2-CZ 3.77Å; E341-R343 IonicContact OE2-NE 3.02Å; E341-R343 PolarHBondContact OE2-NE 2.77Å; E341-R343 IonicContact OE2-NH2 3.33Å; E341-R343 PolarHBondContact OE2-NH2 3.48Å; R343-H345 WeakPolarHBondContact CB-NE2 3.41Å
344	E	77.3	Confident	76.1	Confident	177 Å²	177	77.7 Å²	77.7	83%	0.827	37%	0.372	S	S	*	.			trans	-84.5	119.3	166.9	-67.8	-168.7	162.6	0	0	107.8
345	H	85.1	Confident	77.3	Confident	41 Å²	41	70.2 Å²	70.2	19%	0.19	34%	0.336	C	S	.	.			trans	-119.5	151	178.1	-68.9	-66.8	0	0	0	109.6	R343 Q349 W350	R343-H345 WeakPolarHBondContact CB-NE2 3.41Å; H345-Q349 VanDerWaalsContact CA-OE1 3.3Å; H345-Q349 HydrophobicContact CB-CB 3.83Å; H345-Q349 PolarHBondContact ND1-OE1 3.2Å; H345-W350 HydrophobicContact CB-CD2 3.94Å; H345-W350 HydrophobicContact CB-CG 4.06Å; H345-W350 HydrophobicContact CB-CZ2 4.09Å; H345-W350 AromaticContact CD2-CE2 4Å; H345-W350 AromaticContact CD2-CH2 3.56Å; H345-W350 AromaticContact CD2-CZ2 3.62Å; H345-W350 AromaticContact CD2-CZ3 3.88Å; H345-W350 PolarHBondContact O-NE1 2.86Å
346	T	91.9	Very high	78.5	Confident	57 Å²	57	73.8 Å²	73.8	35%	0.35	35%	0.352	S	S	.	.			trans	-67.1	168.1	168.9	75.4	0	0	0	0	110.3	E348 Q349 W350	T346-E348 WeakPolarHBondContact CB-OE2 3.32Å; T346-E348 PolarHBondContact O-N 3.39Å; T346-E348 PolarHBondContact OG1-OE2 3.28Å; T346-E348 VanDerWaalsContact OG1-OE2 3.08Å; T346-Q349 PolarHBondContact O-N 2.98Å; T346-Q349 WeakPolarHBondContact OG1-CG 3.23Å; T346-Q349 PolarHBondContact OG1-N 2.89Å; T346-W350 VanDerWaalsContact O-CD1 3.27Å; T346-W350 PolarHBondContact O-N 3.39Å
347	I	91.9	Very high	80.1	Confident	45 Å²	45	71.9 Å²	71.9	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-39.2	179	-63.1	173.9	0	0	0	110	F59 Q62 W350 K351	F59-I347 HydrophobicContact CB-CG2 3.93Å; F59-I347 VanDerWaalsContact O-CG2 3.28Å; F59-I347 WeakPolarHBondContact O-CG2 3.41Å; Q62-I347 HydrophobicContact CG-CG1 3.82Å; I347-W350 PolarHBondContact O-N 3.17Å; I347-K351 VanDerWaalsContact O-CB 3.31Å; I347-K351 WeakPolarHBondContact O-CB 3.11Å; I347-K351 PolarHBondContact O-N 2.94Å
348	E	92	Very high	82	Confident	117 Å²	117	66.1 Å²	66.1	55%	0.547	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-44.5	179.2	-61	70	-152	0	0	111.1	T346 K351 E352	T346-E348 WeakPolarHBondContact CB-OE2 3.32Å; T346-E348 PolarHBondContact O-N 3.39Å; T346-E348 PolarHBondContact OG1-OE2 3.28Å; T346-E348 VanDerWaalsContact OG1-OE2 3.08Å; E348-K351 WeakPolarHBondContact O-CB 3.49Å; E348-K351 PolarHBondContact O-N 3.21Å; E348-E352 WeakPolarHBondContact O-CG 3.22Å; E348-E352 PolarHBondContact O-N 2.92Å
349	Q	92.4	Very high	83.7	Confident	81 Å²	81	60.7 Å²	60.7	38%	0.379	28%	0.283	S	S	.	.	H	α-helix	trans	-64.3	-41.8	175.5	-72.3	174.6	-21.6	0	0	112.1	H345 T346 K351 E352 L353	H345-Q349 VanDerWaalsContact CA-OE1 3.3Å; H345-Q349 HydrophobicContact CB-CB 3.83Å; H345-Q349 PolarHBondContact ND1-OE1 3.2Å; T346-Q349 PolarHBondContact O-N 2.98Å; T346-Q349 WeakPolarHBondContact OG1-CG 3.23Å; T346-Q349 PolarHBondContact OG1-N 2.89Å; Q349-K351 VanDerWaalsContact C-N 3.28Å; Q349-K351 PolarHBondContact O-N 3.36Å; Q349-E352 WeakPolarHBondContact O-CB 3.34Å; Q349-E352 PolarHBondContact O-N 3.12Å; Q349-L353 VanDerWaalsContact O-CG 3.3Å; Q349-L353 WeakPolarHBondContact O-CG 3.48Å; Q349-L353 PolarHBondContact O-N 3.44Å
350	W	92.1	Very high	85.2	Confident	11 Å²	11	61.5 Å²	61.5	4%	0.042	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-38.4	173.2	-79.1	123.3	0	0	0	112.1	A65 K66 Y69 H345 T346 I347 L353 I354	A65-W350 HydrophobicContact CB-CB 3.59Å; A65-W350 HydrophobicContact CB-CG 3.89Å; K66-W350 HydrophobicContact CB-CD2 4.46Å; K66-W350 HydrophobicContact CB-CZ2 3.86Å; K66-W350 HydrophobicContact CD-CZ2 3.9Å; K66-W350 HydrophobicContact CG-CH2 4.11Å; K66-W350 HydrophobicContact CG-CZ2 3.59Å; Y69-W350 AromaticContact CD1-CE3 3.91Å; Y69-W350 HydrophobicContact CD1-CE3 3.91Å; Y69-W350 HydrophobicContact CD1-CH2 4.16Å; Y69-W350 AromaticContact CD1-CZ3 3.28Å; Y69-W350 HydrophobicContact CD1-CZ3 3.28Å; Y69-W350 HydrophobicContact CD2-CE3 4.42Å; Y69-W350 HydrophobicContact CD2-CZ3 4.47Å; Y69-W350 AromaticContact CE1-CZ3 3.78Å; Y69-W350 HydrophobicContact CE1-CZ3 3.78Å; Y69-W350 AromaticContact CG-CE3 3.78Å; Y69-W350 HydrophobicContact CG-CE3 3.78Å; Y69-W350 AromaticContact CG-CZ3 3.66Å; Y69-W350 HydrophobicContact CG-CZ3 3.66Å; H345-W350 HydrophobicContact CB-CD2 3.94Å; H345-W350 HydrophobicContact CB-CG 4.06Å; H345-W350 HydrophobicContact CB-CZ2 4.09Å; H345-W350 AromaticContact CD2-CE2 4Å; H345-W350 AromaticContact CD2-CH2 3.56Å; H345-W350 AromaticContact CD2-CZ2 3.62Å; H345-W350 AromaticContact CD2-CZ3 3.88Å; H345-W350 PolarHBondContact O-NE1 2.86Å; T346-W350 VanDerWaalsContact O-CD1 3.27Å; T346-W350 PolarHBondContact O-N 3.39Å; I347-W350 PolarHBondContact O-N 3.17Å; W350-L353 HydrophobicContact CE3-CD1 3.84Å; W350-L353 HydrophobicContact CZ3-CD1 3.9Å; W350-L353 PolarHBondContact O-N 2.95Å; W350-I354 WeakPolarHBondContact O-CB 3.5Å; W350-I354 WeakPolarHBondContact O-CD1 3.33Å; W350-I354 VanDerWaalsContact O-CG1 3.22Å; W350-I354 WeakPolarHBondContact O-CG1 3.43Å; W350-I354 PolarHBondContact O-N 3.28Å
351	K	93.6	Very high	86.4	Confident	37 Å²	37	61.4 Å²	61.4	16%	0.161	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-44.1	177.6	-173.5	-173.7	-175.8	-172.8	0	111.2	F59 L96 E97 F99 I347 E348 Q349 Y355	F59-K351 HydrophobicContact CD1-CB 3.88Å; F59-K351 HydrophobicContact CD1-CG 4.04Å; F59-K351 HydrophobicContact CD2-CG 4.35Å; F59-K351 HydrophobicContact CE1-CB 3.96Å; F59-K351 HydrophobicContact CE1-CG 3.94Å; F59-K351 HydrophobicContact CE2-CG 4.26Å; F59-K351 HydrophobicContact CG-CB 4.44Å; F59-K351 HydrophobicContact CG-CG 4.27Å; F59-K351 HydrophobicContact CZ-CG 4.08Å; L96-K351 HydrophobicContact CD1-CD 4.4Å; L96-K351 HydrophobicContact CD1-CG 4.07Å; L96-K351 WeakPolarHBondContact O-CE 3.21Å; L96-K351 PolarHBondContact O-NZ 3.12Å; E97-K351 PolarHBondContact O-NZ 2.89Å; E97-K351 VanDerWaalsContact O-NZ 3.17Å; F99-K351 HydrophobicContact CD1-CG 3.75Å; F99-K351 HydrophobicContact CE1-CG 4.3Å; F99-K351 WeakPolarHBondContact O-CE 3.27Å; F99-K351 PolarHBondContact O-NZ 2.86Å; I347-K351 VanDerWaalsContact O-CB 3.31Å; I347-K351 WeakPolarHBondContact O-CB 3.11Å; I347-K351 PolarHBondContact O-N 2.94Å; E348-K351 WeakPolarHBondContact O-CB 3.49Å; E348-K351 PolarHBondContact O-N 3.21Å; Q349-K351 VanDerWaalsContact C-N 3.28Å; Q349-K351 PolarHBondContact O-N 3.36Å; K351-Y355 VanDerWaalsContact O-CB 3.3Å; K351-Y355 WeakPolarHBondContact O-CB 3.39Å; K351-Y355 PolarHBondContact O-N 3.15Å
352	E	93.5	Very high	87.6	Confident	89 Å²	89	59.2 Å²	59.2	42%	0.416	28%	0.278	S	S	.	.	H	α-helix	trans	-56.7	-55.1	172.5	-78.3	166.5	-168.1	0	0	111.2	L96 E348 Q349 I354 Y355 E356	L96-E352 HydrophobicContact CD1-CG 4.1Å; L96-E352 HydrophobicContact CD2-CG 3.47Å; L96-E352 VanDerWaalsContact CD2-CG 3.47Å; L96-E352 HydrophobicContact CG-CG 4.37Å; E348-E352 WeakPolarHBondContact O-CG 3.22Å; E348-E352 PolarHBondContact O-N 2.92Å; Q349-E352 WeakPolarHBondContact O-CB 3.34Å; Q349-E352 PolarHBondContact O-N 3.12Å; E352-I354 VanDerWaalsContact C-N 3.34Å; E352-I354 PolarHBondContact O-N 3.34Å; E352-Y355 WeakPolarHBondContact O-CB 3.47Å; E352-Y355 PolarHBondContact O-N 3.19Å; E352-Y355 VanDerWaalsContact O-N 3.07Å; E352-E356 WeakPolarHBondContact O-CG 3.34Å; E352-E356 PolarHBondContact O-N 3.27Å
353	L	92.2	Very high	88.6	Confident	44 Å²	44	61.1 Å²	61.1	23%	0.23	29%	0.286	C	S	.	.	H	α-helix	trans	-58.8	-42.7	-179.6	-70.3	171.3	0	0	0	112.7	Y69 Q349 W350 E357	Y69-L353 HydrophobicContact CD2-CB 3.98Å; Y69-L353 HydrophobicContact CE2-CB 3.67Å; Q349-L353 VanDerWaalsContact O-CG 3.3Å; Q349-L353 WeakPolarHBondContact O-CG 3.48Å; Q349-L353 PolarHBondContact O-N 3.44Å; W350-L353 HydrophobicContact CE3-CD1 3.84Å; W350-L353 HydrophobicContact CZ3-CD1 3.9Å; W350-L353 PolarHBondContact O-N 2.95Å; L353-E357 VanDerWaalsContact O-CG 3.29Å; L353-E357 WeakPolarHBondContact O-CG 3.38Å; L353-E357 PolarHBondContact O-N 2.76Å; L353-E357 VanDerWaalsContact O-N 3.11Å
354	I	92.6	Very high	89.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.8	-44.2	176.3	-68.6	165.4	0	0	0	110.1	F59 A68 Y69 L72 F99 L102 W350 E352 E357 V358	F59-I354 HydrophobicContact CE1-CB 4.47Å; F59-I354 HydrophobicContact CE1-CD1 3.65Å; F59-I354 HydrophobicContact CZ-CD1 4.4Å; F59-I354 HydrophobicContact CZ-CG2 4.47Å; A68-I354 HydrophobicContact CB-CD1 4Å; Y69-I354 HydrophobicContact CD2-CG1 3.67Å; Y69-I354 HydrophobicContact CG-CG1 4.14Å; L72-I354 HydrophobicContact CD2-CG2 4.26Å; F99-I354 HydrophobicContact CE1-CB 4.2Å; F99-I354 HydrophobicContact CE1-CG2 3.83Å; F99-I354 HydrophobicContact CZ-CG2 3.69Å; L102-I354 HydrophobicContact CD2-CG2 3.87Å; W350-I354 WeakPolarHBondContact O-CB 3.5Å; W350-I354 WeakPolarHBondContact O-CD1 3.33Å; W350-I354 VanDerWaalsContact O-CG1 3.22Å; W350-I354 WeakPolarHBondContact O-CG1 3.43Å; W350-I354 PolarHBondContact O-N 3.28Å; E352-I354 VanDerWaalsContact C-N 3.34Å; E352-I354 PolarHBondContact O-N 3.34Å; I354-E357 PolarHBondContact O-N 3.33Å; I354-V358 HydrophobicContact CG2-CG2 4.45Å; I354-V358 VanDerWaalsContact O-CG2 3.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.39Å; I354-V358 PolarHBondContact O-N 3.01Å; I354-V358 VanDerWaalsContact O-N 3.12Å
355	Y	93.3	Very high	88.9	Confident	36 Å²	36	53.4 Å²	53.4	14%	0.141	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-44.2	-179	-172	-102.6	0	0	0	111.7	T91 K94 L96 F99 K351 E352 E357 V358 M359	T91-Y355 HydrophobicContact CG2-CD2 4.47Å; T91-Y355 HydrophobicContact CG2-CE2 4.15Å; K94-Y355 PolarHBondContact O-OH 3.33Å; K94-Y355 VanDerWaalsContact O-OH 3.07Å; L96-Y355 HydrophobicContact CB-CD1 4.28Å; L96-Y355 HydrophobicContact CB-CE1 4.41Å; L96-Y355 HydrophobicContact CD1-CD1 4.3Å; L96-Y355 HydrophobicContact CD1-CG 4.04Å; F99-Y355 HydrophobicContact CB-CD2 3.92Å; F99-Y355 HydrophobicContact CB-CE2 4.26Å; F99-Y355 AromaticContact CD1-CD2 3.68Å; F99-Y355 HydrophobicContact CD1-CD2 3.68Å; F99-Y355 HydrophobicContact CD1-CG 4.16Å; F99-Y355 HydrophobicContact CD2-CD2 4.23Å; F99-Y355 HydrophobicContact CE1-CD2 4.16Å; F99-Y355 AromaticContact CG-CD2 3.7Å; F99-Y355 HydrophobicContact CG-CD2 3.7Å; F99-Y355 HydrophobicContact CG-CE2 4.39Å; K351-Y355 VanDerWaalsContact O-CB 3.3Å; K351-Y355 WeakPolarHBondContact O-CB 3.39Å; K351-Y355 PolarHBondContact O-N 3.15Å; E352-Y355 WeakPolarHBondContact O-CB 3.47Å; E352-Y355 PolarHBondContact O-N 3.19Å; E352-Y355 VanDerWaalsContact O-N 3.07Å; Y355-E357 PolarHBondContact O-N 3.21Å; Y355-V358 PolarHBondContact O-N 3.25Å; Y355-M359 HydrophobicContact CD1-CG 4.05Å; Y355-M359 HydrophobicContact CE1-CG 3.71Å; Y355-M359 HydrophobicContact CE1-SD 4.29Å; Y355-M359 HydrophobicContact CE2-CE 3.97Å; Y355-M359 HydrophobicContact CE2-SD 4.49Å; Y355-M359 WeakPolarHBondContact O-CG 3.49Å; Y355-M359 PolarHBondContact O-N 2.78Å
356	E	91.9	Very high	88.2	Confident	108 Å²	108	58.9 Å²	58.9	51%	0.505	28%	0.277	S	S	.	.	H	α-helix	trans	-56.7	-49.2	173.7	-71.9	176.2	174.1	0	0	111.3	E352 V358 M359 D360	E352-E356 WeakPolarHBondContact O-CG 3.34Å; E352-E356 PolarHBondContact O-N 3.27Å; E356-V358 PolarHBondContact O-N 3.24Å; E356-M359 PolarHBondContact O-N 3.44Å; E356-D360 WeakPolarHBondContact O-CB 3.26Å; E356-D360 PolarHBondContact O-N 2.89Å
357	E	90.6	Very high	86.8	Confident	19 Å²	19	61.9 Å²	61.9	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-29.4	179.6	-72	-70.4	170.6	0	0	113.7	Y69 L72 K76 Q339 L353 I354 Y355 W361	Y69-E357 HydrophobicContact CE2-CG 3.74Å; L72-E357 HydrophobicContact CD2-CB 3.76Å; K76-E357 WeakPolarHBondContact CE-OE2 3.26Å; K76-E357 PolarHBondContact NZ-O 3.11Å; K76-E357 IonicContact NZ-OE2 3.84Å; K76-E357 PolarHBondContact NZ-OE2 3.24Å; Q339-E357 PolarHBondContact NE2-OE1 3.26Å; L353-E357 VanDerWaalsContact O-CG 3.29Å; L353-E357 WeakPolarHBondContact O-CG 3.38Å; L353-E357 PolarHBondContact O-N 2.76Å; L353-E357 VanDerWaalsContact O-N 3.11Å; I354-E357 PolarHBondContact O-N 3.33Å; Y355-E357 PolarHBondContact O-N 3.21Å; E357-W361 PolarHBondContact O-N 2.9Å
358	V	92.1	Very high	84.9	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-76.1	-46.9	175.4	179	0	0	0	0	110.7	L72 V89 T91 L102 I354 Y355 E356 D360 W361 E362	L72-V358 HydrophobicContact CD2-CG2 4.05Å; V89-V358 HydrophobicContact CG2-CG1 4.33Å; V89-V358 HydrophobicContact CG2-CG2 3.84Å; T91-V358 HydrophobicContact CG2-CG1 4.17Å; L102-V358 HydrophobicContact CD1-CG2 3.49Å; L102-V358 VanDerWaalsContact CD1-CG2 3.49Å; I354-V358 HydrophobicContact CG2-CG2 4.45Å; I354-V358 VanDerWaalsContact O-CG2 3.26Å; I354-V358 WeakPolarHBondContact O-CG2 3.39Å; I354-V358 PolarHBondContact O-N 3.01Å; I354-V358 VanDerWaalsContact O-N 3.12Å; Y355-V358 PolarHBondContact O-N 3.25Å; E356-V358 PolarHBondContact O-N 3.24Å; V358-D360 PolarHBondContact O-N 3.31Å; V358-W361 WeakPolarHBondContact O-CB 3.38Å; V358-W361 PolarHBondContact O-N 3.14Å; V358-W361 VanDerWaalsContact O-N 3.15Å; V358-E362 PolarHBondContact O-N 3.24Å
359	M	90.3	Very high	82.8	Confident	45 Å²	45	61.8 Å²	61.8	22%	0.222	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-43.1	178.3	-66.4	-59.8	106.7	0	0	111.3	T91 Y355 E356 W361 E362 E363	T91-M359 HydrophobicContact CG2-CE 3.81Å; Y355-M359 HydrophobicContact CD1-CG 4.05Å; Y355-M359 HydrophobicContact CE1-CG 3.71Å; Y355-M359 HydrophobicContact CE1-SD 4.29Å; Y355-M359 HydrophobicContact CE2-CE 3.97Å; Y355-M359 HydrophobicContact CE2-SD 4.49Å; Y355-M359 WeakPolarHBondContact O-CG 3.49Å; Y355-M359 PolarHBondContact O-N 2.78Å; E356-M359 PolarHBondContact O-N 3.44Å; M359-W361 PolarHBondContact O-N 2.79Å; M359-E362 PolarHBondContact O-N 2.82Å; M359-E362 VanDerWaalsContact O-N 3.1Å; M359-E363 PolarHBondContact O-N 2.79Å
360	D	87.9	Confident	80.7	Confident	78 Å²	78	60.3 Å²	60.3	42%	0.417	30%	0.295	S	S	.	.	H	α-helix	trans	-58.9	-31.9	175	-79.9	3.5	0	0	0	112.8	E356 V358 R364	E356-D360 WeakPolarHBondContact O-CB 3.26Å; E356-D360 PolarHBondContact O-N 2.89Å; V358-D360 PolarHBondContact O-N 3.31Å; D360-R364 WeakPolarHBondContact O-CB 3.42Å; D360-R364 WeakPolarHBondContact O-CG 3.08Å; D360-R364 PolarHBondContact O-N 3.35Å; D360-R364 PolarHBondContact O-NE 2.8Å
361	W	85.9	Confident	78.2	Confident	12 Å²	12	68.1 Å²	68.1	5%	0.045	33%	0.329	C	S	.	.	H	α-helix	trans	-73.9	-44.4	175.5	-176.3	-89.2	0	0	0	111.3	K76 L86 N88 V89 E357 V358 M359 E363 R364 N365 M370	K76-W361 HydrophobicContact CB-CZ3 4.36Å; K76-W361 HydrophobicContact CD-CE3 4.08Å; K76-W361 HydrophobicContact CD-CZ3 4.41Å; K76-W361 HydrophobicContact CG-CE3 3.92Å; K76-W361 HydrophobicContact CG-CZ3 3.75Å; L86-W361 HydrophobicContact CD2-CH2 4.15Å; L86-W361 HydrophobicContact CD2-CZ2 4.32Å; L86-W361 HydrophobicContact CD2-CZ3 4.36Å; L86-W361 HydrophobicContact CG-CH2 4.49Å; L86-W361 HydrophobicContact CG-CZ2 4.43Å; N88-W361 PolarHBondContact OD1-NE1 3.07Å; N88-W361 VanDerWaalsContact OD1-NE1 3.1Å; V89-W361 HydrophobicContact CG1-CB 3.7Å; V89-W361 VanDerWaalsContact CG1-CD1 3.44Å; V89-W361 HydrophobicContact CG1-CD2 3.88Å; V89-W361 HydrophobicContact CG1-CG 3.4Å; E357-W361 PolarHBondContact O-N 2.9Å; V358-W361 WeakPolarHBondContact O-CB 3.38Å; V358-W361 PolarHBondContact O-N 3.14Å; V358-W361 VanDerWaalsContact O-N 3.15Å; M359-W361 PolarHBondContact O-N 2.79Å; W361-E363 VanDerWaalsContact C-N 3.32Å; W361-E363 PolarHBondContact O-N 3.46Å; W361-R364 PolarHBondContact O-N 3.4Å; W361-N365 PolarHBondContact NE1-ND2 2.91Å; W361-N365 PolarHBondContact O-N 2.76Å; W361-M370 HydrophobicContact CD2-SD 4.48Å; W361-M370 HydrophobicContact CE3-CE 4.05Å; W361-M370 HydrophobicContact CE3-SD 4.27Å; W361-M370 HydrophobicContact CH2-CE 3.76Å; W361-M370 HydrophobicContact CH2-SD 3.69Å; W361-M370 HydrophobicContact CZ2-SD 3.88Å; W361-M370 HydrophobicContact CZ3-CE 3.48Å; W361-M370 VanDerWaalsContact CZ3-CE 3.48Å; W361-M370 HydrophobicContact CZ3-SD 3.9Å
362	E	82.4	Confident	75.5	Confident	43 Å²	43	74.5 Å²	74.5	20%	0.201	36%	0.36	C	S	.	.	H	α-helix	trans	-60.6	-41	176.7	-71.1	-170.5	-177.2	0	0	112.3	V358 M359 N365 K366	V358-E362 PolarHBondContact O-N 3.24Å; M359-E362 PolarHBondContact O-N 2.82Å; M359-E362 VanDerWaalsContact O-N 3.1Å; E362-N365 PolarHBondContact O-N 3.33Å; E362-K366 WeakPolarHBondContact O-CG 3.37Å; E362-K366 PolarHBondContact O-N 2.88Å; E362-K366 IonicContact OE2-NZ 3.93Å
363	E	81.9	Confident	73	Confident	118 Å²	118	75 Å²	75	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-65.4	-44.8	176.7	-72	-169.6	173.7	0	0	112.4	M359 W361 N365 K366 N367	M359-E363 PolarHBondContact O-N 2.79Å; W361-E363 VanDerWaalsContact C-N 3.32Å; W361-E363 PolarHBondContact O-N 3.46Å; E363-N365 VanDerWaalsContact C-N 3.28Å; E363-N365 PolarHBondContact O-N 2.91Å; E363-K366 PolarHBondContact O-N 3.26Å; E363-N367 WeakPolarHBondContact O-CB 2.98Å; E363-N367 VanDerWaalsContact O-CG 3.29Å; E363-N367 PolarHBondContact O-N 3.11Å; E363-N367 PolarHBondContact O-ND2 3.09Å
364	R	80.1	Confident	70.5	Confident	84 Å²	84	75 Å²	75	32%	0.317	37%	0.368	S	S	.	.	H	α-helix	trans	-58.7	-39.9	175.2	-81.3	-177.4	-84.6	-178	-19.9	112.5	D360 W361 N367 G368 L369	D360-R364 WeakPolarHBondContact O-CB 3.42Å; D360-R364 WeakPolarHBondContact O-CG 3.08Å; D360-R364 PolarHBondContact O-N 3.35Å; D360-R364 PolarHBondContact O-NE 2.8Å; W361-R364 PolarHBondContact O-N 3.4Å; R364-N367 PolarHBondContact O-N 3.43Å; R364-G368 PolarHBondContact O-N 3.05Å; R364-L369 PolarHBondContact O-N 3.5Å
365	N	73.9	Confident	67.6	Low	56 Å²	56	78.2 Å²	78.2	30%	0.299	39%	0.391	S	S	.	.	H	α-helix	trans	-70.4	-38.3	177.5	-82.3	-13.9	0	0	0	113	W361 E362 E363 N367 G368	W361-N365 PolarHBondContact NE1-ND2 2.91Å; W361-N365 PolarHBondContact O-N 2.76Å; E362-N365 PolarHBondContact O-N 3.33Å; E363-N365 VanDerWaalsContact C-N 3.28Å; E363-N365 PolarHBondContact O-N 2.91Å; N365-N367 VanDerWaalsContact C-N 3.3Å; N365-N367 PolarHBondContact O-N 2.92Å; N365-G368 PolarHBondContact O-N 2.89Å
366	K	70.3	Confident	65.1	Low	156 Å²	156	81.7 Å²	81.7	68%	0.678	41%	0.412	S	S	*	.	H	α-helix	trans	-63.5	-37.1	173.8	-74.7	168.1	-173.1	161.3	0	111.8	E362 E363 G368	E362-K366 WeakPolarHBondContact O-CG 3.37Å; E362-K366 PolarHBondContact O-N 2.88Å; E362-K366 IonicContact OE2-NZ 3.93Å; E363-K366 PolarHBondContact O-N 3.26Å; K366-G368 PolarHBondContact O-N 2.77Å
367	N	61.8	Low	62.7	Low	120 Å²	120	78.3 Å²	78.3	64%	0.642	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	0.5	179.6	-66	-19.3	0	0	0	113.7	E363 R364 N365 L369	E363-N367 WeakPolarHBondContact O-CB 2.98Å; E363-N367 VanDerWaalsContact O-CG 3.29Å; E363-N367 PolarHBondContact O-N 3.11Å; E363-N367 PolarHBondContact O-ND2 3.09Å; R364-N367 PolarHBondContact O-N 3.43Å; N365-N367 VanDerWaalsContact C-N 3.3Å; N365-N367 PolarHBondContact O-N 2.92Å; N367-L369 HydrophobicContact CB-CD1 3.97Å; N367-L369 HydrophobicContact CB-CG 4.35Å; N367-L369 PolarHBondContact O-N 2.85Å
368	G	52.8	Low	59.9	Low	30 Å²	30	80.2 Å²	80.2	31%	0.309	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	8.5	175.8	0	0	0	0	0	115.2	R364 N365 K366 M370 K371	R364-G368 PolarHBondContact O-N 3.05Å; N365-G368 PolarHBondContact O-N 2.89Å; K366-G368 PolarHBondContact O-N 2.77Å; G368-M370 PolarHBondContact O-N 2.85Å; G368-K371 PolarHBondContact O-N 3.48Å
369	L	46.6	Very low	57.2	Low	130 Å²	130	83 Å²	83	68%	0.681	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.9	-175.2	-76	157.9	0	0	0	113.9	R364 N367	R364-L369 PolarHBondContact O-N 3.5Å; N367-L369 HydrophobicContact CB-CD1 3.97Å; N367-L369 HydrophobicContact CB-CG 4.35Å; N367-L369 PolarHBondContact O-N 2.85Å
370	M	48.8	Very low	54.7	Low	51 Å²	51	85.1 Å²	85.1	25%	0.251	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	8.4	178.3	-74.4	-170.7	157	0	0	114.4	W361 G368 E372	W361-M370 HydrophobicContact CD2-SD 4.48Å; W361-M370 HydrophobicContact CE3-CE 4.05Å; W361-M370 HydrophobicContact CE3-SD 4.27Å; W361-M370 HydrophobicContact CH2-CE 3.76Å; W361-M370 HydrophobicContact CH2-SD 3.69Å; W361-M370 HydrophobicContact CZ2-SD 3.88Å; W361-M370 HydrophobicContact CZ3-CE 3.48Å; W361-M370 VanDerWaalsContact CZ3-CE 3.48Å; W361-M370 HydrophobicContact CZ3-SD 3.9Å; G368-M370 PolarHBondContact O-N 2.85Å; M370-E372 VanDerWaalsContact C-N 3.27Å; M370-E372 PolarHBondContact O-N 3.26Å
371	K	40.2	Very low	52.1	Low	175 Å²	175	86.4 Å²	86.4	76%	0.761	47%	0.471	S	S	*	.	S	Bend	trans	-68.6	-22.8	179.8	-86.4	-175.1	175.3	179	0	113.8	G368	G368-K371 PolarHBondContact O-N 3.48Å
372	E	36.2	Very low	49.4	Very low	170 Å²	170	89.6 Å²	89.6	79%	0.794	50%	0.5	S	S	*	.	S	Bend	trans	-73.8	-36.5	-178.5	-68.1	-175	159.3	0	0	112.3	M370 C374 S375	M370-E372 VanDerWaalsContact C-N 3.27Å; M370-E372 PolarHBondContact O-N 3.26Å; E372-C374 PolarHBondContact O-N 2.93Å; E372-S375 PolarHBondContact O-OG 3Å
373	D	40.8	Very low	46.9	Very low	101 Å²	101	92.2 Å²	92.2	54%	0.54	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-6.2	-176.6	-66.5	-28.8	0	0	0	115.3	R85	R85-D373 PolarHBondContact NH1-O 3.38Å
374	C	39.6	Very low	44.8	Very low	42 Å²	42	95.6 Å²	95.6	28%	0.284	54%	0.539	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-9.2	177	-95.4	0	0	0	0	114.1	E372 D376 V377	E372-C374 PolarHBondContact O-N 2.93Å; C374-D376 VanDerWaalsContact C-N 3.25Å; C374-D376 PolarHBondContact O-N 3.37Å; C374-V377 PolarHBondContact O-N 3.18Å
375	S	32.6	Very low	42.6	Very low	69 Å²	69	97 Å²	97	48%	0.483	56%	0.561	S	S	.	*	H	α-helix	trans	-66.1	-26.7	-179.2	59.7	0	0	0	0	113	E372 V377 A378 S379	E372-S375 PolarHBondContact O-OG 3Å; S375-V377 PolarHBondContact O-N 3.46Å; S375-A378 PolarHBondContact O-N 3.19Å; S375-S379 WeakPolarHBondContact O-CB 3.41Å; S375-S379 PolarHBondContact O-N 3.39Å; S375-S379 PolarHBondContact O-OG 3.47Å
376	D	40.4	Very low	40.5	Very low	109 Å²	109	99.9 Å²	99.9	58%	0.583	59%	0.587	S	S	*	*	H	α-helix	trans	-71.7	-25.6	-179.7	-71	-29	0	0	0	114.9	C374 S379 S380	C374-D376 VanDerWaalsContact C-N 3.25Å; C374-D376 PolarHBondContact O-N 3.37Å; D376-S379 VanDerWaalsContact CA-OG 3.32Å; D376-S379 WeakPolarHBondContact CA-OG 3.36Å; D376-S379 PolarHBondContact O-OG 3.25Å; D376-S380 PolarHBondContact O-N 3.4Å; D376-S380 PolarHBondContact O-OG 3.22Å
377	V	41.3	Very low	38.4	Very low	37 Å²	37	98.4 Å²	98.4	22%	0.224	60%	0.596	C	S	.	*	H	α-helix	trans	-80	-26.9	176.4	-178.7	0	0	0	0	111.6	I48 R85 C374 S375 S380	I48-V377 HydrophobicContact CD1-CG1 3.68Å; R85-V377 VanDerWaalsContact CZ-CG2 3.45Å; C374-V377 PolarHBondContact O-N 3.18Å; S375-V377 PolarHBondContact O-N 3.46Å; V377-S380 PolarHBondContact O-OG 2.93Å
378	A	32.9	Very low	36.9	Very low	59 Å²	59	97.2 Å²	97.2	49%	0.488	60%	0.602	S	S	.	*	H	α-helix	trans	-79.7	-41.2	171.7	0	0	0	0	0	111.6	S375 S380 S381	S375-A378 PolarHBondContact O-N 3.19Å; A378-S380 PolarHBondContact O-N 2.93Å; A378-S381 PolarHBondContact O-N 2.81Å; A378-S381 PolarHBondContact O-OG 3.43Å
379	S	34.4	Very low	35.7	Very low	58 Å²	58	103 Å²	103	41%	0.406	63%	0.626	S	S	.	*	H	α-helix	trans	-67.8	-33.7	-175.8	66.3	0	0	0	0	113.5	S375 D376 S381 A382 S383	S375-S379 WeakPolarHBondContact O-CB 3.41Å; S375-S379 PolarHBondContact O-N 3.39Å; S375-S379 PolarHBondContact O-OG 3.47Å; D376-S379 VanDerWaalsContact CA-OG 3.32Å; D376-S379 WeakPolarHBondContact CA-OG 3.36Å; D376-S379 PolarHBondContact O-OG 3.25Å; S379-S381 PolarHBondContact O-N 3.32Å; S379-A382 PolarHBondContact O-N 3.49Å; S379-S383 PolarHBondContact O-N 2.89Å
380	S	37.3	Very low	34.8	Very low	90 Å²	90	103.5 Å²	103.5	63%	0.629	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-14.7	174.6	50.6	0	0	0	0	114.3	D376 V377 A378	D376-S380 PolarHBondContact O-N 3.4Å; D376-S380 PolarHBondContact O-OG 3.22Å; V377-S380 PolarHBondContact O-OG 2.93Å; A378-S380 PolarHBondContact O-N 2.93Å
381	S	34.1	Very low	33.8	Very low	105 Å²	105	109.1 Å²	109.1	73%	0.734	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-7.4	171.6	67.8	0	0	0	0	114.2	A378 S379	A378-S381 PolarHBondContact O-N 2.81Å; A378-S381 PolarHBondContact O-OG 3.43Å; S379-S381 PolarHBondContact O-N 3.32Å
382	A	28.7	Very low	33.2	Very low	79 Å²	79	105.9 Å²	105.9	65%	0.653	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	-11.6	-171.3	0	0	0	0	0	114.7	S379 Q384	S379-A382 PolarHBondContact O-N 3.49Å; A382-Q384 VanDerWaalsContact C-N 3.35Å; A382-Q384 PolarHBondContact O-N 3.25Å
383	S	29.6	Very low	32.7	Very low	98 Å²	98	102.5 Å²	102.5	69%	0.685	65%	0.653	S	S	*	*			trans	-89.7	66.1	175.7	60.9	0	0	0	0	112.3	S379	S379-S383 PolarHBondContact O-N 2.89Å
384	Q	38.1	Very low	32.1	Very low	189 Å²	189	106.8 Å²	106.8	88%	0.883	67%	0.673	S	S	*	*			trans	-120.7	88.3	155.6	-79.8	-169.9	-0.4	0	0	108.7	A382	A382-Q384 VanDerWaalsContact C-N 3.35Å; A382-Q384 PolarHBondContact O-N 3.25Å
385	S	34.3	Very low	31.5	Very low	112 Å²	112	110.6 Å²	110.6	78%	0.783	70%	0.7	S	S	*	*			trans	-180	142.8	141.8	54.4	0	0	0	0	109.5
386	S	30	Very low	31.3	Very low	118 Å²	118	113.1 Å²	113.1	83%	0.825	71%	0.712	S	S	*	*			trans	88.3	77.8	173.7	76.3	0	0	0	0	118.2
387	S	26.1	Very low	30.6	Very low	125 Å²	125	117.4 Å²	117.4	87%	0.874	73%	0.729	S	S	*	*				-162.8	82.6	129.9	45.7	0	0	0	0	109
388	A	29.6	Very low	30	Very low	94 Å²	94	123.7 Å²	123.7	78%	0.777	76%	0.755	S	S	*	*			trans	-77.7	122.9	160	0	0	0	0	0	107.5
389	N	28.2	Very low	29.6	Very low	152 Å²	152	127 Å²	127	81%	0.813	77%	0.77	S	S	*	*			trans	-147.5	106.9	153.3	-95.4	-14.6	0	0	0	108.2
390	D	27.5	Very low	29.3	Very low	140 Å²	140	131.7 Å²	131.7	75%	0.749	79%	0.79	S	S	*	*			trans	39.6	105.6	141.4	-63.6	-22.7	0	0	0	120
391	I	28.2	Very low	28.8	Very low	170 Å²	170	131.3 Å²	131.3	87%	0.872	79%	0.792	S	S	*	*			trans	-134.2	95.1	130.5	-56.9	-178.5	0	0	0	108.2
392	S	26.6	Very low	28.5	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	80%	0.796	S	S	*	*			trans	-83.7	117.3	163.9	59.3	0	0	0	0	109.8
393	S	27	Very low	28.4	Very low	99 Å²	99	135.8 Å²	135.8	69%	0.692	81%	0.805	S	S	*	*			trans	177.5	108.9	140	55	0	0	0	0	109.7
394	M	27.1	Very low	28.4	Very low	192 Å²	192	137.9 Å²	137.9	95%	0.946	82%	0.815	S	S	*	*				-170.4	118.3	118.3	-94.3	-160.4	176.2	0	0	108.6
395	S	27.4	Very low	27.9	Very low	122 Å²	122	136.6 Å²	136.6	85%	0.853	81%	0.814	S	S	*	*			trans	-73.8	146.7	-176.2	-55.1	0	0	0	0	112
396	T	28.9	Very low	27.6	Very low	122 Å²	122	136.3 Å²	136.3	75%	0.748	81%	0.812	S	S	*	*			trans	-50	146.1	164.7	48.5	0	0	0	0	114.4
397	E	25.7	Very low	27.5	Very low	199 Å²	199	135.3 Å²	135.3	93%	0.93	81%	0.805	S	S	*	*			trans	-149.5	131.7	131.7	-116.9	173.4	-165.6	0	0	111.6
398	H	27.5	Very low	27.6	Very low	168 Å²	168	134 Å²	134	78%	0.778	80%	0.796	S	S	*	*			trans	-96.3	146.8	-179.1	-100.8	-88.4	0	0	0	110.4
399	T	26.4	Very low	27.6	Very low	130 Å²	130	136.5 Å²	136.5	80%	0.798	79%	0.794	S	S	*	*			trans	-156.3	102	146.8	-36.2	0	0	0	0	107.3
400	L	27.5	Very low	27.7	Very low	156 Å²	156	135.8 Å²	135.8	82%	0.817	79%	0.791	S	S	*	*				47	134.9	97.9	-72.2	163.2	0	0	0	113.6
401	A	26.8	Very low	27.8	Very low	82 Å²	82	134.3 Å²	134.3	68%	0.678	79%	0.787	S	S	*	*			cis	-174	160.4	-4.2	0	0	0	0	0	106.9
402	S	26.5	Very low	27.9	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	79%	0.788	S	S	*	*				145.7	114.2	126.5	71.2	0	0	0	0	113.9
403	D	27.1	Very low	28.3	Very low	161 Å²	161	135.2 Å²	135.2	86%	0.861	79%	0.789	S	S	*	*			trans	-65.2	147.8	159	-66.5	-49.9	0	0	0	111.9
404	T	29.8	Very low	28.4	Very low	143 Å²	143	134 Å²	134	88%	0.877	79%	0.792	S	S	*	*			trans	-148	122.6	142.9	39.3	0	0	0	0	110.3
405	D	27.3	Very low	29.4	Very low	162 Å²	162	130.6 Å²	130.6	87%	0.866	78%	0.784	S	S	*	*			trans	-51	151.3	166.9	-77.1	-49.3	0	0	0	114.5
406	S	28.7	Very low	29.8	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	79%	0.785	S	S	*	*				-174.4	107.3	124.6	54.8	0	0	0	0	113.3
407	S	27.9	Very low	30.1	Very low	97 Å²	97	133.6 Å²	133.6	68%	0.678	79%	0.785	S	S	*	*				53.8	116.4	126.8	67.9	0	0	0	0	122.4
408	S	27.7	Very low	30.6	Very low	98 Å²	98	132 Å²	132	69%	0.685	78%	0.778	S	S	*	*				84.6	124.7	114	-61.7	0	0	0	0	121.8
409	I	30.1	Very low	31.2	Very low	146 Å²	146	129 Å²	129	75%	0.749	78%	0.776	S	S	*	*			trans	74.8	130.2	135.5	-63.1	169.1	0	0	0	113.9
410	D	29.5	Very low	31.9	Very low	137 Å²	137	135.8 Å²	135.8	73%	0.733	80%	0.798	S	S	*	*			cis	-162.1	155.2	32.5	-128.3	-30.7	0	0	0	112
411	T	30.4	Very low	32.1	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	80%	0.797	S	S	*	*			trans	-21	139.3	153.8	-19.3	0	0	0	0	118.8
412	L	30.8	Very low	32.4	Very low	172 Å²	172	137.5 Å²	137.5	90%	0.901	80%	0.804	S	S	*	*				-171.9	138.4	126.5	-103.4	150	0	0	0	114.4
413	T	33.7	Very low	32.7	Very low	122 Å²	122	138.7 Å²	138.7	75%	0.748	80%	0.803	S	S	*	*			trans	-90.6	131.7	-175	43.6	0	0	0	0	113.6
414	G	30.1	Very low	33	Very low	75 Å²	75	137.4 Å²	137.4	77%	0.773	80%	0.8	S	S	*	*			trans	54.8	179.9	147.3	0	0	0	0	0	120.8
415	P	48	Very low	33.2	Very low	119 Å²	119	137.1 Å²	137.1	77%	0.773	80%	0.795	S	S	*	*			cis	-134.4	176.7	-10.9	39.5	-20.8	0	0	0	115.6
416	L	36.4	Very low	33.6	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	79%	0.79	S	S	*	*			trans	18.4	129.2	145.6	-64.6	158.3	0	0	0	121.8
417	D	33.5	Very low	33.9	Very low	142 Å²	142	137.5 Å²	137.5	76%	0.759	79%	0.794	S	S	*	*				-175.9	121.9	124.5	-119.5	0.1	0	0	0	109.9
418	E	37.3	Very low	34.4	Very low	166 Å²	166	140.6 Å²	140.6	78%	0.776	80%	0.803	S	S	*	*				76.2	118.8	94.5	-82.6	-162	170.8	0	0	116.9
419	S	38.8	Very low	35	Very low	105 Å²	105	144.2 Å²	144.2	73%	0.734	81%	0.812	S	S	*	*			trans	52.2	112.4	145.5	61.6	0	0	0	0	120.9
420	Q	41.2	Very low	35.4	Very low	271 Å²	271	144 Å²	144	100%	1.266	82%	0.818	S	S	*	*				-162	0	110.3	-105.1	-179.7	19	0	0	111.2

Retrieved 420 of 420 residues in 816.4 ms (Link to these results)

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