A0A096N2X7_PAPAN Loading...

Protein phosphatase

Protein phosphatase that plays an essential role in mitochondrial metabolism and biogenesis. Positively regulates biosynthesis of the ubiquinone, coenzyme Q. Dephosphorylates the ubiquinone biosynthesis protein COQ7 which is likely to lead to its activation. Serves as a crucial sensor for mitophagy, though the underlying mechanism remains ambiguous. May dephosphorylate BNIP3 and NIX and thereby directly regulates mitophagy receptor function and stability. Alternatively, promotes SCF-FBXL4-dependent ubiquitination and degradation of BNIP3 and NIX independently of its catalytic activity to restrain mitophagy.

AlphaFold DB (A0A2K6DBP9), UniProt , Accession A0A096N2X7, Species PAPAN (Papio anubis, Olive baboon), Gene PPTC7, Length 304 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	31.8	Very low	227 Å²	227	158.2 Å²	158.2	100%	1.118	83%	0.829	S	S	*	*				0	131.9	0	-84	-177.2	-171.9	0	0	108.2
2	F	31.4	Very low	31.5	Very low	194 Å²	194	152.8 Å²	152.8	85%	0.851	82%	0.824	S	S	*	*			trans	67.2	97.1	176.3	-56.1	-75.7	0	0	0	115.6
3	S	29.6	Very low	31.3	Very low	99 Å²	99	160.5 Å²	160.5	69%	0.692	83%	0.834	S	S	*	*				67.7	127.2	59.5	-168.7	0	0	0	0	114.2
4	V	37	Very low	31.1	Very low	129 Å²	129	155.6 Å²	155.6	78%	0.782	83%	0.83	S	S	*	*			trans	151.7	94.7	137.8	173.6	0	0	0	0	107.5
5	L	33.4	Very low	31.1	Very low	150 Å²	150	153.9 Å²	153.9	79%	0.785	83%	0.827	S	S	*	*				54.3	110.9	87.6	-86.3	161.3	0	0	0	116.2
6	S	30.6	Very low	30.9	Very low	96 Å²	96	155.3 Å²	155.3	67%	0.671	83%	0.833	S	S	*	*				73.2	106.8	127	-174.2	0	0	0	0	120.6
7	Y	36.5	Very low	30.6	Very low	243 Å²	243	150.7 Å²	150.7	95%	0.953	83%	0.831	S	S	*	*				-140.6	137.9	129	-83.5	-90.2	0	0	0	104.9
8	G	29.8	Very low	30.4	Very low	71 Å²	71	146.9 Å²	146.9	73%	0.732	83%	0.831	S	S	*	*			cis	140.9	111.7	19.7	0	0	0	0	0	106.6
9	R	31.1	Very low	30.4	Very low	239 Å²	239	148.7 Å²	148.7	90%	0.902	84%	0.837	S	S	*	*			trans	-46.1	151.2	-177.6	-68.2	165.5	167.6	177	-4	116.3
10	L	29.4	Very low	30.5	Very low	160 Å²	160	146.9 Å²	146.9	84%	0.838	84%	0.835	S	S	*	*				176.9	107.1	126.7	-99.1	136.2	0	0	0	109.7
11	V	28.7	Very low	30.6	Very low	132 Å²	132	149.2 Å²	149.2	80%	0.8	84%	0.839	S	S	*	*				86.5	120.1	97.1	169	0	0	0	0	115.3
12	A	27.8	Very low	30.6	Very low	93 Å²	93	144.6 Å²	144.6	77%	0.769	82%	0.823	S	S	*	*			trans	131	115.5	135.3	0	0	0	0	0	117.8
13	R	29	Very low	30.6	Very low	253 Å²	253	142.8 Å²	142.8	96%	0.955	82%	0.823	S	S	*	*			trans	-3.6	136.2	146.5	-81.9	172.3	151.4	167.4	-6.7	120.6
14	A	28.7	Very low	31	Very low	93 Å²	93	143.4 Å²	143.4	77%	0.769	82%	0.824	S	S	*	*				166.6	114.5	126	0	0	0	0	0	107.7
15	V	30.9	Very low	31	Very low	130 Å²	130	148.6 Å²	148.6	79%	0.788	83%	0.83	S	S	*	*				55.7	128	77.1	-177.2	0	0	0	0	114.2
16	L	28.4	Very low	31.5	Very low	176 Å²	176	146.6 Å²	146.6	92%	0.921	84%	0.835	S	S	*	*			trans	83.9	131.4	178.2	-58.5	151.8	0	0	0	114.3
17	G	25.9	Very low	31.8	Very low	77 Å²	77	145.9 Å²	145.9	79%	0.794	84%	0.843	S	S	*	*			cis	171.5	133.6	3.2	0	0	0	0	0	105.6
18	G	26.4	Very low	31.7	Very low	82 Å²	82	138.4 Å²	138.4	85%	0.845	84%	0.84	S	S	*	*			trans	-146	95.3	-176.9	0	0	0	0	0	109.9
19	L	29.9	Very low	31.9	Very low	181 Å²	181	138.6 Å²	138.6	95%	0.948	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.2	-179.7	-66.1	149.3	0	0	0	111.4
20	S	32.4	Very low	32.3	Very low	113 Å²	113	132 Å²	132	79%	0.79	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-101.6	120.2	154.9	68.4	0	0	0	0	108.4	T22	S20-T22 PolarHBondContact O-N 3.37Å
21	Q	32.7	Very low	33.6	Very low	196 Å²	196	126.8 Å²	126.8	92%	0.916	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-54.7	125.9	-178.1	-72.9	170	-23	0	0	111.4
22	T	33.3	Very low	35.9	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-76.7	130.2	164.7	44.6	0	0	0	0	108.8	S20 P24	S20-T22 PolarHBondContact O-N 3.37Å; T22-P24 WeakPolarHBondContact O-CD 3.35Å
23	D	31.7	Very low	38.8	Very low	156 Å²	156	121.9 Å²	121.9	83%	0.834	80%	0.8	S	S	*	*			trans	-83.1	112.8	171.3	-137.6	-16.3	0	0	0	108.3	R25	D23-R25 PolarHBondContact O-N 3.39Å
24	P	37.8	Very low	41.8	Very low	112 Å²	112	111.8 Å²	111.8	73%	0.727	76%	0.762	S	S	*	*			trans	-99.9	72.6	-174	35.5	-25.2	0	0	0	109.9	T22	T22-P24 WeakPolarHBondContact O-CD 3.35Å
25	R	36.8	Very low	45	Very low	238 Å²	238	107.6 Å²	107.6	90%	0.898	73%	0.728	S	S	*	*			trans	-144.9	36.1	170.7	-74.7	-162.3	176.1	173	0.2	115.2	D23	D23-R25 PolarHBondContact O-N 3.39Å
26	A	43.8	Very low	48.1	Very low	108 Å²	108	102.5 Å²	102.5	89%	0.893	70%	0.697	S	S	*	*			trans	-113.2	80.1	158.9	0	0	0	0	0	108.7
27	G	37	Very low	51.3	Low	82 Å²	82	96.2 Å²	96.2	85%	0.845	67%	0.665	S	S	*	*			trans	-99.1	117.3	170.7	0	0	0	0	0	109.9
28	G	34	Very low	54.6	Low	85 Å²	85	93.6 Å²	93.6	88%	0.876	63%	0.634	S	S	*	*			trans	143	92.1	156.8	0	0	0	0	0	115.9
29	G	33.7	Very low	57.9	Low	76 Å²	76	89.9 Å²	89.9	78%	0.784	60%	0.595	S	S	*	*			trans	137	87.5	158.6	0	0	0	0	0	114.5	G31	G29-G31 PolarHBondContact O-N 2.94Å
30	G	40.4	Very low	61	Low	100 Å²	100	82.1 Å²	82.1	100%	1.031	56%	0.559	S	S	*	*			trans	-73.9	72.5	169.8	0	0	0	0	0	112.1
31	G	56.6	Low	63.9	Low	50 Å²	50	77.4 Å²	77.4	52%	0.515	53%	0.526	S	S	.	.			trans	-112.5	130.7	163.6	0	0	0	0	0	108.3	G29	G29-G31 PolarHBondContact O-N 2.94Å
32	G	75.8	Confident	66.7	Low	47 Å²	47	68.6 Å²	68.6	49%	0.485	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-61.4	157.3	172.5	0	0	0	0	0	111.1
33	D	88.5	Confident	69.4	Low	75 Å²	75	64 Å²	64	40%	0.401	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-55.9	149.3	175.5	-70.8	-9	0	0	0	110.5	R146 Y302	D33-R146 HydrophobicContact CB-CB 4.5Å; D33-Y302 HydrophobicContact CB-CD1 4.33Å; D33-Y302 WeakPolarHBondContact O-CB 3.41Å; D33-Y302 PolarHBondContact O-N 3.11Å
34	Y	93.6	Very high	72	Confident	41 Å²	41	57.6 Å²	57.6	16%	0.161	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	152.8	175.7	-73.2	9.9	0	0	0	111.2	R146 H149 V212 L214 V299	Y34-R146 WeakPolarHBondContact O-CG 3.45Å; Y34-R146 PolarHBondContact O-NH1 3.04Å; Y34-H149 AromaticContact CD1-CD2 3.94Å; Y34-H149 AromaticContact CD1-NE2 3.89Å; Y34-H149 HydrophobicContact CD2-CB 3.93Å; Y34-H149 AromaticContact CD2-CG 3.98Å; Y34-H149 HydrophobicContact CE2-CB 4.03Å; Y34-H149 HydrophobicContact CG-CB 4.47Å; Y34-H149 AromaticContact CG-CD2 3.75Å; Y34-V212 HydrophobicContact CD2-CG2 3.92Å; Y34-V212 HydrophobicContact CE2-CG2 4.34Å; Y34-L214 HydrophobicContact CD1-CD2 3.9Å; Y34-L214 HydrophobicContact CD1-CG 4.46Å; Y34-L214 HydrophobicContact CE1-CD1 4.32Å; Y34-L214 HydrophobicContact CE1-CD2 3.74Å; Y34-L214 HydrophobicContact CE1-CG 3.81Å; Y34-L214 HydrophobicContact CE2-CD2 4.48Å; Y34-L214 HydrophobicContact CE2-CG 4.41Å; Y34-L214 HydrophobicContact CG-CD2 4.35Å; Y34-V299 HydrophobicContact CD2-CG1 3.53Å; Y34-V299 HydrophobicContact CE2-CG1 4.15Å; Y34-V299 HydrophobicContact CG-CG1 4.06Å
35	G	94.9	Very high	74.1	Confident	5 Å²	5	56.2 Å²	56.2	5%	0.052	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	169.8	172	0	0	0	0	0	113.2	D72 V299 A300	G35-D72 WeakPolarHBondContact CA-OD2 3.37Å; G35-V299 WeakPolarHBondContact O-CA 3.27Å; G35-A300 PolarHBondContact N-O 3.23Å; G35-A300 PolarHBondContact O-N 2.63Å
36	L	95.8	Very high	75.6	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.12	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.6	175.8	-61.2	-177.7	0	0	0	110.7	D72 L74 L144 I218 I298 V299	L36-D72 HydrophobicContact CB-CB 4.03Å; L36-D72 HydrophobicContact CD1-CB 3.85Å; L36-D72 HydrophobicContact CG-CB 3.88Å; L36-D72 PolarHBondContact N-OD2 2.98Å; L36-L74 HydrophobicContact CD1-CD2 3.76Å; L36-L144 HydrophobicContact CD1-CB 4.04Å; L36-L144 HydrophobicContact CD2-CB 4.38Å; L36-L144 HydrophobicContact CD2-CD2 3.66Å; L36-L144 HydrophobicContact CG-CB 4.05Å; L36-L144 HydrophobicContact CG-CD2 3.66Å; L36-L144 HydrophobicContact CG-CG 4.5Å; L36-I218 HydrophobicContact CD2-CD1 3.79Å; L36-I298 WeakPolarHBondContact CA-O 3.46Å; L36-V299 HydrophobicContact CD2-CG2 3.93Å
37	V	95.7	Very high	76.4	Confident	44 Å²	44	52.7 Å²	52.7	27%	0.267	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.7	158.2	-171.1	0	0	0	0	106.6	I249 S297 I298 A300	V37-I249 HydrophobicContact CB-CD1 3.75Å; V37-I249 HydrophobicContact CG1-CD1 3.51Å; V37-I249 WeakPolarHBondContact O-CD1 3.5Å; V37-S297 VanDerWaalsContact O-CA 3.3Å; V37-S297 WeakPolarHBondContact O-CA 3.27Å; V37-I298 PolarHBondContact N-O 3.23Å; V37-I298 PolarHBondContact O-N 2.85Å; V37-A300 HydrophobicContact CG2-CB 4.14Å
38	T	95.9	Very high	76.5	Confident	23 Å²	23	59 Å²	59	14%	0.141	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.5	-173	-55.7	0	0	0	0	111.1	V65 L74 Y246 L296 S297	T38-V65 HydrophobicContact CG2-CG1 4.23Å; T38-V65 HydrophobicContact CG2-CG2 3.71Å; T38-L74 HydrophobicContact CG2-CD2 4.42Å; T38-Y246 VanDerWaalsContact O-CE2 3.29Å; T38-Y246 WeakPolarHBondContact O-CE2 3.44Å; T38-L296 WeakPolarHBondContact CA-O 3.5Å; T38-S297 WeakPolarHBondContact CB-OG 3.31Å; T38-S297 VanDerWaalsContact CG2-OG 3.25Å; T38-S297 WeakPolarHBondContact CG2-OG 3.45Å; T38-S297 WeakPolarHBondContact OG1-CB 3.39Å; T38-S297 PolarHBondContact OG1-OG 3.48Å
39	A	95.3	Very high	76.5	Confident	3 Å²	3	65.6 Å²	65.6	3%	0.025	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	158	165.7	0	0	0	0	0	110.1	Y246 I249 Q250 L296	A39-Y246 HydrophobicContact CB-CD2 4.27Å; A39-Y246 HydrophobicContact CB-CE2 3.83Å; A39-I249 HydrophobicContact CB-CB 4.27Å; A39-I249 HydrophobicContact CB-CG2 3.8Å; A39-Q250 HydrophobicContact CB-CB 3.76Å; A39-L296 PolarHBondContact N-O 2.62Å; A39-L296 PolarHBondContact O-N 2.59Å
40	G	94.3	Very high	76.6	Confident	19 Å²	19	65.1 Å²	65.1	20%	0.196	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.8	-176.7	0	0	0	0	0	113.1	Q250 V294	G40-Q250 PolarHBondContact O-NE2 2.97Å; G40-Q250 PolarHBondContact O-OE1 3.3Å; G40-V294 CarbonylContact C-O 3.59Å; G40-V294 WeakPolarHBondContact CA-O 3.36Å
41	C	94.8	Very high	76.5	Confident	14 Å²	14	68.4 Å²	68.4	10%	0.095	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	149.6	170.7	-167.5	0	0	0	0	109.4	A253 R254 A257 V294	C41-A253 HydrophobicContact CB-CB 4.48Å; C41-R254 HydrophobicContact CB-CB 4.34Å; C41-A257 HydrophobicContact CB-CB 4.26Å; C41-V294 PolarHBondContact N-O 3.27Å; C41-V294 PolarHBondContact O-N 3.43Å
42	G	91.6	Very high	75.8	Confident	10 Å²	10	73.8 Å²	73.8	10%	0.103	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	163.6	173.8	0	0	0	0	0	112.8	Y58 I292	G42-Y58 VanDerWaalsContact O-CD1 3.27Å; G42-Y58 WeakPolarHBondContact O-CD1 3.4Å; G42-I292 CarbonylContact C-O 3.57Å; G42-I292 WeakPolarHBondContact CA-O 3.43Å
43	F	88.4	Confident	74.4	Confident	34 Å²	34	76.2 Å²	76.2	15%	0.149	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.2	-175.8	-59.2	-69.6	0	0	0	109.1	F47 A257 E258 H261 I292	F43-F47 AromaticContact CD1-CE2 3.64Å; F43-F47 HydrophobicContact CD1-CE2 3.64Å; F43-F47 HydrophobicContact CD1-CZ 4.33Å; F43-F47 HydrophobicContact CE1-CE2 4.27Å; F43-F47 HydrophobicContact CG-CE2 4.45Å; F43-A257 HydrophobicContact CD2-CB 3.84Å; F43-A257 VanDerWaalsContact CE2-C 3.46Å; F43-A257 HydrophobicContact CE2-CB 3.46Å; F43-A257 VanDerWaalsContact CE2-CB 3.46Å; F43-E258 HydrophobicContact CE2-CG 3.87Å; F43-E258 HydrophobicContact CZ-CG 3.56Å; F43-H261 HydrophobicContact CD2-CB 4.34Å; F43-I292 PolarHBondContact N-O 3.42Å; F43-I292 PolarHBondContact O-N 2.97Å
44	G	87.4	Confident	72.5	Confident	20 Å²	20	82.4 Å²	82.4	21%	0.206	41%	0.414	C	S	.	.			trans	-79.3	146.1	167.6	0	0	0	0	0	110.7	D46 D291	G44-D46 VanDerWaalsContact C-N 3.3Å; G44-D46 PolarHBondContact O-N 2.67Å; G44-D291 WeakPolarHBondContact CA-OD1 3.36Å
45	K	81.1	Confident	70.6	Confident	83 Å²	83	82.8 Å²	82.8	36%	0.361	43%	0.431	S	S	.	.	S	Bend	trans	-51.4	-45.8	174.9	-178.3	-179.8	-175.8	139.2	0	112.2	F47 Y265 P289 D291	K45-F47 PolarHBondContact O-N 3.02Å; K45-Y265 PolarHBondContact O-OH 3.42Å; K45-P289 WeakPolarHBondContact CE-O 3.15Å; K45-P289 HydrophobicContact CG-CB 4.49Å; K45-P289 PolarHBondContact NZ-O 3.11Å; K45-D291 WeakPolarHBondContact CB-OD1 3.29Å; K45-D291 PolarHBondContact N-OD1 3.09Å
46	D	69.3	Low	69.9	Low	120 Å²	120	84.6 Å²	84.6	64%	0.642	45%	0.445	S	S	*	.			trans	-93.2	91	176.1	-73	-42.2	0	0	0	110	G44 R48	G44-D46 VanDerWaalsContact C-N 3.3Å; G44-D46 PolarHBondContact O-N 2.67Å; D46-R48 PolarHBondContact O-N 3.29Å
47	F	60.6	Low	69.4	Low	152 Å²	152	84.1 Å²	84.1	67%	0.667	44%	0.444	S	S	*	.			trans	-66.4	33.4	171.9	-134.5	-81.9	0	0	0	113.1	F43 K45	F43-F47 AromaticContact CD1-CE2 3.64Å; F43-F47 HydrophobicContact CD1-CE2 3.64Å; F43-F47 HydrophobicContact CD1-CZ 4.33Å; F43-F47 HydrophobicContact CE1-CE2 4.27Å; F43-F47 HydrophobicContact CG-CE2 4.45Å; K45-F47 PolarHBondContact O-N 3.02Å
48	R	39.9	Very low	69.2	Low	214 Å²	214	84.8 Å²	84.8	81%	0.808	44%	0.442	S	S	*	.	S	Bend	trans	-126.1	102.8	-177.5	-75.8	-164.8	-100.9	-157.4	-4.9	111.5	D46 G50	D46-R48 PolarHBondContact O-N 3.29Å; R48-G50 VanDerWaalsContact C-N 3.33Å; R48-G50 PolarHBondContact O-N 3.3Å
49	K	33.6	Very low	69	Low	224 Å²	224	85.3 Å²	85.3	97%	0.974	45%	0.452	S	S	*	.	S	Bend	trans	49	34.3	155.3	-71.4	-174.5	176.3	178.9	0	117.6
50	G	35	Very low	69	Low	66 Å²	66	85.7 Å²	85.7	68%	0.68	45%	0.454	S	S	*	.			trans	-91.6	133.5	157.5	0	0	0	0	0	109.3	R48 L52	R48-G50 VanDerWaalsContact C-N 3.33Å; R48-G50 PolarHBondContact O-N 3.3Å; G50-L52 PolarHBondContact O-N 2.95Å
51	L	38.5	Very low	69.1	Low	170 Å²	170	84.8 Å²	84.8	89%	0.89	44%	0.444	S	S	*	.			trans	-49.8	129.7	170.2	-86.3	125.9	0	0	0	109.2	K53	L51-K53 PolarHBondContact O-N 3.36Å
52	L	42.1	Very low	69.3	Low	163 Å²	163	84.1 Å²	84.1	85%	0.853	44%	0.44	S	S	*	.			trans	-45.3	107.2	161.5	-81.6	157.2	0	0	0	107.3	G50 K54	G50-L52 PolarHBondContact O-N 2.95Å; L52-K54 PolarHBondContact O-N 3.35Å
53	K	47.3	Very low	69.6	Low	98 Å²	98	84.1 Å²	84.1	43%	0.426	44%	0.438	S	S	.	.			trans	-63.1	125.6	178.5	-84.7	177.8	173.3	171.5	0	106.7	L51 G55 C57 D89 S91	L51-K53 PolarHBondContact O-N 3.36Å; K53-G55 PolarHBondContact O-N 2.8Å; K53-C57 HydrophobicContact CB-CB 4.14Å; K53-D89 IonicContact NZ-OD1 3.48Å; K53-D89 PolarHBondContact NZ-OD1 3.48Å; K53-D89 IonicContact NZ-OD2 2.82Å; K53-D89 PolarHBondContact NZ-OD2 2.84Å; K53-S91 PolarHBondContact NZ-OG 2.81Å
54	K	46.9	Very low	70	Confident	204 Å²	204	82.8 Å²	82.8	89%	0.887	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	124.9	175.6	-111	179.4	174.6	179.7	0	108.5	L52	L52-K54 PolarHBondContact O-N 3.35Å
55	G	54.8	Low	70.5	Confident	50 Å²	50	85.1 Å²	85.1	52%	0.515	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	101.1	66.7	167.4	0	0	0	0	0	115.4	K53 C57	K53-G55 PolarHBondContact O-N 2.8Å; G55-C57 VanDerWaalsContact C-N 3.28Å; G55-C57 PolarHBondContact O-N 3.5Å; G55-C57 PolarHBondContact O-SG 2.92Å
56	A	79.2	Confident	71.2	Confident	42 Å²	42	81.2 Å²	81.2	35%	0.347	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	41.8	167.6	0	0	0	0	0	114.4	A62 C63	A56-A62 CarbonylContact O-C 3.51Å; A56-A62 WeakPolarHBondContact O-CA 3.26Å; A56-C63 VanDerWaalsContact CB-O 3.22Å; A56-C63 WeakPolarHBondContact CB-O 3.45Å; A56-C63 PolarHBondContact O-N 3.34Å
57	C	86.6	Confident	72.5	Confident	13 Å²	13	82 Å²	82	9%	0.088	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	136.5	172.9	-56.7	0	0	0	0	109.4	K53 G55 D61	K53-C57 HydrophobicContact CB-CB 4.14Å; G55-C57 VanDerWaalsContact C-N 3.28Å; G55-C57 PolarHBondContact O-N 3.5Å; G55-C57 PolarHBondContact O-SG 2.92Å; C57-D61 CarbonylContact C-O 3.55Å; C57-D61 WeakPolarHBondContact CA-O 3.49Å
58	Y	90.1	Very high	74.1	Confident	58 Å²	58	76.3 Å²	76.3	23%	0.227	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	90.5	-176.8	-56.6	-76.9	0	0	0	109.1	G42 D60 D61 D291 T293	G42-Y58 VanDerWaalsContact O-CD1 3.27Å; G42-Y58 WeakPolarHBondContact O-CD1 3.4Å; Y58-D60 PolarHBondContact O-N 3.19Å; Y58-D61 PolarHBondContact N-O 3.11Å; Y58-D61 WeakPolarHBondContact O-CB 3.4Å; Y58-D61 PolarHBondContact O-N 3.07Å; Y58-D291 WeakPolarHBondContact O-CB 3.37Å; Y58-T293 HydrophobicContact CD2-CG2 3.87Å; Y58-T293 WeakPolarHBondContact CD2-OG1 3.39Å; Y58-T293 HydrophobicContact CE2-CG2 4.07Å
59	G	92.2	Very high	76.6	Confident	34 Å²	34	76.3 Å²	76.3	35%	0.351	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-123.4	-167.4	0	0	0	0	0	111	S91	G59-S91 VanDerWaalsContact O-CB 3.27Å; G59-S91 WeakPolarHBondContact O-CB 3.25Å
60	D	95.3	Very high	79.4	Confident	11 Å²	11	67 Å²	67	6%	0.059	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.6	173.7	-61.9	-35.6	0	0	0	113.2	Y58 G79 R84 P90 S91 S94 D291	Y58-D60 PolarHBondContact O-N 3.19Å; D60-G79 PolarHBondContact O-N 2.75Å; D60-R84 IonicContact OD1-NH2 3.68Å; D60-R84 PolarHBondContact OD1-NH2 2.82Å; D60-R84 IonicContact OD2-CZ 3.4Å; D60-R84 IonicContact OD2-NH1 2.85Å; D60-R84 PolarHBondContact OD2-NH1 2.95Å; D60-R84 IonicContact OD2-NH2 3.25Å; D60-R84 PolarHBondContact OD2-NH2 3.39Å; D60-P90 HydrophobicContact CB-CB 4Å; D60-S91 PolarHBondContact OD1-N 2.71Å; D60-S94 WeakPolarHBondContact O-CB 3.37Å; D60-S94 PolarHBondContact O-OG 2.79Å; D60-D291 WeakPolarHBondContact CA-OD2 3.24Å; D60-D291 VanDerWaalsContact CB-OD2 3.29Å; D60-D291 WeakPolarHBondContact CB-OD2 3.21Å; D60-D291 PolarHBondContact N-OD2 2.63Å
61	D	97.4	Very high	82.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	151.5	171.1	-75	-9.7	0	0	0	112.9	C57 Y58 A77 D78 T222 D291 I292 T293	C57-D61 CarbonylContact C-O 3.55Å; C57-D61 WeakPolarHBondContact CA-O 3.49Å; Y58-D61 PolarHBondContact N-O 3.11Å; Y58-D61 WeakPolarHBondContact O-CB 3.4Å; Y58-D61 PolarHBondContact O-N 3.07Å; D61-A77 CarbonylContact C-O 3.58Å; D61-A77 WeakPolarHBondContact CA-O 3.44Å; D61-D78 WeakPolarHBondContact OD1-CA 3.37Å; D61-D78 WeakPolarHBondContact OD1-CB 3.42Å; D61-T222 HydrophobicContact CB-CG2 4.37Å; D61-T222 WeakPolarHBondContact OD1-CG2 3.4Å; D61-T222 WeakPolarHBondContact OD2-CB 3.48Å; D61-T222 WeakPolarHBondContact OD2-CG2 3.38Å; D61-T222 PolarHBondContact OD2-OG1 2.55Å; D61-D291 HydrophobicContact CB-CB 4.3Å; D61-I292 PolarHBondContact OD2-N 3.45Å; D61-T293 WeakPolarHBondContact CB-OG1 3.41Å; D61-T293 VanDerWaalsContact OD2-CB 3.3Å; D61-T293 WeakPolarHBondContact OD2-CB 3.18Å; D61-T293 PolarHBondContact OD2-N 2.72Å; D61-T293 VanDerWaalsContact OD2-N 3.13Å; D61-T293 PolarHBondContact OD2-OG1 3.01Å
62	A	97.5	Very high	85.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	154.6	166.3	0	0	0	0	0	112.3	A56 V76 A77 G95 M98	A56-A62 CarbonylContact O-C 3.51Å; A56-A62 WeakPolarHBondContact O-CA 3.26Å; A62-V76 CarbonylContact O-C 3.58Å; A62-V76 WeakPolarHBondContact O-CA 3.26Å; A62-A77 PolarHBondContact N-O 3.02Å; A62-A77 PolarHBondContact O-N 3.37Å; A62-G95 VanDerWaalsContact CB-CA 3.47Å; A62-M98 HydrophobicContact CB-CB 4.14Å; A62-M98 HydrophobicContact CB-CG 3.83Å
63	C	98.2	Very high	87.9	Confident	10 Å²	10	48.6 Å²	48.6	7%	0.068	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	167.4	172.5	69.7	0	0	0	0	112.8	A56 G75 V76 T293 L295	A56-C63 VanDerWaalsContact CB-O 3.22Å; A56-C63 WeakPolarHBondContact CB-O 3.45Å; A56-C63 PolarHBondContact O-N 3.34Å; C63-G75 CarbonylContact C-O 3.59Å; C63-G75 WeakPolarHBondContact CA-O 3.21Å; C63-G75 WeakPolarHBondContact CB-O 3.44Å; C63-V76 HydrophobicContact CB-CG1 3.87Å; C63-T293 HydrophobicContact CB-CG2 3.78Å; C63-L295 HydrophobicContact CB-CD1 4.1Å; C63-L295 HydrophobicContact CB-CD2 4.4Å; C63-L295 HydrophobicContact CB-CG 4.35Å
64	F	97.7	Very high	90.3	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.026	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	158.3	169.5	76.2	-83.4	0	0	0	111.7	A66 V73 L74 G75 M98 C101 E102 V105 I141	F64-A66 HydrophobicContact CD2-CB 3.98Å; F64-A66 HydrophobicContact CE2-CB 4.1Å; F64-V73 HydrophobicContact CE2-CB 4.3Å; F64-V73 HydrophobicContact CE2-CG1 3.89Å; F64-V73 HydrophobicContact CZ-CG1 3.9Å; F64-L74 VanDerWaalsContact O-CA 3.29Å; F64-L74 WeakPolarHBondContact O-CA 3.16Å; F64-G75 PolarHBondContact N-O 3.16Å; F64-G75 PolarHBondContact O-N 2.93Å; F64-M98 HydrophobicContact CD1-CB 3.98Å; F64-M98 HydrophobicContact CD1-CG 4.34Å; F64-M98 WeakPolarHBondContact CD1-O 3.36Å; F64-M98 HydrophobicContact CD1-SD 3.6Å; F64-M98 HydrophobicContact CE1-SD 3.79Å; F64-C101 HydrophobicContact CD1-CB 4.12Å; F64-C101 HydrophobicContact CE1-CB 3.41Å; F64-C101 VanDerWaalsContact CE1-CB 3.41Å; F64-C101 HydrophobicContact CE2-CB 4.4Å; F64-C101 HydrophobicContact CZ-CB 3.58Å; F64-E102 HydrophobicContact CB-CB 3.84Å; F64-E102 HydrophobicContact CB-CG 4.05Å; F64-E102 HydrophobicContact CD2-CB 3.69Å; F64-E102 HydrophobicContact CD2-CG 3.92Å; F64-E102 HydrophobicContact CE2-CB 4.45Å; F64-E102 HydrophobicContact CG-CB 3.83Å; F64-E102 HydrophobicContact CG-CG 4.29Å; F64-V105 HydrophobicContact CE2-CG2 4.47Å; F64-I141 HydrophobicContact CE1-CD1 3.83Å; F64-I141 HydrophobicContact CZ-CD1 4.2Å
65	V	97.1	Very high	92.8	Very high	69 Å²	69	34.2 Å²	34.2	42%	0.418	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	121.4	168.2	-178	0	0	0	0	107.3	T38 L74 L295	T38-V65 HydrophobicContact CG2-CG1 4.23Å; T38-V65 HydrophobicContact CG2-CG2 3.71Å; V65-L74 HydrophobicContact CG2-CB 4.25Å; V65-L295 HydrophobicContact CG2-CD1 4.12Å; V65-L295 HydrophobicContact CG2-CD2 4.19Å
66	A	96.8	Very high	94.8	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.008	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	131.3	-177.6	0	0	0	0	0	110.7	F64 V73 E102 V105 K106	F64-A66 HydrophobicContact CD2-CB 3.98Å; F64-A66 HydrophobicContact CE2-CB 4.1Å; A66-V73 PolarHBondContact N-O 3.29Å; A66-V73 PolarHBondContact O-N 3.05Å; A66-E102 HydrophobicContact CB-CG 4.01Å; A66-V105 HydrophobicContact CB-CB 3.83Å; A66-V105 HydrophobicContact CB-CG1 3.56Å; A66-K106 HydrophobicContact CB-CG 4.39Å
67	R	94.9	Very high	95.8	Very high	136 Å²	136	29.8 Å²	29.8	51%	0.513	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.1	174.5	-176.1	157.5	88	140.3	11.5	109.6	D72 R146 D304	R67-D72 VanDerWaalsContact CG-OD1 3.23Å; R67-D72 WeakPolarHBondContact CG-OD1 3.26Å; R67-R146 VanDerWaalsContact CD-NH2 3.33Å; R67-D304 PolarHBondContact NH2-OXT 3.04Å
68	H	95.1	Very high	96.3	Very high	33 Å²	33	29.9 Å²	29.9	15%	0.153	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	161.5	169.8	-177.1	-105.9	0	0	0	109.4	S70 A71 V105 G108 F110 R146	H68-S70 PolarHBondContact ND1-OG 3.06Å; H68-S70 PolarHBondContact O-N 2.7Å; H68-A71 CarbonylContact C-O 3.57Å; H68-A71 PolarHBondContact N-O 3.21Å; H68-A71 PolarHBondContact O-N 3.08Å; H68-V105 HydrophobicContact CB-CG1 4.14Å; H68-V105 PolarHBondContact CD2-O 2.86Å; H68-G108 WeakPolarHBondContact NE2-CA 3.46Å; H68-F110 HydrophobicContact CB-CE1 3.89Å; H68-F110 HydrophobicContact CB-CZ 3.9Å; H68-F110 AromaticContact CG-CE1 3.73Å; H68-F110 AromaticContact ND1-CE1 3.69Å; H68-F110 AromaticContact ND1-CZ 3.82Å; H68-R146 PolarHBondContact O-NE 3.2Å
69	R	92.3	Very high	96.7	Very high	213 Å²	213	27.1 Å²	27.1	80%	0.804	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-28.1	-178.2	61.1	174.1	-177.4	-173.3	-0	114.2
70	S	93.1	Very high	96.9	Very high	30 Å²	30	27 Å²	27	21%	0.21	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.4	-11.4	-174.6	59.6	0	0	0	0	113.9	H68 R146	H68-S70 PolarHBondContact ND1-OG 3.06Å; H68-S70 PolarHBondContact O-N 2.7Å; S70-R146 WeakPolarHBondContact O-CB 3.2Å; S70-R146 PolarHBondContact O-N 2.9Å
71	A	97	Very high	96.8	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	151.3	-174.7	0	0	0	0	0	112.7	H68 V73 F110 P112 V143 L144	H68-A71 CarbonylContact C-O 3.57Å; H68-A71 PolarHBondContact N-O 3.21Å; H68-A71 PolarHBondContact O-N 3.08Å; A71-V73 HydrophobicContact CB-CG2 4.23Å; A71-F110 HydrophobicContact CB-CE2 3.86Å; A71-F110 HydrophobicContact CB-CZ 3.93Å; A71-P112 HydrophobicContact CB-CB 4.18Å; A71-P112 HydrophobicContact CB-CG 4.16Å; A71-V143 HydrophobicContact CB-CG1 3.89Å; A71-L144 WeakPolarHBondContact CA-O 3.47Å; A71-L144 VanDerWaalsContact CB-O 3.28Å; A71-L144 WeakPolarHBondContact CB-O 3.34Å
72	D	97.7	Very high	96.5	Very high	10 Å²	10	30.1 Å²	30.1	5%	0.053	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	131.8	157	-72.6	-40.5	0	0	0	108.7	G35 L36 R67 V143 L144 R146	G35-D72 WeakPolarHBondContact CA-OD2 3.37Å; L36-D72 HydrophobicContact CB-CB 4.03Å; L36-D72 HydrophobicContact CD1-CB 3.85Å; L36-D72 HydrophobicContact CG-CB 3.88Å; L36-D72 PolarHBondContact N-OD2 2.98Å; R67-D72 VanDerWaalsContact CG-OD1 3.23Å; R67-D72 WeakPolarHBondContact CG-OD1 3.26Å; D72-V143 WeakPolarHBondContact O-CA 3.34Å; D72-L144 HydrophobicContact CB-CB 4.42Å; D72-L144 PolarHBondContact N-O 3.46Å; D72-L144 VanDerWaalsContact N-O 3.07Å; D72-L144 PolarHBondContact O-N 3.06Å; D72-R146 IonicContact OD1-CZ 3.72Å; D72-R146 IonicContact OD1-NH2 3.23Å; D72-R146 PolarHBondContact OD1-NH2 2.95Å; D72-R146 IonicContact OD2-CZ 3.55Å; D72-R146 VanDerWaalsContact OD2-CZ 3.23Å; D72-R146 IonicContact OD2-NH1 3.62Å; D72-R146 PolarHBondContact OD2-NH1 2.83Å; D72-R146 IonicContact OD2-NH2 2.82Å; D72-R146 PolarHBondContact OD2-NH2 2.93Å
73	V	98.6	Very high	96.4	Very high	1 Å²	1	31 Å²	31	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	133.5	-178.6	-171.2	0	0	0	0	109.2	F64 A66 A71 V105 F110 I118 I141 V142 V143	F64-V73 HydrophobicContact CE2-CB 4.3Å; F64-V73 HydrophobicContact CE2-CG1 3.89Å; F64-V73 HydrophobicContact CZ-CG1 3.9Å; A66-V73 PolarHBondContact N-O 3.29Å; A66-V73 PolarHBondContact O-N 3.05Å; A71-V73 HydrophobicContact CB-CG2 4.23Å; V73-V105 HydrophobicContact CB-CB 4.49Å; V73-V105 HydrophobicContact CB-CG1 3.94Å; V73-V105 HydrophobicContact CB-CG2 3.84Å; V73-V105 HydrophobicContact CG1-CG2 3.87Å; V73-V105 HydrophobicContact CG2-CB 4.41Å; V73-V105 HydrophobicContact CG2-CG1 3.63Å; V73-V105 HydrophobicContact CG2-CG2 3.81Å; V73-F110 HydrophobicContact CG2-CE2 3.92Å; V73-F110 HydrophobicContact CG2-CZ 4.24Å; V73-I118 HydrophobicContact CG1-CD1 4.13Å; V73-I141 HydrophobicContact CG1-CG2 4.03Å; V73-V142 WeakPolarHBondContact CA-O 3.28Å; V73-V143 HydrophobicContact CB-CG2 4.47Å; V73-V143 HydrophobicContact CG1-CG2 3.85Å; V73-V143 HydrophobicContact CG2-CB 4.45Å; V73-V143 HydrophobicContact CG2-CG1 4.06Å; V73-V143 HydrophobicContact CG2-CG2 4.03Å
74	L	97.9	Very high	96.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	156.3	173.8	59.6	93	0	0	0	109.7	L36 T38 F64 V65 V142 T220 L295 S297	L36-L74 HydrophobicContact CD1-CD2 3.76Å; T38-L74 HydrophobicContact CG2-CD2 4.42Å; F64-L74 VanDerWaalsContact O-CA 3.29Å; F64-L74 WeakPolarHBondContact O-CA 3.16Å; V65-L74 HydrophobicContact CG2-CB 4.25Å; L74-V142 HydrophobicContact CD1-CB 3.72Å; L74-V142 HydrophobicContact CD1-CG1 4.42Å; L74-V142 HydrophobicContact CD1-CG2 4.08Å; L74-V142 HydrophobicContact CG-CB 4.01Å; L74-V142 HydrophobicContact CG-CG1 4.48Å; L74-V142 PolarHBondContact N-O 3.08Å; L74-V142 PolarHBondContact O-N 3.23Å; L74-T220 HydrophobicContact CD1-CG2 3.77Å; L74-T220 VanDerWaalsContact CD1-OG1 3.27Å; L74-T220 WeakPolarHBondContact CD1-OG1 3.49Å; L74-L295 HydrophobicContact CB-CD1 3.95Å; L74-L295 HydrophobicContact CD1-CD1 4.06Å; L74-S297 VanDerWaalsContact CD2-OG 3.24Å; L74-S297 WeakPolarHBondContact CD2-OG 3.47Å
75	G	98.4	Very high	95.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	155.6	176.5	0	0	0	0	0	112.8	C63 F64 C140	C63-G75 CarbonylContact C-O 3.59Å; C63-G75 WeakPolarHBondContact CA-O 3.21Å; C63-G75 WeakPolarHBondContact CB-O 3.44Å; F64-G75 PolarHBondContact N-O 3.16Å; F64-G75 PolarHBondContact O-N 2.93Å; G75-C140 CarbonylContact C-O 3.44Å; G75-C140 WeakPolarHBondContact CA-O 3.43Å
76	V	98.8	Very high	95.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.7	174.6	-60.9	0	0	0	0	108.9	A62 C63 A139 C140 T220 T222 T293 L295	A62-V76 CarbonylContact O-C 3.58Å; A62-V76 WeakPolarHBondContact O-CA 3.26Å; C63-V76 HydrophobicContact CB-CG1 3.87Å; V76-A139 WeakPolarHBondContact O-CA 3.26Å; V76-C140 HydrophobicContact CG2-CB 3.84Å; V76-C140 PolarHBondContact N-O 3.14Å; V76-C140 PolarHBondContact O-N 3.45Å; V76-T220 HydrophobicContact CG1-CG2 4.08Å; V76-T220 HydrophobicContact CG2-CG2 3.8Å; V76-T222 HydrophobicContact CB-CG2 4.05Å; V76-T222 HydrophobicContact CG2-CG2 4.29Å; V76-T293 HydrophobicContact CG1-CG2 4.15Å; V76-L295 HydrophobicContact CG1-CD1 3.97Å; V76-L295 HydrophobicContact CG1-CG 4.1Å
77	A	98.6	Very high	95.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	134.6	172.6	0	0	0	0	0	109.1	D61 A62 M98 T138	D61-A77 CarbonylContact C-O 3.58Å; D61-A77 WeakPolarHBondContact CA-O 3.44Å; A62-A77 PolarHBondContact N-O 3.02Å; A62-A77 PolarHBondContact O-N 3.37Å; A77-M98 HydrophobicContact CB-CE 3.72Å; A77-M98 HydrophobicContact CB-CG 3.9Å; A77-M98 HydrophobicContact CB-SD 4Å; A77-T138 WeakPolarHBondContact CA-O 3.4Å; A77-T138 WeakPolarHBondContact CB-O 3.4Å
78	D	98.4	Very high	95.2	Very high	14 Å²	14	47 Å²	47	8%	0.075	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.4	171	165.7	31	0	0	0	109.6	D61 S137 T138 T222	D61-D78 WeakPolarHBondContact OD1-CA 3.37Å; D61-D78 WeakPolarHBondContact OD1-CB 3.42Å; D78-S137 CarbonylContact O-C 3.47Å; D78-S137 WeakPolarHBondContact O-CA 3.42Å; D78-S137 WeakPolarHBondContact O-CB 3.39Å; D78-T138 WeakPolarHBondContact CB-OG1 3.42Å; D78-T138 PolarHBondContact N-OG1 3.17Å; D78-T138 VanDerWaalsContact N-OG1 3.12Å; D78-T138 PolarHBondContact O-N 3.32Å; D78-T222 HydrophobicContact CB-CG2 4.06Å
79	G	97.9	Very high	95.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-81.2	121.8	177.2	0	0	0	0	0	111.5	D60 G81 P90 S136	D60-G79 PolarHBondContact O-N 2.75Å; G79-G81 PolarHBondContact O-N 3.42Å; G79-P90 WeakPolarHBondContact O-CB 3.27Å; G79-S136 WeakPolarHBondContact CA-O 3.36Å
80	V	96.3	Very high	95.3	Very high	32 Å²	32	37.9 Å²	37.9	19%	0.194	22%	0.218	C	C	.	.			trans	-62.6	113.4	-172.4	178.8	0	0	0	0	111.7	G82 W83 S136 Q185	V80-G82 PolarHBondContact O-N 3.01Å; V80-W83 VanDerWaalsContact O-CD1 3.31Å; V80-W83 PolarHBondContact O-N 2.81Å; V80-S136 VanDerWaalsContact CB-OG 3.31Å; V80-S136 WeakPolarHBondContact CB-OG 3.35Å; V80-S136 VanDerWaalsContact CG2-OG 3.29Å; V80-S136 WeakPolarHBondContact CG2-OG 3.37Å; V80-S136 PolarHBondContact N-O 3.4Å; V80-Q185 HydrophobicContact CG2-CB 4.44Å
81	G	93	Very high	95.4	Very high	36 Å²	36	36.7 Å²	36.7	37%	0.371	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-58.6	-25.2	-172.7	0	0	0	0	0	115.9	G79 W83 R84	G79-G81 PolarHBondContact O-N 3.42Å; G81-W83 PolarHBondContact O-N 3.34Å; G81-W83 VanDerWaalsContact O-N 3.11Å; G81-R84 VanDerWaalsContact O-CB 3.27Å; G81-R84 WeakPolarHBondContact O-CB 3.37Å; G81-R84 PolarHBondContact O-N 3.16Å; G81-R84 VanDerWaalsContact O-N 3.07Å
82	G	92.1	Very high	95.3	Very high	40 Å²	40	41.5 Å²	41.5	41%	0.412	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-60.3	-21.8	-178.2	0	0	0	0	0	114.6	V80 R84 D85	V80-G82 PolarHBondContact O-N 3.01Å; G82-R84 PolarHBondContact O-N 3.3Å; G82-D85 PolarHBondContact O-N 3Å
83	W	93.9	Very high	95.3	Very high	19 Å²	19	41 Å²	41	7%	0.072	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-62	-23.8	174.8	-78.3	104.2	0	0	0	113.9	V80 G81 D85 Y86 G87 V88 P90 G135 S136 V197	V80-W83 VanDerWaalsContact O-CD1 3.31Å; V80-W83 PolarHBondContact O-N 2.81Å; G81-W83 PolarHBondContact O-N 3.34Å; G81-W83 VanDerWaalsContact O-N 3.11Å; W83-D85 PolarHBondContact O-N 3.29Å; W83-Y86 PolarHBondContact O-N 2.86Å; W83-G87 PolarHBondContact O-N 2.91Å; W83-V88 CarbonylContact C-O 3.28Å; W83-V88 VanDerWaalsContact C-O 3.28Å; W83-V88 HydrophobicContact CB-CB 3.98Å; W83-V88 HydrophobicContact CB-CG1 4.02Å; W83-V88 HydrophobicContact CD2-CG1 4.37Å; W83-V88 HydrophobicContact CE3-CB 4Å; W83-V88 HydrophobicContact CE3-CG1 4.09Å; W83-V88 HydrophobicContact CE3-CG2 4.03Å; W83-V88 HydrophobicContact CG-CG1 4.37Å; W83-V88 PolarHBondContact O-N 3.13Å; W83-V88 VanDerWaalsContact O-N 3.13Å; W83-P90 HydrophobicContact CB-CG 4.27Å; W83-G135 VanDerWaalsContact CE2-C 3.44Å; W83-G135 VanDerWaalsContact CE2-CA 3.41Å; W83-G135 VanDerWaalsContact NE1-C 3.31Å; W83-S136 PolarHBondContact NE1-OG 2.94Å; W83-V197 HydrophobicContact CH2-CG1 4.21Å; W83-V197 HydrophobicContact CH2-CG2 4.21Å; W83-V197 HydrophobicContact CZ2-CG1 3.75Å
84	R	93.1	Very high	95.3	Very high	128 Å²	128	41 Å²	41	48%	0.483	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-60.9	-32.9	178.7	-171.1	171.4	-70.4	128.6	-0.4	112.6	D60 G81 G82 Y86 G87 V88	D60-R84 IonicContact OD1-NH2 3.68Å; D60-R84 PolarHBondContact OD1-NH2 2.82Å; D60-R84 IonicContact OD2-CZ 3.4Å; D60-R84 IonicContact OD2-NH1 2.85Å; D60-R84 PolarHBondContact OD2-NH1 2.95Å; D60-R84 IonicContact OD2-NH2 3.25Å; D60-R84 PolarHBondContact OD2-NH2 3.39Å; G81-R84 VanDerWaalsContact O-CB 3.27Å; G81-R84 WeakPolarHBondContact O-CB 3.37Å; G81-R84 PolarHBondContact O-N 3.16Å; G81-R84 VanDerWaalsContact O-N 3.07Å; G82-R84 PolarHBondContact O-N 3.3Å; R84-Y86 PolarHBondContact O-N 2.81Å; R84-G87 PolarHBondContact O-N 3.38Å; R84-V88 WeakPolarHBondContact CA-O 3.35Å; R84-V88 PolarHBondContact N-O 2.82Å
85	D	91.3	Very high	95.2	Very high	147 Å²	147	41 Å²	41	79%	0.786	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-66.3	-19.8	177.1	-67.9	-20.8	0	0	0	112.6	G82 W83	G82-D85 PolarHBondContact O-N 3Å; W83-D85 PolarHBondContact O-N 3.29Å
86	Y	90.1	Very high	95.2	Very high	187 Å²	187	42.5 Å²	42.5	73%	0.733	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-100.1	9.2	176.1	-58.1	-87.5	0	0	0	112.7	W83 R84 V88	W83-Y86 PolarHBondContact O-N 2.86Å; R84-Y86 PolarHBondContact O-N 2.81Å; Y86-V88 VanDerWaalsContact C-N 3.27Å; Y86-V88 PolarHBondContact O-N 2.86Å
87	G	92.1	Very high	95.1	Very high	73 Å²	73	42.5 Å²	42.5	75%	0.753	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	15.9	-178.6	0	0	0	0	0	114.3	W83 R84	W83-G87 PolarHBondContact O-N 2.91Å; R84-G87 PolarHBondContact O-N 3.38Å
88	V	93.6	Very high	95.1	Very high	25 Å²	25	42.6 Å²	42.6	15%	0.152	24%	0.24	C	C	.	.			trans	-98.6	129.7	176.8	174	0	0	0	0	108.9	W83 R84 Y86 P90 L134	W83-V88 CarbonylContact C-O 3.28Å; W83-V88 VanDerWaalsContact C-O 3.28Å; W83-V88 HydrophobicContact CB-CB 3.98Å; W83-V88 HydrophobicContact CB-CG1 4.02Å; W83-V88 HydrophobicContact CD2-CG1 4.37Å; W83-V88 HydrophobicContact CE3-CB 4Å; W83-V88 HydrophobicContact CE3-CG1 4.09Å; W83-V88 HydrophobicContact CE3-CG2 4.03Å; W83-V88 HydrophobicContact CG-CG1 4.37Å; W83-V88 PolarHBondContact O-N 3.13Å; W83-V88 VanDerWaalsContact O-N 3.13Å; R84-V88 WeakPolarHBondContact CA-O 3.35Å; R84-V88 PolarHBondContact N-O 2.82Å; Y86-V88 VanDerWaalsContact C-N 3.27Å; Y86-V88 PolarHBondContact O-N 2.86Å; V88-P90 VanDerWaalsContact O-CD 3.31Å; V88-P90 WeakPolarHBondContact O-CD 3.32Å; V88-L134 HydrophobicContact CG1-CB 4.1Å; V88-L134 WeakPolarHBondContact CG1-O 3.45Å; V88-L134 HydrophobicContact CG2-CB 4.03Å; V88-L134 HydrophobicContact CG2-CD1 4.36Å
89	D	94.4	Very high	95.1	Very high	53 Å²	53	47.3 Å²	47.3	28%	0.283	26%	0.257	S	S	.	.			trans	-82.6	109.3	178.6	178	-2.1	0	0	0	109.9	K53 S91 Q92	K53-D89 IonicContact NZ-OD1 3.48Å; K53-D89 PolarHBondContact NZ-OD1 3.48Å; K53-D89 IonicContact NZ-OD2 2.82Å; K53-D89 PolarHBondContact NZ-OD2 2.84Å; D89-S91 VanDerWaalsContact C-N 3.29Å; D89-S91 PolarHBondContact O-N 3.4Å; D89-S91 WeakPolarHBondContact OD1-CB 3.2Å; D89-S91 PolarHBondContact OD1-N 2.92Å; D89-S91 PolarHBondContact OD1-OG 2.9Å; D89-S91 PolarHBondContact OD2-OG 3.28Å; D89-Q92 HydrophobicContact CB-CG 4.01Å; D89-Q92 WeakPolarHBondContact O-CB 3.34Å; D89-Q92 PolarHBondContact O-N 3.1Å; D89-Q92 VanDerWaalsContact O-N 3.1Å
90	P	95.6	Very high	95.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.6	-36.8	-172.5	-18.9	29.7	0	0	0	113.3	D60 G79 W83 V88 Q92 F93	D60-P90 HydrophobicContact CB-CB 4Å; G79-P90 WeakPolarHBondContact O-CB 3.27Å; W83-P90 HydrophobicContact CB-CG 4.27Å; V88-P90 VanDerWaalsContact O-CD 3.31Å; V88-P90 WeakPolarHBondContact O-CD 3.32Å; P90-Q92 PolarHBondContact O-N 2.84Å; P90-F93 PolarHBondContact O-N 3.22Å
91	S	95.3	Very high	95.2	Very high	5 Å²	5	46.6 Å²	46.6	4%	0.035	25%	0.252	C	S	.	.	H	α-helix	trans	-57.6	-21	177.5	72.5	0	0	0	0	114.8	K53 G59 D60 D89 F93 S94 G95	K53-S91 PolarHBondContact NZ-OG 2.81Å; G59-S91 VanDerWaalsContact O-CB 3.27Å; G59-S91 WeakPolarHBondContact O-CB 3.25Å; D60-S91 PolarHBondContact OD1-N 2.71Å; D89-S91 VanDerWaalsContact C-N 3.29Å; D89-S91 PolarHBondContact O-N 3.4Å; D89-S91 WeakPolarHBondContact OD1-CB 3.2Å; D89-S91 PolarHBondContact OD1-N 2.92Å; D89-S91 PolarHBondContact OD1-OG 2.9Å; D89-S91 PolarHBondContact OD2-OG 3.28Å; S91-F93 VanDerWaalsContact C-N 3.35Å; S91-S94 WeakPolarHBondContact CA-OG 3.34Å; S91-S94 PolarHBondContact O-OG 3.04Å; S91-G95 WeakPolarHBondContact O-CA 3.44Å; S91-G95 PolarHBondContact O-N 3.41Å
92	Q	95.4	Very high	95.5	Very high	102 Å²	102	47.4 Å²	47.4	48%	0.477	25%	0.246	S	C	.	.	H	α-helix	trans	-70.1	-37.3	178.3	-67.1	-167.6	53.1	0	0	110.8	D89 P90 T96 L133	D89-Q92 HydrophobicContact CB-CG 4.01Å; D89-Q92 WeakPolarHBondContact O-CB 3.34Å; D89-Q92 PolarHBondContact O-N 3.1Å; D89-Q92 VanDerWaalsContact O-N 3.1Å; P90-Q92 PolarHBondContact O-N 2.84Å; Q92-T96 WeakPolarHBondContact O-CB 3.44Å; Q92-T96 PolarHBondContact O-N 3.28Å; Q92-T96 VanDerWaalsContact O-N 3.09Å; Q92-T96 PolarHBondContact O-OG1 3.21Å; Q92-L133 HydrophobicContact CB-CD1 3.81Å
93	F	97	Very high	95.7	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-69.4	-60.7	179.5	-167.4	-79.1	0	0	0	110.7	P90 S91 G95 T96 L97 Y123 L126 L133 G135 S137 L186 I188	P90-F93 PolarHBondContact O-N 3.22Å; S91-F93 VanDerWaalsContact C-N 3.35Å; F93-G95 VanDerWaalsContact C-N 3.34Å; F93-G95 PolarHBondContact O-N 2.77Å; F93-T96 PolarHBondContact O-N 3.15Å; F93-L97 HydrophobicContact CE1-CD2 4.48Å; F93-L97 WeakPolarHBondContact O-CB 3.31Å; F93-L97 PolarHBondContact O-N 2.94Å; F93-Y123 HydrophobicContact CZ-CD2 4.37Å; F93-Y123 HydrophobicContact CZ-CE2 4.14Å; F93-L126 HydrophobicContact CE1-CD2 4.46Å; F93-L126 HydrophobicContact CE2-CD2 4.41Å; F93-L126 HydrophobicContact CZ-CD2 4.31Å; F93-L133 HydrophobicContact CD2-CD2 4.48Å; F93-L133 HydrophobicContact CD2-CG 4.42Å; F93-G135 VanDerWaalsContact CD2-C 3.41Å; F93-G135 WeakPolarHBondContact CD2-O 3.37Å; F93-G135 WeakPolarHBondContact CE2-O 3.29Å; F93-S137 WeakPolarHBondContact CD1-OG 3.36Å; F93-S137 WeakPolarHBondContact CE1-OG 3.36Å; F93-L186 HydrophobicContact CE1-CB 4.09Å; F93-L186 WeakPolarHBondContact CE1-O 3.43Å; F93-L186 HydrophobicContact CZ-CB 4.04Å; F93-L186 WeakPolarHBondContact CZ-O 3.29Å; F93-I188 HydrophobicContact CE2-CB 4.1Å; F93-I188 HydrophobicContact CE2-CD1 3.91Å; F93-I188 HydrophobicContact CE2-CG1 3.78Å
94	S	97.7	Very high	95.9	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-55.2	-47.9	179	57	0	0	0	0	111.5	D60 S91 T96 L97 M98	D60-S94 WeakPolarHBondContact O-CB 3.37Å; D60-S94 PolarHBondContact O-OG 2.79Å; S91-S94 WeakPolarHBondContact CA-OG 3.34Å; S91-S94 PolarHBondContact O-OG 3.04Å; S94-T96 PolarHBondContact O-N 2.81Å; S94-L97 PolarHBondContact O-N 3.36Å; S94-M98 WeakPolarHBondContact O-CG 3.23Å; S94-M98 PolarHBondContact O-N 2.86Å
95	G	96.9	Very high	96.2	Very high	1 Å²	1	42 Å²	42	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-62.8	-38.5	179.5	0	0	0	0	0	113.6	A62 S91 F93 R99	A62-G95 VanDerWaalsContact CB-CA 3.47Å; S91-G95 WeakPolarHBondContact O-CA 3.44Å; S91-G95 PolarHBondContact O-N 3.41Å; F93-G95 VanDerWaalsContact C-N 3.34Å; F93-G95 PolarHBondContact O-N 2.77Å; G95-R99 VanDerWaalsContact C-CZ 3.49Å; G95-R99 WeakPolarHBondContact O-CB 3.33Å; G95-R99 VanDerWaalsContact O-CG 3.29Å; G95-R99 WeakPolarHBondContact O-CG 3.24Å; G95-R99 PolarHBondContact O-N 2.8Å; G95-R99 VanDerWaalsContact O-N 3.16Å; G95-R99 PolarHBondContact O-NE 3.21Å; G95-R99 PolarHBondContact O-NH1 3.35Å
96	T	96.9	Very high	96.5	Very high	30 Å²	30	40.7 Å²	40.7	18%	0.184	20%	0.201	C	C	.	.	H	α-helix	trans	-75.8	-37.3	177.9	-55.2	0	0	0	0	111.2	Q92 F93 S94 R99 T100 L126 L133	Q92-T96 WeakPolarHBondContact O-CB 3.44Å; Q92-T96 PolarHBondContact O-N 3.28Å; Q92-T96 VanDerWaalsContact O-N 3.09Å; Q92-T96 PolarHBondContact O-OG1 3.21Å; F93-T96 PolarHBondContact O-N 3.15Å; S94-T96 PolarHBondContact O-N 2.81Å; T96-R99 PolarHBondContact O-N 3.09Å; T96-R99 PolarHBondContact OG1-NH2 3.07Å; T96-T100 WeakPolarHBondContact O-CB 3.47Å; T96-T100 PolarHBondContact O-N 2.83Å; T96-T100 PolarHBondContact O-OG1 3.41Å; T96-L126 HydrophobicContact CG2-CD1 4.13Å; T96-L126 HydrophobicContact CG2-CG 4.27Å; T96-L133 VanDerWaalsContact CB-CD2 3.49Å; T96-L133 HydrophobicContact CG2-CD2 3.8Å
97	L	98.3	Very high	96.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.1	-52.3	174.4	-175.8	67.4	0	0	0	110.9	F93 S94 R99 T100 C101 L119 L126 S137 A139 L186	F93-L97 HydrophobicContact CE1-CD2 4.48Å; F93-L97 WeakPolarHBondContact O-CB 3.31Å; F93-L97 PolarHBondContact O-N 2.94Å; S94-L97 PolarHBondContact O-N 3.36Å; L97-R99 PolarHBondContact O-N 3.03Å; L97-T100 PolarHBondContact O-N 2.71Å; L97-C101 PolarHBondContact O-N 2.85Å; L97-C101 PolarHBondContact O-SG 2.65Å; L97-C101 VanDerWaalsContact O-SG 3.33Å; L97-L119 HydrophobicContact CD1-CD1 4.28Å; L97-L119 HydrophobicContact CD2-CD1 4.12Å; L97-L126 HydrophobicContact CB-CD2 4.04Å; L97-L126 HydrophobicContact CD1-CD2 4.14Å; L97-S137 WeakPolarHBondContact CD2-OG 3.32Å; L97-A139 HydrophobicContact CD2-CB 4.06Å; L97-L186 HydrophobicContact CD1-CD1 4.31Å; L97-L186 HydrophobicContact CD2-CD1 4.11Å
98	M	98.3	Very high	97.1	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.015	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-40.5	180	-68	-58.8	96.8	0	0	112.9	A62 F64 A77 S94 T100 C101 E102 A139 I141	A62-M98 HydrophobicContact CB-CB 4.14Å; A62-M98 HydrophobicContact CB-CG 3.83Å; F64-M98 HydrophobicContact CD1-CB 3.98Å; F64-M98 HydrophobicContact CD1-CG 4.34Å; F64-M98 WeakPolarHBondContact CD1-O 3.36Å; F64-M98 HydrophobicContact CD1-SD 3.6Å; F64-M98 HydrophobicContact CE1-SD 3.79Å; A77-M98 HydrophobicContact CB-CE 3.72Å; A77-M98 HydrophobicContact CB-CG 3.9Å; A77-M98 HydrophobicContact CB-SD 4Å; S94-M98 WeakPolarHBondContact O-CG 3.23Å; S94-M98 PolarHBondContact O-N 2.86Å; M98-T100 VanDerWaalsContact C-N 3.33Å; M98-T100 PolarHBondContact O-N 3.19Å; M98-C101 PolarHBondContact O-N 3.44Å; M98-E102 WeakPolarHBondContact O-CB 3.37Å; M98-E102 PolarHBondContact O-N 3.43Å; M98-A139 HydrophobicContact CE-CB 4.45Å; M98-I141 HydrophobicContact CE-CD1 4.08Å
99	R	97.8	Very high	97.3	Very high	113 Å²	113	39.3 Å²	39.3	43%	0.426	18%	0.183	S	C	.	.	H	α-helix	trans	-62.4	-38.7	174	-77.9	-173.7	-63.9	-93.8	0.3	112.6	G95 T96 L97 R103	G95-R99 VanDerWaalsContact C-CZ 3.49Å; G95-R99 WeakPolarHBondContact O-CB 3.33Å; G95-R99 VanDerWaalsContact O-CG 3.29Å; G95-R99 WeakPolarHBondContact O-CG 3.24Å; G95-R99 PolarHBondContact O-N 2.8Å; G95-R99 VanDerWaalsContact O-N 3.16Å; G95-R99 PolarHBondContact O-NE 3.21Å; G95-R99 PolarHBondContact O-NH1 3.35Å; T96-R99 PolarHBondContact O-N 3.09Å; T96-R99 PolarHBondContact OG1-NH2 3.07Å; L97-R99 PolarHBondContact O-N 3.03Å; R99-R103 WeakPolarHBondContact O-CB 3.48Å; R99-R103 PolarHBondContact O-N 3.39Å
100	T	98	Very high	97.4	Very high	16 Å²	16	38.1 Å²	38.1	10%	0.098	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-44	177.1	-58.6	0	0	0	0	110.7	T96 L97 M98 E102 R103 L104 E125 L126	T96-T100 WeakPolarHBondContact O-CB 3.47Å; T96-T100 PolarHBondContact O-N 2.83Å; T96-T100 PolarHBondContact O-OG1 3.41Å; L97-T100 PolarHBondContact O-N 2.71Å; M98-T100 VanDerWaalsContact C-N 3.33Å; M98-T100 PolarHBondContact O-N 3.19Å; T100-E102 PolarHBondContact O-N 2.88Å; T100-R103 PolarHBondContact O-N 2.81Å; T100-L104 HydrophobicContact CG2-CD1 4.49Å; T100-L104 WeakPolarHBondContact O-CG 3.23Å; T100-L104 PolarHBondContact O-N 3.48Å; T100-E125 HydrophobicContact CG2-CB 4.25Å; T100-E125 WeakPolarHBondContact CG2-OE2 3.27Å; T100-L126 HydrophobicContact CG2-CD1 4.42Å
101	C	98.5	Very high	97.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56.6	-49.8	173.1	-67.6	0	0	0	0	111.5	F64 L97 M98 R103 L104 V105 I118 S122	F64-C101 HydrophobicContact CD1-CB 4.12Å; F64-C101 HydrophobicContact CE1-CB 3.41Å; F64-C101 VanDerWaalsContact CE1-CB 3.41Å; F64-C101 HydrophobicContact CE2-CB 4.4Å; F64-C101 HydrophobicContact CZ-CB 3.58Å; L97-C101 PolarHBondContact O-N 2.85Å; L97-C101 PolarHBondContact O-SG 2.65Å; L97-C101 VanDerWaalsContact O-SG 3.33Å; M98-C101 PolarHBondContact O-N 3.44Å; C101-R103 VanDerWaalsContact C-N 3.3Å; C101-R103 PolarHBondContact O-N 2.76Å; C101-L104 PolarHBondContact O-N 3.05Å; C101-V105 WeakPolarHBondContact O-CG2 3.48Å; C101-V105 PolarHBondContact O-N 3.21Å; C101-I118 HydrophobicContact CB-CG2 3.85Å; C101-S122 WeakPolarHBondContact CA-OG 3.38Å; C101-S122 PolarHBondContact N-OG 2.88Å; C101-S122 PolarHBondContact SG-OG 3.09Å
102	E	98.4	Very high	97.6	Very high	54 Å²	54	42.9 Å²	42.9	25%	0.252	21%	0.205	S	C	.	.	H	α-helix	trans	-56.2	-45.3	178.3	-167.4	-167.5	-167.1	0	0	111.5	F64 A66 M98 T100 V105 K106	F64-E102 HydrophobicContact CB-CB 3.84Å; F64-E102 HydrophobicContact CB-CG 4.05Å; F64-E102 HydrophobicContact CD2-CB 3.69Å; F64-E102 HydrophobicContact CD2-CG 3.92Å; F64-E102 HydrophobicContact CE2-CB 4.45Å; F64-E102 HydrophobicContact CG-CB 3.83Å; F64-E102 HydrophobicContact CG-CG 4.29Å; A66-E102 HydrophobicContact CB-CG 4.01Å; M98-E102 WeakPolarHBondContact O-CB 3.37Å; M98-E102 PolarHBondContact O-N 3.43Å; T100-E102 PolarHBondContact O-N 2.88Å; E102-V105 PolarHBondContact O-N 3.35Å; E102-K106 HydrophobicContact CG-CD 4.29Å; E102-K106 WeakPolarHBondContact O-CG 3.28Å; E102-K106 PolarHBondContact O-N 3.19Å; E102-K106 VanDerWaalsContact OE1-CE 3.29Å; E102-K106 WeakPolarHBondContact OE1-CE 3.12Å; E102-K106 IonicContact OE1-NZ 2.74Å; E102-K106 PolarHBondContact OE1-NZ 2.83Å; E102-K106 IonicContact OE2-NZ 2.67Å
103	R	97.9	Very high	97.7	Very high	73 Å²	73	41.5 Å²	41.5	28%	0.275	21%	0.206	S	C	.	.	H	α-helix	trans	-63.6	-46.5	179.2	-173.1	-174.1	58.9	62.5	11.5	111.7	R99 T100 C101 V105 K106 E107 E125	R99-R103 WeakPolarHBondContact O-CB 3.48Å; R99-R103 PolarHBondContact O-N 3.39Å; T100-R103 PolarHBondContact O-N 2.81Å; C101-R103 VanDerWaalsContact C-N 3.3Å; C101-R103 PolarHBondContact O-N 2.76Å; R103-V105 VanDerWaalsContact C-N 3.28Å; R103-V105 PolarHBondContact O-N 3.48Å; R103-K106 PolarHBondContact O-N 3.2Å; R103-E107 WeakPolarHBondContact CD-OE1 3.17Å; R103-E107 HydrophobicContact CG-CG 4.4Å; R103-E107 WeakPolarHBondContact CG-OE1 3.39Å; R103-E107 IonicContact CZ-OE1 4Å; R103-E107 IonicContact NH1-OE1 2.65Å; R103-E107 PolarHBondContact NH1-OE1 3.46Å; R103-E107 IonicContact NH1-OE2 3.65Å; R103-E107 PolarHBondContact NH1-OE2 3Å; R103-E107 WeakPolarHBondContact O-CB 3.36Å; R103-E107 WeakPolarHBondContact O-CG 3.32Å; R103-E107 PolarHBondContact O-N 3.27Å; R103-E125 IonicContact CZ-OE1 2.91Å; R103-E125 IonicContact CZ-OE2 3.19Å; R103-E125 IonicContact NH2-OE1 3.74Å; R103-E125 PolarHBondContact NH2-OE1 2.94Å; R103-E125 IonicContact NH2-OE2 3.42Å; R103-E125 PolarHBondContact NH2-OE2 2.95Å
104	L	98.4	Very high	97.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-41.1	177.3	-69.6	176	0	0	0	111.8	T100 C101 G108 R109 T121 S122	T100-L104 HydrophobicContact CG2-CD1 4.49Å; T100-L104 WeakPolarHBondContact O-CG 3.23Å; T100-L104 PolarHBondContact O-N 3.48Å; C101-L104 PolarHBondContact O-N 3.05Å; L104-G108 PolarHBondContact O-N 2.92Å; L104-R109 HydrophobicContact CB-CB 4.46Å; L104-R109 HydrophobicContact CD2-CB 3.9Å; L104-R109 PolarHBondContact O-N 2.93Å; L104-T121 HydrophobicContact CD1-CG2 3.65Å; L104-T121 HydrophobicContact CD2-CG2 3.97Å; L104-T121 HydrophobicContact CG-CG2 4.5Å; L104-S122 WeakPolarHBondContact CD1-OG 3.23Å
105	V	98.3	Very high	97.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-49.2	177	174.8	0	0	0	0	111.3	F64 A66 H68 V73 C101 E102 R103 E107 G108 F110 I118	F64-V105 HydrophobicContact CE2-CG2 4.47Å; A66-V105 HydrophobicContact CB-CB 3.83Å; A66-V105 HydrophobicContact CB-CG1 3.56Å; H68-V105 HydrophobicContact CB-CG1 4.14Å; H68-V105 PolarHBondContact CD2-O 2.86Å; V73-V105 HydrophobicContact CB-CB 4.49Å; V73-V105 HydrophobicContact CB-CG1 3.94Å; V73-V105 HydrophobicContact CB-CG2 3.84Å; V73-V105 HydrophobicContact CG1-CG2 3.87Å; V73-V105 HydrophobicContact CG2-CB 4.41Å; V73-V105 HydrophobicContact CG2-CG1 3.63Å; V73-V105 HydrophobicContact CG2-CG2 3.81Å; C101-V105 WeakPolarHBondContact O-CG2 3.48Å; C101-V105 PolarHBondContact O-N 3.21Å; E102-V105 PolarHBondContact O-N 3.35Å; R103-V105 VanDerWaalsContact C-N 3.28Å; R103-V105 PolarHBondContact O-N 3.48Å; V105-E107 VanDerWaalsContact C-N 3.28Å; V105-E107 PolarHBondContact O-N 3.22Å; V105-G108 PolarHBondContact O-N 2.99Å; V105-F110 HydrophobicContact CB-CD1 4.33Å; V105-F110 HydrophobicContact CB-CE1 4.27Å; V105-F110 HydrophobicContact CG1-CD1 4.4Å; V105-F110 HydrophobicContact CG1-CE1 3.85Å; V105-F110 HydrophobicContact CG1-CZ 4.01Å; V105-F110 HydrophobicContact CG2-CD1 4.34Å; V105-F110 HydrophobicContact CG2-CG 4.4Å; V105-F110 WeakPolarHBondContact O-CE1 3.31Å; V105-I118 HydrophobicContact CG2-CD1 4.09Å
106	K	97.6	Very high	97.8	Very high	119 Å²	119	46.5 Å²	46.5	52%	0.517	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-35.2	179.6	-73.9	177.3	-178.5	171.1	0	112.8	A66 E102 R103 G108	A66-K106 HydrophobicContact CB-CG 4.39Å; E102-K106 HydrophobicContact CG-CD 4.29Å; E102-K106 WeakPolarHBondContact O-CG 3.28Å; E102-K106 PolarHBondContact O-N 3.19Å; E102-K106 VanDerWaalsContact OE1-CE 3.29Å; E102-K106 WeakPolarHBondContact OE1-CE 3.12Å; E102-K106 IonicContact OE1-NZ 2.74Å; E102-K106 PolarHBondContact OE1-NZ 2.83Å; E102-K106 IonicContact OE2-NZ 2.67Å; R103-K106 PolarHBondContact O-N 3.2Å; K106-G108 VanDerWaalsContact C-N 3.25Å; K106-G108 PolarHBondContact O-N 2.79Å
107	E	97.7	Very high	97.9	Very high	103 Å²	103	46 Å²	46	48%	0.481	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.8	175.7	-70.3	175.2	-166.5	0	0	113.4	R103 V105 R109	R103-E107 WeakPolarHBondContact CD-OE1 3.17Å; R103-E107 HydrophobicContact CG-CG 4.4Å; R103-E107 WeakPolarHBondContact CG-OE1 3.39Å; R103-E107 IonicContact CZ-OE1 4Å; R103-E107 IonicContact NH1-OE1 2.65Å; R103-E107 PolarHBondContact NH1-OE1 3.46Å; R103-E107 IonicContact NH1-OE2 3.65Å; R103-E107 PolarHBondContact NH1-OE2 3Å; R103-E107 WeakPolarHBondContact O-CB 3.36Å; R103-E107 WeakPolarHBondContact O-CG 3.32Å; R103-E107 PolarHBondContact O-N 3.27Å; V105-E107 VanDerWaalsContact C-N 3.28Å; V105-E107 PolarHBondContact O-N 3.22Å; E107-R109 HydrophobicContact CB-CG 4.02Å; E107-R109 PolarHBondContact O-N 2.99Å; E107-R109 WeakPolarHBondContact OE2-CD 3.46Å; E107-R109 IonicContact OE2-NH1 3.19Å
108	G	97.3	Very high	97.9	Very high	32 Å²	32	46 Å²	46	33%	0.33	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.6	20.5	-176.7	0	0	0	0	0	113.7	H68 L104 V105 K106 F110	H68-G108 WeakPolarHBondContact NE2-CA 3.46Å; L104-G108 PolarHBondContact O-N 2.92Å; V105-G108 PolarHBondContact O-N 2.99Å; K106-G108 VanDerWaalsContact C-N 3.25Å; K106-G108 PolarHBondContact O-N 2.79Å; G108-F110 PolarHBondContact O-N 2.88Å
109	R	97.5	Very high	97.9	Very high	122 Å²	122	45.9 Å²	45.9	46%	0.46	23%	0.232	S	C	.	.			trans	-88.9	49.7	178.6	-65.9	179.7	63.2	-154.7	-11.5	111.3	L104 E107 E125	L104-R109 HydrophobicContact CB-CB 4.46Å; L104-R109 HydrophobicContact CD2-CB 3.9Å; L104-R109 PolarHBondContact O-N 2.93Å; E107-R109 HydrophobicContact CB-CG 4.02Å; E107-R109 PolarHBondContact O-N 2.99Å; E107-R109 WeakPolarHBondContact OE2-CD 3.46Å; E107-R109 IonicContact OE2-NH1 3.19Å; R109-E125 IonicContact CZ-OE1 3.97Å; R109-E125 IonicContact NH1-OE1 3.12Å; R109-E125 PolarHBondContact NH1-OE1 3.38Å; R109-E125 IonicContact NH2-OE1 3.15Å; R109-E125 PolarHBondContact NH2-OE1 3.38Å
110	F	97.9	Very high	98	Very high	28 Å²	28	42.3 Å²	42.3	12%	0.123	22%	0.223	C	C	.	.	S	Bend	trans	-152.8	166.2	178.5	75.5	-71.7	0	0	0	111.1	H68 A71 V73 V105 G108 P112 I118	H68-F110 HydrophobicContact CB-CE1 3.89Å; H68-F110 HydrophobicContact CB-CZ 3.9Å; H68-F110 AromaticContact CG-CE1 3.73Å; H68-F110 AromaticContact ND1-CE1 3.69Å; H68-F110 AromaticContact ND1-CZ 3.82Å; A71-F110 HydrophobicContact CB-CE2 3.86Å; A71-F110 HydrophobicContact CB-CZ 3.93Å; V73-F110 HydrophobicContact CG2-CE2 3.92Å; V73-F110 HydrophobicContact CG2-CZ 4.24Å; V105-F110 HydrophobicContact CB-CD1 4.33Å; V105-F110 HydrophobicContact CB-CE1 4.27Å; V105-F110 HydrophobicContact CG1-CD1 4.4Å; V105-F110 HydrophobicContact CG1-CE1 3.85Å; V105-F110 HydrophobicContact CG1-CZ 4.01Å; V105-F110 HydrophobicContact CG2-CD1 4.34Å; V105-F110 HydrophobicContact CG2-CG 4.4Å; V105-F110 WeakPolarHBondContact O-CE1 3.31Å; G108-F110 PolarHBondContact O-N 2.88Å; F110-P112 HydrophobicContact CE2-CB 4.37Å; F110-P112 HydrophobicContact CE2-CG 3.9Å; F110-P112 HydrophobicContact CZ-CG 4.5Å; F110-I118 HydrophobicContact CB-CD1 4.03Å; F110-I118 HydrophobicContact CB-CG1 3.61Å; F110-I118 HydrophobicContact CD2-CD1 3.9Å; F110-I118 HydrophobicContact CD2-CG1 4.41Å; F110-I118 HydrophobicContact CG-CD1 4.23Å; F110-I118 HydrophobicContact CG-CG1 4.35Å
111	V	97.4	Very high	98	Very high	83 Å²	83	44 Å²	44	50%	0.503	23%	0.233	S	C	.	.			trans	-116.5	122.5	171.6	178.7	0	0	0	0	107.4	S113 N114	V111-S113 WeakPolarHBondContact CG1-OG 3.47Å; V111-S113 PolarHBondContact O-N 3.42Å; V111-S113 VanDerWaalsContact O-N 3.16Å; V111-N114 HydrophobicContact CB-CB 4.23Å; V111-N114 HydrophobicContact CG1-CB 4.49Å; V111-N114 CarbonylContact O-C 3.51Å; V111-N114 PolarHBondContact O-N 2.86Å
112	P	96.9	Very high	98	Very high	22 Å²	22	44 Å²	44	14%	0.143	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-37.3	-174.7	-29.7	35.5	0	0	0	114.6	A71 F110 N114 V143 D145	A71-P112 HydrophobicContact CB-CB 4.18Å; A71-P112 HydrophobicContact CB-CG 4.16Å; F110-P112 HydrophobicContact CE2-CB 4.37Å; F110-P112 HydrophobicContact CE2-CG 3.9Å; F110-P112 HydrophobicContact CZ-CG 4.5Å; P112-N114 PolarHBondContact O-N 2.83Å; P112-V143 HydrophobicContact CB-CG1 4.05Å; P112-V143 VanDerWaalsContact O-CG1 3.26Å; P112-V143 WeakPolarHBondContact O-CG1 3.18Å; P112-D145 HydrophobicContact CB-CB 3.98Å
113	S	97.4	Very high	97.9	Very high	72 Å²	72	42.3 Å²	42.3	50%	0.503	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.6	178.9	58.6	0	0	0	0	114.9	V111	V111-S113 WeakPolarHBondContact CG1-OG 3.47Å; V111-S113 PolarHBondContact O-N 3.42Å; V111-S113 VanDerWaalsContact O-N 3.16Å
114	N	97.8	Very high	97.9	Very high	76 Å²	76	41.4 Å²	41.4	41%	0.406	23%	0.229	S	C	.	.			trans	-131.5	73.6	-177.5	-174.3	13.2	0	0	0	112.3	V111 P112 I116 G117	V111-N114 HydrophobicContact CB-CB 4.23Å; V111-N114 HydrophobicContact CG1-CB 4.49Å; V111-N114 CarbonylContact O-C 3.51Å; V111-N114 PolarHBondContact O-N 2.86Å; P112-N114 PolarHBondContact O-N 2.83Å; N114-I116 VanDerWaalsContact C-N 3.28Å; N114-I116 PolarHBondContact O-N 2.78Å; N114-G117 PolarHBondContact O-N 3.01Å; N114-G117 VanDerWaalsContact O-N 3.09Å; N114-G117 PolarHBondContact OD1-N 2.81Å
115	P	98.1	Very high	97.8	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.013	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-31.5	174.9	24.1	-33.9	0	0	0	113.3	G117 I118 L119 I141 V143 H152 T153 A154	P115-G117 PolarHBondContact O-N 3.2Å; P115-I118 WeakPolarHBondContact O-CB 3.28Å; P115-I118 PolarHBondContact O-N 3.31Å; P115-L119 PolarHBondContact O-N 3.11Å; P115-I141 HydrophobicContact CB-CB 4.33Å; P115-I141 HydrophobicContact CB-CG2 4.04Å; P115-V143 HydrophobicContact CB-CG2 4Å; P115-H152 HydrophobicContact CG-CB 4.03Å; P115-T153 WeakPolarHBondContact CG-O 3.24Å; P115-A154 HydrophobicContact CB-CB 3.86Å; P115-A154 HydrophobicContact CG-CB 3.98Å
116	I	98.4	Very high	97.7	Very high	29 Å²	29	43.9 Å²	43.9	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-57.3	-37.8	172.6	-64.3	177.8	0	0	0	110.4	N114 I118 L119 T120 A154 A205	N114-I116 VanDerWaalsContact C-N 3.28Å; N114-I116 PolarHBondContact O-N 2.78Å; I116-I118 VanDerWaalsContact C-N 3.29Å; I116-I118 PolarHBondContact O-N 2.82Å; I116-L119 PolarHBondContact O-N 2.86Å; I116-T120 VanDerWaalsContact O-CB 3.32Å; I116-T120 WeakPolarHBondContact O-CB 3.23Å; I116-T120 PolarHBondContact O-N 2.75Å; I116-T120 PolarHBondContact O-OG1 3.27Å; I116-A154 HydrophobicContact CG1-CB 3.76Å; I116-A205 HydrophobicContact CG1-CB 4.43Å
117	G	98.4	Very high	97.6	Very high	18 Å²	18	42.7 Å²	42.7	19%	0.186	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-34	176.2	0	0	0	0	0	113.9	N114 P115 T121	N114-G117 PolarHBondContact O-N 3.01Å; N114-G117 VanDerWaalsContact O-N 3.09Å; N114-G117 PolarHBondContact OD1-N 2.81Å; P115-G117 PolarHBondContact O-N 3.2Å; G117-T121 WeakPolarHBondContact O-CB 3.11Å; G117-T121 PolarHBondContact O-N 3.44Å; G117-T121 PolarHBondContact O-OG1 3.48Å
118	I	98.6	Very high	97.4	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-66	-52	173.6	-61.1	169.5	0	0	0	109.1	V73 C101 V105 F110 P115 I116 T120 T121 S122 I141 V143	V73-I118 HydrophobicContact CG1-CD1 4.13Å; C101-I118 HydrophobicContact CB-CG2 3.85Å; V105-I118 HydrophobicContact CG2-CD1 4.09Å; F110-I118 HydrophobicContact CB-CD1 4.03Å; F110-I118 HydrophobicContact CB-CG1 3.61Å; F110-I118 HydrophobicContact CD2-CD1 3.9Å; F110-I118 HydrophobicContact CD2-CG1 4.41Å; F110-I118 HydrophobicContact CG-CD1 4.23Å; F110-I118 HydrophobicContact CG-CG1 4.35Å; P115-I118 WeakPolarHBondContact O-CB 3.28Å; P115-I118 PolarHBondContact O-N 3.31Å; I116-I118 VanDerWaalsContact C-N 3.29Å; I116-I118 PolarHBondContact O-N 2.82Å; I118-T120 PolarHBondContact O-N 2.77Å; I118-T121 PolarHBondContact O-N 2.89Å; I118-S122 WeakPolarHBondContact O-CB 3.38Å; I118-S122 PolarHBondContact O-N 3.42Å; I118-S122 PolarHBondContact O-OG 3.09Å; I118-S122 VanDerWaalsContact O-OG 3.09Å; I118-I141 HydrophobicContact CD1-CG2 4.29Å; I118-V143 HydrophobicContact CD1-CG2 4.02Å
119	L	98.2	Very high	97	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.6	-46.3	-179	-174.6	61.3	0	0	0	111.6	L97 P115 I116 S122 Y123 A139 L156 L186 P202 A205	L97-L119 HydrophobicContact CD1-CD1 4.28Å; L97-L119 HydrophobicContact CD2-CD1 4.12Å; P115-L119 PolarHBondContact O-N 3.11Å; I116-L119 PolarHBondContact O-N 2.86Å; L119-S122 PolarHBondContact O-N 3.39Å; L119-Y123 WeakPolarHBondContact O-CB 3.46Å; L119-Y123 PolarHBondContact O-N 2.93Å; L119-A139 HydrophobicContact CD1-CB 3.56Å; L119-A139 HydrophobicContact CD2-CB 4.27Å; L119-L156 HydrophobicContact CD2-CB 4.33Å; L119-L186 HydrophobicContact CD1-CD1 3.67Å; L119-L186 HydrophobicContact CD2-CD1 4.46Å; L119-L186 HydrophobicContact CG-CD1 4.03Å; L119-P202 HydrophobicContact CD2-CB 4.35Å; L119-P202 HydrophobicContact CG-CB 4.28Å; L119-A205 HydrophobicContact CD2-CB 4.46Å
120	T	98.5	Very high	96.5	Very high	39 Å²	39	51.6 Å²	51.6	24%	0.239	28%	0.276	C	S	.	.	H	α-helix	trans	-60.3	-51.2	178.8	-56.5	0	0	0	0	111.5	I116 I118 S122 Y123 C124 P202	I116-T120 VanDerWaalsContact O-CB 3.32Å; I116-T120 WeakPolarHBondContact O-CB 3.23Å; I116-T120 PolarHBondContact O-N 2.75Å; I116-T120 PolarHBondContact O-OG1 3.27Å; I118-T120 PolarHBondContact O-N 2.77Å; T120-S122 VanDerWaalsContact C-N 3.32Å; T120-S122 PolarHBondContact O-N 2.97Å; T120-Y123 PolarHBondContact O-N 2.85Å; T120-C124 WeakPolarHBondContact O-CB 3.42Å; T120-C124 PolarHBondContact O-N 3.25Å; T120-C124 PolarHBondContact O-SG 3.4Å; T120-P202 VanDerWaalsContact OG1-CB 3.31Å; T120-P202 WeakPolarHBondContact OG1-CB 3.41Å
121	T	98.4	Very high	96	Very high	50 Å²	50	55.9 Å²	55.9	31%	0.307	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-41.9	-178.8	-55.5	0	0	0	0	110.7	L104 G117 I118 C124 E125	L104-T121 HydrophobicContact CD1-CG2 3.65Å; L104-T121 HydrophobicContact CD2-CG2 3.97Å; L104-T121 HydrophobicContact CG-CG2 4.5Å; G117-T121 WeakPolarHBondContact O-CB 3.11Å; G117-T121 PolarHBondContact O-N 3.44Å; G117-T121 PolarHBondContact O-OG1 3.48Å; I118-T121 PolarHBondContact O-N 2.89Å; T121-C124 PolarHBondContact O-N 3.06Å; T121-E125 PolarHBondContact O-N 3.46Å
122	S	98	Very high	95.6	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-48.6	175.6	-66.9	0	0	0	0	111.9	C101 L104 I118 L119 T120 C124 E125 L126	C101-S122 WeakPolarHBondContact CA-OG 3.38Å; C101-S122 PolarHBondContact N-OG 2.88Å; C101-S122 PolarHBondContact SG-OG 3.09Å; L104-S122 WeakPolarHBondContact CD1-OG 3.23Å; I118-S122 WeakPolarHBondContact O-CB 3.38Å; I118-S122 PolarHBondContact O-N 3.42Å; I118-S122 PolarHBondContact O-OG 3.09Å; I118-S122 VanDerWaalsContact O-OG 3.09Å; L119-S122 PolarHBondContact O-N 3.39Å; T120-S122 VanDerWaalsContact C-N 3.32Å; T120-S122 PolarHBondContact O-N 2.97Å; S122-C124 PolarHBondContact O-N 2.94Å; S122-E125 PolarHBondContact O-N 3.4Å; S122-L126 WeakPolarHBondContact O-CD1 3.24Å; S122-L126 PolarHBondContact O-N 3.28Å
123	Y	98.1	Very high	95.4	Very high	19 Å²	19	56 Å²	56	8%	0.075	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-42	179.8	-176.9	-132.6	0	0	0	112.4	F93 L119 T120 E125 L126 L127 L186 S187 I188 S199 P202	F93-Y123 HydrophobicContact CZ-CD2 4.37Å; F93-Y123 HydrophobicContact CZ-CE2 4.14Å; L119-Y123 WeakPolarHBondContact O-CB 3.46Å; L119-Y123 PolarHBondContact O-N 2.93Å; T120-Y123 PolarHBondContact O-N 2.85Å; Y123-E125 VanDerWaalsContact C-N 3.32Å; Y123-E125 PolarHBondContact O-N 3.18Å; Y123-L126 WeakPolarHBondContact O-CB 3.4Å; Y123-L126 PolarHBondContact O-N 3.34Å; Y123-L126 VanDerWaalsContact O-N 3.16Å; Y123-L127 HydrophobicContact CD1-CD1 4.03Å; Y123-L127 HydrophobicContact CD2-CG 4.42Å; Y123-L127 HydrophobicContact CE1-CD1 3.81Å; Y123-L127 HydrophobicContact CE2-CD1 4.29Å; Y123-L127 HydrophobicContact CE2-CD2 4.34Å; Y123-L127 HydrophobicContact CE2-CG 4.11Å; Y123-L127 HydrophobicContact CG-CD1 4.4Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.29Å; Y123-L186 HydrophobicContact CD1-CD2 3.98Å; Y123-L186 HydrophobicContact CD2-CB 4.05Å; Y123-L186 HydrophobicContact CD2-CD1 4.04Å; Y123-L186 HydrophobicContact CD2-CG 4.44Å; Y123-L186 HydrophobicContact CE1-CD2 4.07Å; Y123-L186 HydrophobicContact CE2-CB 3.93Å; Y123-L186 HydrophobicContact CG-CD1 3.94Å; Y123-L186 HydrophobicContact CG-CD2 4.22Å; Y123-L186 HydrophobicContact CG-CG 4.46Å; Y123-S187 PolarHBondContact OH-O 3.06Å; Y123-I188 HydrophobicContact CE2-CG1 4.1Å; Y123-S199 PolarHBondContact OH-OG 3.33Å; Y123-P202 HydrophobicContact CD1-CG 3.64Å; Y123-P202 HydrophobicContact CE1-CG 4.44Å; Y123-P202 HydrophobicContact CG-CG 4.33Å
124	C	97.6	Very high	95.3	Very high	54 Å²	54	55 Å²	55	37%	0.365	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-39.7	173.8	-70.4	0	0	0	0	112.6	T120 T121 S122 L127 Q128	T120-C124 WeakPolarHBondContact O-CB 3.42Å; T120-C124 PolarHBondContact O-N 3.25Å; T120-C124 PolarHBondContact O-SG 3.4Å; T121-C124 PolarHBondContact O-N 3.06Å; S122-C124 PolarHBondContact O-N 2.94Å; C124-L127 PolarHBondContact O-N 2.99Å; C124-Q128 VanDerWaalsContact O-CG 3.3Å; C124-Q128 WeakPolarHBondContact O-CG 3.45Å; C124-Q128 PolarHBondContact O-N 2.99Å
125	E	96.9	Very high	95.3	Very high	51 Å²	51	51.3 Å²	51.3	24%	0.238	28%	0.275	C	S	.	.	H	α-helix	trans	-66.2	-39	174.9	-73.8	-167.6	-168.6	0	0	111.8	T100 R103 R109 T121 S122 Y123 L127 Q128 N129	T100-E125 HydrophobicContact CG2-CB 4.25Å; T100-E125 WeakPolarHBondContact CG2-OE2 3.27Å; R103-E125 IonicContact CZ-OE1 2.91Å; R103-E125 IonicContact CZ-OE2 3.19Å; R103-E125 IonicContact NH2-OE1 3.74Å; R103-E125 PolarHBondContact NH2-OE1 2.94Å; R103-E125 IonicContact NH2-OE2 3.42Å; R103-E125 PolarHBondContact NH2-OE2 2.95Å; R109-E125 IonicContact CZ-OE1 3.97Å; R109-E125 IonicContact NH1-OE1 3.12Å; R109-E125 PolarHBondContact NH1-OE1 3.38Å; R109-E125 IonicContact NH2-OE1 3.15Å; R109-E125 PolarHBondContact NH2-OE1 3.38Å; T121-E125 PolarHBondContact O-N 3.46Å; S122-E125 PolarHBondContact O-N 3.4Å; Y123-E125 VanDerWaalsContact C-N 3.32Å; Y123-E125 PolarHBondContact O-N 3.18Å; E125-L127 PolarHBondContact O-N 2.85Å; E125-Q128 PolarHBondContact O-N 3.29Å; E125-N129 PolarHBondContact O-N 3.25Å
126	L	95.8	Very high	95.3	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.01	28%	0.275	C	S	.	.	H	α-helix	trans	-61.1	-43.2	175	-91.5	66.9	0	0	0	111.8	F93 T96 L97 T100 S122 Y123 Q128 N129 L133 I188	F93-L126 HydrophobicContact CE1-CD2 4.46Å; F93-L126 HydrophobicContact CE2-CD2 4.41Å; F93-L126 HydrophobicContact CZ-CD2 4.31Å; T96-L126 HydrophobicContact CG2-CD1 4.13Å; T96-L126 HydrophobicContact CG2-CG 4.27Å; L97-L126 HydrophobicContact CB-CD2 4.04Å; L97-L126 HydrophobicContact CD1-CD2 4.14Å; T100-L126 HydrophobicContact CG2-CD1 4.42Å; S122-L126 WeakPolarHBondContact O-CD1 3.24Å; S122-L126 PolarHBondContact O-N 3.28Å; Y123-L126 WeakPolarHBondContact O-CB 3.4Å; Y123-L126 PolarHBondContact O-N 3.34Å; Y123-L126 VanDerWaalsContact O-N 3.16Å; L126-Q128 PolarHBondContact O-N 2.9Å; L126-N129 WeakPolarHBondContact O-CB 3.43Å; L126-N129 PolarHBondContact O-N 3.05Å; L126-L133 HydrophobicContact CD2-CD2 3.87Å; L126-L133 HydrophobicContact CG-CD2 4.04Å; L126-I188 HydrophobicContact CB-CD1 3.94Å
127	L	94.7	Very high	95.3	Very high	93 Å²	93	49.9 Å²	49.9	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	-62	-27.9	176.9	-74.2	165.9	0	0	0	113.1	Y123 C124 E125 I188	Y123-L127 HydrophobicContact CD1-CD1 4.03Å; Y123-L127 HydrophobicContact CD2-CG 4.42Å; Y123-L127 HydrophobicContact CE1-CD1 3.81Å; Y123-L127 HydrophobicContact CE2-CD1 4.29Å; Y123-L127 HydrophobicContact CE2-CD2 4.34Å; Y123-L127 HydrophobicContact CE2-CG 4.11Å; Y123-L127 HydrophobicContact CG-CD1 4.4Å; Y123-L127 WeakPolarHBondContact O-CG 3.25Å; Y123-L127 PolarHBondContact O-N 3.29Å; C124-L127 PolarHBondContact O-N 2.99Å; E125-L127 PolarHBondContact O-N 2.85Å; L127-I188 HydrophobicContact CD2-CD1 4.1Å; L127-I188 HydrophobicContact CD2-CG1 3.72Å; L127-I188 HydrophobicContact CG-CD1 4.34Å; L127-I188 HydrophobicContact CG-CG1 4.39Å
128	Q	93.4	Very high	95.3	Very high	159 Å²	159	49 Å²	49	74%	0.743	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	2.9	-177.9	-67.8	173.8	6.5	0	0	113.4	C124 E125 L126 K130	C124-Q128 VanDerWaalsContact O-CG 3.3Å; C124-Q128 WeakPolarHBondContact O-CG 3.45Å; C124-Q128 PolarHBondContact O-N 2.99Å; E125-Q128 PolarHBondContact O-N 3.29Å; L126-Q128 PolarHBondContact O-N 2.9Å; Q128-K130 PolarHBondContact O-N 3.17Å
129	N	89.4	Confident	95.3	Very high	72 Å²	72	49 Å²	49	39%	0.385	26%	0.259	S	S	.	.			trans	-61.9	135.5	177.9	-82.1	-25.1	0	0	0	111.5	E125 L126 V131	E125-N129 PolarHBondContact O-N 3.25Å; L126-N129 WeakPolarHBondContact O-CB 3.43Å; L126-N129 PolarHBondContact O-N 3.05Å; N129-V131 WeakPolarHBondContact CB-O 3.3Å; N129-V131 PolarHBondContact O-N 2.82Å
130	K	86.2	Confident	95.3	Very high	213 Å²	213	49 Å²	49	93%	0.926	26%	0.259	S	S	*	.	S	Bend	trans	-59.2	-34.3	179.2	-67	-175	-179.7	-179.7	0	112.9	Q128	Q128-K130 PolarHBondContact O-N 3.17Å
131	V	87.8	Confident	95.3	Very high	118 Å²	118	47.1 Å²	47.1	72%	0.715	25%	0.247	S	C	*	.	S	Bend	trans	-105.7	115.2	171.6	179.9	0	0	0	0	105.8	N129 L133	N129-V131 WeakPolarHBondContact CB-O 3.3Å; N129-V131 PolarHBondContact O-N 2.82Å; V131-L133 PolarHBondContact O-N 3.25Å
132	P	88.6	Confident	95.4	Very high	89 Å²	89	44.7 Å²	44.7	58%	0.578	23%	0.233	S	C	*	.			trans	-56.4	124.9	179.8	-26.6	34.9	0	0	0	111.1	L134	P132-L134 VanDerWaalsContact C-N 3.34Å; P132-L134 HydrophobicContact CB-CD2 4.07Å; P132-L134 PolarHBondContact O-N 2.84Å
133	L	93.6	Very high	95.4	Very high	19 Å²	19	44.7 Å²	44.7	10%	0.099	23%	0.233	C	C	.	.			trans	-87.4	79.6	174.4	-176.2	69	0	0	0	108.3	Q92 F93 T96 L126 V131 I188	Q92-L133 HydrophobicContact CB-CD1 3.81Å; F93-L133 HydrophobicContact CD2-CD2 4.48Å; F93-L133 HydrophobicContact CD2-CG 4.42Å; T96-L133 VanDerWaalsContact CB-CD2 3.49Å; T96-L133 HydrophobicContact CG2-CD2 3.8Å; L126-L133 HydrophobicContact CD2-CD2 3.87Å; L126-L133 HydrophobicContact CG-CD2 4.04Å; V131-L133 PolarHBondContact O-N 3.25Å; L133-I188 WeakPolarHBondContact O-CB 3.37Å
134	L	95.8	Very high	95.4	Very high	50 Å²	50	43.8 Å²	43.8	26%	0.262	23%	0.229	S	C	.	.			trans	-61.4	143.7	178.9	-56.4	-175.8	0	0	0	110.2	V88 P132 I188 P190	V88-L134 HydrophobicContact CG1-CB 4.1Å; V88-L134 WeakPolarHBondContact CG1-O 3.45Å; V88-L134 HydrophobicContact CG2-CB 4.03Å; V88-L134 HydrophobicContact CG2-CD1 4.36Å; P132-L134 VanDerWaalsContact C-N 3.34Å; P132-L134 HydrophobicContact CB-CD2 4.07Å; P132-L134 PolarHBondContact O-N 2.84Å; L134-I188 WeakPolarHBondContact CA-O 3.4Å; L134-I188 HydrophobicContact CD2-CG2 4.23Å; L134-P190 HydrophobicContact CD1-CB 4.2Å; L134-P190 HydrophobicContact CD2-CB 4.32Å
135	G	96.8	Very high	95.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140.2	-179.1	-177.9	0	0	0	0	0	112.3	W83 F93 S187 I188	W83-G135 VanDerWaalsContact CE2-C 3.44Å; W83-G135 VanDerWaalsContact CE2-CA 3.41Å; W83-G135 VanDerWaalsContact NE1-C 3.31Å; F93-G135 VanDerWaalsContact CD2-C 3.41Å; F93-G135 WeakPolarHBondContact CD2-O 3.37Å; F93-G135 WeakPolarHBondContact CE2-O 3.29Å; G135-S187 WeakPolarHBondContact O-CA 3.48Å; G135-I188 PolarHBondContact N-O 2.6Å; G135-I188 PolarHBondContact O-N 3.46Å
136	S	97.8	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	159.6	170.9	63.6	0	0	0	0	111.4	G79 V80 W83 Q185 L186 S187	G79-S136 WeakPolarHBondContact CA-O 3.36Å; V80-S136 VanDerWaalsContact CB-OG 3.31Å; V80-S136 WeakPolarHBondContact CB-OG 3.35Å; V80-S136 VanDerWaalsContact CG2-OG 3.29Å; V80-S136 WeakPolarHBondContact CG2-OG 3.37Å; V80-S136 PolarHBondContact N-O 3.4Å; W83-S136 PolarHBondContact NE1-OG 2.94Å; S136-Q185 VanDerWaalsContact CB-OE1 3.32Å; S136-Q185 PolarHBondContact OG-OE1 3.47Å; S136-L186 CarbonylContact C-O 3.35Å; S136-L186 WeakPolarHBondContact CA-O 3.3Å; S136-L186 WeakPolarHBondContact CB-O 3.45Å; S136-S187 WeakPolarHBondContact CB-OG 3.18Å
137	S	98.3	Very high	94.7	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	157.4	172.5	74.4	0	0	0	0	112.2	D78 F93 L97 Q185 L186	D78-S137 CarbonylContact O-C 3.47Å; D78-S137 WeakPolarHBondContact O-CA 3.42Å; D78-S137 WeakPolarHBondContact O-CB 3.39Å; F93-S137 WeakPolarHBondContact CD1-OG 3.36Å; F93-S137 WeakPolarHBondContact CE1-OG 3.36Å; L97-S137 WeakPolarHBondContact CD2-OG 3.32Å; S137-Q185 WeakPolarHBondContact O-CA 3.15Å; S137-L186 PolarHBondContact N-O 3.16Å; S137-L186 PolarHBondContact O-N 2.9Å
138	T	98.6	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.23	C	C	.	.			trans	-72.2	171.9	157.6	65.1	0	0	0	0	109.8	A77 D78 L156 S159 P183	A77-T138 WeakPolarHBondContact CA-O 3.4Å; A77-T138 WeakPolarHBondContact CB-O 3.4Å; D78-T138 WeakPolarHBondContact CB-OG1 3.42Å; D78-T138 PolarHBondContact N-OG1 3.17Å; D78-T138 VanDerWaalsContact N-OG1 3.12Å; D78-T138 PolarHBondContact O-N 3.32Å; T138-L156 CarbonylContact C-O 3.58Å; T138-L156 WeakPolarHBondContact CA-O 3.41Å; T138-L156 VanDerWaalsContact CB-O 3.3Å; T138-L156 WeakPolarHBondContact CB-O 3.22Å; T138-S159 PolarHBondContact OG1-OG 2.99Å; T138-S159 VanDerWaalsContact OG1-OG 3.06Å; T138-P183 HydrophobicContact CG2-CB 3.8Å; T138-P183 HydrophobicContact CG2-CG 3.8Å
139	A	98.6	Very high	94.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	130	171	0	0	0	0	0	112.3	V76 L97 M98 L119 L156	V76-A139 WeakPolarHBondContact O-CA 3.26Å; L97-A139 HydrophobicContact CD2-CB 4.06Å; M98-A139 HydrophobicContact CE-CB 4.45Å; L119-A139 HydrophobicContact CD1-CB 3.56Å; L119-A139 HydrophobicContact CD2-CB 4.27Å; A139-L156 PolarHBondContact N-O 2.87Å; A139-L156 PolarHBondContact O-N 2.88Å
140	C	98.8	Very high	95.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.4	168.5	179.4	0	0	0	0	109.7	G75 V76 A154 N155	G75-C140 CarbonylContact C-O 3.44Å; G75-C140 WeakPolarHBondContact CA-O 3.43Å; V76-C140 HydrophobicContact CG2-CB 3.84Å; V76-C140 PolarHBondContact N-O 3.14Å; V76-C140 PolarHBondContact O-N 3.45Å; C140-A154 CarbonylContact C-O 3.56Å; C140-A154 WeakPolarHBondContact CA-O 3.48Å; C140-N155 VanDerWaalsContact CB-OD1 3.28Å; C140-N155 WeakPolarHBondContact CB-OD1 3.23Å
141	I	98.8	Very high	95.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.5	177.2	-53.1	-60	0	0	0	109.4	F64 V73 M98 P115 I118 V143 T153 A154	F64-I141 HydrophobicContact CE1-CD1 3.83Å; F64-I141 HydrophobicContact CZ-CD1 4.2Å; V73-I141 HydrophobicContact CG1-CG2 4.03Å; M98-I141 HydrophobicContact CE-CD1 4.08Å; P115-I141 HydrophobicContact CB-CB 4.33Å; P115-I141 HydrophobicContact CB-CG2 4.04Å; I118-I141 HydrophobicContact CD1-CG2 4.29Å; I141-V143 HydrophobicContact CG2-CG2 4.24Å; I141-T153 CarbonylContact O-C 3.4Å; I141-T153 VanDerWaalsContact O-CA 3.24Å; I141-T153 WeakPolarHBondContact O-CA 3.14Å; I141-A154 PolarHBondContact N-O 3.03Å; I141-A154 PolarHBondContact O-N 2.74Å
142	V	98.8	Very high	96.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	127.7	177.7	177.4	0	0	0	0	109.3	V73 L74 L151 T153 F161 I218 T220	V73-V142 WeakPolarHBondContact CA-O 3.28Å; L74-V142 HydrophobicContact CD1-CB 3.72Å; L74-V142 HydrophobicContact CD1-CG1 4.42Å; L74-V142 HydrophobicContact CD1-CG2 4.08Å; L74-V142 HydrophobicContact CG-CB 4.01Å; L74-V142 HydrophobicContact CG-CG1 4.48Å; L74-V142 PolarHBondContact N-O 3.08Å; L74-V142 PolarHBondContact O-N 3.23Å; V142-L151 HydrophobicContact CG1-CD1 3.62Å; V142-L151 HydrophobicContact CG1-CD2 3.77Å; V142-L151 HydrophobicContact CG1-CG 3.74Å; V142-T153 HydrophobicContact CB-CG2 4.38Å; V142-T153 HydrophobicContact CG1-CG2 4.21Å; V142-T153 HydrophobicContact CG2-CG2 3.95Å; V142-F161 HydrophobicContact CG2-CB 4.16Å; V142-F161 HydrophobicContact CG2-CD1 4.4Å; V142-F161 HydrophobicContact CG2-CG 4.19Å; V142-I218 HydrophobicContact CG1-CG2 4.33Å; V142-T220 HydrophobicContact CG2-CG2 4.22Å
143	V	98.8	Very high	96.6	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.7	-179	-179.1	0	0	0	0	109.3	A71 D72 V73 P112 P115 I118 I141 L151 H152	A71-V143 HydrophobicContact CB-CG1 3.89Å; D72-V143 WeakPolarHBondContact O-CA 3.34Å; V73-V143 HydrophobicContact CB-CG2 4.47Å; V73-V143 HydrophobicContact CG1-CG2 3.85Å; V73-V143 HydrophobicContact CG2-CB 4.45Å; V73-V143 HydrophobicContact CG2-CG1 4.06Å; V73-V143 HydrophobicContact CG2-CG2 4.03Å; P112-V143 HydrophobicContact CB-CG1 4.05Å; P112-V143 VanDerWaalsContact O-CG1 3.26Å; P112-V143 WeakPolarHBondContact O-CG1 3.18Å; P115-V143 HydrophobicContact CB-CG2 4Å; I118-V143 HydrophobicContact CD1-CG2 4.02Å; I141-V143 HydrophobicContact CG2-CG2 4.24Å; V143-L151 CarbonylContact O-C 3.53Å; V143-L151 WeakPolarHBondContact O-CA 3.44Å; V143-H152 HydrophobicContact CB-CB 4.36Å; V143-H152 PolarHBondContact N-O 2.86Å; V143-H152 PolarHBondContact O-N 2.78Å
144	L	98.6	Very high	96.9	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.4	163.2	176.8	67.1	0	0	0	108.5	L36 A71 D72 R146 L151 V212	L36-L144 HydrophobicContact CD1-CB 4.04Å; L36-L144 HydrophobicContact CD2-CB 4.38Å; L36-L144 HydrophobicContact CD2-CD2 3.66Å; L36-L144 HydrophobicContact CG-CB 4.05Å; L36-L144 HydrophobicContact CG-CD2 3.66Å; L36-L144 HydrophobicContact CG-CG 4.5Å; A71-L144 WeakPolarHBondContact CA-O 3.47Å; A71-L144 VanDerWaalsContact CB-O 3.28Å; A71-L144 WeakPolarHBondContact CB-O 3.34Å; D72-L144 HydrophobicContact CB-CB 4.42Å; D72-L144 PolarHBondContact N-O 3.46Å; D72-L144 VanDerWaalsContact N-O 3.07Å; D72-L144 PolarHBondContact O-N 3.06Å; L144-R146 PolarHBondContact O-N 2.96Å; L144-L151 HydrophobicContact CB-CD1 4.08Å; L144-L151 HydrophobicContact CD1-CD1 4.38Å; L144-V212 HydrophobicContact CD1-CG2 3.52Å
145	D	97	Very high	97	Very high	23 Å²	23	16 Å²	16	12%	0.123	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	113.4	169.1	178.8	-8.5	0	0	0	109.3	P112 T147 S148 H149 R150	P112-D145 HydrophobicContact CB-CB 3.98Å; D145-T147 PolarHBondContact O-N 3.22Å; D145-T147 PolarHBondContact OD1-N 3.12Å; D145-S148 VanDerWaalsContact CB-OG 3.29Å; D145-S148 WeakPolarHBondContact CB-OG 3.35Å; D145-S148 PolarHBondContact OD1-N 2.91Å; D145-S148 WeakPolarHBondContact OD2-CB 3.38Å; D145-S148 PolarHBondContact OD2-OG 3.15Å; D145-H149 WeakPolarHBondContact O-CA 3.38Å; D145-H149 PolarHBondContact O-N 3.12Å; D145-R150 PolarHBondContact N-O 3.06Å
146	R	92.5	Very high	97.1	Very high	1 Å²	1	16 Å²	16	0%	0.004	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-31	-175.9	-64.7	-171.4	179	-71.4	2.5	112.8	D33 Y34 R67 H68 S70 D72 L144 H149 Y302	D33-R146 HydrophobicContact CB-CB 4.5Å; Y34-R146 WeakPolarHBondContact O-CG 3.45Å; Y34-R146 PolarHBondContact O-NH1 3.04Å; R67-R146 VanDerWaalsContact CD-NH2 3.33Å; H68-R146 PolarHBondContact O-NE 3.2Å; S70-R146 WeakPolarHBondContact O-CB 3.2Å; S70-R146 PolarHBondContact O-N 2.9Å; D72-R146 IonicContact OD1-CZ 3.72Å; D72-R146 IonicContact OD1-NH2 3.23Å; D72-R146 PolarHBondContact OD1-NH2 2.95Å; D72-R146 IonicContact OD2-CZ 3.55Å; D72-R146 VanDerWaalsContact OD2-CZ 3.23Å; D72-R146 IonicContact OD2-NH1 3.62Å; D72-R146 PolarHBondContact OD2-NH1 2.83Å; D72-R146 IonicContact OD2-NH2 2.82Å; D72-R146 PolarHBondContact OD2-NH2 2.93Å; L144-R146 PolarHBondContact O-N 2.96Å; R146-H149 PolarHBondContact O-CD2 3.05Å; R146-H149 PolarHBondContact O-NE2 3.13Å; R146-Y302 VanDerWaalsContact NH2-CE2 3.29Å
147	T	85.9	Confident	97.1	Very high	107 Å²	107	16 Å²	16	66%	0.656	8%	0.084	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-38.2	-171.8	-55.6	0	0	0	0	111.5	D145	D145-T147 PolarHBondContact O-N 3.22Å; D145-T147 PolarHBondContact OD1-N 3.12Å
148	S	92.9	Very high	97.1	Very high	47 Å²	47	16.1 Å²	16.1	33%	0.329	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-10.9	178.5	68.1	0	0	0	0	113.7	D145 R150	D145-S148 VanDerWaalsContact CB-OG 3.29Å; D145-S148 WeakPolarHBondContact CB-OG 3.35Å; D145-S148 PolarHBondContact OD1-N 2.91Å; D145-S148 WeakPolarHBondContact OD2-CB 3.38Å; D145-S148 PolarHBondContact OD2-OG 3.15Å; S148-R150 PolarHBondContact O-N 2.85Å
149	H	94.9	Very high	97.1	Very high	49 Å²	49	16.1 Å²	16.1	23%	0.227	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	32.6	-173.2	-52.6	158	0	0	0	112.7	Y34 D145 R146 V212	Y34-H149 AromaticContact CD1-CD2 3.94Å; Y34-H149 AromaticContact CD1-NE2 3.89Å; Y34-H149 HydrophobicContact CD2-CB 3.93Å; Y34-H149 AromaticContact CD2-CG 3.98Å; Y34-H149 HydrophobicContact CE2-CB 4.03Å; Y34-H149 HydrophobicContact CG-CB 4.47Å; Y34-H149 AromaticContact CG-CD2 3.75Å; D145-H149 WeakPolarHBondContact O-CA 3.38Å; D145-H149 PolarHBondContact O-N 3.12Å; R146-H149 PolarHBondContact O-CD2 3.05Å; R146-H149 PolarHBondContact O-NE2 3.13Å; H149-V212 WeakPolarHBondContact O-CG2 3.35Å; H149-V212 PolarHBondContact O-N 2.7Å; H149-V212 VanDerWaalsContact O-N 3.07Å
150	R	97.4	Very high	97.1	Very high	89 Å²	89	16.1 Å²	16.1	34%	0.336	9%	0.085	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.5	178.9	-66	-177.7	70.2	127.6	3.9	110.9	D145 S148 S209 F210 D211	D145-R150 PolarHBondContact N-O 3.06Å; S148-R150 PolarHBondContact O-N 2.85Å; R150-S209 PolarHBondContact NE-OG 2.91Å; R150-S209 PolarHBondContact NH2-O 2.99Å; R150-S209 VanDerWaalsContact NH2-O 3.11Å; R150-S209 PolarHBondContact NH2-OG 2.92Å; R150-F210 WeakPolarHBondContact CA-O 3.28Å; R150-D211 WeakPolarHBondContact CG-OD1 3.42Å
151	L	98.1	Very high	97	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	135.7	162.2	-148.9	71.4	0	0	0	108.4	V142 V143 L144 T153 V163 S209 F210 V212 I218	V142-L151 HydrophobicContact CG1-CD1 3.62Å; V142-L151 HydrophobicContact CG1-CD2 3.77Å; V142-L151 HydrophobicContact CG1-CG 3.74Å; V143-L151 CarbonylContact O-C 3.53Å; V143-L151 WeakPolarHBondContact O-CA 3.44Å; L144-L151 HydrophobicContact CB-CD1 4.08Å; L144-L151 HydrophobicContact CD1-CD1 4.38Å; L151-T153 HydrophobicContact CD2-CG2 4.17Å; L151-T153 HydrophobicContact CG-CG2 4.3Å; L151-V163 HydrophobicContact CD2-CG2 4.03Å; L151-S209 WeakPolarHBondContact O-CA 3.43Å; L151-S209 PolarHBondContact O-OG 3.32Å; L151-F210 HydrophobicContact CB-CD2 4.42Å; L151-F210 HydrophobicContact CB-CE2 3.95Å; L151-F210 HydrophobicContact CB-CZ 4.01Å; L151-F210 HydrophobicContact CD2-CE1 4.45Å; L151-F210 HydrophobicContact CD2-CE2 3.99Å; L151-F210 HydrophobicContact CD2-CZ 3.58Å; L151-F210 HydrophobicContact CG-CZ 4.4Å; L151-F210 PolarHBondContact N-O 3.43Å; L151-F210 PolarHBondContact O-N 3.02Å; L151-V212 HydrophobicContact CB-CG1 3.84Å; L151-I218 HydrophobicContact CD1-CD1 3.7Å; L151-I218 HydrophobicContact CD2-CD1 4.08Å; L151-I218 HydrophobicContact CD2-CG1 4.27Å; L151-I218 HydrophobicContact CD2-CG2 4.41Å
152	H	98.6	Very high	97	Very high	18 Å²	18	16.1 Å²	16.1	8%	0.083	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	131.1	170.1	-61	-89.4	0	0	0	108.4	P115 V143 S209	P115-H152 HydrophobicContact CG-CB 4.03Å; V143-H152 HydrophobicContact CB-CB 4.36Å; V143-H152 PolarHBondContact N-O 2.86Å; V143-H152 PolarHBondContact O-N 2.78Å; H152-S209 PolarHBondContact CE1-OG 2.81Å; H152-S209 WeakPolarHBondContact ND1-CB 2.91Å; H152-S209 PolarHBondContact ND1-OG 3.06Å; H152-S209 VanDerWaalsContact ND1-OG 3.08Å
153	T	98.5	Very high	97	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	155.4	-178.3	69.8	0	0	0	0	112.6	P115 I141 V142 L151 F161 S207 T208	P115-T153 WeakPolarHBondContact CG-O 3.24Å; I141-T153 CarbonylContact O-C 3.4Å; I141-T153 VanDerWaalsContact O-CA 3.24Å; I141-T153 WeakPolarHBondContact O-CA 3.14Å; V142-T153 HydrophobicContact CB-CG2 4.38Å; V142-T153 HydrophobicContact CG1-CG2 4.21Å; V142-T153 HydrophobicContact CG2-CG2 3.95Å; L151-T153 HydrophobicContact CD2-CG2 4.17Å; L151-T153 HydrophobicContact CG-CG2 4.3Å; T153-F161 HydrophobicContact CG2-CD1 4.1Å; T153-F161 HydrophobicContact CG2-CD2 4.26Å; T153-F161 HydrophobicContact CG2-CE1 3.62Å; T153-F161 HydrophobicContact CG2-CE2 3.78Å; T153-F161 HydrophobicContact CG2-CG 4.42Å; T153-F161 HydrophobicContact CG2-CZ 3.46Å; T153-F161 VanDerWaalsContact CG2-CZ 3.46Å; T153-F161 WeakPolarHBondContact OG1-CE1 3.43Å; T153-F161 VanDerWaalsContact OG1-CZ 3.25Å; T153-F161 WeakPolarHBondContact OG1-CZ 3.23Å; T153-S207 VanDerWaalsContact O-CA 3.27Å; T153-S207 WeakPolarHBondContact O-CA 3.25Å; T153-S207 WeakPolarHBondContact O-CB 3.37Å; T153-S207 PolarHBondContact O-OG 3.12Å; T153-T208 PolarHBondContact N-O 3.3Å; T153-T208 PolarHBondContact O-N 3.31Å; T153-T208 PolarHBondContact OG1-OG1 3.2Å
154	A	98.6	Very high	97	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	116.4	166.9	0	0	0	0	0	107.7	P115 I116 C140 I141 A205 D206	P115-A154 HydrophobicContact CB-CB 3.86Å; P115-A154 HydrophobicContact CG-CB 3.98Å; I116-A154 HydrophobicContact CG1-CB 3.76Å; C140-A154 CarbonylContact C-O 3.56Å; C140-A154 WeakPolarHBondContact CA-O 3.48Å; I141-A154 PolarHBondContact N-O 3.03Å; I141-A154 PolarHBondContact O-N 2.74Å; A154-A205 HydrophobicContact CB-CB 4.24Å; A154-D206 CarbonylContact C-O 3.59Å; A154-D206 WeakPolarHBondContact CA-O 3.33Å
155	N	98.7	Very high	96.9	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.7	177.2	-169.4	43.7	0	0	0	109.9	C140 G157 S159 D174 Q176 A205 D206	C140-N155 VanDerWaalsContact CB-OD1 3.28Å; C140-N155 WeakPolarHBondContact CB-OD1 3.23Å; N155-G157 PolarHBondContact ND2-O 3.35Å; N155-S159 PolarHBondContact ND2-O 2.85Å; N155-S159 PolarHBondContact OD1-O 2.99Å; N155-D174 PolarHBondContact ND2-O 3.5Å; N155-Q176 PolarHBondContact O-OE1 3.02Å; N155-A205 CarbonylContact O-C 3.41Å; N155-A205 VanDerWaalsContact O-CA 3.23Å; N155-A205 WeakPolarHBondContact O-CA 3.19Å; N155-D206 PolarHBondContact N-O 2.84Å; N155-D206 PolarHBondContact O-N 3.44Å
156	L	98.6	Very high	96.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	110.4	172.3	-170.8	81.6	0	0	0	108.9	L119 T138 A139 Q176 F184 L186 D200 A204 A205	L119-L156 HydrophobicContact CD2-CB 4.33Å; T138-L156 CarbonylContact C-O 3.58Å; T138-L156 WeakPolarHBondContact CA-O 3.41Å; T138-L156 VanDerWaalsContact CB-O 3.3Å; T138-L156 WeakPolarHBondContact CB-O 3.22Å; A139-L156 PolarHBondContact N-O 2.87Å; A139-L156 PolarHBondContact O-N 2.88Å; L156-Q176 VanDerWaalsContact CA-OE1 3.31Å; L156-F184 HydrophobicContact CD1-CB 4.04Å; L156-F184 HydrophobicContact CD1-CD1 4.31Å; L156-F184 HydrophobicContact CG-CB 4.15Å; L156-L186 HydrophobicContact CD2-CD2 3.53Å; L156-L186 HydrophobicContact CD2-CG 3.55Å; L156-D200 HydrophobicContact CD1-CB 4.33Å; L156-A204 HydrophobicContact CD1-CB 4.11Å; L156-A205 HydrophobicContact CB-CB 4.06Å; L156-A205 HydrophobicContact CD1-CB 4.26Å
157	G	98.4	Very high	97	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.152	C	C	.	.	S	Bend	trans	103.6	-149.1	-178.1	0	0	0	0	0	113.4	N155 Q176 F184	N155-G157 PolarHBondContact ND2-O 3.35Å; G157-Q176 CarbonylContact C-O 3.58Å; G157-Q176 WeakPolarHBondContact CA-O 3.36Å; G157-Q176 PolarHBondContact O-N 3.16Å; G157-F184 VanDerWaalsContact CA-O 3.23Å; G157-F184 WeakPolarHBondContact CA-O 3.44Å
158	D	97.8	Very high	97.5	Very high	3 Å²	3	25.4 Å²	25.4	2%	0.016	15%	0.15	C	C	.	.	S	Bend	trans	-115	9	-174.3	51.1	7.4	0	0	0	114.2	E175 Q177 P183 D223	D158-E175 HydrophobicContact CB-CB 4.22Å; D158-E175 HydrophobicContact CB-CG 4.11Å; D158-Q177 PolarHBondContact OD2-NE2 3.18Å; D158-P183 HydrophobicContact CB-CB 4.35Å; D158-P183 VanDerWaalsContact CG-CB 3.48Å; D158-P183 VanDerWaalsContact OD1-CB 3.31Å; D158-P183 WeakPolarHBondContact OD1-CB 3.49Å; D158-P183 WeakPolarHBondContact OD1-CG 3.29Å; D158-P183 WeakPolarHBondContact OD2-CB 3.11Å; D158-D223 HydrophobicContact CB-CB 4.49Å
159	S	98.1	Very high	97.7	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.147	C	C	.	.			trans	-61.3	172.3	147.9	-71.4	0	0	0	0	110.2	T138 N155	T138-S159 PolarHBondContact OG1-OG 2.99Å; T138-S159 VanDerWaalsContact OG1-OG 3.06Å; N155-S159 PolarHBondContact ND2-O 2.85Å; N155-S159 PolarHBondContact OD1-O 2.99Å
160	G	98.3	Very high	97.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-169.4	178.5	0	0	0	0	0	116.4	S173 T220 A221	G160-S173 WeakPolarHBondContact CA-OG 3.21Å; G160-T220 WeakPolarHBondContact O-CA 3.47Å; G160-A221 PolarHBondContact N-O 3.36Å; G160-A221 PolarHBondContact O-N 2.92Å
161	F	98.7	Very high	97.9	Very high	1 Å²	1	24.4 Å²	24.4	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	160.2	177.5	73.6	-81.2	0	0	0	112.7	V142 T153 V163 H171 S173 F210 L219 T220	V142-F161 HydrophobicContact CG2-CB 4.16Å; V142-F161 HydrophobicContact CG2-CD1 4.4Å; V142-F161 HydrophobicContact CG2-CG 4.19Å; T153-F161 HydrophobicContact CG2-CD1 4.1Å; T153-F161 HydrophobicContact CG2-CD2 4.26Å; T153-F161 HydrophobicContact CG2-CE1 3.62Å; T153-F161 HydrophobicContact CG2-CE2 3.78Å; T153-F161 HydrophobicContact CG2-CG 4.42Å; T153-F161 HydrophobicContact CG2-CZ 3.46Å; T153-F161 VanDerWaalsContact CG2-CZ 3.46Å; T153-F161 WeakPolarHBondContact OG1-CE1 3.43Å; T153-F161 VanDerWaalsContact OG1-CZ 3.25Å; T153-F161 WeakPolarHBondContact OG1-CZ 3.23Å; F161-V163 HydrophobicContact CD2-CG2 4.1Å; F161-V163 HydrophobicContact CE2-CG2 4.2Å; F161-H171 AromaticContact CE2-CD2 3.37Å; F161-H171 WeakPolarHBondContact CE2-CD2 3.19Å; F161-H171 AromaticContact CZ-CD2 3.44Å; F161-H171 VanDerWaalsContact CZ-CD2 3.44Å; F161-H171 WeakPolarHBondContact CZ-CD2 3.45Å; F161-H171 AromaticContact CZ-NE2 3.67Å; F161-S173 PolarHBondContact N-OG 2.97Å; F161-S173 PolarHBondContact O-N 3.07Å; F161-S173 PolarHBondContact O-OG 3.45Å; F161-F210 HydrophobicContact CE2-CE1 4.07Å; F161-F210 HydrophobicContact CE2-CZ 4.02Å; F161-F210 HydrophobicContact CZ-CE1 4.39Å; F161-L219 CarbonylContact C-O 3.43Å; F161-L219 WeakPolarHBondContact CA-O 3.41Å; F161-L219 WeakPolarHBondContact CB-O 3.4Å; F161-T220 HydrophobicContact CB-CG2 4.39Å
162	L	97.9	Very high	97.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	134	179.8	-176.4	122.8	0	0	0	109	V164 V169 H171 R172 I218 L219	L162-V164 HydrophobicContact CD2-CG2 3.28Å; L162-V164 HydrophobicContact CG-CG2 4.39Å; L162-V169 HydrophobicContact CD1-CB 4.32Å; L162-V169 HydrophobicContact CD1-CG1 3.58Å; L162-V169 HydrophobicContact CD1-CG2 3.73Å; L162-V169 HydrophobicContact CD2-CG2 4.12Å; L162-V169 HydrophobicContact CG-CG1 3.87Å; L162-V169 HydrophobicContact CG-CG2 4.16Å; L162-H171 CarbonylContact C-O 3.58Å; L162-H171 WeakPolarHBondContact CA-O 3.34Å; L162-R172 HydrophobicContact CD1-CB 4.32Å; L162-R172 HydrophobicContact CD1-CG 4.33Å; L162-I218 WeakPolarHBondContact O-CA 3.45Å; L162-L219 PolarHBondContact N-O 2.86Å; L162-L219 PolarHBondContact O-N 3.38Å
163	V	98.5	Very high	97.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125	174.7	-174.8	0	0	0	0	109.6	L151 F161 V170 H171 F210 D216 I217 I218	L151-V163 HydrophobicContact CD2-CG2 4.03Å; F161-V163 HydrophobicContact CD2-CG2 4.1Å; F161-V163 HydrophobicContact CE2-CG2 4.2Å; V163-V170 HydrophobicContact CB-CG2 4.06Å; V163-V170 HydrophobicContact CG1-CG2 3.77Å; V163-V170 WeakPolarHBondContact O-CG2 3.35Å; V163-V170 PolarHBondContact O-N 3.03Å; V163-H171 HydrophobicContact CB-CB 4.05Å; V163-H171 HydrophobicContact CG2-CB 4.26Å; V163-H171 PolarHBondContact N-O 2.86Å; V163-H171 PolarHBondContact O-N 3.27Å; V163-F210 HydrophobicContact CB-CE2 4.34Å; V163-F210 HydrophobicContact CB-CZ 4.41Å; V163-F210 HydrophobicContact CG1-CE2 4.33Å; V163-F210 HydrophobicContact CG2-CE2 3.83Å; V163-F210 HydrophobicContact CG2-CZ 3.57Å; V163-D216 HydrophobicContact CG1-CB 4.35Å; V163-I217 CarbonylContact C-O 3.49Å; V163-I217 WeakPolarHBondContact CA-O 3.34Å; V163-I218 HydrophobicContact CG1-CG1 4.46Å; V163-I218 HydrophobicContact CG2-CG1 4.14Å
164	V	98.4	Very high	97.7	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.03	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.1	-179.9	-175.2	0	0	0	0	109.9	L162 E168 I217 L235 L238	L162-V164 HydrophobicContact CD2-CG2 3.28Å; L162-V164 HydrophobicContact CG-CG2 4.39Å; V164-E168 CarbonylContact C-O 3.54Å; V164-E168 VanDerWaalsContact CA-O 3.26Å; V164-E168 WeakPolarHBondContact CA-O 3.48Å; V164-E168 WeakPolarHBondContact CG1-O 3.17Å; V164-I217 HydrophobicContact CB-CB 4.25Å; V164-I217 PolarHBondContact N-O 3.1Å; V164-I217 PolarHBondContact O-N 3.29Å; V164-L235 HydrophobicContact CB-CD2 4.41Å; V164-L235 HydrophobicContact CG1-CD2 3.76Å; V164-L235 HydrophobicContact CG2-CD2 3.68Å; V164-L238 HydrophobicContact CB-CD1 4.41Å; V164-L238 HydrophobicContact CG2-CD1 3.69Å
165	R	97.6	Very high	97.5	Very high	68 Å²	68	36.3 Å²	36.3	26%	0.257	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	126.1	175.5	-176.7	179.5	-64.6	158.1	-0.4	109	G167 E168 V170 D211 Q213 D216	R165-G167 PolarHBondContact O-N 3.13Å; R165-G167 VanDerWaalsContact O-N 3.16Å; R165-E168 PolarHBondContact N-O 3.01Å; R165-E168 PolarHBondContact O-N 2.82Å; R165-E168 VanDerWaalsContact O-N 3.13Å; R165-V170 HydrophobicContact CB-CB 4.47Å; R165-V170 HydrophobicContact CB-CG1 3.69Å; R165-V170 HydrophobicContact CB-CG2 3.93Å; R165-D211 PolarHBondContact NH2-O 2.6Å; R165-D211 VanDerWaalsContact NH2-O 3.11Å; R165-Q213 VanDerWaalsContact CZ-NE2 3.34Å; R165-Q213 VanDerWaalsContact NH1-NE2 3.15Å; R165-D216 WeakPolarHBondContact CB-OD1 3.3Å; R165-D216 VanDerWaalsContact CG-OD1 3.24Å; R165-D216 WeakPolarHBondContact CG-OD1 3.45Å; R165-D216 IonicContact CZ-OD1 3.7Å; R165-D216 IonicContact CZ-OD2 3.44Å; R165-D216 IonicContact NE-OD1 2.8Å; R165-D216 PolarHBondContact NE-OD1 2.83Å; R165-D216 IonicContact NE-OD2 3.35Å; R165-D216 PolarHBondContact NE-OD2 3.23Å; R165-D216 IonicContact NH2-OD1 2.71Å; R165-D216 IonicContact NH2-OD2 2.99Å; R165-D216 PolarHBondContact NH2-OD2 2.8Å
166	G	94.9	Very high	97.4	Very high	87 Å²	87	37.9 Å²	37.9	90%	0.897	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	24	-179.9	0	0	0	0	0	114.3
167	G	95.3	Very high	97.3	Very high	33 Å²	33	40 Å²	40	34%	0.34	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	2.4	-178.5	0	0	0	0	0	115.4	R165	R165-G167 PolarHBondContact O-N 3.13Å; R165-G167 VanDerWaalsContact O-N 3.16Å
168	E	97.3	Very high	97.1	Very high	133 Å²	133	43.5 Å²	43.5	62%	0.621	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.7	178.7	-61.9	-61.3	144.5	0	0	111	V164 R165 V170	V164-E168 CarbonylContact C-O 3.54Å; V164-E168 VanDerWaalsContact CA-O 3.26Å; V164-E168 WeakPolarHBondContact CA-O 3.48Å; V164-E168 WeakPolarHBondContact CG1-O 3.17Å; R165-E168 PolarHBondContact N-O 3.01Å; R165-E168 PolarHBondContact O-N 2.82Å; R165-E168 VanDerWaalsContact O-N 3.13Å; E168-V170 PolarHBondContact O-N 3.05Å
169	V	98.1	Very high	96.9	Very high	46 Å²	46	50.2 Å²	50.2	28%	0.279	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	113.9	173.5	-177.8	0	0	0	0	108.7	L162 H171 R172 D231 L235	L162-V169 HydrophobicContact CD1-CB 4.32Å; L162-V169 HydrophobicContact CD1-CG1 3.58Å; L162-V169 HydrophobicContact CD1-CG2 3.73Å; L162-V169 HydrophobicContact CD2-CG2 4.12Å; L162-V169 HydrophobicContact CG-CG1 3.87Å; L162-V169 HydrophobicContact CG-CG2 4.16Å; V169-H171 WeakPolarHBondContact CG1-O 3.08Å; V169-R172 HydrophobicContact CG1-CB 4.17Å; V169-D231 HydrophobicContact CG2-CB 4.46Å; V169-L235 HydrophobicContact CG2-CD1 4.11Å; V169-L235 HydrophobicContact CG2-CD2 4.04Å; V169-L235 HydrophobicContact CG2-CG 4.28Å
170	V	97.8	Very high	96.7	Very high	70 Å²	70	52.2 Å²	52.2	42%	0.424	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-18.1	176.1	-66.8	0	0	0	0	112.8	V163 R165 E168	V163-V170 HydrophobicContact CB-CG2 4.06Å; V163-V170 HydrophobicContact CG1-CG2 3.77Å; V163-V170 WeakPolarHBondContact O-CG2 3.35Å; V163-V170 PolarHBondContact O-N 3.03Å; R165-V170 HydrophobicContact CB-CB 4.47Å; R165-V170 HydrophobicContact CB-CG1 3.69Å; R165-V170 HydrophobicContact CB-CG2 3.93Å; E168-V170 PolarHBondContact O-N 3.05Å
171	H	97.6	Very high	96.4	Very high	47 Å²	47	55.2 Å²	55.2	22%	0.218	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	141.2	174.1	-158.4	88.5	0	0	0	110.4	F161 L162 V163 V169 T208 F210	F161-H171 AromaticContact CE2-CD2 3.37Å; F161-H171 WeakPolarHBondContact CE2-CD2 3.19Å; F161-H171 AromaticContact CZ-CD2 3.44Å; F161-H171 VanDerWaalsContact CZ-CD2 3.44Å; F161-H171 WeakPolarHBondContact CZ-CD2 3.45Å; F161-H171 AromaticContact CZ-NE2 3.67Å; L162-H171 CarbonylContact C-O 3.58Å; L162-H171 WeakPolarHBondContact CA-O 3.34Å; V163-H171 HydrophobicContact CB-CB 4.05Å; V163-H171 HydrophobicContact CG2-CB 4.26Å; V163-H171 PolarHBondContact N-O 2.86Å; V163-H171 PolarHBondContact O-N 3.27Å; V169-H171 WeakPolarHBondContact CG1-O 3.08Å; H171-T208 PolarHBondContact NE2-OG1 2.93Å; H171-F210 HydrophobicContact CB-CE1 4.14Å; H171-F210 HydrophobicContact CB-CE2 4.4Å; H171-F210 HydrophobicContact CB-CZ 3.94Å; H171-F210 AromaticContact CD2-CE1 3.58Å; H171-F210 AromaticContact CE1-CD1 3.89Å; H171-F210 AromaticContact CE1-CE1 3.84Å; H171-F210 AromaticContact CG-CE1 3.53Å; H171-F210 AromaticContact CG-CZ 3.85Å; H171-F210 AromaticContact ND1-CD1 3.77Å; H171-F210 AromaticContact ND1-CE1 3.71Å; H171-F210 AromaticContact NE2-CE1 3.74Å
172	R	97.4	Very high	96.2	Very high	70 Å²	70	56.4 Å²	56.4	26%	0.264	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	134.8	173.7	177.1	171.2	177.7	77	17	107.6	L162 V169 E175 D231	L162-R172 HydrophobicContact CD1-CB 4.32Å; L162-R172 HydrophobicContact CD1-CG 4.33Å; V169-R172 HydrophobicContact CG1-CB 4.17Å; R172-E175 IonicContact NH2-OE1 2.6Å; R172-D231 WeakPolarHBondContact CD-OD2 3.22Å; R172-D231 IonicContact CZ-OD1 3.87Å; R172-D231 IonicContact NE-OD1 2.71Å; R172-D231 IonicContact NH1-OD1 3.75Å; R172-D231 PolarHBondContact NH1-OD1 3.36Å
173	S	97.7	Very high	96.2	Very high	4 Å²	4	57.1 Å²	57.1	3%	0.028	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-67.1	143.4	172.3	53.1	0	0	0	0	111.2	G160 F161	G160-S173 WeakPolarHBondContact CA-OG 3.21Å; F161-S173 PolarHBondContact N-OG 2.97Å; F161-S173 PolarHBondContact O-N 3.07Å; F161-S173 PolarHBondContact O-OG 3.45Å
174	D	95.6	Very high	96.2	Very high	117 Å²	117	59.4 Å²	59.4	63%	0.626	32%	0.315	S	S	*	.	P	Polyproline II helix	trans	-80.5	139.9	167.9	-66.4	-40.6	0	0	0	110.3	N155	N155-D174 PolarHBondContact ND2-O 3.5Å
175	E	95.1	Very high	96.2	Very high	78 Å²	78	59.8 Å²	59.8	36%	0.364	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-77.6	138.7	173.9	-69.4	166	-154.5	0	0	110.1	D158 R172	D158-E175 HydrophobicContact CB-CB 4.22Å; D158-E175 HydrophobicContact CB-CG 4.11Å; R172-E175 IonicContact NH2-OE1 2.6Å
176	Q	97.1	Very high	96.2	Very high	33 Å²	33	56.6 Å²	56.6	15%	0.154	30%	0.304	C	S	.	.			trans	-112	113.9	178.8	-59.9	-175.9	-49.7	0	0	110.6	N155 L156 G157 P183 F184 A204	N155-Q176 PolarHBondContact O-OE1 3.02Å; L156-Q176 VanDerWaalsContact CA-OE1 3.31Å; G157-Q176 CarbonylContact C-O 3.58Å; G157-Q176 WeakPolarHBondContact CA-O 3.36Å; G157-Q176 PolarHBondContact O-N 3.16Å; Q176-P183 WeakPolarHBondContact O-CA 3.47Å; Q176-F184 HydrophobicContact CB-CB 4.03Å; Q176-F184 HydrophobicContact CB-CD2 3.78Å; Q176-F184 HydrophobicContact CB-CE2 4.41Å; Q176-F184 HydrophobicContact CB-CG 3.89Å; Q176-F184 PolarHBondContact O-N 3.4Å; Q176-A204 PolarHBondContact NE2-O 3.2Å
177	Q	96	Very high	96.3	Very high	46 Å²	46	52.7 Å²	52.7	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	144.9	179.1	-63.8	-173.8	-20.6	0	0	111.6	D158 T182	D158-Q177 PolarHBondContact OD2-NE2 3.18Å; Q177-T182 CarbonylContact C-O 3.51Å; Q177-T182 WeakPolarHBondContact CA-O 3.42Å
178	H	94.9	Very high	96.3	Very high	72 Å²	72	51.9 Å²	51.9	33%	0.333	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-36.8	172.5	-68.4	-73.9	0	0	0	111.3	T182 F184 D200	H178-T182 PolarHBondContact N-O 3.33Å; H178-F184 AromaticContact CD2-CD2 3.91Å; H178-F184 AromaticContact CE1-CD2 3.94Å; H178-F184 AromaticContact CE1-CE2 3.7Å; H178-F184 AromaticContact CE1-CZ 3.74Å; H178-F184 AromaticContact ND1-CE2 3.81Å; H178-F184 AromaticContact NE2-CD2 3.71Å; H178-F184 AromaticContact NE2-CE2 3.95Å; H178-F184 AromaticContact NE2-CG 3.85Å; H178-D200 IonicContact CD2-OD2 3.95Å; H178-D200 IonicContact CE1-OD1 2.7Å; H178-D200 PolarHBondContact CE1-OD1 3.28Å; H178-D200 IonicContact CE1-OD2 2.56Å; H178-D200 IonicContact NE2-OD1 2.6Å; H178-D200 PolarHBondContact NE2-OD1 3.13Å; H178-D200 VanDerWaalsContact NE2-OD1 3.15Å; H178-D200 IonicContact NE2-OD2 3.68Å; H178-D200 PolarHBondContact NE2-OD2 3.41Å
179	Y	92.4	Very high	96	Very high	144 Å²	144	46.9 Å²	46.9	57%	0.565	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-159.7	170.3	173.2	38.6	-90.9	0	0	0	107.9	N181 T182	Y179-N181 PolarHBondContact O-N 3.35Å; Y179-T182 VanDerWaalsContact CD2-CB 3.49Å; Y179-T182 HydrophobicContact CD2-CG2 4.21Å; Y179-T182 VanDerWaalsContact CD2-OG1 3.28Å; Y179-T182 WeakPolarHBondContact CD2-OG1 3.22Å; Y179-T182 HydrophobicContact CE1-CG2 4.21Å; Y179-T182 HydrophobicContact CE2-CG2 3.6Å; Y179-T182 WeakPolarHBondContact CE2-OG1 3.11Å; Y179-T182 PolarHBondContact O-N 2.97Å
180	F	93.1	Very high	95.5	Very high	42 Å²	42	46.1 Å²	46.1	18%	0.184	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	125.1	-176.5	173.7	-100.9	0	0	0	112.5	T182 F273 F276 A277 N280 L282	F180-T182 PolarHBondContact O-N 2.96Å; F180-F273 HydrophobicContact CE1-CE2 4.15Å; F180-F273 HydrophobicContact CE1-CZ 4.09Å; F180-F273 HydrophobicContact CE2-CE2 4.25Å; F180-F273 HydrophobicContact CZ-CD2 4.13Å; F180-F273 HydrophobicContact CZ-CE1 4.42Å; F180-F273 AromaticContact CZ-CE2 3.49Å; F180-F273 HydrophobicContact CZ-CE2 3.49Å; F180-F273 VanDerWaalsContact CZ-CE2 3.49Å; F180-F273 AromaticContact CZ-CZ 3.67Å; F180-F273 HydrophobicContact CZ-CZ 3.67Å; F180-F276 AromaticContact CD2-CD1 3.48Å; F180-F276 HydrophobicContact CD2-CD1 3.48Å; F180-F276 VanDerWaalsContact CD2-CD1 3.48Å; F180-F276 AromaticContact CD2-CE1 3.67Å; F180-F276 HydrophobicContact CD2-CE1 3.67Å; F180-F276 HydrophobicContact CD2-CG 4.16Å; F180-F276 HydrophobicContact CD2-CZ 4.47Å; F180-F276 HydrophobicContact CE2-CB 4.21Å; F180-F276 AromaticContact CE2-CD1 3.52Å; F180-F276 HydrophobicContact CE2-CD1 3.52Å; F180-F276 HydrophobicContact CE2-CE1 4.18Å; F180-F276 HydrophobicContact CE2-CG 4.05Å; F180-A277 HydrophobicContact CE1-CB 4.11Å; F180-A277 HydrophobicContact CE2-CB 4.01Å; F180-A277 HydrophobicContact CZ-CB 3.46Å; F180-A277 VanDerWaalsContact CZ-CB 3.46Å; F180-N280 HydrophobicContact CB-CB 4.3Å; F180-N280 HydrophobicContact CD2-CB 4.3Å; F180-N280 HydrophobicContact CG-CB 4.26Å; F180-L282 HydrophobicContact CD1-CD1 3.75Å; F180-L282 HydrophobicContact CE1-CD1 3.55Å; F180-L282 HydrophobicContact CZ-CD1 4.44Å
181	N	92.9	Very high	94.9	Very high	63 Å²	63	47.9 Å²	47.9	34%	0.337	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	35.2	178.2	-167.8	66.1	0	0	0	113.1	Y179 F273 K288	Y179-N181 PolarHBondContact O-N 3.35Å; N181-F273 HydrophobicContact CB-CE2 4.02Å; N181-F273 WeakPolarHBondContact OD1-CE2 3.49Å; N181-K288 PolarHBondContact OD1-NZ 3.19Å
182	T	95.4	Very high	94.2	Very high	27 Å²	27	54.2 Å²	54.2	17%	0.166	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	90	170.6	-62.1	0	0	0	0	109.6	Q177 H178 Y179 F180 L198	Q177-T182 CarbonylContact C-O 3.51Å; Q177-T182 WeakPolarHBondContact CA-O 3.42Å; H178-T182 PolarHBondContact N-O 3.33Å; Y179-T182 VanDerWaalsContact CD2-CB 3.49Å; Y179-T182 HydrophobicContact CD2-CG2 4.21Å; Y179-T182 VanDerWaalsContact CD2-OG1 3.28Å; Y179-T182 WeakPolarHBondContact CD2-OG1 3.22Å; Y179-T182 HydrophobicContact CE1-CG2 4.21Å; Y179-T182 HydrophobicContact CE2-CG2 3.6Å; Y179-T182 WeakPolarHBondContact CE2-OG1 3.11Å; Y179-T182 PolarHBondContact O-N 2.97Å; F180-T182 PolarHBondContact O-N 2.96Å; T182-L198 HydrophobicContact CG2-CD1 3.4Å; T182-L198 VanDerWaalsContact CG2-CD1 3.4Å
183	P	97.3	Very high	93.5	Very high	15 Å²	15	52.1 Å²	52.1	10%	0.097	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	157.7	-175.6	25.7	-32.5	0	0	0	113.2	T138 D158 Q176 Q185	T138-P183 HydrophobicContact CG2-CB 3.8Å; T138-P183 HydrophobicContact CG2-CG 3.8Å; D158-P183 HydrophobicContact CB-CB 4.35Å; D158-P183 VanDerWaalsContact CG-CB 3.48Å; D158-P183 VanDerWaalsContact OD1-CB 3.31Å; D158-P183 WeakPolarHBondContact OD1-CB 3.49Å; D158-P183 WeakPolarHBondContact OD1-CG 3.29Å; D158-P183 WeakPolarHBondContact OD2-CB 3.11Å; Q176-P183 WeakPolarHBondContact O-CA 3.47Å; P183-Q185 PolarHBondContact O-NE2 3.45Å
184	F	98.4	Very high	92.5	Very high	47 Å²	47	59.6 Å²	59.6	21%	0.206	30%	0.303	C	S	.	.			trans	-57.8	137.5	158.7	-80.8	-123.7	0	0	0	109.2	L156 G157 Q176 H178 D200 A204	L156-F184 HydrophobicContact CD1-CB 4.04Å; L156-F184 HydrophobicContact CD1-CD1 4.31Å; L156-F184 HydrophobicContact CG-CB 4.15Å; G157-F184 VanDerWaalsContact CA-O 3.23Å; G157-F184 WeakPolarHBondContact CA-O 3.44Å; Q176-F184 HydrophobicContact CB-CB 4.03Å; Q176-F184 HydrophobicContact CB-CD2 3.78Å; Q176-F184 HydrophobicContact CB-CE2 4.41Å; Q176-F184 HydrophobicContact CB-CG 3.89Å; Q176-F184 PolarHBondContact O-N 3.4Å; H178-F184 AromaticContact CD2-CD2 3.91Å; H178-F184 AromaticContact CE1-CD2 3.94Å; H178-F184 AromaticContact CE1-CE2 3.7Å; H178-F184 AromaticContact CE1-CZ 3.74Å; H178-F184 AromaticContact ND1-CE2 3.81Å; H178-F184 AromaticContact NE2-CD2 3.71Å; H178-F184 AromaticContact NE2-CE2 3.95Å; H178-F184 AromaticContact NE2-CG 3.85Å; F184-D200 WeakPolarHBondContact CA-OD2 3.29Å; F184-D200 HydrophobicContact CD1-CB 4.06Å; F184-D200 WeakPolarHBondContact CD1-OD1 3.45Å; F184-A204 HydrophobicContact CD1-CB 4.24Å; F184-A204 HydrophobicContact CE1-CB 4.32Å
185	Q	97.9	Very high	91.7	Very high	14 Å²	14	57.9 Å²	57.9	7%	0.065	31%	0.313	C	S	.	.			trans	-153.3	142.8	-171	59.7	-167.7	-95.4	0	0	112.4	V80 S136 S137 P183 L198 D200	V80-Q185 HydrophobicContact CG2-CB 4.44Å; S136-Q185 VanDerWaalsContact CB-OE1 3.32Å; S136-Q185 PolarHBondContact OG-OE1 3.47Å; S137-Q185 WeakPolarHBondContact O-CA 3.15Å; P183-Q185 PolarHBondContact O-NE2 3.45Å; Q185-L198 HydrophobicContact CG-CB 4.38Å; Q185-D200 PolarHBondContact N-OD2 2.83Å; Q185-D200 PolarHBondContact O-N 3.29Å
186	L	98	Very high	91.1	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	135	166.3	-60.6	180	0	0	0	108.7	F93 L97 L119 Y123 S136 S137 L156 D200 P202	F93-L186 HydrophobicContact CE1-CB 4.09Å; F93-L186 WeakPolarHBondContact CE1-O 3.43Å; F93-L186 HydrophobicContact CZ-CB 4.04Å; F93-L186 WeakPolarHBondContact CZ-O 3.29Å; L97-L186 HydrophobicContact CD1-CD1 4.31Å; L97-L186 HydrophobicContact CD2-CD1 4.11Å; L119-L186 HydrophobicContact CD1-CD1 3.67Å; L119-L186 HydrophobicContact CD2-CD1 4.46Å; L119-L186 HydrophobicContact CG-CD1 4.03Å; Y123-L186 HydrophobicContact CD1-CD2 3.98Å; Y123-L186 HydrophobicContact CD2-CB 4.05Å; Y123-L186 HydrophobicContact CD2-CD1 4.04Å; Y123-L186 HydrophobicContact CD2-CG 4.44Å; Y123-L186 HydrophobicContact CE1-CD2 4.07Å; Y123-L186 HydrophobicContact CE2-CB 3.93Å; Y123-L186 HydrophobicContact CG-CD1 3.94Å; Y123-L186 HydrophobicContact CG-CD2 4.22Å; Y123-L186 HydrophobicContact CG-CG 4.46Å; S136-L186 CarbonylContact C-O 3.35Å; S136-L186 WeakPolarHBondContact CA-O 3.3Å; S136-L186 WeakPolarHBondContact CB-O 3.45Å; S137-L186 PolarHBondContact N-O 3.16Å; S137-L186 PolarHBondContact O-N 2.9Å; L156-L186 HydrophobicContact CD2-CD2 3.53Å; L156-L186 HydrophobicContact CD2-CG 3.55Å; L186-D200 WeakPolarHBondContact CD2-O 3.43Å; L186-P202 HydrophobicContact CD2-CG 3.79Å
187	S	96.8	Very high	90.6	Very high	5 Å²	5	60.4 Å²	60.4	4%	0.035	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	134.9	-174.1	-54.2	0	0	0	0	113.3	Y123 G135 S136 L198 S199	Y123-S187 PolarHBondContact OH-O 3.06Å; G135-S187 WeakPolarHBondContact O-CA 3.48Å; S136-S187 WeakPolarHBondContact CB-OG 3.18Å; S187-L198 WeakPolarHBondContact CB-O 3.42Å; S187-L198 PolarHBondContact OG-O 3.24Å; S187-S199 PolarHBondContact O-OG 2.99Å; S187-S199 VanDerWaalsContact O-OG 3.05Å
188	I	95.3	Very high	90.5	Very high	16 Å²	16	61 Å²	61	8%	0.082	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	105.3	166.9	-62.7	173.3	0	0	0	107.4	F93 Y123 L126 L127 L133 L134 G135	F93-I188 HydrophobicContact CE2-CB 4.1Å; F93-I188 HydrophobicContact CE2-CD1 3.91Å; F93-I188 HydrophobicContact CE2-CG1 3.78Å; Y123-I188 HydrophobicContact CE2-CG1 4.1Å; L126-I188 HydrophobicContact CB-CD1 3.94Å; L127-I188 HydrophobicContact CD2-CD1 4.1Å; L127-I188 HydrophobicContact CD2-CG1 3.72Å; L127-I188 HydrophobicContact CG-CD1 4.34Å; L127-I188 HydrophobicContact CG-CG1 4.39Å; L133-I188 WeakPolarHBondContact O-CB 3.37Å; L134-I188 WeakPolarHBondContact CA-O 3.4Å; L134-I188 HydrophobicContact CD2-CG2 4.23Å; G135-I188 PolarHBondContact N-O 2.6Å; G135-I188 PolarHBondContact O-N 3.46Å
189	A	90.9	Very high	90.4	Very high	28 Å²	28	60.6 Å²	60.6	23%	0.231	35%	0.345	C	S	.	.			trans	-88.5	152.2	177.9	0	0	0	0	0	111.6	V197	A189-V197 HydrophobicContact CB-CB 3.95Å; A189-V197 HydrophobicContact CB-CG1 4.47Å; A189-V197 HydrophobicContact CB-CG2 3.86Å
190	P	87.2	Confident	90.6	Very high	31 Å²	31	54.8 Å²	54.8	20%	0.201	32%	0.324	C	S	.	.			trans	-61.7	150	165	26.4	-31.5	0	0	0	109.5	L134 E192 A193 E194	L134-P190 HydrophobicContact CD1-CB 4.2Å; L134-P190 HydrophobicContact CD2-CB 4.32Å; P190-E192 PolarHBondContact O-N 3.27Å; P190-A193 HydrophobicContact CG-CB 3.89Å; P190-A193 PolarHBondContact O-N 3.3Å; P190-E194 PolarHBondContact O-N 3.41Å
191	P	84.9	Confident	90.8	Very high	107 Å²	107	55.5 Å²	55.5	70%	0.695	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-54.6	-30.5	-175.9	-27.4	34.9	0	0	0	114.2	A193	P191-A193 VanDerWaalsContact C-N 3.28Å; P191-A193 PolarHBondContact O-N 3.22Å
192	E	84.4	Confident	91	Very high	180 Å²	180	52.9 Å²	52.9	84%	0.841	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-73.1	-18	179.9	-58	126.3	-151.8	0	0	113.7	P190	P190-E192 PolarHBondContact O-N 3.27Å
193	A	81.6	Confident	91.1	Very high	26 Å²	26	57.3 Å²	57.3	22%	0.215	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-113.7	11.8	-177.4	0	0	0	0	0	112.9	P190 P191 G195 V196 V197	P190-A193 HydrophobicContact CG-CB 3.89Å; P190-A193 PolarHBondContact O-N 3.3Å; P191-A193 VanDerWaalsContact C-N 3.28Å; P191-A193 PolarHBondContact O-N 3.22Å; A193-G195 PolarHBondContact O-N 2.56Å; A193-V196 WeakPolarHBondContact O-CB 3.47Å; A193-V196 PolarHBondContact O-N 3.25Å; A193-V196 VanDerWaalsContact O-N 3.09Å; A193-V197 HydrophobicContact CB-CG2 4.13Å; A193-V197 PolarHBondContact O-N 3.46Å
194	E	77.8	Confident	91.1	Very high	160 Å²	160	58.3 Å²	58.3	75%	0.748	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	130.7	178.1	-161.4	170.5	-161.1	0	0	110.4	P190 V196	P190-E194 PolarHBondContact O-N 3.41Å; E194-V196 VanDerWaalsContact C-N 3.25Å; E194-V196 PolarHBondContact O-N 3.01Å
195	G	77.5	Confident	91.1	Very high	82 Å²	82	56.5 Å²	56.5	85%	0.845	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-4.9	-174.8	0	0	0	0	0	115.7	A193	A193-G195 PolarHBondContact O-N 2.56Å
196	V	82.8	Confident	91.1	Very high	123 Å²	123	58.3 Å²	58.3	75%	0.745	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-36.2	172.2	-176.2	0	0	0	0	111.1	A193 E194	A193-V196 WeakPolarHBondContact O-CB 3.47Å; A193-V196 PolarHBondContact O-N 3.25Å; A193-V196 VanDerWaalsContact O-N 3.09Å; E194-V196 VanDerWaalsContact C-N 3.25Å; E194-V196 PolarHBondContact O-N 3.01Å
197	V	88.2	Confident	91	Very high	40 Å²	40	61.1 Å²	61.1	24%	0.242	38%	0.376	C	S	.	.	S	Bend	trans	-81.2	132.6	175.6	-179.3	0	0	0	0	109.5	W83 A189 A193 S199	W83-V197 HydrophobicContact CH2-CG1 4.21Å; W83-V197 HydrophobicContact CH2-CG2 4.21Å; W83-V197 HydrophobicContact CZ2-CG1 3.75Å; A189-V197 HydrophobicContact CB-CB 3.95Å; A189-V197 HydrophobicContact CB-CG1 4.47Å; A189-V197 HydrophobicContact CB-CG2 3.86Å; A193-V197 HydrophobicContact CB-CG2 4.13Å; A193-V197 PolarHBondContact O-N 3.46Å; V197-S199 PolarHBondContact O-N 2.95Å
198	L	91.9	Very high	90.9	Very high	58 Å²	58	62.2 Å²	62.2	30%	0.304	38%	0.383	S	S	.	.			trans	-59.1	128.4	171.9	-65.2	174.5	0	0	0	109.3	T182 Q185 S187	T182-L198 HydrophobicContact CG2-CD1 3.4Å; T182-L198 VanDerWaalsContact CG2-CD1 3.4Å; Q185-L198 HydrophobicContact CG-CB 4.38Å; S187-L198 WeakPolarHBondContact CB-O 3.42Å; S187-L198 PolarHBondContact OG-O 3.24Å
199	S	93.6	Very high	91	Very high	64 Å²	64	63.5 Å²	63.5	45%	0.448	39%	0.393	S	S	.	.			trans	-146.8	109.4	177.1	-168.2	0	0	0	0	108.4	Y123 S187 V197	Y123-S199 PolarHBondContact OH-OG 3.33Å; S187-S199 PolarHBondContact O-OG 2.99Å; S187-S199 VanDerWaalsContact O-OG 3.05Å; V197-S199 PolarHBondContact O-N 2.95Å
200	D	97.1	Very high	91.3	Very high	23 Å²	23	63.8 Å²	63.8	12%	0.123	39%	0.389	C	S	.	.			trans	-91.8	153.3	-178.7	-63.4	-70	0	0	0	110.9	L156 H178 F184 Q185 L186	L156-D200 HydrophobicContact CD1-CB 4.33Å; H178-D200 IonicContact CD2-OD2 3.95Å; H178-D200 IonicContact CE1-OD1 2.7Å; H178-D200 PolarHBondContact CE1-OD1 3.28Å; H178-D200 IonicContact CE1-OD2 2.56Å; H178-D200 IonicContact NE2-OD1 2.6Å; H178-D200 PolarHBondContact NE2-OD1 3.13Å; H178-D200 VanDerWaalsContact NE2-OD1 3.15Å; H178-D200 IonicContact NE2-OD2 3.68Å; H178-D200 PolarHBondContact NE2-OD2 3.41Å; F184-D200 WeakPolarHBondContact CA-OD2 3.29Å; F184-D200 HydrophobicContact CD1-CB 4.06Å; F184-D200 WeakPolarHBondContact CD1-OD1 3.45Å; Q185-D200 PolarHBondContact N-OD2 2.83Å; Q185-D200 PolarHBondContact O-N 3.29Å; L186-D200 WeakPolarHBondContact CD2-O 3.43Å
201	S	96.7	Very high	91.7	Very high	57 Å²	57	67.2 Å²	67.2	40%	0.399	41%	0.406	S	S	.	.			trans	-73.7	142.7	171.4	-177.1	0	0	0	0	109.7	D203 A204	S201-D203 PolarHBondContact O-N 3.06Å; S201-D203 VanDerWaalsContact O-N 3.1Å; S201-D203 PolarHBondContact OG-N 3.17Å; S201-D203 PolarHBondContact OG-OD2 3.49Å; S201-A204 VanDerWaalsContact O-CB 3.23Å; S201-A204 WeakPolarHBondContact O-CB 3.42Å; S201-A204 PolarHBondContact O-N 2.81Å
202	P	97.3	Very high	92.3	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.052	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-51.4	-29.7	165.5	-26.5	34.1	0	0	0	113.7	L119 T120 Y123 L186 A204 A205	L119-P202 HydrophobicContact CD2-CB 4.35Å; L119-P202 HydrophobicContact CG-CB 4.28Å; T120-P202 VanDerWaalsContact OG1-CB 3.31Å; T120-P202 WeakPolarHBondContact OG1-CB 3.41Å; Y123-P202 HydrophobicContact CD1-CG 3.64Å; Y123-P202 HydrophobicContact CE1-CG 4.44Å; Y123-P202 HydrophobicContact CG-CG 4.33Å; L186-P202 HydrophobicContact CD2-CG 3.79Å; P202-A204 PolarHBondContact O-N 3.5Å; P202-A205 VanDerWaalsContact O-CB 3.23Å; P202-A205 WeakPolarHBondContact O-CB 3.3Å; P202-A205 PolarHBondContact O-N 2.93Å; P202-A205 VanDerWaalsContact O-N 3.15Å
203	D	97.2	Very high	92.8	Very high	119 Å²	119	58.7 Å²	58.7	64%	0.636	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-69.2	-13.2	177.2	-62.1	-47.3	0	0	0	113.4	S201 A205	S201-D203 PolarHBondContact O-N 3.06Å; S201-D203 VanDerWaalsContact O-N 3.1Å; S201-D203 PolarHBondContact OG-N 3.17Å; S201-D203 PolarHBondContact OG-OD2 3.49Å; D203-A205 VanDerWaalsContact C-N 3.26Å
204	A	97.7	Very high	93.5	Very high	37 Å²	37	61.1 Å²	61.1	31%	0.306	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-79.4	-9.9	173.4	0	0	0	0	0	112.7	L156 Q176 F184 S201 P202 D206	L156-A204 HydrophobicContact CD1-CB 4.11Å; Q176-A204 PolarHBondContact NE2-O 3.2Å; F184-A204 HydrophobicContact CD1-CB 4.24Å; F184-A204 HydrophobicContact CE1-CB 4.32Å; S201-A204 VanDerWaalsContact O-CB 3.23Å; S201-A204 WeakPolarHBondContact O-CB 3.42Å; S201-A204 PolarHBondContact O-N 2.81Å; P202-A204 PolarHBondContact O-N 3.5Å; A204-D206 PolarHBondContact O-N 3.38Å
205	A	98.1	Very high	94.4	Very high	8 Å²	8	55.7 Å²	55.7	7%	0.066	35%	0.354	C	S	.	.	S	Bend	trans	-59.7	131.6	177.9	0	0	0	0	0	110.6	I116 L119 A154 N155 L156 P202 D203 S207	I116-A205 HydrophobicContact CG1-CB 4.43Å; L119-A205 HydrophobicContact CD2-CB 4.46Å; A154-A205 HydrophobicContact CB-CB 4.24Å; N155-A205 CarbonylContact O-C 3.41Å; N155-A205 VanDerWaalsContact O-CA 3.23Å; N155-A205 WeakPolarHBondContact O-CA 3.19Å; L156-A205 HydrophobicContact CB-CB 4.06Å; L156-A205 HydrophobicContact CD1-CB 4.26Å; P202-A205 VanDerWaalsContact O-CB 3.23Å; P202-A205 WeakPolarHBondContact O-CB 3.3Å; P202-A205 PolarHBondContact O-N 2.93Å; P202-A205 VanDerWaalsContact O-N 3.15Å; D203-A205 VanDerWaalsContact C-N 3.26Å; A205-S207 PolarHBondContact O-N 3.47Å
206	D	97.9	Very high	95.3	Very high	52 Å²	52	51.9 Å²	51.9	28%	0.278	31%	0.314	S	S	.	.	B	Isolated β-bridge	trans	-67	133	171.2	-177.1	49.3	0	0	0	109.6	A154 N155 A204	A154-D206 CarbonylContact C-O 3.59Å; A154-D206 WeakPolarHBondContact CA-O 3.33Å; N155-D206 PolarHBondContact N-O 2.84Å; N155-D206 PolarHBondContact O-N 3.44Å; A204-D206 PolarHBondContact O-N 3.38Å
207	S	96.1	Very high	96.1	Very high	59 Å²	59	47 Å²	47	41%	0.413	28%	0.284	S	S	.	.			trans	-131.8	129.4	-174.2	-172.8	0	0	0	0	111.6	T153 A205	T153-S207 VanDerWaalsContact O-CA 3.27Å; T153-S207 WeakPolarHBondContact O-CA 3.25Å; T153-S207 WeakPolarHBondContact O-CB 3.37Å; T153-S207 PolarHBondContact O-OG 3.12Å; A205-S207 PolarHBondContact O-N 3.47Å
208	T	95.8	Very high	96.6	Very high	28 Å²	28	45.1 Å²	45.1	17%	0.172	27%	0.272	C	S	.	.			trans	-128.1	154.1	179.4	69.9	0	0	0	0	110.4	T153 H171	T153-T208 PolarHBondContact N-O 3.3Å; T153-T208 PolarHBondContact O-N 3.31Å; T153-T208 PolarHBondContact OG1-OG1 3.2Å; H171-T208 PolarHBondContact NE2-OG1 2.93Å
209	S	97.3	Very high	96.9	Very high	43 Å²	43	42.4 Å²	42.4	30%	0.301	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	131.6	170.6	-180	0	0	0	0	111.6	R150 L151 H152	R150-S209 PolarHBondContact NE-OG 2.91Å; R150-S209 PolarHBondContact NH2-O 2.99Å; R150-S209 VanDerWaalsContact NH2-O 3.11Å; R150-S209 PolarHBondContact NH2-OG 2.92Å; L151-S209 WeakPolarHBondContact O-CA 3.43Å; L151-S209 PolarHBondContact O-OG 3.32Å; H152-S209 PolarHBondContact CE1-OG 2.81Å; H152-S209 WeakPolarHBondContact ND1-CB 2.91Å; H152-S209 PolarHBondContact ND1-OG 3.06Å; H152-S209 VanDerWaalsContact ND1-OG 3.08Å
210	F	96.1	Very high	97.1	Very high	34 Å²	34	39.3 Å²	39.3	15%	0.149	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	160.5	-177.5	53.1	-91.1	0	0	0	111.5	R150 L151 F161 V163 H171 V212	R150-F210 WeakPolarHBondContact CA-O 3.28Å; L151-F210 HydrophobicContact CB-CD2 4.42Å; L151-F210 HydrophobicContact CB-CE2 3.95Å; L151-F210 HydrophobicContact CB-CZ 4.01Å; L151-F210 HydrophobicContact CD2-CE1 4.45Å; L151-F210 HydrophobicContact CD2-CE2 3.99Å; L151-F210 HydrophobicContact CD2-CZ 3.58Å; L151-F210 HydrophobicContact CG-CZ 4.4Å; L151-F210 PolarHBondContact N-O 3.43Å; L151-F210 PolarHBondContact O-N 3.02Å; F161-F210 HydrophobicContact CE2-CE1 4.07Å; F161-F210 HydrophobicContact CE2-CZ 4.02Å; F161-F210 HydrophobicContact CZ-CE1 4.39Å; V163-F210 HydrophobicContact CB-CE2 4.34Å; V163-F210 HydrophobicContact CB-CZ 4.41Å; V163-F210 HydrophobicContact CG1-CE2 4.33Å; V163-F210 HydrophobicContact CG2-CE2 3.83Å; V163-F210 HydrophobicContact CG2-CZ 3.57Å; H171-F210 HydrophobicContact CB-CE1 4.14Å; H171-F210 HydrophobicContact CB-CE2 4.4Å; H171-F210 HydrophobicContact CB-CZ 3.94Å; H171-F210 AromaticContact CD2-CE1 3.58Å; H171-F210 AromaticContact CE1-CD1 3.89Å; H171-F210 AromaticContact CE1-CE1 3.84Å; H171-F210 AromaticContact CG-CE1 3.53Å; H171-F210 AromaticContact CG-CZ 3.85Å; H171-F210 AromaticContact ND1-CD1 3.77Å; H171-F210 AromaticContact ND1-CE1 3.71Å; H171-F210 AromaticContact NE2-CE1 3.74Å; F210-V212 HydrophobicContact CD2-CG1 4.48Å; F210-V212 HydrophobicContact CE2-CG1 4.23Å
211	D	96.3	Very high	97.2	Very high	104 Å²	104	38.2 Å²	38.2	56%	0.556	23%	0.231	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.6	179.4	-53.4	-53.2	0	0	0	110.9	R150 R165	R150-D211 WeakPolarHBondContact CG-OD1 3.42Å; R165-D211 PolarHBondContact NH2-O 2.6Å; R165-D211 VanDerWaalsContact NH2-O 3.11Å
212	V	96.6	Very high	97.3	Very high	8 Å²	8	35.5 Å²	35.5	5%	0.048	21%	0.212	C	C	.	.			trans	-101.9	160.6	174.3	-67.2	0	0	0	0	111.6	Y34 L144 H149 L151 F210 D216 V299	Y34-V212 HydrophobicContact CD2-CG2 3.92Å; Y34-V212 HydrophobicContact CE2-CG2 4.34Å; L144-V212 HydrophobicContact CD1-CG2 3.52Å; H149-V212 WeakPolarHBondContact O-CG2 3.35Å; H149-V212 PolarHBondContact O-N 2.7Å; H149-V212 VanDerWaalsContact O-N 3.07Å; L151-V212 HydrophobicContact CB-CG1 3.84Å; F210-V212 HydrophobicContact CD2-CG1 4.48Å; F210-V212 HydrophobicContact CE2-CG1 4.23Å; V212-D216 WeakPolarHBondContact CA-OD2 3.45Å; V212-V299 HydrophobicContact CB-CG2 4.2Å; V212-V299 HydrophobicContact CG2-CG1 4.19Å; V212-V299 HydrophobicContact CG2-CG2 4.35Å
213	Q	96.1	Very high	97.4	Very high	100 Å²	100	35.4 Å²	35.4	47%	0.467	21%	0.211	S	C	.	.			trans	-121.8	152.4	175.6	-62.7	179.6	23	0	0	109.9	R165 G215 D216 V299	R165-Q213 VanDerWaalsContact CZ-NE2 3.34Å; R165-Q213 VanDerWaalsContact NH1-NE2 3.15Å; Q213-G215 PolarHBondContact O-N 2.96Å; Q213-D216 PolarHBondContact N-OD2 3.36Å; Q213-D216 VanDerWaalsContact O-CB 3.26Å; Q213-D216 WeakPolarHBondContact O-CB 2.97Å; Q213-D216 VanDerWaalsContact O-CG 3.28Å; Q213-D216 PolarHBondContact O-N 2.95Å; Q213-V299 WeakPolarHBondContact O-CB 3.31Å; Q213-V299 WeakPolarHBondContact O-CG1 3.38Å
214	L	95.5	Very high	97.4	Very high	76 Å²	76	29.8 Å²	29.8	40%	0.398	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	132.6	169.7	-68.3	174.6	0	0	0	110.2	Y34 D216 V299 E301	Y34-L214 HydrophobicContact CD1-CD2 3.9Å; Y34-L214 HydrophobicContact CD1-CG 4.46Å; Y34-L214 HydrophobicContact CE1-CD1 4.32Å; Y34-L214 HydrophobicContact CE1-CD2 3.74Å; Y34-L214 HydrophobicContact CE1-CG 3.81Å; Y34-L214 HydrophobicContact CE2-CD2 4.48Å; Y34-L214 HydrophobicContact CE2-CG 4.41Å; Y34-L214 HydrophobicContact CG-CD2 4.35Å; L214-D216 VanDerWaalsContact C-N 3.32Å; L214-V299 HydrophobicContact CD2-CG1 4.49Å; L214-E301 HydrophobicContact CD1-CG 3.92Å; L214-E301 HydrophobicContact CD2-CG 4Å
215	G	95.9	Very high	97.4	Very high	47 Å²	47	28 Å²	28	49%	0.485	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	-4	-176.1	0	0	0	0	0	114.8	Q213 I217 V299	Q213-G215 PolarHBondContact O-N 2.96Å; G215-I217 PolarHBondContact O-N 2.89Å; G215-V299 PolarHBondContact N-O 2.67Å
216	D	97.9	Very high	97.5	Very high	2 Å²	2	28 Å²	28	1%	0.011	17%	0.165	C	C	.	.			trans	-58.2	134.6	168.6	-77.4	-8.3	0	0	0	109.6	V163 R165 V212 Q213 L214 I298 V299	V163-D216 HydrophobicContact CG1-CB 4.35Å; R165-D216 WeakPolarHBondContact CB-OD1 3.3Å; R165-D216 VanDerWaalsContact CG-OD1 3.24Å; R165-D216 WeakPolarHBondContact CG-OD1 3.45Å; R165-D216 IonicContact CZ-OD1 3.7Å; R165-D216 IonicContact CZ-OD2 3.44Å; R165-D216 IonicContact NE-OD1 2.8Å; R165-D216 PolarHBondContact NE-OD1 2.83Å; R165-D216 IonicContact NE-OD2 3.35Å; R165-D216 PolarHBondContact NE-OD2 3.23Å; R165-D216 IonicContact NH2-OD1 2.71Å; R165-D216 IonicContact NH2-OD2 2.99Å; R165-D216 PolarHBondContact NH2-OD2 2.8Å; V212-D216 WeakPolarHBondContact CA-OD2 3.45Å; Q213-D216 PolarHBondContact N-OD2 3.36Å; Q213-D216 VanDerWaalsContact O-CB 3.26Å; Q213-D216 WeakPolarHBondContact O-CB 2.97Å; Q213-D216 VanDerWaalsContact O-CG 3.28Å; Q213-D216 PolarHBondContact O-N 2.95Å; L214-D216 VanDerWaalsContact C-N 3.32Å; D216-I298 WeakPolarHBondContact O-CA 3.36Å; D216-V299 HydrophobicContact CB-CB 4.3Å; D216-V299 HydrophobicContact CB-CG2 3.9Å; D216-V299 PolarHBondContact O-N 2.74Å
217	I	98.4	Very high	97.5	Very high	21 Å²	21	26.2 Å²	26.2	11%	0.108	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.3	177.1	-55	173.9	0	0	0	107.6	V163 V164 G215 L238 L241 L296 S297 I298	V163-I217 CarbonylContact C-O 3.49Å; V163-I217 WeakPolarHBondContact CA-O 3.34Å; V164-I217 HydrophobicContact CB-CB 4.25Å; V164-I217 PolarHBondContact N-O 3.1Å; V164-I217 PolarHBondContact O-N 3.29Å; G215-I217 PolarHBondContact O-N 2.89Å; I217-L238 HydrophobicContact CG2-CD1 4.41Å; I217-L238 HydrophobicContact CG2-CD2 4.06Å; I217-L241 HydrophobicContact CD1-CD2 3.77Å; I217-L241 HydrophobicContact CG1-CD2 4.39Å; I217-L296 HydrophobicContact CG2-CD1 3.47Å; I217-L296 VanDerWaalsContact CG2-CD1 3.47Å; I217-L296 HydrophobicContact CG2-CG 4.38Å; I217-S297 CarbonylContact C-O 3.54Å; I217-S297 WeakPolarHBondContact CA-O 3.14Å; I217-I298 HydrophobicContact CG1-CG1 4.32Å
218	I	98.6	Very high	97.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.3	177	-57.3	154.5	0	0	0	107.4	L36 V142 L151 L162 V163 S297 V299	L36-I218 HydrophobicContact CD2-CD1 3.79Å; V142-I218 HydrophobicContact CG1-CG2 4.33Å; L151-I218 HydrophobicContact CD1-CD1 3.7Å; L151-I218 HydrophobicContact CD2-CD1 4.08Å; L151-I218 HydrophobicContact CD2-CG1 4.27Å; L151-I218 HydrophobicContact CD2-CG2 4.41Å; L162-I218 WeakPolarHBondContact O-CA 3.45Å; V163-I218 HydrophobicContact CG1-CG1 4.46Å; V163-I218 HydrophobicContact CG2-CG1 4.14Å; I218-S297 PolarHBondContact N-O 2.82Å; I218-S297 PolarHBondContact O-N 2.96Å; I218-V299 HydrophobicContact CD1-CG2 3.84Å
219	L	98.8	Very high	97.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.3	170.7	178.8	144.5	0	0	0	108.2	F161 L162 A221 L225 F226 I234 I256 V294 L295 L296	F161-L219 CarbonylContact C-O 3.43Å; F161-L219 WeakPolarHBondContact CA-O 3.41Å; F161-L219 WeakPolarHBondContact CB-O 3.4Å; L162-L219 PolarHBondContact N-O 2.86Å; L162-L219 PolarHBondContact O-N 3.38Å; L219-A221 HydrophobicContact CD2-CB 4.03Å; L219-L225 HydrophobicContact CD1-CD2 4.16Å; L219-L225 HydrophobicContact CD2-CD2 3.64Å; L219-L225 HydrophobicContact CG-CD2 4.41Å; L219-F226 HydrophobicContact CD2-CE1 3.95Å; L219-F226 HydrophobicContact CD2-CZ 3.82Å; L219-I234 HydrophobicContact CD1-CG2 3.75Å; L219-I256 HydrophobicContact CD1-CD1 3.8Å; L219-I256 HydrophobicContact CD1-CG2 4.35Å; L219-V294 HydrophobicContact CD1-CG1 4.15Å; L219-V294 HydrophobicContact CG-CG1 4.31Å; L219-L295 WeakPolarHBondContact CA-O 3.29Å; L219-L296 HydrophobicContact CB-CD1 4.17Å; L219-L296 HydrophobicContact CD1-CD1 4.48Å
220	T	98.8	Very high	97.7	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.5	175.4	-57.5	0	0	0	0	108	L74 V76 V142 G160 F161 L295	L74-T220 HydrophobicContact CD1-CG2 3.77Å; L74-T220 VanDerWaalsContact CD1-OG1 3.27Å; L74-T220 WeakPolarHBondContact CD1-OG1 3.49Å; V76-T220 HydrophobicContact CG1-CG2 4.08Å; V76-T220 HydrophobicContact CG2-CG2 3.8Å; V142-T220 HydrophobicContact CG2-CG2 4.22Å; G160-T220 WeakPolarHBondContact O-CA 3.47Å; F161-T220 HydrophobicContact CB-CG2 4.39Å; T220-L295 PolarHBondContact N-O 3.16Å; T220-L295 PolarHBondContact O-N 3.27Å
221	A	98.8	Very high	97.8	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	162.2	-170.3	0	0	0	0	0	112.7	G160 L219 L225 F226 T293 V294	G160-A221 PolarHBondContact N-O 3.36Å; G160-A221 PolarHBondContact O-N 2.92Å; L219-A221 HydrophobicContact CD2-CB 4.03Å; A221-L225 HydrophobicContact CB-CB 3.95Å; A221-L225 HydrophobicContact CB-CD2 3.5Å; A221-L225 VanDerWaalsContact CB-CD2 3.5Å; A221-L225 HydrophobicContact CB-CG 4.34Å; A221-F226 HydrophobicContact CB-CE2 3.93Å; A221-F226 HydrophobicContact CB-CZ 4.06Å; A221-T293 WeakPolarHBondContact CA-O 3.31Å; A221-T293 WeakPolarHBondContact CB-O 3.43Å; A221-V294 HydrophobicContact CB-CG2 4.33Å
222	T	98.8	Very high	97.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.126	C	C	.	.			trans	-80.8	167.8	169.4	49.8	0	0	0	0	111.1	D61 V76 D78 G224 L225 T293	D61-T222 HydrophobicContact CB-CG2 4.37Å; D61-T222 WeakPolarHBondContact OD1-CG2 3.4Å; D61-T222 WeakPolarHBondContact OD2-CB 3.48Å; D61-T222 WeakPolarHBondContact OD2-CG2 3.38Å; D61-T222 PolarHBondContact OD2-OG1 2.55Å; V76-T222 HydrophobicContact CB-CG2 4.05Å; V76-T222 HydrophobicContact CG2-CG2 4.29Å; D78-T222 HydrophobicContact CB-CG2 4.06Å; T222-G224 PolarHBondContact O-N 3.16Å; T222-L225 PolarHBondContact O-N 2.82Å; T222-L225 VanDerWaalsContact O-N 3.16Å; T222-T293 PolarHBondContact N-O 2.95Å; T222-T293 VanDerWaalsContact N-O 3.16Å; T222-T293 PolarHBondContact OG1-N 2.65Å
223	D	98.1	Very high	98	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.032	13%	0.13	C	C	.	.	H	α-helix	trans	-57.8	-33.3	-177.6	69.7	-31.8	0	0	0	112.1	D158 L225 F226 D227 K288	D158-D223 HydrophobicContact CB-CB 4.49Å; D223-L225 CarbonylContact O-C 3.59Å; D223-L225 PolarHBondContact O-N 3.35Å; D223-F226 PolarHBondContact O-N 3.02Å; D223-D227 VanDerWaalsContact O-CB 3.31Å; D223-D227 WeakPolarHBondContact O-CB 2.98Å; D223-D227 PolarHBondContact O-N 2.83Å; D223-K288 IonicContact OD2-NZ 2.97Å; D223-K288 PolarHBondContact OD2-NZ 3.02Å
224	G	98	Very high	98.1	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-53.6	-26	176.9	0	0	0	0	0	114.4	T222 N228 D291	T222-G224 PolarHBondContact O-N 3.16Å; G224-N228 PolarHBondContact O-ND2 2.92Å; G224-D291 WeakPolarHBondContact CA-O 3.16Å
225	L	98.6	Very high	98.3	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-75.9	-58.6	166.4	175.3	65.3	0	0	0	111.7	L219 A221 T222 D223 D227 N228 M229 I234 I256 A260 V294	L219-L225 HydrophobicContact CD1-CD2 4.16Å; L219-L225 HydrophobicContact CD2-CD2 3.64Å; L219-L225 HydrophobicContact CG-CD2 4.41Å; A221-L225 HydrophobicContact CB-CB 3.95Å; A221-L225 HydrophobicContact CB-CD2 3.5Å; A221-L225 VanDerWaalsContact CB-CD2 3.5Å; A221-L225 HydrophobicContact CB-CG 4.34Å; T222-L225 PolarHBondContact O-N 2.82Å; T222-L225 VanDerWaalsContact O-N 3.16Å; D223-L225 CarbonylContact O-C 3.59Å; D223-L225 PolarHBondContact O-N 3.35Å; L225-D227 VanDerWaalsContact C-N 3.29Å; L225-D227 PolarHBondContact O-N 3.13Å; L225-N228 PolarHBondContact O-N 2.97Å; L225-M229 HydrophobicContact CD1-CB 3.94Å; L225-M229 HydrophobicContact CD1-CG 4.08Å; L225-M229 HydrophobicContact CD1-SD 3.67Å; L225-M229 PolarHBondContact O-N 3.09Å; L225-I234 HydrophobicContact CD2-CD1 4.24Å; L225-I234 HydrophobicContact CG-CD1 4.42Å; L225-I256 HydrophobicContact CD1-CG2 3.6Å; L225-I256 HydrophobicContact CD2-CG2 4.13Å; L225-A260 HydrophobicContact CD1-CB 3.57Å; L225-V294 HydrophobicContact CB-CG2 4.47Å; L225-V294 HydrophobicContact CD2-CG2 4.04Å
226	F	98.4	Very high	98.4	Very high	9 Å²	9	19.7 Å²	19.7	4%	0.039	9%	0.093	C	C	.	.	H	α-helix	trans	-66.6	-30.4	-168.7	-63.7	-57.2	0	0	0	113.2	L219 A221 D223 N228 I234 P272	L219-F226 HydrophobicContact CD2-CE1 3.95Å; L219-F226 HydrophobicContact CD2-CZ 3.82Å; A221-F226 HydrophobicContact CB-CE2 3.93Å; A221-F226 HydrophobicContact CB-CZ 4.06Å; D223-F226 PolarHBondContact O-N 3.02Å; F226-N228 PolarHBondContact O-N 3.43Å; F226-I234 HydrophobicContact CD1-CD1 4.19Å; F226-I234 HydrophobicContact CE1-CD1 4.16Å; F226-P272 WeakPolarHBondContact O-CB 2.87Å; F226-P272 WeakPolarHBondContact O-CG 3.33Å
227	D	98.3	Very high	98.4	Very high	13 Å²	13	20 Å²	20	7%	0.07	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.5	174.5	-85.7	-26.5	0	0	0	113.6	D223 L225 S271 P272 F273 K288	D223-D227 VanDerWaalsContact O-CB 3.31Å; D223-D227 WeakPolarHBondContact O-CB 2.98Å; D223-D227 PolarHBondContact O-N 2.83Å; L225-D227 VanDerWaalsContact C-N 3.29Å; L225-D227 PolarHBondContact O-N 3.13Å; D227-S271 VanDerWaalsContact O-CB 3.26Å; D227-S271 WeakPolarHBondContact O-CB 3.43Å; D227-S271 PolarHBondContact O-OG 3.29Å; D227-P272 VanDerWaalsContact O-CD 3.29Å; D227-P272 WeakPolarHBondContact O-CD 3.34Å; D227-F273 HydrophobicContact CB-CB 3.76Å; D227-F273 WeakPolarHBondContact O-CB 3.29Å; D227-F273 PolarHBondContact O-N 3.19Å; D227-K288 HydrophobicContact CB-CB 4.35Å; D227-K288 HydrophobicContact CB-CD 3.89Å; D227-K288 WeakPolarHBondContact OD2-CD 3.31Å; D227-K288 WeakPolarHBondContact OD2-CE 3.29Å; D227-K288 IonicContact OD2-NZ 2.63Å; D227-K288 PolarHBondContact OD2-NZ 3.22Å
228	N	98.6	Very high	98.3	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-26.6	-174.4	-68.7	-59	0	0	0	113.2	G224 L225 F226 L263 A264 Y269 G287 K288	G224-N228 PolarHBondContact O-ND2 2.92Å; L225-N228 PolarHBondContact O-N 2.97Å; F226-N228 PolarHBondContact O-N 3.43Å; N228-L263 HydrophobicContact CB-CB 4.49Å; N228-A264 WeakPolarHBondContact OD1-CA 3.05Å; N228-Y269 WeakPolarHBondContact O-CE1 3.35Å; N228-Y269 PolarHBondContact O-OH 3.4Å; N228-G287 WeakPolarHBondContact OD1-CA 3.07Å; N228-K288 PolarHBondContact ND2-O 3.48Å; N228-K288 PolarHBondContact OD1-N 3.37Å
229	M	98.4	Very high	98.2	Very high	1 Å²	1	27 Å²	27	1%	0.005	13%	0.125	C	C	.	.			trans	-122.9	115	-178.4	-72.5	-171.2	69	0	0	112.2	L225 M233 I234 E237 I256 Q259 A260 L263	L225-M229 HydrophobicContact CD1-CB 3.94Å; L225-M229 HydrophobicContact CD1-CG 4.08Å; L225-M229 HydrophobicContact CD1-SD 3.67Å; L225-M229 PolarHBondContact O-N 3.09Å; M229-M233 HydrophobicContact CE-CB 3.74Å; M229-I234 HydrophobicContact CB-CD1 4.41Å; M229-I234 HydrophobicContact CB-CG1 3.98Å; M229-I234 HydrophobicContact CE-CG1 4.25Å; M229-E237 HydrophobicContact CE-CG 4.1Å; M229-I256 HydrophobicContact SD-CG2 4.3Å; M229-Q259 HydrophobicContact CE-CB 4.32Å; M229-Q259 HydrophobicContact CE-CG 4.15Å; M229-Q259 HydrophobicContact SD-CB 4.09Å; M229-Q259 HydrophobicContact SD-CG 4.24Å; M229-A260 HydrophobicContact CG-CB 3.92Å; M229-A260 HydrophobicContact SD-CB 3.65Å; M229-A260 PolarHBondContact SD-N 3.42Å; M229-A260 VanDerWaalsContact SD-N 3.43Å; M229-L263 HydrophobicContact CG-CD1 3.87Å
230	P	97.8	Very high	97.9	Very high	31 Å²	31	32.1 Å²	32.1	20%	0.201	15%	0.147	C	C	.	.			trans	-70.5	156.4	170.5	30.6	-35.3	0	0	0	110.9	Y232 M233 I234 Y269 P272	P230-Y232 HydrophobicContact CB-CD1 3.82Å; P230-Y232 HydrophobicContact CB-CE1 3.68Å; P230-Y232 HydrophobicContact CG-CD1 3.68Å; P230-Y232 HydrophobicContact CG-CE1 3.17Å; P230-Y232 HydrophobicContact CG-CE2 4.47Å; P230-Y232 PolarHBondContact O-N 2.66Å; P230-M233 HydrophobicContact CG-CB 4.4Å; P230-M233 HydrophobicContact CG-CE 4.33Å; P230-M233 HydrophobicContact CG-CG 3.92Å; P230-M233 HydrophobicContact CG-SD 4.25Å; P230-M233 PolarHBondContact O-N 2.96Å; P230-I234 PolarHBondContact O-N 2.57Å; P230-Y269 VanDerWaalsContact CD-OH 3.3Å; P230-Y269 WeakPolarHBondContact CD-OH 3.06Å; P230-P272 HydrophobicContact CB-CG 4.17Å
231	D	98.1	Very high	97.6	Very high	48 Å²	48	33.8 Å²	33.8	26%	0.257	16%	0.156	S	C	.	.	H	α-helix	trans	-49.3	-40.6	-176.4	-72.6	-3.3	0	0	0	113.4	V169 R172 M233 I234 L235	V169-D231 HydrophobicContact CG2-CB 4.46Å; R172-D231 WeakPolarHBondContact CD-OD2 3.22Å; R172-D231 IonicContact CZ-OD1 3.87Å; R172-D231 IonicContact NE-OD1 2.71Å; R172-D231 IonicContact NH1-OD1 3.75Å; R172-D231 PolarHBondContact NH1-OD1 3.36Å; D231-M233 VanDerWaalsContact C-N 3.28Å; D231-M233 PolarHBondContact O-N 3.02Å; D231-I234 WeakPolarHBondContact O-CB 3.49Å; D231-I234 PolarHBondContact O-N 3.01Å; D231-I234 VanDerWaalsContact O-N 3.17Å; D231-L235 VanDerWaalsContact O-CG 3.31Å; D231-L235 WeakPolarHBondContact O-CG 3.48Å; D231-L235 PolarHBondContact O-N 2.9Å
232	Y	97.9	Very high	97	Very high	135 Å²	135	42.8 Å²	42.8	53%	0.529	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-31.5	-179.2	76.3	-97.5	0	0	0	113.2	P230 Q236	P230-Y232 HydrophobicContact CB-CD1 3.82Å; P230-Y232 HydrophobicContact CB-CE1 3.68Å; P230-Y232 HydrophobicContact CG-CD1 3.68Å; P230-Y232 HydrophobicContact CG-CE1 3.17Å; P230-Y232 HydrophobicContact CG-CE2 4.47Å; P230-Y232 PolarHBondContact O-N 2.66Å; Y232-Q236 VanDerWaalsContact O-CG 3.28Å; Y232-Q236 WeakPolarHBondContact O-CG 3.48Å; Y232-Q236 PolarHBondContact O-N 2.8Å
233	M	98.5	Very high	96.4	Very high	24 Å²	24	45.9 Å²	45.9	12%	0.118	21%	0.212	C	C	.	.	H	α-helix	trans	-74.5	-41.4	174.7	-68.5	-167	-171.7	0	0	110.4	M229 P230 D231 L235 Q236 E237 L263 Y269	M229-M233 HydrophobicContact CE-CB 3.74Å; P230-M233 HydrophobicContact CG-CB 4.4Å; P230-M233 HydrophobicContact CG-CE 4.33Å; P230-M233 HydrophobicContact CG-CG 3.92Å; P230-M233 HydrophobicContact CG-SD 4.25Å; P230-M233 PolarHBondContact O-N 2.96Å; D231-M233 VanDerWaalsContact C-N 3.28Å; D231-M233 PolarHBondContact O-N 3.02Å; M233-L235 VanDerWaalsContact C-N 3.31Å; M233-L235 PolarHBondContact O-N 3.44Å; M233-Q236 WeakPolarHBondContact O-CB 3.39Å; M233-Q236 PolarHBondContact O-N 3.03Å; M233-E237 PolarHBondContact O-N 3.42Å; M233-E237 VanDerWaalsContact O-N 3.08Å; M233-L263 HydrophobicContact SD-CD1 3.76Å; M233-Y269 HydrophobicContact CE-CE2 4.07Å
234	I	98.6	Very high	95.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-56.9	-47.7	174	-61.3	174	0	0	0	109.9	L219 L225 F226 M229 P230 D231 Q236 E237 L238	L219-I234 HydrophobicContact CD1-CG2 3.75Å; L225-I234 HydrophobicContact CD2-CD1 4.24Å; L225-I234 HydrophobicContact CG-CD1 4.42Å; F226-I234 HydrophobicContact CD1-CD1 4.19Å; F226-I234 HydrophobicContact CE1-CD1 4.16Å; M229-I234 HydrophobicContact CB-CD1 4.41Å; M229-I234 HydrophobicContact CB-CG1 3.98Å; M229-I234 HydrophobicContact CE-CG1 4.25Å; P230-I234 PolarHBondContact O-N 2.57Å; D231-I234 WeakPolarHBondContact O-CB 3.49Å; D231-I234 PolarHBondContact O-N 3.01Å; D231-I234 VanDerWaalsContact O-N 3.17Å; I234-Q236 VanDerWaalsContact C-N 3.28Å; I234-Q236 PolarHBondContact O-N 3.12Å; I234-E237 PolarHBondContact O-N 2.85Å; I234-E237 VanDerWaalsContact O-N 3.16Å; I234-L238 HydrophobicContact CG2-CD1 4.06Å; I234-L238 HydrophobicContact CG2-CG 4.36Å; I234-L238 WeakPolarHBondContact O-CG 3.39Å; I234-L238 PolarHBondContact O-N 2.86Å
235	L	98.5	Very high	95.5	Very high	25 Å²	25	52.7 Å²	52.7	13%	0.131	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-33.8	176.3	-68	178.6	0	0	0	112.9	V164 V169 D231 M233 L238 K239	V164-L235 HydrophobicContact CB-CD2 4.41Å; V164-L235 HydrophobicContact CG1-CD2 3.76Å; V164-L235 HydrophobicContact CG2-CD2 3.68Å; V169-L235 HydrophobicContact CG2-CD1 4.11Å; V169-L235 HydrophobicContact CG2-CD2 4.04Å; V169-L235 HydrophobicContact CG2-CG 4.28Å; D231-L235 VanDerWaalsContact O-CG 3.31Å; D231-L235 WeakPolarHBondContact O-CG 3.48Å; D231-L235 PolarHBondContact O-N 2.9Å; M233-L235 VanDerWaalsContact C-N 3.31Å; M233-L235 PolarHBondContact O-N 3.44Å; L235-L238 HydrophobicContact CD2-CD1 4.45Å; L235-L238 PolarHBondContact O-N 2.85Å; L235-K239 WeakPolarHBondContact O-CG 3.2Å; L235-K239 PolarHBondContact O-N 2.97Å; L235-K239 VanDerWaalsContact O-N 3.14Å
236	Q	98.1	Very high	95.2	Very high	98 Å²	98	58.9 Å²	58.9	46%	0.458	28%	0.277	S	S	.	.	H	α-helix	trans	-65.9	-40.2	175	-75.5	171.7	14.7	0	0	112	Y232 M233 I234 K239	Y232-Q236 VanDerWaalsContact O-CG 3.28Å; Y232-Q236 WeakPolarHBondContact O-CG 3.48Å; Y232-Q236 PolarHBondContact O-N 2.8Å; M233-Q236 WeakPolarHBondContact O-CB 3.39Å; M233-Q236 PolarHBondContact O-N 3.03Å; I234-Q236 VanDerWaalsContact C-N 3.28Å; I234-Q236 PolarHBondContact O-N 3.12Å; Q236-K239 PolarHBondContact O-N 3.3Å
237	E	97.9	Very high	95	Very high	9 Å²	9	65.6 Å²	65.6	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-67.1	-42.5	174.2	-68.1	-57.5	119.9	0	0	111.8	M229 M233 I234 K239 K240 S255 I256 Q259	M229-E237 HydrophobicContact CE-CG 4.1Å; M233-E237 PolarHBondContact O-N 3.42Å; M233-E237 VanDerWaalsContact O-N 3.08Å; I234-E237 PolarHBondContact O-N 2.85Å; I234-E237 VanDerWaalsContact O-N 3.16Å; E237-K239 PolarHBondContact O-N 3.4Å; E237-K240 VanDerWaalsContact O-CB 3.24Å; E237-K240 WeakPolarHBondContact O-CB 3.46Å; E237-K240 WeakPolarHBondContact O-CG 3Å; E237-K240 PolarHBondContact O-N 3.42Å; E237-K240 VanDerWaalsContact OE1-CE 3.25Å; E237-K240 WeakPolarHBondContact OE1-CE 3.5Å; E237-K240 IonicContact OE1-NZ 2.94Å; E237-K240 PolarHBondContact OE1-NZ 2.89Å; E237-K240 WeakPolarHBondContact OE2-CE 3.39Å; E237-K240 IonicContact OE2-NZ 3.75Å; E237-K240 PolarHBondContact OE2-NZ 3.17Å; E237-S255 WeakPolarHBondContact OE2-CB 3.49Å; E237-S255 PolarHBondContact OE2-OG 2.9Å; E237-I256 HydrophobicContact CB-CD1 4.22Å; E237-I256 HydrophobicContact CB-CG1 3.44Å; E237-I256 VanDerWaalsContact CB-CG1 3.44Å; E237-I256 HydrophobicContact CG-CG1 4.01Å; E237-Q259 PolarHBondContact OE1-OE1 3.19Å
238	L	97.6	Very high	94.9	Very high	10 Å²	10	65.8 Å²	65.8	5%	0.052	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-27.5	177.9	-67.9	177.9	0	0	0	113.1	V164 I217 I234 L235 K240 L241 T252 I256 L296	V164-L238 HydrophobicContact CB-CD1 4.41Å; V164-L238 HydrophobicContact CG2-CD1 3.69Å; I217-L238 HydrophobicContact CG2-CD1 4.41Å; I217-L238 HydrophobicContact CG2-CD2 4.06Å; I234-L238 HydrophobicContact CG2-CD1 4.06Å; I234-L238 HydrophobicContact CG2-CG 4.36Å; I234-L238 WeakPolarHBondContact O-CG 3.39Å; I234-L238 PolarHBondContact O-N 2.86Å; L235-L238 HydrophobicContact CD2-CD1 4.45Å; L235-L238 PolarHBondContact O-N 2.85Å; L238-K240 PolarHBondContact O-N 3.36Å; L238-L241 WeakPolarHBondContact O-CB 3.3Å; L238-L241 PolarHBondContact O-N 3.02Å; L238-L241 VanDerWaalsContact O-N 3.13Å; L238-T252 HydrophobicContact CD2-CG2 4.17Å; L238-I256 HydrophobicContact CD2-CD1 3.77Å; L238-I256 HydrophobicContact CG-CD1 4.29Å; L238-L296 HydrophobicContact CD2-CD1 3.62Å; L238-L296 HydrophobicContact CD2-CD2 4.06Å
239	K	95.5	Very high	94.8	Very high	157 Å²	157	65.8 Å²	65.8	68%	0.683	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18	172.4	-73.8	169.3	-172.7	177.8	0	113.6	L235 Q236 E237 L241	L235-K239 WeakPolarHBondContact O-CG 3.2Å; L235-K239 PolarHBondContact O-N 2.97Å; L235-K239 VanDerWaalsContact O-N 3.14Å; Q236-K239 PolarHBondContact O-N 3.3Å; E237-K239 PolarHBondContact O-N 3.4Å; K239-L241 VanDerWaalsContact C-N 3.27Å
240	K	92.5	Very high	94.6	Very high	109 Å²	109	67.2 Å²	67.2	47%	0.474	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.3	176.7	-57	176.7	-174.3	170.9	0	112.5	E237 L238 K242	E237-K240 VanDerWaalsContact O-CB 3.24Å; E237-K240 WeakPolarHBondContact O-CB 3.46Å; E237-K240 WeakPolarHBondContact O-CG 3Å; E237-K240 PolarHBondContact O-N 3.42Å; E237-K240 VanDerWaalsContact OE1-CE 3.25Å; E237-K240 WeakPolarHBondContact OE1-CE 3.5Å; E237-K240 IonicContact OE1-NZ 2.94Å; E237-K240 PolarHBondContact OE1-NZ 2.89Å; E237-K240 WeakPolarHBondContact OE2-CE 3.39Å; E237-K240 IonicContact OE2-NZ 3.75Å; E237-K240 PolarHBondContact OE2-NZ 3.17Å; L238-K240 PolarHBondContact O-N 3.36Å; K240-K242 WeakPolarHBondContact O-CG 3.39Å; K240-K242 PolarHBondContact O-N 2.87Å
241	L	92.4	Very high	94.5	Very high	34 Å²	34	70.4 Å²	70.4	18%	0.178	33%	0.329	C	S	.	.			trans	-64.3	115.1	177.4	-174.6	85.6	0	0	0	109.9	I217 L238 K239 I249 T252 I298	I217-L241 HydrophobicContact CD1-CD2 3.77Å; I217-L241 HydrophobicContact CG1-CD2 4.39Å; L238-L241 WeakPolarHBondContact O-CB 3.3Å; L238-L241 PolarHBondContact O-N 3.02Å; L238-L241 VanDerWaalsContact O-N 3.13Å; K239-L241 VanDerWaalsContact C-N 3.27Å; L241-I249 HydrophobicContact CD1-CB 4.47Å; L241-I249 HydrophobicContact CD1-CG1 3.94Å; L241-T252 HydrophobicContact CB-CG2 4.46Å; L241-I298 HydrophobicContact CD1-CD1 4.07Å; L241-I298 HydrophobicContact CD2-CD1 3.37Å; L241-I298 HydrophobicContact CD2-CG1 4.35Å; L241-I298 HydrophobicContact CG-CD1 4.22Å
242	K	85.5	Confident	94.5	Very high	189 Å²	189	68.4 Å²	68.4	82%	0.822	32%	0.319	S	S	*	.			trans	-91.1	-33.4	-172.6	-64.1	-175.8	-179.1	175.9	0	113.6	K240 S248	K240-K242 WeakPolarHBondContact O-CG 3.39Å; K240-K242 PolarHBondContact O-N 2.87Å; K242-S248 PolarHBondContact N-OG 2.93Å; K242-S248 VanDerWaalsContact N-OG 3.12Å
243	N	87.3	Confident	94.5	Very high	66 Å²	66	62 Å²	62	35%	0.353	29%	0.294	S	S	.	.	S	Bend	trans	-156	162.5	-175.2	58.6	52.4	0	0	0	109.6	N245 S248	N243-N245 PolarHBondContact O-N 3.46Å; N243-N245 VanDerWaalsContact O-N 3.11Å; N243-N245 WeakPolarHBondContact OD1-CB 3.37Å; N243-N245 PolarHBondContact OD1-N 3.43Å; N243-N245 PolarHBondContact OD1-ND2 3.35Å; N243-N245 PolarHBondContact OD1-OD1 3.16Å; N243-S248 WeakPolarHBondContact O-CB 3.49Å; N243-S248 PolarHBondContact O-OG 3.09Å; N243-S248 VanDerWaalsContact OD1-CB 3.23Å; N243-S248 WeakPolarHBondContact OD1-CB 3.33Å
244	P	86.4	Confident	94.4	Very high	79 Å²	79	65.2 Å²	65.2	51%	0.513	31%	0.305	S	S	.	.	S	Bend	trans	-81.5	22.7	-177.4	34.2	-37.4	0	0	0	113.6	I298	P244-I298 HydrophobicContact CB-CD1 4.11Å; P244-I298 HydrophobicContact CB-CG2 4.06Å
245	N	90.8	Very high	94.3	Very high	70 Å²	70	66.4 Å²	66.4	37%	0.374	31%	0.313	S	S	.	.	S	Bend	trans	-84.7	156	178.6	83.8	21.6	0	0	0	111.4	N243 E247 S248 I249	N243-N245 PolarHBondContact O-N 3.46Å; N243-N245 VanDerWaalsContact O-N 3.11Å; N243-N245 WeakPolarHBondContact OD1-CB 3.37Å; N243-N245 PolarHBondContact OD1-N 3.43Å; N243-N245 PolarHBondContact OD1-ND2 3.35Å; N243-N245 PolarHBondContact OD1-OD1 3.16Å; N245-E247 VanDerWaalsContact C-N 3.28Å; N245-E247 PolarHBondContact O-N 3.24Å; N245-E247 PolarHBondContact OD1-N 2.89Å; N245-E247 VanDerWaalsContact OD1-N 3.13Å; N245-S248 PolarHBondContact O-N 3.07Å; N245-S248 WeakPolarHBondContact OD1-CB 3.44Å; N245-S248 PolarHBondContact OD1-N 3.36Å; N245-I249 WeakPolarHBondContact O-CD1 3.4Å; N245-I249 VanDerWaalsContact O-CG1 3.22Å; N245-I249 WeakPolarHBondContact O-CG1 3.22Å; N245-I249 PolarHBondContact O-N 3.43Å; N245-I249 VanDerWaalsContact O-N 3.1Å
246	Y	92.5	Very high	94.3	Very high	130 Å²	130	65.2 Å²	65.2	51%	0.51	31%	0.307	S	S	.	.	H	α-helix	trans	-55	-40.4	-177.3	-179.1	-87.3	0	0	0	113.3	T38 A39 I249 Q250	T38-Y246 VanDerWaalsContact O-CE2 3.29Å; T38-Y246 WeakPolarHBondContact O-CE2 3.44Å; A39-Y246 HydrophobicContact CB-CD2 4.27Å; A39-Y246 HydrophobicContact CB-CE2 3.83Å; Y246-I249 PolarHBondContact O-N 3.19Å; Y246-Q250 HydrophobicContact CD1-CB 4.42Å; Y246-Q250 HydrophobicContact CE1-CB 4.08Å; Y246-Q250 HydrophobicContact CE1-CG 4.35Å; Y246-Q250 WeakPolarHBondContact O-CB 3.38Å; Y246-Q250 PolarHBondContact O-N 3.23Å; Y246-Q250 PolarHBondContact OH-OE1 3.12Å
247	E	93.9	Very high	94.3	Very high	150 Å²	150	60.6 Å²	60.6	70%	0.701	29%	0.285	S	S	*	.	H	α-helix	trans	-66.1	-44.1	-177.2	-173.9	179.7	-172.5	0	0	112.2	N245 I249 Q250 Q251	N245-E247 VanDerWaalsContact C-N 3.28Å; N245-E247 PolarHBondContact O-N 3.24Å; N245-E247 PolarHBondContact OD1-N 2.89Å; N245-E247 VanDerWaalsContact OD1-N 3.13Å; E247-I249 VanDerWaalsContact C-N 3.35Å; E247-Q250 PolarHBondContact O-N 3.06Å; E247-Q251 WeakPolarHBondContact O-CB 3.46Å; E247-Q251 PolarHBondContact O-N 3.29Å
248	S	95.3	Very high	94.3	Very high	17 Å²	17	64.1 Å²	64.1	12%	0.119	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-41.8	176.1	-178.4	0	0	0	0	111	K242 N243 N245 T252	K242-S248 PolarHBondContact N-OG 2.93Å; K242-S248 VanDerWaalsContact N-OG 3.12Å; N243-S248 WeakPolarHBondContact O-CB 3.49Å; N243-S248 PolarHBondContact O-OG 3.09Å; N243-S248 VanDerWaalsContact OD1-CB 3.23Å; N243-S248 WeakPolarHBondContact OD1-CB 3.33Å; N245-S248 PolarHBondContact O-N 3.07Å; N245-S248 WeakPolarHBondContact OD1-CB 3.44Å; N245-S248 PolarHBondContact OD1-N 3.36Å; S248-T252 WeakPolarHBondContact O-CB 3.43Å; S248-T252 PolarHBondContact O-N 3.44Å; S248-T252 PolarHBondContact O-OG1 3.01Å
249	I	96.3	Very high	94.3	Very high	0 Å²	0	66 Å²	66	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-47.4	177.4	-60.8	165.3	0	0	0	110.1	V37 A39 L241 N245 Y246 E247 Q251 T252 A253 L296 I298	V37-I249 HydrophobicContact CB-CD1 3.75Å; V37-I249 HydrophobicContact CG1-CD1 3.51Å; V37-I249 WeakPolarHBondContact O-CD1 3.5Å; A39-I249 HydrophobicContact CB-CB 4.27Å; A39-I249 HydrophobicContact CB-CG2 3.8Å; L241-I249 HydrophobicContact CD1-CB 4.47Å; L241-I249 HydrophobicContact CD1-CG1 3.94Å; N245-I249 WeakPolarHBondContact O-CD1 3.4Å; N245-I249 VanDerWaalsContact O-CG1 3.22Å; N245-I249 WeakPolarHBondContact O-CG1 3.22Å; N245-I249 PolarHBondContact O-N 3.43Å; N245-I249 VanDerWaalsContact O-N 3.1Å; Y246-I249 PolarHBondContact O-N 3.19Å; E247-I249 VanDerWaalsContact C-N 3.35Å; I249-Q251 PolarHBondContact O-N 3.05Å; I249-T252 PolarHBondContact O-N 2.74Å; I249-A253 WeakPolarHBondContact O-CB 3.21Å; I249-A253 PolarHBondContact O-N 3.34Å; I249-L296 HydrophobicContact CG2-CB 3.94Å; I249-L296 HydrophobicContact CG2-CD2 3.99Å; I249-L296 HydrophobicContact CG2-CG 3.92Å; I249-L296 WeakPolarHBondContact CG2-O 3.46Å; I249-I298 HydrophobicContact CD1-CB 4.31Å; I249-I298 HydrophobicContact CD1-CD1 3.67Å; I249-I298 HydrophobicContact CD1-CG1 3.99Å; I249-I298 HydrophobicContact CG1-CD1 3.55Å; I249-I298 HydrophobicContact CG1-CG1 4.15Å
250	Q	95.8	Very high	94.4	Very high	31 Å²	31	58.5 Å²	58.5	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-42.8	178.7	179.5	64.5	75.7	0	0	112.4	A39 G40 Y246 E247 T252 R254	A39-Q250 HydrophobicContact CB-CB 3.76Å; G40-Q250 PolarHBondContact O-NE2 2.97Å; G40-Q250 PolarHBondContact O-OE1 3.3Å; Y246-Q250 HydrophobicContact CD1-CB 4.42Å; Y246-Q250 HydrophobicContact CE1-CB 4.08Å; Y246-Q250 HydrophobicContact CE1-CG 4.35Å; Y246-Q250 WeakPolarHBondContact O-CB 3.38Å; Y246-Q250 PolarHBondContact O-N 3.23Å; Y246-Q250 PolarHBondContact OH-OE1 3.12Å; E247-Q250 PolarHBondContact O-N 3.06Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; Q250-R254 WeakPolarHBondContact O-CB 3.43Å; Q250-R254 PolarHBondContact O-N 3.48Å
251	Q	96	Very high	94.6	Very high	98 Å²	98	55 Å²	55	46%	0.458	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-37.4	178	-175	57.8	36	0	0	111.6	E247 I249 R254 S255	E247-Q251 WeakPolarHBondContact O-CB 3.46Å; E247-Q251 PolarHBondContact O-N 3.29Å; I249-Q251 PolarHBondContact O-N 3.05Å; Q251-R254 VanDerWaalsContact OE1-NH1 3.08Å; Q251-S255 WeakPolarHBondContact O-CB 3.36Å; Q251-S255 PolarHBondContact O-N 3.48Å
252	T	97.6	Very high	94.8	Very high	6 Å²	6	60.4 Å²	60.4	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-69.8	-45.7	177.2	-53.2	0	0	0	0	111.1	L238 L241 S248 I249 Q250 R254 S255 I256 L296	L238-T252 HydrophobicContact CD2-CG2 4.17Å; L241-T252 HydrophobicContact CB-CG2 4.46Å; S248-T252 WeakPolarHBondContact O-CB 3.43Å; S248-T252 PolarHBondContact O-N 3.44Å; S248-T252 PolarHBondContact O-OG1 3.01Å; I249-T252 PolarHBondContact O-N 2.74Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; T252-R254 VanDerWaalsContact C-N 3.28Å; T252-R254 PolarHBondContact O-N 3.31Å; T252-S255 WeakPolarHBondContact O-CB 3.47Å; T252-S255 PolarHBondContact O-N 2.85Å; T252-S255 VanDerWaalsContact O-N 3.13Å; T252-I256 HydrophobicContact CG2-CD1 4.24Å; T252-I256 WeakPolarHBondContact O-CG1 3.37Å; T252-I256 PolarHBondContact O-N 3.19Å; T252-L296 HydrophobicContact CG2-CD2 3.84Å
253	A	97.2	Very high	95.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-57.5	-41.4	175	0	0	0	0	0	112	C41 I249 A257 L296	C41-A253 HydrophobicContact CB-CB 4.48Å; I249-A253 WeakPolarHBondContact O-CB 3.21Å; I249-A253 PolarHBondContact O-N 3.34Å; A253-A257 WeakPolarHBondContact O-CB 3.29Å; A253-A257 PolarHBondContact O-N 3.12Å; A253-A257 VanDerWaalsContact O-N 3.08Å; A253-L296 HydrophobicContact CB-CB 3.85Å; A253-L296 HydrophobicContact CB-CD2 4.4Å
254	R	96.4	Very high	95.9	Very high	92 Å²	92	49.6 Å²	49.6	35%	0.347	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-48.8	173.2	179.8	-177.3	-63.1	135.4	-0.6	111.8	C41 Q250 Q251 T252 I256 A257 E258	C41-R254 HydrophobicContact CB-CB 4.34Å; Q250-R254 WeakPolarHBondContact O-CB 3.43Å; Q250-R254 PolarHBondContact O-N 3.48Å; Q251-R254 VanDerWaalsContact OE1-NH1 3.08Å; T252-R254 VanDerWaalsContact C-N 3.28Å; T252-R254 PolarHBondContact O-N 3.31Å; R254-I256 VanDerWaalsContact C-N 3.29Å; R254-I256 PolarHBondContact O-N 2.88Å; R254-A257 PolarHBondContact O-N 2.85Å; R254-E258 WeakPolarHBondContact CD-OE1 3.18Å; R254-E258 HydrophobicContact CG-CG 4.05Å; R254-E258 VanDerWaalsContact CG-OE1 3.29Å; R254-E258 WeakPolarHBondContact CG-OE1 3.41Å; R254-E258 WeakPolarHBondContact O-CB 3.26Å; R254-E258 WeakPolarHBondContact O-CG 3.37Å; R254-E258 PolarHBondContact O-N 3.27Å
255	S	97.7	Very high	96.4	Very high	25 Å²	25	50.8 Å²	50.8	18%	0.175	23%	0.233	C	C	.	.	H	α-helix	trans	-57.6	-42	179.9	-167.1	0	0	0	0	112	E237 Q251 T252 Q259	E237-S255 WeakPolarHBondContact OE2-CB 3.49Å; E237-S255 PolarHBondContact OE2-OG 2.9Å; Q251-S255 WeakPolarHBondContact O-CB 3.36Å; Q251-S255 PolarHBondContact O-N 3.48Å; T252-S255 WeakPolarHBondContact O-CB 3.47Å; T252-S255 PolarHBondContact O-N 2.85Å; T252-S255 VanDerWaalsContact O-N 3.13Å; S255-Q259 WeakPolarHBondContact O-CB 3.1Å; S255-Q259 PolarHBondContact O-N 2.95Å
256	I	98.5	Very high	96.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61.7	-52.4	174.8	-66.7	169.4	0	0	0	110.7	L219 L225 M229 E237 L238 T252 R254 E258 Q259 A260 V294	L219-I256 HydrophobicContact CD1-CD1 3.8Å; L219-I256 HydrophobicContact CD1-CG2 4.35Å; L225-I256 HydrophobicContact CD1-CG2 3.6Å; L225-I256 HydrophobicContact CD2-CG2 4.13Å; M229-I256 HydrophobicContact SD-CG2 4.3Å; E237-I256 HydrophobicContact CB-CD1 4.22Å; E237-I256 HydrophobicContact CB-CG1 3.44Å; E237-I256 VanDerWaalsContact CB-CG1 3.44Å; E237-I256 HydrophobicContact CG-CG1 4.01Å; L238-I256 HydrophobicContact CD2-CD1 3.77Å; L238-I256 HydrophobicContact CG-CD1 4.29Å; T252-I256 HydrophobicContact CG2-CD1 4.24Å; T252-I256 WeakPolarHBondContact O-CG1 3.37Å; T252-I256 PolarHBondContact O-N 3.19Å; R254-I256 VanDerWaalsContact C-N 3.29Å; R254-I256 PolarHBondContact O-N 2.88Å; I256-E258 VanDerWaalsContact C-N 3.33Å; I256-E258 PolarHBondContact O-N 2.97Å; I256-Q259 PolarHBondContact O-N 3.34Å; I256-A260 WeakPolarHBondContact O-CB 3.4Å; I256-A260 PolarHBondContact O-N 3.08Å; I256-V294 HydrophobicContact CG2-CG1 4.39Å; I256-V294 HydrophobicContact CG2-CG2 4.32Å
257	A	97.5	Very high	96.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-37.2	-177.9	0	0	0	0	0	112.2	C41 F43 A253 R254 H261 I292 V294	C41-A257 HydrophobicContact CB-CB 4.26Å; F43-A257 HydrophobicContact CD2-CB 3.84Å; F43-A257 VanDerWaalsContact CE2-C 3.46Å; F43-A257 HydrophobicContact CE2-CB 3.46Å; F43-A257 VanDerWaalsContact CE2-CB 3.46Å; A253-A257 WeakPolarHBondContact O-CB 3.29Å; A253-A257 PolarHBondContact O-N 3.12Å; A253-A257 VanDerWaalsContact O-N 3.08Å; R254-A257 PolarHBondContact O-N 2.85Å; A257-H261 WeakPolarHBondContact O-CB 3.47Å; A257-H261 PolarHBondContact O-N 3.46Å; A257-I292 HydrophobicContact CB-CG2 4.15Å; A257-V294 HydrophobicContact CB-CB 4.49Å; A257-V294 HydrophobicContact CB-CG2 3.98Å
258	E	96.8	Very high	97	Very high	83 Å²	83	46.1 Å²	46.1	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-65.9	-45	176.8	-75.8	174.3	169.6	0	0	110.8	F43 R254 I256 H261 E262	F43-E258 HydrophobicContact CE2-CG 3.87Å; F43-E258 HydrophobicContact CZ-CG 3.56Å; R254-E258 WeakPolarHBondContact CD-OE1 3.18Å; R254-E258 HydrophobicContact CG-CG 4.05Å; R254-E258 VanDerWaalsContact CG-OE1 3.29Å; R254-E258 WeakPolarHBondContact CG-OE1 3.41Å; R254-E258 WeakPolarHBondContact O-CB 3.26Å; R254-E258 WeakPolarHBondContact O-CG 3.37Å; R254-E258 PolarHBondContact O-N 3.27Å; I256-E258 VanDerWaalsContact C-N 3.33Å; I256-E258 PolarHBondContact O-N 2.97Å; E258-H261 WeakPolarHBondContact O-CB 3.44Å; E258-H261 PolarHBondContact O-N 2.91Å; E258-E262 WeakPolarHBondContact O-CG 3.34Å; E258-E262 PolarHBondContact O-N 3.13Å
259	Q	98	Very high	97.1	Very high	49 Å²	49	46.7 Å²	46.7	23%	0.229	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-41.4	177.7	-172	174.6	30.8	0	0	112	M229 E237 S255 I256 H261 E262 L263	M229-Q259 HydrophobicContact CE-CB 4.32Å; M229-Q259 HydrophobicContact CE-CG 4.15Å; M229-Q259 HydrophobicContact SD-CB 4.09Å; M229-Q259 HydrophobicContact SD-CG 4.24Å; E237-Q259 PolarHBondContact OE1-OE1 3.19Å; S255-Q259 WeakPolarHBondContact O-CB 3.1Å; S255-Q259 PolarHBondContact O-N 2.95Å; I256-Q259 PolarHBondContact O-N 3.34Å; Q259-H261 VanDerWaalsContact C-N 3.31Å; Q259-H261 PolarHBondContact O-N 3Å; Q259-E262 PolarHBondContact O-N 3.41Å; Q259-L263 HydrophobicContact CG-CD1 4.15Å; Q259-L263 WeakPolarHBondContact O-CG 3.33Å; Q259-L263 PolarHBondContact O-N 2.82Å
260	A	98.1	Very high	97.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-44.6	174.1	0	0	0	0	0	111.2	L225 M229 I256 L263 A264 I292	L225-A260 HydrophobicContact CD1-CB 3.57Å; M229-A260 HydrophobicContact CG-CB 3.92Å; M229-A260 HydrophobicContact SD-CB 3.65Å; M229-A260 PolarHBondContact SD-N 3.42Å; M229-A260 VanDerWaalsContact SD-N 3.43Å; I256-A260 WeakPolarHBondContact O-CB 3.4Å; I256-A260 PolarHBondContact O-N 3.08Å; A260-L263 PolarHBondContact O-N 2.83Å; A260-A264 WeakPolarHBondContact O-CB 3.41Å; A260-A264 PolarHBondContact O-N 3.33Å; A260-I292 HydrophobicContact CB-CD1 3.95Å; A260-I292 HydrophobicContact CB-CG2 4.42Å
261	H	96.4	Very high	97.3	Very high	37 Å²	37	48.6 Å²	48.6	17%	0.171	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-45.7	176.8	-172.8	77	0	0	0	111.6	F43 A257 E258 Q259 L263 A264 Y265 I292	F43-H261 HydrophobicContact CD2-CB 4.34Å; A257-H261 WeakPolarHBondContact O-CB 3.47Å; A257-H261 PolarHBondContact O-N 3.46Å; E258-H261 WeakPolarHBondContact O-CB 3.44Å; E258-H261 PolarHBondContact O-N 2.91Å; Q259-H261 VanDerWaalsContact C-N 3.31Å; Q259-H261 PolarHBondContact O-N 3Å; H261-L263 VanDerWaalsContact C-N 3.35Å; H261-L263 PolarHBondContact O-N 3.03Å; H261-A264 WeakPolarHBondContact O-CB 3.38Å; H261-A264 PolarHBondContact O-N 3.24Å; H261-Y265 AromaticContact CE1-CE2 3.36Å; H261-Y265 WeakPolarHBondContact CE1-CE2 3.41Å; H261-Y265 AromaticContact ND1-CE2 3.74Å; H261-Y265 AromaticContact NE2-CE2 3.87Å; H261-Y265 VanDerWaalsContact O-CD2 3.29Å; H261-Y265 WeakPolarHBondContact O-CD2 3.48Å; H261-I292 HydrophobicContact CB-CD1 3.84Å
262	E	96.8	Very high	97.4	Very high	147 Å²	147	45.9 Å²	45.9	69%	0.687	23%	0.227	S	C	*	.	H	α-helix	trans	-59.1	-45.5	176.7	-73.7	179.4	177.2	0	0	112.1	E258 Q259 A264 Y265 D266	E258-E262 WeakPolarHBondContact O-CG 3.34Å; E258-E262 PolarHBondContact O-N 3.13Å; Q259-E262 PolarHBondContact O-N 3.41Å; E262-A264 VanDerWaalsContact C-N 3.32Å; E262-A264 PolarHBondContact O-N 2.61Å; E262-Y265 PolarHBondContact O-N 2.73Å; E262-D266 PolarHBondContact O-N 2.91Å
263	L	98.1	Very high	97.4	Very high	27 Å²	27	47 Å²	47	14%	0.141	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-34	178.3	-70.1	169.5	0	0	0	112.4	N228 M229 M233 Q259 A260 H261 Y265 D266 Y269 G287	N228-L263 HydrophobicContact CB-CB 4.49Å; M229-L263 HydrophobicContact CG-CD1 3.87Å; M233-L263 HydrophobicContact SD-CD1 3.76Å; Q259-L263 HydrophobicContact CG-CD1 4.15Å; Q259-L263 WeakPolarHBondContact O-CG 3.33Å; Q259-L263 PolarHBondContact O-N 2.82Å; A260-L263 PolarHBondContact O-N 2.83Å; H261-L263 VanDerWaalsContact C-N 3.35Å; H261-L263 PolarHBondContact O-N 3.03Å; L263-Y265 PolarHBondContact O-N 3.27Å; L263-D266 PolarHBondContact O-N 3.43Å; L263-D266 VanDerWaalsContact O-N 3.15Å; L263-Y269 HydrophobicContact CB-CD1 3.94Å; L263-Y269 HydrophobicContact CB-CE1 3.83Å; L263-Y269 HydrophobicContact CD1-CE1 4.27Å; L263-Y269 HydrophobicContact CD2-CD1 4Å; L263-Y269 HydrophobicContact CD2-CD2 4.11Å; L263-Y269 HydrophobicContact CD2-CE1 4.03Å; L263-Y269 HydrophobicContact CD2-CE2 4.18Å; L263-Y269 HydrophobicContact CD2-CG 4.03Å; L263-Y269 HydrophobicContact CG-CD1 4.49Å; L263-Y269 HydrophobicContact CG-CE1 4.26Å; L263-G287 WeakPolarHBondContact O-CA 3.49Å
264	A	97.4	Very high	97.4	Very high	1 Å²	1	47 Å²	47	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-58.5	-29.3	178	0	0	0	0	0	113.2	N228 A260 H261 E262 G287 K288 P289	N228-A264 WeakPolarHBondContact OD1-CA 3.05Å; A260-A264 WeakPolarHBondContact O-CB 3.41Å; A260-A264 PolarHBondContact O-N 3.33Å; H261-A264 WeakPolarHBondContact O-CB 3.38Å; H261-A264 PolarHBondContact O-N 3.24Å; E262-A264 VanDerWaalsContact C-N 3.32Å; E262-A264 PolarHBondContact O-N 2.61Å; A264-G287 CarbonylContact O-C 3.25Å; A264-G287 VanDerWaalsContact O-C 3.25Å; A264-G287 WeakPolarHBondContact O-CA 3.46Å; A264-K288 WeakPolarHBondContact CB-O 3.1Å; A264-P289 VanDerWaalsContact O-CD 3.26Å; A264-P289 WeakPolarHBondContact O-CD 3.43Å; A264-P289 WeakPolarHBondContact O-CG 3.11Å
265	Y	96.4	Very high	97.4	Very high	104 Å²	104	47 Å²	47	41%	0.408	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	3.9	179.5	-67.1	-97.4	0	0	0	113.9	K45 H261 E262 L263 P267 P289	K45-Y265 PolarHBondContact O-OH 3.42Å; H261-Y265 AromaticContact CE1-CE2 3.36Å; H261-Y265 WeakPolarHBondContact CE1-CE2 3.41Å; H261-Y265 AromaticContact ND1-CE2 3.74Å; H261-Y265 AromaticContact NE2-CE2 3.87Å; H261-Y265 VanDerWaalsContact O-CD2 3.29Å; H261-Y265 WeakPolarHBondContact O-CD2 3.48Å; E262-Y265 PolarHBondContact O-N 2.73Å; L263-Y265 PolarHBondContact O-N 3.27Å; Y265-P267 VanDerWaalsContact O-CD 3.23Å; Y265-P267 WeakPolarHBondContact O-CD 3.33Å; Y265-P289 HydrophobicContact CD1-CB 4.43Å; Y265-P289 HydrophobicContact CD1-CG 4.23Å; Y265-P289 HydrophobicContact CE1-CB 3.89Å; Y265-P289 HydrophobicContact CE1-CG 4.16Å; Y265-P289 HydrophobicContact CE2-CB 4.24Å
266	D	97.3	Very high	97.4	Very high	61 Å²	61	49.8 Å²	49.8	33%	0.326	24%	0.244	S	C	.	.			trans	-80.2	111.4	173.9	-176.3	-7.8	0	0	0	110.2	E262 L263 N268 Y269 G286 G287	E262-D266 PolarHBondContact O-N 2.91Å; L263-D266 PolarHBondContact O-N 3.43Å; L263-D266 VanDerWaalsContact O-N 3.15Å; D266-N268 PolarHBondContact O-N 3.19Å; D266-N268 WeakPolarHBondContact OD1-CA 3.44Å; D266-N268 WeakPolarHBondContact OD1-CB 3.4Å; D266-N268 PolarHBondContact OD1-N 3.04Å; D266-Y269 PolarHBondContact O-N 3.03Å; D266-Y269 PolarHBondContact OD1-N 3.03Å; D266-G286 CarbonylContact O-C 3.49Å; D266-G286 WeakPolarHBondContact O-CA 3.46Å; D266-G287 PolarHBondContact O-N 3.29Å
267	P	96.9	Very high	97.3	Very high	89 Å²	89	49.8 Å²	49.8	58%	0.578	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-13.7	-179.3	32.2	-37.3	0	0	0	113.4	Y265	Y265-P267 VanDerWaalsContact O-CD 3.23Å; Y265-P267 WeakPolarHBondContact O-CD 3.33Å
268	N	96.3	Very high	97.2	Very high	101 Å²	101	51.9 Å²	51.9	54%	0.54	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-11	-178.2	-64	-61.3	0	0	0	112.8	D266 R285	D266-N268 PolarHBondContact O-N 3.19Å; D266-N268 WeakPolarHBondContact OD1-CA 3.44Å; D266-N268 WeakPolarHBondContact OD1-CB 3.4Å; D266-N268 PolarHBondContact OD1-N 3.04Å; N268-R285 VanDerWaalsContact O-CZ 3.24Å; N268-R285 PolarHBondContact O-NE 3.35Å; N268-R285 PolarHBondContact O-NH2 3.07Å
269	Y	97.3	Very high	97.1	Very high	29 Å²	29	53.4 Å²	53.4	11%	0.114	27%	0.27	C	S	.	.			trans	-69.7	144.1	178.2	176	-130.6	0	0	0	111.2	N228 P230 M233 L263 D266 G286	N228-Y269 WeakPolarHBondContact O-CE1 3.35Å; N228-Y269 PolarHBondContact O-OH 3.4Å; P230-Y269 VanDerWaalsContact CD-OH 3.3Å; P230-Y269 WeakPolarHBondContact CD-OH 3.06Å; M233-Y269 HydrophobicContact CE-CE2 4.07Å; L263-Y269 HydrophobicContact CB-CD1 3.94Å; L263-Y269 HydrophobicContact CB-CE1 3.83Å; L263-Y269 HydrophobicContact CD1-CE1 4.27Å; L263-Y269 HydrophobicContact CD2-CD1 4Å; L263-Y269 HydrophobicContact CD2-CD2 4.11Å; L263-Y269 HydrophobicContact CD2-CE1 4.03Å; L263-Y269 HydrophobicContact CD2-CE2 4.18Å; L263-Y269 HydrophobicContact CD2-CG 4.03Å; L263-Y269 HydrophobicContact CG-CD1 4.49Å; L263-Y269 HydrophobicContact CG-CE1 4.26Å; D266-Y269 PolarHBondContact O-N 3.03Å; D266-Y269 PolarHBondContact OD1-N 3.03Å; Y269-G286 CarbonylContact O-C 3.39Å; Y269-G286 WeakPolarHBondContact O-CA 3.21Å; Y269-G286 PolarHBondContact O-N 3Å
270	M	97.4	Very high	97	Very high	72 Å²	72	55 Å²	55	36%	0.355	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-101.1	83.1	172.5	-160.4	69.3	-92.8	0	0	107.9	A274 V284 R285	M270-A274 HydrophobicContact CE-CB 3.05Å; M270-V284 WeakPolarHBondContact CE-O 3.46Å; M270-R285 HydrophobicContact SD-CG 4.37Å
271	S	98.2	Very high	96.8	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.314	C	S	.	.			trans	-70.3	159.6	-175.7	76.2	0	0	0	0	112.2	D227 F273 A274 Q275 G286	D227-S271 VanDerWaalsContact O-CB 3.26Å; D227-S271 WeakPolarHBondContact O-CB 3.43Å; D227-S271 PolarHBondContact O-OG 3.29Å; S271-F273 PolarHBondContact O-N 3.1Å; S271-F273 PolarHBondContact OG-N 2.91Å; S271-A274 PolarHBondContact O-N 3.31Å; S271-A274 VanDerWaalsContact O-N 3.12Å; S271-A274 WeakPolarHBondContact OG-CB 3.48Å; S271-A274 PolarHBondContact OG-N 3.24Å; S271-Q275 WeakPolarHBondContact O-CB 3.29Å; S271-Q275 PolarHBondContact O-N 3.02Å; S271-G286 PolarHBondContact OG-O 3.26Å; S271-G286 VanDerWaalsContact OG-O 3.12Å
272	P	98.1	Very high	96.8	Very high	40 Å²	40	60.5 Å²	60.5	26%	0.26	33%	0.327	S	S	.	.	H	α-helix	trans	-47.3	-46.9	168.5	-29.4	34.8	0	0	0	112.8	F226 D227 P230 A274 Q275 F276	F226-P272 WeakPolarHBondContact O-CB 2.87Å; F226-P272 WeakPolarHBondContact O-CG 3.33Å; D227-P272 VanDerWaalsContact O-CD 3.29Å; D227-P272 WeakPolarHBondContact O-CD 3.34Å; P230-P272 HydrophobicContact CB-CG 4.17Å; P272-A274 PolarHBondContact O-N 3.18Å; P272-Q275 PolarHBondContact O-N 2.68Å; P272-F276 WeakPolarHBondContact O-CB 3.42Å; P272-F276 PolarHBondContact O-N 2.95Å
273	F	98	Very high	96.6	Very high	30 Å²	30	61.5 Å²	61.5	13%	0.132	34%	0.337	C	S	.	.	H	α-helix	trans	-56.9	-51.8	175.5	173	-97.5	0	0	0	112.4	F180 N181 D227 S271 Q275 F276 A277 V284 K288	F180-F273 HydrophobicContact CE1-CE2 4.15Å; F180-F273 HydrophobicContact CE1-CZ 4.09Å; F180-F273 HydrophobicContact CE2-CE2 4.25Å; F180-F273 HydrophobicContact CZ-CD2 4.13Å; F180-F273 HydrophobicContact CZ-CE1 4.42Å; F180-F273 AromaticContact CZ-CE2 3.49Å; F180-F273 HydrophobicContact CZ-CE2 3.49Å; F180-F273 VanDerWaalsContact CZ-CE2 3.49Å; F180-F273 AromaticContact CZ-CZ 3.67Å; F180-F273 HydrophobicContact CZ-CZ 3.67Å; N181-F273 HydrophobicContact CB-CE2 4.02Å; N181-F273 WeakPolarHBondContact OD1-CE2 3.49Å; D227-F273 HydrophobicContact CB-CB 3.76Å; D227-F273 WeakPolarHBondContact O-CB 3.29Å; D227-F273 PolarHBondContact O-N 3.19Å; S271-F273 PolarHBondContact O-N 3.1Å; S271-F273 PolarHBondContact OG-N 2.91Å; F273-Q275 VanDerWaalsContact C-N 3.31Å; F273-Q275 PolarHBondContact O-N 3.27Å; F273-F276 PolarHBondContact O-N 2.84Å; F273-A277 WeakPolarHBondContact O-CB 3.4Å; F273-A277 PolarHBondContact O-N 2.82Å; F273-V284 HydrophobicContact CE1-CG1 4.5Å; F273-K288 HydrophobicContact CB-CB 4.16Å; F273-K288 HydrophobicContact CB-CD 4.46Å; F273-K288 HydrophobicContact CD1-CB 3.94Å; F273-K288 HydrophobicContact CD1-CD 4.43Å; F273-K288 HydrophobicContact CD1-CG 4.23Å; F273-K288 HydrophobicContact CD2-CD 3.73Å; F273-K288 HydrophobicContact CD2-CG 4.39Å; F273-K288 HydrophobicContact CE1-CG 4.42Å; F273-K288 HydrophobicContact CE2-CD 4.03Å; F273-K288 HydrophobicContact CG-CB 3.98Å; F273-K288 HydrophobicContact CG-CD 3.95Å; F273-K288 HydrophobicContact CG-CG 4.21Å
274	A	97.8	Very high	96.4	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71.8	-29.7	-174.1	0	0	0	0	0	111.6	M270 S271 P272 A277 C278 V284 G286	M270-A274 HydrophobicContact CE-CB 3.05Å; S271-A274 PolarHBondContact O-N 3.31Å; S271-A274 VanDerWaalsContact O-N 3.12Å; S271-A274 WeakPolarHBondContact OG-CB 3.48Å; S271-A274 PolarHBondContact OG-N 3.24Å; P272-A274 PolarHBondContact O-N 3.18Å; A274-A277 WeakPolarHBondContact O-CB 3.27Å; A274-A277 PolarHBondContact O-N 3.44Å; A274-C278 PolarHBondContact O-N 3.4Å; A274-C278 PolarHBondContact O-SG 3.45Å; A274-V284 HydrophobicContact CB-CG1 4.19Å; A274-G286 WeakPolarHBondContact CB-O 3.45Å
275	Q	97.3	Very high	96.3	Very high	92 Å²	92	70.2 Å²	70.2	43%	0.43	37%	0.373	S	S	.	.	H	α-helix	trans	-63.4	-47.7	168.7	-175.6	63.3	63.8	0	0	110.8	S271 P272 F273 A277 C278 D279	S271-Q275 WeakPolarHBondContact O-CB 3.29Å; S271-Q275 PolarHBondContact O-N 3.02Å; P272-Q275 PolarHBondContact O-N 2.68Å; F273-Q275 VanDerWaalsContact C-N 3.31Å; F273-Q275 PolarHBondContact O-N 3.27Å; Q275-A277 VanDerWaalsContact C-N 3.3Å; Q275-A277 PolarHBondContact O-N 2.77Å; Q275-C278 WeakPolarHBondContact O-CB 3.46Å; Q275-C278 PolarHBondContact O-N 2.91Å; Q275-C278 VanDerWaalsContact O-N 3.13Å; Q275-D279 PolarHBondContact NE2-OD1 3.46Å; Q275-D279 VanDerWaalsContact O-CG 3.3Å; Q275-D279 PolarHBondContact O-N 3.2Å
276	F	95.7	Very high	96.4	Very high	83 Å²	83	65.4 Å²	65.4	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-65.3	-34.5	177.7	-170.5	-136.8	0	0	0	112.3	F180 P272 F273 C278 D279 N280	F180-F276 AromaticContact CD2-CD1 3.48Å; F180-F276 HydrophobicContact CD2-CD1 3.48Å; F180-F276 VanDerWaalsContact CD2-CD1 3.48Å; F180-F276 AromaticContact CD2-CE1 3.67Å; F180-F276 HydrophobicContact CD2-CE1 3.67Å; F180-F276 HydrophobicContact CD2-CG 4.16Å; F180-F276 HydrophobicContact CD2-CZ 4.47Å; F180-F276 HydrophobicContact CE2-CB 4.21Å; F180-F276 AromaticContact CE2-CD1 3.52Å; F180-F276 HydrophobicContact CE2-CD1 3.52Å; F180-F276 HydrophobicContact CE2-CE1 4.18Å; F180-F276 HydrophobicContact CE2-CG 4.05Å; P272-F276 WeakPolarHBondContact O-CB 3.42Å; P272-F276 PolarHBondContact O-N 2.95Å; F273-F276 PolarHBondContact O-N 2.84Å; F276-C278 VanDerWaalsContact C-N 3.34Å; F276-C278 PolarHBondContact O-N 3.27Å; F276-D279 PolarHBondContact O-N 3.34Å; F276-N280 WeakPolarHBondContact CD2-ND2 3.04Å; F276-N280 VanDerWaalsContact CE2-ND2 3.26Å; F276-N280 WeakPolarHBondContact CE2-ND2 3.35Å; F276-N280 PolarHBondContact O-N 3.25Å; F276-N280 PolarHBondContact O-ND2 3.43Å
277	A	96.4	Very high	96.4	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.349	C	S	.	.	H	α-helix	trans	-59.8	-44.8	171.5	0	0	0	0	0	111.3	F180 F273 A274 Q275 N280 G281 L282 V284	F180-A277 HydrophobicContact CE1-CB 4.11Å; F180-A277 HydrophobicContact CE2-CB 4.01Å; F180-A277 HydrophobicContact CZ-CB 3.46Å; F180-A277 VanDerWaalsContact CZ-CB 3.46Å; F273-A277 WeakPolarHBondContact O-CB 3.4Å; F273-A277 PolarHBondContact O-N 2.82Å; A274-A277 WeakPolarHBondContact O-CB 3.27Å; A274-A277 PolarHBondContact O-N 3.44Å; Q275-A277 VanDerWaalsContact C-N 3.3Å; Q275-A277 PolarHBondContact O-N 2.77Å; A277-N280 CarbonylContact O-C 3.52Å; A277-N280 PolarHBondContact O-N 2.89Å; A277-G281 PolarHBondContact O-N 3.38Å; A277-L282 CarbonylContact C-O 3.56Å; A277-L282 HydrophobicContact CB-CB 4.16Å; A277-L282 HydrophobicContact CB-CD1 4.38Å; A277-L282 WeakPolarHBondContact O-CB 3.37Å; A277-L282 PolarHBondContact O-N 2.88Å; A277-V284 HydrophobicContact CB-CB 4.08Å; A277-V284 HydrophobicContact CB-CG2 4.27Å
278	C	96.6	Very high	96.4	Very high	45 Å²	45	60.3 Å²	60.3	30%	0.304	33%	0.326	S	S	.	.	H	α-helix	trans	-63.1	-41.9	176.6	-68.8	0	0	0	0	112.3	A274 Q275 F276 N280 G281 L282 V284	A274-C278 PolarHBondContact O-N 3.4Å; A274-C278 PolarHBondContact O-SG 3.45Å; Q275-C278 WeakPolarHBondContact O-CB 3.46Å; Q275-C278 PolarHBondContact O-N 2.91Å; Q275-C278 VanDerWaalsContact O-N 3.13Å; F276-C278 VanDerWaalsContact C-N 3.34Å; F276-C278 PolarHBondContact O-N 3.27Å; C278-N280 PolarHBondContact O-N 3.15Å; C278-G281 PolarHBondContact O-N 2.77Å; C278-L282 WeakPolarHBondContact CA-O 3.15Å; C278-L282 PolarHBondContact N-O 3.06Å; C278-L282 PolarHBondContact SG-O 2.69Å; C278-V284 PolarHBondContact SG-O 3.21Å
279	D	95.3	Very high	96.4	Very high	115 Å²	115	57.8 Å²	57.8	62%	0.615	32%	0.315	S	S	*	.	H	α-helix	trans	-64.9	-25.7	177	-63	-16.9	0	0	0	111.9	Q275 F276	Q275-D279 PolarHBondContact NE2-OD1 3.46Å; Q275-D279 VanDerWaalsContact O-CG 3.3Å; Q275-D279 PolarHBondContact O-N 3.2Å; F276-D279 PolarHBondContact O-N 3.34Å
280	N	94.4	Very high	96.3	Very high	81 Å²	81	57.6 Å²	57.6	43%	0.433	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	11.8	172.2	-74.7	-85.4	0	0	0	113.9	F180 F276 A277 C278	F180-N280 HydrophobicContact CB-CB 4.3Å; F180-N280 HydrophobicContact CD2-CB 4.3Å; F180-N280 HydrophobicContact CG-CB 4.26Å; F276-N280 WeakPolarHBondContact CD2-ND2 3.04Å; F276-N280 VanDerWaalsContact CE2-ND2 3.26Å; F276-N280 WeakPolarHBondContact CE2-ND2 3.35Å; F276-N280 PolarHBondContact O-N 3.25Å; F276-N280 PolarHBondContact O-ND2 3.43Å; A277-N280 CarbonylContact O-C 3.52Å; A277-N280 PolarHBondContact O-N 2.89Å; C278-N280 PolarHBondContact O-N 3.15Å
281	G	95.5	Very high	96.2	Very high	71 Å²	71	54.6 Å²	54.6	73%	0.732	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	9.6	173	0	0	0	0	0	115.6	A277 C278	A277-G281 PolarHBondContact O-N 3.38Å; C278-G281 PolarHBondContact O-N 2.77Å
282	L	94.6	Very high	96.2	Very high	83 Å²	83	54.6 Å²	54.6	44%	0.435	30%	0.302	S	S	.	.			trans	-94.7	128.1	175	-56.2	175.6	0	0	0	110.5	F180 A277 C278 V284	F180-L282 HydrophobicContact CD1-CD1 3.75Å; F180-L282 HydrophobicContact CE1-CD1 3.55Å; F180-L282 HydrophobicContact CZ-CD1 4.44Å; A277-L282 CarbonylContact C-O 3.56Å; A277-L282 HydrophobicContact CB-CB 4.16Å; A277-L282 HydrophobicContact CB-CD1 4.38Å; A277-L282 WeakPolarHBondContact O-CB 3.37Å; A277-L282 PolarHBondContact O-N 2.88Å; C278-L282 WeakPolarHBondContact CA-O 3.15Å; C278-L282 PolarHBondContact N-O 3.06Å; C278-L282 PolarHBondContact SG-O 2.69Å; L282-V284 HydrophobicContact CB-CG2 4.02Å; L282-V284 PolarHBondContact O-N 3.35Å; L282-V284 VanDerWaalsContact O-N 3.07Å
283	N	93.9	Very high	96.2	Very high	167 Å²	167	52.7 Å²	52.7	89%	0.893	29%	0.289	S	S	*	.			trans	-86.1	80.4	176.3	-170.7	14.3	0	0	0	110.7
284	V	93.5	Very high	96.2	Very high	54 Å²	54	51.2 Å²	51.2	33%	0.327	28%	0.283	S	S	.	.			trans	-115.9	143.7	-178.3	179.7	0	0	0	0	109.9	M270 F273 A274 A277 C278 L282	M270-V284 WeakPolarHBondContact CE-O 3.46Å; F273-V284 HydrophobicContact CE1-CG1 4.5Å; A274-V284 HydrophobicContact CB-CG1 4.19Å; A277-V284 HydrophobicContact CB-CB 4.08Å; A277-V284 HydrophobicContact CB-CG2 4.27Å; C278-V284 PolarHBondContact SG-O 3.21Å; L282-V284 HydrophobicContact CB-CG2 4.02Å; L282-V284 PolarHBondContact O-N 3.35Å; L282-V284 VanDerWaalsContact O-N 3.07Å
285	R	95.8	Very high	96.2	Very high	158 Å²	158	51.4 Å²	51.4	60%	0.596	28%	0.284	S	S	*	.			trans	-140.7	153.1	172.4	-174.1	178.5	177.9	-167.5	-1.8	109.3	N268 M270	N268-R285 VanDerWaalsContact O-CZ 3.24Å; N268-R285 PolarHBondContact O-NE 3.35Å; N268-R285 PolarHBondContact O-NH2 3.07Å; M270-R285 HydrophobicContact SD-CG 4.37Å
286	G	97.4	Very high	96.3	Very high	3 Å²	3	47 Å²	47	3%	0.031	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	110.8	172.8	-178.4	0	0	0	0	0	111.6	D266 Y269 S271 A274	D266-G286 CarbonylContact O-C 3.49Å; D266-G286 WeakPolarHBondContact O-CA 3.46Å; Y269-G286 CarbonylContact O-C 3.39Å; Y269-G286 WeakPolarHBondContact O-CA 3.21Å; Y269-G286 PolarHBondContact O-N 3Å; S271-G286 PolarHBondContact OG-O 3.26Å; S271-G286 VanDerWaalsContact OG-O 3.12Å; A274-G286 WeakPolarHBondContact CB-O 3.45Å
287	G	97.6	Very high	96.4	Very high	18 Å²	18	43.1 Å²	43.1	19%	0.186	25%	0.246	C	C	.	.			trans	-67.8	170.8	164	0	0	0	0	0	113.1	N228 L263 A264 D266 P289	N228-G287 WeakPolarHBondContact OD1-CA 3.07Å; L263-G287 WeakPolarHBondContact O-CA 3.49Å; A264-G287 CarbonylContact O-C 3.25Å; A264-G287 VanDerWaalsContact O-C 3.25Å; A264-G287 WeakPolarHBondContact O-CA 3.46Å; D266-G287 PolarHBondContact O-N 3.29Å; G287-P289 WeakPolarHBondContact O-CD 3.26Å
288	K	96.7	Very high	96.5	Very high	25 Å²	25	43.4 Å²	43.4	11%	0.109	25%	0.248	C	C	.	.			trans	-107.5	101.2	172	-173.9	-161.6	-176.6	-165.1	0	108.3	N181 D223 D227 N228 A264 F273 D290	N181-K288 PolarHBondContact OD1-NZ 3.19Å; D223-K288 IonicContact OD2-NZ 2.97Å; D223-K288 PolarHBondContact OD2-NZ 3.02Å; D227-K288 HydrophobicContact CB-CB 4.35Å; D227-K288 HydrophobicContact CB-CD 3.89Å; D227-K288 WeakPolarHBondContact OD2-CD 3.31Å; D227-K288 WeakPolarHBondContact OD2-CE 3.29Å; D227-K288 IonicContact OD2-NZ 2.63Å; D227-K288 PolarHBondContact OD2-NZ 3.22Å; N228-K288 PolarHBondContact ND2-O 3.48Å; N228-K288 PolarHBondContact OD1-N 3.37Å; A264-K288 WeakPolarHBondContact CB-O 3.1Å; F273-K288 HydrophobicContact CB-CB 4.16Å; F273-K288 HydrophobicContact CB-CD 4.46Å; F273-K288 HydrophobicContact CD1-CB 3.94Å; F273-K288 HydrophobicContact CD1-CD 4.43Å; F273-K288 HydrophobicContact CD1-CG 4.23Å; F273-K288 HydrophobicContact CD2-CD 3.73Å; F273-K288 HydrophobicContact CD2-CG 4.39Å; F273-K288 HydrophobicContact CE1-CG 4.42Å; F273-K288 HydrophobicContact CE2-CD 4.03Å; F273-K288 HydrophobicContact CG-CB 3.98Å; F273-K288 HydrophobicContact CG-CD 3.95Å; F273-K288 HydrophobicContact CG-CG 4.21Å; K288-D290 WeakPolarHBondContact CE-OD2 3.4Å; K288-D290 IonicContact NZ-OD2 3.45Å; K288-D290 PolarHBondContact NZ-OD2 3.29Å; K288-D290 PolarHBondContact O-N 3.13Å; K288-D290 VanDerWaalsContact O-N 3.12Å
289	P	95.9	Very high	96.5	Very high	47 Å²	47	41.4 Å²	41.4	31%	0.305	23%	0.234	S	C	.	.			trans	-59.9	114.1	173.2	-25.9	35.2	0	0	0	111.1	K45 A264 Y265 G287	K45-P289 WeakPolarHBondContact CE-O 3.15Å; K45-P289 HydrophobicContact CG-CB 4.49Å; K45-P289 PolarHBondContact NZ-O 3.11Å; A264-P289 VanDerWaalsContact O-CD 3.26Å; A264-P289 WeakPolarHBondContact O-CD 3.43Å; A264-P289 WeakPolarHBondContact O-CG 3.11Å; Y265-P289 HydrophobicContact CD1-CB 4.43Å; Y265-P289 HydrophobicContact CD1-CG 4.23Å; Y265-P289 HydrophobicContact CE1-CB 3.89Å; Y265-P289 HydrophobicContact CE1-CG 4.16Å; Y265-P289 HydrophobicContact CE2-CB 4.24Å; G287-P289 WeakPolarHBondContact O-CD 3.26Å
290	D	95.6	Very high	96.4	Very high	25 Å²	25	36.9 Å²	36.9	13%	0.134	21%	0.213	C	C	.	.			trans	-146.5	171.1	178.8	-121.4	-20	0	0	0	113.1	K288	K288-D290 WeakPolarHBondContact CE-OD2 3.4Å; K288-D290 IonicContact NZ-OD2 3.45Å; K288-D290 PolarHBondContact NZ-OD2 3.29Å; K288-D290 PolarHBondContact O-N 3.13Å; K288-D290 VanDerWaalsContact O-N 3.12Å
291	D	96.3	Very high	96.2	Very high	9 Å²	9	39.5 Å²	39.5	5%	0.048	22%	0.222	C	C	.	.			trans	-66.4	139.9	165.3	-65.4	-40	0	0	0	109.3	G44 K45 Y58 D60 D61 G224	G44-D291 WeakPolarHBondContact CA-OD1 3.36Å; K45-D291 WeakPolarHBondContact CB-OD1 3.29Å; K45-D291 PolarHBondContact N-OD1 3.09Å; Y58-D291 WeakPolarHBondContact O-CB 3.37Å; D60-D291 WeakPolarHBondContact CA-OD2 3.24Å; D60-D291 VanDerWaalsContact CB-OD2 3.29Å; D60-D291 WeakPolarHBondContact CB-OD2 3.21Å; D60-D291 PolarHBondContact N-OD2 2.63Å; D61-D291 HydrophobicContact CB-CB 4.3Å; G224-D291 WeakPolarHBondContact CA-O 3.16Å
292	I	97.4	Very high	95.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.3	-175.4	-63.2	169.4	0	0	0	108	G42 F43 D61 A257 A260 H261 V294	G42-I292 CarbonylContact C-O 3.57Å; G42-I292 WeakPolarHBondContact CA-O 3.43Å; F43-I292 PolarHBondContact N-O 3.42Å; F43-I292 PolarHBondContact O-N 2.97Å; D61-I292 PolarHBondContact OD2-N 3.45Å; A257-I292 HydrophobicContact CB-CG2 4.15Å; A260-I292 HydrophobicContact CB-CD1 3.95Å; A260-I292 HydrophobicContact CB-CG2 4.42Å; H261-I292 HydrophobicContact CB-CD1 3.84Å; I292-V294 HydrophobicContact CG2-CG2 4.17Å
293	T	98.1	Very high	94.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.9	173.3	-61.4	0	0	0	0	110.3	Y58 D61 C63 V76 A221 T222	Y58-T293 HydrophobicContact CD2-CG2 3.87Å; Y58-T293 WeakPolarHBondContact CD2-OG1 3.39Å; Y58-T293 HydrophobicContact CE2-CG2 4.07Å; D61-T293 WeakPolarHBondContact CB-OG1 3.41Å; D61-T293 VanDerWaalsContact OD2-CB 3.3Å; D61-T293 WeakPolarHBondContact OD2-CB 3.18Å; D61-T293 PolarHBondContact OD2-N 2.72Å; D61-T293 VanDerWaalsContact OD2-N 3.13Å; D61-T293 PolarHBondContact OD2-OG1 3.01Å; C63-T293 HydrophobicContact CB-CG2 3.78Å; V76-T293 HydrophobicContact CG1-CG2 4.15Å; A221-T293 WeakPolarHBondContact CA-O 3.31Å; A221-T293 WeakPolarHBondContact CB-O 3.43Å; T222-T293 PolarHBondContact N-O 2.95Å; T222-T293 VanDerWaalsContact N-O 3.16Å; T222-T293 PolarHBondContact OG1-N 2.65Å
294	V	98.4	Very high	93	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.9	-179.9	-177.4	0	0	0	0	109.4	G40 C41 L219 A221 L225 I256 A257 I292	G40-V294 CarbonylContact C-O 3.59Å; G40-V294 WeakPolarHBondContact CA-O 3.36Å; C41-V294 PolarHBondContact N-O 3.27Å; C41-V294 PolarHBondContact O-N 3.43Å; L219-V294 HydrophobicContact CD1-CG1 4.15Å; L219-V294 HydrophobicContact CG-CG1 4.31Å; A221-V294 HydrophobicContact CB-CG2 4.33Å; L225-V294 HydrophobicContact CB-CG2 4.47Å; L225-V294 HydrophobicContact CD2-CG2 4.04Å; I256-V294 HydrophobicContact CG2-CG1 4.39Å; I256-V294 HydrophobicContact CG2-CG2 4.32Å; A257-V294 HydrophobicContact CB-CB 4.49Å; A257-V294 HydrophobicContact CB-CG2 3.98Å; I292-V294 HydrophobicContact CG2-CG2 4.17Å
295	L	98.6	Very high	93	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.5	164.7	-62	-176.7	0	0	0	108.6	C63 V65 L74 V76 L219 T220	C63-L295 HydrophobicContact CB-CD1 4.1Å; C63-L295 HydrophobicContact CB-CD2 4.4Å; C63-L295 HydrophobicContact CB-CG 4.35Å; V65-L295 HydrophobicContact CG2-CD1 4.12Å; V65-L295 HydrophobicContact CG2-CD2 4.19Å; L74-L295 HydrophobicContact CB-CD1 3.95Å; L74-L295 HydrophobicContact CD1-CD1 4.06Å; V76-L295 HydrophobicContact CG1-CD1 3.97Å; V76-L295 HydrophobicContact CG1-CG 4.1Å; L219-L295 WeakPolarHBondContact CA-O 3.29Å; T220-L295 PolarHBondContact N-O 3.16Å; T220-L295 PolarHBondContact O-N 3.27Å
296	L	98.5	Very high	92.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.8	176.7	-172	64.9	0	0	0	109.1	T38 A39 I217 L219 L238 I249 T252 A253	T38-L296 WeakPolarHBondContact CA-O 3.5Å; A39-L296 PolarHBondContact N-O 2.62Å; A39-L296 PolarHBondContact O-N 2.59Å; I217-L296 HydrophobicContact CG2-CD1 3.47Å; I217-L296 VanDerWaalsContact CG2-CD1 3.47Å; I217-L296 HydrophobicContact CG2-CG 4.38Å; L219-L296 HydrophobicContact CB-CD1 4.17Å; L219-L296 HydrophobicContact CD1-CD1 4.48Å; L238-L296 HydrophobicContact CD2-CD1 3.62Å; L238-L296 HydrophobicContact CD2-CD2 4.06Å; I249-L296 HydrophobicContact CG2-CB 3.94Å; I249-L296 HydrophobicContact CG2-CD2 3.99Å; I249-L296 HydrophobicContact CG2-CG 3.92Å; I249-L296 WeakPolarHBondContact CG2-O 3.46Å; T252-L296 HydrophobicContact CG2-CD2 3.84Å; A253-L296 HydrophobicContact CB-CB 3.85Å; A253-L296 HydrophobicContact CB-CD2 4.4Å
297	S	97.9	Very high	92.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	148.4	-178.7	-51.7	0	0	0	0	111.3	V37 T38 L74 I217 I218	V37-S297 VanDerWaalsContact O-CA 3.3Å; V37-S297 WeakPolarHBondContact O-CA 3.27Å; T38-S297 WeakPolarHBondContact CB-OG 3.31Å; T38-S297 VanDerWaalsContact CG2-OG 3.25Å; T38-S297 WeakPolarHBondContact CG2-OG 3.45Å; T38-S297 WeakPolarHBondContact OG1-CB 3.39Å; T38-S297 PolarHBondContact OG1-OG 3.48Å; L74-S297 VanDerWaalsContact CD2-OG 3.24Å; L74-S297 WeakPolarHBondContact CD2-OG 3.47Å; I217-S297 CarbonylContact C-O 3.54Å; I217-S297 WeakPolarHBondContact CA-O 3.14Å; I218-S297 PolarHBondContact N-O 2.82Å; I218-S297 PolarHBondContact O-N 2.96Å
298	I	97.6	Very high	92.3	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.036	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.3	170.5	-61	176.3	0	0	0	108.8	L36 V37 D216 I217 L241 P244 I249 A300	L36-I298 WeakPolarHBondContact CA-O 3.46Å; V37-I298 PolarHBondContact N-O 3.23Å; V37-I298 PolarHBondContact O-N 2.85Å; D216-I298 WeakPolarHBondContact O-CA 3.36Å; I217-I298 HydrophobicContact CG1-CG1 4.32Å; L241-I298 HydrophobicContact CD1-CD1 4.07Å; L241-I298 HydrophobicContact CD2-CD1 3.37Å; L241-I298 HydrophobicContact CD2-CG1 4.35Å; L241-I298 HydrophobicContact CG-CD1 4.22Å; P244-I298 HydrophobicContact CB-CD1 4.11Å; P244-I298 HydrophobicContact CB-CG2 4.06Å; I249-I298 HydrophobicContact CD1-CB 4.31Å; I249-I298 HydrophobicContact CD1-CD1 3.67Å; I249-I298 HydrophobicContact CD1-CG1 3.99Å; I249-I298 HydrophobicContact CG1-CD1 3.55Å; I249-I298 HydrophobicContact CG1-CG1 4.15Å; I298-A300 PolarHBondContact O-N 3.34Å
299	V	96.8	Very high	92	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.012	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	117.1	171.5	-176.3	0	0	0	0	108.6	Y34 G35 L36 V212 Q213 L214 G215 D216 I218	Y34-V299 HydrophobicContact CD2-CG1 3.53Å; Y34-V299 HydrophobicContact CE2-CG1 4.15Å; Y34-V299 HydrophobicContact CG-CG1 4.06Å; G35-V299 WeakPolarHBondContact O-CA 3.27Å; L36-V299 HydrophobicContact CD2-CG2 3.93Å; V212-V299 HydrophobicContact CB-CG2 4.2Å; V212-V299 HydrophobicContact CG2-CG1 4.19Å; V212-V299 HydrophobicContact CG2-CG2 4.35Å; Q213-V299 WeakPolarHBondContact O-CB 3.31Å; Q213-V299 WeakPolarHBondContact O-CG1 3.38Å; L214-V299 HydrophobicContact CD2-CG1 4.49Å; G215-V299 PolarHBondContact N-O 2.67Å; D216-V299 HydrophobicContact CB-CB 4.3Å; D216-V299 HydrophobicContact CB-CG2 3.9Å; D216-V299 PolarHBondContact O-N 2.74Å; I218-V299 HydrophobicContact CD1-CG2 3.84Å
300	A	94.2	Very high	91.8	Very high	21 Å²	21	37 Å²	37	17%	0.174	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	167.1	-179.6	0	0	0	0	0	110.5	G35 V37 I298 Y302	G35-A300 PolarHBondContact N-O 3.23Å; G35-A300 PolarHBondContact O-N 2.63Å; V37-A300 HydrophobicContact CG2-CB 4.14Å; I298-A300 PolarHBondContact O-N 3.34Å; A300-Y302 PolarHBondContact O-N 2.71Å
301	E	91	Very high	91.5	Very high	135 Å²	135	37.9 Å²	37.9	63%	0.631	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-62.1	133.7	169.1	-67.9	-174.5	179.1	0	0	109.3	L214 T303	L214-E301 HydrophobicContact CD1-CG 3.92Å; L214-E301 HydrophobicContact CD2-CG 4Å; E301-T303 PolarHBondContact O-N 3.03Å
302	Y	82.4	Confident	91.1	Very high	56 Å²	56	40.1 Å²	40.1	22%	0.22	21%	0.213	C	C	.	.			trans	-75	124.2	177.5	-178.9	-110.1	0	0	0	110.3	D33 R146 A300 D304	D33-Y302 HydrophobicContact CB-CD1 4.33Å; D33-Y302 WeakPolarHBondContact O-CB 3.41Å; D33-Y302 PolarHBondContact O-N 3.11Å; R146-Y302 VanDerWaalsContact NH2-CE2 3.29Å; A300-Y302 PolarHBondContact O-N 2.71Å; Y302-D304 WeakPolarHBondContact CE1-OD1 3.23Å; Y302-D304 PolarHBondContact OH-OD1 3.25Å
303	T	74.4	Confident	90.6	Very high	111 Å²	111	43.4 Å²	43.4	68%	0.681	23%	0.23	S	C	*	.			trans	-115.7	126.2	168.7	60	0	0	0	0	108.2	E301	E301-T303 PolarHBondContact O-N 3.03Å
304	D	59.3	Low	89.9	Confident	185 Å²	185	47.4 Å²	47.4	99%	0.989	25%	0.251	S	S	*	.			trans	-52	0	179.3	-86.4	-36.7	0	0	0	113.5	R67 Y302	R67-D304 PolarHBondContact NH2-OXT 3.04Å; Y302-D304 WeakPolarHBondContact CE1-OD1 3.23Å; Y302-D304 PolarHBondContact OH-OD1 3.25Å

Retrieved 304 of 304 residues in 167.6 ms (Link to these results)

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