A0A5K4F8K6_SCHMA Loading...

Bardet-Biedl syndrome 7-like protein

AlphaFold DB , UniProt , Accession A0A5K4F8K6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 748 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.8	Very low	81.7	Confident	215 Å²	215	74.6 Å²	74.6	100%	1.059	39%	0.394	S	S	*	.				0	126.7	0	-73.6	175.9	-175.9	0	0	107.5	F3	M1-F3 PolarHBondContact O-N 3.48Å
2	S	61.2	Low	82.6	Confident	114 Å²	114	74.6 Å²	74.6	80%	0.797	41%	0.405	S	S	*	.			trans	-68.1	110.3	170.3	49.7	0	0	0	0	108	N4	S2-N4 PolarHBondContact O-N 3.33Å
3	F	77.2	Confident	83.4	Confident	43 Å²	43	70.5 Å²	70.5	19%	0.189	38%	0.382	C	S	.	.			trans	-62.4	126.1	169.7	-174.2	-92.3	0	0	0	107.7	M1 L5 M224 L225 L258 Y271 T309	M1-F3 PolarHBondContact O-N 3.48Å; F3-L5 HydrophobicContact CE1-CD1 4.12Å; F3-L5 HydrophobicContact CE1-CD2 3.79Å; F3-L5 HydrophobicContact CE1-CG 3.7Å; F3-L5 HydrophobicContact CZ-CD2 3.77Å; F3-L5 HydrophobicContact CZ-CG 4.22Å; F3-M224 HydrophobicContact CE2-CB 4.48Å; F3-M224 HydrophobicContact CZ-CB 4.06Å; F3-L225 HydrophobicContact CD2-CD2 3.75Å; F3-L225 HydrophobicContact CE2-CD2 3.78Å; F3-L258 HydrophobicContact CD1-CD1 4.13Å; F3-L258 HydrophobicContact CE1-CD1 3.36Å; F3-L258 HydrophobicContact CZ-CD1 3.99Å; F3-Y271 HydrophobicContact CD1-CD1 4.23Å; F3-Y271 AromaticContact CD1-CD2 3.91Å; F3-Y271 HydrophobicContact CD1-CD2 3.91Å; F3-Y271 HydrophobicContact CD1-CE2 4.44Å; F3-Y271 AromaticContact CD1-CG 3.78Å; F3-Y271 HydrophobicContact CD1-CG 3.78Å; F3-Y271 HydrophobicContact CE1-CD1 4.36Å; F3-Y271 HydrophobicContact CE1-CG 4.34Å; F3-Y271 WeakPolarHBondContact O-CD2 3.5Å; F3-Y271 WeakPolarHBondContact O-CE2 3.5Å; F3-T309 HydrophobicContact CE2-CG2 4.06Å; F3-T309 HydrophobicContact CZ-CG2 4Å
4	N	84.4	Confident	83.9	Confident	85 Å²	85	73.1 Å²	73.1	46%	0.455	39%	0.388	S	S	.	.			trans	-141.1	138.8	-179.3	-160.5	-10	0	0	0	108.9	S2 Y271	S2-N4 PolarHBondContact O-N 3.33Å; N4-Y271 PolarHBondContact OD1-OH 3.03Å
5	L	89.6	Confident	84.4	Confident	10 Å²	10	68.5 Å²	68.5	5%	0.052	36%	0.364	C	S	.	.			trans	-110.7	127.5	176.9	-64.8	176	0	0	0	109.6	F3 M224 L258 Y271 L295 L307 T308 T309	F3-L5 HydrophobicContact CE1-CD1 4.12Å; F3-L5 HydrophobicContact CE1-CD2 3.79Å; F3-L5 HydrophobicContact CE1-CG 3.7Å; F3-L5 HydrophobicContact CZ-CD2 3.77Å; F3-L5 HydrophobicContact CZ-CG 4.22Å; L5-M224 HydrophobicContact CD2-CE 3.85Å; L5-L258 HydrophobicContact CD1-CD1 4.36Å; L5-Y271 HydrophobicContact CB-CE1 4.44Å; L5-Y271 HydrophobicContact CD1-CD1 4.49Å; L5-Y271 HydrophobicContact CD1-CE1 4.02Å; L5-Y271 HydrophobicContact CG-CE1 4.18Å; L5-Y271 PolarHBondContact N-OH 3.38Å; L5-L295 HydrophobicContact CD1-CD1 3.87Å; L5-L295 HydrophobicContact CD1-CG 4.4Å; L5-L307 HydrophobicContact CB-CB 3.96Å; L5-L307 HydrophobicContact CD1-CB 4.11Å; L5-T308 WeakPolarHBondContact CA-O 3.32Å; L5-T309 HydrophobicContact CD2-CG2 3.58Å
6	H	89.6	Confident	84.9	Confident	45 Å²	45	64.4 Å²	64.4	21%	0.208	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.4	-177.7	-65	-56.9	0	0	0	111.2	L307 T308 Q310 I312	H6-L307 WeakPolarHBondContact O-CA 3.3Å; H6-T308 HydrophobicContact CB-CG2 4.29Å; H6-T308 PolarHBondContact N-O 3.09Å; H6-T308 WeakPolarHBondContact O-CG2 3.38Å; H6-T308 PolarHBondContact O-N 2.76Å; H6-Q310 PolarHBondContact CD2-O 2.86Å; H6-I312 HydrophobicContact CB-CD1 3.83Å; H6-I312 HydrophobicContact CB-CG1 3.82Å; H6-I312 VanDerWaalsContact CG-CD1 3.45Å; H6-I312 VanDerWaalsContact CG-CG1 3.42Å; H6-I312 WeakPolarHBondContact ND1-CD1 3.41Å
7	Q	91.6	Very high	85.2	Confident	83 Å²	83	62.1 Å²	62.1	39%	0.388	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	124.1	-178.6	-175.4	170.1	-37	0	0	111.6	H9 F305 G306 L307	Q7-H9 PolarHBondContact NE2-CE1 2.91Å; Q7-H9 PolarHBondContact NE2-NE2 3.47Å; Q7-F305 HydrophobicContact CG-CD2 3.84Å; Q7-F305 HydrophobicContact CG-CE2 4.35Å; Q7-G306 CarbonylContact C-O 3.59Å; Q7-G306 WeakPolarHBondContact CA-O 3.49Å; Q7-L307 HydrophobicContact CB-CD2 3.91Å; Q7-L307 HydrophobicContact CG-CD2 4.2Å
8	S	88.8	Confident	85.4	Confident	42 Å²	42	62.8 Å²	62.8	29%	0.294	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	111	178.4	-68.5	0	0	0	0	110.4	F305 G306	S8-F305 CarbonylContact O-C 3.57Å; S8-F305 VanDerWaalsContact O-CA 3.27Å; S8-F305 WeakPolarHBondContact O-CA 3.43Å; S8-F305 WeakPolarHBondContact O-CB 3.44Å; S8-G306 PolarHBondContact N-O 3.03Å; S8-G306 PolarHBondContact O-N 3.49Å
9	H	90.1	Very high	85.4	Confident	101 Å²	101	62.2 Å²	62.2	47%	0.468	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	129.4	177.5	-65.6	-90.2	0	0	0	111.2	Q7	Q7-H9 PolarHBondContact NE2-CE1 2.91Å; Q7-H9 PolarHBondContact NE2-NE2 3.47Å
10	Y	90.9	Very high	85.6	Confident	37 Å²	37	59.1 Å²	59.1	15%	0.145	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-53.9	-178.3	-60.7	-46.9	0	0	0	112.7	Y53 F287 S288 E294 L296 I304 G306	Y10-Y53 HydrophobicContact CD1-CE2 4.39Å; Y10-Y53 HydrophobicContact CE1-CE2 4.43Å; Y10-F287 HydrophobicContact CD2-CD1 4.3Å; Y10-F287 HydrophobicContact CD2-CE1 4Å; Y10-F287 AromaticContact CE2-CD1 3.83Å; Y10-F287 HydrophobicContact CE2-CD1 3.83Å; Y10-F287 HydrophobicContact CE2-CE1 4.01Å; Y10-F287 HydrophobicContact CG-CE1 4.35Å; Y10-S288 WeakPolarHBondContact OH-CB 3.38Å; Y10-S288 PolarHBondContact OH-OG 2.93Å; Y10-E294 WeakPolarHBondContact CE2-OE1 3.37Å; Y10-E294 VanDerWaalsContact OH-CD 3.24Å; Y10-E294 PolarHBondContact OH-OE1 2.87Å; Y10-E294 PolarHBondContact OH-OE2 3.25Å; Y10-L296 HydrophobicContact CD2-CD2 4.26Å; Y10-L296 HydrophobicContact CE2-CD2 3.6Å; Y10-I304 HydrophobicContact CD2-CG2 4.33Å; Y10-I304 PolarHBondContact N-O 3.11Å; Y10-G306 VanDerWaalsContact CE2-N 3.31Å
11	T	92.8	Very high	86	Confident	46 Å²	46	56.5 Å²	56.5	28%	0.282	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	173.9	-178	-167.8	0	0	0	0	111	F51 L57 I304	T11-F51 HydrophobicContact CG2-CD1 4.4Å; T11-F51 HydrophobicContact CG2-CE1 3.76Å; T11-F51 HydrophobicContact CG2-CE2 4.34Å; T11-F51 HydrophobicContact CG2-CZ 3.72Å; T11-L57 HydrophobicContact CG2-CD2 4.02Å; T11-I304 HydrophobicContact CG2-CB 4.11Å; T11-I304 HydrophobicContact CG2-CD1 3.88Å; T11-I304 HydrophobicContact CG2-CG1 4.34Å; T11-I304 PolarHBondContact N-O 3.04Å; T11-I304 PolarHBondContact O-N 3.3Å
12	S	91.8	Very high	88.4	Confident	74 Å²	74	49.3 Å²	49.3	52%	0.517	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.3	167.1	-162.4	0	0	0	0	109.8	G302	S12-G302 CarbonylContact C-O 3.55Å; S12-G302 WeakPolarHBondContact CA-O 3.13Å
13	I	93.1	Very high	89.7	Confident	21 Å²	21	45.2 Å²	45.2	11%	0.108	23%	0.229	C	C	.	.			trans	-116.2	-169.7	168.6	57.4	162.9	0	0	0	109	T16 V41 D43 F51 G302 I304	I13-T16 HydrophobicContact CD1-CG2 3.68Å; I13-T16 HydrophobicContact CG1-CG2 4.29Å; I13-V41 HydrophobicContact CD1-CB 4.09Å; I13-V41 HydrophobicContact CD1-CG1 3.51Å; I13-D43 HydrophobicContact CD1-CB 4.36Å; I13-F51 HydrophobicContact CG2-CE2 4.27Å; I13-F51 HydrophobicContact CG2-CZ 3.81Å; I13-G302 VanDerWaalsContact CG1-O 3.3Å; I13-G302 WeakPolarHBondContact CG1-O 3.42Å; I13-G302 PolarHBondContact N-O 3.48Å; I13-I304 HydrophobicContact CD1-CD1 4.34Å; I13-I304 HydrophobicContact CG1-CD1 4.24Å; I13-I304 HydrophobicContact CG2-CD1 4.32Å
14	K	91.2	Very high	90	Very high	107 Å²	107	43.5 Å²	43.5	47%	0.465	22%	0.222	S	C	.	.	S	Bend	trans	-74.8	-177.6	170.3	-55.6	-175.5	-167.9	158.9	0	110.3	D43 M45 G302	K14-D43 HydrophobicContact CB-CB 4.06Å; K14-D43 WeakPolarHBondContact CD-OD2 2.98Å; K14-M45 HydrophobicContact CD-CB 3.93Å; K14-M45 HydrophobicContact CD-CG 3.52Å; K14-G302 WeakPolarHBondContact O-CA 3.27Å
15	T	91.1	Very high	89.6	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.031	23%	0.225	C	C	.	.			trans	-56.9	149.8	-179.6	37.4	0	0	0	0	114.1	D43 T44 Y300 E367 Q388	T15-D43 CarbonylContact O-C 3.55Å; T15-D43 VanDerWaalsContact O-CA 3.29Å; T15-D43 WeakPolarHBondContact O-CA 3.23Å; T15-D43 WeakPolarHBondContact O-CB 3.48Å; T15-T44 PolarHBondContact O-N 2.92Å; T15-T44 PolarHBondContact O-OG1 3.47Å; T15-T44 PolarHBondContact OG1-OG1 3.22Å; T15-Y300 CarbonylContact C-O 3.54Å; T15-Y300 WeakPolarHBondContact CA-O 3.46Å; T15-Y300 WeakPolarHBondContact CB-O 3.41Å; T15-Y300 HydrophobicContact CG2-CE1 4.16Å; T15-Y300 HydrophobicContact CG2-CE2 4.2Å; T15-Y300 VanDerWaalsContact CG2-O 3.31Å; T15-Y300 WeakPolarHBondContact CG2-O 3.3Å; T15-E367 PolarHBondContact OG1-OE2 2.85Å; T15-Q388 HydrophobicContact CG2-CB 4.28Å; T15-Q388 HydrophobicContact CG2-CG 3.39Å; T15-Q388 PolarHBondContact OG1-NE2 2.92Å
16	T	92.8	Very high	88.3	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.012	24%	0.239	C	C	.	.			trans	-121.6	148.2	-179.3	62.2	0	0	0	0	111	I13 S20 V41 T280 I298 T299 Y300	I13-T16 HydrophobicContact CD1-CG2 3.68Å; I13-T16 HydrophobicContact CG1-CG2 4.29Å; T16-S20 WeakPolarHBondContact CB-OG 3.36Å; T16-V41 HydrophobicContact CG2-CG1 4.04Å; T16-T280 WeakPolarHBondContact OG1-CG2 3.31Å; T16-T280 PolarHBondContact OG1-OG1 3.31Å; T16-I298 HydrophobicContact CG2-CG2 3.83Å; T16-T299 PolarHBondContact OG1-O 3.2Å; T16-Y300 PolarHBondContact N-O 2.78Å
17	S	89.5	Confident	86.5	Confident	26 Å²	26	48.6 Å²	48.6	18%	0.182	26%	0.26	C	S	.	.			trans	-89.2	168.5	168.9	60.3	0	0	0	0	110.7	S20 T69 T280	S17-S20 WeakPolarHBondContact O-CB 3.42Å; S17-S20 PolarHBondContact O-N 3.47Å; S17-S20 PolarHBondContact O-OG 3.26Å; S17-T69 WeakPolarHBondContact CB-O 3.35Å; S17-T69 PolarHBondContact OG-O 3.18Å; S17-T280 WeakPolarHBondContact O-CB 3.33Å
18	R	88.7	Confident	84.3	Confident	74 Å²	74	54.4 Å²	54.4	28%	0.279	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	144.7	170.4	-172.8	171.1	-179.1	-135.5	-10.5	110.5	S20 V168 L217	R18-S20 PolarHBondContact O-N 2.91Å; R18-V168 VanDerWaalsContact CZ-O 3.29Å; R18-V168 VanDerWaalsContact NH1-CG1 3.29Å; R18-V168 PolarHBondContact NH1-O 2.92Å; R18-V168 PolarHBondContact NH2-O 3.22Å; R18-L217 HydrophobicContact CG-CD1 3.93Å; R18-L217 PolarHBondContact NH2-O 3.24Å
19	N	85.6	Confident	81.7	Confident	52 Å²	52	54.2 Å²	54.2	28%	0.278	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	57	31	-178	-62.5	-24.5	0	0	0	113.8	I71 T280	N19-I71 PolarHBondContact O-N 3.35Å; N19-T280 PolarHBondContact N-O 2.91Å
20	S	90.3	Very high	79.1	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.301	C	S	.	.			trans	-90.5	4.3	178.5	81.5	0	0	0	0	114	T16 S17 R18 V41 A42 I71	T16-S20 WeakPolarHBondContact CB-OG 3.36Å; S17-S20 WeakPolarHBondContact O-CB 3.42Å; S17-S20 PolarHBondContact O-N 3.47Å; S17-S20 PolarHBondContact O-OG 3.26Å; R18-S20 PolarHBondContact O-N 2.91Å; S20-V41 CarbonylContact O-C 3.56Å; S20-V41 WeakPolarHBondContact O-CA 3.25Å; S20-A42 WeakPolarHBondContact CB-O 3.46Å; S20-A42 PolarHBondContact O-N 3.46Å; S20-A42 PolarHBondContact OG-O 2.99Å; S20-I71 WeakPolarHBondContact O-CD1 3.46Å
21	A	93.6	Very high	76.5	Confident	4 Å²	4	61.5 Å²	61.5	3%	0.033	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.9	179.7	0	0	0	0	0	112.9	L39 I40 V41 I283 I298	A21-L39 HydrophobicContact CB-CD1 4.41Å; A21-I40 CarbonylContact C-O 3.57Å; A21-I40 VanDerWaalsContact CA-O 3.23Å; A21-I40 WeakPolarHBondContact CA-O 3.41Å; A21-V41 HydrophobicContact CB-CG1 4.33Å; A21-V41 HydrophobicContact CB-CG2 4.13Å; A21-I283 HydrophobicContact CB-CD1 3.79Å; A21-I283 WeakPolarHBondContact O-CD1 3.37Å; A21-I298 HydrophobicContact CB-CD1 3.58Å; A21-I298 HydrophobicContact CB-CG1 3.97Å
22	K	92.7	Very high	73.9	Confident	64 Å²	64	65.6 Å²	65.6	28%	0.278	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.5	175	-63.5	-71.1	175.2	163.7	0	111.6	I40 I71 D72 I73	K22-I40 PolarHBondContact N-O 3.32Å; K22-I40 PolarHBondContact O-N 2.92Å; K22-I71 HydrophobicContact CB-CD1 4.42Å; K22-I71 VanDerWaalsContact CE-O 3.3Å; K22-I71 WeakPolarHBondContact CE-O 3.49Å; K22-I71 HydrophobicContact CG-CD1 4.18Å; K22-I71 HydrophobicContact CG-CG1 4.07Å; K22-D72 VanDerWaalsContact CE-OD1 3.22Å; K22-D72 WeakPolarHBondContact CE-OD1 3.43Å; K22-D72 IonicContact NZ-OD1 3.21Å; K22-D72 PolarHBondContact NZ-OD1 3.41Å; K22-I73 HydrophobicContact CB-CD1 3.4Å; K22-I73 VanDerWaalsContact CB-CD1 3.4Å; K22-I73 HydrophobicContact CB-CG1 3.74Å; K22-I73 HydrophobicContact CG-CD1 4.33Å; K22-I73 HydrophobicContact CG-CG1 4.19Å
23	I	88.4	Confident	71.9	Confident	29 Å²	29	67.3 Å²	67.3	15%	0.149	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.1	172.8	-74.6	176.8	0	0	0	110.8	L25 C37 K38 I73 I283 L296	I23-L25 HydrophobicContact CG2-CD2 4.12Å; I23-L25 HydrophobicContact CG2-CG 4.48Å; I23-C37 HydrophobicContact CG2-CB 3.59Å; I23-K38 CarbonylContact C-O 3.57Å; I23-K38 WeakPolarHBondContact CA-O 3.45Å; I23-I73 VanDerWaalsContact C-CD1 3.43Å; I23-I73 WeakPolarHBondContact O-CD1 3.34Å; I23-I283 HydrophobicContact CB-CG2 4.33Å; I23-I283 HydrophobicContact CD1-CB 4.17Å; I23-I283 HydrophobicContact CD1-CG2 3.43Å; I23-I283 VanDerWaalsContact CD1-CG2 3.43Å; I23-I283 HydrophobicContact CG1-CB 4.44Å; I23-I283 HydrophobicContact CG1-CD1 4.4Å; I23-I283 HydrophobicContact CG1-CG2 3.73Å; I23-L296 HydrophobicContact CD1-CD1 3.9Å; I23-L296 HydrophobicContact CG1-CD1 4.21Å
24	L	84.5	Confident	69.8	Low	6 Å²	6	71.7 Å²	71.7	3%	0.031	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	120.1	165.9	-71.6	166.8	0	0	0	110	K38 I40 I73 Q82 I84 P97	L24-K38 HydrophobicContact CB-CB 4.16Å; L24-K38 PolarHBondContact N-O 2.92Å; L24-K38 PolarHBondContact O-N 3.32Å; L24-K38 VanDerWaalsContact O-N 3.09Å; L24-I40 HydrophobicContact CD1-CD1 3.68Å; L24-I40 HydrophobicContact CD1-CG1 3.45Å; L24-I40 VanDerWaalsContact CD1-CG1 3.45Å; L24-I40 HydrophobicContact CG-CG1 3.87Å; L24-I73 HydrophobicContact CD2-CD1 3.61Å; L24-I73 HydrophobicContact CD2-CG1 3.98Å; L24-I73 HydrophobicContact CD2-CG2 3.74Å; L24-I73 HydrophobicContact CG-CD1 3.78Å; L24-Q82 HydrophobicContact CD2-CB 3.91Å; L24-Q82 HydrophobicContact CD2-CG 4.37Å; L24-I84 HydrophobicContact CD1-CD1 4.31Å; L24-I84 HydrophobicContact CD1-CG1 4.32Å; L24-P97 HydrophobicContact CD1-CB 4.2Å; L24-P97 HydrophobicContact CD1-CG 4.4Å
25	L	74.9	Confident	68.1	Low	101 Å²	101	69.3 Å²	69.3	53%	0.529	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-85.6	141.6	171.2	-62.6	173.9	0	0	0	110.6	I23 Q82	I23-L25 HydrophobicContact CG2-CD2 4.12Å; I23-L25 HydrophobicContact CG2-CG 4.48Å; L25-Q82 PolarHBondContact O-NE2 2.85Å; L25-Q82 PolarHBondContact O-OE1 3.45Å
26	P	62.8	Low	66.9	Low	54 Å²	54	72 Å²	72	35%	0.351	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-62.8	138.4	179.3	19.6	-26.1	0	0	0	112.7	K28 C35	P26-K28 PolarHBondContact O-N 2.92Å; P26-C35 HydrophobicContact CG-CB 3.67Å
27	S	52.6	Low	66.4	Low	93 Å²	93	72.3 Å²	72.3	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	4.9	-171.2	39.6	0	0	0	0	116.5
28	K	44.3	Very low	66.4	Low	204 Å²	204	74.6 Å²	74.6	89%	0.887	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	18.7	-176.7	-74.8	-167.8	175.3	-172.9	0	114.9	P26	P26-K28 PolarHBondContact O-N 2.92Å
29	S	34.5	Very low	66.6	Low	38 Å²	38	71.1 Å²	71.1	27%	0.266	36%	0.361	S	S	.	.			trans	-148.7	84.7	178.2	10.6	0	0	0	0	110.9	S31	S29-S31 WeakPolarHBondContact CB-O 3.21Å
30	Y	35.5	Very low	67	Low	214 Å²	214	68.7 Å²	68.7	84%	0.839	35%	0.348	S	S	*	.	S	Bend	trans	-76.4	-3.7	155.8	-84.9	-82.3	0	0	0	111.5
31	S	35.4	Very low	67.3	Low	77 Å²	77	68.7 Å²	68.7	54%	0.538	35%	0.348	S	S	.	.	S	Bend	trans	-127.3	143.9	167.2	59.5	0	0	0	0	109.7	S29	S29-S31 WeakPolarHBondContact CB-O 3.21Å
32	N	37.9	Very low	67.3	Low	132 Å²	132	68.6 Å²	68.6	71%	0.706	35%	0.347	S	S	*	.			trans	103	121.2	160.6	-57.2	-5.3	0	0	0	118.5	H34	N32-H34 PolarHBondContact O-N 3.39Å
33	K	50.2	Low	67.3	Low	111 Å²	111	65.6 Å²	65.6	48%	0.483	33%	0.334	S	S	.	.	S	Bend	trans	-67.1	15.5	-168.6	-63.4	165.3	175	169.9	0	115.2
34	H	50.4	Low	67.4	Low	112 Å²	112	65.2 Å²	65.2	52%	0.519	33%	0.333	S	S	.	.			trans	-129.7	25.8	-162.8	-64.6	-63.4	0	0	0	117.3	N32 V290	N32-H34 PolarHBondContact O-N 3.39Å; H34-V290 HydrophobicContact CB-CG1 3.99Å; H34-V290 WeakPolarHBondContact O-CG1 3.47Å
35	C	54.6	Low	67.5	Low	57 Å²	57	68.8 Å²	68.8	39%	0.385	35%	0.35	S	S	.	.			trans	-117.5	137.4	-179	-76.3	0	0	0	0	113.6	P26	P26-C35 HydrophobicContact CG-CB 3.67Å
36	K	64.9	Low	68.3	Low	62 Å²	62	64 Å²	64	27%	0.27	33%	0.325	S	S	.	.			trans	-72.7	128.9	174.9	-66.8	-164.7	173.6	-167.2	0	111.8	Y53 S288 V290	K36-Y53 WeakPolarHBondContact CD-O 3.5Å; K36-Y53 WeakPolarHBondContact CE-O 3.49Å; K36-Y53 PolarHBondContact NZ-O 3.01Å; K36-S288 WeakPolarHBondContact CE-O 3.45Å; K36-S288 PolarHBondContact NZ-O 3.41Å; K36-V290 HydrophobicContact CB-CG2 4.46Å; K36-V290 HydrophobicContact CD-CG2 4.2Å; K36-V290 HydrophobicContact CG-CG2 3.29Å
37	C	82.6	Confident	69.8	Low	8 Å²	8	62 Å²	62	5%	0.054	31%	0.312	C	S	.	.			trans	-74.8	156.7	176.2	-64.1	0	0	0	0	112.1	I23 R286	I23-C37 HydrophobicContact CG2-CB 3.59Å; C37-R286 WeakPolarHBondContact CB-O 3.22Å; C37-R286 PolarHBondContact N-O 3.24Å; C37-R286 VanDerWaalsContact N-O 3.15Å; C37-R286 PolarHBondContact SG-O 3Å
38	K	89.1	Confident	71.9	Confident	75 Å²	75	57.7 Å²	57.7	33%	0.326	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	129.6	165.4	-72.8	-175.9	176.4	-173.7	0	109.5	I23 L24 F51 Q52	I23-K38 CarbonylContact C-O 3.57Å; I23-K38 WeakPolarHBondContact CA-O 3.45Å; L24-K38 HydrophobicContact CB-CB 4.16Å; L24-K38 PolarHBondContact N-O 2.92Å; L24-K38 PolarHBondContact O-N 3.32Å; L24-K38 VanDerWaalsContact O-N 3.09Å; K38-F51 WeakPolarHBondContact CA-O 3.43Å; K38-Q52 HydrophobicContact CG-CB 4.08Å; K38-Q52 HydrophobicContact CG-CG 3.85Å
39	L	93.2	Very high	74.3	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124	175.6	175.1	66.4	0	0	0	109	A21 V41 S50 F51 I283 F287 L296 I298 I304	A21-L39 HydrophobicContact CB-CD1 4.41Å; L39-V41 HydrophobicContact CD1-CG2 3.99Å; L39-V41 HydrophobicContact CD2-CG2 3.76Å; L39-V41 HydrophobicContact CG-CG2 3.63Å; L39-S50 WeakPolarHBondContact O-CA 2.89Å; L39-F51 HydrophobicContact CB-CB 4.36Å; L39-F51 HydrophobicContact CD2-CD2 4.41Å; L39-F51 PolarHBondContact N-O 2.92Å; L39-F51 PolarHBondContact O-N 2.86Å; L39-I283 HydrophobicContact CD1-CD1 4.11Å; L39-F287 HydrophobicContact CB-CD2 4.16Å; L39-F287 HydrophobicContact CB-CE2 3.69Å; L39-F287 HydrophobicContact CB-CZ 4.28Å; L39-L296 HydrophobicContact CB-CD1 4.25Å; L39-L296 HydrophobicContact CD1-CD1 3.98Å; L39-L296 HydrophobicContact CD2-CD1 4.25Å; L39-L296 HydrophobicContact CG-CD1 4.37Å; L39-I298 HydrophobicContact CD1-CD1 4.47Å; L39-I304 HydrophobicContact CD2-CG2 3.7Å
40	I	95	Very high	77.1	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	128.7	170.1	-57.4	-55.5	0	0	0	108	A21 K22 L24 V48 H49 S50 I71 I84	A21-I40 CarbonylContact C-O 3.57Å; A21-I40 VanDerWaalsContact CA-O 3.23Å; A21-I40 WeakPolarHBondContact CA-O 3.41Å; K22-I40 PolarHBondContact N-O 3.32Å; K22-I40 PolarHBondContact O-N 2.92Å; L24-I40 HydrophobicContact CD1-CD1 3.68Å; L24-I40 HydrophobicContact CD1-CG1 3.45Å; L24-I40 VanDerWaalsContact CD1-CG1 3.45Å; L24-I40 HydrophobicContact CG-CG1 3.87Å; I40-V48 HydrophobicContact CG2-CG1 3.71Å; I40-H49 CarbonylContact C-O 3.46Å; I40-H49 VanDerWaalsContact CA-O 3.29Å; I40-H49 WeakPolarHBondContact CA-O 3.28Å; I40-S50 VanDerWaalsContact CD1-CB 3.48Å; I40-S50 WeakPolarHBondContact CD1-OG 3.1Å; I40-I71 HydrophobicContact CB-CD1 4.5Å; I40-I71 HydrophobicContact CG2-CD1 3.89Å; I40-I84 HydrophobicContact CD1-CD1 3.98Å; I40-I84 HydrophobicContact CG1-CD1 4.06Å; I40-I84 HydrophobicContact CG2-CD1 4.17Å; I40-I84 HydrophobicContact CG2-CG2 4.22Å
41	V	95.2	Very high	79.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130.6	176	-167.1	0	0	0	0	109.3	I13 T16 S20 A21 L39 H49 F51 I298 I304	I13-V41 HydrophobicContact CD1-CB 4.09Å; I13-V41 HydrophobicContact CD1-CG1 3.51Å; T16-V41 HydrophobicContact CG2-CG1 4.04Å; S20-V41 CarbonylContact O-C 3.56Å; S20-V41 WeakPolarHBondContact O-CA 3.25Å; A21-V41 HydrophobicContact CB-CG1 4.33Å; A21-V41 HydrophobicContact CB-CG2 4.13Å; L39-V41 HydrophobicContact CD1-CG2 3.99Å; L39-V41 HydrophobicContact CD2-CG2 3.76Å; L39-V41 HydrophobicContact CG-CG2 3.63Å; V41-H49 PolarHBondContact N-O 3.33Å; V41-H49 WeakPolarHBondContact O-CA 3.33Å; V41-H49 WeakPolarHBondContact O-CB 2.89Å; V41-H49 PolarHBondContact O-N 3.42Å; V41-F51 HydrophobicContact CG2-CD2 4.47Å; V41-F51 HydrophobicContact CG2-CE2 4.47Å; V41-I298 HydrophobicContact CG1-CG2 4.13Å; V41-I298 HydrophobicContact CG2-CG1 4.31Å; V41-I304 HydrophobicContact CB-CD1 4.42Å; V41-I304 HydrophobicContact CG2-CD1 3.9Å
42	A	94.9	Very high	82.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.4	171.7	0	0	0	0	0	111	S20 D47 V48 I68 I71	S20-A42 WeakPolarHBondContact CB-O 3.46Å; S20-A42 PolarHBondContact O-N 3.46Å; S20-A42 PolarHBondContact OG-O 2.99Å; A42-D47 WeakPolarHBondContact CA-O 3.16Å; A42-V48 HydrophobicContact CB-CG2 4.43Å; A42-I68 HydrophobicContact CB-CB 4.12Å; A42-I68 HydrophobicContact CB-CD1 3.78Å; A42-I68 HydrophobicContact CB-CG2 3.63Å; A42-I71 HydrophobicContact CB-CG2 3.63Å
43	D	93.3	Very high	84.8	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	16%	0.161	C	C	.	.			trans	-96.7	162.6	170.7	82.7	9.8	0	0	0	111.8	I13 K14 T15 M45 G46 D47 H49	I13-D43 HydrophobicContact CD1-CB 4.36Å; K14-D43 HydrophobicContact CB-CB 4.06Å; K14-D43 WeakPolarHBondContact CD-OD2 2.98Å; T15-D43 CarbonylContact O-C 3.55Å; T15-D43 VanDerWaalsContact O-CA 3.29Å; T15-D43 WeakPolarHBondContact O-CA 3.23Å; T15-D43 WeakPolarHBondContact O-CB 3.48Å; D43-M45 PolarHBondContact O-N 2.87Å; D43-M45 WeakPolarHBondContact OD1-CA 3.28Å; D43-M45 WeakPolarHBondContact OD1-CB 3.47Å; D43-M45 PolarHBondContact OD1-N 3.13Å; D43-G46 PolarHBondContact O-N 2.67Å; D43-G46 PolarHBondContact OD1-N 3.17Å; D43-D47 PolarHBondContact N-O 2.9Å; D43-D47 PolarHBondContact OD1-N 2.99Å; D43-H49 IonicContact OD2-NE2 2.66Å
44	T	89.2	Confident	86.4	Confident	22 Å²	22	30.6 Å²	30.6	14%	0.135	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.5	-179.7	58.6	0	0	0	0	113.3	T15 P67 E367	T15-T44 PolarHBondContact O-N 2.92Å; T15-T44 PolarHBondContact O-OG1 3.47Å; T15-T44 PolarHBondContact OG1-OG1 3.22Å; T44-P67 WeakPolarHBondContact O-CA 3.36Å; T44-P67 WeakPolarHBondContact O-CB 3.4Å; T44-E367 PolarHBondContact OG1-OE2 3.23Å
45	M	88	Confident	87.6	Confident	80 Å²	80	33.3 Å²	33.3	39%	0.394	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-1.6	179.6	-65.2	-70.3	152.8	0	0	112.9	K14 D43 E367	K14-M45 HydrophobicContact CD-CB 3.93Å; K14-M45 HydrophobicContact CD-CG 3.52Å; D43-M45 PolarHBondContact O-N 2.87Å; D43-M45 WeakPolarHBondContact OD1-CA 3.28Å; D43-M45 WeakPolarHBondContact OD1-CB 3.47Å; D43-M45 PolarHBondContact OD1-N 3.13Å; M45-E367 WeakPolarHBondContact CE-OE1 3.18Å
46	G	91.6	Very high	88.9	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	97.9	9.1	176.4	0	0	0	0	0	115.5	D43 T63 V64 S66	D43-G46 PolarHBondContact O-N 2.67Å; D43-G46 PolarHBondContact OD1-N 3.17Å; G46-T63 CarbonylContact O-C 3.56Å; G46-T63 WeakPolarHBondContact O-CA 3.41Å; G46-V64 PolarHBondContact O-N 3.28Å; G46-S66 WeakPolarHBondContact CA-O 3.36Å
47	D	94.4	Very high	89.9	Confident	14 Å²	14	31.6 Å²	31.6	8%	0.075	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.4	172.9	-76	-17.9	0	0	0	110.6	A42 D43 H49 K61 T63	A42-D47 WeakPolarHBondContact CA-O 3.16Å; D43-D47 PolarHBondContact N-O 2.9Å; D43-D47 PolarHBondContact OD1-N 2.99Å; D47-H49 WeakPolarHBondContact CB-NE2 3.32Å; D47-H49 PolarHBondContact O-CD2 3.41Å; D47-K61 IonicContact OD2-NZ 3.69Å; D47-K61 PolarHBondContact OD2-NZ 2.88Å; D47-T63 WeakPolarHBondContact OD1-CB 3.47Å; D47-T63 WeakPolarHBondContact OD1-CG2 3.42Å; D47-T63 PolarHBondContact OD1-OG1 2.92Å
48	V	95.3	Very high	90.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	112.1	170.5	-177.6	0	0	0	0	108.9	I40 A42 K61 F62 V64 I68 V86	I40-V48 HydrophobicContact CG2-CG1 3.71Å; A42-V48 HydrophobicContact CB-CG2 4.43Å; V48-K61 VanDerWaalsContact O-CA 3.24Å; V48-K61 WeakPolarHBondContact O-CA 3.49Å; V48-F62 HydrophobicContact CB-CD1 4.14Å; V48-F62 HydrophobicContact CB-CD2 4.26Å; V48-F62 HydrophobicContact CB-CE1 3.65Å; V48-F62 HydrophobicContact CB-CE2 3.79Å; V48-F62 HydrophobicContact CB-CG 4.43Å; V48-F62 HydrophobicContact CB-CZ 3.47Å; V48-F62 VanDerWaalsContact CB-CZ 3.47Å; V48-F62 HydrophobicContact CG1-CD1 4.42Å; V48-F62 HydrophobicContact CG1-CE1 3.57Å; V48-F62 HydrophobicContact CG1-CE2 4.34Å; V48-F62 HydrophobicContact CG1-CZ 3.53Å; V48-F62 HydrophobicContact CG2-CD2 4.49Å; V48-F62 HydrophobicContact CG2-CE1 4.47Å; V48-F62 HydrophobicContact CG2-CE2 3.8Å; V48-F62 HydrophobicContact CG2-CZ 3.8Å; V48-F62 PolarHBondContact N-O 2.89Å; V48-F62 PolarHBondContact O-N 2.87Å; V48-F62 VanDerWaalsContact O-N 3.11Å; V48-V64 HydrophobicContact CG2-CG2 4.09Å; V48-I68 HydrophobicContact CG2-CD1 3.54Å; V48-V86 HydrophobicContact CG2-CG2 4.08Å
49	H	95.2	Very high	90.4	Very high	11 Å²	11	37.9 Å²	37.9	5%	0.051	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	138.6	-178.4	-58.3	-110	0	0	0	110.7	I40 V41 D43 D47 F51 H59	I40-H49 CarbonylContact C-O 3.46Å; I40-H49 VanDerWaalsContact CA-O 3.29Å; I40-H49 WeakPolarHBondContact CA-O 3.28Å; V41-H49 PolarHBondContact N-O 3.33Å; V41-H49 WeakPolarHBondContact O-CA 3.33Å; V41-H49 WeakPolarHBondContact O-CB 2.89Å; V41-H49 PolarHBondContact O-N 3.42Å; D43-H49 IonicContact OD2-NE2 2.66Å; D47-H49 WeakPolarHBondContact CB-NE2 3.32Å; D47-H49 PolarHBondContact O-CD2 3.41Å; H49-F51 HydrophobicContact CB-CD2 4.22Å; H49-F51 HydrophobicContact CB-CE2 3.45Å; H49-F51 VanDerWaalsContact CB-CE2 3.45Å; H49-F51 HydrophobicContact CB-CZ 3.76Å; H49-H59 AromaticContact CG-NE2 3.76Å; H49-H59 AromaticContact ND1-CE1 3.57Å; H49-H59 AromaticContact ND1-NE2 3.03Å; H49-H59 PolarHBondContact ND1-NE2 2.91Å
50	S	94.1	Very high	90.4	Very high	10 Å²	10	42.1 Å²	42.1	7%	0.07	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.1	175.4	176.8	0	0	0	0	109.4	L39 I40 H59 T60	L39-S50 WeakPolarHBondContact O-CA 2.89Å; I40-S50 VanDerWaalsContact CD1-CB 3.48Å; I40-S50 WeakPolarHBondContact CD1-OG 3.1Å; S50-H59 WeakPolarHBondContact O-CA 3.49Å; S50-T60 WeakPolarHBondContact CB-OG1 3.5Å; S50-T60 PolarHBondContact N-O 3.07Å; S50-T60 PolarHBondContact O-N 3.14Å; S50-T60 PolarHBondContact O-OG1 3.21Å
51	F	93.3	Very high	90.3	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	139.3	-177.7	-60.3	-75	0	0	0	111.2	T11 I13 K38 L39 V41 H49 L57 K58 H59 F287 I304	T11-F51 HydrophobicContact CG2-CD1 4.4Å; T11-F51 HydrophobicContact CG2-CE1 3.76Å; T11-F51 HydrophobicContact CG2-CE2 4.34Å; T11-F51 HydrophobicContact CG2-CZ 3.72Å; I13-F51 HydrophobicContact CG2-CE2 4.27Å; I13-F51 HydrophobicContact CG2-CZ 3.81Å; K38-F51 WeakPolarHBondContact CA-O 3.43Å; L39-F51 HydrophobicContact CB-CB 4.36Å; L39-F51 HydrophobicContact CD2-CD2 4.41Å; L39-F51 PolarHBondContact N-O 2.92Å; L39-F51 PolarHBondContact O-N 2.86Å; V41-F51 HydrophobicContact CG2-CD2 4.47Å; V41-F51 HydrophobicContact CG2-CE2 4.47Å; H49-F51 HydrophobicContact CB-CD2 4.22Å; H49-F51 HydrophobicContact CB-CE2 3.45Å; H49-F51 VanDerWaalsContact CB-CE2 3.45Å; H49-F51 HydrophobicContact CB-CZ 3.76Å; F51-L57 HydrophobicContact CB-CD1 4.08Å; F51-L57 HydrophobicContact CD1-CD1 4.32Å; F51-L57 HydrophobicContact CD1-CD2 4.04Å; F51-L57 HydrophobicContact CD1-CG 4.17Å; F51-L57 HydrophobicContact CE1-CD2 4.42Å; F51-K58 WeakPolarHBondContact CA-O 3.17Å; F51-H59 HydrophobicContact CD1-CB 3.83Å; F51-H59 AromaticContact CD1-CD2 3.69Å; F51-H59 AromaticContact CD1-CG 3.94Å; F51-H59 HydrophobicContact CE1-CB 3.76Å; F51-H59 AromaticContact CE1-CD2 3.18Å; F51-H59 WeakPolarHBondContact CE1-CD2 3.46Å; F51-H59 AromaticContact CE1-CG 3.43Å; F51-H59 VanDerWaalsContact CE1-CG 3.43Å; F51-H59 AromaticContact CE1-NE2 3.85Å; F51-H59 AromaticContact CZ-CD2 3.65Å; F51-H59 AromaticContact CZ-NE2 3.91Å; F51-F287 HydrophobicContact CB-CE2 4.3Å; F51-F287 HydrophobicContact CB-CZ 3.94Å; F51-I304 HydrophobicContact CD2-CD1 4.07Å; F51-I304 HydrophobicContact CE2-CD1 3.48Å; F51-I304 VanDerWaalsContact CE2-CD1 3.48Å; F51-I304 HydrophobicContact CZ-CD1 4.11Å
52	Q	90.3	Very high	90.2	Very high	57 Å²	57	49.4 Å²	49.4	27%	0.266	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	128.2	174.8	-164.1	-174.8	0.5	0	0	110.3	K38 V54 K58	K38-Q52 HydrophobicContact CG-CB 4.08Å; K38-Q52 HydrophobicContact CG-CG 3.85Å; Q52-V54 HydrophobicContact CG-CG2 3.82Å; Q52-V54 PolarHBondContact O-N 3.47Å; Q52-K58 PolarHBondContact N-O 3.47Å; Q52-K58 WeakPolarHBondContact O-CB 3.49Å; Q52-K58 PolarHBondContact O-N 3.38Å
53	Y	85.8	Confident	90.2	Very high	77 Å²	77	53 Å²	53	30%	0.302	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	92.9	-178.9	-153.7	-84.2	0	0	0	111.7	Y10 K36 G56 L57 F287 S288	Y10-Y53 HydrophobicContact CD1-CE2 4.39Å; Y10-Y53 HydrophobicContact CE1-CE2 4.43Å; K36-Y53 WeakPolarHBondContact CD-O 3.5Å; K36-Y53 WeakPolarHBondContact CE-O 3.49Å; K36-Y53 PolarHBondContact NZ-O 3.01Å; Y53-G56 CarbonylContact C-O 3.18Å; Y53-G56 WeakPolarHBondContact CA-O 3.23Å; Y53-L57 HydrophobicContact CD2-CB 4.35Å; Y53-L57 HydrophobicContact CD2-CD1 4.12Å; Y53-F287 WeakPolarHBondContact CB-O 3.39Å; Y53-F287 HydrophobicContact CD2-CE1 4.42Å; Y53-S288 VanDerWaalsContact CD1-O 3.3Å; Y53-S288 WeakPolarHBondContact CD1-O 3.36Å
54	V	83.2	Confident	90	Very high	49 Å²	49	53.9 Å²	53.9	30%	0.297	28%	0.279	S	S	.	.	S	Bend	trans	-127.8	100.2	178.4	-174.6	0	0	0	0	109.2	Q52 G56 K58	Q52-V54 HydrophobicContact CG-CG2 3.82Å; Q52-V54 PolarHBondContact O-N 3.47Å; V54-G56 CarbonylContact C-O 3.47Å; V54-G56 PolarHBondContact N-O 2.97Å; V54-G56 PolarHBondContact O-N 3.38Å; V54-K58 HydrophobicContact CB-CD 4.25Å
55	N	76.2	Confident	89.7	Confident	168 Å²	168	61.5 Å²	61.5	90%	0.898	31%	0.313	S	S	*	.	S	Bend	trans	51.9	40.2	-172.2	-59.2	-9.6	0	0	0	112.4
56	G	82	Confident	89.7	Confident	26 Å²	26	58 Å²	58	27%	0.268	30%	0.297	S	S	.	.	S	Bend	trans	122.8	167.3	-168.2	0	0	0	0	0	111.8	Y53 V54 K58	Y53-G56 CarbonylContact C-O 3.18Å; Y53-G56 WeakPolarHBondContact CA-O 3.23Å; V54-G56 CarbonylContact C-O 3.47Å; V54-G56 PolarHBondContact N-O 2.97Å; V54-G56 PolarHBondContact O-N 3.38Å; G56-K58 PolarHBondContact O-N 3.35Å
57	L	86.5	Confident	89.5	Confident	58 Å²	58	61.4 Å²	61.4	30%	0.304	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	112.1	179.9	-170.1	72.3	0	0	0	110	T11 F51 Y53 F287	T11-L57 HydrophobicContact CG2-CD2 4.02Å; F51-L57 HydrophobicContact CB-CD1 4.08Å; F51-L57 HydrophobicContact CD1-CD1 4.32Å; F51-L57 HydrophobicContact CD1-CD2 4.04Å; F51-L57 HydrophobicContact CD1-CG 4.17Å; F51-L57 HydrophobicContact CE1-CD2 4.42Å; Y53-L57 HydrophobicContact CD2-CB 4.35Å; Y53-L57 HydrophobicContact CD2-CD1 4.12Å; L57-F287 HydrophobicContact CD1-CE1 3.96Å; L57-F287 HydrophobicContact CD1-CZ 3.71Å
58	K	90.2	Very high	89.3	Confident	123 Å²	123	61 Å²	61	54%	0.535	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136	168.4	-63.9	-172.2	177.5	-177.3	0	109.3	F51 Q52 V54 G56	F51-K58 WeakPolarHBondContact CA-O 3.17Å; Q52-K58 PolarHBondContact N-O 3.47Å; Q52-K58 WeakPolarHBondContact O-CB 3.49Å; Q52-K58 PolarHBondContact O-N 3.38Å; V54-K58 HydrophobicContact CB-CD 4.25Å; G56-K58 PolarHBondContact O-N 3.35Å
59	H	92	Very high	88.9	Confident	91 Å²	91	62.5 Å²	62.5	42%	0.421	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.4	-178.7	174.3	-139.4	0	0	0	110.4	H49 S50 F51	H49-H59 AromaticContact CG-NE2 3.76Å; H49-H59 AromaticContact ND1-CE1 3.57Å; H49-H59 AromaticContact ND1-NE2 3.03Å; H49-H59 PolarHBondContact ND1-NE2 2.91Å; S50-H59 WeakPolarHBondContact O-CA 3.49Å; F51-H59 HydrophobicContact CD1-CB 3.83Å; F51-H59 AromaticContact CD1-CD2 3.69Å; F51-H59 AromaticContact CD1-CG 3.94Å; F51-H59 HydrophobicContact CE1-CB 3.76Å; F51-H59 AromaticContact CE1-CD2 3.18Å; F51-H59 WeakPolarHBondContact CE1-CD2 3.46Å; F51-H59 AromaticContact CE1-CG 3.43Å; F51-H59 VanDerWaalsContact CE1-CG 3.43Å; F51-H59 AromaticContact CE1-NE2 3.85Å; F51-H59 AromaticContact CZ-CD2 3.65Å; F51-H59 AromaticContact CZ-NE2 3.91Å
60	T	92.6	Very high	88.6	Confident	90 Å²	90	62.1 Å²	62.1	55%	0.552	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-132.9	152.5	167.8	51.7	0	0	0	0	108.5	S50	S50-T60 WeakPolarHBondContact CB-OG1 3.5Å; S50-T60 PolarHBondContact N-O 3.07Å; S50-T60 PolarHBondContact O-N 3.14Å; S50-T60 PolarHBondContact O-OG1 3.21Å
61	K	93.5	Very high	88.6	Confident	119 Å²	119	61.8 Å²	61.8	52%	0.517	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	157	175.5	69.6	174	-167.1	163.2	0	112.2	D47 V48	D47-K61 IonicContact OD2-NZ 3.69Å; D47-K61 PolarHBondContact OD2-NZ 2.88Å; V48-K61 VanDerWaalsContact O-CA 3.24Å; V48-K61 WeakPolarHBondContact O-CA 3.49Å
62	F	93.8	Very high	88.5	Confident	35 Å²	35	62.7 Å²	62.7	15%	0.154	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	158.4	165.5	65.3	-88.7	0	0	0	109.1	V48 V64 I84 F95	V48-F62 HydrophobicContact CB-CD1 4.14Å; V48-F62 HydrophobicContact CB-CD2 4.26Å; V48-F62 HydrophobicContact CB-CE1 3.65Å; V48-F62 HydrophobicContact CB-CE2 3.79Å; V48-F62 HydrophobicContact CB-CG 4.43Å; V48-F62 HydrophobicContact CB-CZ 3.47Å; V48-F62 VanDerWaalsContact CB-CZ 3.47Å; V48-F62 HydrophobicContact CG1-CD1 4.42Å; V48-F62 HydrophobicContact CG1-CE1 3.57Å; V48-F62 HydrophobicContact CG1-CE2 4.34Å; V48-F62 HydrophobicContact CG1-CZ 3.53Å; V48-F62 HydrophobicContact CG2-CD2 4.49Å; V48-F62 HydrophobicContact CG2-CE1 4.47Å; V48-F62 HydrophobicContact CG2-CE2 3.8Å; V48-F62 HydrophobicContact CG2-CZ 3.8Å; V48-F62 PolarHBondContact N-O 2.89Å; V48-F62 PolarHBondContact O-N 2.87Å; V48-F62 VanDerWaalsContact O-N 3.11Å; F62-V64 HydrophobicContact CD2-CG2 4.34Å; F62-V64 HydrophobicContact CE2-CG2 4.04Å; F62-I84 HydrophobicContact CE1-CD1 4.3Å; F62-F95 HydrophobicContact CD2-CD1 4.22Å; F62-F95 HydrophobicContact CD2-CE1 4.42Å; F62-F95 HydrophobicContact CE2-CB 4.09Å; F62-F95 AromaticContact CE2-CD1 3.71Å; F62-F95 HydrophobicContact CE2-CD1 3.71Å; F62-F95 AromaticContact CE2-CD2 3.92Å; F62-F95 HydrophobicContact CE2-CD2 3.92Å; F62-F95 HydrophobicContact CE2-CE1 4.08Å; F62-F95 HydrophobicContact CE2-CE2 4.26Å; F62-F95 AromaticContact CE2-CG 3.63Å; F62-F95 HydrophobicContact CE2-CG 3.63Å; F62-F95 HydrophobicContact CE2-CZ 4.35Å; F62-F95 HydrophobicContact CZ-CB 3.86Å; F62-F95 HydrophobicContact CZ-CD1 4.35Å; F62-F95 HydrophobicContact CZ-CD2 4.27Å; F62-F95 AromaticContact CZ-CG 3.92Å; F62-F95 HydrophobicContact CZ-CG 3.92Å
63	T	93.2	Very high	88.5	Confident	77 Å²	77	61.8 Å²	61.8	47%	0.472	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	138.9	-172.3	-54	0	0	0	0	109.9	G46 D47 E65	G46-T63 CarbonylContact O-C 3.56Å; G46-T63 WeakPolarHBondContact O-CA 3.41Å; D47-T63 WeakPolarHBondContact OD1-CB 3.47Å; D47-T63 WeakPolarHBondContact OD1-CG2 3.42Å; D47-T63 PolarHBondContact OD1-OG1 2.92Å; T63-E65 HydrophobicContact CG2-CG 4.28Å
64	V	89	Confident	88.5	Confident	20 Å²	20	58.3 Å²	58.3	12%	0.121	31%	0.31	C	S	.	.			trans	-103.1	-5.2	179.5	-173.4	0	0	0	0	111.7	G46 V48 F62 S66 I68 V86 H88 F95	G46-V64 PolarHBondContact O-N 3.28Å; V48-V64 HydrophobicContact CG2-CG2 4.09Å; F62-V64 HydrophobicContact CD2-CG2 4.34Å; F62-V64 HydrophobicContact CE2-CG2 4.04Å; V64-S66 PolarHBondContact O-N 3.28Å; V64-S66 PolarHBondContact O-OG 2.99Å; V64-I68 HydrophobicContact CG2-CD1 4.26Å; V64-V86 HydrophobicContact CG2-CG1 4.36Å; V64-H88 HydrophobicContact CG1-CB 4.29Å; V64-H88 VanDerWaalsContact CG1-CD2 3.47Å; V64-H88 WeakPolarHBondContact CG1-CD2 3.16Å; V64-F95 HydrophobicContact CG1-CZ 4.32Å; V64-F95 HydrophobicContact CG2-CE2 4.06Å; V64-F95 HydrophobicContact CG2-CZ 3.96Å
65	E	84.3	Confident	88.4	Confident	182 Å²	182	57.4 Å²	57.4	85%	0.85	31%	0.305	S	S	*	.	S	Bend	trans	64.4	10.6	176.8	-56.2	-175.3	169.4	0	0	115.3	T63	T63-E65 HydrophobicContact CG2-CG 4.28Å
66	S	88	Confident	88.2	Confident	7 Å²	7	51.9 Å²	51.9	5%	0.049	27%	0.272	C	S	.	.	S	Bend	trans	-145.4	152.2	-178.4	51.4	0	0	0	0	111.1	G46 V64 I68 H88 N89	G46-S66 WeakPolarHBondContact CA-O 3.36Å; V64-S66 PolarHBondContact O-N 3.28Å; V64-S66 PolarHBondContact O-OG 2.99Å; S66-I68 PolarHBondContact O-N 2.66Å; S66-H88 WeakPolarHBondContact OG-CB 3.48Å; S66-H88 PolarHBondContact OG-ND1 3.11Å; S66-N89 VanDerWaalsContact CB-ND2 3.33Å; S66-N89 WeakPolarHBondContact CB-ND2 3.42Å
67	P	86.7	Confident	87.5	Confident	71 Å²	71	55.7 Å²	55.7	46%	0.461	28%	0.283	S	S	.	.			trans	-59.1	127.3	176.4	-25.1	35.4	0	0	0	112.1	T44 H88	T44-P67 WeakPolarHBondContact O-CA 3.36Å; T44-P67 WeakPolarHBondContact O-CB 3.4Å; P67-H88 WeakPolarHBondContact O-CA 3.38Å; P67-H88 WeakPolarHBondContact O-CB 3.46Å
68	I	90.8	Very high	86.6	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	129.9	178.9	-63.8	165.8	0	0	0	109	A42 V48 V64 S66 I71 V86 C87 H88	A42-I68 HydrophobicContact CB-CB 4.12Å; A42-I68 HydrophobicContact CB-CD1 3.78Å; A42-I68 HydrophobicContact CB-CG2 3.63Å; V48-I68 HydrophobicContact CG2-CD1 3.54Å; V64-I68 HydrophobicContact CG2-CD1 4.26Å; S66-I68 PolarHBondContact O-N 2.66Å; I68-I71 HydrophobicContact CG2-CG2 3.83Å; I68-V86 HydrophobicContact CB-CG1 4.26Å; I68-V86 HydrophobicContact CD1-CG1 3.75Å; I68-V86 HydrophobicContact CG1-CG1 3.59Å; I68-V86 HydrophobicContact CG2-CG1 3.7Å; I68-C87 WeakPolarHBondContact CA-O 3.17Å; I68-H88 HydrophobicContact CG1-CB 4.45Å
69	T	86.9	Confident	85.6	Confident	34 Å²	34	58.6 Å²	58.6	21%	0.209	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-45.4	-177.8	61.7	0	0	0	0	111.2	S17 C87 H112 V113	S17-T69 WeakPolarHBondContact CB-O 3.35Å; S17-T69 PolarHBondContact OG-O 3.18Å; T69-C87 PolarHBondContact N-O 2.98Å; T69-C87 PolarHBondContact OG1-O 3.49Å; T69-H112 HydrophobicContact CG2-CB 3.89Å; T69-V113 WeakPolarHBondContact CB-O 3.41Å; T69-V113 PolarHBondContact OG1-O 2.77Å
70	C	89	Confident	84.5	Confident	3 Å²	3	61 Å²	61	2%	0.02	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.7	175.6	62.2	0	0	0	0	111.8	C87	C70-C87 PolarHBondContact O-N 3.37Å; C70-C87 VanDerWaalsContact SG-CB 3.55Å; C70-C87 VanDerWaalsContact SG-SG 3.68Å
71	I	93	Very high	83.8	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	153.2	172.7	67.2	167.2	0	0	0	111.3	N19 S20 K22 I40 A42 I68 I85 V86	N19-I71 PolarHBondContact O-N 3.35Å; S20-I71 WeakPolarHBondContact O-CD1 3.46Å; K22-I71 HydrophobicContact CB-CD1 4.42Å; K22-I71 VanDerWaalsContact CE-O 3.3Å; K22-I71 WeakPolarHBondContact CE-O 3.49Å; K22-I71 HydrophobicContact CG-CD1 4.18Å; K22-I71 HydrophobicContact CG-CG1 4.07Å; I40-I71 HydrophobicContact CB-CD1 4.5Å; I40-I71 HydrophobicContact CG2-CD1 3.89Å; A42-I71 HydrophobicContact CB-CG2 3.63Å; I68-I71 HydrophobicContact CG2-CG2 3.83Å; I71-I85 VanDerWaalsContact CA-O 3.3Å; I71-I85 WeakPolarHBondContact CA-O 3.31Å; I71-V86 HydrophobicContact CG2-CG1 4.37Å; I71-V86 HydrophobicContact CG2-CG2 4.23Å
72	D	92	Very high	83.4	Confident	23 Å²	23	57.8 Å²	57.8	12%	0.123	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	165.8	169.2	-160.7	23.2	0	0	0	111.9	K22 I85 I116 I118	K22-D72 VanDerWaalsContact CE-OD1 3.22Å; K22-D72 WeakPolarHBondContact CE-OD1 3.43Å; K22-D72 IonicContact NZ-OD1 3.21Å; K22-D72 PolarHBondContact NZ-OD1 3.41Å; D72-I85 PolarHBondContact N-O 3.32Å; D72-I85 PolarHBondContact O-N 3.29Å; D72-I116 HydrophobicContact CB-CG2 3.83Å; D72-I118 HydrophobicContact CB-CD1 3.68Å; D72-I118 HydrophobicContact CB-CG1 4.49Å
73	I	89.7	Confident	83.2	Confident	38 Å²	38	56.9 Å²	56.9	20%	0.195	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	118.8	179.8	-63.7	171.4	0	0	0	108.8	K22 I23 L24 Q82	K22-I73 HydrophobicContact CB-CD1 3.4Å; K22-I73 VanDerWaalsContact CB-CD1 3.4Å; K22-I73 HydrophobicContact CB-CG1 3.74Å; K22-I73 HydrophobicContact CG-CD1 4.33Å; K22-I73 HydrophobicContact CG-CG1 4.19Å; I23-I73 VanDerWaalsContact C-CD1 3.43Å; I23-I73 WeakPolarHBondContact O-CD1 3.34Å; L24-I73 HydrophobicContact CD2-CD1 3.61Å; L24-I73 HydrophobicContact CD2-CG1 3.98Å; L24-I73 HydrophobicContact CD2-CG2 3.74Å; L24-I73 HydrophobicContact CG-CD1 3.78Å; I73-Q82 HydrophobicContact CG2-CB 4.46Å; I73-Q82 HydrophobicContact CG2-CG 4.45Å
74	G	85.2	Confident	83.2	Confident	3 Å²	3	53.3 Å²	53.3	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	169.1	171.9	0	0	0	0	0	111.8	Q82 R83	G74-Q82 WeakPolarHBondContact O-CA 3.44Å; G74-R83 PolarHBondContact N-O 2.69Å; G74-R83 WeakPolarHBondContact O-CG 3.41Å; G74-R83 PolarHBondContact O-N 3.16Å
75	T	81.2	Confident	83.4	Confident	31 Å²	31	52.3 Å²	52.3	19%	0.19	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	157.9	165.7	53.9	0	0	0	0	111	N79 K81 R83	T75-N79 PolarHBondContact OG1-OD1 3.32Å; T75-K81 CarbonylContact C-O 3.56Å; T75-K81 VanDerWaalsContact CA-O 3.23Å; T75-K81 WeakPolarHBondContact CA-O 3.46Å; T75-R83 PolarHBondContact O-NE 2.92Å; T75-R83 PolarHBondContact O-NH2 3.26Å
76	Y	73	Confident	83.8	Confident	51 Å²	51	43.7 Å²	43.7	20%	0.2	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	165	172.6	73.8	-75.3	0	0	0	109.9	K81 Q82 R83 I102	Y76-K81 HydrophobicContact CD1-CB 3.82Å; Y76-K81 VanDerWaalsContact CD1-O 3.25Å; Y76-K81 WeakPolarHBondContact CD1-O 3.31Å; Y76-K81 HydrophobicContact CE1-CB 3.36Å; Y76-K81 HydrophobicContact CE2-CB 4.16Å; Y76-K81 HydrophobicContact CE2-CD 4.17Å; Y76-K81 HydrophobicContact CG-CB 4.41Å; Y76-K81 PolarHBondContact N-O 3.33Å; Y76-K81 PolarHBondContact O-N 2.95Å; Y76-K81 VanDerWaalsContact O-N 3.15Å; Y76-Q82 WeakPolarHBondContact CE1-O 3.39Å; Y76-R83 HydrophobicContact CD1-CB 3.74Å; Y76-R83 HydrophobicContact CD1-CG 3.94Å; Y76-R83 HydrophobicContact CE1-CB 4.03Å; Y76-I102 HydrophobicContact CD1-CD1 4.36Å; Y76-I102 HydrophobicContact CE1-CD1 3.93Å; Y76-I102 HydrophobicContact CE2-CD1 4.44Å
77	Q	67.6	Low	84.1	Confident	106 Å²	106	43.3 Å²	43.3	50%	0.495	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	71.1	-171.9	-68.3	177.8	-10.5	0	0	111.6	N79 E80 K81	Q77-N79 VanDerWaalsContact C-N 3.26Å; Q77-N79 PolarHBondContact O-N 3.26Å; Q77-N79 VanDerWaalsContact O-N 3.16Å; Q77-E80 WeakPolarHBondContact O-CB 3.48Å; Q77-E80 WeakPolarHBondContact O-CG 3.43Å; Q77-E80 PolarHBondContact O-N 3.07Å; Q77-K81 VanDerWaalsContact OE1-CD 3.26Å; Q77-K81 VanDerWaalsContact OE1-CE 3.25Å
78	N	67.4	Low	84.2	Confident	158 Å²	158	40.4 Å²	40.4	85%	0.845	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	42	176.8	-65.1	-8	0	0	0	114.4	E80	N78-E80 PolarHBondContact O-N 3.23Å
79	N	68.4	Low	83.9	Confident	85 Å²	85	43.5 Å²	43.5	46%	0.455	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	66	12.4	-179.1	-60.9	-22.5	0	0	0	116.4	T75 Q77	T75-N79 PolarHBondContact OG1-OD1 3.32Å; Q77-N79 VanDerWaalsContact C-N 3.26Å; Q77-N79 PolarHBondContact O-N 3.26Å; Q77-N79 VanDerWaalsContact O-N 3.16Å
80	E	69.5	Low	83.8	Confident	141 Å²	141	45.9 Å²	45.9	66%	0.659	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-30.9	-179.2	-63.9	-174.3	170.7	0	0	113.8	Q77 N78	Q77-E80 WeakPolarHBondContact O-CB 3.48Å; Q77-E80 WeakPolarHBondContact O-CG 3.43Å; Q77-E80 PolarHBondContact O-N 3.07Å; N78-E80 PolarHBondContact O-N 3.23Å
81	K	77.6	Confident	83.9	Confident	94 Å²	94	47.1 Å²	47.1	41%	0.409	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.5	-176.1	-65.2	-174.5	-173.2	154.9	0	111.9	T75 Y76 Q77	T75-K81 CarbonylContact C-O 3.56Å; T75-K81 VanDerWaalsContact CA-O 3.23Å; T75-K81 WeakPolarHBondContact CA-O 3.46Å; Y76-K81 HydrophobicContact CD1-CB 3.82Å; Y76-K81 VanDerWaalsContact CD1-O 3.25Å; Y76-K81 WeakPolarHBondContact CD1-O 3.31Å; Y76-K81 HydrophobicContact CE1-CB 3.36Å; Y76-K81 HydrophobicContact CE2-CB 4.16Å; Y76-K81 HydrophobicContact CE2-CD 4.17Å; Y76-K81 HydrophobicContact CG-CB 4.41Å; Y76-K81 PolarHBondContact N-O 3.33Å; Y76-K81 PolarHBondContact O-N 2.95Å; Y76-K81 VanDerWaalsContact O-N 3.15Å; Q77-K81 VanDerWaalsContact OE1-CD 3.26Å; Q77-K81 VanDerWaalsContact OE1-CE 3.25Å
82	Q	85.3	Confident	83.9	Confident	48 Å²	48	47 Å²	47	22%	0.224	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	142.8	174.2	-70.3	170.5	-14.5	0	0	111.1	L24 L25 I73 G74 Y76 P97	L24-Q82 HydrophobicContact CD2-CB 3.91Å; L24-Q82 HydrophobicContact CD2-CG 4.37Å; L25-Q82 PolarHBondContact O-NE2 2.85Å; L25-Q82 PolarHBondContact O-OE1 3.45Å; I73-Q82 HydrophobicContact CG2-CB 4.46Å; I73-Q82 HydrophobicContact CG2-CG 4.45Å; G74-Q82 WeakPolarHBondContact O-CA 3.44Å; Y76-Q82 WeakPolarHBondContact CE1-O 3.39Å; Q82-P97 WeakPolarHBondContact O-CD 3.13Å
83	R	89.4	Confident	84	Confident	15 Å²	15	46 Å²	46	6%	0.057	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.7	172.3	54.1	177.5	172.7	172.6	4.4	109.3	G74 T75 Y76 I85 F95 I102 S120	G74-R83 PolarHBondContact N-O 2.69Å; G74-R83 WeakPolarHBondContact O-CG 3.41Å; G74-R83 PolarHBondContact O-N 3.16Å; T75-R83 PolarHBondContact O-NE 2.92Å; T75-R83 PolarHBondContact O-NH2 3.26Å; Y76-R83 HydrophobicContact CD1-CB 3.74Å; Y76-R83 HydrophobicContact CD1-CG 3.94Å; Y76-R83 HydrophobicContact CE1-CB 4.03Å; R83-I85 HydrophobicContact CG-CG1 4.42Å; R83-F95 CarbonylContact C-O 3.57Å; R83-F95 WeakPolarHBondContact CA-O 3.47Å; R83-I102 HydrophobicContact CB-CD1 3.81Å; R83-S120 PolarHBondContact NH2-O 2.66Å
84	I	92.8	Very high	84.1	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.2	171.3	-55.2	168.7	0	0	0	106.2	L24 I40 F62 V86 G94 F95	L24-I84 HydrophobicContact CD1-CD1 4.31Å; L24-I84 HydrophobicContact CD1-CG1 4.32Å; I40-I84 HydrophobicContact CD1-CD1 3.98Å; I40-I84 HydrophobicContact CG1-CD1 4.06Å; I40-I84 HydrophobicContact CG2-CD1 4.17Å; I40-I84 HydrophobicContact CG2-CG2 4.22Å; F62-I84 HydrophobicContact CE1-CD1 4.3Å; I84-V86 HydrophobicContact CG2-CG2 3.92Å; I84-G94 CarbonylContact O-C 3.56Å; I84-G94 WeakPolarHBondContact O-CA 3.33Å; I84-F95 PolarHBondContact N-O 3.43Å; I84-F95 PolarHBondContact O-N 3.36Å
85	I	93.2	Very high	84.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	130.3	172	-54.9	-158.2	0	0	0	107.7	I71 D72 R83 I92 S93 F103 I116 I118 I123	I71-I85 VanDerWaalsContact CA-O 3.3Å; I71-I85 WeakPolarHBondContact CA-O 3.31Å; D72-I85 PolarHBondContact N-O 3.32Å; D72-I85 PolarHBondContact O-N 3.29Å; R83-I85 HydrophobicContact CG-CG1 4.42Å; I85-I92 HydrophobicContact CG2-CG2 3.52Å; I85-S93 WeakPolarHBondContact CA-O 3.48Å; I85-F103 HydrophobicContact CD1-CZ 4.19Å; I85-I116 HydrophobicContact CG2-CD1 3.8Å; I85-I118 HydrophobicContact CB-CD1 3.89Å; I85-I118 HydrophobicContact CD1-CD1 3.27Å; I85-I118 HydrophobicContact CD1-CG1 3.85Å; I85-I118 HydrophobicContact CD1-CG2 4.45Å; I85-I118 HydrophobicContact CG1-CD1 3.59Å; I85-I123 HydrophobicContact CD1-CD1 4.11Å; I85-I123 HydrophobicContact CD1-CG1 4.47Å
86	V	93.9	Very high	84.9	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.1	-177.4	-177	0	0	0	0	108.2	V48 V64 I68 I71 I84 S93 F95	V48-V86 HydrophobicContact CG2-CG2 4.08Å; V64-V86 HydrophobicContact CG2-CG1 4.36Å; I68-V86 HydrophobicContact CB-CG1 4.26Å; I68-V86 HydrophobicContact CD1-CG1 3.75Å; I68-V86 HydrophobicContact CG1-CG1 3.59Å; I68-V86 HydrophobicContact CG2-CG1 3.7Å; I71-V86 HydrophobicContact CG2-CG1 4.37Å; I71-V86 HydrophobicContact CG2-CG2 4.23Å; I84-V86 HydrophobicContact CG2-CG2 3.92Å; V86-S93 PolarHBondContact N-O 3.36Å; V86-S93 PolarHBondContact O-N 2.7Å; V86-F95 HydrophobicContact CB-CD2 4.37Å; V86-F95 HydrophobicContact CB-CE2 4.17Å; V86-F95 HydrophobicContact CG2-CD2 3.9Å; V86-F95 HydrophobicContact CG2-CE2 4.13Å
87	C	92.6	Very high	85.5	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	126.4	172.4	-66.1	0	0	0	0	109.4	I68 T69 C70 N91 V113	I68-C87 WeakPolarHBondContact CA-O 3.17Å; T69-C87 PolarHBondContact N-O 2.98Å; T69-C87 PolarHBondContact OG1-O 3.49Å; C70-C87 PolarHBondContact O-N 3.37Å; C70-C87 VanDerWaalsContact SG-CB 3.55Å; C70-C87 VanDerWaalsContact SG-SG 3.68Å; C87-N91 WeakPolarHBondContact CA-O 3.29Å; C87-V113 HydrophobicContact CB-CB 3.9Å; C87-V113 HydrophobicContact CB-CG1 4.29Å; C87-V113 HydrophobicContact CB-CG2 4.35Å
88	H	90.7	Very high	86.3	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.046	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	140.4	-176.9	64.3	93	0	0	0	110.2	V64 S66 P67 I68 F90 N91 S93 E104	V64-H88 HydrophobicContact CG1-CB 4.29Å; V64-H88 VanDerWaalsContact CG1-CD2 3.47Å; V64-H88 WeakPolarHBondContact CG1-CD2 3.16Å; S66-H88 WeakPolarHBondContact OG-CB 3.48Å; S66-H88 PolarHBondContact OG-ND1 3.11Å; P67-H88 WeakPolarHBondContact O-CA 3.38Å; P67-H88 WeakPolarHBondContact O-CB 3.46Å; I68-H88 HydrophobicContact CG1-CB 4.45Å; H88-F90 PolarHBondContact O-N 3.17Å; H88-N91 PolarHBondContact N-O 3.41Å; H88-N91 PolarHBondContact O-N 2.95Å; H88-S93 PolarHBondContact NE2-OG 3.34Å; H88-E104 IonicContact CE1-OE1 3.68Å; H88-E104 IonicContact NE2-OE1 4Å
89	N	83.1	Confident	87.3	Confident	68 Å²	68	42 Å²	42	36%	0.364	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	-101	-172.3	-68.9	-21.8	0	0	0	112.7	S66 H112	S66-N89 VanDerWaalsContact CB-ND2 3.33Å; S66-N89 WeakPolarHBondContact CB-ND2 3.42Å; N89-H112 PolarHBondContact O-ND1 3.32Å
90	F	86.3	Confident	88.4	Confident	84 Å²	84	45.6 Å²	45.6	37%	0.368	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	13.1	178.2	-52.5	-63	0	0	0	112.1	H88 S107 G111	H88-F90 PolarHBondContact O-N 3.17Å; F90-S107 VanDerWaalsContact O-CB 3.24Å; F90-S107 WeakPolarHBondContact O-CB 3.42Å; F90-S107 PolarHBondContact O-N 3.07Å; F90-G111 VanDerWaalsContact CD1-O 3.24Å; F90-G111 WeakPolarHBondContact CD1-O 3.31Å; F90-G111 VanDerWaalsContact CE1-N 3.26Å
91	N	90.4	Very high	89.5	Confident	30 Å²	30	43.2 Å²	43.2	16%	0.16	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	147.1	-171	-66.5	-5.5	0	0	0	111.2	C87 H88 E104 H105 H106	C87-N91 WeakPolarHBondContact CA-O 3.29Å; H88-N91 PolarHBondContact N-O 3.41Å; H88-N91 PolarHBondContact O-N 2.95Å; N91-E104 HydrophobicContact CB-CG 4.4Å; N91-E104 PolarHBondContact ND2-OE1 3.32Å; N91-H105 CarbonylContact C-O 3.59Å; N91-H105 WeakPolarHBondContact CA-O 3.42Å; N91-H106 PolarHBondContact OD1-ND1 3.1Å
92	I	92.7	Very high	90.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.1	169	-55.4	176.7	0	0	0	106.7	I85 F103 H105 V113 I116 I123 Y125 L134	I85-I92 HydrophobicContact CG2-CG2 3.52Å; I92-F103 HydrophobicContact CG2-CE2 4.26Å; I92-F103 HydrophobicContact CG2-CZ 4.47Å; I92-F103 VanDerWaalsContact O-CE2 3.24Å; I92-F103 WeakPolarHBondContact O-CE2 3.24Å; I92-H105 PolarHBondContact N-O 3.15Å; I92-H105 PolarHBondContact O-N 3.44Å; I92-V113 HydrophobicContact CG1-CG2 4.49Å; I92-I116 HydrophobicContact CG2-CD1 4.18Å; I92-I123 HydrophobicContact CD1-CG2 4.35Å; I92-I123 HydrophobicContact CG2-CD1 4.5Å; I92-Y125 HydrophobicContact CD1-CD1 3.66Å; I92-Y125 HydrophobicContact CD1-CD2 4.28Å; I92-Y125 HydrophobicContact CD1-CE1 3.94Å; I92-Y125 HydrophobicContact CD1-CG 3.82Å; I92-L134 HydrophobicContact CD1-CD1 4.21Å
93	S	93.2	Very high	90.4	Very high	1 Å²	1	41 Å²	41	1%	0.007	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	136.9	-178.3	-64.7	0	0	0	0	111.1	I85 V86 H88 F95 F103 E104	I85-S93 WeakPolarHBondContact CA-O 3.48Å; V86-S93 PolarHBondContact N-O 3.36Å; V86-S93 PolarHBondContact O-N 2.7Å; H88-S93 PolarHBondContact NE2-OG 3.34Å; S93-F95 VanDerWaalsContact CB-CE2 3.48Å; S93-F103 WeakPolarHBondContact CA-O 2.98Å; S93-E104 WeakPolarHBondContact OG-CG 3.38Å
94	G	92.4	Very high	90.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.4	175.2	0	0	0	0	0	111.5	I84 Q101 I102 F103	I84-G94 CarbonylContact O-C 3.56Å; I84-G94 WeakPolarHBondContact O-CA 3.33Å; G94-Q101 CarbonylContact O-C 3.59Å; G94-I102 WeakPolarHBondContact O-CB 3.14Å; G94-I102 PolarHBondContact O-N 3.45Å; G94-F103 PolarHBondContact N-O 3.5Å; G94-F103 PolarHBondContact O-N 3.12Å
95	F	93	Very high	90.4	Very high	9 Å²	9	46.2 Å²	46.2	4%	0.039	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	146.8	178.8	-61.6	-92.2	0	0	0	111.1	F62 V64 R83 I84 V86 S93 K100 Q101	F62-F95 HydrophobicContact CD2-CD1 4.22Å; F62-F95 HydrophobicContact CD2-CE1 4.42Å; F62-F95 HydrophobicContact CE2-CB 4.09Å; F62-F95 AromaticContact CE2-CD1 3.71Å; F62-F95 HydrophobicContact CE2-CD1 3.71Å; F62-F95 AromaticContact CE2-CD2 3.92Å; F62-F95 HydrophobicContact CE2-CD2 3.92Å; F62-F95 HydrophobicContact CE2-CE1 4.08Å; F62-F95 HydrophobicContact CE2-CE2 4.26Å; F62-F95 AromaticContact CE2-CG 3.63Å; F62-F95 HydrophobicContact CE2-CG 3.63Å; F62-F95 HydrophobicContact CE2-CZ 4.35Å; F62-F95 HydrophobicContact CZ-CB 3.86Å; F62-F95 HydrophobicContact CZ-CD1 4.35Å; F62-F95 HydrophobicContact CZ-CD2 4.27Å; F62-F95 AromaticContact CZ-CG 3.92Å; F62-F95 HydrophobicContact CZ-CG 3.92Å; V64-F95 HydrophobicContact CG1-CZ 4.32Å; V64-F95 HydrophobicContact CG2-CE2 4.06Å; V64-F95 HydrophobicContact CG2-CZ 3.96Å; R83-F95 CarbonylContact C-O 3.57Å; R83-F95 WeakPolarHBondContact CA-O 3.47Å; I84-F95 PolarHBondContact N-O 3.43Å; I84-F95 PolarHBondContact O-N 3.36Å; V86-F95 HydrophobicContact CB-CD2 4.37Å; V86-F95 HydrophobicContact CB-CE2 4.17Å; V86-F95 HydrophobicContact CG2-CD2 3.9Å; V86-F95 HydrophobicContact CG2-CE2 4.13Å; S93-F95 VanDerWaalsContact CB-CE2 3.48Å; F95-K100 CarbonylContact C-O 3.46Å; F95-K100 WeakPolarHBondContact CA-O 3.12Å; F95-Q101 HydrophobicContact CD1-CB 3.87Å; F95-Q101 HydrophobicContact CD1-CG 4.28Å; F95-Q101 HydrophobicContact CE1-CB 3.67Å; F95-Q101 HydrophobicContact CE1-CG 3.84Å; F95-Q101 HydrophobicContact CZ-CG 4.21Å
96	T	90.6	Very high	90.2	Very high	24 Å²	24	51.8 Å²	51.8	15%	0.147	25%	0.251	C	S	.	.			trans	-66.9	159.6	165.1	62.8	0	0	0	0	109.7	K98 G99 K100 I102	T96-K98 PolarHBondContact O-N 3.11Å; T96-K98 PolarHBondContact OG1-N 2.73Å; T96-G99 PolarHBondContact O-N 3.03Å; T96-K100 HydrophobicContact CG2-CB 4.22Å; T96-K100 PolarHBondContact N-O 2.93Å; T96-K100 WeakPolarHBondContact OG1-CB 3.48Å; T96-K100 PolarHBondContact OG1-N 3.17Å; T96-K100 PolarHBondContact OG1-O 3.5Å; T96-I102 HydrophobicContact CG2-CD1 3.75Å; T96-I102 HydrophobicContact CG2-CG1 3.72Å
97	P	85.3	Confident	89.8	Confident	49 Å²	49	52 Å²	52	32%	0.318	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-7.6	173.1	-26.1	35.6	0	0	0	115	L24 Q82	L24-P97 HydrophobicContact CD1-CB 4.2Å; L24-P97 HydrophobicContact CD1-CG 4.4Å; Q82-P97 WeakPolarHBondContact O-CD 3.13Å
98	K	85.5	Confident	89.4	Confident	203 Å²	203	57.8 Å²	57.8	88%	0.883	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	4.6	175.1	-63.3	-174	177.7	-176.3	0	113.2	T96	T96-K98 PolarHBondContact O-N 3.11Å; T96-K98 PolarHBondContact OG1-N 2.73Å
99	G	87.9	Confident	89.2	Confident	20 Å²	20	57.8 Å²	57.8	21%	0.206	28%	0.283	C	S	.	.	S	Bend	trans	84.7	2.4	179.2	0	0	0	0	0	115.7	T96 Q101	T96-G99 PolarHBondContact O-N 3.03Å; G99-Q101 PolarHBondContact O-N 2.98Å
100	K	91.6	Very high	89.2	Confident	159 Å²	159	63.3 Å²	63.3	69%	0.691	31%	0.307	S	S	*	.			trans	-73.2	121.3	172	-175.6	179.2	179.4	178.2	0	110.1	F95 T96	F95-K100 CarbonylContact C-O 3.46Å; F95-K100 WeakPolarHBondContact CA-O 3.12Å; T96-K100 HydrophobicContact CG2-CB 4.22Å; T96-K100 PolarHBondContact N-O 2.93Å; T96-K100 WeakPolarHBondContact OG1-CB 3.48Å; T96-K100 PolarHBondContact OG1-N 3.17Å; T96-K100 PolarHBondContact OG1-O 3.5Å
101	Q	92.1	Very high	89.1	Confident	91 Å²	91	60.4 Å²	60.4	43%	0.425	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	133.8	174.2	-165.7	173.2	-17	0	0	110.9	G94 F95 G99 E104	G94-Q101 CarbonylContact O-C 3.59Å; F95-Q101 HydrophobicContact CD1-CB 3.87Å; F95-Q101 HydrophobicContact CD1-CG 4.28Å; F95-Q101 HydrophobicContact CE1-CB 3.67Å; F95-Q101 HydrophobicContact CE1-CG 3.84Å; F95-Q101 HydrophobicContact CZ-CG 4.21Å; G99-Q101 PolarHBondContact O-N 2.98Å; Q101-E104 VanDerWaalsContact NE2-CB 3.28Å; Q101-E104 PolarHBondContact NE2-OE2 3.24Å; Q101-E104 VanDerWaalsContact NE2-OE2 3.08Å
102	I	90.5	Very high	88.9	Confident	69 Å²	69	63.6 Å²	63.6	35%	0.354	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	-42.9	-177.9	-55.7	172.6	0	0	0	109.7	Y76 R83 G94 T96	Y76-I102 HydrophobicContact CD1-CD1 4.36Å; Y76-I102 HydrophobicContact CE1-CD1 3.93Å; Y76-I102 HydrophobicContact CE2-CD1 4.44Å; R83-I102 HydrophobicContact CB-CD1 3.81Å; G94-I102 WeakPolarHBondContact O-CB 3.14Å; G94-I102 PolarHBondContact O-N 3.45Å; T96-I102 HydrophobicContact CG2-CD1 3.75Å; T96-I102 HydrophobicContact CG2-CG1 3.72Å
103	F	90.8	Very high	88.7	Confident	27 Å²	27	63.7 Å²	63.7	12%	0.118	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	163.3	177.6	74.2	-91.4	0	0	0	110	I85 I92 S93 G94 H105 I123 F137	I85-F103 HydrophobicContact CD1-CZ 4.19Å; I92-F103 HydrophobicContact CG2-CE2 4.26Å; I92-F103 HydrophobicContact CG2-CZ 4.47Å; I92-F103 VanDerWaalsContact O-CE2 3.24Å; I92-F103 WeakPolarHBondContact O-CE2 3.24Å; S93-F103 WeakPolarHBondContact CA-O 2.98Å; G94-F103 PolarHBondContact N-O 3.5Å; G94-F103 PolarHBondContact O-N 3.12Å; F103-H105 HydrophobicContact CD2-CB 4.45Å; F103-H105 HydrophobicContact CE2-CB 4.5Å; F103-I123 HydrophobicContact CZ-CD1 4.13Å; F103-F137 HydrophobicContact CB-CE1 4.42Å; F103-F137 HydrophobicContact CB-CZ 4.21Å; F103-F137 AromaticContact CD1-CE1 3.87Å; F103-F137 HydrophobicContact CD1-CE1 3.87Å; F103-F137 AromaticContact CD1-CZ 3.72Å; F103-F137 HydrophobicContact CD1-CZ 3.72Å; F103-F137 HydrophobicContact CD2-CD1 4.05Å; F103-F137 AromaticContact CD2-CE1 3.41Å; F103-F137 HydrophobicContact CD2-CE1 3.41Å; F103-F137 VanDerWaalsContact CD2-CE1 3.41Å; F103-F137 AromaticContact CD2-CZ 4Å; F103-F137 HydrophobicContact CD2-CZ 4Å; F103-F137 AromaticContact CE1-CE1 3.91Å; F103-F137 HydrophobicContact CE1-CE1 3.91Å; F103-F137 HydrophobicContact CE1-CZ 4.05Å; F103-F137 HydrophobicContact CE2-CD1 4.19Å; F103-F137 AromaticContact CE2-CE1 3.48Å; F103-F137 HydrophobicContact CE2-CE1 3.48Å; F103-F137 VanDerWaalsContact CE2-CE1 3.48Å; F103-F137 HydrophobicContact CE2-CZ 4.32Å; F103-F137 AromaticContact CG-CE1 3.63Å; F103-F137 HydrophobicContact CG-CE1 3.63Å; F103-F137 AromaticContact CG-CZ 3.7Å; F103-F137 HydrophobicContact CG-CZ 3.7Å; F103-F137 AromaticContact CZ-CE1 3.74Å; F103-F137 HydrophobicContact CZ-CE1 3.74Å; F103-F137 HydrophobicContact CZ-CZ 4.35Å
104	E	91.8	Very high	88.4	Confident	101 Å²	101	67.4 Å²	67.4	47%	0.472	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	129.4	165.6	169.7	165.2	-141.2	0	0	108.2	H88 N91 S93 Q101	H88-E104 IonicContact CE1-OE1 3.68Å; H88-E104 IonicContact NE2-OE1 4Å; N91-E104 HydrophobicContact CB-CG 4.4Å; N91-E104 PolarHBondContact ND2-OE1 3.32Å; S93-E104 WeakPolarHBondContact OG-CG 3.38Å; Q101-E104 VanDerWaalsContact NE2-CB 3.28Å; Q101-E104 PolarHBondContact NE2-OE2 3.24Å; Q101-E104 VanDerWaalsContact NE2-OE2 3.08Å
105	H	90.4	Very high	88.3	Confident	26 Å²	26	67.8 Å²	67.8	12%	0.12	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.1	178.4	174	79.1	0	0	0	108.3	N91 I92 F103 L134	N91-H105 CarbonylContact C-O 3.59Å; N91-H105 WeakPolarHBondContact CA-O 3.42Å; I92-H105 PolarHBondContact N-O 3.15Å; I92-H105 PolarHBondContact O-N 3.44Å; F103-H105 HydrophobicContact CD2-CB 4.45Å; F103-H105 HydrophobicContact CE2-CB 4.5Å; H105-L134 VanDerWaalsContact CD2-CD1 3.45Å; H105-L134 WeakPolarHBondContact CD2-CD1 3.17Å; H105-L134 WeakPolarHBondContact NE2-CD2 3.5Å
106	H	90.1	Very high	88.2	Confident	117 Å²	117	68.2 Å²	68.2	54%	0.542	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120.4	172.7	-172.6	63.9	0	0	0	108.9	N91	N91-H106 PolarHBondContact OD1-ND1 3.1Å
107	S	85.7	Confident	88.1	Confident	4 Å²	4	68.8 Å²	68.8	3%	0.028	34%	0.34	C	S	.	.			trans	-68	137.9	176.4	-177.9	0	0	0	0	110.2	F90 I109 Y125	F90-S107 VanDerWaalsContact O-CB 3.24Å; F90-S107 WeakPolarHBondContact O-CB 3.42Å; F90-S107 PolarHBondContact O-N 3.07Å; S107-I109 PolarHBondContact O-N 2.89Å; S107-I109 PolarHBondContact OG-N 2.87Å; S107-I109 VanDerWaalsContact OG-N 3.12Å; S107-Y125 WeakPolarHBondContact OG-CE2 3.49Å; S107-Y125 PolarHBondContact OG-OH 3Å
108	N	84	Confident	88.3	Confident	121 Å²	121	67.4 Å²	67.4	65%	0.647	33%	0.33	S	S	*	.	S	Bend	trans	-75.1	-4.8	171.7	-69.2	-31.8	0	0	0	112.7	D139	N108-D139 PolarHBondContact ND2-OD2 2.96Å
109	I	85.1	Confident	88.2	Confident	11 Å²	11	61.6 Å²	61.6	6%	0.056	31%	0.306	C	S	.	.	S	Bend	trans	-100.3	129.3	-178.2	-55.5	174.3	0	0	0	109.3	S107 G111 Y125 V127 M130 Q132 F142	S107-I109 PolarHBondContact O-N 2.89Å; S107-I109 PolarHBondContact OG-N 2.87Å; S107-I109 VanDerWaalsContact OG-N 3.12Å; I109-G111 PolarHBondContact O-N 3.44Å; I109-Y125 HydrophobicContact CD1-CE2 4.19Å; I109-V127 HydrophobicContact CB-CG2 4.38Å; I109-V127 HydrophobicContact CG2-CB 3.76Å; I109-V127 HydrophobicContact CG2-CG1 3.78Å; I109-V127 HydrophobicContact CG2-CG2 4.13Å; I109-M130 HydrophobicContact CB-CE 4.17Å; I109-M130 HydrophobicContact CD1-CB 4.16Å; I109-M130 HydrophobicContact CD1-CE 3.92Å; I109-M130 HydrophobicContact CG1-CE 3.71Å; I109-M130 HydrophobicContact CG2-CB 4.38Å; I109-M130 HydrophobicContact CG2-CE 3.5Å; I109-M130 VanDerWaalsContact CG2-CE 3.5Å; I109-M130 HydrophobicContact CG2-SD 3.56Å; I109-M130 VanDerWaalsContact CG2-SD 3.56Å; I109-Q132 HydrophobicContact CD1-CB 3.89Å; I109-Q132 HydrophobicContact CD1-CG 4.49Å; I109-F142 HydrophobicContact CD1-CE2 4.31Å
110	Q	84.2	Confident	87.9	Confident	184 Å²	184	63.7 Å²	63.7	86%	0.86	32%	0.317	S	S	*	.	S	Bend	trans	-77	119.2	173.2	-68.9	-174.8	-11.6	0	0	110.1
111	G	84.4	Confident	87.5	Confident	22 Å²	22	59.6 Å²	59.6	23%	0.227	31%	0.305	C	S	.	.	S	Bend	trans	140.7	167.8	175.1	0	0	0	0	0	111.8	F90 I109 V127	F90-G111 VanDerWaalsContact CD1-O 3.24Å; F90-G111 WeakPolarHBondContact CD1-O 3.31Å; F90-G111 VanDerWaalsContact CE1-N 3.26Å; I109-G111 PolarHBondContact O-N 3.44Å; G111-V127 VanDerWaalsContact CA-CG1 3.45Å
112	H	85.4	Confident	87.3	Confident	97 Å²	97	56.9 Å²	56.9	45%	0.449	29%	0.294	S	S	.	.			trans	-78.2	145.6	178	-65.8	-52	0	0	0	110.8	T69 N89 D114	T69-H112 HydrophobicContact CG2-CB 3.89Å; N89-H112 PolarHBondContact O-ND1 3.32Å; H112-D114 PolarHBondContact O-N 3.13Å
113	V	89.1	Confident	87.3	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	28%	0.277	C	S	.	.			trans	-75.8	116.4	175.3	179.8	0	0	0	0	109.3	T69 C87 I92 S115 Y125 T126 V127	T69-V113 WeakPolarHBondContact CB-O 3.41Å; T69-V113 PolarHBondContact OG1-O 2.77Å; C87-V113 HydrophobicContact CB-CB 3.9Å; C87-V113 HydrophobicContact CB-CG1 4.29Å; C87-V113 HydrophobicContact CB-CG2 4.35Å; I92-V113 HydrophobicContact CG1-CG2 4.49Å; V113-S115 WeakPolarHBondContact CG1-O 3.49Å; V113-Y125 HydrophobicContact CG1-CD2 4.48Å; V113-Y125 HydrophobicContact CG2-CD2 4.13Å; V113-T126 WeakPolarHBondContact CA-O 3.22Å; V113-V127 HydrophobicContact CG2-CG2 4.24Å
114	D	86.9	Confident	87.4	Confident	79 Å²	79	53.1 Å²	53.1	42%	0.422	28%	0.275	S	S	.	.			trans	-85.2	-40.6	-177.4	-61.3	-60.6	0	0	0	112.1	H112 T126 G128	H112-D114 PolarHBondContact O-N 3.13Å; D114-T126 PolarHBondContact N-O 3.14Å; D114-G128 PolarHBondContact OD2-N 3.16Å
115	S	89.1	Confident	87.4	Confident	7 Å²	7	48.3 Å²	48.3	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	146.9	178.4	-173.2	0	0	0	0	111	V113 Y125 T126 I152	V113-S115 WeakPolarHBondContact CG1-O 3.49Å; S115-Y125 VanDerWaalsContact O-CA 3.31Å; S115-Y125 WeakPolarHBondContact O-CA 3.48Å; S115-T126 WeakPolarHBondContact CB-OG1 3.49Å; S115-T126 PolarHBondContact N-OG1 3.25Å; S115-T126 PolarHBondContact O-N 3.06Å; S115-I152 PolarHBondContact OG-N 3.35Å
116	I	91.1	Very high	87.4	Confident	18 Å²	18	47.1 Å²	47.1	9%	0.092	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.3	176.1	-170.6	167.7	0	0	0	109.9	D72 I85 I92 I118 I123 Y124	D72-I116 HydrophobicContact CB-CG2 3.83Å; I85-I116 HydrophobicContact CG2-CD1 3.8Å; I92-I116 HydrophobicContact CG2-CD1 4.18Å; I116-I118 HydrophobicContact CG1-CG1 4.45Å; I116-I123 HydrophobicContact CD1-CG2 3.68Å; I116-I123 HydrophobicContact CG1-CG2 3.92Å; I116-Y124 CarbonylContact C-O 3.59Å; I116-Y124 VanDerWaalsContact CA-O 3.3Å; I116-Y124 WeakPolarHBondContact CA-O 3.48Å
117	F	90	Very high	87.5	Confident	37 Å²	37	42 Å²	42	16%	0.162	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	136.1	171.2	175.2	-105.4	0	0	0	109.1	Q119 Y124 I152 Y153	F117-Q119 HydrophobicContact CE1-CB 3.88Å; F117-Q119 HydrophobicContact CZ-CB 4.38Å; F117-Y124 AromaticContact CD1-CD2 3.63Å; F117-Y124 HydrophobicContact CD1-CD2 3.63Å; F117-Y124 HydrophobicContact CD1-CE2 4.2Å; F117-Y124 HydrophobicContact CD1-CG 4.31Å; F117-Y124 HydrophobicContact CE1-CD2 4.31Å; F117-Y124 HydrophobicContact CE1-CE2 4.45Å; F117-Y124 PolarHBondContact N-O 3.15Å; F117-Y124 WeakPolarHBondContact O-CD2 3.48Å; F117-Y124 PolarHBondContact O-N 3.44Å; F117-I152 HydrophobicContact CB-CG2 4.04Å; F117-Y153 HydrophobicContact CD2-CD2 4.34Å; F117-Y153 AromaticContact CE2-CD2 3.93Å; F117-Y153 HydrophobicContact CE2-CD2 3.93Å; F117-Y153 AromaticContact CE2-CE2 3.94Å; F117-Y153 HydrophobicContact CE2-CE2 3.94Å; F117-Y153 HydrophobicContact CZ-CD2 4.43Å; F117-Y153 HydrophobicContact CZ-CE2 4.31Å
118	I	88.5	Confident	87.7	Confident	20 Å²	20	42.9 Å²	42.9	10%	0.103	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.4	-177	-54.3	157.9	0	0	0	109.2	D72 I85 I116	D72-I118 HydrophobicContact CB-CD1 3.68Å; D72-I118 HydrophobicContact CB-CG1 4.49Å; I85-I118 HydrophobicContact CB-CD1 3.89Å; I85-I118 HydrophobicContact CD1-CD1 3.27Å; I85-I118 HydrophobicContact CD1-CG1 3.85Å; I85-I118 HydrophobicContact CD1-CG2 4.45Å; I85-I118 HydrophobicContact CG1-CD1 3.59Å; I116-I118 HydrophobicContact CG1-CG1 4.45Å
119	Q	84.2	Confident	88	Confident	81 Å²	81	37.3 Å²	37.3	38%	0.379	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	108.1	172.9	-169.5	174.1	-17	0	0	109.6	F117 T121 N122 Y124 N154	F117-Q119 HydrophobicContact CE1-CB 3.88Å; F117-Q119 HydrophobicContact CZ-CB 4.38Å; Q119-T121 PolarHBondContact O-N 3.46Å; Q119-N122 PolarHBondContact N-O 3.01Å; Q119-N122 WeakPolarHBondContact O-CB 3.38Å; Q119-N122 PolarHBondContact O-N 3.12Å; Q119-Y124 HydrophobicContact CB-CE2 4Å; Q119-N154 PolarHBondContact OE1-OD1 3.25Å
120	S	81.4	Confident	88.4	Confident	63 Å²	63	38.9 Å²	38.9	44%	0.441	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	-110.8	-176.6	-56.2	0	0	0	0	111.7	R83	R83-S120 PolarHBondContact NH2-O 2.66Å
121	T	81.7	Confident	88.7	Confident	73 Å²	73	30.9 Å²	30.9	45%	0.448	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.9	177.4	49.6	0	0	0	0	113.5	Q119	Q119-T121 PolarHBondContact O-N 3.46Å
122	N	88.8	Confident	89.1	Confident	34 Å²	34	30.5 Å²	30.5	18%	0.182	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	135.8	-175.5	-61.1	-4.7	0	0	0	110.2	Q119 Y124 Q133 L134 T135	Q119-N122 PolarHBondContact N-O 3.01Å; Q119-N122 WeakPolarHBondContact O-CB 3.38Å; Q119-N122 PolarHBondContact O-N 3.12Å; N122-Y124 HydrophobicContact CB-CD2 4.42Å; N122-Y124 HydrophobicContact CB-CE2 3.58Å; N122-Y124 PolarHBondContact ND2-OH 2.99Å; N122-Q133 PolarHBondContact ND2-NE2 3.34Å; N122-L134 CarbonylContact C-O 3.57Å; N122-L134 VanDerWaalsContact CA-O 3.25Å; N122-L134 WeakPolarHBondContact CA-O 3.37Å; N122-T135 WeakPolarHBondContact OD1-CG2 3.48Å
123	I	90.8	Very high	89.4	Confident	2 Å²	2	26.6 Å²	26.6	1%	0.01	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	123.3	174.1	-57.6	172.6	0	0	0	107	I85 I92 F103 I116 Q133 L134 F137	I85-I123 HydrophobicContact CD1-CD1 4.11Å; I85-I123 HydrophobicContact CD1-CG1 4.47Å; I92-I123 HydrophobicContact CD1-CG2 4.35Å; I92-I123 HydrophobicContact CG2-CD1 4.5Å; F103-I123 HydrophobicContact CZ-CD1 4.13Å; I116-I123 HydrophobicContact CD1-CG2 3.68Å; I116-I123 HydrophobicContact CG1-CG2 3.92Å; I123-Q133 WeakPolarHBondContact O-CA 3.37Å; I123-L134 HydrophobicContact CB-CB 4.19Å; I123-L134 HydrophobicContact CB-CD1 4.33Å; I123-L134 PolarHBondContact N-O 2.7Å; I123-L134 PolarHBondContact O-N 2.86Å; I123-F137 HydrophobicContact CD1-CE1 4.23Å
124	Y	91.6	Very high	89.4	Confident	15 Å²	15	26.4 Å²	26.4	6%	0.059	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	125.4	177.3	-57.3	-87.9	0	0	0	107	I116 F117 Q119 N122 Y131 Q133	I116-Y124 CarbonylContact C-O 3.59Å; I116-Y124 VanDerWaalsContact CA-O 3.3Å; I116-Y124 WeakPolarHBondContact CA-O 3.48Å; F117-Y124 AromaticContact CD1-CD2 3.63Å; F117-Y124 HydrophobicContact CD1-CD2 3.63Å; F117-Y124 HydrophobicContact CD1-CE2 4.2Å; F117-Y124 HydrophobicContact CD1-CG 4.31Å; F117-Y124 HydrophobicContact CE1-CD2 4.31Å; F117-Y124 HydrophobicContact CE1-CE2 4.45Å; F117-Y124 PolarHBondContact N-O 3.15Å; F117-Y124 WeakPolarHBondContact O-CD2 3.48Å; F117-Y124 PolarHBondContact O-N 3.44Å; Q119-Y124 HydrophobicContact CB-CE2 4Å; N122-Y124 HydrophobicContact CB-CD2 4.42Å; N122-Y124 HydrophobicContact CB-CE2 3.58Å; N122-Y124 PolarHBondContact ND2-OH 2.99Å; Y124-Y131 AromaticContact CD1-CE2 3.92Å; Y124-Y131 HydrophobicContact CD1-CE2 3.92Å; Y124-Y131 AromaticContact CD1-CZ 3.99Å; Y124-Y131 WeakPolarHBondContact CD1-OH 3.38Å; Y124-Q133 HydrophobicContact CD1-CB 4.11Å; Y124-Q133 HydrophobicContact CD1-CG 3.84Å; Y124-Q133 HydrophobicContact CE1-CB 4.21Å; Y124-Q133 VanDerWaalsContact CE1-CD 3.4Å; Y124-Q133 HydrophobicContact CE1-CG 3.57Å
125	Y	92.1	Very high	89.4	Confident	1 Å²	1	24.4 Å²	24.4	0%	0.004	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157	-178	72.3	-88.6	0	0	0	112.2	I92 S107 I109 V113 S115 V127 Q132 L134	I92-Y125 HydrophobicContact CD1-CD1 3.66Å; I92-Y125 HydrophobicContact CD1-CD2 4.28Å; I92-Y125 HydrophobicContact CD1-CE1 3.94Å; I92-Y125 HydrophobicContact CD1-CG 3.82Å; S107-Y125 WeakPolarHBondContact OG-CE2 3.49Å; S107-Y125 PolarHBondContact OG-OH 3Å; I109-Y125 HydrophobicContact CD1-CE2 4.19Å; V113-Y125 HydrophobicContact CG1-CD2 4.48Å; V113-Y125 HydrophobicContact CG2-CD2 4.13Å; S115-Y125 VanDerWaalsContact O-CA 3.31Å; S115-Y125 WeakPolarHBondContact O-CA 3.48Å; Y125-V127 HydrophobicContact CD2-CG2 4.19Å; Y125-V127 HydrophobicContact CE2-CG2 4.21Å; Y125-Q132 HydrophobicContact CD1-CB 4.06Å; Y125-Q132 HydrophobicContact CD1-CG 4.42Å; Y125-Q132 HydrophobicContact CD2-CB 4.42Å; Y125-Q132 HydrophobicContact CE1-CB 3.53Å; Y125-Q132 HydrophobicContact CE1-CG 3.52Å; Y125-Q132 HydrophobicContact CE2-CB 3.93Å; Y125-Q132 HydrophobicContact CE2-CG 4.47Å; Y125-Q132 HydrophobicContact CG-CB 4.49Å; Y125-Q132 VanDerWaalsContact CZ-CB 3.48Å; Y125-Q132 PolarHBondContact N-O 3.46Å; Y125-Q132 PolarHBondContact O-N 2.94Å; Y125-Q132 WeakPolarHBondContact OH-CG 3.44Å; Y125-L134 HydrophobicContact CD1-CD1 4.24Å; Y125-L134 HydrophobicContact CD1-CG 4.33Å; Y125-L134 HydrophobicContact CE1-CD1 3.8Å; Y125-L134 HydrophobicContact CE1-CD2 4.27Å; Y125-L134 HydrophobicContact CE1-CG 3.78Å
126	T	92	Very high	89.2	Confident	1 Å²	1	29 Å²	29	1%	0.006	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	145.9	-177.6	66.5	0	0	0	0	111.3	V113 D114 S115 M130 I149 I152	V113-T126 WeakPolarHBondContact CA-O 3.22Å; D114-T126 PolarHBondContact N-O 3.14Å; S115-T126 WeakPolarHBondContact CB-OG1 3.49Å; S115-T126 PolarHBondContact N-OG1 3.25Å; S115-T126 PolarHBondContact O-N 3.06Å; T126-M130 CarbonylContact C-O 3.6Å; T126-M130 WeakPolarHBondContact CA-O 3.48Å; T126-I149 HydrophobicContact CG2-CB 3.97Å; T126-I149 HydrophobicContact CG2-CD1 4.21Å; T126-I149 HydrophobicContact CG2-CG2 3.62Å; T126-I152 HydrophobicContact CG2-CB 4.28Å; T126-I152 HydrophobicContact CG2-CG2 4.2Å
127	V	91.7	Very high	88.8	Confident	9 Å²	9	32.5 Å²	32.5	6%	0.055	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	104.8	174.7	178.2	0	0	0	0	107.5	I109 G111 V113 Y125 C129 M130	I109-V127 HydrophobicContact CB-CG2 4.38Å; I109-V127 HydrophobicContact CG2-CB 3.76Å; I109-V127 HydrophobicContact CG2-CG1 3.78Å; I109-V127 HydrophobicContact CG2-CG2 4.13Å; G111-V127 VanDerWaalsContact CA-CG1 3.45Å; V113-V127 HydrophobicContact CG2-CG2 4.24Å; Y125-V127 HydrophobicContact CD2-CG2 4.19Å; Y125-V127 HydrophobicContact CE2-CG2 4.21Å; V127-C129 PolarHBondContact O-N 3.41Å; V127-M130 PolarHBondContact N-O 3.39Å; V127-M130 WeakPolarHBondContact O-CB 3.27Å; V127-M130 PolarHBondContact O-N 2.87Å
128	G	89.8	Confident	88.7	Confident	22 Å²	22	38.1 Å²	38.1	23%	0.227	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-118	-171.9	0	0	0	0	0	111.4	D114 M130 I149	D114-G128 PolarHBondContact OD2-N 3.16Å; G128-M130 VanDerWaalsContact C-N 3.34Å; G128-I149 PolarHBondContact O-N 3.47Å
129	C	90.3	Very high	88.7	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.034	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	3.4	177.8	55.1	0	0	0	0	114.8	V127 L144 L145 D147	V127-C129 PolarHBondContact O-N 3.41Å; C129-L144 HydrophobicContact CB-CD1 4.39Å; C129-L145 WeakPolarHBondContact CB-O 3.39Å; C129-L145 PolarHBondContact O-N 3.41Å; C129-D147 WeakPolarHBondContact CA-O 3.5Å; C129-D147 VanDerWaalsContact CB-O 3.3Å; C129-D147 WeakPolarHBondContact CB-O 3.32Å
130	M	92.3	Very high	88.9	Confident	44 Å²	44	40 Å²	40	22%	0.217	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	137.9	-175.3	-62.6	170.6	68.4	0	0	111.4	I109 T126 V127 G128 F142 L144	I109-M130 HydrophobicContact CB-CE 4.17Å; I109-M130 HydrophobicContact CD1-CB 4.16Å; I109-M130 HydrophobicContact CD1-CE 3.92Å; I109-M130 HydrophobicContact CG1-CE 3.71Å; I109-M130 HydrophobicContact CG2-CB 4.38Å; I109-M130 HydrophobicContact CG2-CE 3.5Å; I109-M130 VanDerWaalsContact CG2-CE 3.5Å; I109-M130 HydrophobicContact CG2-SD 3.56Å; I109-M130 VanDerWaalsContact CG2-SD 3.56Å; T126-M130 CarbonylContact C-O 3.6Å; T126-M130 WeakPolarHBondContact CA-O 3.48Å; V127-M130 PolarHBondContact N-O 3.39Å; V127-M130 WeakPolarHBondContact O-CB 3.27Å; V127-M130 PolarHBondContact O-N 2.87Å; G128-M130 VanDerWaalsContact C-N 3.34Å; M130-F142 HydrophobicContact CB-CE2 4.07Å; M130-F142 HydrophobicContact CE-CE2 3.35Å; M130-F142 HydrophobicContact CE-CZ 3.59Å; M130-F142 HydrophobicContact CG-CE2 4.17Å; M130-F142 HydrophobicContact CG-CZ 4.26Å; M130-L144 HydrophobicContact CG-CD1 3.71Å
131	Y	92	Very high	89.3	Confident	16 Å²	16	41.2 Å²	41.2	6%	0.063	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	142.8	171.5	156.2	-95	0	0	0	110.2	Y124 E141 F142 L143 I152 G155	Y124-Y131 AromaticContact CD1-CE2 3.92Å; Y124-Y131 HydrophobicContact CD1-CE2 3.92Å; Y124-Y131 AromaticContact CD1-CZ 3.99Å; Y124-Y131 WeakPolarHBondContact CD1-OH 3.38Å; Y131-E141 HydrophobicContact CE1-CB 4.21Å; Y131-E141 PolarHBondContact OH-OE2 3.28Å; Y131-F142 WeakPolarHBondContact O-CA 3.44Å; Y131-F142 WeakPolarHBondContact O-CD2 3.23Å; Y131-L143 HydrophobicContact CD1-CB 3.67Å; Y131-L143 HydrophobicContact CG-CB 4.37Å; Y131-L143 PolarHBondContact N-O 3.17Å; Y131-L143 PolarHBondContact O-N 2.92Å; Y131-I152 HydrophobicContact CD2-CD1 3.29Å; Y131-I152 HydrophobicContact CE2-CD1 3.15Å; Y131-G155 WeakPolarHBondContact OH-CA 3.4Å; Y131-G155 PolarHBondContact OH-O 3.16Å
132	Q	91.6	Very high	89.7	Confident	14 Å²	14	43 Å²	43	7%	0.065	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140	176.7	-172.7	68.5	26.6	0	0	111.5	I109 Y125 D139 E141 F142	I109-Q132 HydrophobicContact CD1-CB 3.89Å; I109-Q132 HydrophobicContact CD1-CG 4.49Å; Y125-Q132 HydrophobicContact CD1-CB 4.06Å; Y125-Q132 HydrophobicContact CD1-CG 4.42Å; Y125-Q132 HydrophobicContact CD2-CB 4.42Å; Y125-Q132 HydrophobicContact CE1-CB 3.53Å; Y125-Q132 HydrophobicContact CE1-CG 3.52Å; Y125-Q132 HydrophobicContact CE2-CB 3.93Å; Y125-Q132 HydrophobicContact CE2-CG 4.47Å; Y125-Q132 HydrophobicContact CG-CB 4.49Å; Y125-Q132 VanDerWaalsContact CZ-CB 3.48Å; Y125-Q132 PolarHBondContact N-O 3.46Å; Y125-Q132 PolarHBondContact O-N 2.94Å; Y125-Q132 WeakPolarHBondContact OH-CG 3.44Å; Q132-D139 PolarHBondContact NE2-OD1 3.28Å; Q132-E141 WeakPolarHBondContact CA-O 3.09Å; Q132-E141 PolarHBondContact NE2-O 2.92Å; Q132-E141 PolarHBondContact OE1-O 2.99Å; Q132-F142 VanDerWaalsContact OE1-CD2 3.29Å
133	Q	91.5	Very high	89.7	Confident	14 Å²	14	44 Å²	44	7%	0.065	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.7	168.1	-176.1	-177.2	-18.5	0	0	111.3	N122 I123 Y124 T135 T140 E141	N122-Q133 PolarHBondContact ND2-NE2 3.34Å; I123-Q133 WeakPolarHBondContact O-CA 3.37Å; Y124-Q133 HydrophobicContact CD1-CB 4.11Å; Y124-Q133 HydrophobicContact CD1-CG 3.84Å; Y124-Q133 HydrophobicContact CE1-CB 4.21Å; Y124-Q133 VanDerWaalsContact CE1-CD 3.4Å; Y124-Q133 HydrophobicContact CE1-CG 3.57Å; Q133-T135 PolarHBondContact NE2-OG1 3.17Å; Q133-T135 VanDerWaalsContact NE2-OG1 3.09Å; Q133-T140 WeakPolarHBondContact CG-OG1 3.37Å; Q133-T140 PolarHBondContact O-N 3.05Å; Q133-T140 PolarHBondContact O-OG1 3.37Å; Q133-E141 HydrophobicContact CB-CB 3.87Å; Q133-E141 HydrophobicContact CB-CG 4.28Å; Q133-E141 PolarHBondContact N-O 3.2Å; Q133-E141 PolarHBondContact OE1-OE1 3.37Å; Q133-E141 PolarHBondContact OE1-OE2 2.98Å; Q133-E141 VanDerWaalsContact OE1-OE2 3.12Å
134	L	89.8	Confident	89.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.1	167.3	-56.6	171.8	0	0	0	109.8	I92 H105 N122 I123 Y125 K138 D139	I92-L134 HydrophobicContact CD1-CD1 4.21Å; H105-L134 VanDerWaalsContact CD2-CD1 3.45Å; H105-L134 WeakPolarHBondContact CD2-CD1 3.17Å; H105-L134 WeakPolarHBondContact NE2-CD2 3.5Å; N122-L134 CarbonylContact C-O 3.57Å; N122-L134 VanDerWaalsContact CA-O 3.25Å; N122-L134 WeakPolarHBondContact CA-O 3.37Å; I123-L134 HydrophobicContact CB-CB 4.19Å; I123-L134 HydrophobicContact CB-CD1 4.33Å; I123-L134 PolarHBondContact N-O 2.7Å; I123-L134 PolarHBondContact O-N 2.86Å; Y125-L134 HydrophobicContact CD1-CD1 4.24Å; Y125-L134 HydrophobicContact CD1-CG 4.33Å; Y125-L134 HydrophobicContact CE1-CD1 3.8Å; Y125-L134 HydrophobicContact CE1-CD2 4.27Å; Y125-L134 HydrophobicContact CE1-CG 3.78Å; L134-K138 CarbonylContact C-O 3.6Å; L134-K138 WeakPolarHBondContact CA-O 3.21Å; L134-D139 WeakPolarHBondContact CD2-OD1 3.35Å
135	T	87.6	Confident	89.5	Confident	36 Å²	36	49.6 Å²	49.6	22%	0.221	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	115.8	168.8	-56.1	0	0	0	0	108.1	N122 Q133 F137 K138 T140	N122-T135 WeakPolarHBondContact OD1-CG2 3.48Å; Q133-T135 PolarHBondContact NE2-OG1 3.17Å; Q133-T135 VanDerWaalsContact NE2-OG1 3.09Å; T135-F137 PolarHBondContact O-N 3.44Å; T135-K138 PolarHBondContact N-O 3.46Å; T135-K138 PolarHBondContact O-N 3.2Å; T135-T140 VanDerWaalsContact CB-CG2 3.5Å; T135-T140 WeakPolarHBondContact OG1-CG2 3.47Å; T135-T140 PolarHBondContact OG1-OG1 2.74Å; T135-T140 VanDerWaalsContact OG1-OG1 3.08Å
136	N	84.7	Confident	89.2	Confident	104 Å²	104	51.6 Å²	51.6	56%	0.556	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	42.2	-173.3	-62.7	-36.4	0	0	0	113	K138	N136-K138 PolarHBondContact O-N 3.35Å
137	F	83.1	Confident	89	Confident	91 Å²	91	55.3 Å²	55.3	40%	0.399	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.7	19.5	-178.8	-45.5	-71.8	0	0	0	115	F103 I123 T135	F103-F137 HydrophobicContact CB-CE1 4.42Å; F103-F137 HydrophobicContact CB-CZ 4.21Å; F103-F137 AromaticContact CD1-CE1 3.87Å; F103-F137 HydrophobicContact CD1-CE1 3.87Å; F103-F137 AromaticContact CD1-CZ 3.72Å; F103-F137 HydrophobicContact CD1-CZ 3.72Å; F103-F137 HydrophobicContact CD2-CD1 4.05Å; F103-F137 AromaticContact CD2-CE1 3.41Å; F103-F137 HydrophobicContact CD2-CE1 3.41Å; F103-F137 VanDerWaalsContact CD2-CE1 3.41Å; F103-F137 AromaticContact CD2-CZ 4Å; F103-F137 HydrophobicContact CD2-CZ 4Å; F103-F137 AromaticContact CE1-CE1 3.91Å; F103-F137 HydrophobicContact CE1-CE1 3.91Å; F103-F137 HydrophobicContact CE1-CZ 4.05Å; F103-F137 HydrophobicContact CE2-CD1 4.19Å; F103-F137 AromaticContact CE2-CE1 3.48Å; F103-F137 HydrophobicContact CE2-CE1 3.48Å; F103-F137 VanDerWaalsContact CE2-CE1 3.48Å; F103-F137 HydrophobicContact CE2-CZ 4.32Å; F103-F137 AromaticContact CG-CE1 3.63Å; F103-F137 HydrophobicContact CG-CE1 3.63Å; F103-F137 AromaticContact CG-CZ 3.7Å; F103-F137 HydrophobicContact CG-CZ 3.7Å; F103-F137 AromaticContact CZ-CE1 3.74Å; F103-F137 HydrophobicContact CZ-CE1 3.74Å; F103-F137 HydrophobicContact CZ-CZ 4.35Å; I123-F137 HydrophobicContact CD1-CE1 4.23Å; T135-F137 PolarHBondContact O-N 3.44Å
138	K	87.8	Confident	88.9	Confident	155 Å²	155	59 Å²	59	67%	0.674	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.9	168.6	-64	-176	178.2	-177.6	0	109.2	L134 T135 N136 T140	L134-K138 CarbonylContact C-O 3.6Å; L134-K138 WeakPolarHBondContact CA-O 3.21Å; T135-K138 PolarHBondContact N-O 3.46Å; T135-K138 PolarHBondContact O-N 3.2Å; N136-K138 PolarHBondContact O-N 3.35Å; K138-T140 PolarHBondContact O-N 2.78Å
139	D	88.1	Confident	89	Confident	68 Å²	68	58.9 Å²	58.9	36%	0.364	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	119.7	170.7	-71.4	-31.9	0	0	0	110	N108 Q132 L134	N108-D139 PolarHBondContact ND2-OD2 2.96Å; Q132-D139 PolarHBondContact NE2-OD1 3.28Å; L134-D139 WeakPolarHBondContact CD2-OD1 3.35Å
140	T	89.1	Confident	89	Confident	72 Å²	72	61.4 Å²	61.4	44%	0.442	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	-33.5	179.2	50.9	0	0	0	0	113.6	Q133 T135 K138	Q133-T140 WeakPolarHBondContact CG-OG1 3.37Å; Q133-T140 PolarHBondContact O-N 3.05Å; Q133-T140 PolarHBondContact O-OG1 3.37Å; T135-T140 VanDerWaalsContact CB-CG2 3.5Å; T135-T140 WeakPolarHBondContact OG1-CG2 3.47Å; T135-T140 PolarHBondContact OG1-OG1 2.74Å; T135-T140 VanDerWaalsContact OG1-OG1 3.08Å; K138-T140 PolarHBondContact O-N 2.78Å
141	E	89.6	Confident	88.9	Confident	90 Å²	90	60.8 Å²	60.8	42%	0.421	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	145.5	-179	-57.3	-173.2	170.9	0	0	110.4	Y131 Q132 Q133	Y131-E141 HydrophobicContact CE1-CB 4.21Å; Y131-E141 PolarHBondContact OH-OE2 3.28Å; Q132-E141 WeakPolarHBondContact CA-O 3.09Å; Q132-E141 PolarHBondContact NE2-O 2.92Å; Q132-E141 PolarHBondContact OE1-O 2.99Å; Q133-E141 HydrophobicContact CB-CB 3.87Å; Q133-E141 HydrophobicContact CB-CG 4.28Å; Q133-E141 PolarHBondContact N-O 3.2Å; Q133-E141 PolarHBondContact OE1-OE1 3.37Å; Q133-E141 PolarHBondContact OE1-OE2 2.98Å; Q133-E141 VanDerWaalsContact OE1-OE2 3.12Å
142	F	90.2	Very high	88.8	Confident	110 Å²	110	61.2 Å²	61.2	48%	0.482	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	134.2	175.5	174	-104.2	0	0	0	108.9	I109 M130 Y131 Q132 L144	I109-F142 HydrophobicContact CD1-CE2 4.31Å; M130-F142 HydrophobicContact CB-CE2 4.07Å; M130-F142 HydrophobicContact CE-CE2 3.35Å; M130-F142 HydrophobicContact CE-CZ 3.59Å; M130-F142 HydrophobicContact CG-CE2 4.17Å; M130-F142 HydrophobicContact CG-CZ 4.26Å; Y131-F142 WeakPolarHBondContact O-CA 3.44Å; Y131-F142 WeakPolarHBondContact O-CD2 3.23Å; Q132-F142 VanDerWaalsContact OE1-CD2 3.29Å; F142-L144 HydrophobicContact CE1-CB 4.09Å; F142-L144 HydrophobicContact CZ-CB 4.04Å
143	L	88.9	Confident	88.5	Confident	56 Å²	56	63 Å²	63	29%	0.293	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	139.6	173.5	-178	66	0	0	0	109.2	Y131 L145 L157	Y131-L143 HydrophobicContact CD1-CB 3.67Å; Y131-L143 HydrophobicContact CG-CB 4.37Å; Y131-L143 PolarHBondContact N-O 3.17Å; Y131-L143 PolarHBondContact O-N 2.92Å; L143-L145 HydrophobicContact CD1-CD2 4.43Å; L143-L145 HydrophobicContact CD2-CD2 3.85Å; L143-L145 HydrophobicContact CD2-CG 4.23Å; L143-L145 HydrophobicContact CG-CD2 4.02Å; L143-L145 HydrophobicContact CG-CG 4.34Å; L143-L157 HydrophobicContact CD2-CD2 4.19Å
144	L	89.4	Confident	87.8	Confident	71 Å²	71	66.1 Å²	66.1	37%	0.372	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	118.1	173.4	173.8	72.3	0	0	0	107.9	C129 M130 F142	C129-L144 HydrophobicContact CB-CD1 4.39Å; M130-L144 HydrophobicContact CG-CD1 3.71Å; F142-L144 HydrophobicContact CE1-CB 4.09Å; F142-L144 HydrophobicContact CZ-CB 4.04Å
145	L	88.5	Confident	86.6	Confident	63 Å²	63	66.6 Å²	66.6	33%	0.33	34%	0.344	S	S	.	.			trans	-95.2	161.3	175	-65	-174.4	0	0	0	111.1	C129 L143 D147 I149	C129-L145 WeakPolarHBondContact CB-O 3.39Å; C129-L145 PolarHBondContact O-N 3.41Å; L143-L145 HydrophobicContact CD1-CD2 4.43Å; L143-L145 HydrophobicContact CD2-CD2 3.85Å; L143-L145 HydrophobicContact CD2-CG 4.23Å; L143-L145 HydrophobicContact CG-CD2 4.02Å; L143-L145 HydrophobicContact CG-CG 4.34Å; L145-D147 PolarHBondContact O-N 3.37Å; L145-I149 HydrophobicContact CD1-CD1 4Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CG-CD1 4.3Å
146	P	85.6	Confident	85.6	Confident	42 Å²	42	69.6 Å²	69.6	27%	0.273	36%	0.362	S	S	.	.	S	Bend	trans	-67.3	-23	176.8	-21.7	34.2	0	0	0	114	R526 T528	P146-R526 PolarHBondContact O-N 2.99Å; P146-T528 VanDerWaalsContact CB-OG1 3.29Å; P146-T528 WeakPolarHBondContact CB-OG1 3.46Å; P146-T528 HydrophobicContact CG-CG2 4.21Å; P146-T528 WeakPolarHBondContact CG-OG1 3.41Å
147	D	88.3	Confident	84.9	Confident	80 Å²	80	70.5 Å²	70.5	43%	0.428	37%	0.367	S	S	.	.	S	Bend	trans	-134.6	169.3	-173.1	-157.7	3.5	0	0	0	111.7	C129 L145	C129-D147 WeakPolarHBondContact CA-O 3.5Å; C129-D147 VanDerWaalsContact CB-O 3.3Å; C129-D147 WeakPolarHBondContact CB-O 3.32Å; L145-D147 PolarHBondContact O-N 3.37Å
148	I	89.4	Confident	84.6	Confident	86 Å²	86	70.5 Å²	70.5	44%	0.441	37%	0.37	S	S	.	.			trans	-66.2	134.9	-173.9	-61.2	170.1	0	0	0	111.3
149	I	91.3	Very high	84.2	Confident	20 Å²	20	65.5 Å²	65.5	10%	0.103	35%	0.354	C	S	.	.			trans	-90.1	109.5	177.1	-47.3	-178.3	0	0	0	109.4	T126 G128 L145	T126-I149 HydrophobicContact CG2-CB 3.97Å; T126-I149 HydrophobicContact CG2-CD1 4.21Å; T126-I149 HydrophobicContact CG2-CG2 3.62Å; G128-I149 PolarHBondContact O-N 3.47Å; L145-I149 HydrophobicContact CD1-CD1 4Å; L145-I149 HydrophobicContact CD1-CG1 4.03Å; L145-I149 HydrophobicContact CG-CD1 4.3Å
150	T	90.5	Very high	84	Confident	57 Å²	57	71 Å²	71	35%	0.35	38%	0.377	S	S	.	.			trans	-84.4	-28.2	-175.1	57.4	0	0	0	0	114.2	P167	T150-P167 VanDerWaalsContact CB-O 3.27Å; T150-P167 WeakPolarHBondContact CB-O 3.26Å; T150-P167 WeakPolarHBondContact CG2-O 3.28Å; T150-P167 PolarHBondContact OG1-O 2.93Å
151	S	89.9	Confident	83.9	Confident	32 Å²	32	70.4 Å²	70.4	22%	0.224	37%	0.372	C	S	.	.			trans	-159.3	149.6	-177.7	-167	0	0	0	0	110.5	I170	S151-I170 VanDerWaalsContact OG-CG2 3.25Å; S151-I170 WeakPolarHBondContact OG-CG2 3.47Å; S151-I170 PolarHBondContact OG-N 3.33Å
152	I	89.9	Confident	83.8	Confident	24 Å²	24	71 Å²	71	12%	0.123	37%	0.374	C	S	.	.			trans	-129.2	141.2	175.8	-178.9	158.3	0	0	0	111.7	S115 F117 T126 Y131	S115-I152 PolarHBondContact OG-N 3.35Å; F117-I152 HydrophobicContact CB-CG2 4.04Å; T126-I152 HydrophobicContact CG2-CB 4.28Å; T126-I152 HydrophobicContact CG2-CG2 4.2Å; Y131-I152 HydrophobicContact CD2-CD1 3.29Å; Y131-I152 HydrophobicContact CE2-CD1 3.15Å
153	Y	86.3	Confident	83.8	Confident	51 Å²	51	67.5 Å²	67.5	20%	0.2	36%	0.36	C	S	.	.			trans	-146.1	115.5	169.2	-175	-84	0	0	0	109.1	F117 R172 L182	F117-Y153 HydrophobicContact CD2-CD2 4.34Å; F117-Y153 AromaticContact CE2-CD2 3.93Å; F117-Y153 HydrophobicContact CE2-CD2 3.93Å; F117-Y153 AromaticContact CE2-CE2 3.94Å; F117-Y153 HydrophobicContact CE2-CE2 3.94Å; F117-Y153 HydrophobicContact CZ-CD2 4.43Å; F117-Y153 HydrophobicContact CZ-CE2 4.31Å; Y153-R172 HydrophobicContact CE2-CB 4.28Å; Y153-R172 WeakPolarHBondContact OH-CB 3.27Å; Y153-L182 HydrophobicContact CD1-CD1 3.97Å; Y153-L182 HydrophobicContact CD1-CD2 3.52Å; Y153-L182 HydrophobicContact CD1-CG 4.43Å; Y153-L182 HydrophobicContact CE1-CD1 4.41Å; Y153-L182 HydrophobicContact CE1-CD2 3.25Å; Y153-L182 HydrophobicContact CE1-CG 4.48Å; Y153-L182 HydrophobicContact CG-CD2 4.4Å
154	N	77	Confident	83.7	Confident	81 Å²	81	67.4 Å²	67.4	43%	0.433	36%	0.364	S	S	.	.	S	Bend	trans	59.9	117.2	178	-160.1	15.6	0	0	0	114.8	Q119 V156	Q119-N154 PolarHBondContact OE1-OD1 3.25Å; N154-V156 PolarHBondContact O-N 3.07Å
155	G	63.1	Low	83.7	Confident	10 Å²	10	64.6 Å²	64.6	10%	0.103	35%	0.35	C	S	.	.	S	Bend	trans	-82.9	38.3	-159.4	0	0	0	0	0	118.8	Y131	Y131-G155 WeakPolarHBondContact OH-CA 3.4Å; Y131-G155 PolarHBondContact OH-O 3.16Å
156	V	67.9	Low	83.8	Confident	99 Å²	99	65 Å²	65	60%	0.6	36%	0.358	S	S	*	.			trans	-116.3	115.9	177.8	-171.3	0	0	0	0	111.1	N154 L158	N154-V156 PolarHBondContact O-N 3.07Å; V156-L158 HydrophobicContact CG1-CD2 3.71Å; V156-L158 HydrophobicContact CG1-CG 3.9Å; V156-L158 PolarHBondContact O-N 3.3Å
157	L	69.9	Low	84.2	Confident	123 Å²	123	65.5 Å²	65.5	64%	0.644	36%	0.362	S	S	*	.			trans	-77.5	114	171.3	-175	70.6	0	0	0	109.6	L143	L143-L157 HydrophobicContact CD2-CD2 4.19Å
158	L	76.3	Confident	84.4	Confident	91 Å²	91	62.1 Å²	62.1	48%	0.476	34%	0.344	S	S	.	.			trans	-114.2	-47.9	-178.3	-66.3	172.3	0	0	0	112.3	V156 V196	V156-L158 HydrophobicContact CG1-CD2 3.71Å; V156-L158 HydrophobicContact CG1-CG 3.9Å; V156-L158 PolarHBondContact O-N 3.3Å; L158-V196 HydrophobicContact CD1-CG1 3.98Å
159	C	79.2	Confident	84.6	Confident	50 Å²	50	58.7 Å²	58.7	34%	0.338	33%	0.327	S	S	.	.			trans	-157.9	173.4	-178.3	59.5	0	0	0	0	110.9	V201	C159-V201 WeakPolarHBondContact SG-CG2 3.23Å
160	E	84	Confident	84.7	Confident	182 Å²	182	59.8 Å²	59.8	85%	0.85	33%	0.333	S	S	*	.			trans	-106.4	139	174.9	-64.9	175.8	-178.2	0	0	109.5
161	L	86.5	Confident	84.7	Confident	61 Å²	61	60.2 Å²	60.2	32%	0.319	33%	0.333	S	S	.	.			trans	-119.2	124.3	175.1	177.3	68.8	0	0	0	109	I163 F194 V201	L161-I163 HydrophobicContact CD2-CG2 3.97Å; L161-I163 HydrophobicContact CG-CG2 4.08Å; L161-F194 HydrophobicContact CD2-CB 4.43Å; L161-F194 HydrophobicContact CD2-CG 4.45Å; L161-V201 HydrophobicContact CB-CG1 4.14Å; L161-V201 HydrophobicContact CD1-CG1 4.07Å; L161-V201 HydrophobicContact CD2-CG1 3.76Å; L161-V201 HydrophobicContact CG-CG1 4.19Å
162	E	88.3	Confident	84.6	Confident	103 Å²	103	63.9 Å²	63.9	48%	0.481	34%	0.342	S	S	.	.			trans	-69.4	128.1	168.6	172.3	163.9	-165.5	0	0	110.2	H487 H488	E162-H487 VanDerWaalsContact CG-CD2 3.44Å; E162-H487 WeakPolarHBondContact CG-CD2 3.46Å; E162-H487 IonicContact OE1-CD2 2.85Å; E162-H487 PolarHBondContact OE1-CD2 3.05Å; E162-H487 VanDerWaalsContact OE1-CD2 3.29Å; E162-H487 IonicContact OE1-CG 2.74Å; E162-H488 IonicContact OE1-CE1 2.73Å; E162-H488 PolarHBondContact OE1-CE1 3.36Å; E162-H488 VanDerWaalsContact OE1-CE1 3.29Å; E162-H488 IonicContact OE1-ND1 3.74Å; E162-H488 IonicContact OE2-CE1 3.79Å; E162-H488 PolarHBondContact OE2-CE1 3.24Å; E162-H488 IonicContact OE2-ND1 3.48Å
163	I	90.1	Very high	84.5	Confident	36 Å²	36	63 Å²	63	19%	0.185	34%	0.339	C	S	.	.			trans	-129	151.5	-178.3	55.2	175.5	0	0	0	110	L161 S165 P167 Y184	L161-I163 HydrophobicContact CD2-CG2 3.97Å; L161-I163 HydrophobicContact CG-CG2 4.08Å; I163-S165 VanDerWaalsContact CD1-O 3.31Å; I163-S165 WeakPolarHBondContact CD1-O 3.49Å; I163-S165 WeakPolarHBondContact CG1-O 3.31Å; I163-S165 PolarHBondContact O-N 3.03Å; I163-S165 VanDerWaalsContact O-N 3.14Å; I163-P167 HydrophobicContact CD1-CB 3.74Å; I163-P167 HydrophobicContact CD1-CG 3.75Å; I163-Y184 HydrophobicContact CB-CE2 4.25Å; I163-Y184 HydrophobicContact CG2-CE1 3.88Å; I163-Y184 HydrophobicContact CG2-CE2 4.09Å
164	S	86	Confident	84.4	Confident	53 Å²	53	62.2 Å²	62.2	37%	0.371	34%	0.337	S	S	.	.	S	Bend	trans	-66.7	-18.3	-169.8	-56.7	0	0	0	0	114.6	E206	S164-E206 VanDerWaalsContact OG-CD 3.31Å; S164-E206 PolarHBondContact OG-OE1 3.06Å; S164-E206 PolarHBondContact OG-OE2 2.8Å
165	S	89.8	Confident	84.7	Confident	12 Å²	12	66.2 Å²	66.2	8%	0.084	35%	0.35	C	S	.	.	S	Bend	trans	-163.2	170.7	-179.1	-176.2	0	0	0	0	111	I163 S187 E188	I163-S165 VanDerWaalsContact CD1-O 3.31Å; I163-S165 WeakPolarHBondContact CD1-O 3.49Å; I163-S165 WeakPolarHBondContact CG1-O 3.31Å; I163-S165 PolarHBondContact O-N 3.03Å; I163-S165 VanDerWaalsContact O-N 3.14Å; S165-S187 PolarHBondContact OG-OG 3.45Å; S165-E188 WeakPolarHBondContact OG-CB 3.28Å; S165-E188 VanDerWaalsContact OG-CG 3.25Å; S165-E188 WeakPolarHBondContact OG-CG 3.33Å
166	S	90.4	Very high	85.6	Confident	71 Å²	71	69.3 Å²	69.3	50%	0.497	37%	0.37	S	S	.	.			trans	-57.4	128.6	-178.6	-49	0	0	0	0	111.3	T186 S187	S166-T186 CarbonylContact O-C 3.53Å; S166-T186 WeakPolarHBondContact O-CA 3.39Å; S166-T186 VanDerWaalsContact O-CB 3.29Å; S166-T186 WeakPolarHBondContact O-CB 3.45Å; S166-S187 PolarHBondContact O-N 3.27Å
167	P	93.4	Very high	86.3	Confident	53 Å²	53	65.7 Å²	65.7	34%	0.344	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	143.4	-179.3	30.3	-28.9	0	0	0	109.5	T150 I163	T150-P167 VanDerWaalsContact CB-O 3.27Å; T150-P167 WeakPolarHBondContact CB-O 3.26Å; T150-P167 WeakPolarHBondContact CG2-O 3.28Å; T150-P167 PolarHBondContact OG1-O 2.93Å; I163-P167 HydrophobicContact CD1-CB 3.74Å; I163-P167 HydrophobicContact CD1-CG 3.75Å
168	V	93.6	Very high	87.1	Confident	9 Å²	9	63.5 Å²	63.5	6%	0.055	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	-39.9	-175	171.6	0	0	0	0	111.1	R18 G185 S187 E215 I216	R18-V168 VanDerWaalsContact CZ-O 3.29Å; R18-V168 VanDerWaalsContact NH1-CG1 3.29Å; R18-V168 PolarHBondContact NH1-O 2.92Å; R18-V168 PolarHBondContact NH2-O 3.22Å; V168-G185 PolarHBondContact N-O 3.45Å; V168-S187 VanDerWaalsContact CG2-N 3.34Å; V168-E215 HydrophobicContact CB-CG 4.32Å; V168-E215 HydrophobicContact CG1-CG 3.69Å; V168-E215 HydrophobicContact CG2-CG 3.97Å; V168-I216 WeakPolarHBondContact CG1-O 3.47Å
169	C	93.2	Very high	87.4	Confident	14 Å²	14	63.1 Å²	63.1	10%	0.095	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	149.1	172.4	61.5	0	0	0	0	110.8	Y184 G185	C169-Y184 CarbonylContact O-C 3.56Å; C169-Y184 VanDerWaalsContact O-CA 3.24Å; C169-Y184 WeakPolarHBondContact O-CA 3.39Å; C169-G185 PolarHBondContact N-O 2.97Å; C169-G185 PolarHBondContact O-N 2.9Å
170	I	92.9	Very high	87.8	Confident	44 Å²	44	63.2 Å²	63.2	23%	0.226	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	139.8	167.3	-177.8	163.2	0	0	0	109.3	S151 L182 M183 F194	S151-I170 VanDerWaalsContact OG-CG2 3.25Å; S151-I170 WeakPolarHBondContact OG-CG2 3.47Å; S151-I170 PolarHBondContact OG-N 3.33Å; I170-L182 HydrophobicContact CD1-CB 4.49Å; I170-L182 HydrophobicContact CD1-CD1 4.05Å; I170-M183 CarbonylContact C-O 3.58Å; I170-M183 VanDerWaalsContact CA-O 3.32Å; I170-M183 WeakPolarHBondContact CA-O 3.26Å; I170-F194 HydrophobicContact CD1-CE1 4.38Å; I170-F194 HydrophobicContact CD1-CZ 3.75Å
171	N	90	Very high	88.1	Confident	66 Å²	66	56.4 Å²	56.4	35%	0.353	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	165.9	175.7	-152.1	-14	0	0	0	110.9	M183 L219	N171-M183 PolarHBondContact N-O 2.92Å; N171-M183 PolarHBondContact O-N 2.53Å; N171-L219 PolarHBondContact ND2-O 2.91Å
172	R	88.1	Confident	88.4	Confident	109 Å²	109	54.3 Å²	54.3	41%	0.411	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	143.9	173.1	-164.7	179.5	169.9	167	-3.6	110.1	Y153	Y153-R172 HydrophobicContact CE2-CB 4.28Å; Y153-R172 WeakPolarHBondContact OH-CB 3.27Å
173	A	87.5	Confident	88.6	Confident	6 Å²	6	49.5 Å²	49.5	5%	0.05	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-64.8	170.7	168.1	0	0	0	0	0	111.9	Y177 Y181 M183 L193	A173-Y177 HydrophobicContact CB-CD2 4.22Å; A173-Y177 HydrophobicContact CB-CG 4.32Å; A173-Y181 VanDerWaalsContact CB-O 3.29Å; A173-Y181 WeakPolarHBondContact CB-O 3.44Å; A173-Y181 PolarHBondContact N-O 3.05Å; A173-M183 HydrophobicContact CB-CG 4.36Å; A173-L193 HydrophobicContact CB-CD1 3.54Å
174	H	85.4	Confident	88.8	Confident	33 Å²	33	48.2 Å²	48.2	15%	0.153	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-50.6	146.7	176.2	177.4	-113.1	0	0	0	111.8	S176 Y177 H221 D245	H174-S176 VanDerWaalsContact ND1-CB 3.25Å; H174-S176 WeakPolarHBondContact ND1-CB 3.48Å; H174-S176 PolarHBondContact ND1-N 3.36Å; H174-S176 PolarHBondContact ND1-OG 3.16Å; H174-S176 PolarHBondContact O-N 2.75Å; H174-Y177 HydrophobicContact CB-CD2 4.02Å; H174-Y177 HydrophobicContact CB-CE2 4.38Å; H174-Y177 WeakPolarHBondContact O-CB 3.13Å; H174-Y177 PolarHBondContact O-N 2.79Å; H174-H221 PolarHBondContact N-CE1 2.9Å; H174-H221 PolarHBondContact N-ND1 3.37Å; H174-D245 WeakPolarHBondContact CD2-CB 3.2Å; H174-D245 IonicContact CD2-OD2 3.65Å; H174-D245 PolarHBondContact CD2-OD2 3.33Å; H174-D245 VanDerWaalsContact CD2-OD2 3.24Å; H174-D245 WeakPolarHBondContact NE2-CB 3.25Å; H174-D245 IonicContact NE2-OD2 3.04Å; H174-D245 PolarHBondContact NE2-OD2 3.12Å
175	K	82.3	Confident	89.3	Confident	165 Å²	165	45.7 Å²	45.7	72%	0.717	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.8	-174.7	-65.5	171.3	-172.1	153.4	0	113.9	Y177	K175-Y177 PolarHBondContact O-N 2.97Å
176	S	82.3	Confident	89.5	Confident	75 Å²	75	45.1 Å²	45.1	52%	0.524	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.4	174.1	71	0	0	0	0	113.6	H174	H174-S176 VanDerWaalsContact ND1-CB 3.25Å; H174-S176 WeakPolarHBondContact ND1-CB 3.48Å; H174-S176 PolarHBondContact ND1-N 3.36Å; H174-S176 PolarHBondContact ND1-OG 3.16Å; H174-S176 PolarHBondContact O-N 2.75Å
177	Y	83.9	Confident	89.6	Confident	24 Å²	24	43 Å²	43	9%	0.094	23%	0.231	C	C	.	.	S	Bend	trans	-86.5	147	176.1	-70.4	-89.2	0	0	0	110.7	A173 H174 K175 Y181 L193 K265	A173-Y177 HydrophobicContact CB-CD2 4.22Å; A173-Y177 HydrophobicContact CB-CG 4.32Å; H174-Y177 HydrophobicContact CB-CD2 4.02Å; H174-Y177 HydrophobicContact CB-CE2 4.38Å; H174-Y177 WeakPolarHBondContact O-CB 3.13Å; H174-Y177 PolarHBondContact O-N 2.79Å; K175-Y177 PolarHBondContact O-N 2.97Å; Y177-Y181 AromaticContact CD1-CD1 3.6Å; Y177-Y181 HydrophobicContact CD1-CD1 3.6Å; Y177-Y181 HydrophobicContact CD1-CD2 4.32Å; Y177-Y181 AromaticContact CD1-CE1 3.82Å; Y177-Y181 HydrophobicContact CD1-CE1 3.82Å; Y177-Y181 AromaticContact CD1-CG 3.85Å; Y177-Y181 HydrophobicContact CD1-CG 3.85Å; Y177-Y181 HydrophobicContact CE1-CD1 4.15Å; Y177-Y181 HydrophobicContact CE1-CE1 4.18Å; Y177-Y181 HydrophobicContact CG-CD1 4.3Å; Y177-Y181 HydrophobicContact CG-CG 4.2Å; Y177-L193 HydrophobicContact CE1-CD2 3.88Å; Y177-L193 HydrophobicContact CE2-CD2 4.4Å; Y177-K265 HydrophobicContact CE1-CD 4.39Å; Y177-K265 WeakPolarHBondContact OH-CB 3.29Å; Y177-K265 VanDerWaalsContact OH-CD 3.22Å; Y177-K265 WeakPolarHBondContact OH-CD 3.23Å
178	P	85.4	Confident	89.4	Confident	77 Å²	77	42.3 Å²	42.3	50%	0.5	22%	0.223	S	C	.	.			trans	-53	154.1	167.9	-27.3	36.5	0	0	0	112.3	N180 Y181	P178-N180 WeakPolarHBondContact CB-OD1 3.41Å; P178-N180 PolarHBondContact O-N 3.28Å; P178-Y181 HydrophobicContact CB-CD2 3.99Å; P178-Y181 HydrophobicContact CB-CE2 4.12Å; P178-Y181 HydrophobicContact CG-CD2 4.19Å; P178-Y181 HydrophobicContact CG-CE2 3.94Å; P178-Y181 PolarHBondContact O-N 2.94Å
179	S	83.3	Confident	89.3	Confident	83 Å²	83	41.9 Å²	41.9	58%	0.58	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-12.7	-172.4	55.6	0	0	0	0	115.4	Y181	S179-Y181 VanDerWaalsContact C-N 3.34Å
180	N	86.8	Confident	89.4	Confident	51 Å²	51	43.9 Å²	43.9	27%	0.273	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	3.9	178.5	70.6	-45.2	0	0	0	113.5	P178 V196	P178-N180 WeakPolarHBondContact CB-OD1 3.41Å; P178-N180 PolarHBondContact O-N 3.28Å; N180-V196 VanDerWaalsContact CB-O 3.23Å; N180-V196 WeakPolarHBondContact CB-O 3.36Å; N180-V196 PolarHBondContact ND2-O 3.24Å; N180-V196 PolarHBondContact O-N 3.48Å
181	Y	90.9	Very high	89.5	Confident	40 Å²	40	41.8 Å²	41.8	16%	0.157	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	128	170.1	-74.5	-105.3	0	0	0	110.2	A173 Y177 P178 S179 L193 F194 Q195 I204	A173-Y181 VanDerWaalsContact CB-O 3.29Å; A173-Y181 WeakPolarHBondContact CB-O 3.44Å; A173-Y181 PolarHBondContact N-O 3.05Å; Y177-Y181 AromaticContact CD1-CD1 3.6Å; Y177-Y181 HydrophobicContact CD1-CD1 3.6Å; Y177-Y181 HydrophobicContact CD1-CD2 4.32Å; Y177-Y181 AromaticContact CD1-CE1 3.82Å; Y177-Y181 HydrophobicContact CD1-CE1 3.82Å; Y177-Y181 AromaticContact CD1-CG 3.85Å; Y177-Y181 HydrophobicContact CD1-CG 3.85Å; Y177-Y181 HydrophobicContact CE1-CD1 4.15Å; Y177-Y181 HydrophobicContact CE1-CE1 4.18Å; Y177-Y181 HydrophobicContact CG-CD1 4.3Å; Y177-Y181 HydrophobicContact CG-CG 4.2Å; P178-Y181 HydrophobicContact CB-CD2 3.99Å; P178-Y181 HydrophobicContact CB-CE2 4.12Å; P178-Y181 HydrophobicContact CG-CD2 4.19Å; P178-Y181 HydrophobicContact CG-CE2 3.94Å; P178-Y181 PolarHBondContact O-N 2.94Å; S179-Y181 VanDerWaalsContact C-N 3.34Å; Y181-L193 HydrophobicContact CD1-CD1 4.27Å; Y181-L193 HydrophobicContact CD1-CD2 4.35Å; Y181-L193 HydrophobicContact CD1-CG 4.32Å; Y181-F194 WeakPolarHBondContact CA-O 3.14Å; Y181-Q195 HydrophobicContact CD1-CB 4.1Å; Y181-Q195 HydrophobicContact CD2-CG 4.29Å; Y181-Q195 HydrophobicContact CE1-CB 3.84Å; Y181-Q195 HydrophobicContact CE1-CG 4.16Å; Y181-Q195 HydrophobicContact CE2-CB 4.4Å; Y181-Q195 HydrophobicContact CE2-CG 3.85Å; Y181-Q195 PolarHBondContact OH-OE1 3.12Å; Y181-I204 HydrophobicContact CE1-CD1 4.34Å; Y181-I204 HydrophobicContact CE1-CG1 4.19Å
182	L	92	Very high	89.7	Confident	16 Å²	16	38.6 Å²	38.6	8%	0.084	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.6	-176.4	-59.6	179.7	0	0	0	110	Y153 I170 F194 V196	Y153-L182 HydrophobicContact CD1-CD1 3.97Å; Y153-L182 HydrophobicContact CD1-CD2 3.52Å; Y153-L182 HydrophobicContact CD1-CG 4.43Å; Y153-L182 HydrophobicContact CE1-CD1 4.41Å; Y153-L182 HydrophobicContact CE1-CD2 3.25Å; Y153-L182 HydrophobicContact CE1-CG 4.48Å; Y153-L182 HydrophobicContact CG-CD2 4.4Å; I170-L182 HydrophobicContact CD1-CB 4.49Å; I170-L182 HydrophobicContact CD1-CD1 4.05Å; L182-F194 HydrophobicContact CB-CD1 4.22Å; L182-F194 HydrophobicContact CB-CD2 4.3Å; L182-F194 HydrophobicContact CB-CE1 3.58Å; L182-F194 HydrophobicContact CB-CE2 3.72Å; L182-F194 HydrophobicContact CB-CZ 3.35Å; L182-F194 HydrophobicContact CD1-CE2 3.92Å; L182-F194 HydrophobicContact CD1-CZ 3.91Å; L182-F194 HydrophobicContact CG-CE2 4.29Å; L182-F194 HydrophobicContact CG-CZ 4.22Å; L182-F194 PolarHBondContact N-O 3.37Å; L182-F194 WeakPolarHBondContact O-CD1 3.23Å; L182-F194 PolarHBondContact O-N 3.17Å; L182-V196 HydrophobicContact CD1-CG2 3.82Å; L182-V196 HydrophobicContact CG-CG2 4.31Å
183	M	93.4	Very high	89.9	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	143.8	175.6	-68.5	-173.8	56.6	0	0	110.4	I170 N171 A173 S192 L193 W205 L219 H221 L247	I170-M183 CarbonylContact C-O 3.58Å; I170-M183 VanDerWaalsContact CA-O 3.32Å; I170-M183 WeakPolarHBondContact CA-O 3.26Å; N171-M183 PolarHBondContact N-O 2.92Å; N171-M183 PolarHBondContact O-N 2.53Å; A173-M183 HydrophobicContact CB-CG 4.36Å; M183-S192 WeakPolarHBondContact CA-O 3.28Å; M183-L193 HydrophobicContact CG-CB 4.37Å; M183-L193 HydrophobicContact CG-CD1 3.64Å; M183-L193 HydrophobicContact SD-CD1 4.31Å; M183-W205 HydrophobicContact CE-CH2 3.72Å; M183-W205 HydrophobicContact CE-CZ2 4.32Å; M183-L219 HydrophobicContact CB-CD1 4.24Å; M183-H221 PolarHBondContact SD-CE1 2.75Å; M183-L247 HydrophobicContact CE-CD1 3.64Å; M183-L247 HydrophobicContact CE-CD2 3.7Å; M183-L247 HydrophobicContact CE-CG 4.33Å; M183-L247 HydrophobicContact SD-CD1 4.27Å
184	Y	94.4	Very high	90.2	Very high	9 Å²	9	34 Å²	34	4%	0.035	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	155.8	173.5	72	-95.3	0	0	0	111	I163 C169 T186 F191 S192 F194 E206 L219	I163-Y184 HydrophobicContact CB-CE2 4.25Å; I163-Y184 HydrophobicContact CG2-CE1 3.88Å; I163-Y184 HydrophobicContact CG2-CE2 4.09Å; C169-Y184 CarbonylContact O-C 3.56Å; C169-Y184 VanDerWaalsContact O-CA 3.24Å; C169-Y184 WeakPolarHBondContact O-CA 3.39Å; Y184-T186 HydrophobicContact CD2-CG2 3.71Å; Y184-T186 HydrophobicContact CE2-CG2 3.5Å; Y184-T186 VanDerWaalsContact CE2-CG2 3.5Å; Y184-F191 WeakPolarHBondContact O-CA 3.38Å; Y184-F191 WeakPolarHBondContact O-CB 3.49Å; Y184-S192 VanDerWaalsContact CE1-CB 3.4Å; Y184-S192 VanDerWaalsContact CZ-CB 3.45Å; Y184-S192 PolarHBondContact N-O 3.43Å; Y184-S192 PolarHBondContact O-N 3.02Å; Y184-S192 VanDerWaalsContact O-N 3.14Å; Y184-F194 AromaticContact CD1-CD1 3.64Å; Y184-F194 HydrophobicContact CD1-CD1 3.64Å; Y184-F194 AromaticContact CD1-CE1 3.61Å; Y184-F194 HydrophobicContact CD1-CE1 3.61Å; Y184-F194 HydrophobicContact CE1-CD1 4.15Å; Y184-F194 HydrophobicContact CG-CE1 4.45Å; Y184-E206 PolarHBondContact OH-OE2 2.89Å; Y184-E206 VanDerWaalsContact OH-OE2 3.12Å; Y184-L219 VanDerWaalsContact O-CD1 3.31Å; Y184-L219 WeakPolarHBondContact O-CD1 3.38Å
185	G	95.3	Very high	90.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.7	170.7	0	0	0	0	0	110	V168 C169 Y190	V168-G185 PolarHBondContact N-O 3.45Å; C169-G185 PolarHBondContact N-O 2.97Å; C169-G185 PolarHBondContact O-N 2.9Å; G185-Y190 CarbonylContact C-O 3.56Å; G185-Y190 WeakPolarHBondContact CA-O 3.37Å
186	T	95.1	Very high	90.6	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	168.7	-174.4	66.8	0	0	0	0	113.4	S166 Y184 E188 G189 Y190 I216	S166-T186 CarbonylContact O-C 3.53Å; S166-T186 WeakPolarHBondContact O-CA 3.39Å; S166-T186 VanDerWaalsContact O-CB 3.29Å; S166-T186 WeakPolarHBondContact O-CB 3.45Å; Y184-T186 HydrophobicContact CD2-CG2 3.71Å; Y184-T186 HydrophobicContact CE2-CG2 3.5Å; Y184-T186 VanDerWaalsContact CE2-CG2 3.5Å; T186-E188 PolarHBondContact O-N 3.21Å; T186-G189 PolarHBondContact O-N 3.03Å; T186-G189 PolarHBondContact OG1-N 3.5Å; T186-Y190 PolarHBondContact N-O 3.46Å; T186-Y190 WeakPolarHBondContact OG1-CA 3.03Å; T186-Y190 WeakPolarHBondContact OG1-CB 3.43Å; T186-Y190 PolarHBondContact OG1-N 2.87Å; T186-Y190 PolarHBondContact OG1-O 3.1Å; T186-I216 PolarHBondContact O-N 3.45Å
187	S	91.9	Very high	90.7	Very high	26 Å²	26	27 Å²	27	18%	0.182	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.4	177.1	61.8	0	0	0	0	113.7	S165 S166 V168 N214 E215	S165-S187 PolarHBondContact OG-OG 3.45Å; S166-S187 PolarHBondContact O-N 3.27Å; V168-S187 VanDerWaalsContact CG2-N 3.34Å; S187-N214 CarbonylContact O-C 3.43Å; S187-E215 VanDerWaalsContact O-CA 3.3Å; S187-E215 WeakPolarHBondContact O-CA 3.2Å; S187-E215 PolarHBondContact O-N 3Å
188	E	89.3	Confident	90.5	Very high	40 Å²	40	30.8 Å²	30.8	19%	0.187	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	5.9	177.3	-72.8	178.3	-158	0	0	114	S165 T186 Y190 T213 K376	S165-E188 WeakPolarHBondContact OG-CB 3.28Å; S165-E188 VanDerWaalsContact OG-CG 3.25Å; S165-E188 WeakPolarHBondContact OG-CG 3.33Å; T186-E188 PolarHBondContact O-N 3.21Å; E188-Y190 HydrophobicContact CB-CD2 3.93Å; E188-Y190 HydrophobicContact CB-CE2 3.79Å; E188-T213 VanDerWaalsContact O-CA 3.24Å; E188-T213 WeakPolarHBondContact O-CA 3.08Å; E188-T213 WeakPolarHBondContact O-CB 3.35Å; E188-T213 WeakPolarHBondContact O-CG2 3.33Å; E188-K376 WeakPolarHBondContact OE1-CD 3.35Å; E188-K376 VanDerWaalsContact OE1-CE 3.24Å; E188-K376 WeakPolarHBondContact OE1-CE 3.33Å; E188-K376 IonicContact OE1-NZ 3.32Å; E188-K376 PolarHBondContact OE1-NZ 3.49Å
189	G	92.2	Very high	90.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	89.7	15.2	173.2	0	0	0	0	0	115.5	T186 N214	T186-G189 PolarHBondContact O-N 3.03Å; T186-G189 PolarHBondContact OG1-N 3.5Å; G189-N214 WeakPolarHBondContact CA-O 3.29Å; G189-N214 PolarHBondContact N-O 3.14Å
190	Y	94	Very high	90.2	Very high	55 Å²	55	35.1 Å²	35.1	22%	0.216	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	137.3	169.3	-57.2	-85.3	0	0	0	110.2	G185 T186 E188 E206 A207 I216	G185-Y190 CarbonylContact C-O 3.56Å; G185-Y190 WeakPolarHBondContact CA-O 3.37Å; T186-Y190 PolarHBondContact N-O 3.46Å; T186-Y190 WeakPolarHBondContact OG1-CA 3.03Å; T186-Y190 WeakPolarHBondContact OG1-CB 3.43Å; T186-Y190 PolarHBondContact OG1-N 2.87Å; T186-Y190 PolarHBondContact OG1-O 3.1Å; E188-Y190 HydrophobicContact CB-CD2 3.93Å; E188-Y190 HydrophobicContact CB-CE2 3.79Å; Y190-E206 HydrophobicContact CD1-CG 4.43Å; Y190-A207 WeakPolarHBondContact CA-O 3.22Å; Y190-I216 WeakPolarHBondContact O-CD1 3.25Å
191	F	95.3	Very high	90.2	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.2	169.3	59	-79.8	0	0	0	110.3	Y184 W205 A207 I216 L219 L247 V249 Y259 P267	Y184-F191 WeakPolarHBondContact O-CA 3.38Å; Y184-F191 WeakPolarHBondContact O-CB 3.49Å; F191-W205 HydrophobicContact CD2-CH2 4.05Å; F191-W205 AromaticContact CD2-CZ3 3.76Å; F191-W205 HydrophobicContact CD2-CZ3 3.76Å; F191-W205 HydrophobicContact CE2-CH2 4.23Å; F191-W205 AromaticContact CE2-CZ3 3.97Å; F191-W205 HydrophobicContact CE2-CZ3 3.97Å; F191-A207 HydrophobicContact CD2-CB 4.31Å; F191-A207 HydrophobicContact CE1-CB 4.03Å; F191-A207 HydrophobicContact CE2-CB 3.72Å; F191-A207 HydrophobicContact CZ-CB 3.56Å; F191-A207 PolarHBondContact N-O 3.47Å; F191-A207 PolarHBondContact O-N 3.05Å; F191-A207 VanDerWaalsContact O-O 3.1Å; F191-I216 HydrophobicContact CB-CD1 3.69Å; F191-I216 HydrophobicContact CD1-CD1 3.86Å; F191-I216 HydrophobicContact CG-CD1 4.21Å; F191-L219 HydrophobicContact CB-CD1 4.25Å; F191-L219 HydrophobicContact CB-CD2 4.15Å; F191-L247 HydrophobicContact CD2-CD2 4.17Å; F191-L247 HydrophobicContact CE2-CD2 3.94Å; F191-V249 HydrophobicContact CD1-CG1 4.4Å; F191-V249 HydrophobicContact CD2-CG2 4.44Å; F191-V249 HydrophobicContact CE1-CG2 4.48Å; F191-V249 HydrophobicContact CE2-CG2 4.35Å; F191-V249 HydrophobicContact CZ-CG2 4.37Å; F191-Y259 HydrophobicContact CE1-CE2 4.26Å; F191-Y259 HydrophobicContact CZ-CD1 4.37Å; F191-Y259 HydrophobicContact CZ-CD2 4.25Å; F191-Y259 AromaticContact CZ-CE1 3.93Å; F191-Y259 HydrophobicContact CZ-CE1 3.93Å; F191-Y259 AromaticContact CZ-CE2 3.79Å; F191-Y259 HydrophobicContact CZ-CE2 3.79Å; F191-Y259 AromaticContact CZ-CZ 3.63Å; F191-P267 HydrophobicContact CE2-CB 4.23Å; F191-P267 HydrophobicContact CE2-CG 3.97Å
192	S	94.6	Very high	90.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	155.7	-169.4	172.2	0	0	0	0	111.4	M183 Y184 R203 W205	M183-S192 WeakPolarHBondContact CA-O 3.28Å; Y184-S192 VanDerWaalsContact CE1-CB 3.4Å; Y184-S192 VanDerWaalsContact CZ-CB 3.45Å; Y184-S192 PolarHBondContact N-O 3.43Å; Y184-S192 PolarHBondContact O-N 3.02Å; Y184-S192 VanDerWaalsContact O-N 3.14Å; S192-R203 WeakPolarHBondContact OG-CG 3.42Å; S192-W205 WeakPolarHBondContact CA-O 3.39Å; S192-W205 VanDerWaalsContact CB-O 3.25Å; S192-W205 WeakPolarHBondContact CB-O 3.45Å; S192-W205 PolarHBondContact OG-O 3.18Å
193	L	93.5	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.6	169.3	179.9	71.5	0	0	0	109.6	A173 Y177 Y181 M183 I204 W205	A173-L193 HydrophobicContact CB-CD1 3.54Å; Y177-L193 HydrophobicContact CE1-CD2 3.88Å; Y177-L193 HydrophobicContact CE2-CD2 4.4Å; Y181-L193 HydrophobicContact CD1-CD1 4.27Å; Y181-L193 HydrophobicContact CD1-CD2 4.35Å; Y181-L193 HydrophobicContact CD1-CG 4.32Å; M183-L193 HydrophobicContact CG-CB 4.37Å; M183-L193 HydrophobicContact CG-CD1 3.64Å; M183-L193 HydrophobicContact SD-CD1 4.31Å; L193-I204 HydrophobicContact CB-CB 4.43Å; L193-I204 HydrophobicContact CD2-CB 4.22Å; L193-I204 HydrophobicContact CD2-CG1 4.35Å; L193-I204 HydrophobicContact CD2-CG2 4.29Å; L193-I204 HydrophobicContact CG-CB 4.31Å; L193-I204 HydrophobicContact CG-CG1 4.29Å; L193-I204 WeakPolarHBondContact O-CB 3.29Å; L193-I204 PolarHBondContact O-N 3.25Å; L193-W205 HydrophobicContact CB-CD2 3.92Å; L193-W205 HydrophobicContact CB-CG 4.41Å; L193-W205 HydrophobicContact CB-CH2 4.14Å; L193-W205 HydrophobicContact CB-CZ2 3.51Å; L193-W205 HydrophobicContact CD2-CZ2 4.35Å; L193-W205 HydrophobicContact CG-CZ2 4.49Å; L193-W205 PolarHBondContact N-O 3.49Å
194	F	91.9	Very high	90	Very high	18 Å²	18	43.7 Å²	43.7	8%	0.079	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	150.6	175	65.1	-80.7	0	0	0	111.6	L161 I170 Y181 L182 Y184 V196 V201 T202	L161-F194 HydrophobicContact CD2-CB 4.43Å; L161-F194 HydrophobicContact CD2-CG 4.45Å; I170-F194 HydrophobicContact CD1-CE1 4.38Å; I170-F194 HydrophobicContact CD1-CZ 3.75Å; Y181-F194 WeakPolarHBondContact CA-O 3.14Å; L182-F194 HydrophobicContact CB-CD1 4.22Å; L182-F194 HydrophobicContact CB-CD2 4.3Å; L182-F194 HydrophobicContact CB-CE1 3.58Å; L182-F194 HydrophobicContact CB-CE2 3.72Å; L182-F194 HydrophobicContact CB-CZ 3.35Å; L182-F194 HydrophobicContact CD1-CE2 3.92Å; L182-F194 HydrophobicContact CD1-CZ 3.91Å; L182-F194 HydrophobicContact CG-CE2 4.29Å; L182-F194 HydrophobicContact CG-CZ 4.22Å; L182-F194 PolarHBondContact N-O 3.37Å; L182-F194 WeakPolarHBondContact O-CD1 3.23Å; L182-F194 PolarHBondContact O-N 3.17Å; Y184-F194 AromaticContact CD1-CD1 3.64Å; Y184-F194 HydrophobicContact CD1-CD1 3.64Å; Y184-F194 AromaticContact CD1-CE1 3.61Å; Y184-F194 HydrophobicContact CD1-CE1 3.61Å; Y184-F194 HydrophobicContact CE1-CD1 4.15Å; Y184-F194 HydrophobicContact CG-CE1 4.45Å; F194-V196 HydrophobicContact CD2-CG2 3.67Å; F194-V196 HydrophobicContact CE2-CG2 3.46Å; F194-V196 VanDerWaalsContact CE2-CG2 3.46Å; F194-V201 HydrophobicContact CB-CG1 4.21Å; F194-V201 HydrophobicContact CD2-CG1 3.65Å; F194-V201 HydrophobicContact CE2-CG1 4.42Å; F194-V201 HydrophobicContact CG-CG1 4.31Å; F194-T202 CarbonylContact C-O 3.59Å; F194-T202 VanDerWaalsContact CA-O 3.26Å; F194-T202 WeakPolarHBondContact CA-O 3.45Å; F194-T202 WeakPolarHBondContact CB-O 3.49Å
195	Q	90.2	Very high	89.9	Confident	49 Å²	49	43.8 Å²	43.8	23%	0.229	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	126.1	174.8	-179.3	-175	-1.8	0	0	108.7	Y181 T197 V201 T202 I204	Y181-Q195 HydrophobicContact CD1-CB 4.1Å; Y181-Q195 HydrophobicContact CD2-CG 4.29Å; Y181-Q195 HydrophobicContact CE1-CB 3.84Å; Y181-Q195 HydrophobicContact CE1-CG 4.16Å; Y181-Q195 HydrophobicContact CE2-CB 4.4Å; Y181-Q195 HydrophobicContact CE2-CG 3.85Å; Y181-Q195 PolarHBondContact OH-OE1 3.12Å; Q195-T197 HydrophobicContact CG-CG2 4.23Å; Q195-V201 WeakPolarHBondContact O-CA 3.27Å; Q195-T202 PolarHBondContact N-O 3.22Å; Q195-T202 PolarHBondContact O-N 2.96Å; Q195-I204 HydrophobicContact CB-CD1 4.29Å
196	V	87.2	Confident	89.8	Confident	30 Å²	30	46.7 Å²	46.7	18%	0.182	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.9	173.4	-171.8	0	0	0	0	108.7	L158 N180 L182 F194 V201	L158-V196 HydrophobicContact CD1-CG1 3.98Å; N180-V196 VanDerWaalsContact CB-O 3.23Å; N180-V196 WeakPolarHBondContact CB-O 3.36Å; N180-V196 PolarHBondContact ND2-O 3.24Å; N180-V196 PolarHBondContact O-N 3.48Å; L182-V196 HydrophobicContact CD1-CG2 3.82Å; L182-V196 HydrophobicContact CG-CG2 4.31Å; F194-V196 HydrophobicContact CD2-CG2 3.67Å; F194-V196 HydrophobicContact CE2-CG2 3.46Å; F194-V196 VanDerWaalsContact CE2-CG2 3.46Å; V196-V201 HydrophobicContact CB-CG2 4.24Å; V196-V201 HydrophobicContact CG1-CG2 3.97Å; V196-V201 HydrophobicContact CG2-CG2 4.11Å
197	T	84	Confident	89.7	Confident	48 Å²	48	47.8 Å²	47.8	29%	0.294	25%	0.25	S	C	.	.			trans	-119.6	172.8	169	67.7	0	0	0	0	109.2	Q195 E199 N200	Q195-T197 HydrophobicContact CG-CG2 4.23Å; T197-E199 PolarHBondContact O-N 3.17Å; T197-N200 PolarHBondContact N-O 2.8Å; T197-N200 PolarHBondContact OG1-N 2.71Å; T197-N200 PolarHBondContact OG1-O 3.13Å
198	S	79.5	Confident	89.8	Confident	102 Å²	102	49.7 Å²	49.7	71%	0.713	26%	0.263	S	S	*	.	S	Bend	trans	-62.8	-22.3	177.3	48.7	0	0	0	0	113.7
199	E	80.1	Confident	89.7	Confident	153 Å²	153	48.3 Å²	48.3	72%	0.715	26%	0.258	S	S	*	.	S	Bend	trans	-111.2	-35.8	-173.9	-63.6	-178.9	177.2	0	0	112.9	T197	T197-E199 PolarHBondContact O-N 3.17Å
200	N	83.3	Confident	89.4	Confident	98 Å²	98	56.2 Å²	56.2	52%	0.524	29%	0.292	S	S	.	.			trans	-144.4	157	-172.2	-68	-50.6	0	0	0	111.7	T197	T197-N200 PolarHBondContact N-O 2.8Å; T197-N200 PolarHBondContact OG1-N 2.71Å; T197-N200 PolarHBondContact OG1-O 3.13Å
201	V	86.2	Confident	88.8	Confident	30 Å²	30	58 Å²	58	18%	0.182	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	127.7	164.3	169.4	0	0	0	0	109.4	C159 L161 F194 Q195 V196	C159-V201 WeakPolarHBondContact SG-CG2 3.23Å; L161-V201 HydrophobicContact CB-CG1 4.14Å; L161-V201 HydrophobicContact CD1-CG1 4.07Å; L161-V201 HydrophobicContact CD2-CG1 3.76Å; L161-V201 HydrophobicContact CG-CG1 4.19Å; F194-V201 HydrophobicContact CB-CG1 4.21Å; F194-V201 HydrophobicContact CD2-CG1 3.65Å; F194-V201 HydrophobicContact CE2-CG1 4.42Å; F194-V201 HydrophobicContact CG-CG1 4.31Å; Q195-V201 WeakPolarHBondContact O-CA 3.27Å; V196-V201 HydrophobicContact CB-CG2 4.24Å; V196-V201 HydrophobicContact CG1-CG2 3.97Å; V196-V201 HydrophobicContact CG2-CG2 4.11Å
202	T	88.5	Confident	87.9	Confident	64 Å²	64	59.5 Å²	59.5	39%	0.393	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.5	-179.3	54.7	0	0	0	0	110.2	F194 Q195 I204	F194-T202 CarbonylContact C-O 3.59Å; F194-T202 VanDerWaalsContact CA-O 3.26Å; F194-T202 WeakPolarHBondContact CA-O 3.45Å; F194-T202 WeakPolarHBondContact CB-O 3.49Å; Q195-T202 PolarHBondContact N-O 3.22Å; Q195-T202 PolarHBondContact O-N 2.96Å; T202-I204 PolarHBondContact O-N 3.49Å
203	R	91.1	Very high	87.3	Confident	125 Å²	125	61 Å²	61	47%	0.472	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	120.2	172.1	-174.4	174.9	65.5	-177.5	-10.1	109	S192 E206	S192-R203 WeakPolarHBondContact OG-CG 3.42Å; R203-E206 IonicContact CZ-OE2 3.52Å; R203-E206 IonicContact NH1-OE1 3.27Å; R203-E206 IonicContact NH1-OE2 3.23Å; R203-E206 PolarHBondContact NH1-OE2 3.28Å
204	I	91.9	Very high	87.1	Confident	70 Å²	70	63 Å²	63	36%	0.359	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-49.8	-179.1	-54.6	-59.1	0	0	0	110.2	Y181 L193 Q195 T202	Y181-I204 HydrophobicContact CE1-CD1 4.34Å; Y181-I204 HydrophobicContact CE1-CG1 4.19Å; L193-I204 HydrophobicContact CB-CB 4.43Å; L193-I204 HydrophobicContact CD2-CB 4.22Å; L193-I204 HydrophobicContact CD2-CG1 4.35Å; L193-I204 HydrophobicContact CD2-CG2 4.29Å; L193-I204 HydrophobicContact CG-CB 4.31Å; L193-I204 HydrophobicContact CG-CG1 4.29Å; L193-I204 WeakPolarHBondContact O-CB 3.29Å; L193-I204 PolarHBondContact O-N 3.25Å; Q195-I204 HydrophobicContact CB-CD1 4.29Å; T202-I204 PolarHBondContact O-N 3.49Å
205	W	93.3	Very high	87.1	Confident	12 Å²	12	64 Å²	64	5%	0.045	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	159.1	175.9	54.1	-110.4	0	0	0	110.3	M183 F191 S192 L193 A207 Y261 K265 Y266 P267	M183-W205 HydrophobicContact CE-CH2 3.72Å; M183-W205 HydrophobicContact CE-CZ2 4.32Å; F191-W205 HydrophobicContact CD2-CH2 4.05Å; F191-W205 AromaticContact CD2-CZ3 3.76Å; F191-W205 HydrophobicContact CD2-CZ3 3.76Å; F191-W205 HydrophobicContact CE2-CH2 4.23Å; F191-W205 AromaticContact CE2-CZ3 3.97Å; F191-W205 HydrophobicContact CE2-CZ3 3.97Å; S192-W205 WeakPolarHBondContact CA-O 3.39Å; S192-W205 VanDerWaalsContact CB-O 3.25Å; S192-W205 WeakPolarHBondContact CB-O 3.45Å; S192-W205 PolarHBondContact OG-O 3.18Å; L193-W205 HydrophobicContact CB-CD2 3.92Å; L193-W205 HydrophobicContact CB-CG 4.41Å; L193-W205 HydrophobicContact CB-CH2 4.14Å; L193-W205 HydrophobicContact CB-CZ2 3.51Å; L193-W205 HydrophobicContact CD2-CZ2 4.35Å; L193-W205 HydrophobicContact CG-CZ2 4.49Å; L193-W205 PolarHBondContact N-O 3.49Å; W205-A207 HydrophobicContact CE3-CB 4.34Å; W205-A207 HydrophobicContact CZ3-CB 4.25Å; W205-Y261 AromaticContact CZ2-CE1 3.98Å; W205-Y261 HydrophobicContact CZ2-CE1 3.98Å; W205-K265 PolarHBondContact NE1-O 2.88Å; W205-Y266 HydrophobicContact CB-CD1 3.8Å; W205-Y266 HydrophobicContact CB-CE1 3.41Å; W205-Y266 VanDerWaalsContact CB-CE1 3.41Å; W205-Y266 HydrophobicContact CG-CD1 4.15Å; W205-Y266 HydrophobicContact CG-CE1 4.18Å; W205-P267 HydrophobicContact CD2-CG 4.5Å; W205-P267 HydrophobicContact CE3-CG 4.09Å; W205-P267 HydrophobicContact CH2-CG 3.91Å; W205-P267 HydrophobicContact CZ2-CG 4.3Å; W205-P267 HydrophobicContact CZ3-CG 3.79Å
206	E	93.4	Very high	87.4	Confident	61 Å²	61	61.6 Å²	61.6	29%	0.285	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.1	172.3	-175.1	169.8	105.8	0	0	108.3	S164 Y184 Y190 R203	S164-E206 VanDerWaalsContact OG-CD 3.31Å; S164-E206 PolarHBondContact OG-OE1 3.06Å; S164-E206 PolarHBondContact OG-OE2 2.8Å; Y184-E206 PolarHBondContact OH-OE2 2.89Å; Y184-E206 VanDerWaalsContact OH-OE2 3.12Å; Y190-E206 HydrophobicContact CD1-CG 4.43Å; R203-E206 IonicContact CZ-OE2 3.52Å; R203-E206 IonicContact NH1-OE1 3.27Å; R203-E206 IonicContact NH1-OE2 3.23Å; R203-E206 PolarHBondContact NH1-OE2 3.28Å
207	A	93.2	Very high	87.7	Confident	23 Å²	23	60.3 Å²	60.3	19%	0.19	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	158.3	178	0	0	0	0	0	109.5	Y190 F191 W205 P267	Y190-A207 WeakPolarHBondContact CA-O 3.22Å; F191-A207 HydrophobicContact CD2-CB 4.31Å; F191-A207 HydrophobicContact CE1-CB 4.03Å; F191-A207 HydrophobicContact CE2-CB 3.72Å; F191-A207 HydrophobicContact CZ-CB 3.56Å; F191-A207 PolarHBondContact N-O 3.47Å; F191-A207 PolarHBondContact O-N 3.05Å; F191-A207 VanDerWaalsContact O-O 3.1Å; W205-A207 HydrophobicContact CE3-CB 4.34Å; W205-A207 HydrophobicContact CZ3-CB 4.25Å; A207-P267 HydrophobicContact CB-CG 3.89Å
208	S	92.4	Very high	88.2	Confident	65 Å²	65	59.2 Å²	59.2	46%	0.455	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	156.1	174	59.9	0	0	0	0	109.8
209	S	87.6	Confident	89	Confident	11 Å²	11	54.6 Å²	54.6	8%	0.077	28%	0.284	C	S	.	.			trans	-64.6	138.8	174.2	175.9	0	0	0	0	111.1	F211 R255 E257	S209-F211 PolarHBondContact O-N 2.85Å; S209-F211 PolarHBondContact OG-N 2.84Å; S209-R255 PolarHBondContact OG-NH2 3.17Å; S209-R255 VanDerWaalsContact OG-NH2 3.16Å; S209-E257 VanDerWaalsContact CB-OE1 3.26Å; S209-E257 WeakPolarHBondContact CB-OE1 3.22Å; S209-E257 PolarHBondContact OG-OE1 2.8Å
210	K	85.5	Confident	89.5	Confident	166 Å²	166	49.7 Å²	49.7	72%	0.722	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-17.3	171.9	-64.5	-178.4	-179.4	178.3	0	112.8
211	F	82.9	Confident	89.9	Confident	93 Å²	93	46.4 Å²	46.4	41%	0.408	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	20	-173	-52.5	-73.9	0	0	0	112.5	S209 R255 L269 E272	S209-F211 PolarHBondContact O-N 2.85Å; S209-F211 PolarHBondContact OG-N 2.84Å; F211-R255 VanDerWaalsContact C-NH1 3.35Å; F211-R255 VanDerWaalsContact CB-NH1 3.25Å; F211-R255 PolarHBondContact O-NH1 3.4Å; F211-L269 HydrophobicContact CE2-CD2 3.58Å; F211-L269 HydrophobicContact CZ-CD2 3.95Å; F211-E272 HydrophobicContact CD2-CG 4.09Å; F211-E272 VanDerWaalsContact CE1-OE2 3.29Å; F211-E272 WeakPolarHBondContact CE1-OE2 3.45Å; F211-E272 HydrophobicContact CE2-CB 4.06Å; F211-E272 HydrophobicContact CE2-CG 3.69Å; F211-E272 WeakPolarHBondContact CE2-OE2 3.29Å; F211-E272 HydrophobicContact CZ-CB 4.36Å; F211-E272 VanDerWaalsContact CZ-CD 3.46Å; F211-E272 HydrophobicContact CZ-CG 4.18Å; F211-E272 WeakPolarHBondContact CZ-OE2 3.35Å
212	G	76.1	Confident	90.1	Very high	32 Å²	32	47.1 Å²	47.1	33%	0.33	24%	0.242	S	C	.	.			trans	96.9	174	175.3	0	0	0	0	0	115	N214 R255	G212-N214 PolarHBondContact O-N 2.92Å; G212-R255 PolarHBondContact O-NH2 3.15Å
213	T	82.5	Confident	90.1	Very high	32 Å²	32	44.9 Å²	44.9	20%	0.196	23%	0.228	C	C	.	.			trans	-84	108.7	-171.5	56.6	0	0	0	0	111.1	E188	E188-T213 VanDerWaalsContact O-CA 3.24Å; E188-T213 WeakPolarHBondContact O-CA 3.08Å; E188-T213 WeakPolarHBondContact O-CB 3.35Å; E188-T213 WeakPolarHBondContact O-CG2 3.33Å
214	N	87.6	Confident	89.8	Confident	41 Å²	41	39 Å²	39	22%	0.219	21%	0.205	C	C	.	.			trans	-137.4	153.5	173.8	-71.8	-44.4	0	0	0	109.3	S187 G189 G212 I216 F251 N253 R255	S187-N214 CarbonylContact O-C 3.43Å; G189-N214 WeakPolarHBondContact CA-O 3.29Å; G189-N214 PolarHBondContact N-O 3.14Å; G212-N214 PolarHBondContact O-N 2.92Å; N214-I216 PolarHBondContact O-N 3.06Å; N214-F251 HydrophobicContact CB-CB 4.5Å; N214-F251 HydrophobicContact CB-CD1 3.75Å; N214-F251 HydrophobicContact CB-CE1 4.46Å; N214-F251 HydrophobicContact CB-CG 4.45Å; N214-F251 WeakPolarHBondContact O-CD1 3.18Å; N214-N253 PolarHBondContact ND2-ND2 2.93Å; N214-R255 PolarHBondContact ND2-NH1 3.24Å
215	E	93	Very high	89.4	Confident	38 Å²	38	38.4 Å²	38.4	18%	0.178	20%	0.203	C	C	.	.			trans	-66.8	128.1	-178.5	174.7	170.6	113.2	0	0	112	V168 S187 L217 F251 T252 K371	V168-E215 HydrophobicContact CB-CG 4.32Å; V168-E215 HydrophobicContact CG1-CG 3.69Å; V168-E215 HydrophobicContact CG2-CG 3.97Å; S187-E215 VanDerWaalsContact O-CA 3.3Å; S187-E215 WeakPolarHBondContact O-CA 3.2Å; S187-E215 PolarHBondContact O-N 3Å; E215-L217 PolarHBondContact O-N 2.92Å; E215-F251 VanDerWaalsContact O-CA 3.31Å; E215-F251 WeakPolarHBondContact O-CA 3.42Å; E215-T252 HydrophobicContact CB-CG2 4.23Å; E215-T252 HydrophobicContact CG-CG2 3.9Å; E215-T252 PolarHBondContact O-N 3.38Å; E215-T252 WeakPolarHBondContact OE1-CG2 3.14Å; E215-K371 IonicContact OE2-NZ 3.47Å; E215-K371 PolarHBondContact OE2-NZ 2.65Å
216	I	95.5	Very high	88.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	114.6	174.9	-58.7	-177.3	0	0	0	108.7	V168 T186 Y190 F191 N214 L219 V249 A250 F251	V168-I216 WeakPolarHBondContact CG1-O 3.47Å; T186-I216 PolarHBondContact O-N 3.45Å; Y190-I216 WeakPolarHBondContact O-CD1 3.25Å; F191-I216 HydrophobicContact CB-CD1 3.69Å; F191-I216 HydrophobicContact CD1-CD1 3.86Å; F191-I216 HydrophobicContact CG-CD1 4.21Å; N214-I216 PolarHBondContact O-N 3.06Å; I216-L219 HydrophobicContact CG2-CD2 3.93Å; I216-L219 HydrophobicContact CG2-CG 4.01Å; I216-V249 HydrophobicContact CD1-CG1 4.03Å; I216-V249 HydrophobicContact CG1-CG1 4.27Å; I216-V249 HydrophobicContact CG2-CG1 4.02Å; I216-A250 CarbonylContact C-O 3.59Å; I216-F251 HydrophobicContact CD1-CE1 4.43Å; I216-F251 HydrophobicContact CG1-CD1 4.12Å; I216-F251 HydrophobicContact CG1-CE1 3.72Å; I216-F251 HydrophobicContact CG1-CZ 4.31Å
217	L	94.8	Very high	87.4	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-51.4	178.5	174.5	68.9	0	0	0	111.4	R18 E215 A250 T252 L279 V282	R18-L217 HydrophobicContact CG-CD1 3.93Å; R18-L217 PolarHBondContact NH2-O 3.24Å; E215-L217 PolarHBondContact O-N 2.92Å; L217-A250 WeakPolarHBondContact CB-O 3.27Å; L217-A250 PolarHBondContact N-O 3.19Å; L217-T252 HydrophobicContact CB-CG2 3.86Å; L217-T252 HydrophobicContact CD1-CG2 4.06Å; L217-L279 HydrophobicContact CD2-CB 3.68Å; L217-L279 WeakPolarHBondContact CD2-O 3.5Å; L217-V282 HydrophobicContact CD2-CG2 4.19Å
218	S	94.3	Very high	85.8	Confident	24 Å²	24	42.3 Å²	42.3	17%	0.168	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	154.9	-175.7	63.4	0	0	0	0	112.5	A250	S218-A250 PolarHBondContact N-O 3.03Å; S218-A250 PolarHBondContact O-N 2.96Å
219	L	94.7	Very high	84	Confident	6 Å²	6	42.9 Å²	42.9	3%	0.031	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.2	173.6	-64.9	170.6	0	0	0	107.9	N171 M183 Y184 F191 I216 I248 V249	N171-L219 PolarHBondContact ND2-O 2.91Å; M183-L219 HydrophobicContact CB-CD1 4.24Å; Y184-L219 VanDerWaalsContact O-CD1 3.31Å; Y184-L219 WeakPolarHBondContact O-CD1 3.38Å; F191-L219 HydrophobicContact CB-CD1 4.25Å; F191-L219 HydrophobicContact CB-CD2 4.15Å; I216-L219 HydrophobicContact CG2-CD2 3.93Å; I216-L219 HydrophobicContact CG2-CG 4.01Å; L219-I248 WeakPolarHBondContact CA-O 3.5Å; L219-V249 HydrophobicContact CD2-CB 4.12Å; L219-V249 HydrophobicContact CD2-CG1 3.87Å; L219-V249 HydrophobicContact CD2-CG2 3.7Å
220	E	92.4	Very high	82	Confident	49 Å²	49	47.2 Å²	47.2	23%	0.229	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	143.2	179.4	-174.6	173.1	-167.6	0	0	110.9	I248 A284	E220-I248 PolarHBondContact N-O 3.28Å; E220-I248 VanDerWaalsContact N-O 3.08Å; E220-I248 WeakPolarHBondContact O-CB 3.11Å; E220-I248 PolarHBondContact O-N 2.96Å; E220-A284 PolarHBondContact OE2-N 3.36Å
221	H	91.9	Very high	80.1	Confident	29 Å²	29	47 Å²	47	13%	0.134	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.1	168.2	-69.6	94.1	0	0	0	110.1	H174 M183 D245 I246 Y261	H174-H221 PolarHBondContact N-CE1 2.9Å; H174-H221 PolarHBondContact N-ND1 3.37Å; M183-H221 PolarHBondContact SD-CE1 2.75Å; H221-D245 HydrophobicContact CB-CB 4.15Å; H221-I246 WeakPolarHBondContact CA-O 3.47Å; H221-Y261 AromaticContact NE2-CE2 3.78Å; H221-Y261 AromaticContact NE2-CZ 3.77Å; H221-Y261 PolarHBondContact NE2-OH 3.49Å
222	Y	90.2	Very high	78	Confident	46 Å²	46	46.2 Å²	46.2	18%	0.18	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	140	175.3	-165	-93.6	0	0	0	111.8	M224 I246 A284 G285 R286 P293	Y222-M224 HydrophobicContact CD1-CG 4.22Å; Y222-M224 HydrophobicContact CD1-SD 3.69Å; Y222-M224 HydrophobicContact CE1-SD 4.25Å; Y222-M224 PolarHBondContact O-N 3.32Å; Y222-I246 PolarHBondContact N-O 3.27Å; Y222-I246 PolarHBondContact O-N 2.98Å; Y222-A284 HydrophobicContact CD1-CB 3.8Å; Y222-A284 HydrophobicContact CD2-CB 3.71Å; Y222-A284 HydrophobicContact CE2-CB 4.44Å; Y222-A284 HydrophobicContact CG-CB 3.35Å; Y222-G285 WeakPolarHBondContact OH-CA 3.35Å; Y222-R286 PolarHBondContact OH-NH1 2.7Å; Y222-P293 HydrophobicContact CD1-CB 4.47Å; Y222-P293 HydrophobicContact CE1-CB 3.76Å
223	D	87.7	Confident	76	Confident	17 Å²	17	52.5 Å²	52.5	9%	0.091	28%	0.279	C	S	.	.			trans	-72.5	92.5	173	-176.5	-3.1	0	0	0	111	L225 N226 T243 D245	D223-L225 PolarHBondContact OD1-N 3.33Å; D223-L225 VanDerWaalsContact OD1-N 3.11Å; D223-N226 VanDerWaalsContact OD1-CB 3.23Å; D223-N226 WeakPolarHBondContact OD1-CB 3.45Å; D223-N226 PolarHBondContact OD1-N 3.32Å; D223-N226 WeakPolarHBondContact OD2-CB 3.44Å; D223-N226 PolarHBondContact OD2-ND2 3.18Å; D223-T243 WeakPolarHBondContact OD2-CG2 3.35Å; D223-D245 WeakPolarHBondContact CB-OD1 3.26Å; D223-D245 PolarHBondContact N-OD1 3.03Å
224	M	85.7	Confident	73.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.			trans	-85.7	-6.4	175.7	-66.9	-64.2	-63.8	0	0	113.3	F3 L5 Y222 I246 I248 P293 L295 T309	F3-M224 HydrophobicContact CE2-CB 4.48Å; F3-M224 HydrophobicContact CZ-CB 4.06Å; L5-M224 HydrophobicContact CD2-CE 3.85Å; Y222-M224 HydrophobicContact CD1-CG 4.22Å; Y222-M224 HydrophobicContact CD1-SD 3.69Å; Y222-M224 HydrophobicContact CE1-SD 4.25Å; Y222-M224 PolarHBondContact O-N 3.32Å; M224-I246 HydrophobicContact CB-CD1 3.88Å; M224-I248 HydrophobicContact CG-CD1 4.38Å; M224-P293 HydrophobicContact CE-CB 4.31Å; M224-P293 VanDerWaalsContact O-CG 3.29Å; M224-P293 WeakPolarHBondContact O-CG 3.35Å; M224-P293 HydrophobicContact SD-CB 3.94Å; M224-L295 HydrophobicContact CE-CD2 3.99Å; M224-L295 HydrophobicContact CE-CG 3.92Å; M224-L295 HydrophobicContact SD-CD2 3.72Å; M224-L295 HydrophobicContact SD-CG 4.33Å; M224-T309 HydrophobicContact CE-CG2 4.15Å
225	L	82.3	Confident	71.5	Confident	59 Å²	59	60 Å²	60	31%	0.309	32%	0.324	S	S	.	.	S	Bend	trans	-97.9	-16.6	-175.3	-65.3	172.2	0	0	0	113.2	F3 D223 Y227 I246	F3-L225 HydrophobicContact CD2-CD2 3.75Å; F3-L225 HydrophobicContact CE2-CD2 3.78Å; D223-L225 PolarHBondContact OD1-N 3.33Å; D223-L225 VanDerWaalsContact OD1-N 3.11Å; L225-Y227 VanDerWaalsContact C-N 3.3Å; L225-Y227 WeakPolarHBondContact O-CD1 3.49Å; L225-Y227 WeakPolarHBondContact O-CE1 3.23Å; L225-Y227 PolarHBondContact O-N 3.4Å; L225-I246 HydrophobicContact CD1-CD1 3.83Å; L225-I246 HydrophobicContact CD2-CD1 4.23Å; L225-I246 HydrophobicContact CG-CD1 3.59Å
226	N	76	Confident	68.9	Low	41 Å²	41	64 Å²	64	22%	0.219	35%	0.346	C	S	.	.			trans	-82.2	74.4	-178.9	-174.1	-0.1	0	0	0	111.9	D223 R286	D223-N226 VanDerWaalsContact OD1-CB 3.23Å; D223-N226 WeakPolarHBondContact OD1-CB 3.45Å; D223-N226 PolarHBondContact OD1-N 3.32Å; D223-N226 WeakPolarHBondContact OD2-CB 3.44Å; D223-N226 PolarHBondContact OD2-ND2 3.18Å; N226-R286 PolarHBondContact O-NH2 2.9Å
227	Y	68.7	Low	66.2	Low	77 Å²	77	71.7 Å²	71.7	30%	0.302	39%	0.388	S	S	.	.			trans	-102.4	141.8	166.3	55.3	-89.3	0	0	0	110.2	L225 D229 N291 Y292	L225-Y227 VanDerWaalsContact C-N 3.3Å; L225-Y227 WeakPolarHBondContact O-CD1 3.49Å; L225-Y227 WeakPolarHBondContact O-CE1 3.23Å; L225-Y227 PolarHBondContact O-N 3.4Å; Y227-D229 PolarHBondContact O-N 3.42Å; Y227-N291 VanDerWaalsContact CA-O 3.28Å; Y227-N291 WeakPolarHBondContact CA-O 3.29Å; Y227-N291 WeakPolarHBondContact CB-O 3.46Å; Y227-Y292 HydrophobicContact CD2-CE1 4.39Å; Y227-Y292 HydrophobicContact CG-CD1 4.43Å
228	V	60.1	Low	63.5	Low	59 Å²	59	77.8 Å²	77.8	36%	0.358	42%	0.42	S	S	.	.			trans	-86	101.5	174.7	-177.8	0	0	0	0	107.6	N230 N291	V228-N230 PolarHBondContact O-N 3.42Å; V228-N291 PolarHBondContact N-O 3.1Å
229	D	54.5	Low	60.9	Low	78 Å²	78	83.8 Å²	83.8	42%	0.417	45%	0.45	S	S	.	.			trans	-69.2	118.2	165	-90.7	-16.7	0	0	0	108.2	Y227 N231 S232	Y227-D229 PolarHBondContact O-N 3.42Å; D229-N231 PolarHBondContact O-N 3.5Å; D229-S232 PolarHBondContact O-N 2.9Å; D229-S232 PolarHBondContact O-OG 3.47Å
230	N	46.6	Very low	58.2	Low	101 Å²	101	89.8 Å²	89.8	54%	0.54	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	7.2	-179.9	-69.2	-30.4	0	0	0	114.4	V228	V228-N230 PolarHBondContact O-N 3.42Å
231	N	44.4	Very low	55.9	Low	163 Å²	163	95.9 Å²	95.9	87%	0.872	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-3.3	179.9	-77.2	-8.4	0	0	0	114.1	D229	D229-N231 PolarHBondContact O-N 3.5Å
232	S	39.1	Very low	53.8	Low	75 Å²	75	101.6 Å²	101.6	52%	0.524	54%	0.543	S	S	.	.			trans	-101.5	92.1	169	55.6	0	0	0	0	110.7	D229 S234	D229-S232 PolarHBondContact O-N 2.9Å; D229-S232 PolarHBondContact O-OG 3.47Å; S232-S234 PolarHBondContact O-N 3.08Å
233	N	34.7	Very low	52.3	Low	164 Å²	164	102.3 Å²	102.3	88%	0.877	55%	0.552	S	S	*	*			trans	-73.4	58.4	164.5	-82	-24.5	0	0	0	110.9
234	S	36.9	Very low	51.5	Low	75 Å²	75	107.3 Å²	107.3	52%	0.524	58%	0.575	S	S	.	*			trans	-102.5	101.5	165.3	52.1	0	0	0	0	107.7	S232 D236	S232-S234 PolarHBondContact O-N 3.08Å; S234-D236 PolarHBondContact O-N 3.01Å
235	N	37.3	Very low	51.2	Low	156 Å²	156	108.4 Å²	108.4	83%	0.834	58%	0.581	S	S	*	*			trans	-72.3	35.7	167.1	-73.6	-36.2	0	0	0	111.5	D237	N235-D237 PolarHBondContact O-N 3.05Å
236	D	38.5	Very low	51.6	Low	121 Å²	121	105.7 Å²	105.7	65%	0.647	57%	0.566	S	S	*	*			trans	-93.4	98.9	178.3	-64.4	-31.8	0	0	0	107.1	S234 D238	S234-D236 PolarHBondContact O-N 3.01Å; D236-D238 PolarHBondContact O-N 3.44Å
237	D	40.3	Very low	52.5	Low	163 Å²	163	103.7 Å²	103.7	87%	0.872	56%	0.556	S	S	*	*			trans	-62.7	31.3	164.7	-75.9	-40.5	0	0	0	112	N235 D239	N235-D237 PolarHBondContact O-N 3.05Å; D237-D239 PolarHBondContact O-N 3.04Å
238	D	37.5	Very low	53.8	Low	130 Å²	130	100.2 Å²	100.2	70%	0.695	54%	0.542	S	S	*	.			trans	-80.7	118.6	176.1	-89.4	-18.9	0	0	0	109.2	D236 N240	D236-D238 PolarHBondContact O-N 3.44Å; D238-N240 PolarHBondContact O-N 3.49Å
239	D	40	Very low	55.5	Low	150 Å²	150	97.4 Å²	97.4	80%	0.802	53%	0.525	S	S	*	.			trans	-51.2	76.8	169	-68.8	-51	0	0	0	111.5	D237 E241	D237-D239 PolarHBondContact O-N 3.04Å; D239-E241 PolarHBondContact O-N 3.04Å
240	N	37.9	Very low	57.5	Low	132 Å²	132	93.7 Å²	93.7	71%	0.706	51%	0.505	S	S	*	.			trans	-68.1	86.8	165.6	-89.1	-39.5	0	0	0	107.7	D238 N242	D238-N240 PolarHBondContact O-N 3.49Å; N240-N242 PolarHBondContact O-N 3.34Å
241	E	44	Very low	59.8	Low	177 Å²	177	88.9 Å²	88.9	83%	0.827	48%	0.48	S	S	*	.			trans	-60.7	0.8	174.4	-74.1	-171.7	144.8	0	0	113.6	D239 T243	D239-E241 PolarHBondContact O-N 3.04Å; E241-T243 VanDerWaalsContact C-N 3.3Å; E241-T243 PolarHBondContact O-N 3.46Å
242	N	47.6	Very low	62.1	Low	149 Å²	149	81.9 Å²	81.9	80%	0.797	44%	0.443	S	S	*	.			trans	-89.9	48.4	177.7	-77.7	-11.5	0	0	0	113.1	N240 E244	N240-N242 PolarHBondContact O-N 3.34Å; N242-E244 PolarHBondContact O-N 2.97Å
243	T	57.8	Low	64.5	Low	61 Å²	61	80.7 Å²	80.7	37%	0.374	43%	0.43	S	S	.	.			trans	-79	101.3	164.8	51.3	0	0	0	0	109	D223 E241 D245	D223-T243 WeakPolarHBondContact OD2-CG2 3.35Å; E241-T243 VanDerWaalsContact C-N 3.3Å; E241-T243 PolarHBondContact O-N 3.46Å; T243-D245 PolarHBondContact O-N 3.32Å
244	E	70.8	Confident	67.2	Low	123 Å²	123	72.9 Å²	72.9	58%	0.575	39%	0.389	S	S	*	.			trans	-81.1	94.6	171.6	-69.9	-176.6	172.9	0	0	109.5	N242 I246 K260	N242-E244 PolarHBondContact O-N 2.97Å; E244-I246 PolarHBondContact O-N 3.49Å; E244-K260 IonicContact OE2-NZ 3.29Å; E244-K260 PolarHBondContact OE2-NZ 3.46Å
245	D	81.2	Confident	70	Confident	23 Å²	23	69.7 Å²	69.7	12%	0.123	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-59.8	130.7	169.8	-76.2	-10.9	0	0	0	109.3	H174 H221 D223 T243	H174-D245 WeakPolarHBondContact CD2-CB 3.2Å; H174-D245 IonicContact CD2-OD2 3.65Å; H174-D245 PolarHBondContact CD2-OD2 3.33Å; H174-D245 VanDerWaalsContact CD2-OD2 3.24Å; H174-D245 WeakPolarHBondContact NE2-CB 3.25Å; H174-D245 IonicContact NE2-OD2 3.04Å; H174-D245 PolarHBondContact NE2-OD2 3.12Å; H221-D245 HydrophobicContact CB-CB 4.15Å; D223-D245 WeakPolarHBondContact CB-OD1 3.26Å; D223-D245 PolarHBondContact N-OD1 3.03Å; T243-D245 PolarHBondContact O-N 3.32Å
246	I	90.7	Very high	72.8	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	138.6	177.5	-70.8	156.5	0	0	0	108.6	H221 Y222 M224 L225 E244 I248 L258 K260 M270	H221-I246 WeakPolarHBondContact CA-O 3.47Å; Y222-I246 PolarHBondContact N-O 3.27Å; Y222-I246 PolarHBondContact O-N 2.98Å; M224-I246 HydrophobicContact CB-CD1 3.88Å; L225-I246 HydrophobicContact CD1-CD1 3.83Å; L225-I246 HydrophobicContact CD2-CD1 4.23Å; L225-I246 HydrophobicContact CG-CD1 3.59Å; E244-I246 PolarHBondContact O-N 3.49Å; I246-I248 PolarHBondContact O-N 3.45Å; I246-L258 HydrophobicContact CG2-CB 3.79Å; I246-L258 HydrophobicContact CG2-CD2 4.24Å; I246-L258 HydrophobicContact CG2-CG 4.44Å; I246-K260 HydrophobicContact CG1-CG 4.44Å; I246-M270 HydrophobicContact CD1-CE 3.53Å; I246-M270 HydrophobicContact CD1-SD 4.28Å; I246-M270 HydrophobicContact CG1-CE 3.99Å; I246-M270 HydrophobicContact CG2-CE 3.87Å
247	L	94.4	Very high	75.5	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	118.8	169.6	172.1	67.7	0	0	0	109.2	M183 F191 V249 L258 Y259 Y261	M183-L247 HydrophobicContact CE-CD1 3.64Å; M183-L247 HydrophobicContact CE-CD2 3.7Å; M183-L247 HydrophobicContact CE-CG 4.33Å; M183-L247 HydrophobicContact SD-CD1 4.27Å; F191-L247 HydrophobicContact CD2-CD2 4.17Å; F191-L247 HydrophobicContact CE2-CD2 3.94Å; L247-V249 HydrophobicContact CD2-CG2 4.15Å; L247-V249 HydrophobicContact CG-CG2 4.01Å; L247-L258 WeakPolarHBondContact O-CA 3.48Å; L247-Y259 PolarHBondContact N-O 3.48Å; L247-Y259 PolarHBondContact O-N 3.35Å; L247-Y261 HydrophobicContact CB-CE2 4.48Å
248	I	95.1	Very high	78.1	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.015	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.1	174.7	-58.5	152.8	0	0	0	107.9	L219 E220 M224 I246 I256 L258 A284 L295	L219-I248 WeakPolarHBondContact CA-O 3.5Å; E220-I248 PolarHBondContact N-O 3.28Å; E220-I248 VanDerWaalsContact N-O 3.08Å; E220-I248 WeakPolarHBondContact O-CB 3.11Å; E220-I248 PolarHBondContact O-N 2.96Å; M224-I248 HydrophobicContact CG-CD1 4.38Å; I246-I248 PolarHBondContact O-N 3.45Å; I248-I256 HydrophobicContact CG2-CG2 4.16Å; I248-L258 HydrophobicContact CB-CD2 4.06Å; I248-L258 HydrophobicContact CG1-CD2 3.54Å; I248-L258 HydrophobicContact CG2-CD2 4.02Å; I248-A284 HydrophobicContact CD1-CB 3.6Å; I248-L295 HydrophobicContact CD1-CD2 3.58Å; I248-L295 HydrophobicContact CG1-CD2 4.25Å; I248-L295 HydrophobicContact CG2-CD1 4.35Å; I248-L295 HydrophobicContact CG2-CD2 4.37Å
249	V	96.3	Very high	80.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	108.8	174.8	-174.4	0	0	0	0	107.8	F191 I216 L219 L247 F251 E257 Y259	F191-V249 HydrophobicContact CD1-CG1 4.4Å; F191-V249 HydrophobicContact CD2-CG2 4.44Å; F191-V249 HydrophobicContact CE1-CG2 4.48Å; F191-V249 HydrophobicContact CE2-CG2 4.35Å; F191-V249 HydrophobicContact CZ-CG2 4.37Å; I216-V249 HydrophobicContact CD1-CG1 4.03Å; I216-V249 HydrophobicContact CG1-CG1 4.27Å; I216-V249 HydrophobicContact CG2-CG1 4.02Å; L219-V249 HydrophobicContact CD2-CB 4.12Å; L219-V249 HydrophobicContact CD2-CG1 3.87Å; L219-V249 HydrophobicContact CD2-CG2 3.7Å; L247-V249 HydrophobicContact CD2-CG2 4.15Å; L247-V249 HydrophobicContact CG-CG2 4.01Å; V249-F251 HydrophobicContact CB-CE2 4.38Å; V249-F251 HydrophobicContact CG1-CD2 4.47Å; V249-F251 HydrophobicContact CG1-CE2 3.7Å; V249-F251 HydrophobicContact CG1-CZ 3.79Å; V249-E257 HydrophobicContact CB-CB 4.37Å; V249-E257 PolarHBondContact N-O 2.53Å; V249-E257 PolarHBondContact O-N 3.07Å; V249-Y259 HydrophobicContact CB-CD2 4.47Å; V249-Y259 HydrophobicContact CB-CE2 4.24Å; V249-Y259 HydrophobicContact CG2-CD2 3.71Å; V249-Y259 HydrophobicContact CG2-CE2 3.79Å
250	A	96.4	Very high	83.2	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.6	178	0	0	0	0	0	110.4	I216 L217 S218 I256 V282	I216-A250 CarbonylContact C-O 3.59Å; L217-A250 WeakPolarHBondContact CB-O 3.27Å; L217-A250 PolarHBondContact N-O 3.19Å; S218-A250 PolarHBondContact N-O 3.03Å; S218-A250 PolarHBondContact O-N 2.96Å; A250-I256 HydrophobicContact CB-CG1 4.46Å; A250-V282 HydrophobicContact CB-CB 3.72Å; A250-V282 HydrophobicContact CB-CG1 4.15Å; A250-V282 HydrophobicContact CB-CG2 3.63Å
251	F	95.6	Very high	85.7	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	148.8	177.1	-63.1	-95.3	0	0	0	110.5	N214 E215 I216 V249 N253 G254 R255 E257	N214-F251 HydrophobicContact CB-CB 4.5Å; N214-F251 HydrophobicContact CB-CD1 3.75Å; N214-F251 HydrophobicContact CB-CE1 4.46Å; N214-F251 HydrophobicContact CB-CG 4.45Å; N214-F251 WeakPolarHBondContact O-CD1 3.18Å; E215-F251 VanDerWaalsContact O-CA 3.31Å; E215-F251 WeakPolarHBondContact O-CA 3.42Å; I216-F251 HydrophobicContact CD1-CE1 4.43Å; I216-F251 HydrophobicContact CG1-CD1 4.12Å; I216-F251 HydrophobicContact CG1-CE1 3.72Å; I216-F251 HydrophobicContact CG1-CZ 4.31Å; V249-F251 HydrophobicContact CB-CE2 4.38Å; V249-F251 HydrophobicContact CG1-CD2 4.47Å; V249-F251 HydrophobicContact CG1-CE2 3.7Å; V249-F251 HydrophobicContact CG1-CZ 3.79Å; F251-N253 VanDerWaalsContact CB-OD1 3.24Å; F251-N253 WeakPolarHBondContact CB-OD1 3.06Å; F251-N253 PolarHBondContact O-N 3.39Å; F251-G254 PolarHBondContact O-N 3.38Å; F251-R255 HydrophobicContact CB-CB 4.11Å; F251-R255 WeakPolarHBondContact CB-O 3.34Å; F251-R255 HydrophobicContact CD2-CB 3.95Å; F251-R255 HydrophobicContact CD2-CG 4.1Å; F251-R255 WeakPolarHBondContact CD2-O 3.49Å; F251-R255 VanDerWaalsContact CE1-NH2 3.29Å; F251-R255 HydrophobicContact CG-CB 4.26Å; F251-R255 PolarHBondContact N-O 3.27Å; F251-E257 HydrophobicContact CE2-CB 4.35Å; F251-E257 HydrophobicContact CE2-CG 3.89Å; F251-E257 WeakPolarHBondContact CE2-OE1 3.49Å
252	T	92.7	Very high	87.8	Confident	16 Å²	16	30.1 Å²	30.1	10%	0.098	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.8	-179.8	52.9	0	0	0	0	112.9	E215 L217 G254 H278 L279	E215-T252 HydrophobicContact CB-CG2 4.23Å; E215-T252 HydrophobicContact CG-CG2 3.9Å; E215-T252 PolarHBondContact O-N 3.38Å; E215-T252 WeakPolarHBondContact OE1-CG2 3.14Å; L217-T252 HydrophobicContact CB-CG2 3.86Å; L217-T252 HydrophobicContact CD1-CG2 4.06Å; T252-G254 VanDerWaalsContact C-N 3.28Å; T252-G254 PolarHBondContact O-N 3.34Å; T252-H278 CarbonylContact O-C 3.52Å; T252-H278 WeakPolarHBondContact O-CA 3.4Å; T252-L279 PolarHBondContact O-N 3.29Å
253	N	89.3	Confident	89.6	Confident	50 Å²	50	30.7 Å²	30.7	27%	0.267	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-1.9	-178.5	73.6	-24.1	0	0	0	115.1	N214 F251 R255 Y277	N214-N253 PolarHBondContact ND2-ND2 2.93Å; F251-N253 VanDerWaalsContact CB-OD1 3.24Å; F251-N253 WeakPolarHBondContact CB-OD1 3.06Å; F251-N253 PolarHBondContact O-N 3.39Å; N253-R255 PolarHBondContact OD1-N 3.09Å; N253-Y277 CarbonylContact C-O 3.41Å
254	G	91.6	Very high	90.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	105.3	-5	179.2	0	0	0	0	0	115.2	F251 T252 N274 V275 Y277	F251-G254 PolarHBondContact O-N 3.38Å; T252-G254 VanDerWaalsContact C-N 3.28Å; T252-G254 PolarHBondContact O-N 3.34Å; G254-N274 PolarHBondContact O-OD1 3.25Å; G254-V275 WeakPolarHBondContact O-CG2 3.22Å; G254-V275 PolarHBondContact O-N 2.96Å; G254-Y277 WeakPolarHBondContact CA-O 3.33Å; G254-Y277 PolarHBondContact N-O 3.42Å
255	R	94.4	Very high	91.6	Very high	9 Å²	9	34.9 Å²	34.9	3%	0.034	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138.4	171.3	-171.3	172.7	66.4	-148.8	4.2	110.1	S209 F211 G212 N214 F251 N253 E257 E272 T273	S209-R255 PolarHBondContact OG-NH2 3.17Å; S209-R255 VanDerWaalsContact OG-NH2 3.16Å; F211-R255 VanDerWaalsContact C-NH1 3.35Å; F211-R255 VanDerWaalsContact CB-NH1 3.25Å; F211-R255 PolarHBondContact O-NH1 3.4Å; G212-R255 PolarHBondContact O-NH2 3.15Å; N214-R255 PolarHBondContact ND2-NH1 3.24Å; F251-R255 HydrophobicContact CB-CB 4.11Å; F251-R255 WeakPolarHBondContact CB-O 3.34Å; F251-R255 HydrophobicContact CD2-CB 3.95Å; F251-R255 HydrophobicContact CD2-CG 4.1Å; F251-R255 WeakPolarHBondContact CD2-O 3.49Å; F251-R255 VanDerWaalsContact CE1-NH2 3.29Å; F251-R255 HydrophobicContact CG-CB 4.26Å; F251-R255 PolarHBondContact N-O 3.27Å; N253-R255 PolarHBondContact OD1-N 3.09Å; R255-E257 WeakPolarHBondContact CD-OE1 3.45Å; R255-E257 HydrophobicContact CG-CG 4.26Å; R255-E257 IonicContact CZ-OE1 2.69Å; R255-E257 IonicContact NE-OE1 3.14Å; R255-E257 PolarHBondContact NE-OE1 2.93Å; R255-E257 IonicContact NH2-OE1 3.97Å; R255-E272 HydrophobicContact CG-CG 4.31Å; R255-T273 CarbonylContact C-O 3.57Å; R255-T273 WeakPolarHBondContact CA-O 2.95Å
256	I	95.8	Very high	92	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	127	173.7	-59.7	172.9	0	0	0	107.6	I248 A250 E272 T273 L279 V282 L295 L307	I248-I256 HydrophobicContact CG2-CG2 4.16Å; A250-I256 HydrophobicContact CB-CG1 4.46Å; I256-E272 WeakPolarHBondContact O-CA 3.49Å; I256-T273 HydrophobicContact CB-CG2 3.95Å; I256-T273 PolarHBondContact N-O 3.36Å; I256-T273 PolarHBondContact O-N 3.25Å; I256-L279 HydrophobicContact CD1-CD1 4Å; I256-L279 HydrophobicContact CG1-CD1 4.04Å; I256-V282 HydrophobicContact CD1-CG1 4.41Å; I256-V282 HydrophobicContact CD1-CG2 4.33Å; I256-L295 HydrophobicContact CG2-CD1 3.87Å; I256-L307 HydrophobicContact CD1-CD1 3.65Å
257	E	95.6	Very high	92.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.1	-178.5	-66.7	170.3	-164.3	0	0	110	S209 V249 F251 R255 Y259 L269 Y271 E272	S209-E257 VanDerWaalsContact CB-OE1 3.26Å; S209-E257 WeakPolarHBondContact CB-OE1 3.22Å; S209-E257 PolarHBondContact OG-OE1 2.8Å; V249-E257 HydrophobicContact CB-CB 4.37Å; V249-E257 PolarHBondContact N-O 2.53Å; V249-E257 PolarHBondContact O-N 3.07Å; F251-E257 HydrophobicContact CE2-CB 4.35Å; F251-E257 HydrophobicContact CE2-CG 3.89Å; F251-E257 WeakPolarHBondContact CE2-OE1 3.49Å; R255-E257 WeakPolarHBondContact CD-OE1 3.45Å; R255-E257 HydrophobicContact CG-CG 4.26Å; R255-E257 IonicContact CZ-OE1 2.69Å; R255-E257 IonicContact NE-OE1 3.14Å; R255-E257 PolarHBondContact NE-OE1 2.93Å; R255-E257 IonicContact NH2-OE1 3.97Å; E257-Y259 HydrophobicContact CB-CD2 4.19Å; E257-Y259 HydrophobicContact CB-CE2 3.48Å; E257-Y259 VanDerWaalsContact CB-CE2 3.48Å; E257-Y259 HydrophobicContact CG-CE2 4.44Å; E257-Y259 VanDerWaalsContact OE2-CE2 3.3Å; E257-Y259 WeakPolarHBondContact OE2-CE2 2.95Å; E257-Y259 VanDerWaalsContact OE2-CZ 3.29Å; E257-Y259 PolarHBondContact OE2-OH 3.24Å; E257-L269 HydrophobicContact CB-CD1 3.86Å; E257-L269 HydrophobicContact CG-CD1 4.09Å; E257-Y271 WeakPolarHBondContact CA-O 3.33Å; E257-E272 HydrophobicContact CG-CG 4.3Å
258	L	95	Very high	91.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.3	177.4	-58.3	-172.3	0	0	0	109.4	F3 L5 I246 L247 I248 M270 Y271 L295	F3-L258 HydrophobicContact CD1-CD1 4.13Å; F3-L258 HydrophobicContact CE1-CD1 3.36Å; F3-L258 HydrophobicContact CZ-CD1 3.99Å; L5-L258 HydrophobicContact CD1-CD1 4.36Å; I246-L258 HydrophobicContact CG2-CB 3.79Å; I246-L258 HydrophobicContact CG2-CD2 4.24Å; I246-L258 HydrophobicContact CG2-CG 4.44Å; L247-L258 WeakPolarHBondContact O-CA 3.48Å; I248-L258 HydrophobicContact CB-CD2 4.06Å; I248-L258 HydrophobicContact CG1-CD2 3.54Å; I248-L258 HydrophobicContact CG2-CD2 4.02Å; L258-M270 HydrophobicContact CB-CE 3.6Å; L258-M270 HydrophobicContact CD1-CE 3.99Å; L258-M270 HydrophobicContact CG-CE 4.46Å; L258-M270 WeakPolarHBondContact O-CB 3.27Å; L258-M270 PolarHBondContact O-N 2.7Å; L258-Y271 HydrophobicContact CD1-CD1 3.91Å; L258-Y271 HydrophobicContact CD1-CG 4.36Å; L258-Y271 HydrophobicContact CG-CD1 4.13Å; L258-Y271 PolarHBondContact N-O 2.86Å; L258-Y271 PolarHBondContact O-N 2.85Å; L258-L295 HydrophobicContact CD2-CD1 4.43Å
259	Y	93.5	Very high	91.9	Very high	9 Å²	9	47.4 Å²	47.4	4%	0.035	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	129.8	-178	-69.8	-96.1	0	0	0	111.1	F191 L247 V249 E257 P267 L268 L269	F191-Y259 HydrophobicContact CE1-CE2 4.26Å; F191-Y259 HydrophobicContact CZ-CD1 4.37Å; F191-Y259 HydrophobicContact CZ-CD2 4.25Å; F191-Y259 AromaticContact CZ-CE1 3.93Å; F191-Y259 HydrophobicContact CZ-CE1 3.93Å; F191-Y259 AromaticContact CZ-CE2 3.79Å; F191-Y259 HydrophobicContact CZ-CE2 3.79Å; F191-Y259 AromaticContact CZ-CZ 3.63Å; L247-Y259 PolarHBondContact N-O 3.48Å; L247-Y259 PolarHBondContact O-N 3.35Å; V249-Y259 HydrophobicContact CB-CD2 4.47Å; V249-Y259 HydrophobicContact CB-CE2 4.24Å; V249-Y259 HydrophobicContact CG2-CD2 3.71Å; V249-Y259 HydrophobicContact CG2-CE2 3.79Å; E257-Y259 HydrophobicContact CB-CD2 4.19Å; E257-Y259 HydrophobicContact CB-CE2 3.48Å; E257-Y259 VanDerWaalsContact CB-CE2 3.48Å; E257-Y259 HydrophobicContact CG-CE2 4.44Å; E257-Y259 VanDerWaalsContact OE2-CE2 3.3Å; E257-Y259 WeakPolarHBondContact OE2-CE2 2.95Å; E257-Y259 VanDerWaalsContact OE2-CZ 3.29Å; E257-Y259 PolarHBondContact OE2-OH 3.24Å; Y259-P267 HydrophobicContact CD1-CB 3.76Å; Y259-P267 HydrophobicContact CG-CB 4.09Å; Y259-L268 CarbonylContact C-O 3.58Å; Y259-L268 WeakPolarHBondContact CA-O 3.11Å; Y259-L269 HydrophobicContact CD1-CB 4.13Å; Y259-L269 VanDerWaalsContact CD1-N 3.34Å; Y259-L269 HydrophobicContact CE1-CB 3.74Å; Y259-L269 HydrophobicContact CE1-CD1 4.13Å; Y259-L269 HydrophobicContact CE2-CD1 4.09Å
260	K	91.6	Very high	91.6	Very high	67 Å²	67	50.1 Å²	50.1	29%	0.291	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	158.2	163.9	-76	-170.6	159.7	-156.7	0	109.6	E244 I246 P267 L268 M270	E244-K260 IonicContact OE2-NZ 3.29Å; E244-K260 PolarHBondContact OE2-NZ 3.46Å; I246-K260 HydrophobicContact CG1-CG 4.44Å; K260-P267 CarbonylContact O-C 3.58Å; K260-P267 WeakPolarHBondContact O-CA 3.4Å; K260-L268 PolarHBondContact N-O 3.39Å; K260-L268 PolarHBondContact O-N 2.87Å; K260-M270 HydrophobicContact CD-CG 4.34Å; K260-M270 HydrophobicContact CD-SD 3.68Å; K260-M270 WeakPolarHBondContact CE-SD 3.31Å; K260-M270 HydrophobicContact CG-CB 4.17Å; K260-M270 HydrophobicContact CG-CE 4.44Å; K260-M270 HydrophobicContact CG-CG 4.36Å; K260-M270 HydrophobicContact CG-SD 3.72Å
261	Y	89.8	Confident	91.5	Very high	58 Å²	58	51.8 Å²	51.8	23%	0.227	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	137.7	172.3	-68.8	-71.7	0	0	0	110.4	W205 H221 L247 K265 Y266 P267	W205-Y261 AromaticContact CZ2-CE1 3.98Å; W205-Y261 HydrophobicContact CZ2-CE1 3.98Å; H221-Y261 AromaticContact NE2-CE2 3.78Å; H221-Y261 AromaticContact NE2-CZ 3.77Å; H221-Y261 PolarHBondContact NE2-OH 3.49Å; L247-Y261 HydrophobicContact CB-CE2 4.48Å; Y261-K265 WeakPolarHBondContact CD1-O 3.35Å; Y261-Y266 CarbonylContact C-O 3.55Å; Y261-Y266 WeakPolarHBondContact CA-O 3.33Å; Y261-P267 HydrophobicContact CE1-CB 4.39Å
262	D	88.6	Confident	91.4	Very high	63 Å²	63	55.3 Å²	55.3	34%	0.337	25%	0.253	S	S	.	.			trans	-75.9	-179.5	169.2	77.4	-2.8	0	0	0	111.4	Y264 K265 Y266	D262-Y264 PolarHBondContact O-N 3.27Å; D262-Y264 VanDerWaalsContact O-N 3.1Å; D262-Y264 VanDerWaalsContact OD1-C 3.22Å; D262-Y264 VanDerWaalsContact OD1-CA 3.29Å; D262-Y264 WeakPolarHBondContact OD1-CA 3.3Å; D262-Y264 WeakPolarHBondContact OD1-CB 3.34Å; D262-Y264 PolarHBondContact OD1-N 3.14Å; D262-K265 PolarHBondContact O-N 3.19Å; D262-K265 PolarHBondContact OD1-N 3.29Å; D262-Y266 PolarHBondContact N-O 2.89Å; D262-Y266 PolarHBondContact OD1-N 3.45Å
263	Q	85.3	Confident	91.4	Very high	161 Å²	161	55.9 Å²	55.9	75%	0.752	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-20.7	177.4	65.7	-173.3	-2.6	0	0	114.2
264	Y	85.1	Confident	91.6	Very high	166 Å²	166	56.9 Å²	56.9	65%	0.651	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	7.2	178.6	-57.8	-63.4	0	0	0	112.6	D262 Y266	D262-Y264 PolarHBondContact O-N 3.27Å; D262-Y264 VanDerWaalsContact O-N 3.1Å; D262-Y264 VanDerWaalsContact OD1-C 3.22Å; D262-Y264 VanDerWaalsContact OD1-CA 3.29Å; D262-Y264 WeakPolarHBondContact OD1-CA 3.3Å; D262-Y264 WeakPolarHBondContact OD1-CB 3.34Å; D262-Y264 PolarHBondContact OD1-N 3.14Å; Y264-Y266 VanDerWaalsContact C-N 3.3Å; Y264-Y266 PolarHBondContact O-N 3.29Å
265	K	85.5	Confident	91.6	Very high	107 Å²	107	57.4 Å²	57.4	47%	0.465	27%	0.265	S	S	.	.	S	Bend	trans	63.6	27.8	-176.6	-49.8	-170.7	-178.4	-177.2	0	114.8	Y177 W205 Y261 D262	Y177-K265 HydrophobicContact CE1-CD 4.39Å; Y177-K265 WeakPolarHBondContact OH-CB 3.29Å; Y177-K265 VanDerWaalsContact OH-CD 3.22Å; Y177-K265 WeakPolarHBondContact OH-CD 3.23Å; W205-K265 PolarHBondContact NE1-O 2.88Å; Y261-K265 WeakPolarHBondContact CD1-O 3.35Å; D262-K265 PolarHBondContact O-N 3.19Å; D262-K265 PolarHBondContact OD1-N 3.29Å
266	Y	89.4	Confident	91.2	Very high	117 Å²	117	62.4 Å²	62.4	46%	0.459	29%	0.292	S	S	.	.			trans	-87.7	142	166.9	-74.2	-91.8	0	0	0	110.9	W205 Y261 D262 Y264 L268	W205-Y266 HydrophobicContact CB-CD1 3.8Å; W205-Y266 HydrophobicContact CB-CE1 3.41Å; W205-Y266 VanDerWaalsContact CB-CE1 3.41Å; W205-Y266 HydrophobicContact CG-CD1 4.15Å; W205-Y266 HydrophobicContact CG-CE1 4.18Å; Y261-Y266 CarbonylContact C-O 3.55Å; Y261-Y266 WeakPolarHBondContact CA-O 3.33Å; D262-Y266 PolarHBondContact N-O 2.89Å; D262-Y266 PolarHBondContact OD1-N 3.45Å; Y264-Y266 VanDerWaalsContact C-N 3.3Å; Y264-Y266 PolarHBondContact O-N 3.29Å; Y266-L268 PolarHBondContact O-N 2.89Å
267	P	92.3	Very high	90.9	Very high	23 Å²	23	66 Å²	66	15%	0.149	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	125.3	179.3	30.4	-35.1	0	0	0	111.3	F191 W205 A207 Y259 K260 Y261	F191-P267 HydrophobicContact CE2-CB 4.23Å; F191-P267 HydrophobicContact CE2-CG 3.97Å; W205-P267 HydrophobicContact CD2-CG 4.5Å; W205-P267 HydrophobicContact CE3-CG 4.09Å; W205-P267 HydrophobicContact CH2-CG 3.91Å; W205-P267 HydrophobicContact CZ2-CG 4.3Å; W205-P267 HydrophobicContact CZ3-CG 3.79Å; A207-P267 HydrophobicContact CB-CG 3.89Å; Y259-P267 HydrophobicContact CD1-CB 3.76Å; Y259-P267 HydrophobicContact CG-CB 4.09Å; K260-P267 CarbonylContact O-C 3.58Å; K260-P267 WeakPolarHBondContact O-CA 3.4Å; Y261-P267 HydrophobicContact CE1-CB 4.39Å
268	L	92.1	Very high	90.7	Very high	106 Å²	106	68.3 Å²	68.3	56%	0.555	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.7	172.7	-177	70.1	0	0	0	109.5	Y259 K260 Y266 M270	Y259-L268 CarbonylContact C-O 3.58Å; Y259-L268 WeakPolarHBondContact CA-O 3.11Å; K260-L268 PolarHBondContact N-O 3.39Å; K260-L268 PolarHBondContact O-N 2.87Å; Y266-L268 PolarHBondContact O-N 2.89Å; L268-M270 PolarHBondContact O-N 3.46Å
269	L	93.3	Very high	90.6	Very high	43 Å²	43	68.3 Å²	68.3	23%	0.225	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	121.8	177.8	-179.4	71.1	0	0	0	110.1	F211 E257 Y259 Y271	F211-L269 HydrophobicContact CE2-CD2 3.58Å; F211-L269 HydrophobicContact CZ-CD2 3.95Å; E257-L269 HydrophobicContact CB-CD1 3.86Å; E257-L269 HydrophobicContact CG-CD1 4.09Å; Y259-L269 HydrophobicContact CD1-CB 4.13Å; Y259-L269 VanDerWaalsContact CD1-N 3.34Å; Y259-L269 HydrophobicContact CE1-CB 3.74Å; Y259-L269 HydrophobicContact CE1-CD1 4.13Å; Y259-L269 HydrophobicContact CE2-CD1 4.09Å; L269-Y271 WeakPolarHBondContact CD1-O 3.41Å
270	M	91.8	Very high	90.7	Very high	58 Å²	58	68 Å²	68	29%	0.286	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-41.2	179.3	175.4	-170.2	56.9	0	0	111.8	I246 L258 K260 L268	I246-M270 HydrophobicContact CD1-CE 3.53Å; I246-M270 HydrophobicContact CD1-SD 4.28Å; I246-M270 HydrophobicContact CG1-CE 3.99Å; I246-M270 HydrophobicContact CG2-CE 3.87Å; L258-M270 HydrophobicContact CB-CE 3.6Å; L258-M270 HydrophobicContact CD1-CE 3.99Å; L258-M270 HydrophobicContact CG-CE 4.46Å; L258-M270 WeakPolarHBondContact O-CB 3.27Å; L258-M270 PolarHBondContact O-N 2.7Å; K260-M270 HydrophobicContact CD-CG 4.34Å; K260-M270 HydrophobicContact CD-SD 3.68Å; K260-M270 WeakPolarHBondContact CE-SD 3.31Å; K260-M270 HydrophobicContact CG-CB 4.17Å; K260-M270 HydrophobicContact CG-CE 4.44Å; K260-M270 HydrophobicContact CG-CG 4.36Å; K260-M270 HydrophobicContact CG-SD 3.72Å; L268-M270 PolarHBondContact O-N 3.46Å
271	Y	92.5	Very high	90.8	Very high	34 Å²	34	65.2 Å²	65.2	13%	0.133	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	147.5	-175.3	177.9	-96.1	0	0	0	110.8	F3 N4 L5 E257 L258 L269 T273	F3-Y271 HydrophobicContact CD1-CD1 4.23Å; F3-Y271 AromaticContact CD1-CD2 3.91Å; F3-Y271 HydrophobicContact CD1-CD2 3.91Å; F3-Y271 HydrophobicContact CD1-CE2 4.44Å; F3-Y271 AromaticContact CD1-CG 3.78Å; F3-Y271 HydrophobicContact CD1-CG 3.78Å; F3-Y271 HydrophobicContact CE1-CD1 4.36Å; F3-Y271 HydrophobicContact CE1-CG 4.34Å; F3-Y271 WeakPolarHBondContact O-CD2 3.5Å; F3-Y271 WeakPolarHBondContact O-CE2 3.5Å; N4-Y271 PolarHBondContact OD1-OH 3.03Å; L5-Y271 HydrophobicContact CB-CE1 4.44Å; L5-Y271 HydrophobicContact CD1-CD1 4.49Å; L5-Y271 HydrophobicContact CD1-CE1 4.02Å; L5-Y271 HydrophobicContact CG-CE1 4.18Å; L5-Y271 PolarHBondContact N-OH 3.38Å; E257-Y271 WeakPolarHBondContact CA-O 3.33Å; L258-Y271 HydrophobicContact CD1-CD1 3.91Å; L258-Y271 HydrophobicContact CD1-CG 4.36Å; L258-Y271 HydrophobicContact CG-CD1 4.13Å; L258-Y271 PolarHBondContact N-O 2.86Å; L258-Y271 PolarHBondContact O-N 2.85Å; L269-Y271 WeakPolarHBondContact CD1-O 3.41Å; Y271-T273 HydrophobicContact CE1-CG2 3.83Å
272	E	93.4	Very high	91.1	Very high	74 Å²	74	62.8 Å²	62.8	35%	0.346	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.6	176.7	-175.1	-146.1	173.7	0	0	108.5	F211 R255 I256 E257	F211-E272 HydrophobicContact CD2-CG 4.09Å; F211-E272 VanDerWaalsContact CE1-OE2 3.29Å; F211-E272 WeakPolarHBondContact CE1-OE2 3.45Å; F211-E272 HydrophobicContact CE2-CB 4.06Å; F211-E272 HydrophobicContact CE2-CG 3.69Å; F211-E272 WeakPolarHBondContact CE2-OE2 3.29Å; F211-E272 HydrophobicContact CZ-CB 4.36Å; F211-E272 VanDerWaalsContact CZ-CD 3.46Å; F211-E272 HydrophobicContact CZ-CG 4.18Å; F211-E272 WeakPolarHBondContact CZ-OE2 3.35Å; R255-E272 HydrophobicContact CG-CG 4.31Å; I256-E272 WeakPolarHBondContact O-CA 3.49Å; E257-E272 HydrophobicContact CG-CG 4.3Å
273	T	94	Very high	91.3	Very high	29 Å²	29	60.8 Å²	60.8	18%	0.178	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	149.7	166.9	-174.1	0	0	0	0	109.9	R255 I256 Y271 L307	R255-T273 CarbonylContact C-O 3.57Å; R255-T273 WeakPolarHBondContact CA-O 2.95Å; I256-T273 HydrophobicContact CB-CG2 3.95Å; I256-T273 PolarHBondContact N-O 3.36Å; I256-T273 PolarHBondContact O-N 3.25Å; Y271-T273 HydrophobicContact CE1-CG2 3.83Å; T273-L307 HydrophobicContact CG2-CD1 4.04Å
274	N	93.1	Very high	91.6	Very high	71 Å²	71	53.4 Å²	53.4	38%	0.38	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	118.7	171.8	-174.9	3.7	0	0	0	109.8	G254 N276	G254-N274 PolarHBondContact O-OD1 3.25Å; N274-N276 VanDerWaalsContact CG-OD1 3.26Å; N274-N276 PolarHBondContact ND2-OD1 2.92Å; N274-N276 PolarHBondContact OD1-N 3.1Å; N274-N276 PolarHBondContact OD1-OD1 2.62Å
275	V	91.6	Very high	91.8	Very high	10 Å²	10	45.6 Å²	45.6	6%	0.061	22%	0.222	C	C	.	.			trans	-89.6	-7.1	-179.6	-61.3	0	0	0	0	113.1	G254 Y277 L279 F305 L307	G254-V275 WeakPolarHBondContact O-CG2 3.22Å; G254-V275 PolarHBondContact O-N 2.96Å; V275-Y277 HydrophobicContact CB-CD2 4.1Å; V275-Y277 HydrophobicContact CG2-CD2 4.2Å; V275-Y277 WeakPolarHBondContact O-CD2 3.29Å; V275-Y277 WeakPolarHBondContact O-CE2 3.34Å; V275-Y277 PolarHBondContact O-N 3.2Å; V275-Y277 VanDerWaalsContact O-N 3.16Å; V275-L279 HydrophobicContact CG2-CD1 4.19Å; V275-L279 HydrophobicContact CG2-CD2 4.09Å; V275-L279 HydrophobicContact CG2-CG 4.34Å; V275-F305 HydrophobicContact CB-CE2 4.32Å; V275-F305 HydrophobicContact CB-CZ 3.94Å; V275-F305 HydrophobicContact CG1-CE2 3.83Å; V275-F305 HydrophobicContact CG1-CZ 3.92Å; V275-F305 HydrophobicContact CG2-CZ 3.93Å; V275-L307 HydrophobicContact CG1-CD1 4.17Å; V275-L307 HydrophobicContact CG1-CD2 4.27Å
276	N	86.9	Confident	91.9	Very high	114 Å²	114	41.7 Å²	41.7	61%	0.61	20%	0.204	S	C	*	.			trans	55.7	26.7	-177.5	-58.6	-42.9	0	0	0	114.4	N274 R439	N274-N276 VanDerWaalsContact CG-OD1 3.26Å; N274-N276 PolarHBondContact ND2-OD1 2.92Å; N274-N276 PolarHBondContact OD1-N 3.1Å; N274-N276 PolarHBondContact OD1-OD1 2.62Å; N276-R439 PolarHBondContact O-NH1 3.12Å
277	Y	88.3	Confident	91.9	Very high	76 Å²	76	36.1 Å²	36.1	30%	0.298	18%	0.183	S	C	.	.	S	Bend	trans	-118.1	151.4	173.4	-64.2	-69.1	0	0	0	111.5	N253 G254 V275 L279 T299 L303 F305 R439	N253-Y277 CarbonylContact C-O 3.41Å; G254-Y277 WeakPolarHBondContact CA-O 3.33Å; G254-Y277 PolarHBondContact N-O 3.42Å; V275-Y277 HydrophobicContact CB-CD2 4.1Å; V275-Y277 HydrophobicContact CG2-CD2 4.2Å; V275-Y277 WeakPolarHBondContact O-CD2 3.29Å; V275-Y277 WeakPolarHBondContact O-CE2 3.34Å; V275-Y277 PolarHBondContact O-N 3.2Å; V275-Y277 VanDerWaalsContact O-N 3.16Å; Y277-L279 PolarHBondContact O-N 3.35Å; Y277-T299 VanDerWaalsContact CB-CG2 3.48Å; Y277-T299 HydrophobicContact CD1-CG2 4.24Å; Y277-T299 HydrophobicContact CD2-CG2 4.33Å; Y277-T299 HydrophobicContact CG-CG2 3.79Å; Y277-L303 HydrophobicContact CD2-CD2 4.49Å; Y277-L303 HydrophobicContact CE1-CD2 4.14Å; Y277-L303 HydrophobicContact CE2-CD2 4.01Å; Y277-F305 HydrophobicContact CD2-CE1 4.03Å; Y277-F305 HydrophobicContact CD2-CZ 4.21Å; Y277-R439 VanDerWaalsContact C-NH1 3.28Å
278	H	90.9	Very high	91.6	Very high	48 Å²	48	35.8 Å²	35.8	22%	0.222	18%	0.181	C	C	.	.			trans	-82.7	105.5	176.4	-177.8	100.4	0	0	0	107	T252 T299 Y300 E386 R439	T252-H278 CarbonylContact O-C 3.52Å; T252-H278 WeakPolarHBondContact O-CA 3.4Å; H278-T299 CarbonylContact O-C 3.46Å; H278-T299 WeakPolarHBondContact O-CA 3.37Å; H278-Y300 PolarHBondContact O-N 2.93Å; H278-E386 WeakPolarHBondContact CB-OE2 3.44Å; H278-E386 IonicContact CG-OE2 3.96Å; H278-E386 VanDerWaalsContact CG-OE2 3.23Å; H278-E386 IonicContact ND1-OE2 3.24Å; H278-R439 VanDerWaalsContact CB-CZ 3.49Å
279	L	94.5	Very high	91.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	128.8	-175.6	-60.7	176.9	0	0	0	108.6	L217 T252 I256 V275 Y277 V282 C297 I298 T299 F305	L217-L279 HydrophobicContact CD2-CB 3.68Å; L217-L279 WeakPolarHBondContact CD2-O 3.5Å; T252-L279 PolarHBondContact O-N 3.29Å; I256-L279 HydrophobicContact CD1-CD1 4Å; I256-L279 HydrophobicContact CG1-CD1 4.04Å; V275-L279 HydrophobicContact CG2-CD1 4.19Å; V275-L279 HydrophobicContact CG2-CD2 4.09Å; V275-L279 HydrophobicContact CG2-CG 4.34Å; Y277-L279 PolarHBondContact O-N 3.35Å; L279-V282 HydrophobicContact CB-CG2 4.23Å; L279-V282 HydrophobicContact CD1-CG2 3.67Å; L279-V282 HydrophobicContact CG-CG2 4.4Å; L279-C297 HydrophobicContact CD2-CB 3.96Å; L279-I298 WeakPolarHBondContact CA-O 3.34Å; L279-T299 HydrophobicContact CD2-CG2 4.39Å; L279-F305 HydrophobicContact CD2-CE1 4.39Å; L279-F305 HydrophobicContact CD2-CZ 4.22Å
280	T	94.3	Very high	90.8	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.025	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-20.5	173.4	58.7	0	0	0	0	111.9	T16 S17 N19 I298	T16-T280 WeakPolarHBondContact OG1-CG2 3.31Å; T16-T280 PolarHBondContact OG1-OG1 3.31Å; S17-T280 WeakPolarHBondContact O-CB 3.33Å; N19-T280 PolarHBondContact N-O 2.91Å; T280-I298 PolarHBondContact N-O 3.48Å; T280-I298 PolarHBondContact OG1-O 3.4Å
281	S	94.6	Very high	90.4	Very high	7 Å²	7	31.2 Å²	31.2	5%	0.049	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	140.1	171.7	-67.4	0	0	0	0	110.8	I298	S281-I298 PolarHBondContact N-O 3.36Å; S281-I298 PolarHBondContact O-N 3.14Å
282	V	95.1	Very high	90.2	Very high	8 Å²	8	30.4 Å²	30.4	5%	0.048	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.9	167.9	178.6	0	0	0	0	107.5	L217 A250 I256 L279 L295 L296	L217-V282 HydrophobicContact CD2-CG2 4.19Å; A250-V282 HydrophobicContact CB-CB 3.72Å; A250-V282 HydrophobicContact CB-CG1 4.15Å; A250-V282 HydrophobicContact CB-CG2 3.63Å; I256-V282 HydrophobicContact CD1-CG1 4.41Å; I256-V282 HydrophobicContact CD1-CG2 4.33Å; L279-V282 HydrophobicContact CB-CG2 4.23Å; L279-V282 HydrophobicContact CD1-CG2 3.67Å; L279-V282 HydrophobicContact CG-CG2 4.4Å; V282-L295 HydrophobicContact CG1-CB 4.36Å; V282-L296 WeakPolarHBondContact CA-O 3.39Å
283	I	93.5	Very high	90	Very high	20 Å²	20	26.9 Å²	26.9	10%	0.103	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130	-177.1	-46.5	167.9	0	0	0	109.1	A21 I23 L39 L296	A21-I283 HydrophobicContact CB-CD1 3.79Å; A21-I283 WeakPolarHBondContact O-CD1 3.37Å; I23-I283 HydrophobicContact CB-CG2 4.33Å; I23-I283 HydrophobicContact CD1-CB 4.17Å; I23-I283 HydrophobicContact CD1-CG2 3.43Å; I23-I283 VanDerWaalsContact CD1-CG2 3.43Å; I23-I283 HydrophobicContact CG1-CB 4.44Å; I23-I283 HydrophobicContact CG1-CD1 4.4Å; I23-I283 HydrophobicContact CG1-CG2 3.73Å; L39-I283 HydrophobicContact CD1-CD1 4.11Å; I283-L296 PolarHBondContact N-O 3.4Å; I283-L296 PolarHBondContact O-N 3.43Å
284	A	92	Very high	89.9	Confident	6 Å²	6	25.5 Å²	25.5	5%	0.05	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	142.3	174.9	0	0	0	0	0	112.2	E220 Y222 I248 L295	E220-A284 PolarHBondContact OE2-N 3.36Å; Y222-A284 HydrophobicContact CD1-CB 3.8Å; Y222-A284 HydrophobicContact CD2-CB 3.71Å; Y222-A284 HydrophobicContact CE2-CB 4.44Å; Y222-A284 HydrophobicContact CG-CB 3.35Å; I248-A284 HydrophobicContact CD1-CB 3.6Å; A284-L295 HydrophobicContact CB-CD2 3.79Å
285	G	88.4	Confident	90	Very high	2 Å²	2	22.1 Å²	22.1	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	-170.5	179.1	0	0	0	0	0	114.9	Y222 E294	Y222-G285 WeakPolarHBondContact OH-CA 3.35Å; G285-E294 PolarHBondContact N-O 2.79Å; G285-E294 PolarHBondContact O-N 3.35Å; G285-E294 VanDerWaalsContact O-O 3.05Å
286	R	88.2	Confident	90.1	Very high	25 Å²	25	21.6 Å²	21.6	9%	0.094	11%	0.11	C	C	.	.			trans	-121.1	101.6	170	-75.5	164.9	169.2	95.9	-7.7	107.9	C37 Y222 N226 V290	C37-R286 WeakPolarHBondContact CB-O 3.22Å; C37-R286 PolarHBondContact N-O 3.24Å; C37-R286 VanDerWaalsContact N-O 3.15Å; C37-R286 PolarHBondContact SG-O 3Å; Y222-R286 PolarHBondContact OH-NH1 2.7Å; N226-R286 PolarHBondContact O-NH2 2.9Å; R286-V290 WeakPolarHBondContact CD-O 3.45Å; R286-V290 PolarHBondContact NE-O 2.79Å
287	F	89	Confident	90.6	Very high	1 Å²	1	16.2 Å²	16.2	0%	0.004	8%	0.081	C	C	.	.			trans	-115.6	-60.6	-170.1	173.1	-98.7	0	0	0	112.6	Y10 L39 F51 Y53 L57 E294 L296	Y10-F287 HydrophobicContact CD2-CD1 4.3Å; Y10-F287 HydrophobicContact CD2-CE1 4Å; Y10-F287 AromaticContact CE2-CD1 3.83Å; Y10-F287 HydrophobicContact CE2-CD1 3.83Å; Y10-F287 HydrophobicContact CE2-CE1 4.01Å; Y10-F287 HydrophobicContact CG-CE1 4.35Å; L39-F287 HydrophobicContact CB-CD2 4.16Å; L39-F287 HydrophobicContact CB-CE2 3.69Å; L39-F287 HydrophobicContact CB-CZ 4.28Å; F51-F287 HydrophobicContact CB-CE2 4.3Å; F51-F287 HydrophobicContact CB-CZ 3.94Å; Y53-F287 WeakPolarHBondContact CB-O 3.39Å; Y53-F287 HydrophobicContact CD2-CE1 4.42Å; L57-F287 HydrophobicContact CD1-CE1 3.96Å; L57-F287 HydrophobicContact CD1-CZ 3.71Å; F287-E294 HydrophobicContact CB-CG 4.3Å; F287-E294 WeakPolarHBondContact CB-OE1 3.22Å; F287-L296 HydrophobicContact CB-CD1 3.91Å; F287-L296 HydrophobicContact CB-CD2 4.03Å; F287-L296 HydrophobicContact CB-CG 4.32Å; F287-L296 HydrophobicContact CD1-CD2 3.78Å; F287-L296 HydrophobicContact CD2-CD1 4.23Å; F287-L296 HydrophobicContact CE1-CD2 4.47Å; F287-L296 HydrophobicContact CG-CD1 3.99Å; F287-L296 HydrophobicContact CG-CD2 3.99Å
288	S	86.9	Confident	91	Very high	16 Å²	16	12.6 Å²	12.6	11%	0.112	7%	0.067	C	C	.	.	S	Bend	trans	-71.3	-50.5	178.7	63.8	0	0	0	0	111.8	Y10 K36 Y53 E294	Y10-S288 WeakPolarHBondContact OH-CB 3.38Å; Y10-S288 PolarHBondContact OH-OG 2.93Å; K36-S288 WeakPolarHBondContact CE-O 3.45Å; K36-S288 PolarHBondContact NZ-O 3.41Å; Y53-S288 VanDerWaalsContact CD1-O 3.3Å; Y53-S288 WeakPolarHBondContact CD1-O 3.36Å; S288-E294 VanDerWaalsContact CB-OE2 3.32Å; S288-E294 WeakPolarHBondContact CB-OE2 3.08Å; S288-E294 PolarHBondContact N-OE2 3.23Å; S288-E294 PolarHBondContact OG-OE2 2.71Å
289	N	84.4	Confident	91.1	Very high	44 Å²	44	10.3 Å²	10.3	24%	0.235	6%	0.056	C	C	.	.			trans	-124.3	136.1	-179.4	-162.2	-26.5	0	0	0	110.1	N291 Y292 Q310	N289-N291 VanDerWaalsContact C-N 3.3Å; N289-N291 PolarHBondContact OD1-N 3.38Å; N289-N291 VanDerWaalsContact OD1-N 3.09Å; N289-Y292 HydrophobicContact CB-CD2 4.17Å; N289-Y292 WeakPolarHBondContact ND2-CD2 3.43Å; N289-Q310 PolarHBondContact ND2-OE1 2.73Å
290	V	82.6	Confident	91	Very high	23 Å²	23	10.8 Å²	10.8	14%	0.139	6%	0.058	C	C	.	.	S	Bend	trans	-71.8	-29.9	179.6	176.5	0	0	0	0	111.1	H34 K36 R286	H34-V290 HydrophobicContact CB-CG1 3.99Å; H34-V290 WeakPolarHBondContact O-CG1 3.47Å; K36-V290 HydrophobicContact CB-CG2 4.46Å; K36-V290 HydrophobicContact CD-CG2 4.2Å; K36-V290 HydrophobicContact CG-CG2 3.29Å; R286-V290 WeakPolarHBondContact CD-O 3.45Å; R286-V290 PolarHBondContact NE-O 2.79Å
291	N	84.4	Confident	90.8	Very high	43 Å²	43	12.5 Å²	12.5	23%	0.23	7%	0.069	C	C	.	.	S	Bend	trans	-83.2	-17.2	-172.9	-64.6	-1.6	0	0	0	113.1	Y227 V228 N289	Y227-N291 VanDerWaalsContact CA-O 3.28Å; Y227-N291 WeakPolarHBondContact CA-O 3.29Å; Y227-N291 WeakPolarHBondContact CB-O 3.46Å; V228-N291 PolarHBondContact N-O 3.1Å; N289-N291 VanDerWaalsContact C-N 3.3Å; N289-N291 PolarHBondContact OD1-N 3.38Å; N289-N291 VanDerWaalsContact OD1-N 3.09Å
292	Y	87.3	Confident	90.7	Very high	17 Å²	17	12.2 Å²	12.2	7%	0.067	7%	0.066	C	C	.	.	S	Bend	trans	-122.5	116.9	-173.4	-63.4	-75	0	0	0	109.9	Y227 N289 T309 Q310	Y227-Y292 HydrophobicContact CD2-CE1 4.39Å; Y227-Y292 HydrophobicContact CG-CD1 4.43Å; N289-Y292 HydrophobicContact CB-CD2 4.17Å; N289-Y292 WeakPolarHBondContact ND2-CD2 3.43Å; Y292-T309 WeakPolarHBondContact CB-OG1 3.18Å; Y292-Q310 HydrophobicContact CD1-CB 4.19Å; Y292-Q310 HydrophobicContact CD2-CB 3.72Å; Y292-Q310 HydrophobicContact CD2-CG 3.77Å; Y292-Q310 HydrophobicContact CE2-CB 4.27Å; Y292-Q310 HydrophobicContact CE2-CG 3.87Å; Y292-Q310 HydrophobicContact CG-CB 3.68Å; Y292-Q310 HydrophobicContact CG-CG 4.21Å
293	P	90.3	Very high	90.6	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.071	C	C	.	.			trans	-63.5	148.7	171.7	28.6	-36.2	0	0	0	111.3	Y222 M224 T309	Y222-P293 HydrophobicContact CD1-CB 4.47Å; Y222-P293 HydrophobicContact CE1-CB 3.76Å; M224-P293 HydrophobicContact CE-CB 4.31Å; M224-P293 VanDerWaalsContact O-CG 3.29Å; M224-P293 WeakPolarHBondContact O-CG 3.35Å; M224-P293 HydrophobicContact SD-CB 3.94Å; P293-T309 WeakPolarHBondContact CD-OG1 3.5Å; P293-T309 HydrophobicContact CG-CG2 4.04Å; P293-T309 PolarHBondContact O-N 2.8Å; P293-T309 VanDerWaalsContact O-N 3.09Å; P293-T309 PolarHBondContact O-OG1 3.33Å
294	E	91.9	Very high	90.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.067	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.3	-178.8	65.5	-177.7	-106.5	0	0	112.2	Y10 G285 F287 S288 L296 L307	Y10-E294 WeakPolarHBondContact CE2-OE1 3.37Å; Y10-E294 VanDerWaalsContact OH-CD 3.24Å; Y10-E294 PolarHBondContact OH-OE1 2.87Å; Y10-E294 PolarHBondContact OH-OE2 3.25Å; G285-E294 PolarHBondContact N-O 2.79Å; G285-E294 PolarHBondContact O-N 3.35Å; G285-E294 VanDerWaalsContact O-O 3.05Å; F287-E294 HydrophobicContact CB-CG 4.3Å; F287-E294 WeakPolarHBondContact CB-OE1 3.22Å; S288-E294 VanDerWaalsContact CB-OE2 3.32Å; S288-E294 WeakPolarHBondContact CB-OE2 3.08Å; S288-E294 PolarHBondContact N-OE2 3.23Å; S288-E294 PolarHBondContact OG-OE2 2.71Å; E294-L296 HydrophobicContact CG-CD2 4.49Å; E294-L296 WeakPolarHBondContact OE1-CD2 3.41Å; E294-L307 CarbonylContact C-O 3.53Å; E294-L307 VanDerWaalsContact CA-O 3.24Å; E294-L307 WeakPolarHBondContact CA-O 3.49Å
295	L	94.4	Very high	90.9	Very high	0 Å²	0	12 Å²	12	0%	0	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.7	168.2	-51.9	177	0	0	0	109.2	L5 M224 I248 I256 L258 V282 A284 C297 G306 L307	L5-L295 HydrophobicContact CD1-CD1 3.87Å; L5-L295 HydrophobicContact CD1-CG 4.4Å; M224-L295 HydrophobicContact CE-CD2 3.99Å; M224-L295 HydrophobicContact CE-CG 3.92Å; M224-L295 HydrophobicContact SD-CD2 3.72Å; M224-L295 HydrophobicContact SD-CG 4.33Å; I248-L295 HydrophobicContact CD1-CD2 3.58Å; I248-L295 HydrophobicContact CG1-CD2 4.25Å; I248-L295 HydrophobicContact CG2-CD1 4.35Å; I248-L295 HydrophobicContact CG2-CD2 4.37Å; I256-L295 HydrophobicContact CG2-CD1 3.87Å; L258-L295 HydrophobicContact CD2-CD1 4.43Å; V282-L295 HydrophobicContact CG1-CB 4.36Å; A284-L295 HydrophobicContact CB-CD2 3.79Å; L295-C297 PolarHBondContact O-N 3.16Å; L295-G306 CarbonylContact O-C 3.54Å; L295-G306 WeakPolarHBondContact O-CA 3.39Å; L295-L307 HydrophobicContact CB-CB 4.18Å; L295-L307 PolarHBondContact N-O 2.88Å; L295-L307 PolarHBondContact O-N 2.73Å
296	L	95	Very high	91.1	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	116.4	172.7	-65.8	177.4	0	0	0	109.4	Y10 I23 L39 V282 I283 F287 E294	Y10-L296 HydrophobicContact CD2-CD2 4.26Å; Y10-L296 HydrophobicContact CE2-CD2 3.6Å; I23-L296 HydrophobicContact CD1-CD1 3.9Å; I23-L296 HydrophobicContact CG1-CD1 4.21Å; L39-L296 HydrophobicContact CB-CD1 4.25Å; L39-L296 HydrophobicContact CD1-CD1 3.98Å; L39-L296 HydrophobicContact CD2-CD1 4.25Å; L39-L296 HydrophobicContact CG-CD1 4.37Å; V282-L296 WeakPolarHBondContact CA-O 3.39Å; I283-L296 PolarHBondContact N-O 3.4Å; I283-L296 PolarHBondContact O-N 3.43Å; F287-L296 HydrophobicContact CB-CD1 3.91Å; F287-L296 HydrophobicContact CB-CD2 4.03Å; F287-L296 HydrophobicContact CB-CG 4.32Å; F287-L296 HydrophobicContact CD1-CD2 3.78Å; F287-L296 HydrophobicContact CD2-CD1 4.23Å; F287-L296 HydrophobicContact CE1-CD2 4.47Å; F287-L296 HydrophobicContact CG-CD1 3.99Å; F287-L296 HydrophobicContact CG-CD2 3.99Å; E294-L296 HydrophobicContact CG-CD2 4.49Å; E294-L296 WeakPolarHBondContact OE1-CD2 3.41Å
297	C	96.3	Very high	91.4	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128.7	-179.4	-60.6	0	0	0	0	109.6	L279 L295 F305	L279-C297 HydrophobicContact CD2-CB 3.96Å; L295-C297 PolarHBondContact O-N 3.16Å; C297-F305 HydrophobicContact CB-CD1 4.05Å; C297-F305 HydrophobicContact CB-CD2 3.94Å; C297-F305 HydrophobicContact CB-CE1 3.57Å; C297-F305 HydrophobicContact CB-CE2 3.45Å; C297-F305 VanDerWaalsContact CB-CE2 3.45Å; C297-F305 HydrophobicContact CB-CG 4.23Å; C297-F305 HydrophobicContact CB-CZ 3.24Å; C297-F305 PolarHBondContact N-O 3.06Å; C297-F305 PolarHBondContact O-N 2.68Å
298	I	96.2	Very high	91.6	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.06	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	128.4	176.4	-60.6	85.6	0	0	0	107.8	T16 A21 L39 V41 L279 T280 S281 L303 I304	T16-I298 HydrophobicContact CG2-CG2 3.83Å; A21-I298 HydrophobicContact CB-CD1 3.58Å; A21-I298 HydrophobicContact CB-CG1 3.97Å; L39-I298 HydrophobicContact CD1-CD1 4.47Å; V41-I298 HydrophobicContact CG1-CG2 4.13Å; V41-I298 HydrophobicContact CG2-CG1 4.31Å; L279-I298 WeakPolarHBondContact CA-O 3.34Å; T280-I298 PolarHBondContact N-O 3.48Å; T280-I298 PolarHBondContact OG1-O 3.4Å; S281-I298 PolarHBondContact N-O 3.36Å; S281-I298 PolarHBondContact O-N 3.14Å; I298-L303 WeakPolarHBondContact CA-O 3.49Å; I298-I304 HydrophobicContact CG1-CG1 4.34Å
299	T	94.4	Very high	91.7	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	160.5	179.5	77.2	0	0	0	0	112.4	T16 Y277 H278 L279 T301 G302 L303 F305	T16-T299 PolarHBondContact OG1-O 3.2Å; Y277-T299 VanDerWaalsContact CB-CG2 3.48Å; Y277-T299 HydrophobicContact CD1-CG2 4.24Å; Y277-T299 HydrophobicContact CD2-CG2 4.33Å; Y277-T299 HydrophobicContact CG-CG2 3.79Å; H278-T299 CarbonylContact O-C 3.46Å; H278-T299 WeakPolarHBondContact O-CA 3.37Å; L279-T299 HydrophobicContact CD2-CG2 4.39Å; T299-T301 PolarHBondContact O-N 2.76Å; T299-T301 PolarHBondContact OG1-N 2.74Å; T299-T301 PolarHBondContact OG1-OG1 3.2Å; T299-G302 WeakPolarHBondContact O-CA 3Å; T299-G302 PolarHBondContact O-N 3.43Å; T299-G302 PolarHBondContact OG1-N 3.45Å; T299-L303 HydrophobicContact CG2-CB 3.87Å; T299-L303 HydrophobicContact CG2-CD2 4.41Å; T299-L303 PolarHBondContact N-O 2.93Å; T299-L303 VanDerWaalsContact OG1-CB 3.3Å; T299-L303 WeakPolarHBondContact OG1-CB 3.48Å; T299-L303 PolarHBondContact OG1-N 2.83Å; T299-F305 HydrophobicContact CG2-CD1 4.35Å; T299-F305 HydrophobicContact CG2-CE1 3.72Å
300	Y	91.9	Very high	91.8	Very high	11 Å²	11	12.3 Å²	12.3	4%	0.043	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-42.6	172.7	169.2	-107.7	0	0	0	112	T15 T16 H278 G302 I369 E386 Q388	T15-Y300 CarbonylContact C-O 3.54Å; T15-Y300 WeakPolarHBondContact CA-O 3.46Å; T15-Y300 WeakPolarHBondContact CB-O 3.41Å; T15-Y300 HydrophobicContact CG2-CE1 4.16Å; T15-Y300 HydrophobicContact CG2-CE2 4.2Å; T15-Y300 VanDerWaalsContact CG2-O 3.31Å; T15-Y300 WeakPolarHBondContact CG2-O 3.3Å; T16-Y300 PolarHBondContact N-O 2.78Å; H278-Y300 PolarHBondContact O-N 2.93Å; Y300-G302 PolarHBondContact O-N 2.9Å; Y300-G302 VanDerWaalsContact O-N 3.15Å; Y300-I369 HydrophobicContact CD1-CD1 4.3Å; Y300-I369 HydrophobicContact CD2-CD1 3.73Å; Y300-I369 HydrophobicContact CD2-CG1 4.36Å; Y300-I369 HydrophobicContact CD2-CG2 4.36Å; Y300-I369 HydrophobicContact CE1-CD1 4.47Å; Y300-I369 HydrophobicContact CE1-CG1 4.29Å; Y300-I369 HydrophobicContact CE2-CB 4.46Å; Y300-I369 HydrophobicContact CE2-CD1 3.93Å; Y300-I369 HydrophobicContact CE2-CG1 4.07Å; Y300-I369 HydrophobicContact CE2-CG2 3.59Å; Y300-I369 HydrophobicContact CG-CD1 3.92Å; Y300-E386 HydrophobicContact CD1-CG 3.6Å; Y300-E386 HydrophobicContact CE1-CG 3.91Å; Y300-Q388 HydrophobicContact CE1-CG 4.46Å
301	T	90.1	Very high	91.7	Very high	40 Å²	40	14.1 Å²	14.1	25%	0.245	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	1.2	178.1	61.8	0	0	0	0	114.1	T299	T299-T301 PolarHBondContact O-N 2.76Å; T299-T301 PolarHBondContact OG1-N 2.74Å; T299-T301 PolarHBondContact OG1-OG1 3.2Å
302	G	92.1	Very high	91	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.088	C	C	.	.			trans	87.6	9	178	0	0	0	0	0	115.5	S12 I13 K14 T299 Y300 I304	S12-G302 CarbonylContact C-O 3.55Å; S12-G302 WeakPolarHBondContact CA-O 3.13Å; I13-G302 VanDerWaalsContact CG1-O 3.3Å; I13-G302 WeakPolarHBondContact CG1-O 3.42Å; I13-G302 PolarHBondContact N-O 3.48Å; K14-G302 WeakPolarHBondContact O-CA 3.27Å; T299-G302 WeakPolarHBondContact O-CA 3Å; T299-G302 PolarHBondContact O-N 3.43Å; T299-G302 PolarHBondContact OG1-N 3.45Å; Y300-G302 PolarHBondContact O-N 2.9Å; Y300-G302 VanDerWaalsContact O-N 3.15Å; G302-I304 PolarHBondContact O-N 2.69Å
303	L	94	Very high	89.7	Confident	28 Å²	28	26.1 Å²	26.1	15%	0.147	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.8	176.5	-178.1	68.1	0	0	0	109.6	Y277 I298 T299 F305	Y277-L303 HydrophobicContact CD2-CD2 4.49Å; Y277-L303 HydrophobicContact CE1-CD2 4.14Å; Y277-L303 HydrophobicContact CE2-CD2 4.01Å; I298-L303 WeakPolarHBondContact CA-O 3.49Å; T299-L303 HydrophobicContact CG2-CB 3.87Å; T299-L303 HydrophobicContact CG2-CD2 4.41Å; T299-L303 PolarHBondContact N-O 2.93Å; T299-L303 VanDerWaalsContact OG1-CB 3.3Å; T299-L303 WeakPolarHBondContact OG1-CB 3.48Å; T299-L303 PolarHBondContact OG1-N 2.83Å; L303-F305 HydrophobicContact CD2-CD1 4.06Å; L303-F305 HydrophobicContact CG-CD1 4.09Å
304	I	95.7	Very high	88	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118.2	177	-55.4	176.9	0	0	0	108.4	Y10 T11 I13 L39 V41 F51 I298 G302	Y10-I304 HydrophobicContact CD2-CG2 4.33Å; Y10-I304 PolarHBondContact N-O 3.11Å; T11-I304 HydrophobicContact CG2-CB 4.11Å; T11-I304 HydrophobicContact CG2-CD1 3.88Å; T11-I304 HydrophobicContact CG2-CG1 4.34Å; T11-I304 PolarHBondContact N-O 3.04Å; T11-I304 PolarHBondContact O-N 3.3Å; I13-I304 HydrophobicContact CD1-CD1 4.34Å; I13-I304 HydrophobicContact CG1-CD1 4.24Å; I13-I304 HydrophobicContact CG2-CD1 4.32Å; L39-I304 HydrophobicContact CD2-CG2 3.7Å; V41-I304 HydrophobicContact CB-CD1 4.42Å; V41-I304 HydrophobicContact CG2-CD1 3.9Å; F51-I304 HydrophobicContact CD2-CD1 4.07Å; F51-I304 HydrophobicContact CE2-CD1 3.48Å; F51-I304 VanDerWaalsContact CE2-CD1 3.48Å; F51-I304 HydrophobicContact CZ-CD1 4.11Å; I298-I304 HydrophobicContact CG1-CG1 4.34Å; G302-I304 PolarHBondContact O-N 2.69Å
305	F	94.9	Very high	85.8	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	155.3	178.8	67.8	-86.3	0	0	0	111.3	Q7 S8 V275 Y277 L279 C297 T299 L303 L307	Q7-F305 HydrophobicContact CG-CD2 3.84Å; Q7-F305 HydrophobicContact CG-CE2 4.35Å; S8-F305 CarbonylContact O-C 3.57Å; S8-F305 VanDerWaalsContact O-CA 3.27Å; S8-F305 WeakPolarHBondContact O-CA 3.43Å; S8-F305 WeakPolarHBondContact O-CB 3.44Å; V275-F305 HydrophobicContact CB-CE2 4.32Å; V275-F305 HydrophobicContact CB-CZ 3.94Å; V275-F305 HydrophobicContact CG1-CE2 3.83Å; V275-F305 HydrophobicContact CG1-CZ 3.92Å; V275-F305 HydrophobicContact CG2-CZ 3.93Å; Y277-F305 HydrophobicContact CD2-CE1 4.03Å; Y277-F305 HydrophobicContact CD2-CZ 4.21Å; L279-F305 HydrophobicContact CD2-CE1 4.39Å; L279-F305 HydrophobicContact CD2-CZ 4.22Å; C297-F305 HydrophobicContact CB-CD1 4.05Å; C297-F305 HydrophobicContact CB-CD2 3.94Å; C297-F305 HydrophobicContact CB-CE1 3.57Å; C297-F305 HydrophobicContact CB-CE2 3.45Å; C297-F305 VanDerWaalsContact CB-CE2 3.45Å; C297-F305 HydrophobicContact CB-CG 4.23Å; C297-F305 HydrophobicContact CB-CZ 3.24Å; C297-F305 PolarHBondContact N-O 3.06Å; C297-F305 PolarHBondContact O-N 2.68Å; T299-F305 HydrophobicContact CG2-CD1 4.35Å; T299-F305 HydrophobicContact CG2-CE1 3.72Å; L303-F305 HydrophobicContact CD2-CD1 4.06Å; L303-F305 HydrophobicContact CG-CD1 4.09Å; F305-L307 HydrophobicContact CD2-CD2 4.27Å; F305-L307 HydrophobicContact CD2-CG 4.48Å; F305-L307 HydrophobicContact CE2-CD2 3.98Å; F305-L307 HydrophobicContact CE2-CG 4.11Å
306	G	93.6	Very high	83.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	143.2	175.9	0	0	0	0	0	111.4	Q7 S8 Y10 L295	Q7-G306 CarbonylContact C-O 3.59Å; Q7-G306 WeakPolarHBondContact CA-O 3.49Å; S8-G306 PolarHBondContact N-O 3.03Å; S8-G306 PolarHBondContact O-N 3.49Å; Y10-G306 VanDerWaalsContact CE2-N 3.31Å; L295-G306 CarbonylContact O-C 3.54Å; L295-G306 WeakPolarHBondContact O-CA 3.39Å
307	L	94.7	Very high	81.4	Confident	2 Å²	2	51 Å²	51	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	96.1	164.3	-61.5	178.8	0	0	0	107.6	L5 H6 Q7 I256 T273 V275 E294 L295 F305	L5-L307 HydrophobicContact CB-CB 3.96Å; L5-L307 HydrophobicContact CD1-CB 4.11Å; H6-L307 WeakPolarHBondContact O-CA 3.3Å; Q7-L307 HydrophobicContact CB-CD2 3.91Å; Q7-L307 HydrophobicContact CG-CD2 4.2Å; I256-L307 HydrophobicContact CD1-CD1 3.65Å; T273-L307 HydrophobicContact CG2-CD1 4.04Å; V275-L307 HydrophobicContact CG1-CD1 4.17Å; V275-L307 HydrophobicContact CG1-CD2 4.27Å; E294-L307 CarbonylContact C-O 3.53Å; E294-L307 VanDerWaalsContact CA-O 3.24Å; E294-L307 WeakPolarHBondContact CA-O 3.49Å; L295-L307 HydrophobicContact CB-CB 4.18Å; L295-L307 PolarHBondContact N-O 2.88Å; L295-L307 PolarHBondContact O-N 2.73Å; F305-L307 HydrophobicContact CD2-CD2 4.27Å; F305-L307 HydrophobicContact CD2-CG 4.48Å; F305-L307 HydrophobicContact CE2-CD2 3.98Å; F305-L307 HydrophobicContact CE2-CG 4.11Å
308	T	92	Very high	79.6	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	148.2	-171.2	-176.3	0	0	0	0	112.6	L5 H6 Q310	L5-T308 WeakPolarHBondContact CA-O 3.32Å; H6-T308 HydrophobicContact CB-CG2 4.29Å; H6-T308 PolarHBondContact N-O 3.09Å; H6-T308 WeakPolarHBondContact O-CG2 3.38Å; H6-T308 PolarHBondContact O-N 2.76Å; T308-Q310 HydrophobicContact CG2-CB 4.05Å; T308-Q310 PolarHBondContact OG1-N 3.17Å; T308-Q310 VanDerWaalsContact OG1-N 3.16Å
309	T	90	Very high	77.8	Confident	19 Å²	19	67 Å²	67	12%	0.117	33%	0.334	C	S	.	.			trans	-77.8	-5.9	170	51	0	0	0	0	113.4	F3 L5 M224 Y292 P293	F3-T309 HydrophobicContact CE2-CG2 4.06Å; F3-T309 HydrophobicContact CZ-CG2 4Å; L5-T309 HydrophobicContact CD2-CG2 3.58Å; M224-T309 HydrophobicContact CE-CG2 4.15Å; Y292-T309 WeakPolarHBondContact CB-OG1 3.18Å; P293-T309 WeakPolarHBondContact CD-OG1 3.5Å; P293-T309 HydrophobicContact CG-CG2 4.04Å; P293-T309 PolarHBondContact O-N 2.8Å; P293-T309 VanDerWaalsContact O-N 3.09Å; P293-T309 PolarHBondContact O-OG1 3.33Å
310	Q	86.6	Confident	76	Confident	69 Å²	69	73.7 Å²	73.7	32%	0.322	37%	0.365	S	S	.	.	S	Bend	trans	-66	123.9	179.9	-177.3	176.5	-32.5	0	0	111.3	H6 N289 Y292 T308	H6-Q310 PolarHBondContact CD2-O 2.86Å; N289-Q310 PolarHBondContact ND2-OE1 2.73Å; Y292-Q310 HydrophobicContact CD1-CB 4.19Å; Y292-Q310 HydrophobicContact CD2-CB 3.72Å; Y292-Q310 HydrophobicContact CD2-CG 3.77Å; Y292-Q310 HydrophobicContact CE2-CB 4.27Å; Y292-Q310 HydrophobicContact CE2-CG 3.87Å; Y292-Q310 HydrophobicContact CG-CB 3.68Å; Y292-Q310 HydrophobicContact CG-CG 4.21Å; T308-Q310 HydrophobicContact CG2-CB 4.05Å; T308-Q310 PolarHBondContact OG1-N 3.17Å; T308-Q310 VanDerWaalsContact OG1-N 3.16Å
311	P	79.8	Confident	74.4	Confident	61 Å²	61	77.5 Å²	77.5	40%	0.396	39%	0.391	S	S	.	.			trans	-64.2	136	-178.7	24.4	-33.2	0	0	0	112.3	R313	P311-R313 VanDerWaalsContact C-N 3.35Å; P311-R313 PolarHBondContact O-N 3.39Å
312	I	70.2	Confident	73	Confident	88 Å²	88	78.8 Å²	78.8	45%	0.451	40%	0.396	S	S	.	.	S	Bend	trans	-67.2	-32.2	-179.8	-70	174.7	0	0	0	112.4	H6 M324	H6-I312 HydrophobicContact CB-CD1 3.83Å; H6-I312 HydrophobicContact CB-CG1 3.82Å; H6-I312 VanDerWaalsContact CG-CD1 3.45Å; H6-I312 VanDerWaalsContact CG-CG1 3.42Å; H6-I312 WeakPolarHBondContact ND1-CD1 3.41Å; I312-M324 HydrophobicContact CG2-CE 4.13Å; I312-M324 HydrophobicContact CG2-SD 4.26Å
313	R	60.1	Low	71.7	Confident	223 Å²	223	82.1 Å²	82.1	84%	0.842	42%	0.418	S	S	*	.			trans	-115.1	107.4	-176.1	-66.4	-177.7	177.8	171.7	-0.6	110.7	P311	P311-R313 VanDerWaalsContact C-N 3.35Å; P311-R313 PolarHBondContact O-N 3.39Å
314	K	54.4	Low	70.1	Confident	154 Å²	154	85.6 Å²	85.6	67%	0.67	44%	0.435	S	S	*	.			trans	-79.2	130.3	149.5	-70.9	-178.3	177.2	-179.7	0	105.7	I316	K314-I316 WeakPolarHBondContact O-CG1 3.28Å; K314-I316 PolarHBondContact O-N 2.83Å
315	E	46.5	Very low	69.1	Low	206 Å²	206	91.1 Å²	91.1	96%	0.963	46%	0.461	S	S	*	.			trans	-46.1	108.5	179.2	-67.6	176.4	163.4	0	0	110.3
316	I	45.4	Very low	68.1	Low	83 Å²	83	95.8 Å²	95.8	43%	0.426	49%	0.485	S	S	.	.			trans	-93.6	127.4	177.6	-47.4	-173.7	0	0	0	106.6	K314 L318 P323	K314-I316 WeakPolarHBondContact O-CG1 3.28Å; K314-I316 PolarHBondContact O-N 2.83Å; I316-L318 PolarHBondContact O-N 2.87Å; I316-P323 HydrophobicContact CD1-CG 4.35Å
317	S	51.1	Low	67.2	Low	80 Å²	80	101.6 Å²	101.6	56%	0.559	51%	0.512	S	S	*	.			trans	-55.1	132.4	168.1	49.8	0	0	0	0	110.2	D319 Q320	S317-D319 PolarHBondContact O-N 3.37Å; S317-Q320 PolarHBondContact O-N 3.14Å
318	L	57.6	Low	66.3	Low	181 Å²	181	107.7 Å²	107.7	95%	0.948	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-9.9	-173.6	-76.2	146.6	0	0	0	116.9	I316	I316-L318 PolarHBondContact O-N 2.87Å
319	D	58.9	Low	65.9	Low	156 Å²	156	112.5 Å²	112.5	83%	0.834	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106	7.8	-170.7	-70.5	-28.3	0	0	0	115.4	S317	S317-D319 PolarHBondContact O-N 3.37Å
320	Q	57.4	Low	65.6	Low	139 Å²	139	114.2 Å²	114.2	65%	0.65	58%	0.575	S	S	*	*	S	Bend	trans	-120.1	135.4	174.1	-67.5	-167.5	-7.3	0	0	111.7	S317 D322	S317-Q320 PolarHBondContact O-N 3.14Å; Q320-D322 PolarHBondContact O-N 3.29Å
321	P	57.4	Low	65.4	Low	92 Å²	92	117.6 Å²	117.6	60%	0.597	59%	0.589	S	S	*	*			trans	-56.9	136.8	173.1	24	-31.5	0	0	0	108.9	P323 L326	P321-P323 WeakPolarHBondContact O-CD 3.4Å; P321-L326 HydrophobicContact CB-CD1 4.15Å; P321-L326 HydrophobicContact CG-CD1 4Å
322	D	61.6	Low	65.8	Low	66 Å²	66	118.5 Å²	118.5	35%	0.353	59%	0.589	S	S	.	*			trans	-58.2	117.2	-175	-173.6	-13.6	0	0	0	108.8	Q320 M324 E325 L326	Q320-D322 PolarHBondContact O-N 3.29Å; D322-M324 PolarHBondContact O-N 3.36Å; D322-M324 VanDerWaalsContact OD1-CB 3.28Å; D322-M324 WeakPolarHBondContact OD1-CB 3.49Å; D322-M324 PolarHBondContact OD1-N 2.87Å; D322-E325 HydrophobicContact CB-CB 4Å; D322-E325 WeakPolarHBondContact O-CB 3.45Å; D322-E325 PolarHBondContact O-N 3.05Å; D322-L326 PolarHBondContact O-N 2.89Å; D322-L326 VanDerWaalsContact O-N 3.12Å
323	P	64	Low	66.7	Low	71 Å²	71	119.2 Å²	119.2	46%	0.461	59%	0.593	S	S	.	*	H	α-helix	trans	-57	-24.2	178.7	22.1	-32.1	0	0	0	111.9	I316 P321 Q327	I316-P323 HydrophobicContact CD1-CG 4.35Å; P321-P323 WeakPolarHBondContact O-CD 3.4Å; P323-Q327 VanDerWaalsContact O-CG 3.3Å; P323-Q327 WeakPolarHBondContact O-CG 3.34Å; P323-Q327 PolarHBondContact O-N 2.93Å; P323-Q327 VanDerWaalsContact O-N 3.12Å
324	M	61	Low	68.1	Low	100 Å²	100	114.6 Å²	114.6	49%	0.493	58%	0.58	S	S	.	*	H	α-helix	trans	-71.9	-38	173.9	-164.3	171.5	-67.4	0	0	112.4	I312 D322 Q327 F328	I312-M324 HydrophobicContact CG2-CE 4.13Å; I312-M324 HydrophobicContact CG2-SD 4.26Å; D322-M324 PolarHBondContact O-N 3.36Å; D322-M324 VanDerWaalsContact OD1-CB 3.28Å; D322-M324 WeakPolarHBondContact OD1-CB 3.49Å; D322-M324 PolarHBondContact OD1-N 2.87Å; M324-Q327 PolarHBondContact O-N 2.81Å; M324-F328 WeakPolarHBondContact O-CB 3.44Å; M324-F328 PolarHBondContact O-N 2.97Å
325	E	73.1	Confident	69.8	Low	118 Å²	118	111.5 Å²	111.5	55%	0.551	57%	0.57	S	S	*	*	H	α-helix	trans	-66.9	-42.5	176	-171.1	174.2	-166.1	0	0	111.1	D322 Q327 F328 M329	D322-E325 HydrophobicContact CB-CB 4Å; D322-E325 WeakPolarHBondContact O-CB 3.45Å; D322-E325 PolarHBondContact O-N 3.05Å; E325-Q327 VanDerWaalsContact C-N 3.33Å; E325-Q327 PolarHBondContact O-N 2.99Å; E325-F328 WeakPolarHBondContact O-CB 3.28Å; E325-F328 PolarHBondContact O-N 3.28Å; E325-F328 VanDerWaalsContact O-N 3.13Å; E325-M329 WeakPolarHBondContact O-CG 3.15Å; E325-M329 PolarHBondContact O-N 3.1Å
326	L	74.8	Confident	72.1	Confident	99 Å²	99	105.8 Å²	105.8	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-59.7	-42.2	172.7	-79.5	158.5	0	0	0	112.3	P321 D322 F328 S330	P321-L326 HydrophobicContact CB-CD1 4.15Å; P321-L326 HydrophobicContact CG-CD1 4Å; D322-L326 PolarHBondContact O-N 2.89Å; D322-L326 VanDerWaalsContact O-N 3.12Å; L326-F328 VanDerWaalsContact C-N 3.34Å; L326-S330 PolarHBondContact O-N 2.8Å
327	Q	74.3	Confident	74.4	Confident	122 Å²	122	108.8 Å²	108.8	57%	0.57	56%	0.558	S	S	*	*	H	α-helix	trans	-65.8	-37.8	174.4	-76.6	-179.4	13.3	0	0	112.2	P323 M324 E325 K331	P323-Q327 VanDerWaalsContact O-CG 3.3Å; P323-Q327 WeakPolarHBondContact O-CG 3.34Å; P323-Q327 PolarHBondContact O-N 2.93Å; P323-Q327 VanDerWaalsContact O-N 3.12Å; M324-Q327 PolarHBondContact O-N 2.81Å; E325-Q327 VanDerWaalsContact C-N 3.33Å; E325-Q327 PolarHBondContact O-N 2.99Å; Q327-K331 VanDerWaalsContact O-CG 3.3Å; Q327-K331 WeakPolarHBondContact O-CG 3.49Å; Q327-K331 PolarHBondContact O-N 3.12Å; Q327-K331 VanDerWaalsContact O-N 3.08Å
328	F	76.6	Confident	76.4	Confident	129 Å²	129	110.6 Å²	110.6	57%	0.566	56%	0.557	S	S	*	*	H	α-helix	trans	-64.6	-48.1	176.7	-178.5	-95.5	0	0	0	111.3	M324 E325 L326 S330 K331 M332	M324-F328 WeakPolarHBondContact O-CB 3.44Å; M324-F328 PolarHBondContact O-N 2.97Å; E325-F328 WeakPolarHBondContact O-CB 3.28Å; E325-F328 PolarHBondContact O-N 3.28Å; E325-F328 VanDerWaalsContact O-N 3.13Å; L326-F328 VanDerWaalsContact C-N 3.34Å; F328-S330 PolarHBondContact O-N 3.45Å; F328-K331 PolarHBondContact O-N 2.82Å; F328-M332 HydrophobicContact CE1-CE 4.03Å; F328-M332 HydrophobicContact CZ-CE 3.83Å; F328-M332 PolarHBondContact O-N 3.37Å
329	M	82.4	Confident	78.1	Confident	107 Å²	107	105.4 Å²	105.4	53%	0.527	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-47	176.8	-70	-175.6	73.1	0	0	111.8	E325 K331 M332 D333	E325-M329 WeakPolarHBondContact O-CG 3.15Å; E325-M329 PolarHBondContact O-N 3.1Å; M329-K331 VanDerWaalsContact C-N 3.3Å; M329-K331 PolarHBondContact O-N 3.48Å; M329-M332 WeakPolarHBondContact O-CB 3.21Å; M329-M332 PolarHBondContact O-N 2.73Å; M329-M332 VanDerWaalsContact O-N 3.1Å; M329-D333 PolarHBondContact O-N 3.44Å
330	S	84	Confident	79.7	Confident	54 Å²	54	100.8 Å²	100.8	38%	0.378	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-35.5	177.4	179.1	0	0	0	0	113.1	L326 F328 K334	L326-S330 PolarHBondContact O-N 2.8Å; F328-S330 PolarHBondContact O-N 3.45Å; S330-K334 WeakPolarHBondContact O-CG 3.46Å; S330-K334 PolarHBondContact O-N 3.38Å
331	K	83.7	Confident	81.5	Confident	140 Å²	140	98.4 Å²	98.4	61%	0.609	50%	0.502	S	S	*	.	H	α-helix	trans	-67.6	-40.7	173.6	-75.6	176.9	-179.4	-178.8	0	111.5	Q327 F328 M329 K334 L335	Q327-K331 VanDerWaalsContact O-CG 3.3Å; Q327-K331 WeakPolarHBondContact O-CG 3.49Å; Q327-K331 PolarHBondContact O-N 3.12Å; Q327-K331 VanDerWaalsContact O-N 3.08Å; F328-K331 PolarHBondContact O-N 2.82Å; M329-K331 VanDerWaalsContact C-N 3.3Å; M329-K331 PolarHBondContact O-N 3.48Å; K331-K334 PolarHBondContact O-N 3.4Å; K331-L335 WeakPolarHBondContact O-CB 3.34Å; K331-L335 PolarHBondContact O-N 3.16Å
332	M	86.9	Confident	83.1	Confident	80 Å²	80	99.1 Å²	99.1	39%	0.394	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-44.1	177.4	-172.1	65	80.8	0	0	111.5	F328 M329 K334 L335 N336	F328-M332 HydrophobicContact CE1-CE 4.03Å; F328-M332 HydrophobicContact CZ-CE 3.83Å; F328-M332 PolarHBondContact O-N 3.37Å; M329-M332 WeakPolarHBondContact O-CB 3.21Å; M329-M332 PolarHBondContact O-N 2.73Å; M329-M332 VanDerWaalsContact O-N 3.1Å; M332-K334 PolarHBondContact O-N 3.07Å; M332-L335 PolarHBondContact O-N 2.85Å; M332-N336 PolarHBondContact O-N 3.01Å; M332-N336 PolarHBondContact O-ND2 3.17Å
333	D	89.5	Confident	84.5	Confident	104 Å²	104	101.1 Å²	101.1	56%	0.556	51%	0.507	S	S	*	.	H	α-helix	trans	-62.6	-44.8	178.8	-68	-25.3	0	0	0	111.8	M329 L335 N336 E337	M329-D333 PolarHBondContact O-N 3.44Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 3.27Å; D333-N336 PolarHBondContact O-N 2.93Å; D333-E337 PolarHBondContact O-N 3.08Å
334	K	90.6	Very high	85.8	Confident	126 Å²	126	101.7 Å²	101.7	55%	0.548	51%	0.506	S	S	.	.	H	α-helix	trans	-61.2	-42.7	174.9	-71.6	176.2	-176.8	179.4	0	112	S330 K331 M332 N336 E337 E338	S330-K334 WeakPolarHBondContact O-CG 3.46Å; S330-K334 PolarHBondContact O-N 3.38Å; K331-K334 PolarHBondContact O-N 3.4Å; M332-K334 PolarHBondContact O-N 3.07Å; K334-N336 VanDerWaalsContact C-N 3.34Å; K334-N336 PolarHBondContact O-N 3Å; K334-E337 PolarHBondContact O-N 2.69Å; K334-E338 WeakPolarHBondContact O-CG 3.28Å; K334-E338 PolarHBondContact O-N 2.82Å
335	L	90	Very high	87.2	Confident	89 Å²	89	100.9 Å²	100.9	47%	0.466	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-42.5	178.2	-164.9	93.6	0	0	0	111.3	K331 M332 D333 E338 I339	K331-L335 WeakPolarHBondContact O-CB 3.34Å; K331-L335 PolarHBondContact O-N 3.16Å; M332-L335 PolarHBondContact O-N 2.85Å; D333-L335 VanDerWaalsContact C-N 3.34Å; D333-L335 PolarHBondContact O-N 3.27Å; L335-E338 PolarHBondContact O-N 3.07Å; L335-I339 HydrophobicContact CD2-CD1 3.91Å; L335-I339 HydrophobicContact CG-CD1 4.01Å; L335-I339 WeakPolarHBondContact O-CB 3.17Å; L335-I339 VanDerWaalsContact O-CG1 3.22Å; L335-I339 WeakPolarHBondContact O-CG1 3.46Å; L335-I339 PolarHBondContact O-N 3.37Å
336	N	93.4	Very high	87.8	Confident	85 Å²	85	98.5 Å²	98.5	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-39.9	178.1	-73.5	-33.7	0	0	0	112.1	M332 D333 K334 S340	M332-N336 PolarHBondContact O-N 3.01Å; M332-N336 PolarHBondContact O-ND2 3.17Å; D333-N336 PolarHBondContact O-N 2.93Å; K334-N336 VanDerWaalsContact C-N 3.34Å; K334-N336 PolarHBondContact O-N 3Å; N336-S340 WeakPolarHBondContact O-CB 2.95Å; N336-S340 PolarHBondContact O-N 3.29Å
337	E	93.6	Very high	88.3	Confident	147 Å²	147	99.5 Å²	99.5	69%	0.687	49%	0.494	S	S	*	.	H	α-helix	trans	-63.6	-45.4	174.2	-171.6	-179.3	178.9	0	0	111.5	D333 K334 S340 N341	D333-E337 PolarHBondContact O-N 3.08Å; K334-E337 PolarHBondContact O-N 2.69Å; E337-S340 PolarHBondContact O-N 3.44Å; E337-N341 PolarHBondContact O-N 2.93Å
338	E	93.3	Very high	88.8	Confident	117 Å²	117	98.9 Å²	98.9	55%	0.547	49%	0.494	S	S	.	.	H	α-helix	trans	-61.4	-45	176.3	-75.3	177.9	-170.7	0	0	112.1	K334 L335 N341 L342	K334-E338 WeakPolarHBondContact O-CG 3.28Å; K334-E338 PolarHBondContact O-N 2.82Å; L335-E338 PolarHBondContact O-N 3.07Å; E338-N341 PolarHBondContact O-N 2.93Å; E338-L342 WeakPolarHBondContact O-CB 3.38Å; E338-L342 VanDerWaalsContact O-CG 3.31Å; E338-L342 WeakPolarHBondContact O-CG 3.24Å; E338-L342 PolarHBondContact O-N 2.86Å
339	I	93.1	Very high	89	Confident	72 Å²	72	98.3 Å²	98.3	37%	0.369	50%	0.495	S	S	.	.	H	α-helix	trans	-58.6	-49.8	176.2	-72	165.3	0	0	0	110.1	L335 N341 L342 E343	L335-I339 HydrophobicContact CD2-CD1 3.91Å; L335-I339 HydrophobicContact CG-CD1 4.01Å; L335-I339 WeakPolarHBondContact O-CB 3.17Å; L335-I339 VanDerWaalsContact O-CG1 3.22Å; L335-I339 WeakPolarHBondContact O-CG1 3.46Å; L335-I339 PolarHBondContact O-N 3.37Å; I339-N341 VanDerWaalsContact C-N 3.32Å; I339-N341 PolarHBondContact O-N 3.17Å; I339-L342 PolarHBondContact O-N 3.14Å; I339-E343 HydrophobicContact CG2-CG 4.22Å; I339-E343 WeakPolarHBondContact O-CB 3.2Å; I339-E343 WeakPolarHBondContact O-CG 3.36Å; I339-E343 PolarHBondContact O-N 3.04Å
340	S	93.3	Very high	88.9	Confident	59 Å²	59	96.4 Å²	96.4	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-60.7	-41.6	-179.4	-172.3	0	0	0	0	112.2	N336 E337 N344	N336-S340 WeakPolarHBondContact O-CB 2.95Å; N336-S340 PolarHBondContact O-N 3.29Å; E337-S340 PolarHBondContact O-N 3.44Å; S340-N344 PolarHBondContact O-N 2.91Å; S340-N344 VanDerWaalsContact O-N 3.12Å; S340-N344 PolarHBondContact O-ND2 2.82Å
341	N	94.2	Very high	88.6	Confident	90 Å²	90	99.2 Å²	99.2	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-45.6	176	-172.6	7.5	0	0	0	111.7	E337 E338 I339 E343 N344 Q345	E337-N341 PolarHBondContact O-N 2.93Å; E338-N341 PolarHBondContact O-N 2.93Å; I339-N341 VanDerWaalsContact C-N 3.32Å; I339-N341 PolarHBondContact O-N 3.17Å; N341-E343 PolarHBondContact O-N 2.81Å; N341-N344 PolarHBondContact O-N 2.81Å; N341-Q345 WeakPolarHBondContact O-CG 3.49Å; N341-Q345 PolarHBondContact O-N 2.88Å; N341-Q345 PolarHBondContact OD1-NE2 2.83Å
342	L	92.5	Very high	88.3	Confident	107 Å²	107	99.3 Å²	99.3	56%	0.56	49%	0.494	S	S	*	.	H	α-helix	trans	-65.4	-38.2	178.7	-73.1	171.9	0	0	0	112.5	E338 I339 Q345 L346	E338-L342 WeakPolarHBondContact O-CB 3.38Å; E338-L342 VanDerWaalsContact O-CG 3.31Å; E338-L342 WeakPolarHBondContact O-CG 3.24Å; E338-L342 PolarHBondContact O-N 2.86Å; I339-L342 PolarHBondContact O-N 3.14Å; L342-Q345 PolarHBondContact O-N 2.9Å; L342-L346 VanDerWaalsContact O-CB 3.28Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 PolarHBondContact O-N 3.17Å
343	E	90.6	Very high	87.5	Confident	107 Å²	107	97.9 Å²	97.9	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-62.5	-43.8	175	-76.1	-179.8	161.3	0	0	111.7	I339 N341 L346 Q347	I339-E343 HydrophobicContact CG2-CG 4.22Å; I339-E343 WeakPolarHBondContact O-CB 3.2Å; I339-E343 WeakPolarHBondContact O-CG 3.36Å; I339-E343 PolarHBondContact O-N 3.04Å; N341-E343 PolarHBondContact O-N 2.81Å; E343-L346 PolarHBondContact O-N 3.32Å; E343-Q347 WeakPolarHBondContact O-CG 3.19Å; E343-Q347 PolarHBondContact O-N 3.29Å
344	N	90.6	Very high	86.4	Confident	83 Å²	83	96.8 Å²	96.8	44%	0.444	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-44.5	175.3	-73.6	-39.8	0	0	0	111.6	S340 N341 L346 Q347 L348	S340-N344 PolarHBondContact O-N 2.91Å; S340-N344 VanDerWaalsContact O-N 3.12Å; S340-N344 PolarHBondContact O-ND2 2.82Å; N341-N344 PolarHBondContact O-N 2.81Å; N344-L346 VanDerWaalsContact C-N 3.34Å; N344-L346 PolarHBondContact O-N 3.1Å; N344-Q347 PolarHBondContact O-N 2.77Å; N344-L348 WeakPolarHBondContact O-CG 3.12Å; N344-L348 PolarHBondContact O-N 2.8Å; N344-L348 VanDerWaalsContact O-N 3.1Å
345	Q	90.7	Very high	85.3	Confident	83 Å²	83	98.3 Å²	98.3	39%	0.388	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175.5	-70.5	179.5	22.4	0	0	111.7	N341 L342 L348 M349	N341-Q345 WeakPolarHBondContact O-CG 3.49Å; N341-Q345 PolarHBondContact O-N 2.88Å; N341-Q345 PolarHBondContact OD1-NE2 2.83Å; L342-Q345 PolarHBondContact O-N 2.9Å; Q345-L348 PolarHBondContact O-N 2.91Å; Q345-M349 WeakPolarHBondContact O-CG 3.2Å; Q345-M349 PolarHBondContact O-N 3.43Å
346	L	86.4	Confident	84.3	Confident	69 Å²	69	97.5 Å²	97.5	36%	0.361	49%	0.485	S	S	.	.	H	α-helix	trans	-62.1	-44.5	178.2	-174.4	71.8	0	0	0	111.5	L342 E343 N344 M349 K350 N463	L342-L346 VanDerWaalsContact O-CB 3.28Å; L342-L346 WeakPolarHBondContact O-CB 3.49Å; L342-L346 PolarHBondContact O-N 3.17Å; E343-L346 PolarHBondContact O-N 3.32Å; N344-L346 VanDerWaalsContact C-N 3.34Å; N344-L346 PolarHBondContact O-N 3.1Å; L346-M349 PolarHBondContact O-N 3.4Å; L346-K350 WeakPolarHBondContact O-CG 3.47Å; L346-K350 PolarHBondContact O-N 3.2Å; L346-N463 HydrophobicContact CD2-CB 4.32Å
347	Q	84.4	Confident	82.9	Confident	119 Å²	119	95.3 Å²	95.3	56%	0.556	47%	0.472	S	S	*	.	H	α-helix	trans	-61.7	-44.1	177.1	-72.9	178.8	10.9	0	0	111.8	E343 N344 M349 K350 L351	E343-Q347 WeakPolarHBondContact O-CG 3.19Å; E343-Q347 PolarHBondContact O-N 3.29Å; N344-Q347 PolarHBondContact O-N 2.77Å; Q347-M349 VanDerWaalsContact C-N 3.31Å; Q347-M349 PolarHBondContact O-N 2.79Å; Q347-K350 PolarHBondContact O-N 3.47Å; Q347-L351 WeakPolarHBondContact O-CG 3.3Å; Q347-L351 PolarHBondContact O-N 2.81Å; Q347-L351 VanDerWaalsContact O-N 3.17Å
348	L	86.2	Confident	81.5	Confident	110 Å²	110	97.7 Å²	97.7	58%	0.576	48%	0.48	S	S	*	.	H	α-helix	trans	-61.7	-38.5	175.8	-70	171.8	0	0	0	112.2	N344 Q345 K352	N344-L348 WeakPolarHBondContact O-CG 3.12Å; N344-L348 PolarHBondContact O-N 2.8Å; N344-L348 VanDerWaalsContact O-N 3.1Å; Q345-L348 PolarHBondContact O-N 2.91Å; L348-K352 WeakPolarHBondContact O-CG 3.25Å; L348-K352 PolarHBondContact O-N 2.84Å
349	M	80.6	Confident	80.5	Confident	117 Å²	117	100.5 Å²	100.5	58%	0.576	49%	0.493	S	S	*	.	H	α-helix	trans	-70	-41.4	176.7	-70.7	-169.8	-162.4	0	0	112.3	Q345 L346 Q347 L351 K352 Q353	Q345-M349 WeakPolarHBondContact O-CG 3.2Å; Q345-M349 PolarHBondContact O-N 3.43Å; L346-M349 PolarHBondContact O-N 3.4Å; Q347-M349 VanDerWaalsContact C-N 3.31Å; Q347-M349 PolarHBondContact O-N 2.79Å; M349-L351 VanDerWaalsContact C-N 3.34Å; M349-L351 PolarHBondContact O-N 2.85Å; M349-K352 WeakPolarHBondContact O-CB 3.26Å; M349-K352 PolarHBondContact O-N 2.78Å; M349-K352 VanDerWaalsContact O-N 3.12Å; M349-Q353 WeakPolarHBondContact O-CB 3.47Å; M349-Q353 PolarHBondContact O-N 2.89Å
350	K	78.7	Confident	79.5	Confident	66 Å²	66	103 Å²	103	29%	0.287	50%	0.503	S	S	.	.	H	α-helix	trans	-57.2	-45.1	176.3	-77.4	179.3	172	-175.1	0	112.2	L346 Q347 K352 Q353 D354 N463	L346-K350 WeakPolarHBondContact O-CG 3.47Å; L346-K350 PolarHBondContact O-N 3.2Å; Q347-K350 PolarHBondContact O-N 3.47Å; K350-K352 VanDerWaalsContact C-N 3.28Å; K350-K352 PolarHBondContact O-N 2.94Å; K350-Q353 PolarHBondContact O-N 2.87Å; K350-Q353 VanDerWaalsContact O-N 3.08Å; K350-D354 PolarHBondContact O-N 3.33Å; K350-D354 VanDerWaalsContact O-N 3.08Å; K350-N463 WeakPolarHBondContact CE-O 3.49Å
351	L	78.3	Confident	78.5	Confident	113 Å²	113	107.7 Å²	107.7	59%	0.592	52%	0.522	S	S	*	.	H	α-helix	trans	-61.9	-34.8	177.4	-69	171.7	0	0	0	113	Q347 M349	Q347-L351 WeakPolarHBondContact O-CG 3.3Å; Q347-L351 PolarHBondContact O-N 2.81Å; Q347-L351 VanDerWaalsContact O-N 3.17Å; M349-L351 VanDerWaalsContact C-N 3.34Å; M349-L351 PolarHBondContact O-N 2.85Å
352	K	78.2	Confident	77.3	Confident	143 Å²	143	106.2 Å²	106.2	62%	0.622	51%	0.512	S	S	*	.	H	α-helix	trans	-72.5	-36.9	173.9	-69.8	176.7	-179.7	179.2	0	111.5	L348 M349 K350 Q355 I356	L348-K352 WeakPolarHBondContact O-CG 3.25Å; L348-K352 PolarHBondContact O-N 2.84Å; M349-K352 WeakPolarHBondContact O-CB 3.26Å; M349-K352 PolarHBondContact O-N 2.78Å; M349-K352 VanDerWaalsContact O-N 3.12Å; K350-K352 VanDerWaalsContact C-N 3.28Å; K350-K352 PolarHBondContact O-N 2.94Å; K352-Q355 PolarHBondContact O-N 3.25Å; K352-I356 WeakPolarHBondContact O-CG1 3.33Å
353	Q	69.5	Low	76.5	Confident	50 Å²	50	108.7 Å²	108.7	23%	0.234	53%	0.525	C	S	.	.	H	α-helix	trans	-68.8	-41.5	-175.8	-175	170	-19.8	0	0	112.5	M349 K350 Q355 I356 E357	M349-Q353 WeakPolarHBondContact O-CB 3.47Å; M349-Q353 PolarHBondContact O-N 2.89Å; K350-Q353 PolarHBondContact O-N 2.87Å; K350-Q353 VanDerWaalsContact O-N 3.08Å; Q353-Q355 PolarHBondContact O-N 2.99Å; Q353-I356 PolarHBondContact O-N 3.48Å; Q353-E357 HydrophobicContact CG-CG 4.01Å; Q353-E357 PolarHBondContact NE2-OE1 2.77Å; Q353-E357 VanDerWaalsContact NE2-OE1 3.09Å; Q353-E357 WeakPolarHBondContact O-CG 3.24Å; Q353-E357 PolarHBondContact O-N 2.92Å; Q353-E357 VanDerWaalsContact O-N 3.12Å
354	D	67.5	Low	75.9	Confident	80 Å²	80	106.4 Å²	106.4	43%	0.428	52%	0.516	S	S	.	.	H	α-helix	trans	-55.7	-24.4	177.4	-69.9	-21.3	0	0	0	112.7	K350 S465	K350-D354 PolarHBondContact O-N 3.33Å; K350-D354 VanDerWaalsContact O-N 3.08Å; D354-S465 PolarHBondContact OD1-OG 3.47Å
355	Q	67.2	Low	75.2	Confident	158 Å²	158	107.7 Å²	107.7	74%	0.738	53%	0.529	S	S	*	.	H	α-helix	trans	-81	-28.3	176.1	-60.4	-177.4	-4.7	0	0	113.4	K352 Q353	K352-Q355 PolarHBondContact O-N 3.25Å; Q353-Q355 PolarHBondContact O-N 2.99Å
356	I	67.4	Low	74.9	Confident	72 Å²	72	105.3 Å²	105.3	37%	0.369	52%	0.519	S	S	.	.	H	α-helix	trans	-91.2	-31.2	-172	-62.3	169.2	0	0	0	111.8	K352 Q353 K358 Q359 Q360	K352-I356 WeakPolarHBondContact O-CG1 3.33Å; Q353-I356 PolarHBondContact O-N 3.48Å; I356-K358 PolarHBondContact O-N 3.24Å; I356-Q359 PolarHBondContact O-N 2.83Å; I356-Q360 HydrophobicContact CG2-CB 4.34Å; I356-Q360 HydrophobicContact CG2-CG 4.09Å
357	E	64.1	Low	74.7	Confident	39 Å²	39	105.1 Å²	105.1	18%	0.182	52%	0.516	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.9	-171.3	-78.7	-179.6	175.1	0	0	115.3	Q353 T466	Q353-E357 HydrophobicContact CG-CG 4.01Å; Q353-E357 PolarHBondContact NE2-OE1 2.77Å; Q353-E357 VanDerWaalsContact NE2-OE1 3.09Å; Q353-E357 WeakPolarHBondContact O-CG 3.24Å; Q353-E357 PolarHBondContact O-N 2.92Å; Q353-E357 VanDerWaalsContact O-N 3.12Å; E357-T466 PolarHBondContact OE1-OG1 3.16Å; E357-T466 PolarHBondContact OE2-OG1 2.95Å
358	K	65.6	Low	74.9	Confident	197 Å²	197	100.3 Å²	100.3	86%	0.857	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.2	178.9	-67	-177	177.8	175.7	0	114.5	I356	I356-K358 PolarHBondContact O-N 3.24Å
359	Q	71.4	Confident	75.1	Confident	177 Å²	177	98 Å²	98	83%	0.827	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	-12.3	-169.8	-64.9	-176.2	-0.6	0	0	114.4	I356	I356-Q359 PolarHBondContact O-N 2.83Å
360	Q	72	Confident	75.6	Confident	123 Å²	123	97.9 Å²	97.9	58%	0.575	48%	0.475	S	S	*	.			trans	-129.5	148.4	-171.6	-63.6	-173.5	-8.5	0	0	112.1	I356	I356-Q360 HydrophobicContact CG2-CB 4.34Å; I356-Q360 HydrophobicContact CG2-CG 4.09Å
361	I	72.7	Confident	76.2	Confident	159 Å²	159	98.1 Å²	98.1	82%	0.815	48%	0.476	S	S	*	.			trans	-86.5	121.5	170.2	-61.7	173.8	0	0	0	107.4
362	H	69.9	Low	76.9	Confident	59 Å²	59	95.4 Å²	95.4	27%	0.273	46%	0.46	S	S	.	.			trans	-92.8	119.3	176.7	-64.8	-80.5	0	0	0	110.3	M467	H362-M467 HydrophobicContact CB-SD 4.49Å
363	L	74.4	Confident	77.5	Confident	158 Å²	158	92 Å²	92	83%	0.827	44%	0.443	S	S	*	.			trans	-95.7	111.6	170.1	-64.4	174.8	0	0	0	108.3	P365	L363-P365 WeakPolarHBondContact O-CD 3.5Å
364	I	78	Confident	78.6	Confident	59 Å²	59	90.5 Å²	90.5	30%	0.303	44%	0.437	S	S	.	.			trans	-100.1	107.2	178.1	-60.6	166.2	0	0	0	107.6	L366 I462 L464 A469	I364-L366 HydrophobicContact CG2-CD2 3.97Å; I364-L366 HydrophobicContact CG2-CG 4.14Å; I364-L366 PolarHBondContact O-N 3.37Å; I364-L366 VanDerWaalsContact O-N 3.14Å; I364-I462 HydrophobicContact CG2-CD1 3.98Å; I364-L464 HydrophobicContact CD1-CD1 3.47Å; I364-L464 VanDerWaalsContact CD1-CD1 3.47Å; I364-A469 HydrophobicContact CB-CB 4.37Å; I364-A469 HydrophobicContact CD1-CB 3.87Å; I364-A469 HydrophobicContact CG2-CB 4.32Å
365	P	77.1	Confident	79.6	Confident	111 Å²	111	87.6 Å²	87.6	72%	0.721	42%	0.421	S	S	*	.			trans	-69.7	112	175.9	28.4	-32.2	0	0	0	109.1	L363	L363-P365 WeakPolarHBondContact O-CD 3.5Å
366	L	82.6	Confident	80.5	Confident	33 Å²	33	82.9 Å²	82.9	17%	0.173	40%	0.399	C	S	.	.			trans	-104.9	97.2	173	-68.6	-175.7	0	0	0	109.8	I364 P460 I462 A469 K471	I364-L366 HydrophobicContact CG2-CD2 3.97Å; I364-L366 HydrophobicContact CG2-CG 4.14Å; I364-L366 PolarHBondContact O-N 3.37Å; I364-L366 VanDerWaalsContact O-N 3.14Å; L366-P460 HydrophobicContact CD1-CG 4.04Å; L366-P460 HydrophobicContact CD2-CG 3.66Å; L366-P460 HydrophobicContact CG-CG 4.49Å; L366-I462 HydrophobicContact CD2-CD1 3.85Å; L366-A469 HydrophobicContact CD1-CB 3.79Å; L366-K471 HydrophobicContact CB-CB 4.41Å; L366-K471 HydrophobicContact CB-CD 4.37Å; L366-K471 WeakPolarHBondContact O-CD 3.45Å; L366-K471 PolarHBondContact O-NZ 2.81Å
367	E	82.2	Confident	81.2	Confident	64 Å²	64	85.2 Å²	85.2	30%	0.299	41%	0.408	S	S	.	.			trans	-79.8	128.4	169.7	-68.9	-170.1	-169.1	0	0	109.9	T15 T44 M45 Q388	T15-E367 PolarHBondContact OG1-OE2 2.85Å; T44-E367 PolarHBondContact OG1-OE2 3.23Å; M45-E367 WeakPolarHBondContact CE-OE1 3.18Å; E367-Q388 HydrophobicContact CB-CG 4.16Å; E367-Q388 VanDerWaalsContact CB-NE2 3.33Å; E367-Q388 PolarHBondContact OE2-NE2 2.92Å
368	L	89.1	Confident	82.1	Confident	19 Å²	19	85.9 Å²	85.9	10%	0.099	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	147.1	169.8	75	82	0	0	0	107.3	Y370 E386 T387 V458 K471 I473	L368-Y370 HydrophobicContact CD1-CD1 3.74Å; L368-Y370 HydrophobicContact CD1-CG 4.47Å; L368-E386 CarbonylContact C-O 3.53Å; L368-E386 VanDerWaalsContact CA-O 3.24Å; L368-E386 WeakPolarHBondContact CA-O 3.24Å; L368-E386 WeakPolarHBondContact CB-O 3.35Å; L368-T387 HydrophobicContact CB-CG2 3.86Å; L368-V458 HydrophobicContact CD2-CB 4.12Å; L368-V458 HydrophobicContact CD2-CG2 4.18Å; L368-K471 HydrophobicContact CD2-CB 3.6Å; L368-K471 HydrophobicContact CD2-CD 3.51Å; L368-K471 HydrophobicContact CD2-CG 3.58Å; L368-K471 HydrophobicContact CG-CD 3.69Å; L368-K471 HydrophobicContact CG-CG 4.25Å; L368-I473 HydrophobicContact CD1-CD1 3.74Å; L368-I473 HydrophobicContact CD1-CG1 4.06Å; L368-I473 HydrophobicContact CD2-CD1 4.41Å
369	I	89.7	Confident	83.1	Confident	60 Å²	60	78 Å²	78	31%	0.308	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.4	167.3	60.1	171.5	0	0	0	108.1	Y300 E386	Y300-I369 HydrophobicContact CD1-CD1 4.3Å; Y300-I369 HydrophobicContact CD2-CD1 3.73Å; Y300-I369 HydrophobicContact CD2-CG1 4.36Å; Y300-I369 HydrophobicContact CD2-CG2 4.36Å; Y300-I369 HydrophobicContact CE1-CD1 4.47Å; Y300-I369 HydrophobicContact CE1-CG1 4.29Å; Y300-I369 HydrophobicContact CE2-CB 4.46Å; Y300-I369 HydrophobicContact CE2-CD1 3.93Å; Y300-I369 HydrophobicContact CE2-CG1 4.07Å; Y300-I369 HydrophobicContact CE2-CG2 3.59Å; Y300-I369 HydrophobicContact CG-CD1 3.92Å; I369-E386 HydrophobicContact CD1-CB 4.18Å; I369-E386 HydrophobicContact CG1-CB 3.76Å; I369-E386 PolarHBondContact N-O 3.03Å; I369-E386 PolarHBondContact O-N 3.47Å
370	Y	92.8	Very high	84	Confident	116 Å²	116	69.8 Å²	69.8	46%	0.455	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	149.5	170.4	70	-86.1	0	0	0	110.3	L368 L383 N384 I473 L475	L368-Y370 HydrophobicContact CD1-CD1 3.74Å; L368-Y370 HydrophobicContact CD1-CG 4.47Å; Y370-L383 HydrophobicContact CD2-CD1 3.82Å; Y370-L383 HydrophobicContact CG-CD1 4.35Å; Y370-N384 CarbonylContact C-O 3.58Å; Y370-N384 WeakPolarHBondContact CA-O 3.34Å; Y370-N384 WeakPolarHBondContact CB-O 3.44Å; Y370-I473 HydrophobicContact CD1-CD1 3.87Å; Y370-I473 HydrophobicContact CD1-CG1 3.94Å; Y370-I473 HydrophobicContact CD1-CG2 3.97Å; Y370-I473 HydrophobicContact CD2-CG2 3.83Å; Y370-I473 HydrophobicContact CE1-CG1 4.22Å; Y370-I473 HydrophobicContact CE1-CG2 3.77Å; Y370-I473 HydrophobicContact CE2-CG2 3.63Å; Y370-I473 HydrophobicContact CG-CD1 3.88Å; Y370-I473 HydrophobicContact CG-CG1 4.35Å; Y370-I473 HydrophobicContact CG-CG2 4Å; Y370-L475 HydrophobicContact CD2-CD2 4.31Å; Y370-L475 HydrophobicContact CE2-CD2 3.77Å
371	K	90.7	Very high	85	Confident	70 Å²	70	64.4 Å²	64.4	30%	0.304	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121.2	173.9	-171.1	179.9	172.1	172.5	0	108.7	E215 Y373 L383 N384	E215-K371 IonicContact OE2-NZ 3.47Å; E215-K371 PolarHBondContact OE2-NZ 2.65Å; K371-Y373 HydrophobicContact CD-CD1 4.13Å; K371-Y373 HydrophobicContact CD-CE1 4.37Å; K371-Y373 HydrophobicContact CG-CD1 3.94Å; K371-Y373 HydrophobicContact CG-CE1 4.48Å; K371-L383 WeakPolarHBondContact O-CA 3.25Å; K371-N384 HydrophobicContact CB-CB 4.49Å; K371-N384 PolarHBondContact N-O 3.5Å; K371-N384 PolarHBondContact O-N 3.04Å
372	F	93.4	Very high	86	Confident	56 Å²	56	57 Å²	57	25%	0.246	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.5	177.4	-177.3	-122.6	0	0	0	109.3	Y381 C382 L383 F444 L475 I477	F372-Y381 HydrophobicContact CD2-CD1 4.38Å; F372-Y381 AromaticContact CE1-CD1 3.83Å; F372-Y381 HydrophobicContact CE1-CD1 3.83Å; F372-Y381 AromaticContact CE1-CE1 3.89Å; F372-Y381 HydrophobicContact CE1-CE1 3.89Å; F372-Y381 AromaticContact CE2-CD1 3.53Å; F372-Y381 HydrophobicContact CE2-CD1 3.53Å; F372-Y381 HydrophobicContact CE2-CE1 4.4Å; F372-Y381 AromaticContact CE2-CG 3.94Å; F372-Y381 HydrophobicContact CE2-CG 3.94Å; F372-Y381 AromaticContact CZ-CD1 3.19Å; F372-Y381 HydrophobicContact CZ-CD1 3.19Å; F372-Y381 AromaticContact CZ-CE1 3.65Å; F372-Y381 HydrophobicContact CZ-CE1 3.65Å; F372-Y381 AromaticContact CZ-CG 3.78Å; F372-Y381 HydrophobicContact CZ-CG 3.78Å; F372-C382 WeakPolarHBondContact CA-O 3.44Å; F372-L383 HydrophobicContact CB-CD1 4.09Å; F372-L383 HydrophobicContact CD2-CB 4.17Å; F372-L383 HydrophobicContact CD2-CD1 4.35Å; F372-F444 AromaticContact CE2-CE1 3.86Å; F372-F444 HydrophobicContact CE2-CE1 3.86Å; F372-F444 HydrophobicContact CE2-CE2 4.37Å; F372-F444 AromaticContact CE2-CZ 3.42Å; F372-F444 HydrophobicContact CE2-CZ 3.42Å; F372-F444 VanDerWaalsContact CE2-CZ 3.42Å; F372-F444 HydrophobicContact CZ-CE2 4.44Å; F372-F444 AromaticContact CZ-CZ 3.77Å; F372-F444 HydrophobicContact CZ-CZ 3.77Å; F372-L475 HydrophobicContact CB-CD2 3.93Å; F372-L475 HydrophobicContact CD1-CD2 4.04Å; F372-L475 HydrophobicContact CD2-CD1 3.78Å; F372-L475 HydrophobicContact CD2-CD2 4.49Å; F372-L475 HydrophobicContact CE1-CB 4.38Å; F372-L475 HydrophobicContact CE2-CD1 4.01Å; F372-L475 HydrophobicContact CG-CD1 4.05Å; F372-L475 HydrophobicContact CG-CD2 3.9Å; F372-L475 HydrophobicContact CG-CG 4.47Å; F372-L475 HydrophobicContact CZ-CD1 4.47Å; F372-I477 HydrophobicContact CE1-CD1 4.48Å; F372-I477 HydrophobicContact CZ-CD1 3.84Å
373	Y	91	Very high	87.2	Confident	71 Å²	71	54.1 Å²	54.1	28%	0.278	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	161.8	-177.5	66.1	-81.3	0	0	0	111.4	K371 N375 Y381 C382 N384	K371-Y373 HydrophobicContact CD-CD1 4.13Å; K371-Y373 HydrophobicContact CD-CE1 4.37Å; K371-Y373 HydrophobicContact CG-CD1 3.94Å; K371-Y373 HydrophobicContact CG-CE1 4.48Å; Y373-N375 HydrophobicContact CE2-CB 4.45Å; Y373-Y381 WeakPolarHBondContact O-CA 3.32Å; Y373-C382 HydrophobicContact CD1-CB 4.09Å; Y373-C382 HydrophobicContact CD2-CB 4.36Å; Y373-C382 HydrophobicContact CE1-CB 3.56Å; Y373-C382 HydrophobicContact CE2-CB 3.83Å; Y373-C382 HydrophobicContact CG-CB 4.47Å; Y373-C382 PolarHBondContact N-O 3.24Å; Y373-C382 PolarHBondContact O-N 3.04Å; Y373-N384 WeakPolarHBondContact CE1-OD1 3.41Å
374	L	91.4	Very high	88	Confident	19 Å²	19	49 Å²	49	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	116.8	175.8	-179.6	56.8	0	0	0	109.7	K376 I380 Y381 S481 I556	L374-K376 PolarHBondContact O-N 2.97Å; L374-K376 VanDerWaalsContact O-N 3.17Å; L374-I380 WeakPolarHBondContact CD1-O 3.33Å; L374-Y381 HydrophobicContact CB-CD1 4.18Å; L374-Y381 HydrophobicContact CB-CE1 3.96Å; L374-Y381 HydrophobicContact CD1-CD1 4.41Å; L374-Y381 HydrophobicContact CD1-CD2 3.97Å; L374-Y381 HydrophobicContact CD1-CE1 4.45Å; L374-Y381 HydrophobicContact CD1-CE2 3.99Å; L374-Y381 HydrophobicContact CD1-CG 4.22Å; L374-S481 WeakPolarHBondContact CD2-O 3.26Å; L374-I556 HydrophobicContact CD2-CD1 3.3Å; L374-I556 HydrophobicContact CG-CD1 3.98Å
375	N	88.3	Confident	88.7	Confident	19 Å²	19	46.2 Å²	46.2	10%	0.102	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	104.2	170.2	-176.6	-37.3	0	0	0	109.3	Y373 Q377 L378 F379 I380	Y373-N375 HydrophobicContact CE2-CB 4.45Å; N375-Q377 VanDerWaalsContact C-N 3.26Å; N375-Q377 PolarHBondContact O-N 2.81Å; N375-Q377 WeakPolarHBondContact OD1-CB 3.38Å; N375-Q377 PolarHBondContact OD1-N 3.27Å; N375-L378 PolarHBondContact O-N 3Å; N375-L378 PolarHBondContact OD1-N 3.17Å; N375-L378 VanDerWaalsContact OD1-N 3.1Å; N375-F379 WeakPolarHBondContact O-CA 3.43Å; N375-F379 PolarHBondContact O-N 2.97Å; N375-I380 HydrophobicContact CB-CG1 4.02Å; N375-I380 WeakPolarHBondContact CB-O 3.41Å; N375-I380 PolarHBondContact N-O 3.27Å; N375-I380 PolarHBondContact O-N 2.83Å
376	K	87.4	Confident	89.4	Confident	60 Å²	60	41.2 Å²	41.2	26%	0.261	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-26.4	-177	-64.7	176.8	-178.7	156	0	113.9	E188 L374 I556	E188-K376 WeakPolarHBondContact OE1-CD 3.35Å; E188-K376 VanDerWaalsContact OE1-CE 3.24Å; E188-K376 WeakPolarHBondContact OE1-CE 3.33Å; E188-K376 IonicContact OE1-NZ 3.32Å; E188-K376 PolarHBondContact OE1-NZ 3.49Å; L374-K376 PolarHBondContact O-N 2.97Å; L374-K376 VanDerWaalsContact O-N 3.17Å; K376-I556 HydrophobicContact CB-CG2 4.01Å; K376-I556 HydrophobicContact CG-CD1 3.84Å; K376-I556 HydrophobicContact CG-CG1 4.42Å; K376-I556 HydrophobicContact CG-CG2 4.44Å; K376-I556 VanDerWaalsContact O-CG2 3.23Å; K376-I556 WeakPolarHBondContact O-CG2 3.41Å
377	Q	82.3	Confident	89.7	Confident	120 Å²	120	39.9 Å²	39.9	56%	0.561	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-39.4	-179.4	-64	-178.4	-10.9	0	0	111.9	N375	N375-Q377 VanDerWaalsContact C-N 3.26Å; N375-Q377 PolarHBondContact O-N 2.81Å; N375-Q377 WeakPolarHBondContact OD1-CB 3.38Å; N375-Q377 PolarHBondContact OD1-N 3.27Å
378	L	81.8	Confident	89.9	Confident	54 Å²	54	40.3 Å²	40.3	28%	0.283	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-9.6	-176.3	-62.6	179.5	0	0	0	113.6	N375 I380 Y692	N375-L378 PolarHBondContact O-N 3Å; N375-L378 PolarHBondContact OD1-N 3.17Å; N375-L378 VanDerWaalsContact OD1-N 3.1Å; L378-I380 VanDerWaalsContact C-N 3.26Å; L378-I380 HydrophobicContact CB-CD1 3.82Å; L378-I380 HydrophobicContact CB-CG1 3.83Å; L378-I380 HydrophobicContact CB-CG2 4.24Å; L378-I380 HydrophobicContact CD1-CD1 3.75Å; L378-I380 HydrophobicContact CG-CD1 4.46Å; L378-I380 WeakPolarHBondContact O-CG2 3.48Å; L378-I380 PolarHBondContact O-N 3.03Å; L378-Y692 HydrophobicContact CD2-CD1 4.22Å
379	F	86.9	Confident	89.9	Confident	32 Å²	32	42.9 Å²	42.9	14%	0.14	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	36.8	-175	-44.1	-75.7	0	0	0	112.8	N375 I556 Y557	N375-F379 WeakPolarHBondContact O-CA 3.43Å; N375-F379 PolarHBondContact O-N 2.97Å; F379-I556 HydrophobicContact CD1-CB 4.28Å; F379-I556 HydrophobicContact CD1-CG2 3.67Å; F379-I556 HydrophobicContact CE1-CB 4.36Å; F379-I556 HydrophobicContact CE1-CG2 3.53Å; F379-I556 WeakPolarHBondContact CE1-O 3.17Å; F379-Y557 HydrophobicContact CB-CD2 4.18Å; F379-Y557 AromaticContact CD1-CD2 4Å; F379-Y557 HydrophobicContact CD1-CD2 4Å; F379-Y557 HydrophobicContact CD2-CD2 4.13Å; F379-Y557 HydrophobicContact CD2-CE2 4.45Å; F379-Y557 HydrophobicContact CE1-CD2 4.45Å; F379-Y557 AromaticContact CG-CD2 3.82Å; F379-Y557 HydrophobicContact CG-CD2 3.82Å
380	I	89.8	Confident	89.9	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	143.8	-177.7	69.6	-174.1	0	0	0	110.2	L374 N375 L378 Q443 R445	L374-I380 WeakPolarHBondContact CD1-O 3.33Å; N375-I380 HydrophobicContact CB-CG1 4.02Å; N375-I380 WeakPolarHBondContact CB-O 3.41Å; N375-I380 PolarHBondContact N-O 3.27Å; N375-I380 PolarHBondContact O-N 2.83Å; L378-I380 VanDerWaalsContact C-N 3.26Å; L378-I380 HydrophobicContact CB-CD1 3.82Å; L378-I380 HydrophobicContact CB-CG1 3.83Å; L378-I380 HydrophobicContact CB-CG2 4.24Å; L378-I380 HydrophobicContact CD1-CD1 3.75Å; L378-I380 HydrophobicContact CG-CD1 4.46Å; L378-I380 WeakPolarHBondContact O-CG2 3.48Å; L378-I380 PolarHBondContact O-N 3.03Å; I380-Q443 HydrophobicContact CD1-CB 4.09Å; I380-Q443 HydrophobicContact CD1-CG 3.88Å; I380-Q443 VanDerWaalsContact CD1-OE1 3.29Å; I380-R445 HydrophobicContact CB-CG 4.2Å; I380-R445 HydrophobicContact CG2-CG 3.53Å; I380-R445 VanDerWaalsContact CG2-NE 3.27Å
381	Y	93.8	Very high	89.9	Confident	9 Å²	9	36.3 Å²	36.3	4%	0.035	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	133.1	165.7	-81.7	-83.3	0	0	0	110	F372 Y373 L374 Q443 F444 T446 S481	F372-Y381 HydrophobicContact CD2-CD1 4.38Å; F372-Y381 AromaticContact CE1-CD1 3.83Å; F372-Y381 HydrophobicContact CE1-CD1 3.83Å; F372-Y381 AromaticContact CE1-CE1 3.89Å; F372-Y381 HydrophobicContact CE1-CE1 3.89Å; F372-Y381 AromaticContact CE2-CD1 3.53Å; F372-Y381 HydrophobicContact CE2-CD1 3.53Å; F372-Y381 HydrophobicContact CE2-CE1 4.4Å; F372-Y381 AromaticContact CE2-CG 3.94Å; F372-Y381 HydrophobicContact CE2-CG 3.94Å; F372-Y381 AromaticContact CZ-CD1 3.19Å; F372-Y381 HydrophobicContact CZ-CD1 3.19Å; F372-Y381 AromaticContact CZ-CE1 3.65Å; F372-Y381 HydrophobicContact CZ-CE1 3.65Å; F372-Y381 AromaticContact CZ-CG 3.78Å; F372-Y381 HydrophobicContact CZ-CG 3.78Å; Y373-Y381 WeakPolarHBondContact O-CA 3.32Å; L374-Y381 HydrophobicContact CB-CD1 4.18Å; L374-Y381 HydrophobicContact CB-CE1 3.96Å; L374-Y381 HydrophobicContact CD1-CD1 4.41Å; L374-Y381 HydrophobicContact CD1-CD2 3.97Å; L374-Y381 HydrophobicContact CD1-CE1 4.45Å; L374-Y381 HydrophobicContact CD1-CE2 3.99Å; L374-Y381 HydrophobicContact CD1-CG 4.22Å; Y381-Q443 WeakPolarHBondContact O-CA 3.22Å; Y381-F444 HydrophobicContact CD2-CE2 4.39Å; Y381-F444 HydrophobicContact CG-CE2 4.23Å; Y381-F444 PolarHBondContact N-O 3.32Å; Y381-F444 PolarHBondContact O-N 2.99Å; Y381-T446 HydrophobicContact CD2-CG2 3.6Å; Y381-T446 HydrophobicContact CE2-CG2 3.73Å; Y381-S481 WeakPolarHBondContact OH-CA 3.46Å; Y381-S481 VanDerWaalsContact OH-CB 3.28Å; Y381-S481 WeakPolarHBondContact OH-CB 3.39Å; Y381-S481 PolarHBondContact OH-O 2.77Å
382	C	93	Very high	90	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.02	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.4	174.8	-64	0	0	0	0	108.9	F372 Y373 I442	F372-C382 WeakPolarHBondContact CA-O 3.44Å; Y373-C382 HydrophobicContact CD1-CB 4.09Å; Y373-C382 HydrophobicContact CD2-CB 4.36Å; Y373-C382 HydrophobicContact CE1-CB 3.56Å; Y373-C382 HydrophobicContact CE2-CB 3.83Å; Y373-C382 HydrophobicContact CG-CB 4.47Å; Y373-C382 PolarHBondContact N-O 3.24Å; Y373-C382 PolarHBondContact O-N 3.04Å; C382-I442 WeakPolarHBondContact CA-O 3.5Å
383	L	94.9	Very high	90.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	109.7	170.2	175.6	66.1	0	0	0	108.6	Y370 K371 F372 I385 D441 I442 V456 L475	Y370-L383 HydrophobicContact CD2-CD1 3.82Å; Y370-L383 HydrophobicContact CG-CD1 4.35Å; K371-L383 WeakPolarHBondContact O-CA 3.25Å; F372-L383 HydrophobicContact CB-CD1 4.09Å; F372-L383 HydrophobicContact CD2-CB 4.17Å; F372-L383 HydrophobicContact CD2-CD1 4.35Å; L383-I385 HydrophobicContact CD1-CG1 4.37Å; L383-I385 HydrophobicContact CD2-CD1 3.9Å; L383-I385 HydrophobicContact CD2-CG1 4.21Å; L383-I385 HydrophobicContact CG-CD1 4.17Å; L383-I385 HydrophobicContact CG-CG1 3.93Å; L383-D441 WeakPolarHBondContact O-CA 3.46Å; L383-I442 HydrophobicContact CB-CB 4.26Å; L383-I442 HydrophobicContact CD2-CD1 4.1Å; L383-I442 PolarHBondContact N-O 3.48Å; L383-I442 PolarHBondContact O-N 2.83Å; L383-V456 HydrophobicContact CD2-CB 4.3Å; L383-V456 HydrophobicContact CD2-CG1 4.37Å; L383-V456 HydrophobicContact CD2-CG2 3.71Å; L383-L475 HydrophobicContact CD1-CD1 3.9Å; L383-L475 HydrophobicContact CD2-CD1 3.68Å; L383-L475 HydrophobicContact CG-CD1 4.26Å
384	N	91.8	Very high	90.3	Very high	49 Å²	49	31.4 Å²	31.4	26%	0.262	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126.7	174.8	-61.4	63.2	0	0	0	107.9	Y370 K371 Y373 D441	Y370-N384 CarbonylContact C-O 3.58Å; Y370-N384 WeakPolarHBondContact CA-O 3.34Å; Y370-N384 WeakPolarHBondContact CB-O 3.44Å; K371-N384 HydrophobicContact CB-CB 4.49Å; K371-N384 PolarHBondContact N-O 3.5Å; K371-N384 PolarHBondContact O-N 3.04Å; Y373-N384 WeakPolarHBondContact CE1-OD1 3.41Å; N384-D441 WeakPolarHBondContact CA-OD1 3.36Å; N384-D441 WeakPolarHBondContact CB-OD1 3.37Å; N384-D441 VanDerWaalsContact ND2-CG 3.34Å; N384-D441 PolarHBondContact ND2-OD1 3.48Å; N384-D441 PolarHBondContact ND2-OD2 3.25Å
385	I	93.1	Very high	90.5	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.6	-179.2	-59	172.4	0	0	0	108	L383 I394 R439 F440 I442 V456 V458 I473	L383-I385 HydrophobicContact CD1-CG1 4.37Å; L383-I385 HydrophobicContact CD2-CD1 3.9Å; L383-I385 HydrophobicContact CD2-CG1 4.21Å; L383-I385 HydrophobicContact CG-CD1 4.17Å; L383-I385 HydrophobicContact CG-CG1 3.93Å; I385-I394 HydrophobicContact CD1-CD1 4.39Å; I385-R439 CarbonylContact O-C 3.56Å; I385-R439 VanDerWaalsContact O-CA 3.27Å; I385-R439 WeakPolarHBondContact O-CA 3.47Å; I385-F440 PolarHBondContact N-O 2.97Å; I385-F440 PolarHBondContact O-N 3.1Å; I385-I442 HydrophobicContact CD1-CD1 4.01Å; I385-V456 HydrophobicContact CD1-CG1 3.78Å; I385-V458 HydrophobicContact CD1-CG2 3.97Å; I385-V458 HydrophobicContact CG2-CG1 4.31Å; I385-V458 HydrophobicContact CG2-CG2 3.92Å; I385-I473 HydrophobicContact CD1-CD1 4.06Å; I385-I473 HydrophobicContact CG1-CD1 4.13Å
386	E	90.8	Very high	90.9	Very high	5 Å²	5	32.8 Å²	32.8	2%	0.023	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.2	171.8	-173.9	164.7	-171.6	0	0	111.9	H278 Y300 L368 I369 T438 R439	H278-E386 WeakPolarHBondContact CB-OE2 3.44Å; H278-E386 IonicContact CG-OE2 3.96Å; H278-E386 VanDerWaalsContact CG-OE2 3.23Å; H278-E386 IonicContact ND1-OE2 3.24Å; Y300-E386 HydrophobicContact CD1-CG 3.6Å; Y300-E386 HydrophobicContact CE1-CG 3.91Å; L368-E386 CarbonylContact C-O 3.53Å; L368-E386 VanDerWaalsContact CA-O 3.24Å; L368-E386 WeakPolarHBondContact CA-O 3.24Å; L368-E386 WeakPolarHBondContact CB-O 3.35Å; I369-E386 HydrophobicContact CD1-CB 4.18Å; I369-E386 HydrophobicContact CG1-CB 3.76Å; I369-E386 PolarHBondContact N-O 3.03Å; I369-E386 PolarHBondContact O-N 3.47Å; E386-T438 WeakPolarHBondContact CA-O 3.48Å; E386-R439 HydrophobicContact CB-CG 4.07Å; E386-R439 HydrophobicContact CG-CG 3.78Å; E386-R439 IonicContact OE1-CZ 2.78Å; E386-R439 IonicContact OE1-NE 3.29Å; E386-R439 PolarHBondContact OE1-NE 2.59Å; E386-R439 IonicContact OE1-NH2 3.52Å; E386-R439 PolarHBondContact OE1-NH2 3.29Å; E386-R439 IonicContact OE2-CZ 3.8Å; E386-R439 IonicContact OE2-NE 3.68Å; E386-R439 PolarHBondContact OE2-NE 2.78Å; E386-R439 IonicContact OE2-NH2 3.67Å
387	T	90.3	Very high	91.3	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.031	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	154.5	-179.1	52.5	0	0	0	0	110.4	L368 L389 I391 T438 V458	L368-T387 HydrophobicContact CB-CG2 3.86Å; T387-L389 VanDerWaalsContact C-N 3.3Å; T387-L389 WeakPolarHBondContact CB-O 3.45Å; T387-L389 PolarHBondContact OG1-O 3.46Å; T387-I391 HydrophobicContact CG2-CD1 4.49Å; T387-I391 HydrophobicContact CG2-CG1 4.21Å; T387-I391 VanDerWaalsContact OG1-CG1 3.28Å; T387-I391 WeakPolarHBondContact OG1-CG1 3.46Å; T387-T438 PolarHBondContact N-O 2.85Å; T387-T438 WeakPolarHBondContact O-CB 3.47Å; T387-T438 PolarHBondContact OG1-O 3.18Å; T387-V458 HydrophobicContact CG2-CG1 3.77Å
388	Q	85.5	Confident	91.9	Very high	73 Å²	73	27 Å²	27	34%	0.341	14%	0.137	S	C	.	.	S	Bend	trans	-68.8	-33.3	174.5	-48.2	-170.2	-17.6	0	0	112.5	T15 Y300 E367	T15-Q388 HydrophobicContact CG2-CB 4.28Å; T15-Q388 HydrophobicContact CG2-CG 3.39Å; T15-Q388 PolarHBondContact OG1-NE2 2.92Å; Y300-Q388 HydrophobicContact CE1-CG 4.46Å; E367-Q388 HydrophobicContact CB-CG 4.16Å; E367-Q388 VanDerWaalsContact CB-NE2 3.33Å; E367-Q388 PolarHBondContact OE2-NE2 2.92Å
389	L	88.3	Confident	92.5	Very high	74 Å²	74	27.9 Å²	27.9	39%	0.387	14%	0.143	S	C	.	.	S	Bend	trans	-103.5	151.6	-179.2	-60.7	177.1	0	0	0	109.7	T387 P460 I462	T387-L389 VanDerWaalsContact C-N 3.3Å; T387-L389 WeakPolarHBondContact CB-O 3.45Å; T387-L389 PolarHBondContact OG1-O 3.46Å; L389-P460 HydrophobicContact CB-CB 3.95Å; L389-P460 HydrophobicContact CD1-CB 4.45Å; L389-I462 HydrophobicContact CD1-CG1 4.08Å
390	P	90.9	Very high	92.7	Very high	38 Å²	38	26.7 Å²	26.7	25%	0.247	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-55.5	141.9	173.9	-24.3	34.1	0	0	0	111.8	N436 T437 P460 K461	P390-N436 HydrophobicContact CB-CB 3.94Å; P390-N436 HydrophobicContact CG-CB 4.03Å; P390-T437 CarbonylContact C-O 3.57Å; P390-T437 WeakPolarHBondContact CA-O 3.37Å; P390-P460 CarbonylContact O-C 3.59Å; P390-P460 WeakPolarHBondContact O-CA 3.31Å; P390-K461 HydrophobicContact CB-CD 4.25Å; P390-K461 PolarHBondContact O-N 2.81Å
391	I	92.9	Very high	92.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	133.9	178.9	-59.2	168.6	0	0	0	108.5	T387 I394 C433 T437 F440 V458 K461	T387-I391 HydrophobicContact CG2-CD1 4.49Å; T387-I391 HydrophobicContact CG2-CG1 4.21Å; T387-I391 VanDerWaalsContact OG1-CG1 3.28Å; T387-I391 WeakPolarHBondContact OG1-CG1 3.46Å; I391-I394 HydrophobicContact CD1-CD1 4.32Å; I391-I394 HydrophobicContact CG2-CD1 4.02Å; I391-I394 HydrophobicContact CG2-CG1 3.81Å; I391-C433 WeakPolarHBondContact O-CB 2.99Å; I391-T437 PolarHBondContact N-O 2.88Å; I391-F440 HydrophobicContact CD1-CB 3.75Å; I391-V458 HydrophobicContact CG1-CG1 4.41Å; I391-V458 HydrophobicContact CG2-CG1 4.48Å; I391-K461 WeakPolarHBondContact O-CE 3.31Å
392	D	93.4	Very high	92.7	Very high	48 Å²	48	31.8 Å²	31.8	26%	0.257	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-58.8	171.3	-172.2	61.3	0	0	0	110	C433 V459 K461	D392-C433 PolarHBondContact O-N 3.47Å; D392-V459 WeakPolarHBondContact CB-O 3.37Å; D392-V459 PolarHBondContact N-O 2.63Å; D392-K461 HydrophobicContact CB-CG 3.62Å
393	H	94.2	Very high	92.5	Very high	45 Å²	45	35.2 Å²	35.2	21%	0.208	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	159.9	176.4	62.3	-84.2	0	0	0	112.1	Y431 V459	H393-Y431 CarbonylContact C-O 3.57Å; H393-Y431 WeakPolarHBondContact CA-O 3.43Å; H393-Y431 VanDerWaalsContact CB-O 3.29Å; H393-Y431 WeakPolarHBondContact CB-O 3.39Å; H393-V459 PolarHBondContact N-O 2.97Å; H393-V459 WeakPolarHBondContact NE2-CG2 3.41Å; H393-V459 WeakPolarHBondContact O-CB 3.18Å; H393-V459 PolarHBondContact O-N 2.96Å
394	I	95.7	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.4	175.1	-68.5	164.3	0	0	0	108.8	I385 I391 I396 T430 Y431 F440 I442 V456 Y457 V458	I385-I394 HydrophobicContact CD1-CD1 4.39Å; I391-I394 HydrophobicContact CD1-CD1 4.32Å; I391-I394 HydrophobicContact CG2-CD1 4.02Å; I391-I394 HydrophobicContact CG2-CG1 3.81Å; I394-I396 HydrophobicContact CG2-CG1 4.24Å; I394-T430 CarbonylContact O-C 3.55Å; I394-T430 WeakPolarHBondContact O-CA 3.47Å; I394-Y431 PolarHBondContact N-O 2.84Å; I394-Y431 PolarHBondContact O-N 2.85Å; I394-F440 HydrophobicContact CD1-CB 3.55Å; I394-F440 HydrophobicContact CD1-CD1 3.21Å; I394-F440 HydrophobicContact CD1-CD2 3.98Å; I394-F440 HydrophobicContact CD1-CE1 3.81Å; I394-F440 HydrophobicContact CD1-CE2 4.49Å; I394-F440 HydrophobicContact CD1-CG 3.3Å; I394-F440 HydrophobicContact CD1-CZ 4.41Å; I394-I442 HydrophobicContact CG2-CD1 4.23Å; I394-V456 HydrophobicContact CG2-CG1 3.45Å; I394-V456 VanDerWaalsContact CG2-CG1 3.45Å; I394-Y457 CarbonylContact C-O 3.57Å; I394-Y457 VanDerWaalsContact CA-O 3.3Å; I394-Y457 WeakPolarHBondContact CA-O 3.29Å; I394-V458 HydrophobicContact CG1-CG1 4.36Å; I394-V458 HydrophobicContact CG1-CG2 4.43Å
395	L	96	Very high	92	Very high	63 Å²	63	37.3 Å²	37.3	33%	0.33	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.2	171.4	-51.4	169.5	0	0	0	109.2	T429 T430 V456 Y457	L395-T429 CarbonylContact C-O 3.59Å; L395-T429 WeakPolarHBondContact CA-O 3.33Å; L395-T430 HydrophobicContact CD2-CG2 3.54Å; L395-T430 WeakPolarHBondContact CD2-OG1 3.4Å; L395-V456 CarbonylContact O-C 3.6Å; L395-V456 WeakPolarHBondContact O-CA 3.12Å; L395-Y457 HydrophobicContact CB-CD2 4.23Å; L395-Y457 PolarHBondContact N-O 3.16Å; L395-Y457 PolarHBondContact O-N 3.02Å
396	I	96.3	Very high	91.5	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.5	173.3	-53.9	-177.2	0	0	0	107.8	I394 L404 L428 T429 Y431 I442 V454 V456	I394-I396 HydrophobicContact CG2-CG1 4.24Å; I396-L404 HydrophobicContact CD1-CD1 4.33Å; I396-L404 HydrophobicContact CD1-CD2 3.88Å; I396-L428 WeakPolarHBondContact O-CA 3.31Å; I396-T429 PolarHBondContact N-O 2.68Å; I396-T429 PolarHBondContact O-N 3.27Å; I396-Y431 HydrophobicContact CD1-CD2 4.03Å; I396-Y431 HydrophobicContact CD1-CE2 3.63Å; I396-Y431 HydrophobicContact CG1-CD2 4.48Å; I396-Y431 HydrophobicContact CG1-CE2 4.47Å; I396-I442 HydrophobicContact CD1-CD1 3.74Å; I396-I442 HydrophobicContact CD1-CG1 4.2Å; I396-I442 HydrophobicContact CD1-CG2 3.85Å; I396-I442 HydrophobicContact CG1-CD1 4.33Å; I396-V454 HydrophobicContact CG2-CG1 3.91Å; I396-V456 HydrophobicContact CG1-CG1 4.5Å; I396-V456 HydrophobicContact CG1-CG2 4.44Å
397	Q	95.6	Very high	91.1	Very high	58 Å²	58	44.7 Å²	44.7	27%	0.271	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.1	171.2	178.7	-157.8	-3.7	0	0	108.1	N425 L427 L428 V454 S455 Y457	Q397-N425 WeakPolarHBondContact CG-OD1 3.17Å; Q397-N425 PolarHBondContact NE2-OD1 3.21Å; Q397-L427 WeakPolarHBondContact CA-O 3.24Å; Q397-L428 HydrophobicContact CB-CD2 3.98Å; Q397-L428 HydrophobicContact CG-CD2 3.78Å; Q397-V454 CarbonylContact O-C 3.57Å; Q397-S455 PolarHBondContact N-O 2.75Å; Q397-S455 PolarHBondContact O-N 3.29Å; Q397-Y457 HydrophobicContact CB-CE2 4.3Å; Q397-Y457 PolarHBondContact OE1-OH 2.85Å
398	S	95.4	Very high	90.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141	172	-171.1	0	0	0	0	111.5	C400 N425 A426 L427 Y453 V454	S398-C400 PolarHBondContact OG-N 3.46Å; S398-C400 PolarHBondContact OG-O 2.79Å; S398-C400 PolarHBondContact OG-SG 3.2Å; S398-C400 VanDerWaalsContact OG-SG 3.37Å; S398-N425 CarbonylContact O-C 3.55Å; S398-A426 PolarHBondContact O-N 2.78Å; S398-L427 PolarHBondContact N-O 2.9Å; S398-L427 PolarHBondContact O-N 2.9Å; S398-L427 VanDerWaalsContact O-N 3.14Å; S398-Y453 WeakPolarHBondContact CA-O 3.36Å; S398-V454 WeakPolarHBondContact OG-CG2 3.39Å
399	D	93.7	Very high	90.1	Very high	74 Å²	74	56.6 Å²	56.6	40%	0.396	28%	0.284	S	S	.	.	S	Bend	trans	-91.8	-7.7	170.7	63.4	4.7	0	0	0	112.8	G424 G452 Y453	D399-G424 WeakPolarHBondContact CA-O 3.42Å; D399-G424 WeakPolarHBondContact CB-O 3.07Å; D399-G452 VanDerWaalsContact OD1-C 3.25Å; D399-G452 WeakPolarHBondContact OD1-CA 3.42Å; D399-Y453 PolarHBondContact N-O 2.83Å; D399-Y453 PolarHBondContact OD1-N 3.13Å; D399-Y453 PolarHBondContact OD2-N 2.92Å
400	C	91.9	Very high	89.8	Confident	6 Å²	6	55.1 Å²	55.1	4%	0.041	28%	0.276	C	S	.	.	S	Bend	trans	-117.4	156.4	177.4	68	0	0	0	0	110.8	S398 I402 A426	S398-C400 PolarHBondContact OG-N 3.46Å; S398-C400 PolarHBondContact OG-O 2.79Å; S398-C400 PolarHBondContact OG-SG 3.2Å; S398-C400 VanDerWaalsContact OG-SG 3.37Å; C400-I402 PolarHBondContact O-N 3.34Å; C400-A426 VanDerWaalsContact O-CB 3.3Å; C400-A426 WeakPolarHBondContact O-CB 3Å
401	Q	90.3	Very high	89.4	Confident	111 Å²	111	56.7 Å²	56.7	52%	0.519	29%	0.285	S	S	.	.			trans	-72.9	119.6	179.8	-172.7	173.1	-5.2	0	0	109.8
402	I	92.1	Very high	89.3	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.046	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	147.4	174.7	69.7	176.8	0	0	0	110.2	C400 L427 F444 R445 T446 V454	C400-I402 PolarHBondContact O-N 3.34Å; I402-L427 HydrophobicContact CD1-CD2 3.76Å; I402-L427 HydrophobicContact CG1-CD2 3.45Å; I402-L427 VanDerWaalsContact CG1-CD2 3.45Å; I402-F444 HydrophobicContact CB-CD2 4.11Å; I402-F444 HydrophobicContact CD1-CB 4.39Å; I402-F444 HydrophobicContact CD1-CD2 4.15Å; I402-F444 HydrophobicContact CD1-CG 4.17Å; I402-F444 HydrophobicContact CG2-CD2 4.15Å; I402-F444 HydrophobicContact CG2-CE2 4.43Å; I402-R445 VanDerWaalsContact CA-O 3.31Å; I402-R445 WeakPolarHBondContact CA-O 3.3Å; I402-T446 HydrophobicContact CG2-CG2 4.45Å; I402-V454 HydrophobicContact CD1-CG1 4.24Å; I402-V454 HydrophobicContact CD1-CG2 3.92Å; I402-V454 HydrophobicContact CG2-CG2 4.33Å
403	D	89.4	Confident	89.1	Confident	75 Å²	75	58.8 Å²	58.8	40%	0.401	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.3	176.1	-60	-38.8	0	0	0	109.6	F405 F444 R445	D403-F405 HydrophobicContact CB-CE2 4.4Å; D403-F405 VanDerWaalsContact O-CE2 3.27Å; D403-F405 WeakPolarHBondContact O-CE2 3.35Å; D403-F444 CarbonylContact O-C 3.58Å; D403-F444 WeakPolarHBondContact O-CA 3.27Å; D403-F444 WeakPolarHBondContact O-CB 3.29Å; D403-R445 HydrophobicContact CB-CB 4.44Å; D403-R445 PolarHBondContact N-O 2.84Å; D403-R445 PolarHBondContact O-N 3.28Å
404	L	90.9	Very high	89	Confident	39 Å²	39	59.5 Å²	59.5	20%	0.204	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	139.1	177.1	-71.5	169.6	0	0	0	111.7	I396 L427 T429 Y431 I442 F444	I396-L404 HydrophobicContact CD1-CD1 4.33Å; I396-L404 HydrophobicContact CD1-CD2 3.88Å; L404-L427 HydrophobicContact CD1-CD2 3.65Å; L404-L427 HydrophobicContact CG-CD2 3.9Å; L404-T429 HydrophobicContact CD1-CG2 3.74Å; L404-T429 WeakPolarHBondContact CD1-OG1 3.34Å; L404-Y431 HydrophobicContact CD1-CE2 4.35Å; L404-I442 HydrophobicContact CD2-CG2 3.88Å; L404-F444 HydrophobicContact CD2-CB 3.98Å
405	F	84.8	Confident	88.9	Confident	54 Å²	54	62.3 Å²	62.3	24%	0.237	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.2	174.9	-68.2	-87	0	0	0	111.5	D403 Q443 R445	D403-F405 HydrophobicContact CB-CE2 4.4Å; D403-F405 VanDerWaalsContact O-CE2 3.27Å; D403-F405 WeakPolarHBondContact O-CE2 3.35Å; F405-Q443 HydrophobicContact CB-CB 4.11Å; F405-Q443 PolarHBondContact N-O 3.36Å; F405-R445 HydrophobicContact CD2-CG 4.4Å; F405-R445 HydrophobicContact CE2-CB 3.84Å; F405-R445 HydrophobicContact CE2-CG 3.41Å; F405-R445 VanDerWaalsContact CE2-CG 3.41Å; F405-R445 HydrophobicContact CZ-CB 4.4Å; F405-R445 VanDerWaalsContact CZ-CD 3.49Å; F405-R445 HydrophobicContact CZ-CG 3.89Å; F405-R445 VanDerWaalsContact CZ-NE 3.28Å
406	N	82.2	Confident	88.7	Confident	131 Å²	131	65.3 Å²	65.3	70%	0.701	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-80.8	121.1	168.6	-68.1	-24.4	0	0	0	109.2
407	I	82.6	Confident	88.5	Confident	32 Å²	32	67.7 Å²	67.7	16%	0.164	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-91.2	126.9	175.6	-56.3	176.2	0	0	0	108	E409 N410 D441 Q443	I407-E409 VanDerWaalsContact C-N 3.27Å; I407-E409 HydrophobicContact CG2-CB 4.39Å; I407-E409 PolarHBondContact O-N 2.54Å; I407-N410 HydrophobicContact CB-CB 4.18Å; I407-N410 WeakPolarHBondContact O-CB 3.26Å; I407-N410 PolarHBondContact O-N 2.98Å; I407-D441 HydrophobicContact CD1-CB 3.77Å; I407-D441 VanDerWaalsContact CD1-O 3.29Å; I407-D441 WeakPolarHBondContact CD1-O 3.44Å; I407-Q443 HydrophobicContact CD1-CB 4.26Å; I407-Q443 HydrophobicContact CD1-CG 3.79Å; I407-Q443 HydrophobicContact CG1-CB 4.42Å; I407-Q443 HydrophobicContact CG1-CG 4.27Å
408	E	77.9	Confident	88.2	Confident	154 Å²	154	74 Å²	74	72%	0.72	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.7	-174.4	-65.5	-175.6	174.3	0	0	113.6	N410 K691	E408-N410 PolarHBondContact O-N 2.53Å; E408-K691 IonicContact OE1-NZ 2.9Å; E408-K691 PolarHBondContact OE1-NZ 2.83Å
409	E	77.5	Confident	87.8	Confident	174 Å²	174	76.3 Å²	76.3	81%	0.813	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-15	178.9	-61	-179.8	179.8	0	0	112.8	I407 T411	I407-E409 VanDerWaalsContact C-N 3.27Å; I407-E409 HydrophobicContact CG2-CB 4.39Å; I407-E409 PolarHBondContact O-N 2.54Å; E409-T411 PolarHBondContact O-N 3.33Å
410	N	81.4	Confident	87.5	Confident	43 Å²	43	80 Å²	80	23%	0.23	42%	0.417	C	S	.	.			trans	-83.4	119.5	-176.7	-166.1	-12.2	0	0	0	111	I407 E408 A412 F440	I407-N410 HydrophobicContact CB-CB 4.18Å; I407-N410 WeakPolarHBondContact O-CB 3.26Å; I407-N410 PolarHBondContact O-N 2.98Å; E408-N410 PolarHBondContact O-N 2.53Å; N410-A412 VanDerWaalsContact C-N 3.34Å; N410-A412 VanDerWaalsContact OD1-CB 3.3Å; N410-A412 WeakPolarHBondContact OD1-CB 3.32Å; N410-A412 PolarHBondContact OD1-N 3.49Å; N410-F440 WeakPolarHBondContact ND2-CE2 3.08Å; N410-F440 WeakPolarHBondContact ND2-CZ 3.42Å; N410-F440 VanDerWaalsContact OD1-CE2 3.27Å; N410-F440 WeakPolarHBondContact OD1-CE2 3.46Å
411	T	84.1	Confident	86.9	Confident	71 Å²	71	90.2 Å²	90.2	44%	0.436	46%	0.461	S	S	.	.			trans	-89.6	2.9	179.3	56.6	0	0	0	0	113.5	E409	E409-T411 PolarHBondContact O-N 3.33Å
412	A	89.3	Confident	86.4	Confident	17 Å²	17	88.7 Å²	88.7	14%	0.14	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-75.5	144.1	179.7	0	0	0	0	0	112.9	N410 Y431 R432 F440	N410-A412 VanDerWaalsContact C-N 3.34Å; N410-A412 VanDerWaalsContact OD1-CB 3.3Å; N410-A412 WeakPolarHBondContact OD1-CB 3.32Å; N410-A412 PolarHBondContact OD1-N 3.49Å; A412-Y431 HydrophobicContact CB-CD1 4.36Å; A412-R432 CarbonylContact C-O 3.47Å; A412-R432 WeakPolarHBondContact CA-O 3.31Å; A412-R432 WeakPolarHBondContact CB-O 3.3Å; A412-F440 HydrophobicContact CB-CE2 3.54Å; A412-F440 HydrophobicContact CB-CZ 3.99Å
413	V	90.4	Very high	86.1	Confident	74 Å²	74	92.9 Å²	92.9	45%	0.448	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	122.8	172.8	-179.3	0	0	0	0	108.6	Y431 R432 Q434	V413-Y431 CarbonylContact O-C 3.55Å; V413-Y431 WeakPolarHBondContact O-CA 3.41Å; V413-R432 PolarHBondContact N-O 2.75Å; V413-R432 PolarHBondContact O-N 2.92Å; V413-Q434 HydrophobicContact CG2-CG 4.12Å; V413-Q434 VanDerWaalsContact CG2-NE2 3.25Å
414	N	91.9	Very high	86	Confident	60 Å²	60	91.9 Å²	91.9	32%	0.321	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	130.9	176.2	-177.2	-2.8	0	0	0	110.4	T429 T430 Y431	N414-T429 WeakPolarHBondContact OD1-CG2 3.45Å; N414-T430 CarbonylContact C-O 3.56Å; N414-T430 WeakPolarHBondContact CA-O 3.1Å; N414-Y431 HydrophobicContact CB-CD1 3.89Å; N414-Y431 HydrophobicContact CB-CE1 3.62Å; N414-Y431 PolarHBondContact ND2-OH 2.92Å
415	S	92.6	Very high	86	Confident	60 Å²	60	91.6 Å²	91.6	42%	0.42	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	121.9	169.2	63.1	0	0	0	0	111.2	T430	S415-T430 PolarHBondContact N-O 3.38Å; S415-T430 PolarHBondContact O-N 3.14Å; S415-T430 WeakPolarHBondContact OG-CB 3.36Å; S415-T430 PolarHBondContact OG-O 2.74Å
416	L	92	Very high	86.3	Confident	126 Å²	126	91.5 Å²	91.5	66%	0.66	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.8	174.2	-172.8	73	0	0	0	110	L427 L428 T429	L416-L427 HydrophobicContact CD1-CD1 3.5Å; L416-L427 VanDerWaalsContact CD1-CD1 3.5Å; L416-L428 WeakPolarHBondContact CD1-O 3.45Å; L416-T429 WeakPolarHBondContact CD1-OG1 3.48Å
417	S	92.3	Very high	86.8	Confident	54 Å²	54	86.3 Å²	86.3	38%	0.378	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	142.8	176.4	-63.9	0	0	0	0	110.7	C419 L428	S417-C419 PolarHBondContact O-N 2.98Å; S417-L428 PolarHBondContact N-O 3.18Å
418	E	89.6	Confident	87.4	Confident	189 Å²	189	86.8 Å²	86.8	88%	0.883	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-66.6	126.8	175.8	-66.8	-174.7	172.5	0	0	111.5
419	C	88	Confident	88.2	Confident	50 Å²	50	79.7 Å²	79.7	34%	0.338	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-81.7	123.5	175.5	-62.6	0	0	0	0	110.4	S417	S417-C419 PolarHBondContact O-N 2.98Å
420	K	87.3	Confident	89.1	Confident	152 Å²	152	72.9 Å²	72.9	66%	0.661	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-76.7	138.3	174.2	-63.6	177.7	-178.8	174.2	0	110.6	G422 D423	K420-G422 PolarHBondContact O-N 2.95Å; K420-D423 PolarHBondContact O-N 2.87Å
421	K	78.2	Confident	89.7	Confident	220 Å²	220	71.3 Å²	71.3	96%	0.957	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	117.2	173.9	-65.2	-175.9	179.9	-178.7	0	109.6
422	G	81	Confident	90.2	Very high	79 Å²	79	75.7 Å²	75.7	81%	0.814	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	117.2	-19.8	177.6	0	0	0	0	0	114.8	K420 G424	K420-G422 PolarHBondContact O-N 2.95Å; G422-G424 PolarHBondContact O-N 2.81Å
423	D	84.8	Confident	90.3	Very high	97 Å²	97	75.1 Å²	75.1	52%	0.519	42%	0.419	S	S	.	.	S	Bend	trans	-76	-7.3	-178.1	-68.3	-3.1	0	0	0	113	K420 N425	K420-D423 PolarHBondContact O-N 2.87Å; D423-N425 PolarHBondContact O-N 3.33Å
424	G	87.3	Confident	90.2	Very high	54 Å²	54	78.2 Å²	78.2	56%	0.557	43%	0.429	S	S	*	.			trans	75.1	3.4	-176.4	0	0	0	0	0	114.4	D399 G422	D399-G424 WeakPolarHBondContact CA-O 3.42Å; D399-G424 WeakPolarHBondContact CB-O 3.07Å; G422-G424 PolarHBondContact O-N 2.81Å
425	N	91	Very high	90.1	Very high	32 Å²	32	79.2 Å²	79.2	17%	0.171	44%	0.437	C	S	.	.			trans	-88.1	123.9	179.8	-60.8	-40.7	0	0	0	110.9	Q397 S398 D423 L428	Q397-N425 WeakPolarHBondContact CG-OD1 3.17Å; Q397-N425 PolarHBondContact NE2-OD1 3.21Å; S398-N425 CarbonylContact O-C 3.55Å; D423-N425 PolarHBondContact O-N 3.33Å; N425-L428 HydrophobicContact CB-CD1 4.39Å; N425-L428 HydrophobicContact CB-CD2 4.32Å; N425-L428 HydrophobicContact CB-CG 4.14Å
426	A	91.4	Very high	89.8	Confident	52 Å²	52	81.7 Å²	81.7	43%	0.43	45%	0.446	S	S	.	.	S	Bend	trans	-86.3	-33.2	168.5	0	0	0	0	0	111.5	S398 C400	S398-A426 PolarHBondContact O-N 2.78Å; C400-A426 VanDerWaalsContact O-CB 3.3Å; C400-A426 WeakPolarHBondContact O-CB 3Å
427	L	92.7	Very high	89.7	Confident	23 Å²	23	77.5 Å²	77.5	12%	0.12	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	135.6	-178.9	-174.3	74.9	0	0	0	111.8	Q397 S398 I402 L404 L416	Q397-L427 WeakPolarHBondContact CA-O 3.24Å; S398-L427 PolarHBondContact N-O 2.9Å; S398-L427 PolarHBondContact O-N 2.9Å; S398-L427 VanDerWaalsContact O-N 3.14Å; I402-L427 HydrophobicContact CD1-CD2 3.76Å; I402-L427 HydrophobicContact CG1-CD2 3.45Å; I402-L427 VanDerWaalsContact CG1-CD2 3.45Å; L404-L427 HydrophobicContact CD1-CD2 3.65Å; L404-L427 HydrophobicContact CG-CD2 3.9Å; L416-L427 HydrophobicContact CD1-CD1 3.5Å; L416-L427 VanDerWaalsContact CD1-CD1 3.5Å
428	L	95.3	Very high	89.5	Confident	42 Å²	42	76.8 Å²	76.8	22%	0.22	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	115	170.1	-68.3	174.8	0	0	0	109.3	I396 Q397 L416 S417 N425	I396-L428 WeakPolarHBondContact O-CA 3.31Å; Q397-L428 HydrophobicContact CB-CD2 3.98Å; Q397-L428 HydrophobicContact CG-CD2 3.78Å; L416-L428 WeakPolarHBondContact CD1-O 3.45Å; S417-L428 PolarHBondContact N-O 3.18Å; N425-L428 HydrophobicContact CB-CD1 4.39Å; N425-L428 HydrophobicContact CB-CD2 4.32Å; N425-L428 HydrophobicContact CB-CG 4.14Å
429	T	94.7	Very high	89.5	Confident	4 Å²	4	70.8 Å²	70.8	3%	0.025	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.6	-177.5	-58.9	0	0	0	0	111	L395 I396 L404 N414 L416 Y431	L395-T429 CarbonylContact C-O 3.59Å; L395-T429 WeakPolarHBondContact CA-O 3.33Å; I396-T429 PolarHBondContact N-O 2.68Å; I396-T429 PolarHBondContact O-N 3.27Å; L404-T429 HydrophobicContact CD1-CG2 3.74Å; L404-T429 WeakPolarHBondContact CD1-OG1 3.34Å; N414-T429 WeakPolarHBondContact OD1-CG2 3.45Å; L416-T429 WeakPolarHBondContact CD1-OG1 3.48Å; T429-Y431 HydrophobicContact CG2-CD2 4.15Å; T429-Y431 HydrophobicContact CG2-CE2 3.71Å
430	T	95.9	Very high	89.7	Confident	32 Å²	32	68.7 Å²	68.7	20%	0.196	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.6	174.9	-54.4	0	0	0	0	110.1	I394 L395 N414 S415	I394-T430 CarbonylContact O-C 3.55Å; I394-T430 WeakPolarHBondContact O-CA 3.47Å; L395-T430 HydrophobicContact CD2-CG2 3.54Å; L395-T430 WeakPolarHBondContact CD2-OG1 3.4Å; N414-T430 CarbonylContact C-O 3.56Å; N414-T430 WeakPolarHBondContact CA-O 3.1Å; S415-T430 PolarHBondContact N-O 3.38Å; S415-T430 PolarHBondContact O-N 3.14Å; S415-T430 WeakPolarHBondContact OG-CB 3.36Å; S415-T430 PolarHBondContact OG-O 2.74Å
431	Y	95	Very high	89.9	Confident	10 Å²	10	64.2 Å²	64.2	4%	0.039	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.9	170	-72.1	-86	0	0	0	109.6	H393 I394 I396 L404 A412 V413 N414 T429 F440	H393-Y431 CarbonylContact C-O 3.57Å; H393-Y431 WeakPolarHBondContact CA-O 3.43Å; H393-Y431 VanDerWaalsContact CB-O 3.29Å; H393-Y431 WeakPolarHBondContact CB-O 3.39Å; I394-Y431 PolarHBondContact N-O 2.84Å; I394-Y431 PolarHBondContact O-N 2.85Å; I396-Y431 HydrophobicContact CD1-CD2 4.03Å; I396-Y431 HydrophobicContact CD1-CE2 3.63Å; I396-Y431 HydrophobicContact CG1-CD2 4.48Å; I396-Y431 HydrophobicContact CG1-CE2 4.47Å; L404-Y431 HydrophobicContact CD1-CE2 4.35Å; A412-Y431 HydrophobicContact CB-CD1 4.36Å; V413-Y431 CarbonylContact O-C 3.55Å; V413-Y431 WeakPolarHBondContact O-CA 3.41Å; N414-Y431 HydrophobicContact CB-CD1 3.89Å; N414-Y431 HydrophobicContact CB-CE1 3.62Å; N414-Y431 PolarHBondContact ND2-OH 2.92Å; T429-Y431 HydrophobicContact CG2-CD2 4.15Å; T429-Y431 HydrophobicContact CG2-CE2 3.71Å; Y431-F440 VanDerWaalsContact CB-CZ 3.49Å; Y431-F440 HydrophobicContact CD1-CE1 4.35Å; Y431-F440 AromaticContact CD1-CZ 3.67Å; Y431-F440 HydrophobicContact CD1-CZ 3.67Å; Y431-F440 HydrophobicContact CD2-CE1 4.21Å; Y431-F440 HydrophobicContact CD2-CZ 4.23Å; Y431-F440 HydrophobicContact CE1-CZ 4.43Å; Y431-F440 AromaticContact CG-CE1 3.97Å; Y431-F440 HydrophobicContact CG-CE1 3.97Å; Y431-F440 AromaticContact CG-CZ 3.54Å; Y431-F440 HydrophobicContact CG-CZ 3.54Å
432	R	94.5	Very high	90.6	Very high	163 Å²	163	54 Å²	54	62%	0.615	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	118.3	176.4	-172.5	175.7	-177.3	156.1	2.7	110.6	A412 V413 Q434	A412-R432 CarbonylContact C-O 3.47Å; A412-R432 WeakPolarHBondContact CA-O 3.31Å; A412-R432 WeakPolarHBondContact CB-O 3.3Å; V413-R432 PolarHBondContact N-O 2.75Å; V413-R432 PolarHBondContact O-N 2.92Å; R432-Q434 PolarHBondContact O-N 2.71Å
433	C	91.6	Very high	91.2	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.034	29%	0.285	C	S	.	.			trans	-80.1	118.4	-178.4	-64.3	0	0	0	0	110.4	I391 D392	I391-C433 WeakPolarHBondContact O-CB 2.99Å; D392-C433 PolarHBondContact O-N 3.47Å
434	Q	88	Confident	91.6	Very high	138 Å²	138	48.2 Å²	48.2	65%	0.645	26%	0.26	S	S	*	.	S	Bend	trans	-81.5	-33.1	179	-63.3	-169.3	-29.9	0	0	112.2	V413 R432	V413-Q434 HydrophobicContact CG2-CG 4.12Å; V413-Q434 VanDerWaalsContact CG2-NE2 3.25Å; R432-Q434 PolarHBondContact O-N 2.71Å
435	V	88.2	Confident	91.7	Very high	81 Å²	81	46.2 Å²	46.2	49%	0.491	24%	0.236	S	C	.	.	S	Bend	trans	-97.8	156.4	178.9	-175.5	0	0	0	0	109.4	T437	V435-T437 HydrophobicContact CB-CG2 4.17Å; V435-T437 HydrophobicContact CG1-CG2 4.35Å; V435-T437 PolarHBondContact O-N 3.43Å
436	N	87.7	Confident	91.8	Very high	113 Å²	113	44.8 Å²	44.8	60%	0.604	23%	0.228	S	C	*	.			trans	-73.9	72.6	174.1	-73.3	-18.9	0	0	0	111	P390 K461	P390-N436 HydrophobicContact CB-CB 3.94Å; P390-N436 HydrophobicContact CG-CB 4.03Å; N436-K461 PolarHBondContact OD1-NZ 2.85Å
437	T	88.7	Confident	91.7	Very high	37 Å²	37	43.8 Å²	43.8	23%	0.227	22%	0.217	C	C	.	.			trans	-91.8	131.5	177.5	52.2	0	0	0	0	110.1	P390 I391 V435	P390-T437 CarbonylContact C-O 3.57Å; P390-T437 WeakPolarHBondContact CA-O 3.37Å; I391-T437 PolarHBondContact N-O 2.88Å; V435-T437 HydrophobicContact CB-CG2 4.17Å; V435-T437 HydrophobicContact CG1-CG2 4.35Å; V435-T437 PolarHBondContact O-N 3.43Å
438	T	88.6	Confident	91.6	Very high	39 Å²	39	44.2 Å²	44.2	24%	0.239	22%	0.219	C	C	.	.	S	Bend	trans	-92.6	-15.7	171.8	51.5	0	0	0	0	112.4	E386 T387	E386-T438 WeakPolarHBondContact CA-O 3.48Å; T387-T438 PolarHBondContact N-O 2.85Å; T387-T438 WeakPolarHBondContact O-CB 3.47Å; T387-T438 PolarHBondContact OG1-O 3.18Å
439	R	89.4	Confident	91.3	Very high	64 Å²	64	43.7 Å²	43.7	24%	0.242	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.3	176	-65.9	-163.6	-169.9	95.2	48.6	111.8	N276 Y277 H278 I385 E386	N276-R439 PolarHBondContact O-NH1 3.12Å; Y277-R439 VanDerWaalsContact C-NH1 3.28Å; H278-R439 VanDerWaalsContact CB-CZ 3.49Å; I385-R439 CarbonylContact O-C 3.56Å; I385-R439 VanDerWaalsContact O-CA 3.27Å; I385-R439 WeakPolarHBondContact O-CA 3.47Å; E386-R439 HydrophobicContact CB-CG 4.07Å; E386-R439 HydrophobicContact CG-CG 3.78Å; E386-R439 IonicContact OE1-CZ 2.78Å; E386-R439 IonicContact OE1-NE 3.29Å; E386-R439 PolarHBondContact OE1-NE 2.59Å; E386-R439 IonicContact OE1-NH2 3.52Å; E386-R439 PolarHBondContact OE1-NH2 3.29Å; E386-R439 IonicContact OE2-CZ 3.8Å; E386-R439 IonicContact OE2-NE 3.68Å; E386-R439 PolarHBondContact OE2-NE 2.78Å; E386-R439 IonicContact OE2-NH2 3.67Å
440	F	91.6	Very high	91.2	Very high	5 Å²	5	47.9 Å²	47.9	2%	0.022	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	124.5	173.7	-160.1	-95	0	0	0	110.8	I385 I391 I394 N410 A412 Y431 I442	I385-F440 PolarHBondContact N-O 2.97Å; I385-F440 PolarHBondContact O-N 3.1Å; I391-F440 HydrophobicContact CD1-CB 3.75Å; I394-F440 HydrophobicContact CD1-CB 3.55Å; I394-F440 HydrophobicContact CD1-CD1 3.21Å; I394-F440 HydrophobicContact CD1-CD2 3.98Å; I394-F440 HydrophobicContact CD1-CE1 3.81Å; I394-F440 HydrophobicContact CD1-CE2 4.49Å; I394-F440 HydrophobicContact CD1-CG 3.3Å; I394-F440 HydrophobicContact CD1-CZ 4.41Å; N410-F440 WeakPolarHBondContact ND2-CE2 3.08Å; N410-F440 WeakPolarHBondContact ND2-CZ 3.42Å; N410-F440 VanDerWaalsContact OD1-CE2 3.27Å; N410-F440 WeakPolarHBondContact OD1-CE2 3.46Å; A412-F440 HydrophobicContact CB-CE2 3.54Å; A412-F440 HydrophobicContact CB-CZ 3.99Å; Y431-F440 VanDerWaalsContact CB-CZ 3.49Å; Y431-F440 HydrophobicContact CD1-CE1 4.35Å; Y431-F440 AromaticContact CD1-CZ 3.67Å; Y431-F440 HydrophobicContact CD1-CZ 3.67Å; Y431-F440 HydrophobicContact CD2-CE1 4.21Å; Y431-F440 HydrophobicContact CD2-CZ 4.23Å; Y431-F440 HydrophobicContact CE1-CZ 4.43Å; Y431-F440 AromaticContact CG-CE1 3.97Å; Y431-F440 HydrophobicContact CG-CE1 3.97Å; Y431-F440 AromaticContact CG-CZ 3.54Å; Y431-F440 HydrophobicContact CG-CZ 3.54Å; F440-I442 HydrophobicContact CD1-CD1 3.98Å; F440-I442 HydrophobicContact CD1-CG1 3.62Å; F440-I442 HydrophobicContact CE1-CD1 4.06Å; F440-I442 HydrophobicContact CE1-CG1 3.53Å
441	D	91.4	Very high	91.1	Very high	59 Å²	59	49.9 Å²	49.9	32%	0.316	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	133.2	177.2	-66.7	-19.6	0	0	0	109.6	L383 N384 I407	L383-D441 WeakPolarHBondContact O-CA 3.46Å; N384-D441 WeakPolarHBondContact CA-OD1 3.36Å; N384-D441 WeakPolarHBondContact CB-OD1 3.37Å; N384-D441 VanDerWaalsContact ND2-CG 3.34Å; N384-D441 PolarHBondContact ND2-OD1 3.48Å; N384-D441 PolarHBondContact ND2-OD2 3.25Å; I407-D441 HydrophobicContact CD1-CB 3.77Å; I407-D441 VanDerWaalsContact CD1-O 3.29Å; I407-D441 WeakPolarHBondContact CD1-O 3.44Å
442	I	93.5	Very high	91.1	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	131.4	175.3	-64	159	0	0	0	107.4	C382 L383 I385 I394 I396 L404 F440 F444 V456	C382-I442 WeakPolarHBondContact CA-O 3.5Å; L383-I442 HydrophobicContact CB-CB 4.26Å; L383-I442 HydrophobicContact CD2-CD1 4.1Å; L383-I442 PolarHBondContact N-O 3.48Å; L383-I442 PolarHBondContact O-N 2.83Å; I385-I442 HydrophobicContact CD1-CD1 4.01Å; I394-I442 HydrophobicContact CG2-CD1 4.23Å; I396-I442 HydrophobicContact CD1-CD1 3.74Å; I396-I442 HydrophobicContact CD1-CG1 4.2Å; I396-I442 HydrophobicContact CD1-CG2 3.85Å; I396-I442 HydrophobicContact CG1-CD1 4.33Å; L404-I442 HydrophobicContact CD2-CG2 3.88Å; F440-I442 HydrophobicContact CD1-CD1 3.98Å; F440-I442 HydrophobicContact CD1-CG1 3.62Å; F440-I442 HydrophobicContact CE1-CD1 4.06Å; F440-I442 HydrophobicContact CE1-CG1 3.53Å; I442-F444 HydrophobicContact CG2-CD1 4.07Å; I442-V456 HydrophobicContact CD1-CG1 4.13Å
443	Q	93.2	Very high	91.1	Very high	53 Å²	53	47.3 Å²	47.3	25%	0.248	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.4	173.4	-73.6	175	9.5	0	0	109.3	I380 Y381 F405 I407	I380-Q443 HydrophobicContact CD1-CB 4.09Å; I380-Q443 HydrophobicContact CD1-CG 3.88Å; I380-Q443 VanDerWaalsContact CD1-OE1 3.29Å; Y381-Q443 WeakPolarHBondContact O-CA 3.22Å; F405-Q443 HydrophobicContact CB-CB 4.11Å; F405-Q443 PolarHBondContact N-O 3.36Å; I407-Q443 HydrophobicContact CD1-CB 4.26Å; I407-Q443 HydrophobicContact CD1-CG 3.79Å; I407-Q443 HydrophobicContact CG1-CB 4.42Å; I407-Q443 HydrophobicContact CG1-CG 4.27Å
444	F	92.8	Very high	91.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157.8	174.2	61.8	-92.2	0	0	0	112.2	F372 Y381 I402 D403 L404 I442 T446 V454 I477	F372-F444 AromaticContact CE2-CE1 3.86Å; F372-F444 HydrophobicContact CE2-CE1 3.86Å; F372-F444 HydrophobicContact CE2-CE2 4.37Å; F372-F444 AromaticContact CE2-CZ 3.42Å; F372-F444 HydrophobicContact CE2-CZ 3.42Å; F372-F444 VanDerWaalsContact CE2-CZ 3.42Å; F372-F444 HydrophobicContact CZ-CE2 4.44Å; F372-F444 AromaticContact CZ-CZ 3.77Å; F372-F444 HydrophobicContact CZ-CZ 3.77Å; Y381-F444 HydrophobicContact CD2-CE2 4.39Å; Y381-F444 HydrophobicContact CG-CE2 4.23Å; Y381-F444 PolarHBondContact N-O 3.32Å; Y381-F444 PolarHBondContact O-N 2.99Å; I402-F444 HydrophobicContact CB-CD2 4.11Å; I402-F444 HydrophobicContact CD1-CB 4.39Å; I402-F444 HydrophobicContact CD1-CD2 4.15Å; I402-F444 HydrophobicContact CD1-CG 4.17Å; I402-F444 HydrophobicContact CG2-CD2 4.15Å; I402-F444 HydrophobicContact CG2-CE2 4.43Å; D403-F444 CarbonylContact O-C 3.58Å; D403-F444 WeakPolarHBondContact O-CA 3.27Å; D403-F444 WeakPolarHBondContact O-CB 3.29Å; L404-F444 HydrophobicContact CD2-CB 3.98Å; I442-F444 HydrophobicContact CG2-CD1 4.07Å; F444-T446 HydrophobicContact CD2-CG2 4.1Å; F444-T446 HydrophobicContact CE2-CG2 3.9Å; F444-V454 HydrophobicContact CE2-CG2 4.5Å; F444-V454 HydrophobicContact CZ-CG2 4.4Å; F444-I477 HydrophobicContact CE2-CD1 3.61Å; F444-I477 HydrophobicContact CZ-CD1 3.87Å
445	R	91.2	Very high	91.8	Very high	13 Å²	13	41.1 Å²	41.1	5%	0.049	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	147	172.4	-76.1	179	-160.4	146.9	3.1	110.7	I380 I402 D403 F405 Y692 C695	I380-R445 HydrophobicContact CB-CG 4.2Å; I380-R445 HydrophobicContact CG2-CG 3.53Å; I380-R445 VanDerWaalsContact CG2-NE 3.27Å; I402-R445 VanDerWaalsContact CA-O 3.31Å; I402-R445 WeakPolarHBondContact CA-O 3.3Å; D403-R445 HydrophobicContact CB-CB 4.44Å; D403-R445 PolarHBondContact N-O 2.84Å; D403-R445 PolarHBondContact O-N 3.28Å; F405-R445 HydrophobicContact CD2-CG 4.4Å; F405-R445 HydrophobicContact CE2-CB 3.84Å; F405-R445 HydrophobicContact CE2-CG 3.41Å; F405-R445 VanDerWaalsContact CE2-CG 3.41Å; F405-R445 HydrophobicContact CZ-CB 4.4Å; F405-R445 VanDerWaalsContact CZ-CD 3.49Å; F405-R445 HydrophobicContact CZ-CG 3.89Å; F405-R445 VanDerWaalsContact CZ-NE 3.28Å; R445-Y692 PolarHBondContact NH2-O 2.86Å; R445-C695 PolarHBondContact NH1-SG 2.79Å; R445-C695 PolarHBondContact NH2-SG 3.34Å
446	T	92.3	Very high	92.2	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	164.1	176.1	59.9	0	0	0	0	109.3	Y381 I402 F444 I477 S481 R699	Y381-T446 HydrophobicContact CD2-CG2 3.6Å; Y381-T446 HydrophobicContact CE2-CG2 3.73Å; I402-T446 HydrophobicContact CG2-CG2 4.45Å; F444-T446 HydrophobicContact CD2-CG2 4.1Å; F444-T446 HydrophobicContact CE2-CG2 3.9Å; T446-I477 HydrophobicContact CG2-CD1 4.06Å; T446-I477 HydrophobicContact CG2-CG1 4.36Å; T446-I477 HydrophobicContact CG2-CG2 3.52Å; T446-S481 WeakPolarHBondContact CB-OG 3.46Å; T446-S481 PolarHBondContact OG1-OG 2.92Å; T446-R699 PolarHBondContact O-NH1 2.8Å; T446-R699 PolarHBondContact O-NH2 3.03Å
447	V	89.8	Confident	92.6	Very high	32 Å²	32	35 Å²	35	19%	0.194	17%	0.172	C	C	.	.			trans	-118.8	130.2	171.8	179.9	0	0	0	0	107.8	G449 H450	V447-G449 PolarHBondContact O-N 2.82Å; V447-H450 PolarHBondContact O-N 2.85Å; V447-H450 VanDerWaalsContact O-N 3.1Å
448	E	90.5	Very high	92.9	Very high	32 Å²	32	33.4 Å²	33.4	15%	0.15	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	140.4	177.8	-64.3	-156.9	140.8	0	0	110.9	H450 P479 L482 H483 I583	E448-H450 VanDerWaalsContact C-N 3.31Å; E448-P479 WeakPolarHBondContact CA-O 3.4Å; E448-L482 HydrophobicContact CG-CB 4.11Å; E448-L482 HydrophobicContact CG-CD1 3.74Å; E448-L482 HydrophobicContact CG-CG 3.81Å; E448-L482 WeakPolarHBondContact OE1-CB 3.35Å; E448-L482 PolarHBondContact OE1-N 3.37Å; E448-L482 VanDerWaalsContact OE1-N 3.16Å; E448-H483 IonicContact OE1-CE1 3.18Å; E448-H483 PolarHBondContact OE1-CE1 3.4Å; E448-H483 IonicContact OE1-CG 2.68Å; E448-H483 IonicContact OE1-ND1 2.69Å; E448-H483 PolarHBondContact OE1-ND1 2.98Å; E448-H483 IonicContact OE2-CE1 2.75Å; E448-H483 PolarHBondContact OE2-CE1 2.76Å; E448-H483 IonicContact OE2-ND1 2.81Å; E448-I583 HydrophobicContact CB-CD1 4.02Å
449	G	89.7	Confident	93.2	Very high	31 Å²	31	31.9 Å²	31.9	32%	0.32	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	-23.1	-171.8	0	0	0	0	0	114.4	V447 P479	V447-G449 PolarHBondContact O-N 2.82Å; G449-P479 PolarHBondContact N-O 3.38Å
450	H	91.2	Very high	93.3	Very high	91 Å²	91	29.5 Å²	29.5	42%	0.421	15%	0.145	S	C	.	.			trans	-95.5	108.3	172.8	-64.4	82.5	0	0	0	109.8	V447 E448	V447-H450 PolarHBondContact O-N 2.85Å; V447-H450 VanDerWaalsContact O-N 3.1Å; E448-H450 VanDerWaalsContact C-N 3.31Å
451	Y	94.4	Very high	93.2	Very high	75 Å²	75	32.4 Å²	32.4	29%	0.294	16%	0.158	S	C	.	.			trans	-130.1	155.3	-173.5	69.8	-84.1	0	0	0	111.4	I477 P479 V587 K590	Y451-I477 WeakPolarHBondContact CA-O 3.47Å; Y451-I477 VanDerWaalsContact CB-O 3.28Å; Y451-I477 WeakPolarHBondContact CB-O 3.42Å; Y451-P479 HydrophobicContact CD1-CB 4.2Å; Y451-P479 HydrophobicContact CD1-CG 3.89Å; Y451-P479 HydrophobicContact CD2-CG 4.04Å; Y451-P479 HydrophobicContact CG-CB 4.3Å; Y451-P479 HydrophobicContact CG-CG 3.65Å; Y451-V587 HydrophobicContact CD1-CG2 4.38Å; Y451-V587 HydrophobicContact CE1-CG2 3.85Å; Y451-K590 WeakPolarHBondContact OH-CD 3.42Å; Y451-K590 PolarHBondContact OH-NZ 2.8Å
452	G	94.1	Very high	92.7	Very high	7 Å²	7	31.9 Å²	31.9	7%	0.072	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	-160.9	-173.8	0	0	0	0	0	112	D399 I477	D399-G452 VanDerWaalsContact OD1-C 3.25Å; D399-G452 WeakPolarHBondContact OD1-CA 3.42Å; G452-I477 PolarHBondContact N-O 2.92Å; G452-I477 PolarHBondContact O-N 2.87Å
453	Y	95.4	Very high	91.7	Very high	111 Å²	111	36.8 Å²	36.8	44%	0.435	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.7	179.5	-63.5	-82.7	0	0	0	113.4	S398 D399 L475 L476	S398-Y453 WeakPolarHBondContact CA-O 3.36Å; D399-Y453 PolarHBondContact N-O 2.83Å; D399-Y453 PolarHBondContact OD1-N 3.13Å; D399-Y453 PolarHBondContact OD2-N 2.92Å; Y453-L475 CarbonylContact C-O 3.53Å; Y453-L475 VanDerWaalsContact CA-O 3.26Å; Y453-L475 WeakPolarHBondContact CA-O 3.49Å; Y453-L476 HydrophobicContact CD1-CB 4.42Å; Y453-L476 HydrophobicContact CD1-CD1 4.31Å; Y453-L476 HydrophobicContact CE1-CB 4.18Å; Y453-L476 HydrophobicContact CE1-CD1 3.88Å
454	V	96.5	Very high	90.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	113.3	163.8	-178.5	0	0	0	0	107.7	I396 Q397 S398 I402 F444 V456 L475 I477	I396-V454 HydrophobicContact CG2-CG1 3.91Å; Q397-V454 CarbonylContact O-C 3.57Å; S398-V454 WeakPolarHBondContact OG-CG2 3.39Å; I402-V454 HydrophobicContact CD1-CG1 4.24Å; I402-V454 HydrophobicContact CD1-CG2 3.92Å; I402-V454 HydrophobicContact CG2-CG2 4.33Å; F444-V454 HydrophobicContact CE2-CG2 4.5Å; F444-V454 HydrophobicContact CZ-CG2 4.4Å; V454-V456 HydrophobicContact CG1-CG2 4.11Å; V454-L475 HydrophobicContact CB-CB 4.39Å; V454-L475 PolarHBondContact N-O 2.86Å; V454-L475 PolarHBondContact O-N 3.36Å; V454-I477 HydrophobicContact CG2-CD1 4.08Å; V454-I477 HydrophobicContact CG2-CG1 3.66Å
455	S	96.9	Very high	89.1	Confident	12 Å²	12	39.6 Å²	39.6	8%	0.084	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.3	176	-60.6	0	0	0	0	110	Q397 I473	Q397-S455 PolarHBondContact N-O 2.75Å; Q397-S455 PolarHBondContact O-N 3.29Å; S455-I473 CarbonylContact C-O 3.53Å; S455-I473 WeakPolarHBondContact CA-O 3.43Å
456	V	97	Very high	87.9	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114	179.7	-174.9	0	0	0	0	109.3	L383 I385 I394 L395 I396 I442 V454 V458 C472 I473	L383-V456 HydrophobicContact CD2-CB 4.3Å; L383-V456 HydrophobicContact CD2-CG1 4.37Å; L383-V456 HydrophobicContact CD2-CG2 3.71Å; I385-V456 HydrophobicContact CD1-CG1 3.78Å; I394-V456 HydrophobicContact CG2-CG1 3.45Å; I394-V456 VanDerWaalsContact CG2-CG1 3.45Å; L395-V456 CarbonylContact O-C 3.6Å; L395-V456 WeakPolarHBondContact O-CA 3.12Å; I396-V456 HydrophobicContact CG1-CG1 4.5Å; I396-V456 HydrophobicContact CG1-CG2 4.44Å; I442-V456 HydrophobicContact CD1-CG1 4.13Å; V454-V456 HydrophobicContact CG1-CG2 4.11Å; V456-V458 HydrophobicContact CG1-CG2 4.35Å; V456-C472 WeakPolarHBondContact O-CA 3.44Å; V456-I473 HydrophobicContact CB-CB 4.35Å; V456-I473 PolarHBondContact N-O 2.81Å; V456-I473 PolarHBondContact O-N 2.88Å
457	Y	96.7	Very high	86.9	Confident	66 Å²	66	47 Å²	47	26%	0.259	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	115.1	179.3	-57.3	-98.4	0	0	0	109.2	I394 L395 Q397 C472	I394-Y457 CarbonylContact C-O 3.57Å; I394-Y457 VanDerWaalsContact CA-O 3.3Å; I394-Y457 WeakPolarHBondContact CA-O 3.29Å; L395-Y457 HydrophobicContact CB-CD2 4.23Å; L395-Y457 PolarHBondContact N-O 3.16Å; L395-Y457 PolarHBondContact O-N 3.02Å; Q397-Y457 HydrophobicContact CB-CE2 4.3Å; Q397-Y457 PolarHBondContact OE1-OH 2.85Å; Y457-C472 HydrophobicContact CD1-CB 3.77Å; Y457-C472 HydrophobicContact CE1-CB 3.76Å; Y457-C472 VanDerWaalsContact CE1-SG 3.52Å
458	V	95.4	Very high	86.4	Confident	2 Å²	2	51 Å²	51	1%	0.012	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	121.3	-179.2	-173.7	0	0	0	0	108.9	L368 I385 T387 I391 I394 V456 C470 K471 I473	L368-V458 HydrophobicContact CD2-CB 4.12Å; L368-V458 HydrophobicContact CD2-CG2 4.18Å; I385-V458 HydrophobicContact CD1-CG2 3.97Å; I385-V458 HydrophobicContact CG2-CG1 4.31Å; I385-V458 HydrophobicContact CG2-CG2 3.92Å; T387-V458 HydrophobicContact CG2-CG1 3.77Å; I391-V458 HydrophobicContact CG1-CG1 4.41Å; I391-V458 HydrophobicContact CG2-CG1 4.48Å; I394-V458 HydrophobicContact CG1-CG1 4.36Å; I394-V458 HydrophobicContact CG1-CG2 4.43Å; V456-V458 HydrophobicContact CG1-CG2 4.35Å; V458-C470 WeakPolarHBondContact O-CA 3.43Å; V458-K471 PolarHBondContact N-O 2.85Å; V458-K471 PolarHBondContact O-N 2.86Å; V458-I473 HydrophobicContact CG2-CD1 4.1Å
459	V	94.3	Very high	86.1	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.048	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	108.9	178.1	-176.1	0	0	0	0	109.2	D392 H393 V468 C470	D392-V459 WeakPolarHBondContact CB-O 3.37Å; D392-V459 PolarHBondContact N-O 2.63Å; H393-V459 PolarHBondContact N-O 2.97Å; H393-V459 WeakPolarHBondContact NE2-CG2 3.41Å; H393-V459 WeakPolarHBondContact O-CB 3.18Å; H393-V459 PolarHBondContact O-N 2.96Å; V459-V468 HydrophobicContact CG1-CG1 3.56Å; V459-V468 HydrophobicContact CG2-CG1 4.48Å; V459-C470 HydrophobicContact CG2-CB 3.73Å
460	P	91.8	Very high	86.2	Confident	13 Å²	13	52.1 Å²	52.1	8%	0.084	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	156.3	173.9	28.5	-28.5	0	0	0	111.8	L366 L389 P390 I462	L366-P460 HydrophobicContact CD1-CG 4.04Å; L366-P460 HydrophobicContact CD2-CG 3.66Å; L366-P460 HydrophobicContact CG-CG 4.49Å; L389-P460 HydrophobicContact CB-CB 3.95Å; L389-P460 HydrophobicContact CD1-CB 4.45Å; P390-P460 CarbonylContact O-C 3.59Å; P390-P460 WeakPolarHBondContact O-CA 3.31Å; P460-I462 HydrophobicContact CB-CG1 4.33Å; P460-I462 HydrophobicContact CG-CD1 4.02Å; P460-I462 HydrophobicContact CG-CG1 3.92Å; P460-I462 PolarHBondContact O-N 2.85Å
461	K	88.5	Confident	86.3	Confident	66 Å²	66	51.5 Å²	51.5	29%	0.287	27%	0.273	S	S	.	.			trans	-72.7	92.9	170	-67.2	-174.7	-171.8	176.8	0	109.2	P390 I391 D392 N436	P390-K461 HydrophobicContact CB-CD 4.25Å; P390-K461 PolarHBondContact O-N 2.81Å; I391-K461 WeakPolarHBondContact O-CE 3.31Å; D392-K461 HydrophobicContact CB-CG 3.62Å; N436-K461 PolarHBondContact OD1-NZ 2.85Å
462	I	82.1	Confident	86.3	Confident	49 Å²	49	50.2 Å²	50.2	25%	0.251	28%	0.275	S	S	.	.			trans	-105.5	134.1	172.6	-42	179.3	0	0	0	108.6	I364 L366 L389 P460 L464 A469	I364-I462 HydrophobicContact CG2-CD1 3.98Å; L366-I462 HydrophobicContact CD2-CD1 3.85Å; L389-I462 HydrophobicContact CD1-CG1 4.08Å; P460-I462 HydrophobicContact CB-CG1 4.33Å; P460-I462 HydrophobicContact CG-CD1 4.02Å; P460-I462 HydrophobicContact CG-CG1 3.92Å; P460-I462 PolarHBondContact O-N 2.85Å; I462-L464 HydrophobicContact CB-CG 4.46Å; I462-L464 HydrophobicContact CG2-CD1 3.9Å; I462-L464 HydrophobicContact CG2-CG 3.76Å; I462-L464 PolarHBondContact O-N 3.06Å; I462-A469 HydrophobicContact CD1-CB 4.07Å
463	N	71.6	Confident	86.4	Confident	107 Å²	107	50.1 Å²	50.1	57%	0.572	27%	0.272	S	S	*	.			trans	-77.9	57	178.7	-76.6	-33.6	0	0	0	112.4	L346 K350	L346-N463 HydrophobicContact CD2-CB 4.32Å; K350-N463 WeakPolarHBondContact CE-O 3.49Å
464	L	69.2	Low	86.4	Confident	41 Å²	41	51.8 Å²	51.8	22%	0.215	28%	0.282	C	S	.	.			trans	-106.7	135.1	173.3	-64.3	174.9	0	0	0	109.7	I364 I462 M467	I364-L464 HydrophobicContact CD1-CD1 3.47Å; I364-L464 VanDerWaalsContact CD1-CD1 3.47Å; I462-L464 HydrophobicContact CB-CG 4.46Å; I462-L464 HydrophobicContact CG2-CD1 3.9Å; I462-L464 HydrophobicContact CG2-CG 3.76Å; I462-L464 PolarHBondContact O-N 3.06Å; L464-M467 HydrophobicContact CD1-CB 4.49Å
465	S	62.4	Low	86.4	Confident	72 Å²	72	52.1 Å²	52.1	50%	0.503	28%	0.283	S	S	.	.	S	Bend	trans	-73.5	-29.8	-174	35.4	0	0	0	0	113.4	D354	D354-S465 PolarHBondContact OD1-OG 3.47Å
466	T	65.2	Low	86.3	Confident	89 Å²	89	53.4 Å²	53.4	55%	0.546	29%	0.289	S	S	.	.	S	Bend	trans	-129	-13.9	-164.6	57	0	0	0	0	114.4	E357	E357-T466 PolarHBondContact OE1-OG1 3.16Å; E357-T466 PolarHBondContact OE2-OG1 2.95Å
467	M	71.5	Confident	86.2	Confident	80 Å²	80	53.4 Å²	53.4	39%	0.394	29%	0.289	S	S	.	.			trans	-122.7	133.6	-171.8	-60.1	-173.9	78.6	0	0	111.6	H362 L464	H362-M467 HydrophobicContact CB-SD 4.49Å; L464-M467 HydrophobicContact CD1-CB 4.49Å
468	V	79.4	Confident	86.2	Confident	118 Å²	118	51.7 Å²	51.7	72%	0.715	28%	0.284	S	S	*	.			trans	-107.5	118.4	168.4	-178.4	0	0	0	0	107.8	V459	V459-V468 HydrophobicContact CG1-CG1 3.56Å; V459-V468 HydrophobicContact CG2-CG1 4.48Å
469	A	85.6	Confident	86.3	Confident	19 Å²	19	51.8 Å²	51.8	16%	0.157	28%	0.284	C	S	.	.			trans	-98.6	140.4	172.5	0	0	0	0	0	109.5	I364 L366 I462	I364-A469 HydrophobicContact CB-CB 4.37Å; I364-A469 HydrophobicContact CD1-CB 3.87Å; I364-A469 HydrophobicContact CG2-CB 4.32Å; L366-A469 HydrophobicContact CD1-CB 3.79Å; I462-A469 HydrophobicContact CD1-CB 4.07Å
470	C	91.1	Very high	86.4	Confident	67 Å²	67	51.4 Å²	51.4	45%	0.453	28%	0.282	S	S	.	.			trans	-135.9	156.1	175.2	75.7	0	0	0	0	110.3	V458 V459	V458-C470 WeakPolarHBondContact O-CA 3.43Å; V459-C470 HydrophobicContact CG2-CB 3.73Å
471	K	92.9	Very high	86.6	Confident	77 Å²	77	50.8 Å²	50.8	34%	0.335	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.8	169.2	-174.5	160.1	171.8	-170.8	0	109.2	L366 L368 V458	L366-K471 HydrophobicContact CB-CB 4.41Å; L366-K471 HydrophobicContact CB-CD 4.37Å; L366-K471 WeakPolarHBondContact O-CD 3.45Å; L366-K471 PolarHBondContact O-NZ 2.81Å; L368-K471 HydrophobicContact CD2-CB 3.6Å; L368-K471 HydrophobicContact CD2-CD 3.51Å; L368-K471 HydrophobicContact CD2-CG 3.58Å; L368-K471 HydrophobicContact CG-CD 3.69Å; L368-K471 HydrophobicContact CG-CG 4.25Å; V458-K471 PolarHBondContact N-O 2.85Å; V458-K471 PolarHBondContact O-N 2.86Å
472	C	95	Very high	86.9	Confident	49 Å²	49	48 Å²	48	33%	0.331	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.8	-178	-178.3	0	0	0	0	109.9	V456 Y457	V456-C472 WeakPolarHBondContact O-CA 3.44Å; Y457-C472 HydrophobicContact CD1-CB 3.77Å; Y457-C472 HydrophobicContact CE1-CB 3.76Å; Y457-C472 VanDerWaalsContact CE1-SG 3.52Å
473	I	96	Very high	87.5	Confident	5 Å²	5	45.6 Å²	45.6	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123	170.7	-55.8	165.5	0	0	0	107	L368 Y370 I385 S455 V456 V458 L475	L368-I473 HydrophobicContact CD1-CD1 3.74Å; L368-I473 HydrophobicContact CD1-CG1 4.06Å; L368-I473 HydrophobicContact CD2-CD1 4.41Å; Y370-I473 HydrophobicContact CD1-CD1 3.87Å; Y370-I473 HydrophobicContact CD1-CG1 3.94Å; Y370-I473 HydrophobicContact CD1-CG2 3.97Å; Y370-I473 HydrophobicContact CD2-CG2 3.83Å; Y370-I473 HydrophobicContact CE1-CG1 4.22Å; Y370-I473 HydrophobicContact CE1-CG2 3.77Å; Y370-I473 HydrophobicContact CE2-CG2 3.63Å; Y370-I473 HydrophobicContact CG-CD1 3.88Å; Y370-I473 HydrophobicContact CG-CG1 4.35Å; Y370-I473 HydrophobicContact CG-CG2 4Å; I385-I473 HydrophobicContact CD1-CD1 4.06Å; I385-I473 HydrophobicContact CG1-CD1 4.13Å; S455-I473 CarbonylContact C-O 3.53Å; S455-I473 WeakPolarHBondContact CA-O 3.43Å; V456-I473 HydrophobicContact CB-CB 4.35Å; V456-I473 PolarHBondContact N-O 2.81Å; V456-I473 PolarHBondContact O-N 2.88Å; V458-I473 HydrophobicContact CG2-CD1 4.1Å; I473-L475 HydrophobicContact CG2-CD2 3.75Å; I473-L475 HydrophobicContact CG2-CG 4.01Å
474	K	95.5	Very high	88.5	Confident	145 Å²	145	41 Å²	41	63%	0.63	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-108.2	115.4	176.3	-66.9	-172.4	176.7	-175.8	0	109.9
475	L	95.5	Very high	89.6	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.7	-178.6	-56	172.8	0	0	0	109.6	Y370 F372 L383 Y453 V454 I473	Y370-L475 HydrophobicContact CD2-CD2 4.31Å; Y370-L475 HydrophobicContact CE2-CD2 3.77Å; F372-L475 HydrophobicContact CB-CD2 3.93Å; F372-L475 HydrophobicContact CD1-CD2 4.04Å; F372-L475 HydrophobicContact CD2-CD1 3.78Å; F372-L475 HydrophobicContact CD2-CD2 4.49Å; F372-L475 HydrophobicContact CE1-CB 4.38Å; F372-L475 HydrophobicContact CE2-CD1 4.01Å; F372-L475 HydrophobicContact CG-CD1 4.05Å; F372-L475 HydrophobicContact CG-CD2 3.9Å; F372-L475 HydrophobicContact CG-CG 4.47Å; F372-L475 HydrophobicContact CZ-CD1 4.47Å; L383-L475 HydrophobicContact CD1-CD1 3.9Å; L383-L475 HydrophobicContact CD2-CD1 3.68Å; L383-L475 HydrophobicContact CG-CD1 4.26Å; Y453-L475 CarbonylContact C-O 3.53Å; Y453-L475 VanDerWaalsContact CA-O 3.26Å; Y453-L475 WeakPolarHBondContact CA-O 3.49Å; V454-L475 HydrophobicContact CB-CB 4.39Å; V454-L475 PolarHBondContact N-O 2.86Å; V454-L475 PolarHBondContact O-N 3.36Å; I473-L475 HydrophobicContact CG2-CD2 3.75Å; I473-L475 HydrophobicContact CG2-CG 4.01Å
476	L	95.1	Very high	91	Very high	40 Å²	40	39.8 Å²	39.8	21%	0.209	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.1	174.4	177.6	64.8	0	0	0	109.5	Y453 M518	Y453-L476 HydrophobicContact CD1-CB 4.42Å; Y453-L476 HydrophobicContact CD1-CD1 4.31Å; Y453-L476 HydrophobicContact CE1-CB 4.18Å; Y453-L476 HydrophobicContact CE1-CD1 3.88Å; L476-M518 HydrophobicContact CD1-CE 4.3Å; L476-M518 HydrophobicContact CD2-CE 3.96Å; L476-M518 HydrophobicContact CD2-SD 4Å
477	I	96.5	Very high	92.1	Very high	1 Å²	1	41 Å²	41	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	115.2	167	-55.8	-51.7	0	0	0	107.9	F372 F444 T446 Y451 G452 V454	F372-I477 HydrophobicContact CE1-CD1 4.48Å; F372-I477 HydrophobicContact CZ-CD1 3.84Å; F444-I477 HydrophobicContact CE2-CD1 3.61Å; F444-I477 HydrophobicContact CZ-CD1 3.87Å; T446-I477 HydrophobicContact CG2-CD1 4.06Å; T446-I477 HydrophobicContact CG2-CG1 4.36Å; T446-I477 HydrophobicContact CG2-CG2 3.52Å; Y451-I477 WeakPolarHBondContact CA-O 3.47Å; Y451-I477 VanDerWaalsContact CB-O 3.28Å; Y451-I477 WeakPolarHBondContact CB-O 3.42Å; G452-I477 PolarHBondContact N-O 2.92Å; G452-I477 PolarHBondContact O-N 2.87Å; V454-I477 HydrophobicContact CG2-CD1 4.08Å; V454-I477 HydrophobicContact CG2-CG1 3.66Å
478	H	96.7	Very high	92.8	Very high	30 Å²	30	41.6 Å²	41.6	14%	0.139	22%	0.22	C	C	.	.			trans	-73.7	148.1	-177.9	-63.4	-83.1	0	0	0	111.9	L480 S481 S517 M518	H478-L480 PolarHBondContact O-N 2.94Å; H478-S481 WeakPolarHBondContact O-CB 3.47Å; H478-S481 PolarHBondContact O-N 3.32Å; H478-S481 VanDerWaalsContact O-N 3.07Å; H478-S481 PolarHBondContact O-OG 3.07Å; H478-S517 PolarHBondContact CE1-O 3.21Å; H478-S517 PolarHBondContact ND1-O 2.79Å; H478-M518 PolarHBondContact ND1-O 3.12Å
479	P	97	Very high	93.1	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.019	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-43.5	170.7	-24.6	28.5	0	0	0	113.8	E448 G449 Y451 M518 I583 V587	E448-P479 WeakPolarHBondContact CA-O 3.4Å; G449-P479 PolarHBondContact N-O 3.38Å; Y451-P479 HydrophobicContact CD1-CB 4.2Å; Y451-P479 HydrophobicContact CD1-CG 3.89Å; Y451-P479 HydrophobicContact CD2-CG 4.04Å; Y451-P479 HydrophobicContact CG-CB 4.3Å; Y451-P479 HydrophobicContact CG-CG 3.65Å; P479-M518 WeakPolarHBondContact CD-O 3.2Å; P479-I583 HydrophobicContact CB-CG2 3.79Å; P479-V587 HydrophobicContact CB-CG2 3.91Å; P479-V587 HydrophobicContact CG-CB 4.5Å; P479-V587 HydrophobicContact CG-CG1 4.04Å; P479-V587 HydrophobicContact CG-CG2 3.86Å
480	L	96.6	Very high	92.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.2	53.3	175.3	-64.6	-177.6	0	0	0	110.4	H478 L482 H483 C519 L520 P521 L562 T580 I583 L584	H478-L480 PolarHBondContact O-N 2.94Å; L480-L482 PolarHBondContact O-N 2.92Å; L480-L482 VanDerWaalsContact O-N 3.12Å; L480-H483 HydrophobicContact CB-CB 4.47Å; L480-H483 PolarHBondContact O-N 3.47Å; L480-C519 WeakPolarHBondContact CB-O 3.22Å; L480-C519 PolarHBondContact N-O 3.45Å; L480-L520 HydrophobicContact CB-CD2 3.69Å; L480-L520 HydrophobicContact CB-CG 4.44Å; L480-L520 HydrophobicContact CD1-CD2 3.73Å; L480-L520 HydrophobicContact CD1-CG 4.31Å; L480-L520 HydrophobicContact CG-CD2 4.37Å; L480-P521 WeakPolarHBondContact O-CD 3.13Å; L480-L562 HydrophobicContact CD1-CD2 3.9Å; L480-T580 HydrophobicContact CD1-CG2 3.73Å; L480-T580 HydrophobicContact CD2-CG2 4.1Å; L480-I583 HydrophobicContact CD2-CB 4.1Å; L480-I583 HydrophobicContact CD2-CD1 3.89Å; L480-I583 HydrophobicContact CD2-CG2 3.86Å; L480-I583 HydrophobicContact CG-CG2 4.28Å; L480-L584 HydrophobicContact CD1-CD1 4.09Å; L480-L584 HydrophobicContact CD1-CD2 3.75Å; L480-L584 HydrophobicContact CD1-CG 3.78Å
481	S	95.1	Very high	91.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.9	-175.1	51.2	0	0	0	0	115	L374 Y381 T446 H478	L374-S481 WeakPolarHBondContact CD2-O 3.26Å; Y381-S481 WeakPolarHBondContact OH-CA 3.46Å; Y381-S481 VanDerWaalsContact OH-CB 3.28Å; Y381-S481 WeakPolarHBondContact OH-CB 3.39Å; Y381-S481 PolarHBondContact OH-O 2.77Å; T446-S481 WeakPolarHBondContact CB-OG 3.46Å; T446-S481 PolarHBondContact OG1-OG 2.92Å; H478-S481 WeakPolarHBondContact O-CB 3.47Å; H478-S481 PolarHBondContact O-N 3.32Å; H478-S481 VanDerWaalsContact O-N 3.07Å; H478-S481 PolarHBondContact O-OG 3.07Å
482	L	94.5	Very high	90.3	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	7.3	178.9	-52	173.4	0	0	0	113.6	E448 L480 I556 Y557	E448-L482 HydrophobicContact CG-CB 4.11Å; E448-L482 HydrophobicContact CG-CD1 3.74Å; E448-L482 HydrophobicContact CG-CG 3.81Å; E448-L482 WeakPolarHBondContact OE1-CB 3.35Å; E448-L482 PolarHBondContact OE1-N 3.37Å; E448-L482 VanDerWaalsContact OE1-N 3.16Å; L480-L482 PolarHBondContact O-N 2.92Å; L480-L482 VanDerWaalsContact O-N 3.12Å; L482-I556 PolarHBondContact O-N 3.26Å; L482-Y557 HydrophobicContact CD1-CG 4.41Å
483	H	94.9	Very high	88.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	143	172.6	-70.2	63.8	0	0	0	109.6	E448 L480 L520 P521 Y553 K554	E448-H483 IonicContact OE1-CE1 3.18Å; E448-H483 PolarHBondContact OE1-CE1 3.4Å; E448-H483 IonicContact OE1-CG 2.68Å; E448-H483 IonicContact OE1-ND1 2.69Å; E448-H483 PolarHBondContact OE1-ND1 2.98Å; E448-H483 IonicContact OE2-CE1 2.75Å; E448-H483 PolarHBondContact OE2-CE1 2.76Å; E448-H483 IonicContact OE2-ND1 2.81Å; L480-H483 HydrophobicContact CB-CB 4.47Å; L480-H483 PolarHBondContact O-N 3.47Å; H483-L520 HydrophobicContact CB-CD2 3.78Å; H483-P521 WeakPolarHBondContact O-CG 3.18Å; H483-Y553 HydrophobicContact CB-CD1 4.33Å; H483-K554 CarbonylContact C-O 3.46Å; H483-K554 WeakPolarHBondContact CA-O 3.37Å
484	C	92.9	Very high	87	Confident	11 Å²	11	53.2 Å²	53.2	7%	0.074	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	149.9	168.5	60.5	0	0	0	0	110	Y553 K554 I556	C484-Y553 CarbonylContact O-C 3.45Å; C484-Y553 VanDerWaalsContact O-CA 3.22Å; C484-Y553 WeakPolarHBondContact O-CA 3.36Å; C484-K554 PolarHBondContact N-O 3.12Å; C484-K554 PolarHBondContact O-N 3.44Å; C484-I556 HydrophobicContact CB-CD1 3.89Å; C484-I556 HydrophobicContact CB-CG1 4.05Å; C484-I556 VanDerWaalsContact SG-CG1 3.52Å
485	L	93.3	Very high	86.1	Confident	55 Å²	55	55.3 Å²	55.3	29%	0.288	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.8	177	-171.8	74.8	0	0	0	109.3	E522 P524 L551 F552 Y553	L485-E522 HydrophobicContact CB-CB 4.01Å; L485-E522 PolarHBondContact N-OE2 3.14Å; L485-P524 HydrophobicContact CD2-CG 4.44Å; L485-L551 HydrophobicContact CD1-CB 4.31Å; L485-L551 HydrophobicContact CD1-CD2 4.13Å; L485-F552 WeakPolarHBondContact CD1-O 3.38Å; L485-Y553 HydrophobicContact CB-CD1 4.33Å; L485-Y553 HydrophobicContact CB-CE1 3.95Å; L485-Y553 HydrophobicContact CD1-CD1 4.36Å; L485-Y553 HydrophobicContact CD1-CE1 3.76Å; L485-Y553 HydrophobicContact CD1-CE2 3.95Å; L485-Y553 HydrophobicContact CG-CE1 4.49Å
486	T	91.4	Very high	85.4	Confident	32 Å²	32	55.9 Å²	55.9	20%	0.196	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158	174.8	63.8	0	0	0	0	110.9	H488 F552 K554	T486-H488 PolarHBondContact OG1-O 3.47Å; T486-H488 VanDerWaalsContact OG1-O 3.1Å; T486-F552 PolarHBondContact N-O 2.82Å; T486-K554 HydrophobicContact CG2-CB 3.65Å
487	H	87.7	Confident	84.9	Confident	115 Å²	115	56.4 Å²	56.4	53%	0.532	28%	0.284	S	S	.	.	S	Bend	trans	-74.5	-35.5	-179.8	-64.7	-67.6	0	0	0	112.9	E162 F552	E162-H487 VanDerWaalsContact CG-CD2 3.44Å; E162-H487 WeakPolarHBondContact CG-CD2 3.46Å; E162-H487 IonicContact OE1-CD2 2.85Å; E162-H487 PolarHBondContact OE1-CD2 3.05Å; E162-H487 VanDerWaalsContact OE1-CD2 3.29Å; E162-H487 IonicContact OE1-CG 2.74Å; H487-F552 VanDerWaalsContact O-CD2 3.24Å; H487-F552 WeakPolarHBondContact O-CD2 3.48Å; H487-F552 WeakPolarHBondContact O-CE2 3.49Å
488	H	86.9	Confident	84.7	Confident	92 Å²	92	59.4 Å²	59.4	43%	0.426	30%	0.296	S	S	.	.	S	Bend	trans	-147.1	169.6	-178.2	54.3	-87.7	0	0	0	111	E162 T486	E162-H488 IonicContact OE1-CE1 2.73Å; E162-H488 PolarHBondContact OE1-CE1 3.36Å; E162-H488 VanDerWaalsContact OE1-CE1 3.29Å; E162-H488 IonicContact OE1-ND1 3.74Å; E162-H488 IonicContact OE2-CE1 3.79Å; E162-H488 PolarHBondContact OE2-CE1 3.24Å; E162-H488 IonicContact OE2-ND1 3.48Å; T486-H488 PolarHBondContact OG1-O 3.47Å; T486-H488 VanDerWaalsContact OG1-O 3.1Å
489	I	85.2	Confident	84.6	Confident	33 Å²	33	58 Å²	58	17%	0.169	29%	0.289	C	S	.	.			trans	-81	125.8	170.2	-72.6	168.5	0	0	0	107.1	D491 W498 F552 K563	I489-D491 PolarHBondContact O-N 3.23Å; I489-W498 HydrophobicContact CD1-CH2 3.82Å; I489-W498 HydrophobicContact CD1-CZ2 4.09Å; I489-W498 HydrophobicContact CG1-CH2 4.36Å; I489-W498 HydrophobicContact CG2-CH2 4.15Å; I489-W498 HydrophobicContact CG2-CZ2 3.98Å; I489-F552 HydrophobicContact CD1-CD1 3.7Å; I489-F552 HydrophobicContact CD1-CE1 3.64Å; I489-F552 HydrophobicContact CG1-CD1 3.55Å; I489-F552 HydrophobicContact CG1-CE1 3.83Å; I489-F552 HydrophobicContact CG1-CG 4.34Å; I489-K563 HydrophobicContact CD1-CB 3.95Å; I489-K563 HydrophobicContact CD1-CD 3.79Å; I489-K563 HydrophobicContact CD1-CG 4.02Å
490	E	78.2	Confident	84.5	Confident	76 Å²	76	58 Å²	58	36%	0.355	29%	0.289	S	S	.	.			trans	-73.2	117.5	172.6	-57.5	167.2	-179.3	0	0	109.4	E492 R496 K554 Q561	E490-E492 PolarHBondContact O-N 3.13Å; E490-R496 PolarHBondContact O-NE 3.23Å; E490-R496 VanDerWaalsContact O-NE 3.17Å; E490-R496 PolarHBondContact O-NH2 3.35Å; E490-K554 IonicContact OE1-NZ 3.75Å; E490-K554 PolarHBondContact OE1-NZ 3.05Å; E490-K554 IonicContact OE2-NZ 2.73Å; E490-K554 PolarHBondContact OE2-NZ 2.91Å; E490-Q561 PolarHBondContact O-NE2 2.7Å
491	D	68.2	Low	84.5	Confident	158 Å²	158	58 Å²	58	85%	0.845	29%	0.289	S	S	*	.			trans	-71.1	107.7	170.8	-70.8	-30.9	0	0	0	109	I489	I489-D491 PolarHBondContact O-N 3.23Å
492	E	64.4	Low	84.6	Confident	79 Å²	79	60.8 Å²	60.8	37%	0.369	30%	0.302	S	S	.	.			trans	-80.4	158.7	170.9	-76.9	-97.7	163	0	0	110.1	E490 L494 R496	E490-E492 PolarHBondContact O-N 3.13Å; E492-L494 PolarHBondContact O-N 2.92Å; E492-R496 IonicContact OE1-NH2 3.74Å
493	P	58.9	Low	84.6	Confident	129 Å²	129	60.4 Å²	60.4	84%	0.838	30%	0.3	S	S	*	.	S	Bend	trans	-59.1	-18.4	169.8	25.6	-34.7	0	0	0	113.1
494	L	61.9	Low	84.6	Confident	104 Å²	104	63.2 Å²	63.2	55%	0.545	32%	0.317	S	S	.	.	S	Bend	trans	-96.3	135.5	179.3	-67.2	165.4	0	0	0	111.3	E492 R496 Y612	E492-L494 PolarHBondContact O-N 2.92Å; L494-R496 PolarHBondContact O-N 3.04Å; L494-Y612 HydrophobicContact CB-CE2 4.03Å; L494-Y612 HydrophobicContact CD1-CE2 4.47Å
495	K	76.6	Confident	84.6	Confident	189 Å²	189	64 Å²	64	82%	0.822	33%	0.328	S	S	*	.			trans	-64.1	103.8	174.4	-173.7	-179.8	-179.8	-176.5	0	109.6
496	R	82.1	Confident	84.6	Confident	20 Å²	20	67 Å²	67	8%	0.075	34%	0.344	C	S	.	.			trans	-59.9	135.7	177.4	-64.5	-172	-177.2	-86.5	-3.5	111	E490 E492 L494 W498 Q561 D576 Y612	E490-R496 PolarHBondContact O-NE 3.23Å; E490-R496 VanDerWaalsContact O-NE 3.17Å; E490-R496 PolarHBondContact O-NH2 3.35Å; E492-R496 IonicContact OE1-NH2 3.74Å; L494-R496 PolarHBondContact O-N 3.04Å; R496-W498 HydrophobicContact CB-CZ2 4.38Å; R496-Q561 VanDerWaalsContact CZ-NE2 3.28Å; R496-D576 IonicContact CZ-OD2 3.43Å; R496-D576 IonicContact NH1-OD2 3.84Å; R496-D576 PolarHBondContact NH1-OD2 2.93Å; R496-Y612 PolarHBondContact NH1-OH 2.89Å
497	H	85.2	Confident	84.7	Confident	51 Å²	51	65.6 Å²	65.6	24%	0.236	34%	0.335	C	S	.	.			trans	-90	115	173.1	-66.7	166.1	0	0	0	109.3	D576 Q606 D608	H497-D576 VanDerWaalsContact O-CA 3.26Å; H497-D576 WeakPolarHBondContact O-CA 3.45Å; H497-Q606 HydrophobicContact CB-CB 4.42Å; H497-Q606 VanDerWaalsContact CB-OE1 3.3Å; H497-D608 VanDerWaalsContact ND1-C 3.29Å; H497-D608 PolarHBondContact ND1-O 3.25Å; H497-D608 VanDerWaalsContact ND1-O 3.15Å
498	W	90.6	Very high	84.9	Confident	64 Å²	64	62.1 Å²	62.1	24%	0.242	32%	0.324	C	S	.	.			trans	-96.3	117.3	-175.4	-68.3	103.1	0	0	0	110.9	I489 R496 Q561 K563 Q574 Q606	I489-W498 HydrophobicContact CD1-CH2 3.82Å; I489-W498 HydrophobicContact CD1-CZ2 4.09Å; I489-W498 HydrophobicContact CG1-CH2 4.36Å; I489-W498 HydrophobicContact CG2-CH2 4.15Å; I489-W498 HydrophobicContact CG2-CZ2 3.98Å; R496-W498 HydrophobicContact CB-CZ2 4.38Å; W498-Q561 HydrophobicContact CH2-CB 4.21Å; W498-K563 HydrophobicContact CZ3-CB 4.47Å; W498-Q574 HydrophobicContact CE3-CB 3.86Å; W498-Q574 HydrophobicContact CZ3-CB 4.48Å; W498-Q606 VanDerWaalsContact N-OE1 3.13Å
499	N	94.6	Very high	85.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	130.3	166.3	-56.2	-66.3	0	0	0	108.8	Q574 S575 L578 I581 D604 I605 Q606 S609	N499-Q574 CarbonylContact O-C 3.56Å; N499-Q574 VanDerWaalsContact O-CA 3.22Å; N499-Q574 WeakPolarHBondContact O-CA 3.41Å; N499-S575 WeakPolarHBondContact CB-O 3.29Å; N499-S575 PolarHBondContact N-O 3.23Å; N499-S575 PolarHBondContact ND2-O 3.04Å; N499-S575 PolarHBondContact O-N 3.31Å; N499-L578 HydrophobicContact CB-CD2 4.25Å; N499-L578 WeakPolarHBondContact ND2-CD2 3.28Å; N499-L578 VanDerWaalsContact OD1-CD2 3.25Å; N499-L578 WeakPolarHBondContact OD1-CD2 3.41Å; N499-I581 HydrophobicContact CB-CG1 3.93Å; N499-D604 CarbonylContact C-O 3.39Å; N499-D604 WeakPolarHBondContact CA-O 3.47Å; N499-I605 HydrophobicContact CB-CD1 4.05Å; N499-Q606 PolarHBondContact OD1-N 3.39Å; N499-Q606 PolarHBondContact OD1-O 3.07Å; N499-S609 VanDerWaalsContact ND2-CB 3.29Å; N499-S609 WeakPolarHBondContact ND2-CB 3.4Å; N499-S609 PolarHBondContact ND2-OG 2.93Å; N499-S609 PolarHBondContact OD1-OG 3.17Å
500	S	95.7	Very high	85.6	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.6	-169.4	172.3	0	0	0	0	111.3	N572 L603 D604	S500-N572 PolarHBondContact OG-OD1 3.2Å; S500-L603 WeakPolarHBondContact O-CA 3.35Å; S500-D604 PolarHBondContact N-O 2.85Å; S500-D604 PolarHBondContact O-N 2.76Å
501	L	96.5	Very high	86.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	106.9	170.6	170.4	65	0	0	0	109.3	L503 L573 I581 L584 K585 L588 I601 L603	L501-L503 HydrophobicContact CD1-CD2 3.91Å; L501-L503 HydrophobicContact CD1-CG 4.48Å; L501-L503 HydrophobicContact CG-CD2 4.25Å; L501-L503 HydrophobicContact CG-CG 4.31Å; L501-L573 HydrophobicContact CB-CB 4.34Å; L501-L573 HydrophobicContact CD2-CD1 4.21Å; L501-L573 PolarHBondContact N-O 2.99Å; L501-L573 PolarHBondContact O-N 2.9Å; L501-I581 HydrophobicContact CB-CD1 4.27Å; L501-I581 HydrophobicContact CB-CG2 3.86Å; L501-L584 HydrophobicContact CD2-CB 3.91Å; L501-K585 HydrophobicContact CD1-CB 4.36Å; L501-K585 HydrophobicContact CD1-CG 4.5Å; L501-K585 HydrophobicContact CD2-CB 4.13Å; L501-L588 HydrophobicContact CD2-CD1 4.49Å; L501-I601 HydrophobicContact CD1-CG2 3.54Å; L501-L603 HydrophobicContact CB-CD2 4.22Å; L501-L603 HydrophobicContact CD1-CD2 3.59Å; L501-L603 HydrophobicContact CD1-CG 4.41Å
502	Q	96.8	Very high	87.7	Confident	58 Å²	58	53 Å²	53	27%	0.271	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.8	177.1	-66.8	175.8	-1.1	0	0	109.9	A571 N572 I601 N602	Q502-A571 CarbonylContact C-O 3.51Å; Q502-A571 WeakPolarHBondContact CA-O 3.46Å; Q502-N572 HydrophobicContact CG-CB 4.49Å; Q502-I601 WeakPolarHBondContact O-CA 3.46Å; Q502-N602 HydrophobicContact CB-CB 4.12Å; Q502-N602 PolarHBondContact N-O 3.02Å; Q502-N602 PolarHBondContact O-N 3.28Å; Q502-N602 PolarHBondContact OE1-ND2 2.89Å; Q502-N602 VanDerWaalsContact OE1-ND2 3.17Å
503	L	95.6	Very high	89.1	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.1	177.8	-57	175.9	0	0	0	108.8	L501 M512 Y570 A571 L588 I601	L501-L503 HydrophobicContact CD1-CD2 3.91Å; L501-L503 HydrophobicContact CD1-CG 4.48Å; L501-L503 HydrophobicContact CG-CD2 4.25Å; L501-L503 HydrophobicContact CG-CG 4.31Å; L503-M512 HydrophobicContact CD1-CE 4.36Å; L503-Y570 CarbonylContact O-C 3.56Å; L503-Y570 WeakPolarHBondContact O-CA 3.43Å; L503-A571 HydrophobicContact CB-CB 4.32Å; L503-A571 PolarHBondContact N-O 2.92Å; L503-A571 PolarHBondContact O-N 3.22Å; L503-L588 HydrophobicContact CD1-CB 4.27Å; L503-L588 HydrophobicContact CD1-CD1 3.62Å; L503-I601 HydrophobicContact CD2-CB 4.28Å; L503-I601 HydrophobicContact CD2-CD1 4.43Å; L503-I601 HydrophobicContact CD2-CG1 3.76Å; L503-I601 HydrophobicContact CD2-CG2 4.11Å
504	T	95	Very high	90.8	Very high	58 Å²	58	46.8 Å²	46.8	36%	0.356	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.9	171.8	45.6	0	0	0	0	109.5	G569 Y570 L599 T600	T504-G569 WeakPolarHBondContact CA-O 3.32Å; T504-Y570 HydrophobicContact CG2-CD2 3.8Å; T504-Y570 HydrophobicContact CG2-CE2 4.46Å; T504-L599 WeakPolarHBondContact O-CA 3.41Å; T504-T600 PolarHBondContact N-O 3.18Å; T504-T600 PolarHBondContact O-N 3.01Å; T504-T600 WeakPolarHBondContact OG1-CB 3.27Å; T504-T600 PolarHBondContact OG1-O 3.21Å
505	G	92.1	Very high	92.4	Very high	29 Å²	29	42 Å²	42	30%	0.299	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	172.9	-172.6	-177.1	0	0	0	0	0	113.3	F507 G569 Q598	G505-F507 VanDerWaalsContact C-N 3.3Å; G505-F507 PolarHBondContact O-N 3.41Å; G505-G569 PolarHBondContact N-O 3.37Å; G505-G569 VanDerWaalsContact N-O 3.12Å; G505-G569 WeakPolarHBondContact O-CA 3.38Å; G505-Q598 WeakPolarHBondContact CA-O 3.42Å
506	N	92.5	Very high	93.3	Very high	116 Å²	116	33 Å²	33	62%	0.62	18%	0.18	S	C	*	.	S	Bend	trans	-92.6	38.5	-177.5	65.4	-34.1	0	0	0	113.4	I597 Q598	N506-I597 WeakPolarHBondContact OD1-CG2 3.31Å; N506-Q598 PolarHBondContact OD1-N 3.29Å
507	F	93.8	Very high	93.9	Very high	4 Å²	4	34.2 Å²	34.2	2%	0.018	19%	0.191	C	C	.	.			trans	-97	147.1	176.1	57.3	-93.3	0	0	0	112	G505 E511 M512 W515 G569 A571 I597 L599	G505-F507 VanDerWaalsContact C-N 3.3Å; G505-F507 PolarHBondContact O-N 3.41Å; F507-E511 HydrophobicContact CB-CB 4.38Å; F507-M512 HydrophobicContact CD2-CB 3.77Å; F507-M512 HydrophobicContact CD2-CG 4.47Å; F507-M512 HydrophobicContact CE2-CB 3.81Å; F507-M512 HydrophobicContact CE2-CG 4.05Å; F507-M512 HydrophobicContact CE2-SD 4.11Å; F507-M512 HydrophobicContact CZ-SD 4.42Å; F507-W515 HydrophobicContact CB-CH2 4.2Å; F507-W515 HydrophobicContact CB-CZ3 4.27Å; F507-W515 HydrophobicContact CD1-CZ3 4.24Å; F507-W515 HydrophobicContact CG-CZ3 4.19Å; F507-G569 VanDerWaalsContact CZ-C 3.45Å; F507-G569 WeakPolarHBondContact O-CA 3.41Å; F507-G569 PolarHBondContact O-N 2.82Å; F507-A571 HydrophobicContact CZ-CB 4.4Å; F507-I597 HydrophobicContact CB-CD1 4.35Å; F507-I597 HydrophobicContact CB-CG2 4.24Å; F507-L599 HydrophobicContact CD1-CD2 3.46Å; F507-L599 VanDerWaalsContact CD1-CD2 3.46Å; F507-L599 HydrophobicContact CE1-CD2 3.57Å
508	S	93.1	Very high	94.3	Very high	41 Å²	41	35.3 Å²	35.3	29%	0.287	20%	0.197	S	C	.	.			trans	-77.2	161.5	171.5	63.4	0	0	0	0	112.1	T510 E511 M512	S508-T510 VanDerWaalsContact C-N 3.29Å; S508-T510 PolarHBondContact O-N 2.83Å; S508-E511 WeakPolarHBondContact CB-OE2 3.44Å; S508-E511 PolarHBondContact N-OE2 2.93Å; S508-E511 PolarHBondContact O-N 3.39Å; S508-E511 WeakPolarHBondContact OG-CB 3.34Å; S508-E511 VanDerWaalsContact OG-CD 3.28Å; S508-E511 WeakPolarHBondContact OG-CG 3.33Å; S508-E511 PolarHBondContact OG-N 3.05Å; S508-E511 PolarHBondContact OG-OE2 3.15Å; S508-M512 PolarHBondContact O-N 2.85Å; S508-M512 VanDerWaalsContact O-N 3.09Å
509	L	93.2	Very high	94.6	Very high	30 Å²	30	32.3 Å²	32.3	16%	0.157	19%	0.186	C	C	.	.	H	α-helix	trans	-58.7	-41.4	174.8	178.9	134	0	0	0	111.8	E511 M512 H513 P527 L529 Y566	L509-E511 PolarHBondContact O-N 2.84Å; L509-M512 PolarHBondContact O-N 2.99Å; L509-H513 WeakPolarHBondContact O-CB 3.24Å; L509-H513 PolarHBondContact O-N 3.31Å; L509-P527 HydrophobicContact CD2-CB 4.04Å; L509-P527 HydrophobicContact CD2-CG 3.4Å; L509-P527 VanDerWaalsContact CD2-CG 3.4Å; L509-L529 HydrophobicContact CD1-CD2 3.6Å; L509-L529 HydrophobicContact CD2-CD2 3.92Å; L509-L529 HydrophobicContact CG-CD2 4.44Å; L509-Y566 HydrophobicContact CG-CE2 4.45Å
510	T	92.9	Very high	94.7	Very high	83 Å²	83	32.3 Å²	32.3	51%	0.509	19%	0.186	S	C	.	.	H	α-helix	trans	-64.4	-38	176	-50.9	0	0	0	0	112.3	S508 H513 N514	S508-T510 VanDerWaalsContact C-N 3.29Å; S508-T510 PolarHBondContact O-N 2.83Å; T510-H513 PolarHBondContact O-N 3.4Å; T510-N514 WeakPolarHBondContact O-CB 3.28Å; T510-N514 PolarHBondContact O-N 3.36Å; T510-N514 PolarHBondContact O-ND2 3.29Å
511	E	94.1	Very high	94.5	Very high	55 Å²	55	32.8 Å²	32.8	26%	0.257	19%	0.189	S	C	.	.	H	α-helix	trans	-65.7	-45.5	176.4	-77.5	166.8	141.5	0	0	112.3	F507 S508 L509 H513 N514 W515	F507-E511 HydrophobicContact CB-CB 4.38Å; S508-E511 WeakPolarHBondContact CB-OE2 3.44Å; S508-E511 PolarHBondContact N-OE2 2.93Å; S508-E511 PolarHBondContact O-N 3.39Å; S508-E511 WeakPolarHBondContact OG-CB 3.34Å; S508-E511 VanDerWaalsContact OG-CD 3.28Å; S508-E511 WeakPolarHBondContact OG-CG 3.33Å; S508-E511 PolarHBondContact OG-N 3.05Å; S508-E511 PolarHBondContact OG-OE2 3.15Å; L509-E511 PolarHBondContact O-N 2.84Å; E511-H513 VanDerWaalsContact C-N 3.31Å; E511-H513 PolarHBondContact O-N 2.66Å; E511-N514 PolarHBondContact O-N 3.48Å; E511-W515 VanDerWaalsContact O-CG 3.3Å; E511-W515 PolarHBondContact O-N 2.84Å
512	M	95.3	Very high	94.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-42.2	175.5	-173.6	64.5	-152	0	0	111.3	L503 F507 S508 L509 W515 L516 Y566 A571 L573 L588	L503-M512 HydrophobicContact CD1-CE 4.36Å; F507-M512 HydrophobicContact CD2-CB 3.77Å; F507-M512 HydrophobicContact CD2-CG 4.47Å; F507-M512 HydrophobicContact CE2-CB 3.81Å; F507-M512 HydrophobicContact CE2-CG 4.05Å; F507-M512 HydrophobicContact CE2-SD 4.11Å; F507-M512 HydrophobicContact CZ-SD 4.42Å; S508-M512 PolarHBondContact O-N 2.85Å; S508-M512 VanDerWaalsContact O-N 3.09Å; L509-M512 PolarHBondContact O-N 2.99Å; M512-W515 WeakPolarHBondContact O-CB 3.12Å; M512-W515 PolarHBondContact O-N 3.17Å; M512-W515 HydrophobicContact SD-CE3 3.81Å; M512-W515 HydrophobicContact SD-CZ3 4.36Å; M512-L516 HydrophobicContact CE-CD1 4.24Å; M512-L516 HydrophobicContact CE-CD2 3.86Å; M512-L516 HydrophobicContact CE-CG 3.87Å; M512-L516 WeakPolarHBondContact O-CG 2.9Å; M512-L516 PolarHBondContact O-N 3.37Å; M512-Y566 HydrophobicContact CB-CD2 4.27Å; M512-Y566 HydrophobicContact CG-CD2 4.05Å; M512-Y566 HydrophobicContact CG-CG 4.07Å; M512-A571 HydrophobicContact CE-CB 3.69Å; M512-A571 HydrophobicContact CG-CB 4.04Å; M512-A571 HydrophobicContact SD-CB 3.75Å; M512-L573 HydrophobicContact CE-CD1 4.21Å; M512-L573 HydrophobicContact CE-CD2 4.32Å; M512-L588 HydrophobicContact CE-CD1 4.23Å; M512-L588 HydrophobicContact CE-CD2 4.46Å
513	H	95.3	Very high	94	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.019	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-44	176.7	-174.8	65.7	0	0	0	112.2	L509 T510 E511 W515 L516 S517 P524 Y566	L509-H513 WeakPolarHBondContact O-CB 3.24Å; L509-H513 PolarHBondContact O-N 3.31Å; T510-H513 PolarHBondContact O-N 3.4Å; E511-H513 VanDerWaalsContact C-N 3.31Å; E511-H513 PolarHBondContact O-N 2.66Å; H513-W515 VanDerWaalsContact C-N 3.29Å; H513-W515 PolarHBondContact O-N 2.96Å; H513-L516 PolarHBondContact O-N 2.83Å; H513-L516 VanDerWaalsContact O-N 3.17Å; H513-S517 WeakPolarHBondContact O-CB 3.42Å; H513-S517 PolarHBondContact O-N 2.87Å; H513-P524 PolarHBondContact CE1-O 2.78Å; H513-P524 VanDerWaalsContact CE1-O 3.29Å; H513-P524 PolarHBondContact NE2-O 2.81Å; H513-Y566 HydrophobicContact CB-CE2 3.92Å; H513-Y566 AromaticContact ND1-CZ 3.74Å; H513-Y566 PolarHBondContact ND1-OH 3Å
514	N	94.2	Very high	93.8	Very high	74 Å²	74	35.9 Å²	35.9	40%	0.396	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-37.2	174.7	-73.6	-24.4	0	0	0	112.1	T510 E511 S517 M518	T510-N514 WeakPolarHBondContact O-CB 3.28Å; T510-N514 PolarHBondContact O-N 3.36Å; T510-N514 PolarHBondContact O-ND2 3.29Å; E511-N514 PolarHBondContact O-N 3.48Å; N514-S517 PolarHBondContact O-N 3.07Å; N514-M518 VanDerWaalsContact O-CG 3.31Å; N514-M518 WeakPolarHBondContact O-CG 3.45Å; N514-M518 PolarHBondContact O-N 3.07Å
515	W	95.3	Very high	93.3	Very high	3 Å²	3	38.7 Å²	38.7	1%	0.011	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-40.9	174.4	-66.1	-22.5	0	0	0	112.3	F507 E511 M512 H513 M518 C519 L588 E591 A592 K595 I597 L599	F507-W515 HydrophobicContact CB-CH2 4.2Å; F507-W515 HydrophobicContact CB-CZ3 4.27Å; F507-W515 HydrophobicContact CD1-CZ3 4.24Å; F507-W515 HydrophobicContact CG-CZ3 4.19Å; E511-W515 VanDerWaalsContact O-CG 3.3Å; E511-W515 PolarHBondContact O-N 2.84Å; M512-W515 WeakPolarHBondContact O-CB 3.12Å; M512-W515 PolarHBondContact O-N 3.17Å; M512-W515 HydrophobicContact SD-CE3 3.81Å; M512-W515 HydrophobicContact SD-CZ3 4.36Å; H513-W515 VanDerWaalsContact C-N 3.29Å; H513-W515 PolarHBondContact O-N 2.96Å; W515-M518 PolarHBondContact O-N 2.94Å; W515-C519 PolarHBondContact O-N 2.99Å; W515-C519 PolarHBondContact O-SG 2.77Å; W515-L588 HydrophobicContact CB-CD2 3.61Å; W515-L588 HydrophobicContact CE3-CD2 4.41Å; W515-L588 HydrophobicContact CG-CD2 4.34Å; W515-E591 HydrophobicContact CG-CB 4.48Å; W515-A592 HydrophobicContact CH2-CB 3.89Å; W515-A592 HydrophobicContact CZ2-CB 4.18Å; W515-K595 HydrophobicContact CZ2-CD 4.46Å; W515-I597 HydrophobicContact CH2-CB 4.36Å; W515-I597 HydrophobicContact CH2-CD1 3.98Å; W515-I597 HydrophobicContact CH2-CG2 4.13Å; W515-I597 HydrophobicContact CZ2-CD1 3.79Å; W515-L599 HydrophobicContact CH2-CD1 4.47Å; W515-L599 HydrophobicContact CH2-CD2 4.41Å; W515-L599 HydrophobicContact CZ3-CD1 4.32Å; W515-L599 HydrophobicContact CZ3-CD2 4.32Å
516	L	95.8	Very high	93	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64	-44.7	173.7	-68.5	174.9	0	0	0	111.6	M512 H513 M518 C519 L520 C564 Y566 L573	M512-L516 HydrophobicContact CE-CD1 4.24Å; M512-L516 HydrophobicContact CE-CD2 3.86Å; M512-L516 HydrophobicContact CE-CG 3.87Å; M512-L516 WeakPolarHBondContact O-CG 2.9Å; M512-L516 PolarHBondContact O-N 3.37Å; H513-L516 PolarHBondContact O-N 2.83Å; H513-L516 VanDerWaalsContact O-N 3.17Å; L516-M518 VanDerWaalsContact C-N 3.25Å; L516-M518 PolarHBondContact O-N 3.15Å; L516-C519 CarbonylContact O-C 3.5Å; L516-C519 WeakPolarHBondContact O-CA 3.46Å; L516-C519 PolarHBondContact O-N 2.82Å; L516-L520 HydrophobicContact CD2-CD1 4.27Å; L516-L520 WeakPolarHBondContact O-CB 3.34Å; L516-L520 PolarHBondContact O-N 3.46Å; L516-C564 HydrophobicContact CD1-CB 4.28Å; L516-Y566 HydrophobicContact CD1-CD1 3.46Å; L516-Y566 VanDerWaalsContact CD1-CD1 3.46Å; L516-Y566 HydrophobicContact CD1-CE1 3.45Å; L516-Y566 VanDerWaalsContact CD1-CE1 3.45Å; L516-Y566 HydrophobicContact CD1-CG 4.06Å; L516-L573 HydrophobicContact CD2-CD1 4.34Å; L516-L573 HydrophobicContact CD2-CD2 4.07Å
517	S	94.5	Very high	92.8	Very high	45 Å²	45	38.6 Å²	38.6	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-59.4	-34.3	175.8	177.9	0	0	0	0	112.8	H478 H513 N514	H478-S517 PolarHBondContact CE1-O 3.21Å; H478-S517 PolarHBondContact ND1-O 2.79Å; H513-S517 WeakPolarHBondContact O-CB 3.42Å; H513-S517 PolarHBondContact O-N 2.87Å; N514-S517 PolarHBondContact O-N 3.07Å
518	M	94.4	Very high	92.3	Very high	74 Å²	74	41.5 Å²	41.5	37%	0.365	22%	0.219	S	C	.	.	H	α-helix	trans	-70.9	-35.6	170.8	-72	-64.6	-58.7	0	0	112.6	L476 H478 P479 N514 W515 L516	L476-M518 HydrophobicContact CD1-CE 4.3Å; L476-M518 HydrophobicContact CD2-CE 3.96Å; L476-M518 HydrophobicContact CD2-SD 4Å; H478-M518 PolarHBondContact ND1-O 3.12Å; P479-M518 WeakPolarHBondContact CD-O 3.2Å; N514-M518 VanDerWaalsContact O-CG 3.31Å; N514-M518 WeakPolarHBondContact O-CG 3.45Å; N514-M518 PolarHBondContact O-N 3.07Å; W515-M518 PolarHBondContact O-N 2.94Å; L516-M518 VanDerWaalsContact C-N 3.25Å; L516-M518 PolarHBondContact O-N 3.15Å
519	C	96.3	Very high	91.9	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-79.8	-31.1	-176	-68.3	0	0	0	0	114.2	L480 W515 L516 L584 V587	L480-C519 WeakPolarHBondContact CB-O 3.22Å; L480-C519 PolarHBondContact N-O 3.45Å; W515-C519 PolarHBondContact O-N 2.99Å; W515-C519 PolarHBondContact O-SG 2.77Å; L516-C519 CarbonylContact O-C 3.5Å; L516-C519 WeakPolarHBondContact O-CA 3.46Å; L516-C519 PolarHBondContact O-N 2.82Å; C519-L584 HydrophobicContact CB-CD2 4.15Å; C519-V587 VanDerWaalsContact SG-CG1 3.56Å
520	L	95.8	Very high	91.3	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.224	C	C	.	.	S	Bend	trans	-130.5	134.9	-166.9	-71.6	155.5	0	0	0	110.7	L480 H483 L516 T523 Y553 L562	L480-L520 HydrophobicContact CB-CD2 3.69Å; L480-L520 HydrophobicContact CB-CG 4.44Å; L480-L520 HydrophobicContact CD1-CD2 3.73Å; L480-L520 HydrophobicContact CD1-CG 4.31Å; L480-L520 HydrophobicContact CG-CD2 4.37Å; H483-L520 HydrophobicContact CB-CD2 3.78Å; L516-L520 HydrophobicContact CD2-CD1 4.27Å; L516-L520 WeakPolarHBondContact O-CB 3.34Å; L516-L520 PolarHBondContact O-N 3.46Å; L520-T523 PolarHBondContact O-OG1 2.88Å; L520-Y553 HydrophobicContact CB-CE1 3.97Å; L520-Y553 HydrophobicContact CB-CE2 4.46Å; L520-Y553 HydrophobicContact CD1-CD2 3.91Å; L520-Y553 HydrophobicContact CD1-CE2 3.65Å; L520-Y553 HydrophobicContact CD1-CG 4.44Å; L520-Y553 HydrophobicContact CD2-CD1 4.02Å; L520-Y553 HydrophobicContact CD2-CD2 4.34Å; L520-Y553 HydrophobicContact CD2-CE1 4.3Å; L520-Y553 HydrophobicContact CD2-CG 4.06Å; L520-Y553 HydrophobicContact CG-CE1 4.5Å; L520-Y553 HydrophobicContact CG-CE2 4.45Å; L520-L562 HydrophobicContact CD1-CD2 3.93Å; L520-L562 HydrophobicContact CD2-CD2 3.86Å; L520-L562 HydrophobicContact CG-CD2 4.48Å
521	P	93	Very high	90.4	Very high	13 Å²	13	45.3 Å²	45.3	8%	0.084	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	167	172	34.1	-37.4	0	0	0	110.6	L480 H483 T523 Y553	L480-P521 WeakPolarHBondContact O-CD 3.13Å; H483-P521 WeakPolarHBondContact O-CG 3.18Å; P521-T523 PolarHBondContact O-N 2.93Å; P521-Y553 WeakPolarHBondContact O-CE1 3.42Å
522	E	90	Very high	88.6	Confident	93 Å²	93	45.9 Å²	45.9	44%	0.435	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	14.3	174.1	-57	174.7	173.8	0	0	114.8	L485 P524	L485-E522 HydrophobicContact CB-CB 4.01Å; L485-E522 PolarHBondContact N-OE2 3.14Å; E522-P524 WeakPolarHBondContact O-CD 3.44Å
523	T	92.8	Very high	86.4	Confident	18 Å²	18	49.6 Å²	49.6	11%	0.11	28%	0.275	C	S	.	.			trans	-66.7	126.5	172.4	-58.5	0	0	0	0	108.4	L520 P521 L551 Y553	L520-T523 PolarHBondContact O-OG1 2.88Å; P521-T523 PolarHBondContact O-N 2.93Å; T523-L551 HydrophobicContact CG2-CD1 4.1Å; T523-Y553 WeakPolarHBondContact CA-OH 3.24Å; T523-Y553 PolarHBondContact OG1-OH 2.97Å
524	P	90.5	Very high	84.5	Confident	11 Å²	11	52.6 Å²	52.6	7%	0.071	29%	0.294	C	S	.	.			trans	-54.8	154.7	178.6	-26.4	34.4	0	0	0	112.3	L485 H513 E522 R526 L551	L485-P524 HydrophobicContact CD2-CG 4.44Å; H513-P524 PolarHBondContact CE1-O 2.78Å; H513-P524 VanDerWaalsContact CE1-O 3.29Å; H513-P524 PolarHBondContact NE2-O 2.81Å; E522-P524 WeakPolarHBondContact O-CD 3.44Å; P524-R526 PolarHBondContact O-N 3.27Å; P524-L551 HydrophobicContact CG-CD2 4.36Å
525	E	84.4	Confident	82.4	Confident	118 Å²	118	54.2 Å²	54.2	55%	0.551	31%	0.31	S	S	*	.	S	Bend	trans	-62.1	-30.6	176.6	-67.5	-169.4	160.7	0	0	112.4
526	R	86.3	Confident	80	Confident	112 Å²	112	60.5 Å²	60.5	42%	0.423	34%	0.34	S	S	.	.	S	Bend	trans	-129.6	142.4	-178.7	-60	-176.5	-169.6	-166.7	6.7	111.1	P146 P524 T528	P146-R526 PolarHBondContact O-N 2.99Å; P524-R526 PolarHBondContact O-N 3.27Å; R526-T528 PolarHBondContact O-N 3.33Å
527	P	86.9	Confident	77.8	Confident	31 Å²	31	61.4 Å²	61.4	20%	0.201	35%	0.347	C	S	.	.			trans	-70.5	128.7	176.9	27.4	-31	0	0	0	110.6	L509 L529 A549 Y566	L509-P527 HydrophobicContact CD2-CB 4.04Å; L509-P527 HydrophobicContact CD2-CG 3.4Å; L509-P527 VanDerWaalsContact CD2-CG 3.4Å; P527-L529 PolarHBondContact O-N 3.38Å; P527-A549 HydrophobicContact CB-CB 3.91Å; P527-Y566 HydrophobicContact CB-CE2 4.24Å; P527-Y566 WeakPolarHBondContact CB-OH 3.4Å
528	T	84.5	Confident	75.4	Confident	65 Å²	65	67.8 Å²	67.8	40%	0.399	37%	0.37	S	S	.	.			trans	-73.4	110	168.9	-50.8	0	0	0	0	109.1	P146 R526 A549	P146-T528 VanDerWaalsContact CB-OG1 3.29Å; P146-T528 WeakPolarHBondContact CB-OG1 3.46Å; P146-T528 HydrophobicContact CG-CG2 4.21Å; P146-T528 WeakPolarHBondContact CG-OG1 3.41Å; R526-T528 PolarHBondContact O-N 3.33Å; T528-A549 WeakPolarHBondContact O-CA 3.45Å
529	L	83.6	Confident	73.1	Confident	84 Å²	84	71.2 Å²	71.2	44%	0.44	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	124	-178.6	-63.6	176.9	0	0	0	111.1	L509 P527	L509-L529 HydrophobicContact CD1-CD2 3.6Å; L509-L529 HydrophobicContact CD2-CD2 3.92Å; L509-L529 HydrophobicContact CG-CD2 4.44Å; P527-L529 PolarHBondContact O-N 3.38Å
530	I	81.8	Confident	70.9	Confident	20 Å²	20	73 Å²	73	10%	0.103	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	123.3	174.1	-56.3	171.5	0	0	0	107.6	F548 Q550	I530-F548 HydrophobicContact CB-CD2 4.46Å; I530-F548 HydrophobicContact CB-CE1 4.22Å; I530-F548 HydrophobicContact CB-CE2 4.04Å; I530-F548 HydrophobicContact CB-CZ 3.91Å; I530-F548 HydrophobicContact CD1-CE2 3.89Å; I530-F548 HydrophobicContact CD1-CZ 4.34Å; I530-F548 HydrophobicContact CG2-CE1 4.07Å; I530-F548 HydrophobicContact CG2-CE2 4.29Å; I530-F548 HydrophobicContact CG2-CZ 3.72Å; I530-F548 PolarHBondContact N-O 2.89Å; I530-F548 PolarHBondContact O-N 2.82Å; I530-Q550 HydrophobicContact CD1-CB 3.84Å
531	K	73.8	Confident	68.7	Low	130 Å²	130	80.6 Å²	80.6	57%	0.565	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	128.7	172.8	-67.9	-173.6	176.8	-173.7	0	110.2	G533 T534 E547	K531-G533 PolarHBondContact O-N 2.88Å; K531-G533 VanDerWaalsContact O-N 3.16Å; K531-T534 PolarHBondContact O-N 3.45Å; K531-T534 PolarHBondContact O-OG1 3.2Å; K531-E547 VanDerWaalsContact CE-OE1 3.27Å; K531-E547 WeakPolarHBondContact CE-OE1 3.27Å; K531-E547 HydrophobicContact CG-CG 4.3Å; K531-E547 IonicContact NZ-OE1 2.77Å
532	S	56.1	Low	66.8	Low	66 Å²	66	84 Å²	84	46%	0.462	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	113.8	173.2	46.9	0	0	0	0	110	I545 E546	S532-I545 VanDerWaalsContact CB-O 3.31Å; S532-I545 WeakPolarHBondContact CB-O 3.18Å; S532-I545 PolarHBondContact OG-O 2.82Å; S532-E546 PolarHBondContact N-O 2.93Å; S532-E546 WeakPolarHBondContact OG-CA 3.46Å; S532-E546 PolarHBondContact OG-O 3Å
533	G	49.7	Very low	64.9	Low	79 Å²	79	88.5 Å²	88.5	81%	0.814	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.8	-13.4	-174	0	0	0	0	0	114.3	K531	K531-G533 PolarHBondContact O-N 2.88Å; K531-G533 VanDerWaalsContact O-N 3.16Å
534	T	54.7	Low	63.3	Low	67 Å²	67	95.2 Å²	95.2	41%	0.411	51%	0.513	S	S	.	.	S	Bend	trans	-80.2	157.6	170.6	56	0	0	0	0	111.2	K531 Q536 A537	K531-T534 PolarHBondContact O-N 3.45Å; K531-T534 PolarHBondContact O-OG1 3.2Å; T534-Q536 PolarHBondContact O-N 3.46Å; T534-A537 WeakPolarHBondContact O-CB 3.39Å; T534-A537 PolarHBondContact O-N 3.16Å
535	S	49.5	Very low	62	Low	107 Å²	107	96.3 Å²	96.3	75%	0.748	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-50.6	-30.6	-177.9	-38.2	0	0	0	0	113.7	A537	S535-A537 VanDerWaalsContact C-N 3.34Å
536	Q	46.6	Very low	61.3	Low	135 Å²	135	98.5 Å²	98.5	63%	0.631	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-73.2	-21.3	179.1	-66.7	-179.2	-7.3	0	0	113.6	T534 K538	T534-Q536 PolarHBondContact O-N 3.46Å; Q536-K538 VanDerWaalsContact C-N 3.32Å; Q536-K538 PolarHBondContact O-N 2.94Å
537	A	48.3	Very low	61.2	Low	19 Å²	19	97.3 Å²	97.3	16%	0.157	53%	0.528	C	S	.	.	G	3₁₀ helix	trans	-79.9	-9.4	-178.9	0	0	0	0	0	114	T534 S535 N539 N540	T534-A537 WeakPolarHBondContact O-CB 3.39Å; T534-A537 PolarHBondContact O-N 3.16Å; S535-A537 VanDerWaalsContact C-N 3.34Å; A537-N539 PolarHBondContact O-N 2.87Å; A537-N540 PolarHBondContact O-N 2.97Å
538	K	43.7	Very low	61.3	Low	179 Å²	179	96.2 Å²	96.2	78%	0.778	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-65.9	-9	-171.4	-74.8	-172.8	175.4	180	0	115.3	Q536	Q536-K538 VanDerWaalsContact C-N 3.32Å; Q536-K538 PolarHBondContact O-N 2.94Å
539	N	47.2	Very low	61.7	Low	146 Å²	146	93.1 Å²	93.1	78%	0.781	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-109.5	7.8	-176.6	-68	-7.5	0	0	0	114.5	A537	A537-N539 PolarHBondContact O-N 2.87Å
540	N	48.8	Very low	62.2	Low	40 Å²	40	90.9 Å²	90.9	21%	0.214	49%	0.488	C	S	.	.			trans	-111.3	113.9	178.3	-75.4	-22.3	0	0	0	110.5	A537 N542 F548	A537-N540 PolarHBondContact O-N 2.97Å; N540-N542 PolarHBondContact O-N 2.99Å; N540-F548 WeakPolarHBondContact ND2-CZ 3.33Å
541	D	50.5	Low	62.8	Low	159 Å²	159	90.6 Å²	90.6	85%	0.85	49%	0.487	S	S	*	.			trans	-67.8	4.9	179.4	-70.9	-34.1	0	0	0	114.8	Q543	D541-Q543 PolarHBondContact O-N 2.9Å
542	N	52.5	Low	63.8	Low	86 Å²	86	86.2 Å²	86.2	46%	0.46	47%	0.468	S	S	.	.			trans	-96.1	81.3	-177.2	-71.4	-16	0	0	0	111	N540 N544 I545	N540-N542 PolarHBondContact O-N 2.99Å; N542-N544 PolarHBondContact O-N 2.86Å; N542-I545 HydrophobicContact CB-CD1 4.42Å
543	Q	51	Low	65.7	Low	187 Å²	187	83.1 Å²	83.1	87%	0.874	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	4.6	-175.5	-69	-177.9	-6.7	0	0	116.6	D541	D541-Q543 PolarHBondContact O-N 2.9Å
544	N	58.3	Low	67.8	Low	159 Å²	159	81 Å²	81	85%	0.85	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	9.6	-170	-71	-15.7	0	0	0	115.7	N542	N542-N544 PolarHBondContact O-N 2.86Å
545	I	64.2	Low	69.6	Low	34 Å²	34	77.8 Å²	77.8	17%	0.174	40%	0.395	C	S	.	.			trans	-112	107.9	-177.9	-54.4	174.7	0	0	0	110	S532 N542 E547 F548 A567 Y570	S532-I545 VanDerWaalsContact CB-O 3.31Å; S532-I545 WeakPolarHBondContact CB-O 3.18Å; S532-I545 PolarHBondContact OG-O 2.82Å; N542-I545 HydrophobicContact CB-CD1 4.42Å; I545-E547 WeakPolarHBondContact CG2-O 3.08Å; I545-F548 HydrophobicContact CG2-CB 3.9Å; I545-F548 HydrophobicContact CG2-CD1 4.44Å; I545-A567 HydrophobicContact CG2-CB 3.56Å; I545-Y570 HydrophobicContact CD1-CD1 3.87Å; I545-Y570 HydrophobicContact CD1-CE1 4.09Å
546	E	69.8	Low	71.6	Confident	163 Å²	163	73.2 Å²	73.2	76%	0.762	36%	0.362	S	S	*	.	S	Bend	trans	-64.8	-40.6	-178	-65.4	-177.2	165.7	0	0	113	S532	S532-E546 PolarHBondContact N-O 2.93Å; S532-E546 WeakPolarHBondContact OG-CA 3.46Å; S532-E546 PolarHBondContact OG-O 3Å
547	E	83.4	Confident	73.5	Confident	87 Å²	87	67 Å²	67	41%	0.407	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	124.9	-179.3	-63.3	-173.8	160.2	0	0	110.1	K531 I545	K531-E547 VanDerWaalsContact CE-OE1 3.27Å; K531-E547 WeakPolarHBondContact CE-OE1 3.27Å; K531-E547 HydrophobicContact CG-CG 4.3Å; K531-E547 IonicContact NZ-OE1 2.77Å; I545-E547 WeakPolarHBondContact CG2-O 3.08Å
548	F	90.2	Very high	75.5	Confident	9 Å²	9	66.8 Å²	66.8	4%	0.039	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	159.5	175.1	66.2	-85.7	0	0	0	110.6	I530 N540 I545 Q550 I565 Y566 A567	I530-F548 HydrophobicContact CB-CD2 4.46Å; I530-F548 HydrophobicContact CB-CE1 4.22Å; I530-F548 HydrophobicContact CB-CE2 4.04Å; I530-F548 HydrophobicContact CB-CZ 3.91Å; I530-F548 HydrophobicContact CD1-CE2 3.89Å; I530-F548 HydrophobicContact CD1-CZ 4.34Å; I530-F548 HydrophobicContact CG2-CE1 4.07Å; I530-F548 HydrophobicContact CG2-CE2 4.29Å; I530-F548 HydrophobicContact CG2-CZ 3.72Å; I530-F548 PolarHBondContact N-O 2.89Å; I530-F548 PolarHBondContact O-N 2.82Å; N540-F548 WeakPolarHBondContact ND2-CZ 3.33Å; I545-F548 HydrophobicContact CG2-CB 3.9Å; I545-F548 HydrophobicContact CG2-CD1 4.44Å; F548-Q550 HydrophobicContact CD2-CB 4.4Å; F548-Q550 HydrophobicContact CE2-CB 4.23Å; F548-I565 HydrophobicContact CD2-CG2 4Å; F548-Y566 CarbonylContact C-O 3.6Å; F548-Y566 WeakPolarHBondContact CA-O 3.47Å; F548-A567 HydrophobicContact CB-CB 4.21Å
549	A	92.8	Very high	77.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	149.6	169.8	0	0	0	0	0	109.8	P527 T528 I565 Y566	P527-A549 HydrophobicContact CB-CB 3.91Å; T528-A549 WeakPolarHBondContact O-CA 3.45Å; A549-I565 WeakPolarHBondContact O-CA 3.23Å; A549-Y566 HydrophobicContact CB-CD1 4.32Å; A549-Y566 HydrophobicContact CB-CD2 4.14Å; A549-Y566 HydrophobicContact CB-CE1 3.74Å; A549-Y566 HydrophobicContact CB-CE2 3.53Å; A549-Y566 HydrophobicContact CB-CG 4.5Å; A549-Y566 WeakPolarHBondContact CB-OH 3.38Å; A549-Y566 PolarHBondContact N-O 3.39Å; A549-Y566 PolarHBondContact O-N 2.9Å
550	Q	92.9	Very high	79.8	Confident	37 Å²	37	55.4 Å²	55.4	17%	0.173	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	127.6	-176.8	-174.8	166.9	-3.9	0	0	110	I530 F548 F552 C564 I565	I530-Q550 HydrophobicContact CD1-CB 3.84Å; F548-Q550 HydrophobicContact CD2-CB 4.4Å; F548-Q550 HydrophobicContact CE2-CB 4.23Å; Q550-F552 HydrophobicContact CG-CE1 4.21Å; Q550-F552 HydrophobicContact CG-CE2 4.19Å; Q550-F552 HydrophobicContact CG-CZ 3.92Å; Q550-C564 VanDerWaalsContact CA-O 3.32Å; Q550-C564 WeakPolarHBondContact CA-O 2.94Å; Q550-I565 HydrophobicContact CG-CG1 4.14Å
551	L	94.6	Very high	82	Confident	13 Å²	13	53.7 Å²	53.7	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.7	176.4	-59.8	172.6	0	0	0	109.2	L485 T523 P524 Y553 C564 Y566	L485-L551 HydrophobicContact CD1-CB 4.31Å; L485-L551 HydrophobicContact CD1-CD2 4.13Å; T523-L551 HydrophobicContact CG2-CD1 4.1Å; P524-L551 HydrophobicContact CG-CD2 4.36Å; L551-Y553 HydrophobicContact CB-CD2 4.38Å; L551-Y553 HydrophobicContact CB-CE2 3.69Å; L551-Y553 HydrophobicContact CD1-CE2 4.25Å; L551-C564 HydrophobicContact CB-CB 4.33Å; L551-C564 PolarHBondContact N-O 2.88Å; L551-C564 PolarHBondContact O-N 3.03Å; L551-Y566 HydrophobicContact CD1-CE1 4.06Å; L551-Y566 HydrophobicContact CG-CE1 4.24Å
552	F	94.9	Very high	84.1	Confident	38 Å²	38	46.1 Å²	46.1	17%	0.167	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	138	176	-51.7	-77.2	0	0	0	109.6	L485 T486 H487 I489 Q550 L562 K563	L485-F552 WeakPolarHBondContact CD1-O 3.38Å; T486-F552 PolarHBondContact N-O 2.82Å; H487-F552 VanDerWaalsContact O-CD2 3.24Å; H487-F552 WeakPolarHBondContact O-CD2 3.48Å; H487-F552 WeakPolarHBondContact O-CE2 3.49Å; I489-F552 HydrophobicContact CD1-CD1 3.7Å; I489-F552 HydrophobicContact CD1-CE1 3.64Å; I489-F552 HydrophobicContact CG1-CD1 3.55Å; I489-F552 HydrophobicContact CG1-CE1 3.83Å; I489-F552 HydrophobicContact CG1-CG 4.34Å; Q550-F552 HydrophobicContact CG-CE1 4.21Å; Q550-F552 HydrophobicContact CG-CE2 4.19Å; Q550-F552 HydrophobicContact CG-CZ 3.92Å; F552-L562 CarbonylContact C-O 3.59Å; F552-L562 WeakPolarHBondContact CA-O 3.4Å; F552-K563 HydrophobicContact CD1-CB 4.36Å; F552-K563 HydrophobicContact CD1-CG 3.96Å; F552-K563 HydrophobicContact CE1-CD 4.28Å; F552-K563 HydrophobicContact CE1-CG 3.87Å
553	Y	95.5	Very high	86.1	Confident	1 Å²	1	43.6 Å²	43.6	0%	0.004	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	150.5	179.5	-69.7	-90.4	0	0	0	110.2	H483 C484 L485 L520 P521 T523 L551 Q561 L562	H483-Y553 HydrophobicContact CB-CD1 4.33Å; C484-Y553 CarbonylContact O-C 3.45Å; C484-Y553 VanDerWaalsContact O-CA 3.22Å; C484-Y553 WeakPolarHBondContact O-CA 3.36Å; L485-Y553 HydrophobicContact CB-CD1 4.33Å; L485-Y553 HydrophobicContact CB-CE1 3.95Å; L485-Y553 HydrophobicContact CD1-CD1 4.36Å; L485-Y553 HydrophobicContact CD1-CE1 3.76Å; L485-Y553 HydrophobicContact CD1-CE2 3.95Å; L485-Y553 HydrophobicContact CG-CE1 4.49Å; L520-Y553 HydrophobicContact CB-CE1 3.97Å; L520-Y553 HydrophobicContact CB-CE2 4.46Å; L520-Y553 HydrophobicContact CD1-CD2 3.91Å; L520-Y553 HydrophobicContact CD1-CE2 3.65Å; L520-Y553 HydrophobicContact CD1-CG 4.44Å; L520-Y553 HydrophobicContact CD2-CD1 4.02Å; L520-Y553 HydrophobicContact CD2-CD2 4.34Å; L520-Y553 HydrophobicContact CD2-CE1 4.3Å; L520-Y553 HydrophobicContact CD2-CG 4.06Å; L520-Y553 HydrophobicContact CG-CE1 4.5Å; L520-Y553 HydrophobicContact CG-CE2 4.45Å; P521-Y553 WeakPolarHBondContact O-CE1 3.42Å; T523-Y553 WeakPolarHBondContact CA-OH 3.24Å; T523-Y553 PolarHBondContact OG1-OH 2.97Å; L551-Y553 HydrophobicContact CB-CD2 4.38Å; L551-Y553 HydrophobicContact CB-CE2 3.69Å; L551-Y553 HydrophobicContact CD1-CE2 4.25Å; Y553-Q561 CarbonylContact O-C 3.51Å; Y553-Q561 WeakPolarHBondContact O-CA 3.46Å; Y553-L562 HydrophobicContact CD2-CD2 4.49Å; Y553-L562 PolarHBondContact N-O 2.99Å; Y553-L562 PolarHBondContact O-N 3.41Å
554	K	94	Very high	88.3	Confident	35 Å²	35	34.7 Å²	34.7	15%	0.152	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.9	173.1	-177.3	175.6	178.6	174.2	0	109.4	H483 C484 T486 E490 I556 S560	H483-K554 CarbonylContact C-O 3.46Å; H483-K554 WeakPolarHBondContact CA-O 3.37Å; C484-K554 PolarHBondContact N-O 3.12Å; C484-K554 PolarHBondContact O-N 3.44Å; T486-K554 HydrophobicContact CG2-CB 3.65Å; E490-K554 IonicContact OE1-NZ 3.75Å; E490-K554 PolarHBondContact OE1-NZ 3.05Å; E490-K554 IonicContact OE2-NZ 2.73Å; E490-K554 PolarHBondContact OE2-NZ 2.91Å; K554-I556 PolarHBondContact O-N 2.92Å; K554-S560 CarbonylContact C-O 3.29Å; K554-S560 WeakPolarHBondContact CA-O 3.32Å
555	S	93.9	Very high	90	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	117.7	167.4	179.8	0	0	0	0	108.2	Y557 L558 K559 S560	S555-Y557 PolarHBondContact O-N 2.94Å; S555-L558 PolarHBondContact OG-N 2.9Å; S555-K559 WeakPolarHBondContact O-CA 3.45Å; S555-K559 PolarHBondContact O-N 2.75Å; S555-S560 WeakPolarHBondContact CB-OG 3.15Å; S555-S560 PolarHBondContact N-O 2.81Å
556	I	90.1	Very high	91.5	Very high	10 Å²	10	26.1 Å²	26.1	5%	0.051	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-34.6	-178.9	-56.9	155.8	0	0	0	109.4	L374 K376 F379 L482 C484 K554 K559	L374-I556 HydrophobicContact CD2-CD1 3.3Å; L374-I556 HydrophobicContact CG-CD1 3.98Å; K376-I556 HydrophobicContact CB-CG2 4.01Å; K376-I556 HydrophobicContact CG-CD1 3.84Å; K376-I556 HydrophobicContact CG-CG1 4.42Å; K376-I556 HydrophobicContact CG-CG2 4.44Å; K376-I556 VanDerWaalsContact O-CG2 3.23Å; K376-I556 WeakPolarHBondContact O-CG2 3.41Å; F379-I556 HydrophobicContact CD1-CB 4.28Å; F379-I556 HydrophobicContact CD1-CG2 3.67Å; F379-I556 HydrophobicContact CE1-CB 4.36Å; F379-I556 HydrophobicContact CE1-CG2 3.53Å; F379-I556 WeakPolarHBondContact CE1-O 3.17Å; L482-I556 PolarHBondContact O-N 3.26Å; C484-I556 HydrophobicContact CB-CD1 3.89Å; C484-I556 HydrophobicContact CB-CG1 4.05Å; C484-I556 VanDerWaalsContact SG-CG1 3.52Å; K554-I556 PolarHBondContact O-N 2.92Å; I556-K559 WeakPolarHBondContact O-CD 3.29Å; I556-K559 VanDerWaalsContact O-CE 3.25Å; I556-K559 WeakPolarHBondContact O-CE 3.36Å; I556-K559 PolarHBondContact O-NZ 2.95Å
557	Y	86.7	Confident	92.6	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.016	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-52.5	-176.5	-166.6	-107.8	0	0	0	113.6	F379 L482 S555 Q696 R699 Y700	F379-Y557 HydrophobicContact CB-CD2 4.18Å; F379-Y557 AromaticContact CD1-CD2 4Å; F379-Y557 HydrophobicContact CD1-CD2 4Å; F379-Y557 HydrophobicContact CD2-CD2 4.13Å; F379-Y557 HydrophobicContact CD2-CE2 4.45Å; F379-Y557 HydrophobicContact CE1-CD2 4.45Å; F379-Y557 AromaticContact CG-CD2 3.82Å; F379-Y557 HydrophobicContact CG-CD2 3.82Å; L482-Y557 HydrophobicContact CD1-CG 4.41Å; S555-Y557 PolarHBondContact O-N 2.94Å; Y557-Q696 VanDerWaalsContact CE2-OE1 3.27Å; Y557-Q696 PolarHBondContact OH-O 3.34Å; Y557-R699 HydrophobicContact CE1-CG 4.08Å; Y557-Y700 HydrophobicContact CD1-CE1 4.19Å; Y557-Y700 AromaticContact CE1-CD1 3.78Å; Y557-Y700 HydrophobicContact CE1-CD1 3.78Å; Y557-Y700 HydrophobicContact CE1-CD2 4.35Å; Y557-Y700 AromaticContact CE1-CE1 3.59Å; Y557-Y700 HydrophobicContact CE1-CE1 3.59Å; Y557-Y700 HydrophobicContact CE1-CE2 4.16Å; Y557-Y700 HydrophobicContact CE1-CG 4.16Å; Y557-Y700 AromaticContact CE1-CZ 3.79Å; Y557-Y700 HydrophobicContact CE2-CE2 4.23Å; Y557-Y700 AromaticContact CZ-CD2 3.9Å; Y557-Y700 AromaticContact CZ-CE1 3.93Å; Y557-Y700 AromaticContact CZ-CE2 3.62Å; Y557-Y700 AromaticContact CZ-CZ 3.64Å; Y557-Y700 PolarHBondContact O-OH 2.9Å; Y557-Y700 WeakPolarHBondContact OH-CD2 3.49Å; Y557-Y700 VanDerWaalsContact OH-CE2 3.23Å; Y557-Y700 WeakPolarHBondContact OH-CE2 3.44Å
558	L	89.7	Confident	93.1	Very high	15 Å²	15	22.6 Å²	22.6	8%	0.079	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-10.6	-176.1	-59.8	-178.2	0	0	0	113.7	S555 S560 M613 I617 Y700 C703	S555-L558 PolarHBondContact OG-N 2.9Å; L558-S560 PolarHBondContact O-N 3.11Å; L558-S560 VanDerWaalsContact O-N 3.1Å; L558-M613 HydrophobicContact CB-CE 3.97Å; L558-M613 HydrophobicContact CD1-CE 4Å; L558-I617 HydrophobicContact CD2-CD1 3.75Å; L558-I617 HydrophobicContact CD2-CG1 4.19Å; L558-Y700 HydrophobicContact CD2-CD1 4.24Å; L558-Y700 HydrophobicContact CD2-CE1 3.9Å; L558-C703 HydrophobicContact CD2-CB 4.39Å
559	K	89.6	Confident	93.3	Very high	87 Å²	87	23.1 Å²	23.1	38%	0.378	11%	0.109	S	C	.	.			trans	60.5	10.8	-172.9	-50.2	-57.5	-175.9	-165.7	0	114.6	S555 I556 M616	S555-K559 WeakPolarHBondContact O-CA 3.45Å; S555-K559 PolarHBondContact O-N 2.75Å; I556-K559 WeakPolarHBondContact O-CD 3.29Å; I556-K559 VanDerWaalsContact O-CE 3.25Å; I556-K559 WeakPolarHBondContact O-CE 3.36Å; I556-K559 PolarHBondContact O-NZ 2.95Å; K559-M616 HydrophobicContact CB-CE 3.99Å
560	S	92.5	Very high	93.4	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.117	C	C	.	.			trans	-64.6	155.5	168.9	61	0	0	0	0	110.8	K554 S555 L558 D576	K554-S560 CarbonylContact C-O 3.29Å; K554-S560 WeakPolarHBondContact CA-O 3.32Å; S555-S560 WeakPolarHBondContact CB-OG 3.15Å; S555-S560 PolarHBondContact N-O 2.81Å; L558-S560 PolarHBondContact O-N 3.11Å; L558-S560 VanDerWaalsContact O-N 3.1Å; S560-D576 WeakPolarHBondContact CA-OD1 3.24Å; S560-D576 WeakPolarHBondContact CB-OD1 3.19Å
561	Q	93.9	Very high	93.5	Very high	3 Å²	3	23.4 Å²	23.4	1%	0.014	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	152	-179.7	-61.7	-171.2	20	0	0	111.7	E490 R496 W498 Y553 S575 D576	E490-Q561 PolarHBondContact O-NE2 2.7Å; R496-Q561 VanDerWaalsContact CZ-NE2 3.28Å; W498-Q561 HydrophobicContact CH2-CB 4.21Å; Y553-Q561 CarbonylContact O-C 3.51Å; Y553-Q561 WeakPolarHBondContact O-CA 3.46Å; Q561-S575 VanDerWaalsContact O-CA 3.22Å; Q561-S575 WeakPolarHBondContact O-CA 3.29Å; Q561-S575 WeakPolarHBondContact O-CB 3.18Å; Q561-S575 PolarHBondContact O-OG 3.44Å; Q561-D576 PolarHBondContact N-OD1 3.33Å; Q561-D576 PolarHBondContact N-OD2 3.18Å; Q561-D576 PolarHBondContact O-N 2.91Å
562	L	95.6	Very high	93.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	118.3	178	168.8	68	0	0	0	108.9	L480 L520 F552 Y553 Q574 T580 L584	L480-L562 HydrophobicContact CD1-CD2 3.9Å; L520-L562 HydrophobicContact CD1-CD2 3.93Å; L520-L562 HydrophobicContact CD2-CD2 3.86Å; L520-L562 HydrophobicContact CG-CD2 4.48Å; F552-L562 CarbonylContact C-O 3.59Å; F552-L562 WeakPolarHBondContact CA-O 3.4Å; Y553-L562 HydrophobicContact CD2-CD2 4.49Å; Y553-L562 PolarHBondContact N-O 2.99Å; Y553-L562 PolarHBondContact O-N 3.41Å; L562-Q574 CarbonylContact C-O 3.59Å; L562-Q574 WeakPolarHBondContact CA-O 3.48Å; L562-T580 HydrophobicContact CD1-CG2 4.3Å; L562-T580 HydrophobicContact CD2-CG2 4.2Å; L562-L584 HydrophobicContact CD1-CD1 3.76Å; L562-L584 HydrophobicContact CD2-CD1 4.08Å
563	K	95.4	Very high	93.7	Very high	34 Å²	34	21.6 Å²	21.6	15%	0.148	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	121.8	174.5	-174.4	-178.1	-179.8	-168.5	0	109.1	I489 W498 F552 I565 L573 Q574	I489-K563 HydrophobicContact CD1-CB 3.95Å; I489-K563 HydrophobicContact CD1-CD 3.79Å; I489-K563 HydrophobicContact CD1-CG 4.02Å; W498-K563 HydrophobicContact CZ3-CB 4.47Å; F552-K563 HydrophobicContact CD1-CB 4.36Å; F552-K563 HydrophobicContact CD1-CG 3.96Å; F552-K563 HydrophobicContact CE1-CD 4.28Å; F552-K563 HydrophobicContact CE1-CG 3.87Å; K563-I565 HydrophobicContact CD-CD1 4.38Å; K563-I565 HydrophobicContact CG-CG1 4.49Å; K563-L573 CarbonylContact O-C 3.56Å; K563-L573 WeakPolarHBondContact O-CA 3.45Å; K563-Q574 HydrophobicContact CB-CB 4.31Å; K563-Q574 PolarHBondContact N-O 2.78Å; K563-Q574 PolarHBondContact O-N 2.91Å
564	C	95.6	Very high	93.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	110.5	176.4	-55.4	0	0	0	0	109.2	L516 Q550 L551 L573	L516-C564 HydrophobicContact CD1-CB 4.28Å; Q550-C564 VanDerWaalsContact CA-O 3.32Å; Q550-C564 WeakPolarHBondContact CA-O 2.94Å; L551-C564 HydrophobicContact CB-CB 4.33Å; L551-C564 PolarHBondContact N-O 2.88Å; L551-C564 PolarHBondContact O-N 3.03Å; C564-L573 HydrophobicContact CB-CD2 3.72Å
565	I	95.2	Very high	93.8	Very high	12 Å²	12	21.7 Å²	21.7	6%	0.062	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.5	168	-65.4	170.3	0	0	0	107.6	F548 A549 Q550 K563 A571 N572	F548-I565 HydrophobicContact CD2-CG2 4Å; A549-I565 WeakPolarHBondContact O-CA 3.23Å; Q550-I565 HydrophobicContact CG-CG1 4.14Å; K563-I565 HydrophobicContact CD-CD1 4.38Å; K563-I565 HydrophobicContact CG-CG1 4.49Å; I565-A571 CarbonylContact O-C 3.54Å; I565-A571 WeakPolarHBondContact O-CA 3.36Å; I565-N572 PolarHBondContact N-O 3.24Å; I565-N572 PolarHBondContact O-N 3.38Å
566	Y	95	Very high	93.7	Very high	1 Å²	1	21.7 Å²	21.7	0%	0.004	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	149	179.2	60.5	-80.7	0	0	0	112.7	L509 M512 H513 L516 P527 F548 A549 L551 Y570	L509-Y566 HydrophobicContact CG-CE2 4.45Å; M512-Y566 HydrophobicContact CB-CD2 4.27Å; M512-Y566 HydrophobicContact CG-CD2 4.05Å; M512-Y566 HydrophobicContact CG-CG 4.07Å; H513-Y566 HydrophobicContact CB-CE2 3.92Å; H513-Y566 AromaticContact ND1-CZ 3.74Å; H513-Y566 PolarHBondContact ND1-OH 3Å; L516-Y566 HydrophobicContact CD1-CD1 3.46Å; L516-Y566 VanDerWaalsContact CD1-CD1 3.46Å; L516-Y566 HydrophobicContact CD1-CE1 3.45Å; L516-Y566 VanDerWaalsContact CD1-CE1 3.45Å; L516-Y566 HydrophobicContact CD1-CG 4.06Å; P527-Y566 HydrophobicContact CB-CE2 4.24Å; P527-Y566 WeakPolarHBondContact CB-OH 3.4Å; F548-Y566 CarbonylContact C-O 3.6Å; F548-Y566 WeakPolarHBondContact CA-O 3.47Å; A549-Y566 HydrophobicContact CB-CD1 4.32Å; A549-Y566 HydrophobicContact CB-CD2 4.14Å; A549-Y566 HydrophobicContact CB-CE1 3.74Å; A549-Y566 HydrophobicContact CB-CE2 3.53Å; A549-Y566 HydrophobicContact CB-CG 4.5Å; A549-Y566 WeakPolarHBondContact CB-OH 3.38Å; A549-Y566 PolarHBondContact N-O 3.39Å; A549-Y566 PolarHBondContact O-N 2.9Å; L551-Y566 HydrophobicContact CD1-CE1 4.06Å; L551-Y566 HydrophobicContact CG-CE1 4.24Å; Y566-Y570 WeakPolarHBondContact CA-O 3.25Å
567	A	94.3	Very high	93.9	Very high	4 Å²	4	21.4 Å²	21.4	3%	0.033	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-178.6	-179.7	0	0	0	0	0	109.2	I545 F548 G569 Y570	I545-A567 HydrophobicContact CG2-CB 3.56Å; F548-A567 HydrophobicContact CB-CB 4.21Å; A567-G569 PolarHBondContact O-N 3.16Å; A567-Y570 CarbonylContact C-O 3.56Å; A567-Y570 PolarHBondContact N-O 2.82Å; A567-Y570 PolarHBondContact O-N 3.09Å
568	K	93.8	Very high	94.3	Very high	172 Å²	172	21.2 Å²	21.2	75%	0.748	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	120.3	172.6	-177.4	178.8	178.3	-178.1	0	110	Y570	K568-Y570 PolarHBondContact O-N 2.91Å
569	G	93.1	Very high	94.5	Very high	19 Å²	19	21.4 Å²	21.4	20%	0.196	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	5.4	177.7	0	0	0	0	0	116.2	T504 G505 F507 A567	T504-G569 WeakPolarHBondContact CA-O 3.32Å; G505-G569 PolarHBondContact N-O 3.37Å; G505-G569 VanDerWaalsContact N-O 3.12Å; G505-G569 WeakPolarHBondContact O-CA 3.38Å; F507-G569 VanDerWaalsContact CZ-C 3.45Å; F507-G569 WeakPolarHBondContact O-CA 3.41Å; F507-G569 PolarHBondContact O-N 2.82Å; A567-G569 PolarHBondContact O-N 3.16Å
570	Y	94.8	Very high	94.8	Very high	43 Å²	43	17.2 Å²	17.2	17%	0.169	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	135.7	-179.4	177.1	-95.1	0	0	0	111.2	L503 T504 I545 Y566 A567 K568 N572	L503-Y570 CarbonylContact O-C 3.56Å; L503-Y570 WeakPolarHBondContact O-CA 3.43Å; T504-Y570 HydrophobicContact CG2-CD2 3.8Å; T504-Y570 HydrophobicContact CG2-CE2 4.46Å; I545-Y570 HydrophobicContact CD1-CD1 3.87Å; I545-Y570 HydrophobicContact CD1-CE1 4.09Å; Y566-Y570 WeakPolarHBondContact CA-O 3.25Å; A567-Y570 CarbonylContact C-O 3.56Å; A567-Y570 PolarHBondContact N-O 2.82Å; A567-Y570 PolarHBondContact O-N 3.09Å; K568-Y570 PolarHBondContact O-N 2.91Å; Y570-N572 HydrophobicContact CE1-CB 3.96Å
571	A	96.1	Very high	95	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.4	167.9	0	0	0	0	0	110.6	Q502 L503 F507 M512 I565	Q502-A571 CarbonylContact C-O 3.51Å; Q502-A571 WeakPolarHBondContact CA-O 3.46Å; L503-A571 HydrophobicContact CB-CB 4.32Å; L503-A571 PolarHBondContact N-O 2.92Å; L503-A571 PolarHBondContact O-N 3.22Å; F507-A571 HydrophobicContact CZ-CB 4.4Å; M512-A571 HydrophobicContact CE-CB 3.69Å; M512-A571 HydrophobicContact CG-CB 4.04Å; M512-A571 HydrophobicContact SD-CB 3.75Å; I565-A571 CarbonylContact O-C 3.54Å; I565-A571 WeakPolarHBondContact O-CA 3.36Å
572	N	96.4	Very high	95.1	Very high	13 Å²	13	17.2 Å²	17.2	7%	0.07	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	111.3	173.8	-175.1	19.5	0	0	0	108.9	S500 Q502 I565 Y570	S500-N572 PolarHBondContact OG-OD1 3.2Å; Q502-N572 HydrophobicContact CG-CB 4.49Å; I565-N572 PolarHBondContact N-O 3.24Å; I565-N572 PolarHBondContact O-N 3.38Å; Y570-N572 HydrophobicContact CE1-CB 3.96Å
573	L	97.1	Very high	95.2	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.1	-179.5	-48.6	-178.9	0	0	0	107.9	L501 M512 L516 K563 C564 I581 L584 L588	L501-L573 HydrophobicContact CB-CB 4.34Å; L501-L573 HydrophobicContact CD2-CD1 4.21Å; L501-L573 PolarHBondContact N-O 2.99Å; L501-L573 PolarHBondContact O-N 2.9Å; M512-L573 HydrophobicContact CE-CD1 4.21Å; M512-L573 HydrophobicContact CE-CD2 4.32Å; L516-L573 HydrophobicContact CD2-CD1 4.34Å; L516-L573 HydrophobicContact CD2-CD2 4.07Å; K563-L573 CarbonylContact O-C 3.56Å; K563-L573 WeakPolarHBondContact O-CA 3.45Å; C564-L573 HydrophobicContact CB-CD2 3.72Å; L573-I581 WeakPolarHBondContact O-CD1 3.31Å; L573-L584 HydrophobicContact CB-CD1 4.33Å; L573-L584 HydrophobicContact CD1-CB 4.45Å; L573-L584 HydrophobicContact CD1-CD1 4.1Å; L573-L584 HydrophobicContact CD1-CD2 4.38Å; L573-L588 HydrophobicContact CD1-CD1 3.48Å; L573-L588 VanDerWaalsContact CD1-CD1 3.48Å
574	Q	95.9	Very high	95.2	Very high	39 Å²	39	16.5 Å²	16.5	18%	0.182	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.4	-175.6	-53.9	-177.8	-64.9	0	0	110.3	W498 N499 L562 K563	W498-Q574 HydrophobicContact CE3-CB 3.86Å; W498-Q574 HydrophobicContact CZ3-CB 4.48Å; N499-Q574 CarbonylContact O-C 3.56Å; N499-Q574 VanDerWaalsContact O-CA 3.22Å; N499-Q574 WeakPolarHBondContact O-CA 3.41Å; L562-Q574 CarbonylContact C-O 3.59Å; L562-Q574 WeakPolarHBondContact CA-O 3.48Å; K563-Q574 HydrophobicContact CB-CB 4.31Å; K563-Q574 PolarHBondContact N-O 2.78Å; K563-Q574 PolarHBondContact O-N 2.91Å
575	S	95.2	Very high	95.2	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	148.3	176.3	-173.8	0	0	0	0	111.6	N499 Q561 N577	N499-S575 WeakPolarHBondContact CB-O 3.29Å; N499-S575 PolarHBondContact N-O 3.23Å; N499-S575 PolarHBondContact ND2-O 3.04Å; N499-S575 PolarHBondContact O-N 3.31Å; Q561-S575 VanDerWaalsContact O-CA 3.22Å; Q561-S575 WeakPolarHBondContact O-CA 3.29Å; Q561-S575 WeakPolarHBondContact O-CB 3.18Å; Q561-S575 PolarHBondContact O-OG 3.44Å; S575-N577 PolarHBondContact OG-N 3.47Å
576	D	92.6	Very high	95.2	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	S	Bend	trans	-77.7	-7.5	170.2	56.1	1.8	0	0	0	113.5	R496 H497 S560 Q561 Y612 M613	R496-D576 IonicContact CZ-OD2 3.43Å; R496-D576 IonicContact NH1-OD2 3.84Å; R496-D576 PolarHBondContact NH1-OD2 2.93Å; H497-D576 VanDerWaalsContact O-CA 3.26Å; H497-D576 WeakPolarHBondContact O-CA 3.45Å; S560-D576 WeakPolarHBondContact CA-OD1 3.24Å; S560-D576 WeakPolarHBondContact CB-OD1 3.19Å; Q561-D576 PolarHBondContact N-OD1 3.33Å; Q561-D576 PolarHBondContact N-OD2 3.18Å; Q561-D576 PolarHBondContact O-N 2.91Å; D576-Y612 HydrophobicContact CB-CD1 4.43Å; D576-Y612 HydrophobicContact CB-CE1 4.07Å; D576-M613 WeakPolarHBondContact O-CG 3.32Å
577	N	93.9	Very high	95.3	Very high	4 Å²	4	22 Å²	22	2%	0.021	11%	0.109	C	C	.	.			trans	-107.2	122.7	173.5	-176.2	16.4	0	0	0	112.2	S575 T579 T580 I581 M613	S575-N577 PolarHBondContact OG-N 3.47Å; N577-T579 PolarHBondContact O-N 2.78Å; N577-T579 PolarHBondContact OD1-N 2.84Å; N577-T580 PolarHBondContact ND2-OG1 2.81Å; N577-T580 VanDerWaalsContact ND2-OG1 3.16Å; N577-T580 WeakPolarHBondContact O-CB 3.39Å; N577-T580 PolarHBondContact O-N 2.93Å; N577-I581 PolarHBondContact O-N 2.65Å; N577-M613 HydrophobicContact CB-CE 4Å; N577-M613 HydrophobicContact CB-CG 4.48Å; N577-M613 HydrophobicContact CB-SD 4.04Å
578	L	93.8	Very high	95.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61.6	-41.1	177.9	-68.9	168.6	0	0	0	112.6	N499 T580 I581 A582 I605 S609 A610 L707 K711 F714	N499-L578 HydrophobicContact CB-CD2 4.25Å; N499-L578 WeakPolarHBondContact ND2-CD2 3.28Å; N499-L578 VanDerWaalsContact OD1-CD2 3.25Å; N499-L578 WeakPolarHBondContact OD1-CD2 3.41Å; L578-T580 VanDerWaalsContact C-N 3.29Å; L578-T580 PolarHBondContact O-N 2.76Å; L578-I581 PolarHBondContact O-N 2.94Å; L578-I581 VanDerWaalsContact O-N 3.14Å; L578-A582 PolarHBondContact O-N 3.4Å; L578-I605 HydrophobicContact CD2-CD1 4.31Å; L578-I605 HydrophobicContact CD2-CG2 3.39Å; L578-S609 WeakPolarHBondContact CG-OG 3.34Å; L578-A610 HydrophobicContact CD1-CB 3.93Å; L578-L707 HydrophobicContact CB-CD1 3.9Å; L578-L707 HydrophobicContact CD1-CD1 4.16Å; L578-L707 HydrophobicContact CG-CD1 4.4Å; L578-K711 HydrophobicContact CD1-CB 4.21Å; L578-F714 HydrophobicContact CB-CE2 4.44Å; L578-F714 HydrophobicContact CD2-CD2 4.4Å
579	T	95.1	Very high	95.4	Very high	18 Å²	18	16 Å²	16	11%	0.11	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-36.7	-178.4	-65.8	0	0	0	0	111.4	N577 I581 A582 I583 L707 D710	N577-T579 PolarHBondContact O-N 2.78Å; N577-T579 PolarHBondContact OD1-N 2.84Å; T579-I581 VanDerWaalsContact C-N 3.32Å; T579-I581 PolarHBondContact O-N 3.29Å; T579-A582 PolarHBondContact O-N 2.96Å; T579-I583 HydrophobicContact CG2-CD1 3.83Å; T579-I583 HydrophobicContact CG2-CG1 4.36Å; T579-I583 VanDerWaalsContact O-CG1 3.29Å; T579-I583 WeakPolarHBondContact O-CG1 3.17Å; T579-I583 PolarHBondContact O-N 2.85Å; T579-L707 WeakPolarHBondContact OG1-CA 3.33Å; T579-L707 PolarHBondContact OG1-N 3.38Å; T579-D710 VanDerWaalsContact CA-OD2 3.29Å; T579-D710 WeakPolarHBondContact CA-OD2 3.42Å; T579-D710 VanDerWaalsContact CB-OD2 3.23Å; T579-D710 WeakPolarHBondContact CB-OD2 3.46Å; T579-D710 VanDerWaalsContact CG2-OD2 3.27Å; T579-D710 WeakPolarHBondContact CG2-OD2 3.37Å; T579-D710 PolarHBondContact OG1-OD2 3.4Å
580	T	96.2	Very high	95.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.4	-44.7	173.7	-58.6	0	0	0	0	111.2	L480 L562 N577 L578 L584	L480-T580 HydrophobicContact CD1-CG2 3.73Å; L480-T580 HydrophobicContact CD2-CG2 4.1Å; L562-T580 HydrophobicContact CD1-CG2 4.3Å; L562-T580 HydrophobicContact CD2-CG2 4.2Å; N577-T580 PolarHBondContact ND2-OG1 2.81Å; N577-T580 VanDerWaalsContact ND2-OG1 3.16Å; N577-T580 WeakPolarHBondContact O-CB 3.39Å; N577-T580 PolarHBondContact O-N 2.93Å; L578-T580 VanDerWaalsContact C-N 3.29Å; L578-T580 PolarHBondContact O-N 2.76Å; T580-L584 HydrophobicContact CG2-CD1 4.16Å; T580-L584 WeakPolarHBondContact O-CG 3.23Å; T580-L584 PolarHBondContact O-N 3.09Å
581	I	96.7	Very high	95.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.7	-39.4	176.7	-62.7	-56.6	0	0	0	111.9	N499 L501 L573 N577 L578 T579 L584 K585 L603 I605 F714	N499-I581 HydrophobicContact CB-CG1 3.93Å; L501-I581 HydrophobicContact CB-CD1 4.27Å; L501-I581 HydrophobicContact CB-CG2 3.86Å; L573-I581 WeakPolarHBondContact O-CD1 3.31Å; N577-I581 PolarHBondContact O-N 2.65Å; L578-I581 PolarHBondContact O-N 2.94Å; L578-I581 VanDerWaalsContact O-N 3.14Å; T579-I581 VanDerWaalsContact C-N 3.32Å; T579-I581 PolarHBondContact O-N 3.29Å; I581-L584 PolarHBondContact O-N 3.19Å; I581-K585 VanDerWaalsContact O-CB 3.31Å; I581-K585 WeakPolarHBondContact O-CB 3.42Å; I581-K585 PolarHBondContact O-N 3.18Å; I581-L603 HydrophobicContact CG2-CD2 4.05Å; I581-I605 HydrophobicContact CG2-CD1 4.29Å; I581-F714 HydrophobicContact CB-CZ 4.47Å; I581-F714 HydrophobicContact CG2-CZ 4.05Å
582	A	95.7	Very high	95.3	Very high	2 Å²	2	20.4 Å²	20.4	2%	0.017	10%	0.102	C	C	.	.	H	α-helix	trans	-61.3	-47	176.9	0	0	0	0	0	111.7	L578 T579 K585 D586 D710 F714	L578-A582 PolarHBondContact O-N 3.4Å; T579-A582 PolarHBondContact O-N 2.96Å; A582-K585 PolarHBondContact O-N 3.27Å; A582-D586 PolarHBondContact O-N 2.95Å; A582-D586 VanDerWaalsContact O-N 3.08Å; A582-D710 HydrophobicContact CB-CB 4.15Å; A582-D710 WeakPolarHBondContact CB-OD1 3.24Å; A582-F714 HydrophobicContact CB-CE2 3.89Å; A582-F714 HydrophobicContact CB-CZ 3.78Å
583	I	96.6	Very high	95.2	Very high	18 Å²	18	24.6 Å²	24.6	9%	0.092	13%	0.128	C	C	.	.	H	α-helix	trans	-60.6	-49.3	176.9	-66.7	164.4	0	0	0	110.5	E448 P479 L480 T579 K585 D586 V587	E448-I583 HydrophobicContact CB-CD1 4.02Å; P479-I583 HydrophobicContact CB-CG2 3.79Å; L480-I583 HydrophobicContact CD2-CB 4.1Å; L480-I583 HydrophobicContact CD2-CD1 3.89Å; L480-I583 HydrophobicContact CD2-CG2 3.86Å; L480-I583 HydrophobicContact CG-CG2 4.28Å; T579-I583 HydrophobicContact CG2-CD1 3.83Å; T579-I583 HydrophobicContact CG2-CG1 4.36Å; T579-I583 VanDerWaalsContact O-CG1 3.29Å; T579-I583 WeakPolarHBondContact O-CG1 3.17Å; T579-I583 PolarHBondContact O-N 2.85Å; I583-K585 PolarHBondContact O-N 2.96Å; I583-D586 PolarHBondContact O-N 3.43Å; I583-V587 HydrophobicContact CG2-CG2 4.33Å; I583-V587 WeakPolarHBondContact O-CG2 3.22Å; I583-V587 PolarHBondContact O-N 3.5Å
584	L	97	Very high	95.1	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-59.4	-46.5	179.2	-75.3	168.1	0	0	0	111.7	L480 L501 C519 L562 L573 T580 I581 D586 V587 L588	L480-L584 HydrophobicContact CD1-CD1 4.09Å; L480-L584 HydrophobicContact CD1-CD2 3.75Å; L480-L584 HydrophobicContact CD1-CG 3.78Å; L501-L584 HydrophobicContact CD2-CB 3.91Å; C519-L584 HydrophobicContact CB-CD2 4.15Å; L562-L584 HydrophobicContact CD1-CD1 3.76Å; L562-L584 HydrophobicContact CD2-CD1 4.08Å; L573-L584 HydrophobicContact CB-CD1 4.33Å; L573-L584 HydrophobicContact CD1-CB 4.45Å; L573-L584 HydrophobicContact CD1-CD1 4.1Å; L573-L584 HydrophobicContact CD1-CD2 4.38Å; T580-L584 HydrophobicContact CG2-CD1 4.16Å; T580-L584 WeakPolarHBondContact O-CG 3.23Å; T580-L584 PolarHBondContact O-N 3.09Å; I581-L584 PolarHBondContact O-N 3.19Å; L584-D586 VanDerWaalsContact C-N 3.31Å; L584-D586 PolarHBondContact O-N 3.32Å; L584-V587 PolarHBondContact O-N 3.26Å; L584-L588 HydrophobicContact CB-CD1 4.31Å; L584-L588 HydrophobicContact CD2-CD1 4.48Å; L584-L588 WeakPolarHBondContact O-CB 3.4Å; L584-L588 WeakPolarHBondContact O-CD1 3.37Å; L584-L588 WeakPolarHBondContact O-CG 3.43Å; L584-L588 PolarHBondContact O-N 3.37Å
585	K	95.8	Very high	94.9	Very high	56 Å²	56	34.5 Å²	34.5	24%	0.243	17%	0.166	C	C	.	.	H	α-helix	trans	-55.2	-48.9	177.5	179.9	-164.6	173.2	-171.2	0	110.9	L501 I581 A582 I583 T589 L603 F714	L501-K585 HydrophobicContact CD1-CB 4.36Å; L501-K585 HydrophobicContact CD1-CG 4.5Å; L501-K585 HydrophobicContact CD2-CB 4.13Å; I581-K585 VanDerWaalsContact O-CB 3.31Å; I581-K585 WeakPolarHBondContact O-CB 3.42Å; I581-K585 PolarHBondContact O-N 3.18Å; A582-K585 PolarHBondContact O-N 3.27Å; I583-K585 PolarHBondContact O-N 2.96Å; K585-T589 WeakPolarHBondContact O-CB 3.33Å; K585-T589 PolarHBondContact O-N 2.98Å; K585-T589 PolarHBondContact O-OG1 3.4Å; K585-L603 HydrophobicContact CD-CD1 4.12Å; K585-F714 HydrophobicContact CD-CE1 4.37Å
586	D	95.2	Very high	94.8	Very high	63 Å²	63	43.6 Å²	43.6	34%	0.337	21%	0.205	S	C	.	.	H	α-helix	trans	-66.3	-47.1	-175.9	-71.7	-15.5	0	0	0	112.1	A582 I583 L584 K590 R713	A582-D586 PolarHBondContact O-N 2.95Å; A582-D586 VanDerWaalsContact O-N 3.08Å; I583-D586 PolarHBondContact O-N 3.43Å; L584-D586 VanDerWaalsContact C-N 3.31Å; L584-D586 PolarHBondContact O-N 3.32Å; D586-K590 WeakPolarHBondContact O-CB 3.3Å; D586-K590 PolarHBondContact O-N 3.01Å; D586-R713 IonicContact OD1-CZ 3.94Å; D586-R713 IonicContact OD1-NH1 2.71Å; D586-R713 IonicContact OD1-NH2 3.63Å; D586-R713 PolarHBondContact OD1-NH2 3.11Å; D586-R713 IonicContact OD2-CZ 2.53Å; D586-R713 VanDerWaalsContact OD2-CZ 3.28Å; D586-R713 IonicContact OD2-NH1 2.93Å; D586-R713 PolarHBondContact OD2-NH1 2.78Å; D586-R713 IonicContact OD2-NH2 3.28Å; D586-R713 PolarHBondContact OD2-NH2 2.84Å
587	V	95.7	Very high	94.8	Very high	10 Å²	10	44.5 Å²	44.5	6%	0.061	21%	0.21	C	C	.	.	H	α-helix	trans	-67.8	-46.3	-178.2	178.4	0	0	0	0	111.2	Y451 P479 C519 I583 L584 T589 K590 E591	Y451-V587 HydrophobicContact CD1-CG2 4.38Å; Y451-V587 HydrophobicContact CE1-CG2 3.85Å; P479-V587 HydrophobicContact CB-CG2 3.91Å; P479-V587 HydrophobicContact CG-CB 4.5Å; P479-V587 HydrophobicContact CG-CG1 4.04Å; P479-V587 HydrophobicContact CG-CG2 3.86Å; C519-V587 VanDerWaalsContact SG-CG1 3.56Å; I583-V587 HydrophobicContact CG2-CG2 4.33Å; I583-V587 WeakPolarHBondContact O-CG2 3.22Å; I583-V587 PolarHBondContact O-N 3.5Å; L584-V587 PolarHBondContact O-N 3.26Å; V587-T589 PolarHBondContact O-N 3Å; V587-K590 WeakPolarHBondContact O-CB 3.3Å; V587-K590 PolarHBondContact O-N 3.03Å; V587-E591 PolarHBondContact O-N 2.77Å
588	L	96.2	Very high	94.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-38.3	-178.9	-64.5	173.3	0	0	0	111.6	L501 L503 M512 W515 L573 L584 K590 E591 A592	L501-L588 HydrophobicContact CD2-CD1 4.49Å; L503-L588 HydrophobicContact CD1-CB 4.27Å; L503-L588 HydrophobicContact CD1-CD1 3.62Å; M512-L588 HydrophobicContact CE-CD1 4.23Å; M512-L588 HydrophobicContact CE-CD2 4.46Å; W515-L588 HydrophobicContact CB-CD2 3.61Å; W515-L588 HydrophobicContact CE3-CD2 4.41Å; W515-L588 HydrophobicContact CG-CD2 4.34Å; L573-L588 HydrophobicContact CD1-CD1 3.48Å; L573-L588 VanDerWaalsContact CD1-CD1 3.48Å; L584-L588 HydrophobicContact CB-CD1 4.31Å; L584-L588 HydrophobicContact CD2-CD1 4.48Å; L584-L588 WeakPolarHBondContact O-CB 3.4Å; L584-L588 WeakPolarHBondContact O-CD1 3.37Å; L584-L588 WeakPolarHBondContact O-CG 3.43Å; L584-L588 PolarHBondContact O-N 3.37Å; L588-K590 VanDerWaalsContact C-N 3.34Å; L588-K590 PolarHBondContact O-N 3.03Å; L588-E591 PolarHBondContact O-N 3.27Å; L588-A592 WeakPolarHBondContact O-CB 3.43Å; L588-A592 PolarHBondContact O-N 3.35Å
589	T	94.8	Very high	94.6	Very high	50 Å²	50	53.9 Å²	53.9	31%	0.307	26%	0.255	S	S	.	.	H	α-helix	trans	-64	-41.3	174.7	-56.4	0	0	0	0	111.3	K585 V587 T593 I601	K585-T589 WeakPolarHBondContact O-CB 3.33Å; K585-T589 PolarHBondContact O-N 2.98Å; K585-T589 PolarHBondContact O-OG1 3.4Å; V587-T589 PolarHBondContact O-N 3Å; T589-T593 WeakPolarHBondContact O-CB 3.12Å; T589-T593 PolarHBondContact O-N 3.11Å; T589-T593 PolarHBondContact O-OG1 3.4Å; T589-I601 HydrophobicContact CG2-CD1 4.48Å; T589-I601 VanDerWaalsContact OG1-CD1 3.28Å; T589-I601 WeakPolarHBondContact OG1-CD1 3.41Å
590	K	94.4	Very high	94.6	Very high	127 Å²	127	57.6 Å²	57.6	55%	0.552	28%	0.278	S	S	*	.	H	α-helix	trans	-63.9	-44.4	176.6	-176.4	177.1	172.9	-175.4	0	111.6	Y451 D586 V587 L588 T593 R594	Y451-K590 WeakPolarHBondContact OH-CD 3.42Å; Y451-K590 PolarHBondContact OH-NZ 2.8Å; D586-K590 WeakPolarHBondContact O-CB 3.3Å; D586-K590 PolarHBondContact O-N 3.01Å; V587-K590 WeakPolarHBondContact O-CB 3.3Å; V587-K590 PolarHBondContact O-N 3.03Å; L588-K590 VanDerWaalsContact C-N 3.34Å; L588-K590 PolarHBondContact O-N 3.03Å; K590-T593 PolarHBondContact O-N 3.08Å; K590-R594 WeakPolarHBondContact O-CB 3.3Å; K590-R594 PolarHBondContact O-N 2.77Å
591	E	93.8	Very high	94.6	Very high	25 Å²	25	60.4 Å²	60.4	12%	0.117	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-40.8	177.5	-78.9	-58	120.3	0	0	113	W515 V587 L588 R594 K595	W515-E591 HydrophobicContact CG-CB 4.48Å; V587-E591 PolarHBondContact O-N 2.77Å; L588-E591 PolarHBondContact O-N 3.27Å; E591-R594 WeakPolarHBondContact O-CB 3.1Å; E591-R594 PolarHBondContact O-N 3.46Å; E591-R594 IonicContact OE1-CZ 2.7Å; E591-R594 IonicContact OE1-NE 3.18Å; E591-R594 PolarHBondContact OE1-NE 3.18Å; E591-R594 IonicContact OE1-NH2 2.99Å; E591-R594 IonicContact OE2-CZ 3.84Å; E591-R594 VanDerWaalsContact OE2-CZ 3.27Å; E591-R594 IonicContact OE2-NE 3.96Å; E591-R594 PolarHBondContact OE2-NE 2.82Å; E591-R594 IonicContact OE2-NH2 3.98Å; E591-R594 PolarHBondContact OE2-NH2 2.79Å; E591-K595 PolarHBondContact O-N 3.42Å
592	A	94	Very high	94.5	Very high	3 Å²	3	64.6 Å²	64.6	3%	0.025	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-44.1	174	0	0	0	0	0	111.9	W515 L588 R594 K595 K596 I597 L599	W515-A592 HydrophobicContact CH2-CB 3.89Å; W515-A592 HydrophobicContact CZ2-CB 4.18Å; L588-A592 WeakPolarHBondContact O-CB 3.43Å; L588-A592 PolarHBondContact O-N 3.35Å; A592-R594 VanDerWaalsContact C-N 3.34Å; A592-R594 PolarHBondContact O-N 2.84Å; A592-K595 CarbonylContact O-C 3.59Å; A592-K595 PolarHBondContact O-N 3.05Å; A592-K596 PolarHBondContact O-N 3.18Å; A592-I597 HydrophobicContact CB-CB 4.42Å; A592-I597 PolarHBondContact O-N 3.24Å; A592-L599 HydrophobicContact CB-CD1 3.31Å; A592-L599 HydrophobicContact CB-CG 3.64Å
593	T	94.3	Very high	94.4	Very high	100 Å²	100	67.2 Å²	67.2	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-61.5	-43.1	176	-55.4	0	0	0	0	111.3	T589 K590 K595 K596	T589-T593 WeakPolarHBondContact O-CB 3.12Å; T589-T593 PolarHBondContact O-N 3.11Å; T589-T593 PolarHBondContact O-OG1 3.4Å; K590-T593 PolarHBondContact O-N 3.08Å; T593-K595 VanDerWaalsContact C-N 3.29Å; T593-K595 PolarHBondContact O-N 3.31Å; T593-K596 PolarHBondContact O-N 3.28Å; T593-K596 VanDerWaalsContact O-N 3.07Å
594	R	93.8	Very high	94.3	Very high	167 Å²	167	70.7 Å²	70.7	63%	0.63	35%	0.347	S	S	*	.	H	α-helix	trans	-58.9	-39.6	176.5	-172.4	178.9	72.6	94.7	-2.9	112.3	K590 E591 A592	K590-R594 WeakPolarHBondContact O-CB 3.3Å; K590-R594 PolarHBondContact O-N 2.77Å; E591-R594 WeakPolarHBondContact O-CB 3.1Å; E591-R594 PolarHBondContact O-N 3.46Å; E591-R594 IonicContact OE1-CZ 2.7Å; E591-R594 IonicContact OE1-NE 3.18Å; E591-R594 PolarHBondContact OE1-NE 3.18Å; E591-R594 IonicContact OE1-NH2 2.99Å; E591-R594 IonicContact OE2-CZ 3.84Å; E591-R594 VanDerWaalsContact OE2-CZ 3.27Å; E591-R594 IonicContact OE2-NE 3.96Å; E591-R594 PolarHBondContact OE2-NE 2.82Å; E591-R594 IonicContact OE2-NH2 3.98Å; E591-R594 PolarHBondContact OE2-NH2 2.79Å; A592-R594 VanDerWaalsContact C-N 3.34Å; A592-R594 PolarHBondContact O-N 2.84Å
595	K	92.6	Very high	94.1	Very high	80 Å²	80	72.2 Å²	72.2	35%	0.348	35%	0.354	S	S	.	.	H	α-helix	trans	-87.7	0.6	176.6	-71.8	-167.4	172.3	-174.3	0	114.5	W515 E591 A592 T593 I597	W515-K595 HydrophobicContact CZ2-CD 4.46Å; E591-K595 PolarHBondContact O-N 3.42Å; A592-K595 CarbonylContact O-C 3.59Å; A592-K595 PolarHBondContact O-N 3.05Å; T593-K595 VanDerWaalsContact C-N 3.29Å; T593-K595 PolarHBondContact O-N 3.31Å; K595-I597 VanDerWaalsContact C-N 3.25Å; K595-I597 HydrophobicContact CB-CD1 4.01Å; K595-I597 HydrophobicContact CB-CG1 4.01Å; K595-I597 HydrophobicContact CD-CD1 4.35Å; K595-I597 PolarHBondContact O-N 3.18Å
596	K	93	Very high	93.8	Very high	191 Å²	191	73.2 Å²	73.2	83%	0.83	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	34.3	-175.4	-53.8	178.8	179.2	178.7	0	113.6	A592 T593	A592-K596 PolarHBondContact O-N 3.18Å; T593-K596 PolarHBondContact O-N 3.28Å; T593-K596 VanDerWaalsContact O-N 3.07Å
597	I	92.2	Very high	93.3	Very high	20 Å²	20	73 Å²	73	10%	0.103	36%	0.358	C	S	.	.			trans	-91.9	130.7	175.5	-64.2	179.5	0	0	0	108.5	N506 F507 W515 A592 K595 L599	N506-I597 WeakPolarHBondContact OD1-CG2 3.31Å; F507-I597 HydrophobicContact CB-CD1 4.35Å; F507-I597 HydrophobicContact CB-CG2 4.24Å; W515-I597 HydrophobicContact CH2-CB 4.36Å; W515-I597 HydrophobicContact CH2-CD1 3.98Å; W515-I597 HydrophobicContact CH2-CG2 4.13Å; W515-I597 HydrophobicContact CZ2-CD1 3.79Å; A592-I597 HydrophobicContact CB-CB 4.42Å; A592-I597 PolarHBondContact O-N 3.24Å; K595-I597 VanDerWaalsContact C-N 3.25Å; K595-I597 HydrophobicContact CB-CD1 4.01Å; K595-I597 HydrophobicContact CB-CG1 4.01Å; K595-I597 HydrophobicContact CD-CD1 4.35Å; K595-I597 PolarHBondContact O-N 3.18Å; I597-L599 HydrophobicContact CG2-CD2 4.14Å
598	Q	91.9	Very high	92.9	Very high	164 Å²	164	77.5 Å²	77.5	77%	0.766	38%	0.381	S	S	*	.			trans	-86.3	121.5	177.5	-68.2	-178	-4.4	0	0	109.3	G505 N506	G505-Q598 WeakPolarHBondContact CA-O 3.42Å; N506-Q598 PolarHBondContact OD1-N 3.29Å
599	L	92.7	Very high	92.7	Very high	37 Å²	37	77.5 Å²	77.5	19%	0.194	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.2	177.5	-65.5	-176.5	0	0	0	110.7	T504 F507 W515 A592 I597 I601	T504-L599 WeakPolarHBondContact O-CA 3.41Å; F507-L599 HydrophobicContact CD1-CD2 3.46Å; F507-L599 VanDerWaalsContact CD1-CD2 3.46Å; F507-L599 HydrophobicContact CE1-CD2 3.57Å; W515-L599 HydrophobicContact CH2-CD1 4.47Å; W515-L599 HydrophobicContact CH2-CD2 4.41Å; W515-L599 HydrophobicContact CZ3-CD1 4.32Å; W515-L599 HydrophobicContact CZ3-CD2 4.32Å; A592-L599 HydrophobicContact CB-CD1 3.31Å; A592-L599 HydrophobicContact CB-CG 3.64Å; I597-L599 HydrophobicContact CG2-CD2 4.14Å; L599-I601 HydrophobicContact CB-CG1 4.41Å
600	T	95.1	Very high	92.5	Very high	96 Å²	96	75.1 Å²	75.1	59%	0.589	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.7	163	-59.3	0	0	0	0	107.7	T504	T504-T600 PolarHBondContact N-O 3.18Å; T504-T600 PolarHBondContact O-N 3.01Å; T504-T600 WeakPolarHBondContact OG1-CB 3.27Å; T504-T600 PolarHBondContact OG1-O 3.21Å
601	I	94.6	Very high	92.4	Very high	59 Å²	59	71.7 Å²	71.7	30%	0.303	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122	-176.1	-53.9	179.5	0	0	0	108.4	L501 Q502 L503 T589 L599 L603	L501-I601 HydrophobicContact CD1-CG2 3.54Å; Q502-I601 WeakPolarHBondContact O-CA 3.46Å; L503-I601 HydrophobicContact CD2-CB 4.28Å; L503-I601 HydrophobicContact CD2-CD1 4.43Å; L503-I601 HydrophobicContact CD2-CG1 3.76Å; L503-I601 HydrophobicContact CD2-CG2 4.11Å; T589-I601 HydrophobicContact CG2-CD1 4.48Å; T589-I601 VanDerWaalsContact OG1-CD1 3.28Å; T589-I601 WeakPolarHBondContact OG1-CD1 3.41Å; L599-I601 HydrophobicContact CB-CG1 4.41Å; I601-L603 HydrophobicContact CG2-CG 4.26Å
602	N	95.3	Very high	92.1	Very high	88 Å²	88	71.4 Å²	71.4	47%	0.471	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.5	171.5	-175.8	28.2	0	0	0	109.3	Q502	Q502-N602 HydrophobicContact CB-CB 4.12Å; Q502-N602 PolarHBondContact N-O 3.02Å; Q502-N602 PolarHBondContact O-N 3.28Å; Q502-N602 PolarHBondContact OE1-ND2 2.89Å; Q502-N602 VanDerWaalsContact OE1-ND2 3.17Å
603	L	93.6	Very high	92	Very high	56 Å²	56	71.3 Å²	71.3	29%	0.293	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.6	-175.3	-73.5	167.1	0	0	0	108.8	S500 L501 I581 K585 I601 I605 F714	S500-L603 WeakPolarHBondContact O-CA 3.35Å; L501-L603 HydrophobicContact CB-CD2 4.22Å; L501-L603 HydrophobicContact CD1-CD2 3.59Å; L501-L603 HydrophobicContact CD1-CG 4.41Å; I581-L603 HydrophobicContact CG2-CD2 4.05Å; K585-L603 HydrophobicContact CD-CD1 4.12Å; I601-L603 HydrophobicContact CG2-CG 4.26Å; L603-I605 HydrophobicContact CB-CG1 4.26Å; L603-I605 HydrophobicContact CD2-CD1 4.37Å; L603-F714 HydrophobicContact CD1-CD1 4.05Å; L603-F714 HydrophobicContact CD1-CE1 3.89Å; L603-F714 HydrophobicContact CD2-CE1 4.16Å
604	D	94	Very high	91.9	Very high	92 Å²	92	66.6 Å²	66.6	49%	0.492	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	104.8	169.8	178.3	18.5	0	0	0	107.8	N499 S500	N499-D604 CarbonylContact C-O 3.39Å; N499-D604 WeakPolarHBondContact CA-O 3.47Å; S500-D604 PolarHBondContact N-O 2.85Å; S500-D604 PolarHBondContact O-N 2.76Å
605	I	92.5	Very high	91.7	Very high	32 Å²	32	64.4 Å²	64.4	16%	0.164	31%	0.312	C	S	.	.			trans	-114.7	120.6	-169.9	-60.1	-60.2	0	0	0	109.3	N499 L578 I581 L603 M607 F714	N499-I605 HydrophobicContact CB-CD1 4.05Å; L578-I605 HydrophobicContact CD2-CD1 4.31Å; L578-I605 HydrophobicContact CD2-CG2 3.39Å; I581-I605 HydrophobicContact CG2-CD1 4.29Å; L603-I605 HydrophobicContact CB-CG1 4.26Å; L603-I605 HydrophobicContact CD2-CD1 4.37Å; I605-M607 HydrophobicContact CB-CE 4.4Å; I605-M607 HydrophobicContact CG2-CE 3.81Å; I605-M607 HydrophobicContact CG2-SD 4.26Å; I605-F714 HydrophobicContact CD1-CD1 4.29Å; I605-F714 HydrophobicContact CD1-CD2 4.48Å; I605-F714 HydrophobicContact CD1-CE1 4.24Å; I605-F714 HydrophobicContact CD1-CE2 4.44Å; I605-F714 HydrophobicContact CD1-CG 4.42Å; I605-F714 HydrophobicContact CD1-CZ 4.31Å; I605-F714 HydrophobicContact CG1-CB 4.48Å; I605-F714 HydrophobicContact CG1-CD1 4.13Å; I605-F714 HydrophobicContact CG1-CG 4.19Å; I605-F714 HydrophobicContact CG2-CB 4.5Å
606	Q	90.5	Very high	91.5	Very high	77 Å²	77	62.8 Å²	62.8	36%	0.36	31%	0.307	S	S	.	.			trans	-92.8	106.6	174.5	-64.7	-174.1	-15.9	0	0	108.6	H497 W498 N499 D608 S609	H497-Q606 HydrophobicContact CB-CB 4.42Å; H497-Q606 VanDerWaalsContact CB-OE1 3.3Å; W498-Q606 VanDerWaalsContact N-OE1 3.13Å; N499-Q606 PolarHBondContact OD1-N 3.39Å; N499-Q606 PolarHBondContact OD1-O 3.07Å; Q606-D608 PolarHBondContact O-N 2.92Å; Q606-D608 VanDerWaalsContact O-N 3.17Å; Q606-S609 WeakPolarHBondContact O-CB 3.32Å; Q606-S609 PolarHBondContact O-N 3.28Å; Q606-S609 PolarHBondContact O-OG 3.04Å
607	M	84.8	Confident	91.3	Very high	59 Å²	59	54.1 Å²	54.1	29%	0.291	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-28.3	-176.3	-65.6	-64.7	162.5	0	0	112.9	I605 S609 A610 K711 Q715	I605-M607 HydrophobicContact CB-CE 4.4Å; I605-M607 HydrophobicContact CG2-CE 3.81Å; I605-M607 HydrophobicContact CG2-SD 4.26Å; M607-S609 PolarHBondContact O-N 3.16Å; M607-A610 PolarHBondContact O-N 2.78Å; M607-K711 HydrophobicContact SD-CG 4.2Å; M607-Q715 HydrophobicContact CE-CG 3.54Å; M607-Q715 HydrophobicContact SD-CG 4.02Å; M607-Q715 PolarHBondContact SD-NE2 2.81Å
608	D	87.5	Confident	91.2	Very high	105 Å²	105	54.6 Å²	54.6	56%	0.561	27%	0.272	S	S	*	.	H	α-helix	trans	-68.3	-12.7	175.8	-57	-21.3	0	0	0	112.9	H497 Q606 A610 E611 Y612	H497-D608 VanDerWaalsContact ND1-C 3.29Å; H497-D608 PolarHBondContact ND1-O 3.25Å; H497-D608 VanDerWaalsContact ND1-O 3.15Å; Q606-D608 PolarHBondContact O-N 2.92Å; Q606-D608 VanDerWaalsContact O-N 3.17Å; D608-A610 PolarHBondContact O-N 3.37Å; D608-E611 PolarHBondContact O-N 3.05Å; D608-Y612 PolarHBondContact O-N 2.81Å; D608-Y612 VanDerWaalsContact O-N 3.09Å
609	S	90.6	Very high	91.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-64.9	-29.1	173.1	65.5	0	0	0	0	112.4	N499 L578 Q606 M607 Y612 M613	N499-S609 VanDerWaalsContact ND2-CB 3.29Å; N499-S609 WeakPolarHBondContact ND2-CB 3.4Å; N499-S609 PolarHBondContact ND2-OG 2.93Å; N499-S609 PolarHBondContact OD1-OG 3.17Å; L578-S609 WeakPolarHBondContact CG-OG 3.34Å; Q606-S609 WeakPolarHBondContact O-CB 3.32Å; Q606-S609 PolarHBondContact O-N 3.28Å; Q606-S609 PolarHBondContact O-OG 3.04Å; M607-S609 PolarHBondContact O-N 3.16Å; S609-Y612 PolarHBondContact O-N 2.84Å; S609-M613 WeakPolarHBondContact O-CB 3.38Å; S609-M613 WeakPolarHBondContact O-CG 3.09Å; S609-M613 PolarHBondContact O-N 2.69Å
610	A	91.3	Very high	90.9	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-44.7	175.1	0	0	0	0	0	111	L578 M607 D608 M613 L614 K711 F742	L578-A610 HydrophobicContact CD1-CB 3.93Å; M607-A610 PolarHBondContact O-N 2.78Å; D608-A610 PolarHBondContact O-N 3.37Å; A610-M613 PolarHBondContact O-N 3.24Å; A610-L614 WeakPolarHBondContact O-CG 3.33Å; A610-L614 PolarHBondContact O-N 2.89Å; A610-K711 HydrophobicContact CB-CD 3.99Å; A610-F742 HydrophobicContact CB-CD1 4.32Å
611	E	91.3	Very high	90.6	Very high	55 Å²	55	49.3 Å²	49.3	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-64.7	-43.9	176	-175.2	179.5	148.9	0	0	111.3	D608 M613 L614 R615 I739	D608-E611 PolarHBondContact O-N 3.05Å; E611-M613 VanDerWaalsContact C-N 3.31Å; E611-M613 PolarHBondContact O-N 3.06Å; E611-L614 PolarHBondContact O-N 3.22Å; E611-R615 WeakPolarHBondContact O-CG 3.17Å; E611-R615 PolarHBondContact O-N 2.94Å; E611-R615 IonicContact OE1-CZ 2.78Å; E611-R615 VanDerWaalsContact OE1-CZ 3.22Å; E611-R615 IonicContact OE1-NE 3.22Å; E611-R615 PolarHBondContact OE1-NE 3.05Å; E611-R615 IonicContact OE1-NH2 3.12Å; E611-R615 PolarHBondContact OE1-NH2 2.75Å; E611-I739 HydrophobicContact CG-CD1 3.97Å; E611-I739 HydrophobicContact CG-CG1 4.22Å; E611-I739 HydrophobicContact CG-CG2 4.21Å
612	Y	89.4	Confident	90.4	Very high	18 Å²	18	49.6 Å²	49.6	7%	0.071	25%	0.248	C	C	.	.	H	α-helix	trans	-54.1	-47.6	174.7	173.3	-96.6	0	0	0	111.8	L494 R496 D576 D608 S609 R615 M616	L494-Y612 HydrophobicContact CB-CE2 4.03Å; L494-Y612 HydrophobicContact CD1-CE2 4.47Å; R496-Y612 PolarHBondContact NH1-OH 2.89Å; D576-Y612 HydrophobicContact CB-CD1 4.43Å; D576-Y612 HydrophobicContact CB-CE1 4.07Å; D608-Y612 PolarHBondContact O-N 2.81Å; D608-Y612 VanDerWaalsContact O-N 3.09Å; S609-Y612 PolarHBondContact O-N 2.84Å; Y612-R615 PolarHBondContact O-N 3.25Å; Y612-M616 HydrophobicContact CD1-CG 4.43Å; Y612-M616 HydrophobicContact CD1-SD 4.16Å; Y612-M616 HydrophobicContact CE1-CG 3.95Å; Y612-M616 HydrophobicContact CE1-SD 3.27Å; Y612-M616 WeakPolarHBondContact CE1-SD 3.49Å; Y612-M616 HydrophobicContact CE2-CG 4.4Å; Y612-M616 HydrophobicContact CE2-SD 4.46Å; Y612-M616 PolarHBondContact O-N 3.06Å; Y612-M616 PolarHBondContact OH-SD 2.85Å
613	M	90.6	Very high	90.2	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-42.2	177.3	-76.2	-61.6	-59.8	0	0	112.8	L558 D576 N577 S609 A610 E611 R615 M616 I617 L707	L558-M613 HydrophobicContact CB-CE 3.97Å; L558-M613 HydrophobicContact CD1-CE 4Å; D576-M613 WeakPolarHBondContact O-CG 3.32Å; N577-M613 HydrophobicContact CB-CE 4Å; N577-M613 HydrophobicContact CB-CG 4.48Å; N577-M613 HydrophobicContact CB-SD 4.04Å; S609-M613 WeakPolarHBondContact O-CB 3.38Å; S609-M613 WeakPolarHBondContact O-CG 3.09Å; S609-M613 PolarHBondContact O-N 2.69Å; A610-M613 PolarHBondContact O-N 3.24Å; E611-M613 VanDerWaalsContact C-N 3.31Å; E611-M613 PolarHBondContact O-N 3.06Å; M613-R615 VanDerWaalsContact C-N 3.32Å; M613-R615 PolarHBondContact O-N 3.49Å; M613-M616 PolarHBondContact O-N 3.47Å; M613-I617 HydrophobicContact CE-CD1 4.22Å; M613-I617 WeakPolarHBondContact O-CD1 3.28Å; M613-I617 VanDerWaalsContact O-CG1 3.28Å; M613-I617 WeakPolarHBondContact O-CG1 3.49Å; M613-I617 PolarHBondContact O-N 3.13Å; M613-I617 VanDerWaalsContact O-N 3.12Å; M613-L707 HydrophobicContact CB-CD2 3.97Å
614	L	92.1	Very high	89.9	Confident	2 Å²	2	47 Å²	47	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-60.6	-42.9	175.8	-69.8	176.4	0	0	0	111.4	A610 E611 I617 D618 I704 L707 L735 L738 I739 F742	A610-L614 WeakPolarHBondContact O-CG 3.33Å; A610-L614 PolarHBondContact O-N 2.89Å; E611-L614 PolarHBondContact O-N 3.22Å; L614-I617 PolarHBondContact O-N 3.42Å; L614-D618 PolarHBondContact O-N 3.32Å; L614-I704 HydrophobicContact CD2-CG1 4.19Å; L614-I704 HydrophobicContact CD2-CG2 4.08Å; L614-L707 HydrophobicContact CD2-CD2 4.34Å; L614-L707 HydrophobicContact CG-CD2 4.43Å; L614-L735 HydrophobicContact CB-CD1 4.23Å; L614-L738 HydrophobicContact CD1-CD2 4.34Å; L614-L738 HydrophobicContact CD1-CG 4.24Å; L614-L738 HydrophobicContact CD2-CD2 3.81Å; L614-L738 HydrophobicContact CD2-CG 4.47Å; L614-I739 HydrophobicContact CD1-CG1 4.26Å; L614-F742 HydrophobicContact CD1-CD1 4.1Å; L614-F742 HydrophobicContact CD1-CD2 4Å; L614-F742 HydrophobicContact CD1-CE1 4.23Å; L614-F742 HydrophobicContact CD1-CE2 4.13Å; L614-F742 HydrophobicContact CD1-CG 3.97Å; L614-F742 HydrophobicContact CD1-CZ 4.24Å; L614-F742 HydrophobicContact CD2-CE2 4.48Å; L614-F742 HydrophobicContact CD2-CZ 4.27Å
615	R	90.9	Very high	89.6	Confident	120 Å²	120	44 Å²	44	45%	0.453	21%	0.211	S	C	.	.	H	α-helix	trans	-65.5	-36.8	176.7	-68.8	-178.9	-176.7	-69.3	-0.2	112.6	E611 Y612 M613 I617 D618 L735	E611-R615 WeakPolarHBondContact O-CG 3.17Å; E611-R615 PolarHBondContact O-N 2.94Å; E611-R615 IonicContact OE1-CZ 2.78Å; E611-R615 VanDerWaalsContact OE1-CZ 3.22Å; E611-R615 IonicContact OE1-NE 3.22Å; E611-R615 PolarHBondContact OE1-NE 3.05Å; E611-R615 IonicContact OE1-NH2 3.12Å; E611-R615 PolarHBondContact OE1-NH2 2.75Å; Y612-R615 PolarHBondContact O-N 3.25Å; M613-R615 VanDerWaalsContact C-N 3.32Å; M613-R615 PolarHBondContact O-N 3.49Å; R615-I617 VanDerWaalsContact C-N 3.34Å; R615-D618 WeakPolarHBondContact O-CB 3.47Å; R615-L735 HydrophobicContact CG-CD2 4.42Å
616	M	87.3	Confident	89.4	Confident	46 Å²	46	46.5 Å²	46.5	23%	0.227	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-38.6	175.2	-79	-164.2	71.3	0	0	112.8	K559 Y612 M613	K559-M616 HydrophobicContact CB-CE 3.99Å; Y612-M616 HydrophobicContact CD1-CG 4.43Å; Y612-M616 HydrophobicContact CD1-SD 4.16Å; Y612-M616 HydrophobicContact CE1-CG 3.95Å; Y612-M616 HydrophobicContact CE1-SD 3.27Å; Y612-M616 WeakPolarHBondContact CE1-SD 3.49Å; Y612-M616 HydrophobicContact CE2-CG 4.4Å; Y612-M616 HydrophobicContact CE2-SD 4.46Å; Y612-M616 PolarHBondContact O-N 3.06Å; Y612-M616 PolarHBondContact OH-SD 2.85Å; M613-M616 PolarHBondContact O-N 3.47Å
617	I	89.4	Confident	89.4	Confident	9 Å²	9	43 Å²	43	5%	0.046	21%	0.206	C	C	.	.	H	α-helix	trans	-83.3	-22	-175.5	-61.9	164	0	0	0	111.7	L558 M613 L614 R615 T619 K620 L621 Y700	L558-I617 HydrophobicContact CD2-CD1 3.75Å; L558-I617 HydrophobicContact CD2-CG1 4.19Å; M613-I617 HydrophobicContact CE-CD1 4.22Å; M613-I617 WeakPolarHBondContact O-CD1 3.28Å; M613-I617 VanDerWaalsContact O-CG1 3.28Å; M613-I617 WeakPolarHBondContact O-CG1 3.49Å; M613-I617 PolarHBondContact O-N 3.13Å; M613-I617 VanDerWaalsContact O-N 3.12Å; L614-I617 PolarHBondContact O-N 3.42Å; R615-I617 VanDerWaalsContact C-N 3.34Å; I617-T619 PolarHBondContact O-N 3.1Å; I617-K620 PolarHBondContact O-N 2.92Å; I617-L621 HydrophobicContact CG2-CD1 3.64Å; I617-L621 HydrophobicContact CG2-CG 3.77Å; I617-L621 PolarHBondContact O-N 2.88Å; I617-Y700 HydrophobicContact CG2-CD1 3.37Å; I617-Y700 HydrophobicContact CG2-CE1 3.52Å; I617-Y700 HydrophobicContact CG2-CG 4.25Å
618	D	90.6	Very high	89.5	Confident	30 Å²	30	42.7 Å²	42.7	16%	0.16	20%	0.204	C	C	.	.	H	α-helix	trans	-49.2	-54.9	-173.3	-176.8	51.3	0	0	0	114	L614 R615 K620 L621 I622 Y733 L735	L614-D618 PolarHBondContact O-N 3.32Å; R615-D618 WeakPolarHBondContact O-CB 3.47Å; D618-K620 PolarHBondContact O-N 3.2Å; D618-K620 VanDerWaalsContact O-N 3.12Å; D618-L621 WeakPolarHBondContact O-CB 3.3Å; D618-L621 PolarHBondContact O-N 2.59Å; D618-I622 WeakPolarHBondContact O-CG1 3.39Å; D618-I622 PolarHBondContact O-N 3.35Å; D618-Y733 VanDerWaalsContact OD1-CE1 3.22Å; D618-Y733 WeakPolarHBondContact OD1-CE1 3.48Å; D618-Y733 VanDerWaalsContact OD1-CZ 3.27Å; D618-Y733 PolarHBondContact OD1-OH 3.09Å; D618-L735 HydrophobicContact CB-CD1 4.36Å; D618-L735 HydrophobicContact CB-CD2 4.23Å
619	T	89	Confident	89.6	Confident	110 Å²	110	43.4 Å²	43.4	68%	0.675	20%	0.204	S	C	*	.	H	α-helix	trans	-53.7	-39.4	-179.7	-53.3	0	0	0	0	111.9	I617 Y623	I617-T619 PolarHBondContact O-N 3.1Å; T619-Y623 WeakPolarHBondContact O-CB 3.25Å; T619-Y623 PolarHBondContact O-N 3.12Å
620	K	88	Confident	89.6	Confident	75 Å²	75	46.5 Å²	46.5	33%	0.326	22%	0.217	S	C	.	.	H	α-helix	trans	-76	-38.3	-178.7	-169.1	61.1	175.9	177.5	0	111.7	I617 D618 Y623 L624 Y700	I617-K620 PolarHBondContact O-N 2.92Å; D618-K620 PolarHBondContact O-N 3.2Å; D618-K620 VanDerWaalsContact O-N 3.12Å; K620-Y623 HydrophobicContact CD-CD1 4.29Å; K620-Y623 PolarHBondContact O-N 2.97Å; K620-L624 HydrophobicContact CG-CD1 4.26Å; K620-L624 WeakPolarHBondContact O-CB 3.46Å; K620-L624 VanDerWaalsContact O-CG 3.26Å; K620-L624 WeakPolarHBondContact O-CG 3.27Å; K620-L624 PolarHBondContact O-N 2.97Å; K620-Y700 HydrophobicContact CG-CE2 3.98Å
621	L	88.4	Confident	89.5	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-45.7	175.4	-82.4	169.3	0	0	0	112.4	I617 D618 L624 K625 L697 Y700 Y701 I704 Y733	I617-L621 HydrophobicContact CG2-CD1 3.64Å; I617-L621 HydrophobicContact CG2-CG 3.77Å; I617-L621 PolarHBondContact O-N 2.88Å; D618-L621 WeakPolarHBondContact O-CB 3.3Å; D618-L621 PolarHBondContact O-N 2.59Å; L621-L624 PolarHBondContact O-N 2.93Å; L621-K625 PolarHBondContact O-N 3.28Å; L621-L697 HydrophobicContact CD2-CD1 3.98Å; L621-Y700 VanDerWaalsContact CD2-CB 3.49Å; L621-Y700 HydrophobicContact CD2-CD2 4.36Å; L621-Y700 HydrophobicContact CD2-CG 3.98Å; L621-Y700 HydrophobicContact CG-CG 4.48Å; L621-Y701 HydrophobicContact CD2-CD1 4.48Å; L621-Y701 HydrophobicContact CD2-CE1 4.22Å; L621-I704 HydrophobicContact CD1-CD1 3.73Å; L621-Y733 HydrophobicContact CB-CE1 4.39Å; L621-Y733 HydrophobicContact CB-CE2 4.49Å; L621-Y733 HydrophobicContact CD1-CD2 4.49Å; L621-Y733 HydrophobicContact CD1-CE2 3.67Å
622	I	91.2	Very high	89.5	Confident	66 Å²	66	51.2 Å²	51.2	34%	0.338	24%	0.239	S	C	.	.	H	α-helix	trans	-58.8	-50.3	177.2	-66.5	170.1	0	0	0	109.6	D618 L624 K625 E626 Y733	D618-I622 WeakPolarHBondContact O-CG1 3.39Å; D618-I622 PolarHBondContact O-N 3.35Å; I622-L624 VanDerWaalsContact C-N 3.34Å; I622-L624 PolarHBondContact O-N 3.43Å; I622-K625 PolarHBondContact O-N 3.15Å; I622-E626 HydrophobicContact CG2-CG 4.48Å; I622-E626 WeakPolarHBondContact O-CG 3.33Å; I622-E626 PolarHBondContact O-N 2.8Å; I622-Y733 HydrophobicContact CG1-CD1 4.45Å; I622-Y733 HydrophobicContact CG1-CE1 3.95Å
623	Y	90.3	Very high	89.6	Confident	83 Å²	83	53.4 Å²	53.4	33%	0.325	25%	0.251	S	S	.	.	H	α-helix	trans	-57.9	-43.5	177.5	168.8	-100.8	0	0	0	112.8	T619 K620 E626 L627 E689 Q693	T619-Y623 WeakPolarHBondContact O-CB 3.25Å; T619-Y623 PolarHBondContact O-N 3.12Å; K620-Y623 HydrophobicContact CD-CD1 4.29Å; K620-Y623 PolarHBondContact O-N 2.97Å; Y623-E626 PolarHBondContact O-N 2.8Å; Y623-L627 WeakPolarHBondContact O-CB 3.45Å; Y623-L627 PolarHBondContact O-N 3.05Å; Y623-E689 PolarHBondContact OH-OE2 2.92Å; Y623-E689 VanDerWaalsContact OH-OE2 3.05Å; Y623-Q693 PolarHBondContact OH-NE2 3.21Å
624	L	88	Confident	89.6	Confident	5 Å²	5	53.4 Å²	53.4	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-38.6	179	-74.5	172.1	0	0	0	112.6	K620 L621 I622 L627 E628 Q693 Q696 L697 Y700	K620-L624 HydrophobicContact CG-CD1 4.26Å; K620-L624 WeakPolarHBondContact O-CB 3.46Å; K620-L624 VanDerWaalsContact O-CG 3.26Å; K620-L624 WeakPolarHBondContact O-CG 3.27Å; K620-L624 PolarHBondContact O-N 2.97Å; L621-L624 PolarHBondContact O-N 2.93Å; I622-L624 VanDerWaalsContact C-N 3.34Å; I622-L624 PolarHBondContact O-N 3.43Å; L624-L627 PolarHBondContact O-N 2.97Å; L624-E628 PolarHBondContact O-N 2.94Å; L624-Q693 HydrophobicContact CD2-CB 3.82Å; L624-Q693 HydrophobicContact CD2-CG 4.27Å; L624-Q696 HydrophobicContact CD1-CB 3.94Å; L624-Q696 HydrophobicContact CD2-CB 4.17Å; L624-L697 HydrophobicContact CB-CD1 4.08Å; L624-Y700 HydrophobicContact CD1-CD2 3.48Å; L624-Y700 VanDerWaalsContact CD1-CD2 3.48Å; L624-Y700 HydrophobicContact CD1-CE2 3.5Å; L624-Y700 VanDerWaalsContact CD1-CE2 3.5Å
625	K	87.9	Confident	89.5	Confident	31 Å²	31	60.2 Å²	60.2	14%	0.135	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-48.3	174.3	-80.2	-162.4	164.6	-151.5	0	112.3	L621 I622 L627 E628 E629 L697 Y701 L730 E731 Y733	L621-K625 PolarHBondContact O-N 3.28Å; I622-K625 PolarHBondContact O-N 3.15Å; K625-L627 PolarHBondContact O-N 2.99Å; K625-E628 WeakPolarHBondContact O-CB 3.04Å; K625-E628 PolarHBondContact O-N 2.85Å; K625-E628 VanDerWaalsContact O-N 3.13Å; K625-E629 WeakPolarHBondContact O-CG 3.45Å; K625-E629 PolarHBondContact O-N 2.76Å; K625-L697 HydrophobicContact CG-CD1 4.03Å; K625-L697 HydrophobicContact CG-CD2 4.38Å; K625-Y701 WeakPolarHBondContact CE-OH 3.39Å; K625-L730 WeakPolarHBondContact CE-O 3.49Å; K625-L730 PolarHBondContact NZ-O 3.43Å; K625-E731 PolarHBondContact NZ-O 2.88Å; K625-Y733 HydrophobicContact CD-CG 4.49Å
626	E	89	Confident	89.5	Confident	83 Å²	83	57.7 Å²	57.7	39%	0.388	28%	0.28	S	S	.	.	H	α-helix	trans	-58	-40.2	175.9	-74.5	-174.9	-165	0	0	111.5	I622 Y623 E629 K630	I622-E626 HydrophobicContact CG2-CG 4.48Å; I622-E626 WeakPolarHBondContact O-CG 3.33Å; I622-E626 PolarHBondContact O-N 2.8Å; Y623-E626 PolarHBondContact O-N 2.8Å; E626-E629 PolarHBondContact O-N 3.32Å; E626-K630 VanDerWaalsContact O-CB 3.31Å; E626-K630 WeakPolarHBondContact O-CB 3.38Å; E626-K630 WeakPolarHBondContact O-CD 3.3Å; E626-K630 WeakPolarHBondContact O-CG 3.35Å; E626-K630 PolarHBondContact O-N 3.49Å; E626-K630 IonicContact OE2-NZ 2.69Å; E626-K630 PolarHBondContact OE2-NZ 2.6Å; E626-K630 VanDerWaalsContact OE2-NZ 3.12Å
627	L	89.8	Confident	89.5	Confident	5 Å²	5	56.1 Å²	56.1	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-45.2	176.5	-178.5	64.5	0	0	0	111.3	Y623 L624 K625 K630 V631 L686 E689 F690 Q693	Y623-L627 WeakPolarHBondContact O-CB 3.45Å; Y623-L627 PolarHBondContact O-N 3.05Å; L624-L627 PolarHBondContact O-N 2.97Å; K625-L627 PolarHBondContact O-N 2.99Å; L627-K630 PolarHBondContact O-N 2.75Å; L627-V631 HydrophobicContact CD1-CG2 4.27Å; L627-V631 WeakPolarHBondContact O-CB 3.38Å; L627-V631 WeakPolarHBondContact O-CG2 3.14Å; L627-V631 PolarHBondContact O-N 3.34Å; L627-L686 HydrophobicContact CD1-CB 4.49Å; L627-L686 HydrophobicContact CD1-CD2 3.66Å; L627-E689 HydrophobicContact CD1-CB 4.35Å; L627-E689 HydrophobicContact CD2-CB 4.2Å; L627-F690 HydrophobicContact CD2-CB 4.4Å; L627-F690 HydrophobicContact CD2-CD2 4.44Å; L627-F690 HydrophobicContact CG-CB 4.36Å; L627-F690 HydrophobicContact CG-CD2 4.2Å; L627-Q693 HydrophobicContact CD2-CB 4.01Å; L627-Q693 HydrophobicContact CD2-CG 4.38Å
628	E	87.8	Confident	89.4	Confident	52 Å²	52	57.9 Å²	57.9	24%	0.243	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-45.7	176.1	-171.3	-172.1	179.5	0	0	111.8	L624 K625 V631 K632 F690 L697	L624-E628 PolarHBondContact O-N 2.94Å; K625-E628 WeakPolarHBondContact O-CB 3.04Å; K625-E628 PolarHBondContact O-N 2.85Å; K625-E628 VanDerWaalsContact O-N 3.13Å; E628-V631 PolarHBondContact O-N 3.28Å; E628-K632 VanDerWaalsContact CD-NZ 3.27Å; E628-K632 HydrophobicContact CG-CD 4.38Å; E628-K632 WeakPolarHBondContact O-CG 3.49Å; E628-K632 PolarHBondContact O-N 2.63Å; E628-K632 WeakPolarHBondContact OE1-CE 3.47Å; E628-K632 IonicContact OE1-NZ 3.91Å; E628-K632 PolarHBondContact OE1-NZ 3.48Å; E628-K632 IonicContact OE2-NZ 3.94Å; E628-F690 HydrophobicContact CB-CE2 3.79Å; E628-F690 HydrophobicContact CG-CE2 3.77Å; E628-F690 HydrophobicContact CG-CZ 4.01Å; E628-L697 WeakPolarHBondContact OE2-CD2 3.22Å
629	E	88.6	Confident	89.3	Confident	120 Å²	120	61.1 Å²	61.1	56%	0.561	30%	0.298	S	S	*	.	H	α-helix	trans	-62.9	-47.7	177.4	-71.6	-179.1	169.6	0	0	111.8	K625 E626 V631 K632 L633	K625-E629 WeakPolarHBondContact O-CG 3.45Å; K625-E629 PolarHBondContact O-N 2.76Å; E626-E629 PolarHBondContact O-N 3.32Å; E629-V631 VanDerWaalsContact C-N 3.28Å; E629-V631 PolarHBondContact O-N 2.88Å; E629-K632 PolarHBondContact O-N 2.79Å; E629-L633 WeakPolarHBondContact O-CG 3.3Å; E629-L633 PolarHBondContact O-N 2.95Å
630	K	91	Very high	89.2	Confident	65 Å²	65	59.7 Å²	59.7	28%	0.283	29%	0.286	S	S	.	.	H	α-helix	trans	-56.7	-43.4	176.2	-74.6	167.2	-178.5	158.1	0	111	E626 L627 L633 I634 I679 L686	E626-K630 VanDerWaalsContact O-CB 3.31Å; E626-K630 WeakPolarHBondContact O-CB 3.38Å; E626-K630 WeakPolarHBondContact O-CD 3.3Å; E626-K630 WeakPolarHBondContact O-CG 3.35Å; E626-K630 PolarHBondContact O-N 3.49Å; E626-K630 IonicContact OE2-NZ 2.69Å; E626-K630 PolarHBondContact OE2-NZ 2.6Å; E626-K630 VanDerWaalsContact OE2-NZ 3.12Å; L627-K630 PolarHBondContact O-N 2.75Å; K630-L633 WeakPolarHBondContact O-CB 3.29Å; K630-L633 PolarHBondContact O-N 3.04Å; K630-I634 WeakPolarHBondContact O-CG1 3.36Å; K630-I634 PolarHBondContact O-N 3.24Å; K630-I679 HydrophobicContact CB-CD1 4.42Å; K630-I679 HydrophobicContact CB-CG1 4.4Å; K630-I679 HydrophobicContact CG-CD1 3.9Å; K630-I679 HydrophobicContact CG-CG1 4.07Å; K630-I679 WeakPolarHBondContact O-CG2 3.42Å; K630-L686 HydrophobicContact CB-CD1 4.36Å
631	V	89.8	Confident	89	Confident	25 Å²	25	56.3 Å²	56.3	15%	0.152	27%	0.271	C	S	.	.	H	α-helix	trans	-69.6	-39.4	-180	174.9	0	0	0	0	112.2	L627 E628 E629 L633 I634 L686 F690	L627-V631 HydrophobicContact CD1-CG2 4.27Å; L627-V631 WeakPolarHBondContact O-CB 3.38Å; L627-V631 WeakPolarHBondContact O-CG2 3.14Å; L627-V631 PolarHBondContact O-N 3.34Å; E628-V631 PolarHBondContact O-N 3.28Å; E629-V631 VanDerWaalsContact C-N 3.28Å; E629-V631 PolarHBondContact O-N 2.88Å; V631-L633 PolarHBondContact O-N 2.83Å; V631-I634 HydrophobicContact CB-CD1 4.4Å; V631-I634 HydrophobicContact CG1-CD1 4.48Å; V631-I634 HydrophobicContact CG2-CD1 4.31Å; V631-I634 WeakPolarHBondContact O-CB 3.49Å; V631-I634 PolarHBondContact O-N 2.77Å; V631-I634 VanDerWaalsContact O-N 3.16Å; V631-L686 HydrophobicContact CG2-CB 4.29Å; V631-F690 HydrophobicContact CB-CB 4.36Å; V631-F690 HydrophobicContact CB-CD1 4.31Å; V631-F690 HydrophobicContact CB-CD2 4.38Å; V631-F690 HydrophobicContact CB-CG 4.09Å; V631-F690 HydrophobicContact CG1-CB 4.3Å; V631-F690 HydrophobicContact CG1-CD1 3.73Å; V631-F690 HydrophobicContact CG1-CE1 4.21Å; V631-F690 HydrophobicContact CG1-CG 3.98Å; V631-F690 HydrophobicContact CG2-CB 3.5Å; V631-F690 HydrophobicContact CG2-CD1 4.35Å; V631-F690 HydrophobicContact CG2-CD2 4.09Å; V631-F690 HydrophobicContact CG2-CG 3.73Å
632	K	89.9	Confident	88.7	Confident	129 Å²	129	59.1 Å²	59.1	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-58	-35.5	172.8	-77.2	172.7	-177.3	165	0	111.7	E628 E629 P636	E628-K632 VanDerWaalsContact CD-NZ 3.27Å; E628-K632 HydrophobicContact CG-CD 4.38Å; E628-K632 WeakPolarHBondContact O-CG 3.49Å; E628-K632 PolarHBondContact O-N 2.63Å; E628-K632 WeakPolarHBondContact OE1-CE 3.47Å; E628-K632 IonicContact OE1-NZ 3.91Å; E628-K632 PolarHBondContact OE1-NZ 3.48Å; E628-K632 IonicContact OE2-NZ 3.94Å; E629-K632 PolarHBondContact O-N 2.79Å; K632-P636 WeakPolarHBondContact O-CD 3.2Å
633	L	91.6	Very high	88.3	Confident	63 Å²	63	60.2 Å²	60.2	33%	0.33	30%	0.295	S	S	.	.	H	α-helix	trans	-75.5	-22.4	178.3	-68.2	171.5	0	0	0	114.2	E629 K630 V631 K635 P636 I637 Y676 I679	E629-L633 WeakPolarHBondContact O-CG 3.3Å; E629-L633 PolarHBondContact O-N 2.95Å; K630-L633 WeakPolarHBondContact O-CB 3.29Å; K630-L633 PolarHBondContact O-N 3.04Å; V631-L633 PolarHBondContact O-N 2.83Å; L633-K635 VanDerWaalsContact C-N 3.34Å; L633-K635 PolarHBondContact O-N 2.84Å; L633-P636 WeakPolarHBondContact O-CD 3.42Å; L633-I637 HydrophobicContact CB-CD1 3.82Å; L633-I637 WeakPolarHBondContact O-CB 3.49Å; L633-I637 WeakPolarHBondContact O-CD1 3.23Å; L633-I637 WeakPolarHBondContact O-CG1 3.34Å; L633-I637 PolarHBondContact O-N 2.8Å; L633-Y676 HydrophobicContact CD1-CD1 4.36Å; L633-Y676 HydrophobicContact CD1-CE1 3.87Å; L633-I679 HydrophobicContact CD1-CD1 4.39Å
634	I	90.3	Very high	87.7	Confident	2 Å²	2	59.7 Å²	59.7	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-57.3	-46.1	-177.2	-67.3	168.6	0	0	0	111.5	K630 V631 I637 T638 I679 L686 K687	K630-I634 WeakPolarHBondContact O-CG1 3.36Å; K630-I634 PolarHBondContact O-N 3.24Å; V631-I634 HydrophobicContact CB-CD1 4.4Å; V631-I634 HydrophobicContact CG1-CD1 4.48Å; V631-I634 HydrophobicContact CG2-CD1 4.31Å; V631-I634 WeakPolarHBondContact O-CB 3.49Å; V631-I634 PolarHBondContact O-N 2.77Å; V631-I634 VanDerWaalsContact O-N 3.16Å; I634-I637 PolarHBondContact O-N 2.91Å; I634-T638 VanDerWaalsContact O-CB 3.28Å; I634-T638 WeakPolarHBondContact O-CB 3.49Å; I634-T638 PolarHBondContact O-N 2.92Å; I634-T638 PolarHBondContact O-OG1 3.3Å; I634-I679 HydrophobicContact CG1-CG2 3.83Å; I634-L686 HydrophobicContact CD1-CB 4.06Å; I634-K687 HydrophobicContact CD1-CG 3.96Å
635	K	89.9	Confident	86.9	Confident	144 Å²	144	61 Å²	61	63%	0.626	30%	0.302	S	S	*	.	H	α-helix	trans	-64.6	-53.5	-178.1	176.2	-180	177	-176.4	0	111.5	L633 I637 T638 E639	L633-K635 VanDerWaalsContact C-N 3.34Å; L633-K635 PolarHBondContact O-N 2.84Å; K635-I637 VanDerWaalsContact C-N 3.34Å; K635-I637 PolarHBondContact O-N 3.37Å; K635-T638 PolarHBondContact O-N 2.84Å; K635-E639 WeakPolarHBondContact CE-OE1 3.22Å; K635-E639 IonicContact NZ-OE1 3.42Å; K635-E639 WeakPolarHBondContact O-CG 3.48Å; K635-E639 PolarHBondContact O-N 2.68Å
636	P	91.2	Very high	86.2	Confident	68 Å²	68	64.3 Å²	64.3	44%	0.442	32%	0.318	S	S	.	.	H	α-helix	trans	-54.2	-43.5	173	-27.2	33.3	0	0	0	114.1	K632 L633 E639 L640	K632-P636 WeakPolarHBondContact O-CD 3.2Å; L633-P636 WeakPolarHBondContact O-CD 3.42Å; P636-E639 PolarHBondContact O-N 3.18Å; P636-L640 WeakPolarHBondContact O-CB 3.3Å; P636-L640 PolarHBondContact O-N 3.03Å
637	I	88	Confident	85.2	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.062	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-42.1	179.3	-66.9	164.2	0	0	0	110.7	L633 I634 K635 L640 I641 L672 Y676 I679 W680	L633-I637 HydrophobicContact CB-CD1 3.82Å; L633-I637 WeakPolarHBondContact O-CB 3.49Å; L633-I637 WeakPolarHBondContact O-CD1 3.23Å; L633-I637 WeakPolarHBondContact O-CG1 3.34Å; L633-I637 PolarHBondContact O-N 2.8Å; I634-I637 PolarHBondContact O-N 2.91Å; K635-I637 VanDerWaalsContact C-N 3.34Å; K635-I637 PolarHBondContact O-N 3.37Å; I637-L640 PolarHBondContact O-N 3.38Å; I637-I641 HydrophobicContact CG2-CD1 3.61Å; I637-I641 HydrophobicContact CG2-CG1 4.36Å; I637-I641 WeakPolarHBondContact O-CB 3.47Å; I637-I641 WeakPolarHBondContact O-CD1 3.41Å; I637-I641 VanDerWaalsContact O-CG1 3.28Å; I637-I641 WeakPolarHBondContact O-CG1 3.4Å; I637-I641 PolarHBondContact O-N 3.27Å; I637-L672 HydrophobicContact CG2-CD1 4.32Å; I637-L672 HydrophobicContact CG2-CD2 4.33Å; I637-Y676 HydrophobicContact CD1-CD1 3.81Å; I637-Y676 HydrophobicContact CD1-CG 4.07Å; I637-I679 HydrophobicContact CD1-CB 4.37Å; I637-I679 HydrophobicContact CD1-CG2 4.1Å; I637-W680 HydrophobicContact CG2-CB 3.89Å; I637-W680 HydrophobicContact CG2-CG 4.3Å
638	T	87.6	Confident	84.1	Confident	47 Å²	47	65.9 Å²	65.9	29%	0.288	33%	0.333	S	S	.	.	H	α-helix	trans	-64.4	-42	177.7	-54.9	0	0	0	0	111	I634 K635 T642	I634-T638 VanDerWaalsContact O-CB 3.28Å; I634-T638 WeakPolarHBondContact O-CB 3.49Å; I634-T638 PolarHBondContact O-N 2.92Å; I634-T638 PolarHBondContact O-OG1 3.3Å; K635-T638 PolarHBondContact O-N 2.84Å; T638-T642 WeakPolarHBondContact O-CB 3.38Å; T638-T642 PolarHBondContact O-N 2.96Å; T638-T642 PolarHBondContact O-OG1 3.38Å
639	E	87.7	Confident	82.8	Confident	98 Å²	98	66.4 Å²	66.4	46%	0.458	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-44.1	174.7	-74.3	175.8	-173.6	0	0	111.4	K635 P636 T642 N643	K635-E639 WeakPolarHBondContact CE-OE1 3.22Å; K635-E639 IonicContact NZ-OE1 3.42Å; K635-E639 WeakPolarHBondContact O-CG 3.48Å; K635-E639 PolarHBondContact O-N 2.68Å; P636-E639 PolarHBondContact O-N 3.18Å; E639-T642 PolarHBondContact O-N 2.99Å; E639-N643 WeakPolarHBondContact O-CB 3.33Å; E639-N643 PolarHBondContact O-N 2.86Å; E639-N643 PolarHBondContact O-ND2 2.71Å
640	L	87.2	Confident	81.5	Confident	79 Å²	79	67.7 Å²	67.7	41%	0.414	34%	0.343	S	S	.	.	H	α-helix	trans	-60.7	-48.2	176.3	-175.6	148.4	0	0	0	111.7	P636 I637 T642 N643 E644 L668	P636-L640 WeakPolarHBondContact O-CB 3.3Å; P636-L640 PolarHBondContact O-N 3.03Å; I637-L640 PolarHBondContact O-N 3.38Å; L640-T642 VanDerWaalsContact C-N 3.31Å; L640-T642 PolarHBondContact O-N 3.46Å; L640-N643 PolarHBondContact O-N 3.4Å; L640-E644 HydrophobicContact CD2-CG 4.21Å; L640-E644 WeakPolarHBondContact O-CB 3.06Å; L640-E644 WeakPolarHBondContact O-CG 3.21Å; L640-E644 PolarHBondContact O-N 3.42Å; L640-L668 HydrophobicContact CD2-CD1 3.78Å
641	I	83.4	Confident	80	Confident	4 Å²	4	71.2 Å²	71.2	2%	0.021	36%	0.364	C	S	.	.	H	α-helix	trans	-61.1	-42.9	177.2	-69.8	162.2	0	0	0	110.4	I637 I645 P667 L668 L672 W680	I637-I641 HydrophobicContact CG2-CD1 3.61Å; I637-I641 HydrophobicContact CG2-CG1 4.36Å; I637-I641 WeakPolarHBondContact O-CB 3.47Å; I637-I641 WeakPolarHBondContact O-CD1 3.41Å; I637-I641 VanDerWaalsContact O-CG1 3.28Å; I637-I641 WeakPolarHBondContact O-CG1 3.4Å; I637-I641 PolarHBondContact O-N 3.27Å; I641-I645 HydrophobicContact CG2-CD1 3.53Å; I641-I645 HydrophobicContact CG2-CG1 4.27Å; I641-I645 VanDerWaalsContact O-CB 3.25Å; I641-I645 WeakPolarHBondContact O-CB 3.44Å; I641-I645 WeakPolarHBondContact O-CG1 3.31Å; I641-I645 PolarHBondContact O-N 3.42Å; I641-P667 HydrophobicContact CD1-CB 4.49Å; I641-P667 HydrophobicContact CD1-CG 3.62Å; I641-P667 HydrophobicContact CG1-CG 4.03Å; I641-P667 HydrophobicContact CG2-CB 4.02Å; I641-P667 HydrophobicContact CG2-CG 4.3Å; I641-L668 HydrophobicContact CG1-CD1 4.15Å; I641-L672 HydrophobicContact CD1-CD2 3.98Å; I641-L672 HydrophobicContact CG1-CD2 4.3Å; I641-W680 HydrophobicContact CD1-CB 4.06Å; I641-W680 HydrophobicContact CD1-CD2 3.66Å; I641-W680 HydrophobicContact CD1-CE3 4.47Å; I641-W680 HydrophobicContact CD1-CG 3.42Å; I641-W680 VanDerWaalsContact CD1-CG 3.42Å
642	T	82.8	Confident	78.4	Confident	60 Å²	60	73.7 Å²	73.7	37%	0.368	38%	0.376	S	S	.	.	H	α-helix	trans	-64.4	-43.3	179.6	-54.3	0	0	0	0	111.3	T638 E639 L640 Q646	T638-T642 WeakPolarHBondContact O-CB 3.38Å; T638-T642 PolarHBondContact O-N 2.96Å; T638-T642 PolarHBondContact O-OG1 3.38Å; E639-T642 PolarHBondContact O-N 2.99Å; L640-T642 VanDerWaalsContact C-N 3.31Å; L640-T642 PolarHBondContact O-N 3.46Å; T642-Q646 WeakPolarHBondContact O-CB 3.35Å; T642-Q646 WeakPolarHBondContact O-CG 3.35Å; T642-Q646 PolarHBondContact O-N 3.03Å
643	N	82.2	Confident	76.6	Confident	90 Å²	90	78.2 Å²	78.2	48%	0.481	39%	0.389	S	S	.	.	H	α-helix	trans	-67.7	-41.9	179.3	-70	-16	0	0	0	112.4	E639 L640 Q646 S647	E639-N643 WeakPolarHBondContact O-CB 3.33Å; E639-N643 PolarHBondContact O-N 2.86Å; E639-N643 PolarHBondContact O-ND2 2.71Å; L640-N643 PolarHBondContact O-N 3.4Å; N643-Q646 PolarHBondContact O-N 2.59Å; N643-S647 WeakPolarHBondContact O-CB 3.4Å; N643-S647 PolarHBondContact O-N 3.2Å; N643-S647 PolarHBondContact O-OG 3.48Å
644	E	78.2	Confident	74.6	Confident	72 Å²	72	82.2 Å²	82.2	34%	0.336	41%	0.411	S	S	.	.	H	α-helix	trans	-67.6	-42	177	-73.2	-64.6	157.5	0	0	111.1	L640 Q646 S647 I648 L668	L640-E644 HydrophobicContact CD2-CG 4.21Å; L640-E644 WeakPolarHBondContact O-CB 3.06Å; L640-E644 WeakPolarHBondContact O-CG 3.21Å; L640-E644 PolarHBondContact O-N 3.42Å; E644-Q646 VanDerWaalsContact C-N 3.33Å; E644-Q646 PolarHBondContact O-N 3.21Å; E644-S647 PolarHBondContact O-N 3.37Å; E644-I648 WeakPolarHBondContact O-CB 3.43Å; E644-I648 VanDerWaalsContact O-CG1 3.23Å; E644-I648 WeakPolarHBondContact O-CG1 3.48Å; E644-I648 PolarHBondContact O-N 3.24Å; E644-L668 HydrophobicContact CB-CD1 3.78Å; E644-L668 HydrophobicContact CB-CD2 3.96Å; E644-L668 HydrophobicContact CG-CD1 3.92Å
645	I	72.3	Confident	72.4	Confident	32 Å²	32	88.7 Å²	88.7	16%	0.164	44%	0.441	C	S	.	.	H	α-helix	trans	-61.7	-42.3	174.1	-73	174.1	0	0	0	111	I641 I648 N649 L658 I661	I641-I645 HydrophobicContact CG2-CD1 3.53Å; I641-I645 HydrophobicContact CG2-CG1 4.27Å; I641-I645 VanDerWaalsContact O-CB 3.25Å; I641-I645 WeakPolarHBondContact O-CB 3.44Å; I641-I645 WeakPolarHBondContact O-CG1 3.31Å; I641-I645 PolarHBondContact O-N 3.42Å; I645-I648 PolarHBondContact O-N 3.47Å; I645-N649 PolarHBondContact O-N 3.05Å; I645-N649 PolarHBondContact O-ND2 2.98Å; I645-L658 HydrophobicContact CG2-CD1 3.59Å; I645-L658 HydrophobicContact CG2-CD2 3.61Å; I645-L658 HydrophobicContact CG2-CG 4.09Å; I645-I661 HydrophobicContact CD1-CD1 3.89Å; I645-I661 HydrophobicContact CG1-CD1 4.49Å
646	Q	71.3	Confident	70.3	Confident	100 Å²	100	86.9 Å²	86.9	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-63.1	-42.6	174.4	-76.2	173.9	2.3	0	0	111.7	T642 N643 E644 I648 N649 E650	T642-Q646 WeakPolarHBondContact O-CB 3.35Å; T642-Q646 WeakPolarHBondContact O-CG 3.35Å; T642-Q646 PolarHBondContact O-N 3.03Å; N643-Q646 PolarHBondContact O-N 2.59Å; E644-Q646 VanDerWaalsContact C-N 3.33Å; E644-Q646 PolarHBondContact O-N 3.21Å; Q646-I648 PolarHBondContact O-N 3.02Å; Q646-N649 WeakPolarHBondContact O-CB 3.36Å; Q646-N649 PolarHBondContact O-N 3.37Å; Q646-E650 WeakPolarHBondContact O-CG 3.37Å; Q646-E650 PolarHBondContact O-N 2.92Å
647	S	68.2	Low	68.2	Low	53 Å²	53	91.9 Å²	91.9	37%	0.371	46%	0.461	S	S	.	.	H	α-helix	trans	-63.2	-41.4	177.3	-58.1	0	0	0	0	111.6	N643 E644 N649 E650 I651	N643-S647 WeakPolarHBondContact O-CB 3.4Å; N643-S647 PolarHBondContact O-N 3.2Å; N643-S647 PolarHBondContact O-OG 3.48Å; E644-S647 PolarHBondContact O-N 3.37Å; S647-N649 VanDerWaalsContact C-N 3.33Å; S647-N649 PolarHBondContact O-N 2.84Å; S647-E650 PolarHBondContact O-N 3.35Å; S647-I651 VanDerWaalsContact O-CG1 3.3Å; S647-I651 WeakPolarHBondContact O-CG1 3.31Å; S647-I651 PolarHBondContact O-N 3.49Å; S647-I651 VanDerWaalsContact O-N 3.09Å
648	I	66.8	Low	66.2	Low	69 Å²	69	94.9 Å²	94.9	35%	0.354	48%	0.476	S	S	.	.	H	α-helix	trans	-64	-38.7	175.2	-68.3	164.2	0	0	0	110.8	E644 I645 Q646 I651 N652 L668	E644-I648 WeakPolarHBondContact O-CB 3.43Å; E644-I648 VanDerWaalsContact O-CG1 3.23Å; E644-I648 WeakPolarHBondContact O-CG1 3.48Å; E644-I648 PolarHBondContact O-N 3.24Å; I645-I648 PolarHBondContact O-N 3.47Å; Q646-I648 PolarHBondContact O-N 3.02Å; I648-I651 PolarHBondContact O-N 3.34Å; I648-N652 VanDerWaalsContact O-CB 3.32Å; I648-N652 WeakPolarHBondContact O-CB 3.42Å; I648-N652 PolarHBondContact O-N 2.87Å; I648-N652 PolarHBondContact O-ND2 2.95Å; I648-L668 HydrophobicContact CD1-CD2 4.27Å
649	N	61.6	Low	64.4	Low	62 Å²	62	100.7 Å²	100.7	33%	0.332	50%	0.501	S	S	.	.	H	α-helix	trans	-67.8	-36.8	175.4	-69.4	-21.1	0	0	0	113.3	I645 Q646 S647 I651 N652 L658	I645-N649 PolarHBondContact O-N 3.05Å; I645-N649 PolarHBondContact O-ND2 2.98Å; Q646-N649 WeakPolarHBondContact O-CB 3.36Å; Q646-N649 PolarHBondContact O-N 3.37Å; S647-N649 VanDerWaalsContact C-N 3.33Å; S647-N649 PolarHBondContact O-N 2.84Å; N649-I651 VanDerWaalsContact C-N 3.33Å; N649-N652 CarbonylContact O-C 3.36Å; N649-N652 PolarHBondContact O-N 3.31Å; N649-L658 WeakPolarHBondContact ND2-CD1 3.39Å; N649-L658 WeakPolarHBondContact OD1-CD1 3.28Å
650	E	61.4	Low	62.4	Low	148 Å²	148	104 Å²	104	69%	0.692	52%	0.516	S	S	*	.	H	α-helix	trans	-68.5	-35.4	178	-75	-175.8	175.8	0	0	111.8	Q646 S647	Q646-E650 WeakPolarHBondContact O-CG 3.37Å; Q646-E650 PolarHBondContact O-N 2.92Å; S647-E650 PolarHBondContact O-N 3.35Å
651	I	59.5	Low	60.7	Low	138 Å²	138	103.4 Å²	103.4	71%	0.708	51%	0.513	S	S	*	.	H	α-helix	trans	-73.5	-40.9	175.2	-64	165.3	0	0	0	110.5	S647 I648 N649 R653	S647-I651 VanDerWaalsContact O-CG1 3.3Å; S647-I651 WeakPolarHBondContact O-CG1 3.31Å; S647-I651 PolarHBondContact O-N 3.49Å; S647-I651 VanDerWaalsContact O-N 3.09Å; I648-I651 PolarHBondContact O-N 3.34Å; N649-I651 VanDerWaalsContact C-N 3.33Å; I651-R653 PolarHBondContact O-N 2.99Å
652	N	55.5	Low	59.1	Low	77 Å²	77	106.8 Å²	106.8	41%	0.412	53%	0.533	S	S	.	.			trans	-97.1	60.8	-178.9	-67.2	-37	0	0	0	112	I648 N649 N654 H655	I648-N652 VanDerWaalsContact O-CB 3.32Å; I648-N652 WeakPolarHBondContact O-CB 3.42Å; I648-N652 PolarHBondContact O-N 2.87Å; I648-N652 PolarHBondContact O-ND2 2.95Å; N649-N652 CarbonylContact O-C 3.36Å; N649-N652 PolarHBondContact O-N 3.31Å; N652-N654 PolarHBondContact O-N 3.08Å; N652-H655 PolarHBondContact O-N 3.14Å
653	R	51.5	Low	57.9	Low	224 Å²	224	110.3 Å²	110.3	85%	0.845	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-8.4	171	-82.8	-173.3	178.9	171.8	1	114.9	I651	I651-R653 PolarHBondContact O-N 2.99Å
654	N	49.7	Very low	56.8	Low	148 Å²	148	109.8 Å²	109.8	79%	0.791	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	4.3	-175.3	-68.1	-22.7	0	0	0	115.2	N652	N652-N654 PolarHBondContact O-N 3.08Å
655	H	45.3	Very low	56.2	Low	137 Å²	137	112.4 Å²	112.4	63%	0.634	56%	0.559	S	S	*	*			trans	-136.9	111.5	176.4	-87.6	-70.8	0	0	0	112.3	N652 F657	N652-H655 PolarHBondContact O-N 3.14Å; H655-F657 VanDerWaalsContact C-N 3.26Å; H655-F657 PolarHBondContact O-N 2.88Å
656	C	44.8	Very low	56.1	Low	107 Å²	107	112.3 Å²	112.3	72%	0.723	56%	0.559	S	S	*	*			trans	-65.1	82.6	164.8	-173.1	0	0	0	0	109.4
657	F	48.4	Very low	55.9	Low	173 Å²	173	108.2 Å²	108.2	76%	0.759	54%	0.541	S	S	*	.			trans	-96.9	9.2	176.8	-135.7	-90.1	0	0	0	113.1	H655	H655-F657 VanDerWaalsContact C-N 3.26Å; H655-F657 PolarHBondContact O-N 2.88Å
658	L	45.6	Very low	56.1	Low	74 Å²	74	106 Å²	106	39%	0.387	53%	0.525	S	S	.	.			trans	-103.3	6.7	-165.3	-104.4	170.6	0	0	0	117.6	I645 N649 I661	I645-L658 HydrophobicContact CG2-CD1 3.59Å; I645-L658 HydrophobicContact CG2-CD2 3.61Å; I645-L658 HydrophobicContact CG2-CG 4.09Å; N649-L658 WeakPolarHBondContact ND2-CD1 3.39Å; N649-L658 WeakPolarHBondContact OD1-CD1 3.28Å; L658-I661 HydrophobicContact CD2-CD1 4.36Å
659	E	48.8	Very low	56.1	Low	170 Å²	170	107.3 Å²	107.3	79%	0.794	54%	0.538	S	S	*	.	S	Bend	trans	-90.3	-1.1	-178.6	-72.6	-171.8	155.4	0	0	114.7
660	Q	46	Very low	56.6	Low	166 Å²	166	111.2 Å²	111.2	78%	0.776	56%	0.559	S	S	*	*			trans	-142.9	35.6	-174.3	-65.6	-173.2	0.2	0	0	116.1	T662	Q660-T662 PolarHBondContact O-N 2.8Å
661	I	51.5	Low	57.2	Low	68 Å²	68	111.3 Å²	111.3	35%	0.349	56%	0.557	S	S	.	*			trans	-76.2	81.7	155.4	-53.4	177.7	0	0	0	106.6	I645 L658 K663 P667	I645-I661 HydrophobicContact CD1-CD1 3.89Å; I645-I661 HydrophobicContact CG1-CD1 4.49Å; L658-I661 HydrophobicContact CD2-CD1 4.36Å; I661-K663 PolarHBondContact O-N 3.46Å; I661-P667 HydrophobicContact CG2-CB 4.29Å
662	T	50.2	Low	58.2	Low	75 Å²	75	105.3 Å²	105.3	46%	0.46	53%	0.527	S	S	.	.			trans	-59.3	137.7	165.6	50.4	0	0	0	0	107.2	Q660 S664 E665	Q660-T662 PolarHBondContact O-N 2.8Å; T662-S664 PolarHBondContact O-N 2.94Å; T662-S664 PolarHBondContact OG1-OG 3.28Å; T662-E665 PolarHBondContact O-N 2.86Å; T662-E665 VanDerWaalsContact O-N 3.11Å
663	K	56.6	Low	59.5	Low	133 Å²	133	105.1 Å²	105.1	58%	0.578	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-7.9	178.6	-76.4	-173	175	-174.8	0	113.5	I661 R681 D684	I661-K663 PolarHBondContact O-N 3.46Å; K663-R681 WeakPolarHBondContact O-CD 3.45Å; K663-R681 VanDerWaalsContact O-CG 3.23Å; K663-R681 WeakPolarHBondContact O-CG 3.37Å; K663-R681 PolarHBondContact O-NE 2.83Å; K663-D684 IonicContact NZ-OD2 2.7Å; K663-D684 PolarHBondContact NZ-OD2 2.91Å
664	S	58.9	Low	61.1	Low	79 Å²	79	100.7 Å²	100.7	55%	0.552	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-3.7	178.6	52.6	0	0	0	0	115.9	T662 R681	T662-S664 PolarHBondContact O-N 2.94Å; T662-S664 PolarHBondContact OG1-OG 3.28Å; S664-R681 PolarHBondContact O-NH1 2.69Å; S664-R681 PolarHBondContact O-NH2 3.35Å
665	E	66	Low	62.8	Low	127 Å²	127	99.5 Å²	99.5	59%	0.593	51%	0.512	S	S	*	.	S	Bend	trans	-118.4	153.7	179.2	-66.5	-167.4	173.1	0	0	112.4	T662 P667 R681	T662-E665 PolarHBondContact O-N 2.86Å; T662-E665 VanDerWaalsContact O-N 3.11Å; E665-P667 WeakPolarHBondContact O-CD 3.44Å; E665-R681 PolarHBondContact O-NH2 3.47Å
666	N	70.1	Confident	64.8	Low	31 Å²	31	97.4 Å²	97.4	17%	0.166	50%	0.499	C	S	.	.			trans	-69.2	118.7	178.5	179.5	-11.8	0	0	0	106.3	L668 P669 L672 A677 R681	N666-L668 PolarHBondContact O-N 2.85Å; N666-L668 VanDerWaalsContact O-N 3.17Å; N666-L668 PolarHBondContact OD1-N 3.34Å; N666-L668 VanDerWaalsContact OD1-N 3.13Å; N666-L668 PolarHBondContact OD1-O 3.26Å; N666-P669 WeakPolarHBondContact O-CD 3.36Å; N666-L672 PolarHBondContact ND2-O 2.99Å; N666-A677 HydrophobicContact CB-CB 4.17Å; N666-A677 WeakPolarHBondContact OD1-CB 2.98Å; N666-R681 VanDerWaalsContact N-NH2 3.19Å
667	P	66.7	Low	66.7	Low	13 Å²	13	92.4 Å²	92.4	8%	0.084	47%	0.465	C	S	.	.	S	Bend	trans	-64.2	-23.3	-173.6	24.5	-33.6	0	0	0	112.8	I641 I661 E665 L672 W680	I641-P667 HydrophobicContact CD1-CB 4.49Å; I641-P667 HydrophobicContact CD1-CG 3.62Å; I641-P667 HydrophobicContact CG1-CG 4.03Å; I641-P667 HydrophobicContact CG2-CB 4.02Å; I641-P667 HydrophobicContact CG2-CG 4.3Å; I661-P667 HydrophobicContact CG2-CB 4.29Å; E665-P667 WeakPolarHBondContact O-CD 3.44Å; P667-L672 HydrophobicContact CG-CD2 4.16Å; P667-W680 HydrophobicContact CB-CH2 4.4Å; P667-W680 HydrophobicContact CB-CZ3 4.25Å; P667-W680 HydrophobicContact CG-CD2 4.23Å; P667-W680 HydrophobicContact CG-CE3 3.79Å; P667-W680 HydrophobicContact CG-CH2 4.37Å; P667-W680 HydrophobicContact CG-CZ3 3.86Å
668	L	73.4	Confident	68.4	Low	7 Å²	7	89.7 Å²	89.7	4%	0.037	46%	0.455	C	S	.	.	S	Bend	trans	-138.6	76.4	178.6	-67.9	169.2	0	0	0	109.5	L640 I641 E644 I648 N666 N670 F671 L672	L640-L668 HydrophobicContact CD2-CD1 3.78Å; I641-L668 HydrophobicContact CG1-CD1 4.15Å; E644-L668 HydrophobicContact CB-CD1 3.78Å; E644-L668 HydrophobicContact CB-CD2 3.96Å; E644-L668 HydrophobicContact CG-CD1 3.92Å; I648-L668 HydrophobicContact CD1-CD2 4.27Å; N666-L668 PolarHBondContact O-N 2.85Å; N666-L668 VanDerWaalsContact O-N 3.17Å; N666-L668 PolarHBondContact OD1-N 3.34Å; N666-L668 VanDerWaalsContact OD1-N 3.13Å; N666-L668 PolarHBondContact OD1-O 3.26Å; L668-N670 PolarHBondContact O-N 2.73Å; L668-F671 HydrophobicContact CB-CB 4.27Å; L668-F671 PolarHBondContact O-N 3.41Å; L668-F671 VanDerWaalsContact O-N 3.11Å; L668-L672 HydrophobicContact CB-CB 3.93Å; L668-L672 WeakPolarHBondContact O-CB 3.46Å; L668-L672 PolarHBondContact O-N 3.15Å
669	P	67.4	Low	70.4	Confident	97 Å²	97	86.6 Å²	86.6	63%	0.63	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.7	-170.5	20.5	-28.4	0	0	0	114.1	N666	N666-P669 WeakPolarHBondContact O-CD 3.36Å
670	N	71.9	Confident	72.1	Confident	143 Å²	143	80.7 Å²	80.7	77%	0.765	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-16.8	-179.6	-64.4	-15.8	0	0	0	114.3	L668	L668-N670 PolarHBondContact O-N 2.73Å
671	F	74.1	Confident	73.9	Confident	150 Å²	150	77.3 Å²	77.3	66%	0.658	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	-24.6	-171	-62.3	-80.3	0	0	0	113.3	L668 P673	L668-F671 HydrophobicContact CB-CB 4.27Å; L668-F671 PolarHBondContact O-N 3.41Å; L668-F671 VanDerWaalsContact O-N 3.11Å; F671-P673 WeakPolarHBondContact O-CD 3.34Å
672	L	78.9	Confident	75.6	Confident	12 Å²	12	77.1 Å²	77.1	6%	0.063	39%	0.389	C	S	.	.	S	Bend	trans	-107.6	112	-177.6	-167	69.3	0	0	0	110.2	I637 I641 N666 P667 L668 Y676 A677	I637-L672 HydrophobicContact CG2-CD1 4.32Å; I637-L672 HydrophobicContact CG2-CD2 4.33Å; I641-L672 HydrophobicContact CD1-CD2 3.98Å; I641-L672 HydrophobicContact CG1-CD2 4.3Å; N666-L672 PolarHBondContact ND2-O 2.99Å; P667-L672 HydrophobicContact CG-CD2 4.16Å; L668-L672 HydrophobicContact CB-CB 3.93Å; L668-L672 WeakPolarHBondContact O-CB 3.46Å; L668-L672 PolarHBondContact O-N 3.15Å; L672-Y676 HydrophobicContact CD1-CD2 4.36Å; L672-Y676 HydrophobicContact CD1-CG 4.4Å; L672-A677 HydrophobicContact CD2-CB 3.89Å; L672-A677 HydrophobicContact CG-CB 4.32Å
673	P	84.5	Confident	77.4	Confident	73 Å²	73	74.2 Å²	74.2	47%	0.474	37%	0.372	S	S	.	.			trans	-47.5	145.3	169.1	-29.4	32.8	0	0	0	112.5	F671 E675 Y676 A677	F671-P673 WeakPolarHBondContact O-CD 3.34Å; P673-E675 PolarHBondContact O-N 3.26Å; P673-E675 VanDerWaalsContact O-N 3.14Å; P673-Y676 HydrophobicContact CB-CD2 4Å; P673-Y676 HydrophobicContact CG-CD2 3.85Å; P673-Y676 HydrophobicContact CG-CE2 4.15Å; P673-Y676 PolarHBondContact O-N 3.23Å; P673-A677 PolarHBondContact O-N 3.18Å
674	L	84.4	Confident	78.8	Confident	132 Å²	132	71.7 Å²	71.7	69%	0.691	37%	0.365	S	S	*	.	H	α-helix	trans	-56.6	-34.5	-175.9	-167.6	70.9	0	0	0	112.6	A677 Q678	L674-A677 PolarHBondContact O-N 2.89Å; L674-Q678 WeakPolarHBondContact O-CB 3.37Å; L674-Q678 PolarHBondContact O-N 3.09Å
675	E	85.4	Confident	80.2	Confident	123 Å²	123	73.8 Å²	73.8	58%	0.575	36%	0.364	S	S	*	.	H	α-helix	trans	-61.4	-47.8	176.6	-174.6	178.8	-176.5	0	0	112.2	P673 Q678 I679	P673-E675 PolarHBondContact O-N 3.26Å; P673-E675 VanDerWaalsContact O-N 3.14Å; E675-Q678 WeakPolarHBondContact O-CB 3.41Å; E675-Q678 PolarHBondContact O-N 3.42Å; E675-I679 HydrophobicContact CG-CD1 4.43Å; E675-I679 WeakPolarHBondContact O-CG1 3.34Å; E675-I679 PolarHBondContact O-N 2.99Å
676	Y	87.5	Confident	81.3	Confident	92 Å²	92	68.8 Å²	68.8	36%	0.361	34%	0.341	S	S	.	.	H	α-helix	trans	-70.7	-34.2	177	-61.9	-42.8	0	0	0	112.2	L633 I637 L672 P673 Q678 I679 W680	L633-Y676 HydrophobicContact CD1-CD1 4.36Å; L633-Y676 HydrophobicContact CD1-CE1 3.87Å; I637-Y676 HydrophobicContact CD1-CD1 3.81Å; I637-Y676 HydrophobicContact CD1-CG 4.07Å; L672-Y676 HydrophobicContact CD1-CD2 4.36Å; L672-Y676 HydrophobicContact CD1-CG 4.4Å; P673-Y676 HydrophobicContact CB-CD2 4Å; P673-Y676 HydrophobicContact CG-CD2 3.85Å; P673-Y676 HydrophobicContact CG-CE2 4.15Å; P673-Y676 PolarHBondContact O-N 3.23Å; Y676-Q678 VanDerWaalsContact C-N 3.29Å; Y676-Q678 PolarHBondContact O-N 3.15Å; Y676-I679 HydrophobicContact CD1-CD1 4.07Å; Y676-I679 PolarHBondContact O-N 3.04Å; Y676-W680 PolarHBondContact O-N 2.96Å
677	A	83.7	Confident	82.1	Confident	2 Å²	2	72.2 Å²	72.2	2%	0.017	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-38.6	172.5	0	0	0	0	0	111.5	N666 L672 P673 L674 W680 R681	N666-A677 HydrophobicContact CB-CB 4.17Å; N666-A677 WeakPolarHBondContact OD1-CB 2.98Å; L672-A677 HydrophobicContact CD2-CB 3.89Å; L672-A677 HydrophobicContact CG-CB 4.32Å; P673-A677 PolarHBondContact O-N 3.18Å; L674-A677 PolarHBondContact O-N 2.89Å; A677-W680 PolarHBondContact O-N 2.93Å; A677-R681 WeakPolarHBondContact O-CG 3.42Å; A677-R681 PolarHBondContact O-N 3.37Å
678	Q	84.9	Confident	82.8	Confident	117 Å²	117	77.8 Å²	77.8	55%	0.547	38%	0.379	S	S	.	.	H	α-helix	trans	-66.8	-44.9	174.5	-174.7	176.5	-5.4	0	0	111.8	L674 E675 Y676 W680 R681 D682	L674-Q678 WeakPolarHBondContact O-CB 3.37Å; L674-Q678 PolarHBondContact O-N 3.09Å; E675-Q678 WeakPolarHBondContact O-CB 3.41Å; E675-Q678 PolarHBondContact O-N 3.42Å; Y676-Q678 VanDerWaalsContact C-N 3.29Å; Y676-Q678 PolarHBondContact O-N 3.15Å; Q678-W680 VanDerWaalsContact C-N 3.25Å; Q678-W680 PolarHBondContact O-N 2.92Å; Q678-R681 WeakPolarHBondContact O-CB 3.41Å; Q678-R681 PolarHBondContact O-N 3.03Å; Q678-D682 WeakPolarHBondContact O-CB 3.43Å; Q678-D682 PolarHBondContact O-N 2.73Å
679	I	86.7	Confident	83.3	Confident	8 Å²	8	79.9 Å²	79.9	4%	0.041	39%	0.389	C	S	.	.	H	α-helix	trans	-57.8	-40.4	175.2	-68.9	163.5	0	0	0	111.1	K630 L633 I634 I637 E675 Y676 S683 L686	K630-I679 HydrophobicContact CB-CD1 4.42Å; K630-I679 HydrophobicContact CB-CG1 4.4Å; K630-I679 HydrophobicContact CG-CD1 3.9Å; K630-I679 HydrophobicContact CG-CG1 4.07Å; K630-I679 WeakPolarHBondContact O-CG2 3.42Å; L633-I679 HydrophobicContact CD1-CD1 4.39Å; I634-I679 HydrophobicContact CG1-CG2 3.83Å; I637-I679 HydrophobicContact CD1-CB 4.37Å; I637-I679 HydrophobicContact CD1-CG2 4.1Å; E675-I679 HydrophobicContact CG-CD1 4.43Å; E675-I679 WeakPolarHBondContact O-CG1 3.34Å; E675-I679 PolarHBondContact O-N 2.99Å; Y676-I679 HydrophobicContact CD1-CD1 4.07Å; Y676-I679 PolarHBondContact O-N 3.04Å; I679-S683 WeakPolarHBondContact O-CA 3.18Å; I679-S683 PolarHBondContact O-N 3.17Å; I679-S683 VanDerWaalsContact O-N 3.1Å; I679-L686 HydrophobicContact CB-CD1 4.48Å; I679-L686 HydrophobicContact CG2-CD1 4.12Å
680	W	84.6	Confident	84.1	Confident	47 Å²	47	77.8 Å²	77.8	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-67.5	-43.2	176.4	-177.8	79.1	0	0	0	112.6	I637 I641 P667 Y676 A677 Q678 D682 S683	I637-W680 HydrophobicContact CG2-CB 3.89Å; I637-W680 HydrophobicContact CG2-CG 4.3Å; I641-W680 HydrophobicContact CD1-CB 4.06Å; I641-W680 HydrophobicContact CD1-CD2 3.66Å; I641-W680 HydrophobicContact CD1-CE3 4.47Å; I641-W680 HydrophobicContact CD1-CG 3.42Å; I641-W680 VanDerWaalsContact CD1-CG 3.42Å; P667-W680 HydrophobicContact CB-CH2 4.4Å; P667-W680 HydrophobicContact CB-CZ3 4.25Å; P667-W680 HydrophobicContact CG-CD2 4.23Å; P667-W680 HydrophobicContact CG-CE3 3.79Å; P667-W680 HydrophobicContact CG-CH2 4.37Å; P667-W680 HydrophobicContact CG-CZ3 3.86Å; Y676-W680 PolarHBondContact O-N 2.96Å; A677-W680 PolarHBondContact O-N 2.93Å; Q678-W680 VanDerWaalsContact C-N 3.25Å; Q678-W680 PolarHBondContact O-N 2.92Å; W680-D682 PolarHBondContact O-N 2.82Å; W680-S683 WeakPolarHBondContact O-CB 2.95Å; W680-S683 PolarHBondContact O-N 2.9Å; W680-S683 PolarHBondContact O-OG 3.17Å
681	R	84.2	Confident	84.4	Confident	95 Å²	95	76.8 Å²	76.8	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-58.9	-47.8	174.9	-81.6	-163.5	-174.3	146.6	15.5	112.7	K663 S664 E665 N666 A677 Q678 S683	K663-R681 WeakPolarHBondContact O-CD 3.45Å; K663-R681 VanDerWaalsContact O-CG 3.23Å; K663-R681 WeakPolarHBondContact O-CG 3.37Å; K663-R681 PolarHBondContact O-NE 2.83Å; S664-R681 PolarHBondContact O-NH1 2.69Å; S664-R681 PolarHBondContact O-NH2 3.35Å; E665-R681 PolarHBondContact O-NH2 3.47Å; N666-R681 VanDerWaalsContact N-NH2 3.19Å; A677-R681 WeakPolarHBondContact O-CG 3.42Å; A677-R681 PolarHBondContact O-N 3.37Å; Q678-R681 WeakPolarHBondContact O-CB 3.41Å; Q678-R681 PolarHBondContact O-N 3.03Å; R681-S683 PolarHBondContact O-N 3.1Å
682	D	87.3	Confident	84.2	Confident	63 Å²	63	76 Å²	76	34%	0.337	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	10.4	-176.8	-64.6	-25.6	0	0	0	111.8	Q678 W680 D684 K685 L686	Q678-D682 WeakPolarHBondContact O-CB 3.43Å; Q678-D682 PolarHBondContact O-N 2.73Å; W680-D682 PolarHBondContact O-N 2.82Å; D682-D684 VanDerWaalsContact C-N 3.33Å; D682-D684 PolarHBondContact O-N 3.4Å; D682-K685 WeakPolarHBondContact O-CB 3.47Å; D682-K685 PolarHBondContact O-N 3Å; D682-L686 HydrophobicContact CB-CD1 4.15Å; D682-L686 HydrophobicContact CB-CG 4.17Å; D682-L686 WeakPolarHBondContact O-CB 3.43Å; D682-L686 WeakPolarHBondContact O-CG 3.44Å; D682-L686 PolarHBondContact O-N 3.47Å
683	S	87.7	Confident	84	Confident	14 Å²	14	77.1 Å²	77.1	10%	0.098	36%	0.357	C	S	.	.	H	α-helix	trans	-57.1	-41.3	-171.8	57.2	0	0	0	0	113.9	I679 W680 R681 K687	I679-S683 WeakPolarHBondContact O-CA 3.18Å; I679-S683 PolarHBondContact O-N 3.17Å; I679-S683 VanDerWaalsContact O-N 3.1Å; W680-S683 WeakPolarHBondContact O-CB 2.95Å; W680-S683 PolarHBondContact O-N 2.9Å; W680-S683 PolarHBondContact O-OG 3.17Å; R681-S683 PolarHBondContact O-N 3.1Å; S683-K687 VanDerWaalsContact O-CB 3.29Å; S683-K687 WeakPolarHBondContact O-CB 3.42Å; S683-K687 VanDerWaalsContact O-CG 3.24Å; S683-K687 WeakPolarHBondContact O-CG 3.45Å; S683-K687 PolarHBondContact O-N 3.39Å
684	D	87.2	Confident	83.2	Confident	81 Å²	81	75.9 Å²	75.9	43%	0.433	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-44.2	177.5	-66.7	-36.2	0	0	0	110.8	K663 D682 Q688	K663-D684 IonicContact NZ-OD2 2.7Å; K663-D684 PolarHBondContact NZ-OD2 2.91Å; D682-D684 VanDerWaalsContact C-N 3.33Å; D682-D684 PolarHBondContact O-N 3.4Å; D684-Q688 WeakPolarHBondContact O-CB 3.29Å; D684-Q688 VanDerWaalsContact O-CG 3.28Å; D684-Q688 WeakPolarHBondContact O-CG 3.08Å; D684-Q688 PolarHBondContact O-N 2.94Å
685	K	88.1	Confident	82.6	Confident	123 Å²	123	71.5 Å²	71.5	54%	0.535	33%	0.33	S	S	.	.	H	α-helix	trans	-66.7	-47.6	178.1	-177.8	-178.7	172.8	-174.6	0	111.6	D682 K687 Q688 E689	D682-K685 WeakPolarHBondContact O-CB 3.47Å; D682-K685 PolarHBondContact O-N 3Å; K685-K687 PolarHBondContact O-N 2.91Å; K685-Q688 PolarHBondContact O-N 3.08Å; K685-E689 WeakPolarHBondContact CE-OE1 3.06Å; K685-E689 WeakPolarHBondContact O-CG 3.41Å; K685-E689 PolarHBondContact O-N 3.08Å
686	L	88	Confident	82.4	Confident	21 Å²	21	66 Å²	66	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-40.6	178.5	-69.8	171.8	0	0	0	111.7	L627 K630 V631 I634 I679 D682 E689 F690	L627-L686 HydrophobicContact CD1-CB 4.49Å; L627-L686 HydrophobicContact CD1-CD2 3.66Å; K630-L686 HydrophobicContact CB-CD1 4.36Å; V631-L686 HydrophobicContact CG2-CB 4.29Å; I634-L686 HydrophobicContact CD1-CB 4.06Å; I679-L686 HydrophobicContact CB-CD1 4.48Å; I679-L686 HydrophobicContact CG2-CD1 4.12Å; D682-L686 HydrophobicContact CB-CD1 4.15Å; D682-L686 HydrophobicContact CB-CG 4.17Å; D682-L686 WeakPolarHBondContact O-CB 3.43Å; D682-L686 WeakPolarHBondContact O-CG 3.44Å; D682-L686 PolarHBondContact O-N 3.47Å; L686-E689 PolarHBondContact O-N 3.33Å; L686-F690 WeakPolarHBondContact O-CB 3.3Å; L686-F690 PolarHBondContact O-N 3.33Å
687	K	86.8	Confident	82.2	Confident	104 Å²	104	62.1 Å²	62.1	45%	0.452	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-42.4	173.9	-78.8	174.7	-178.9	167.4	0	112	I634 S683 K685 F690 K691	I634-K687 HydrophobicContact CD1-CG 3.96Å; S683-K687 VanDerWaalsContact O-CB 3.29Å; S683-K687 WeakPolarHBondContact O-CB 3.42Å; S683-K687 VanDerWaalsContact O-CG 3.24Å; S683-K687 WeakPolarHBondContact O-CG 3.45Å; S683-K687 PolarHBondContact O-N 3.39Å; K685-K687 PolarHBondContact O-N 2.91Å; K687-F690 PolarHBondContact O-N 3.34Å; K687-K691 WeakPolarHBondContact O-CB 3.33Å; K687-K691 PolarHBondContact O-N 3.42Å
688	Q	83.2	Confident	82.2	Confident	129 Å²	129	66.8 Å²	66.8	60%	0.603	32%	0.315	S	S	*	.	H	α-helix	trans	-63.2	-49.6	175.8	-75.5	175.4	1.2	0	0	110.9	D684 K685 F690 K691 Y692	D684-Q688 WeakPolarHBondContact O-CB 3.29Å; D684-Q688 VanDerWaalsContact O-CG 3.28Å; D684-Q688 WeakPolarHBondContact O-CG 3.08Å; D684-Q688 PolarHBondContact O-N 2.94Å; K685-Q688 PolarHBondContact O-N 3.08Å; Q688-F690 VanDerWaalsContact C-N 3.33Å; Q688-F690 PolarHBondContact O-N 2.99Å; Q688-K691 WeakPolarHBondContact O-CB 3.41Å; Q688-K691 PolarHBondContact O-N 3.12Å; Q688-Y692 WeakPolarHBondContact O-CD2 3.39Å; Q688-Y692 PolarHBondContact O-N 3.35Å
689	E	82.6	Confident	82.2	Confident	52 Å²	52	62.1 Å²	62.1	24%	0.243	29%	0.292	C	S	.	.	H	α-helix	trans	-57.3	-46.5	176.1	-74.1	-178.3	-167.2	0	0	111.3	Y623 L627 K685 L686 K691 Y692 Q693	Y623-E689 PolarHBondContact OH-OE2 2.92Å; Y623-E689 VanDerWaalsContact OH-OE2 3.05Å; L627-E689 HydrophobicContact CD1-CB 4.35Å; L627-E689 HydrophobicContact CD2-CB 4.2Å; K685-E689 WeakPolarHBondContact CE-OE1 3.06Å; K685-E689 WeakPolarHBondContact O-CG 3.41Å; K685-E689 PolarHBondContact O-N 3.08Å; L686-E689 PolarHBondContact O-N 3.33Å; E689-K691 VanDerWaalsContact C-N 3.34Å; E689-K691 PolarHBondContact O-N 3.29Å; E689-Y692 PolarHBondContact O-N 3.03Å; E689-Q693 VanDerWaalsContact O-CB 3.28Å; E689-Q693 WeakPolarHBondContact O-CB 3.47Å; E689-Q693 VanDerWaalsContact O-CG 3.26Å; E689-Q693 WeakPolarHBondContact O-CG 3.24Å; E689-Q693 PolarHBondContact O-N 3.09Å
690	F	84.3	Confident	82.4	Confident	53 Å²	53	62.2 Å²	62.2	23%	0.232	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-32.2	178.3	-172.1	-104.6	0	0	0	113.1	L627 E628 V631 L686 K687 Q688 Y692 Q693 S694	L627-F690 HydrophobicContact CD2-CB 4.4Å; L627-F690 HydrophobicContact CD2-CD2 4.44Å; L627-F690 HydrophobicContact CG-CB 4.36Å; L627-F690 HydrophobicContact CG-CD2 4.2Å; E628-F690 HydrophobicContact CB-CE2 3.79Å; E628-F690 HydrophobicContact CG-CE2 3.77Å; E628-F690 HydrophobicContact CG-CZ 4.01Å; V631-F690 HydrophobicContact CB-CB 4.36Å; V631-F690 HydrophobicContact CB-CD1 4.31Å; V631-F690 HydrophobicContact CB-CD2 4.38Å; V631-F690 HydrophobicContact CB-CG 4.09Å; V631-F690 HydrophobicContact CG1-CB 4.3Å; V631-F690 HydrophobicContact CG1-CD1 3.73Å; V631-F690 HydrophobicContact CG1-CE1 4.21Å; V631-F690 HydrophobicContact CG1-CG 3.98Å; V631-F690 HydrophobicContact CG2-CB 3.5Å; V631-F690 HydrophobicContact CG2-CD1 4.35Å; V631-F690 HydrophobicContact CG2-CD2 4.09Å; V631-F690 HydrophobicContact CG2-CG 3.73Å; L686-F690 WeakPolarHBondContact O-CB 3.3Å; L686-F690 PolarHBondContact O-N 3.33Å; K687-F690 PolarHBondContact O-N 3.34Å; Q688-F690 VanDerWaalsContact C-N 3.33Å; Q688-F690 PolarHBondContact O-N 2.99Å; F690-Y692 VanDerWaalsContact C-N 3.28Å; F690-Y692 PolarHBondContact O-N 3.34Å; F690-Q693 PolarHBondContact O-N 3.5Å; F690-S694 WeakPolarHBondContact O-CA 3.33Å; F690-S694 WeakPolarHBondContact O-CB 3.3Å; F690-S694 PolarHBondContact O-N 3.35Å; F690-S694 PolarHBondContact O-OG 3.01Å
691	K	79.2	Confident	82.6	Confident	122 Å²	122	60.9 Å²	60.9	53%	0.53	29%	0.287	S	S	.	.	H	α-helix	trans	-58.7	-43	174.3	-176	174.6	178.4	169.5	0	111.2	E408 K687 Q688 E689	E408-K691 IonicContact OE1-NZ 2.9Å; E408-K691 PolarHBondContact OE1-NZ 2.83Å; K687-K691 WeakPolarHBondContact O-CB 3.33Å; K687-K691 PolarHBondContact O-N 3.42Å; Q688-K691 WeakPolarHBondContact O-CB 3.41Å; Q688-K691 PolarHBondContact O-N 3.12Å; E689-K691 VanDerWaalsContact C-N 3.34Å; E689-K691 PolarHBondContact O-N 3.29Å
692	Y	69.2	Low	82.8	Confident	133 Å²	133	61.5 Å²	61.5	52%	0.522	29%	0.294	S	S	.	.	H	α-helix	trans	-75.7	-32.7	176.6	-66.9	-71.3	0	0	0	112.9	L378 R445 Q688 E689 F690	L378-Y692 HydrophobicContact CD2-CD1 4.22Å; R445-Y692 PolarHBondContact NH2-O 2.86Å; Q688-Y692 WeakPolarHBondContact O-CD2 3.39Å; Q688-Y692 PolarHBondContact O-N 3.35Å; E689-Y692 PolarHBondContact O-N 3.03Å; F690-Y692 VanDerWaalsContact C-N 3.28Å; F690-Y692 PolarHBondContact O-N 3.34Å
693	Q	74	Confident	83	Confident	35 Å²	35	60.1 Å²	60.1	16%	0.164	29%	0.289	C	S	.	.	H	α-helix	trans	-99.5	-15.7	-170.3	-65.8	-175.7	23.5	0	0	115.9	Y623 L624 L627 E689 F690 C695 Q696	Y623-Q693 PolarHBondContact OH-NE2 3.21Å; L624-Q693 HydrophobicContact CD2-CB 3.82Å; L624-Q693 HydrophobicContact CD2-CG 4.27Å; L627-Q693 HydrophobicContact CD2-CB 4.01Å; L627-Q693 HydrophobicContact CD2-CG 4.38Å; E689-Q693 VanDerWaalsContact O-CB 3.28Å; E689-Q693 WeakPolarHBondContact O-CB 3.47Å; E689-Q693 VanDerWaalsContact O-CG 3.26Å; E689-Q693 WeakPolarHBondContact O-CG 3.24Å; E689-Q693 PolarHBondContact O-N 3.09Å; F690-Q693 PolarHBondContact O-N 3.5Å; Q693-C695 PolarHBondContact O-N 2.97Å; Q693-C695 VanDerWaalsContact O-N 3.13Å; Q693-Q696 HydrophobicContact CB-CG 4.31Å; Q693-Q696 WeakPolarHBondContact O-CA 3.42Å; Q693-Q696 WeakPolarHBondContact O-CB 3.04Å; Q693-Q696 WeakPolarHBondContact O-CG 3.44Å; Q693-Q696 PolarHBondContact O-N 2.92Å
694	S	68.2	Low	83.2	Confident	47 Å²	47	59.5 Å²	59.5	33%	0.329	29%	0.285	S	S	.	.	H	α-helix	trans	-52.7	-42.5	-171.7	49.7	0	0	0	0	113.4	F690	F690-S694 WeakPolarHBondContact O-CA 3.33Å; F690-S694 WeakPolarHBondContact O-CB 3.3Å; F690-S694 PolarHBondContact O-N 3.35Å; F690-S694 PolarHBondContact O-OG 3.01Å
695	C	73	Confident	83.5	Confident	40 Å²	40	56 Å²	56	27%	0.27	27%	0.266	S	S	.	.	H	α-helix	trans	-74.5	-16.6	176.1	34.5	0	0	0	0	115.3	R445 Q693 R699	R445-C695 PolarHBondContact NH1-SG 2.79Å; R445-C695 PolarHBondContact NH2-SG 3.34Å; Q693-C695 PolarHBondContact O-N 2.97Å; Q693-C695 VanDerWaalsContact O-N 3.13Å; C695-R699 PolarHBondContact O-N 2.82Å
696	Q	79.5	Confident	83.7	Confident	9 Å²	9	52.6 Å²	52.6	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-69.2	-37.5	-179.7	-60.3	-97.6	-43.5	0	0	111.3	Y557 L624 Q693 R699 Y700	Y557-Q696 VanDerWaalsContact CE2-OE1 3.27Å; Y557-Q696 PolarHBondContact OH-O 3.34Å; L624-Q696 HydrophobicContact CD1-CB 3.94Å; L624-Q696 HydrophobicContact CD2-CB 4.17Å; Q693-Q696 HydrophobicContact CB-CG 4.31Å; Q693-Q696 WeakPolarHBondContact O-CA 3.42Å; Q693-Q696 WeakPolarHBondContact O-CB 3.04Å; Q693-Q696 WeakPolarHBondContact O-CG 3.44Å; Q693-Q696 PolarHBondContact O-N 2.92Å; Q696-R699 WeakPolarHBondContact O-CB 3.48Å; Q696-R699 PolarHBondContact O-N 2.75Å; Q696-Y700 VanDerWaalsContact O-CD2 3.27Å; Q696-Y700 WeakPolarHBondContact O-CD2 3.48Å; Q696-Y700 PolarHBondContact O-N 2.82Å
697	L	83.3	Confident	84	Confident	9 Å²	9	51.8 Å²	51.8	5%	0.047	25%	0.254	C	S	.	.	H	α-helix	trans	-61.3	-50.7	-176.4	-175.4	65.5	0	0	0	111.5	L621 L624 K625 E628 R699 Y700 Y701	L621-L697 HydrophobicContact CD2-CD1 3.98Å; L624-L697 HydrophobicContact CB-CD1 4.08Å; K625-L697 HydrophobicContact CG-CD1 4.03Å; K625-L697 HydrophobicContact CG-CD2 4.38Å; E628-L697 WeakPolarHBondContact OE2-CD2 3.22Å; L697-R699 PolarHBondContact O-N 3.31Å; L697-Y700 PolarHBondContact O-N 3.28Å; L697-Y700 VanDerWaalsContact O-N 3.14Å; L697-Y701 HydrophobicContact CD1-CE1 3.83Å; L697-Y701 HydrophobicContact CD2-CE2 4.48Å; L697-Y701 HydrophobicContact CG-CE1 4.16Å; L697-Y701 HydrophobicContact CG-CE2 4.12Å; L697-Y701 PolarHBondContact O-N 3.49Å
698	N	84.2	Confident	84.3	Confident	101 Å²	101	47 Å²	47	54%	0.54	23%	0.232	S	C	.	.	H	α-helix	trans	-57.2	-38.9	176.2	-71.1	-16.3	0	0	0	111.9	Y701 E702	N698-Y701 WeakPolarHBondContact O-CB 3.4Å; N698-Y701 PolarHBondContact O-N 2.94Å; N698-E702 WeakPolarHBondContact O-CG 3.21Å; N698-E702 PolarHBondContact O-N 2.94Å
699	R	85.8	Confident	84.8	Confident	18 Å²	18	42.6 Å²	42.6	7%	0.068	21%	0.213	C	C	.	.	H	α-helix	trans	-68.5	-38.7	178.7	-175.7	-177.8	179	110.8	-6.8	112.5	T446 Y557 C695 Q696 L697 Y701 E702 C703	T446-R699 PolarHBondContact O-NH1 2.8Å; T446-R699 PolarHBondContact O-NH2 3.03Å; Y557-R699 HydrophobicContact CE1-CG 4.08Å; C695-R699 PolarHBondContact O-N 2.82Å; Q696-R699 WeakPolarHBondContact O-CB 3.48Å; Q696-R699 PolarHBondContact O-N 2.75Å; L697-R699 PolarHBondContact O-N 3.31Å; R699-Y701 VanDerWaalsContact C-N 3.26Å; R699-Y701 PolarHBondContact O-N 2.92Å; R699-E702 WeakPolarHBondContact O-CB 3.49Å; R699-E702 PolarHBondContact O-N 3.34Å; R699-C703 PolarHBondContact O-N 2.94Å; R699-C703 PolarHBondContact O-SG 2.97Å
700	Y	89.3	Confident	85.2	Confident	10 Å²	10	40.9 Å²	40.9	4%	0.039	21%	0.205	C	C	.	.	H	α-helix	trans	-62.1	-37.8	170.9	-81.7	-69	0	0	0	111.5	Y557 L558 I617 K620 L621 L624 Q696 L697 E702 C703 I704	Y557-Y700 HydrophobicContact CD1-CE1 4.19Å; Y557-Y700 AromaticContact CE1-CD1 3.78Å; Y557-Y700 HydrophobicContact CE1-CD1 3.78Å; Y557-Y700 HydrophobicContact CE1-CD2 4.35Å; Y557-Y700 AromaticContact CE1-CE1 3.59Å; Y557-Y700 HydrophobicContact CE1-CE1 3.59Å; Y557-Y700 HydrophobicContact CE1-CE2 4.16Å; Y557-Y700 HydrophobicContact CE1-CG 4.16Å; Y557-Y700 AromaticContact CE1-CZ 3.79Å; Y557-Y700 HydrophobicContact CE2-CE2 4.23Å; Y557-Y700 AromaticContact CZ-CD2 3.9Å; Y557-Y700 AromaticContact CZ-CE1 3.93Å; Y557-Y700 AromaticContact CZ-CE2 3.62Å; Y557-Y700 AromaticContact CZ-CZ 3.64Å; Y557-Y700 PolarHBondContact O-OH 2.9Å; Y557-Y700 WeakPolarHBondContact OH-CD2 3.49Å; Y557-Y700 VanDerWaalsContact OH-CE2 3.23Å; Y557-Y700 WeakPolarHBondContact OH-CE2 3.44Å; L558-Y700 HydrophobicContact CD2-CD1 4.24Å; L558-Y700 HydrophobicContact CD2-CE1 3.9Å; I617-Y700 HydrophobicContact CG2-CD1 3.37Å; I617-Y700 HydrophobicContact CG2-CE1 3.52Å; I617-Y700 HydrophobicContact CG2-CG 4.25Å; K620-Y700 HydrophobicContact CG-CE2 3.98Å; L621-Y700 VanDerWaalsContact CD2-CB 3.49Å; L621-Y700 HydrophobicContact CD2-CD2 4.36Å; L621-Y700 HydrophobicContact CD2-CG 3.98Å; L621-Y700 HydrophobicContact CG-CG 4.48Å; L624-Y700 HydrophobicContact CD1-CD2 3.48Å; L624-Y700 VanDerWaalsContact CD1-CD2 3.48Å; L624-Y700 HydrophobicContact CD1-CE2 3.5Å; L624-Y700 VanDerWaalsContact CD1-CE2 3.5Å; Q696-Y700 VanDerWaalsContact O-CD2 3.27Å; Q696-Y700 WeakPolarHBondContact O-CD2 3.48Å; Q696-Y700 PolarHBondContact O-N 2.82Å; L697-Y700 PolarHBondContact O-N 3.28Å; L697-Y700 VanDerWaalsContact O-N 3.14Å; Y700-E702 VanDerWaalsContact C-N 3.34Å; Y700-E702 PolarHBondContact O-N 3.42Å; Y700-C703 PolarHBondContact O-N 2.94Å; Y700-I704 WeakPolarHBondContact O-CD1 3.02Å; Y700-I704 VanDerWaalsContact O-CG1 3.23Å; Y700-I704 WeakPolarHBondContact O-CG1 3.47Å; Y700-I704 PolarHBondContact O-N 2.82Å
701	Y	90	Very high	85.6	Confident	20 Å²	20	38.8 Å²	38.8	8%	0.078	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-43.3	173.8	-62.2	-14	0	0	0	111.9	L621 K625 L697 N698 R699 C703 I704 V705 L730	L621-Y701 HydrophobicContact CD2-CD1 4.48Å; L621-Y701 HydrophobicContact CD2-CE1 4.22Å; K625-Y701 WeakPolarHBondContact CE-OH 3.39Å; L697-Y701 HydrophobicContact CD1-CE1 3.83Å; L697-Y701 HydrophobicContact CD2-CE2 4.48Å; L697-Y701 HydrophobicContact CG-CE1 4.16Å; L697-Y701 HydrophobicContact CG-CE2 4.12Å; L697-Y701 PolarHBondContact O-N 3.49Å; N698-Y701 WeakPolarHBondContact O-CB 3.4Å; N698-Y701 PolarHBondContact O-N 2.94Å; R699-Y701 VanDerWaalsContact C-N 3.26Å; R699-Y701 PolarHBondContact O-N 2.92Å; Y701-C703 PolarHBondContact O-N 2.85Å; Y701-I704 PolarHBondContact O-N 3.01Å; Y701-V705 WeakPolarHBondContact O-CB 3.43Å; Y701-V705 VanDerWaalsContact O-CG2 3.23Å; Y701-V705 WeakPolarHBondContact O-CG2 3.35Å; Y701-V705 PolarHBondContact O-N 2.89Å; Y701-L730 HydrophobicContact CD1-CB 3.81Å; Y701-L730 HydrophobicContact CD1-CD1 3.91Å; Y701-L730 HydrophobicContact CD1-CD2 4.18Å; Y701-L730 HydrophobicContact CD1-CG 4.18Å; Y701-L730 HydrophobicContact CD2-CB 4.36Å; Y701-L730 HydrophobicContact CE1-CB 3.82Å; Y701-L730 HydrophobicContact CE1-CD2 4.4Å; Y701-L730 HydrophobicContact CE2-CB 4.35Å; Y701-L730 HydrophobicContact CG-CB 4.09Å; Y701-L730 HydrophobicContact CG-CD1 3.96Å; Y701-L730 PolarHBondContact OH-O 3.43Å
702	E	88.4	Confident	86.2	Confident	107 Å²	107	33.2 Å²	33.2	50%	0.5	17%	0.172	S	C	.	.	H	α-helix	trans	-60.2	-43.8	173.6	-69.4	176.6	169	0	0	112	N698 R699 Y700 I704 V705 S706	N698-E702 WeakPolarHBondContact O-CG 3.21Å; N698-E702 PolarHBondContact O-N 2.94Å; R699-E702 WeakPolarHBondContact O-CB 3.49Å; R699-E702 PolarHBondContact O-N 3.34Å; Y700-E702 VanDerWaalsContact C-N 3.34Å; Y700-E702 PolarHBondContact O-N 3.42Å; E702-I704 PolarHBondContact O-N 2.83Å; E702-V705 PolarHBondContact O-N 3.09Å; E702-S706 PolarHBondContact O-N 2.97Å; E702-S706 PolarHBondContact O-OG 2.95Å; E702-S706 VanDerWaalsContact O-OG 3.14Å
703	C	91.2	Very high	87.3	Confident	34 Å²	34	32 Å²	32	23%	0.23	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-42.7	175.5	-67.8	0	0	0	0	112.3	L558 R699 Y700 Y701 S706 L707	L558-C703 HydrophobicContact CD2-CB 4.39Å; R699-C703 PolarHBondContact O-N 2.94Å; R699-C703 PolarHBondContact O-SG 2.97Å; Y700-C703 PolarHBondContact O-N 2.94Å; Y701-C703 PolarHBondContact O-N 2.85Å; C703-S706 PolarHBondContact O-N 2.83Å; C703-L707 WeakPolarHBondContact O-CB 3.24Å; C703-L707 PolarHBondContact O-N 2.94Å
704	I	92.8	Very high	88.1	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-66.5	-41.2	177.9	-65	161.8	0	0	0	110.7	L614 L621 Y700 Y701 E702 L707 Y708 L730 L738 F742	L614-I704 HydrophobicContact CD2-CG1 4.19Å; L614-I704 HydrophobicContact CD2-CG2 4.08Å; L621-I704 HydrophobicContact CD1-CD1 3.73Å; Y700-I704 WeakPolarHBondContact O-CD1 3.02Å; Y700-I704 VanDerWaalsContact O-CG1 3.23Å; Y700-I704 WeakPolarHBondContact O-CG1 3.47Å; Y700-I704 PolarHBondContact O-N 2.82Å; Y701-I704 PolarHBondContact O-N 3.01Å; E702-I704 PolarHBondContact O-N 2.83Å; I704-L707 PolarHBondContact O-N 3Å; I704-Y708 WeakPolarHBondContact O-CB 3.45Å; I704-Y708 PolarHBondContact O-N 3Å; I704-L730 HydrophobicContact CB-CD1 4.32Å; I704-L730 HydrophobicContact CD1-CD1 4.43Å; I704-L730 HydrophobicContact CD1-CD2 3.61Å; I704-L730 HydrophobicContact CG2-CD1 4.25Å; I704-L730 HydrophobicContact CG2-CD2 4.18Å; I704-L738 HydrophobicContact CG2-CD1 4.36Å; I704-L738 HydrophobicContact CG2-CD2 4.36Å; I704-F742 HydrophobicContact CG2-CE2 3.85Å; I704-F742 HydrophobicContact CG2-CZ 3.77Å
705	V	92.8	Very high	89.1	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.036	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-45.2	175.5	169.2	0	0	0	0	110.6	Y701 E702 Y708 I709 K723 L726 L727 L730	Y701-V705 WeakPolarHBondContact O-CB 3.43Å; Y701-V705 VanDerWaalsContact O-CG2 3.23Å; Y701-V705 WeakPolarHBondContact O-CG2 3.35Å; Y701-V705 PolarHBondContact O-N 2.89Å; E702-V705 PolarHBondContact O-N 3.09Å; V705-Y708 WeakPolarHBondContact O-CB 3.46Å; V705-Y708 PolarHBondContact O-N 3.19Å; V705-I709 HydrophobicContact CG1-CD1 3.82Å; V705-I709 VanDerWaalsContact O-CG1 3.31Å; V705-I709 WeakPolarHBondContact O-CG1 3.34Å; V705-I709 PolarHBondContact O-N 2.98Å; V705-K723 HydrophobicContact CG1-CD 4.01Å; V705-K723 HydrophobicContact CG1-CG 3.89Å; V705-L726 HydrophobicContact CB-CD2 4.46Å; V705-L726 HydrophobicContact CG2-CD2 3.92Å; V705-L726 HydrophobicContact CG2-CG 4.33Å; V705-L727 HydrophobicContact CG2-CD2 4.09Å; V705-L727 HydrophobicContact CG2-CG 4.44Å; V705-L730 HydrophobicContact CG2-CD1 4.49Å
706	S	92.5	Very high	89.8	Confident	52 Å²	52	35.2 Å²	35.2	36%	0.364	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-45.7	175.7	-63.8	0	0	0	0	111.6	E702 C703 Y708 I709 D710	E702-S706 PolarHBondContact O-N 2.97Å; E702-S706 PolarHBondContact O-OG 2.95Å; E702-S706 VanDerWaalsContact O-OG 3.14Å; C703-S706 PolarHBondContact O-N 2.83Å; S706-Y708 VanDerWaalsContact C-N 3.29Å; S706-Y708 PolarHBondContact O-N 3.18Å; S706-I709 PolarHBondContact O-N 3.38Å; S706-D710 WeakPolarHBondContact O-CB 3.2Å; S706-D710 PolarHBondContact O-N 2.86Å
707	L	93.6	Very high	90.3	Very high	5 Å²	5	38 Å²	38	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-42.1	176.1	-178.3	65.3	0	0	0	111.9	L578 T579 M613 L614 C703 I704 K711 F742	L578-L707 HydrophobicContact CB-CD1 3.9Å; L578-L707 HydrophobicContact CD1-CD1 4.16Å; L578-L707 HydrophobicContact CG-CD1 4.4Å; T579-L707 WeakPolarHBondContact OG1-CA 3.33Å; T579-L707 PolarHBondContact OG1-N 3.38Å; M613-L707 HydrophobicContact CB-CD2 3.97Å; L614-L707 HydrophobicContact CD2-CD2 4.34Å; L614-L707 HydrophobicContact CG-CD2 4.43Å; C703-L707 WeakPolarHBondContact O-CB 3.24Å; C703-L707 PolarHBondContact O-N 2.94Å; I704-L707 PolarHBondContact O-N 3Å; L707-K711 WeakPolarHBondContact O-CB 3.4Å; L707-K711 PolarHBondContact O-N 3.45Å; L707-F742 HydrophobicContact CD2-CE1 4.28Å; L707-F742 HydrophobicContact CG-CE1 4.18Å
708	Y	93.4	Very high	90.6	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-62.1	-49.6	175.8	-176.9	-101.8	0	0	0	111.7	I704 V705 S706 D710 K711 Y712 V719 R722 L726 Y741 F742	I704-Y708 WeakPolarHBondContact O-CB 3.45Å; I704-Y708 PolarHBondContact O-N 3Å; V705-Y708 WeakPolarHBondContact O-CB 3.46Å; V705-Y708 PolarHBondContact O-N 3.19Å; S706-Y708 VanDerWaalsContact C-N 3.29Å; S706-Y708 PolarHBondContact O-N 3.18Å; Y708-D710 VanDerWaalsContact C-N 3.35Å; Y708-D710 PolarHBondContact O-N 3.12Å; Y708-K711 PolarHBondContact O-N 3.44Å; Y708-Y712 HydrophobicContact CD2-CD2 4.26Å; Y708-Y712 AromaticContact CD2-CE2 3.91Å; Y708-Y712 HydrophobicContact CD2-CE2 3.91Å; Y708-Y712 HydrophobicContact CE1-CD2 4.21Å; Y708-Y712 HydrophobicContact CE1-CE2 4.24Å; Y708-Y712 AromaticContact CE2-CD2 3.96Å; Y708-Y712 HydrophobicContact CE2-CD2 3.96Å; Y708-Y712 AromaticContact CE2-CE2 3.31Å; Y708-Y712 HydrophobicContact CE2-CE2 3.31Å; Y708-Y712 AromaticContact CZ-CD2 3.88Å; Y708-Y712 AromaticContact CZ-CE2 3.46Å; Y708-Y712 VanDerWaalsContact CZ-CE2 3.46Å; Y708-Y712 WeakPolarHBondContact O-CD2 3.49Å; Y708-Y712 PolarHBondContact O-N 2.85Å; Y708-V719 HydrophobicContact CD1-CB 4.45Å; Y708-V719 HydrophobicContact CD1-CG2 3.72Å; Y708-V719 HydrophobicContact CE1-CB 3.74Å; Y708-V719 HydrophobicContact CE1-CG1 4.44Å; Y708-V719 HydrophobicContact CE1-CG2 3.5Å; Y708-V719 VanDerWaalsContact CE1-CG2 3.5Å; Y708-R722 HydrophobicContact CE1-CB 4.27Å; Y708-R722 WeakPolarHBondContact OH-CD 3.49Å; Y708-R722 PolarHBondContact OH-NH1 2.81Å; Y708-L726 HydrophobicContact CD1-CD2 4.05Å; Y708-L726 HydrophobicContact CD2-CD2 4.35Å; Y708-L726 HydrophobicContact CG-CD2 3.8Å; Y708-Y741 HydrophobicContact CD2-CD1 4.45Å; Y708-Y741 HydrophobicContact CD2-CE1 4.45Å; Y708-Y741 HydrophobicContact CE1-CE1 4.35Å; Y708-Y741 AromaticContact CE2-CD1 3.8Å; Y708-Y741 HydrophobicContact CE2-CD1 3.8Å; Y708-Y741 AromaticContact CE2-CE1 3.71Å; Y708-Y741 HydrophobicContact CE2-CE1 3.71Å; Y708-Y741 AromaticContact CZ-CE1 3.69Å; Y708-F742 HydrophobicContact CD2-CD1 4.06Å; Y708-F742 AromaticContact CD2-CD2 3.87Å; Y708-F742 HydrophobicContact CD2-CD2 3.87Å; Y708-F742 HydrophobicContact CD2-CE1 4.02Å; Y708-F742 AromaticContact CD2-CE2 3.83Å; Y708-F742 HydrophobicContact CD2-CE2 3.83Å; Y708-F742 HydrophobicContact CD2-CG 4.01Å; Y708-F742 AromaticContact CD2-CZ 3.92Å; Y708-F742 HydrophobicContact CD2-CZ 3.92Å; Y708-F742 HydrophobicContact CE2-CD2 4.49Å; Y708-F742 HydrophobicContact CG-CE1 4.49Å; Y708-F742 HydrophobicContact CG-CE2 4.43Å; Y708-F742 HydrophobicContact CG-CZ 4.24Å
709	I	92.8	Very high	90.9	Very high	38 Å²	38	38 Å²	38	20%	0.195	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-46.4	179	-68.1	165.1	0	0	0	110.3	V705 S706 Y712 R713 V719	V705-I709 HydrophobicContact CG1-CD1 3.82Å; V705-I709 VanDerWaalsContact O-CG1 3.31Å; V705-I709 WeakPolarHBondContact O-CG1 3.34Å; V705-I709 PolarHBondContact O-N 2.98Å; S706-I709 PolarHBondContact O-N 3.38Å; I709-Y712 PolarHBondContact O-N 2.98Å; I709-R713 WeakPolarHBondContact O-CB 3.04Å; I709-R713 PolarHBondContact O-N 3.26Å; I709-V719 HydrophobicContact CG1-CG2 4.36Å
710	D	92.6	Very high	91	Very high	15 Å²	15	41.4 Å²	41.4	8%	0.08	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-39.6	-178.2	-70.3	-39.1	0	0	0	112.4	T579 A582 S706 Y708 Y712 R713 F714	T579-D710 VanDerWaalsContact CA-OD2 3.29Å; T579-D710 WeakPolarHBondContact CA-OD2 3.42Å; T579-D710 VanDerWaalsContact CB-OD2 3.23Å; T579-D710 WeakPolarHBondContact CB-OD2 3.46Å; T579-D710 VanDerWaalsContact CG2-OD2 3.27Å; T579-D710 WeakPolarHBondContact CG2-OD2 3.37Å; T579-D710 PolarHBondContact OG1-OD2 3.4Å; A582-D710 HydrophobicContact CB-CB 4.15Å; A582-D710 WeakPolarHBondContact CB-OD1 3.24Å; S706-D710 WeakPolarHBondContact O-CB 3.2Å; S706-D710 PolarHBondContact O-N 2.86Å; Y708-D710 VanDerWaalsContact C-N 3.35Å; Y708-D710 PolarHBondContact O-N 3.12Å; D710-Y712 PolarHBondContact O-N 2.91Å; D710-R713 PolarHBondContact O-N 2.91Å; D710-F714 HydrophobicContact CB-CE2 4.45Å; D710-F714 WeakPolarHBondContact O-CD2 3.45Å; D710-F714 PolarHBondContact O-N 2.98Å
711	K	92.8	Very high	91	Very high	10 Å²	10	48.3 Å²	48.3	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-53.4	-52.4	174.4	-179.7	-175.6	-178.2	179.6	0	111.2	L578 M607 A610 L707 Y708 F714 Q715 F742 N743	L578-K711 HydrophobicContact CD1-CB 4.21Å; M607-K711 HydrophobicContact SD-CG 4.2Å; A610-K711 HydrophobicContact CB-CD 3.99Å; L707-K711 WeakPolarHBondContact O-CB 3.4Å; L707-K711 PolarHBondContact O-N 3.45Å; Y708-K711 PolarHBondContact O-N 3.44Å; K711-F714 PolarHBondContact O-N 2.9Å; K711-Q715 PolarHBondContact O-N 3.12Å; K711-F742 HydrophobicContact CD-CD1 4.09Å; K711-F742 PolarHBondContact NZ-O 3.16Å; K711-N743 PolarHBondContact NZ-OD1 3.12Å
712	Y	91.4	Very high	91	Very high	5 Å²	5	48.7 Å²	48.7	2%	0.02	25%	0.25	C	S	.	.	H	α-helix	trans	-74.2	-30.8	-179.5	-77.6	-80.3	0	0	0	112.6	Y708 I709 D710 F714 Q715 G716 K717 V719 F742 Q744 L746	Y708-Y712 HydrophobicContact CD2-CD2 4.26Å; Y708-Y712 AromaticContact CD2-CE2 3.91Å; Y708-Y712 HydrophobicContact CD2-CE2 3.91Å; Y708-Y712 HydrophobicContact CE1-CD2 4.21Å; Y708-Y712 HydrophobicContact CE1-CE2 4.24Å; Y708-Y712 AromaticContact CE2-CD2 3.96Å; Y708-Y712 HydrophobicContact CE2-CD2 3.96Å; Y708-Y712 AromaticContact CE2-CE2 3.31Å; Y708-Y712 HydrophobicContact CE2-CE2 3.31Å; Y708-Y712 AromaticContact CZ-CD2 3.88Å; Y708-Y712 AromaticContact CZ-CE2 3.46Å; Y708-Y712 VanDerWaalsContact CZ-CE2 3.46Å; Y708-Y712 WeakPolarHBondContact O-CD2 3.49Å; Y708-Y712 PolarHBondContact O-N 2.85Å; I709-Y712 PolarHBondContact O-N 2.98Å; D710-Y712 PolarHBondContact O-N 2.91Å; Y712-F714 VanDerWaalsContact C-N 3.33Å; Y712-F714 PolarHBondContact O-N 3Å; Y712-Q715 CarbonylContact O-C 3.54Å; Y712-Q715 WeakPolarHBondContact O-CA 3.43Å; Y712-Q715 WeakPolarHBondContact O-CB 3.35Å; Y712-Q715 PolarHBondContact O-N 2.77Å; Y712-G716 PolarHBondContact O-N 2.62Å; Y712-G716 VanDerWaalsContact O-N 3.08Å; Y712-K717 CarbonylContact C-O 3.1Å; Y712-K717 VanDerWaalsContact C-O 3.29Å; Y712-K717 HydrophobicContact CD1-CB 4.28Å; Y712-K717 HydrophobicContact CD1-CD 4.14Å; Y712-K717 PolarHBondContact O-N 3.32Å; Y712-V719 HydrophobicContact CD1-CG1 3.98Å; Y712-V719 HydrophobicContact CD2-CG1 3.91Å; Y712-V719 HydrophobicContact CD2-CG2 4.04Å; Y712-V719 HydrophobicContact CG-CB 4.49Å; Y712-V719 HydrophobicContact CG-CG1 3.56Å; Y712-V719 HydrophobicContact CG-CG2 4.18Å; Y712-F742 PolarHBondContact OH-O 3.36Å; Y712-Q744 PolarHBondContact OH-O 2.94Å; Y712-L746 HydrophobicContact CD1-CD1 3.88Å; Y712-L746 HydrophobicContact CE1-CB 4.31Å; Y712-L746 HydrophobicContact CE1-CD1 3.47Å; Y712-L746 VanDerWaalsContact CE1-CD1 3.47Å; Y712-L746 HydrophobicContact CE1-CG 3.95Å; Y712-L746 HydrophobicContact CE2-CD1 4.44Å; Y712-L746 HydrophobicContact CG-CD1 4.48Å
713	R	91.4	Very high	91	Very high	107 Å²	107	48.3 Å²	48.3	40%	0.404	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-40.8	173.6	-176.4	-178	173.4	-160	-3.2	111.9	D586 I709 D710 Q715 G716 K717	D586-R713 IonicContact OD1-CZ 3.94Å; D586-R713 IonicContact OD1-NH1 2.71Å; D586-R713 IonicContact OD1-NH2 3.63Å; D586-R713 PolarHBondContact OD1-NH2 3.11Å; D586-R713 IonicContact OD2-CZ 2.53Å; D586-R713 VanDerWaalsContact OD2-CZ 3.28Å; D586-R713 IonicContact OD2-NH1 2.93Å; D586-R713 PolarHBondContact OD2-NH1 2.78Å; D586-R713 IonicContact OD2-NH2 3.28Å; D586-R713 PolarHBondContact OD2-NH2 2.84Å; I709-R713 WeakPolarHBondContact O-CB 3.04Å; I709-R713 PolarHBondContact O-N 3.26Å; D710-R713 PolarHBondContact O-N 2.91Å; R713-Q715 PolarHBondContact O-N 3.46Å; R713-G716 PolarHBondContact O-N 2.73Å; R713-K717 PolarHBondContact N-O 3.19Å
714	F	90.8	Very high	90.9	Very high	41 Å²	41	52 Å²	52	18%	0.18	27%	0.265	C	S	.	.	H	α-helix	trans	-67.2	-23	173.3	-74.5	-62	0	0	0	113.2	L578 I581 A582 K585 L603 I605 D710 K711 Y712 G716	L578-F714 HydrophobicContact CB-CE2 4.44Å; L578-F714 HydrophobicContact CD2-CD2 4.4Å; I581-F714 HydrophobicContact CB-CZ 4.47Å; I581-F714 HydrophobicContact CG2-CZ 4.05Å; A582-F714 HydrophobicContact CB-CE2 3.89Å; A582-F714 HydrophobicContact CB-CZ 3.78Å; K585-F714 HydrophobicContact CD-CE1 4.37Å; L603-F714 HydrophobicContact CD1-CD1 4.05Å; L603-F714 HydrophobicContact CD1-CE1 3.89Å; L603-F714 HydrophobicContact CD2-CE1 4.16Å; I605-F714 HydrophobicContact CD1-CD1 4.29Å; I605-F714 HydrophobicContact CD1-CD2 4.48Å; I605-F714 HydrophobicContact CD1-CE1 4.24Å; I605-F714 HydrophobicContact CD1-CE2 4.44Å; I605-F714 HydrophobicContact CD1-CG 4.42Å; I605-F714 HydrophobicContact CD1-CZ 4.31Å; I605-F714 HydrophobicContact CG1-CB 4.48Å; I605-F714 HydrophobicContact CG1-CD1 4.13Å; I605-F714 HydrophobicContact CG1-CG 4.19Å; I605-F714 HydrophobicContact CG2-CB 4.5Å; D710-F714 HydrophobicContact CB-CE2 4.45Å; D710-F714 WeakPolarHBondContact O-CD2 3.45Å; D710-F714 PolarHBondContact O-N 2.98Å; K711-F714 PolarHBondContact O-N 2.9Å; Y712-F714 VanDerWaalsContact C-N 3.33Å; Y712-F714 PolarHBondContact O-N 3Å; F714-G716 VanDerWaalsContact C-N 3.32Å
715	Q	89.1	Confident	90.8	Very high	79 Å²	79	55.7 Å²	55.7	37%	0.369	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-0.5	170.6	-61.1	178.3	-5.4	0	0	113.4	M607 K711 Y712 R713	M607-Q715 HydrophobicContact CE-CG 3.54Å; M607-Q715 HydrophobicContact SD-CG 4.02Å; M607-Q715 PolarHBondContact SD-NE2 2.81Å; K711-Q715 PolarHBondContact O-N 3.12Å; Y712-Q715 CarbonylContact O-C 3.54Å; Y712-Q715 WeakPolarHBondContact O-CA 3.43Å; Y712-Q715 WeakPolarHBondContact O-CB 3.35Å; Y712-Q715 PolarHBondContact O-N 2.77Å; R713-Q715 PolarHBondContact O-N 3.46Å
716	G	88.4	Confident	90.7	Very high	70 Å²	70	55.4 Å²	55.4	72%	0.722	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	19.4	-178.9	0	0	0	0	0	115.1	Y712 R713 F714	Y712-G716 PolarHBondContact O-N 2.62Å; Y712-G716 VanDerWaalsContact O-N 3.08Å; R713-G716 PolarHBondContact O-N 2.73Å; F714-G716 VanDerWaalsContact C-N 3.32Å
717	K	89.7	Confident	90.6	Very high	66 Å²	66	55.5 Å²	55.5	29%	0.287	28%	0.279	S	S	.	.			trans	-111.6	140.4	-179.6	-62.7	-179.9	-177.6	177.5	0	111.2	Y712 R713 L746	Y712-K717 CarbonylContact C-O 3.1Å; Y712-K717 VanDerWaalsContact C-O 3.29Å; Y712-K717 HydrophobicContact CD1-CB 4.28Å; Y712-K717 HydrophobicContact CD1-CD 4.14Å; Y712-K717 PolarHBondContact O-N 3.32Å; R713-K717 PolarHBondContact N-O 3.19Å; K717-L746 HydrophobicContact CD-CB 4.41Å; K717-L746 PolarHBondContact NZ-O 3.27Å
718	D	89.5	Confident	90.4	Very high	110 Å²	110	61.1 Å²	61.1	59%	0.588	30%	0.303	S	S	*	.			trans	-96.2	128.3	170.4	-174.2	5	0	0	0	109.9	N720 Y721	D718-N720 WeakPolarHBondContact OD1-CB 3.43Å; D718-N720 PolarHBondContact OD1-N 2.91Å; D718-N720 PolarHBondContact OD1-ND2 2.79Å; D718-Y721 WeakPolarHBondContact O-CE1 3.23Å
719	V	90.2	Very high	90.2	Very high	2 Å²	2	62.8 Å²	62.8	1%	0.012	31%	0.312	C	S	.	.			trans	-127.3	14.2	-175.7	-62.6	0	0	0	0	112.9	Y708 I709 Y712 Y721 R722 L746	Y708-V719 HydrophobicContact CD1-CB 4.45Å; Y708-V719 HydrophobicContact CD1-CG2 3.72Å; Y708-V719 HydrophobicContact CE1-CB 3.74Å; Y708-V719 HydrophobicContact CE1-CG1 4.44Å; Y708-V719 HydrophobicContact CE1-CG2 3.5Å; Y708-V719 VanDerWaalsContact CE1-CG2 3.5Å; I709-V719 HydrophobicContact CG1-CG2 4.36Å; Y712-V719 HydrophobicContact CD1-CG1 3.98Å; Y712-V719 HydrophobicContact CD2-CG1 3.91Å; Y712-V719 HydrophobicContact CD2-CG2 4.04Å; Y712-V719 HydrophobicContact CG-CB 4.49Å; Y712-V719 HydrophobicContact CG-CG1 3.56Å; Y712-V719 HydrophobicContact CG-CG2 4.18Å; V719-Y721 PolarHBondContact O-N 2.86Å; V719-Y721 VanDerWaalsContact O-N 3.1Å; V719-R722 WeakPolarHBondContact O-CB 3.25Å; V719-R722 PolarHBondContact O-N 2.86Å; V719-L746 HydrophobicContact CG1-CD1 3.39Å
720	N	88	Confident	90	Very high	88 Å²	88	61 Å²	61	47%	0.471	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-55.7	-31.6	-178	-80.7	-53.4	0	0	0	113.5	D718 R722 K723	D718-N720 WeakPolarHBondContact OD1-CB 3.43Å; D718-N720 PolarHBondContact OD1-N 2.91Å; D718-N720 PolarHBondContact OD1-ND2 2.79Å; N720-R722 PolarHBondContact O-N 2.81Å; N720-K723 WeakPolarHBondContact O-CB 3.36Å; N720-K723 PolarHBondContact O-N 3.03Å
721	Y	89.7	Confident	89.7	Confident	155 Å²	155	66.4 Å²	66.4	61%	0.608	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-64.2	-24.2	177.7	65.4	-89.1	0	0	0	113.6	D718 V719 K723	D718-Y721 WeakPolarHBondContact O-CE1 3.23Å; V719-Y721 PolarHBondContact O-N 2.86Å; V719-Y721 VanDerWaalsContact O-N 3.1Å; Y721-K723 VanDerWaalsContact C-N 3.33Å
722	R	90.2	Very high	89.4	Confident	28 Å²	28	72.1 Å²	72.1	11%	0.106	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-85.5	-1.3	-179.8	-62.3	-165.1	72.8	-173.7	7.7	114	Y708 V719 N720 N724 D725 L726 Y741 L746	Y708-R722 HydrophobicContact CE1-CB 4.27Å; Y708-R722 WeakPolarHBondContact OH-CD 3.49Å; Y708-R722 PolarHBondContact OH-NH1 2.81Å; V719-R722 WeakPolarHBondContact O-CB 3.25Å; V719-R722 PolarHBondContact O-N 2.86Å; N720-R722 PolarHBondContact O-N 2.81Å; R722-N724 VanDerWaalsContact C-N 3.33Å; R722-N724 PolarHBondContact O-N 2.84Å; R722-D725 PolarHBondContact O-N 3.35Å; R722-L726 PolarHBondContact O-N 2.94Å; R722-L726 VanDerWaalsContact O-N 3.07Å; R722-Y741 WeakPolarHBondContact CB-OH 3.34Å; R722-Y741 PolarHBondContact NE-OH 2.76Å; R722-Y741 VanDerWaalsContact NE-OH 3.12Å; R722-Y741 VanDerWaalsContact NH2-CZ 3.31Å; R722-Y741 PolarHBondContact NH2-OH 3.06Å; R722-Y741 PolarHBondContact O-OH 3.28Å; R722-L746 VanDerWaalsContact NH1-CD2 3.34Å
723	K	88.2	Confident	89.2	Confident	99 Å²	99	73.6 Å²	73.6	43%	0.43	36%	0.364	S	S	.	.	H	α-helix	trans	-56.3	-45.1	-176.3	177.8	172.8	176.1	175.3	0	112.5	V705 N720 Y721 D725 L726 L727	V705-K723 HydrophobicContact CG1-CD 4.01Å; V705-K723 HydrophobicContact CG1-CG 3.89Å; N720-K723 WeakPolarHBondContact O-CB 3.36Å; N720-K723 PolarHBondContact O-N 3.03Å; Y721-K723 VanDerWaalsContact C-N 3.33Å; K723-D725 VanDerWaalsContact C-N 3.32Å; K723-D725 PolarHBondContact O-N 2.81Å; K723-L726 PolarHBondContact O-N 3.03Å; K723-L727 HydrophobicContact CG-CD1 4.26Å; K723-L727 WeakPolarHBondContact O-CG 3.47Å; K723-L727 PolarHBondContact O-N 2.87Å
724	N	89.4	Confident	89	Confident	112 Å²	112	71.4 Å²	71.4	60%	0.599	36%	0.361	S	S	*	.	H	α-helix	trans	-66.9	-34.4	-178.3	-67.5	-24.2	0	0	0	112.4	R722 L727 K728	R722-N724 VanDerWaalsContact C-N 3.33Å; R722-N724 PolarHBondContact O-N 2.84Å; N724-L727 PolarHBondContact O-N 2.84Å; N724-K728 WeakPolarHBondContact O-CG 3.43Å; N724-K728 PolarHBondContact O-N 3.12Å
725	D	90	Very high	89	Confident	80 Å²	80	70.6 Å²	70.6	43%	0.428	36%	0.358	S	S	.	.	H	α-helix	trans	-71.1	-39.4	177.8	-62.7	-26	0	0	0	111.1	R722 K723 K728 L729	R722-D725 PolarHBondContact O-N 3.35Å; K723-D725 VanDerWaalsContact C-N 3.32Å; K723-D725 PolarHBondContact O-N 2.81Å; D725-K728 PolarHBondContact O-N 2.98Å; D725-L729 PolarHBondContact O-N 2.86Å
726	L	90.9	Very high	89.1	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-63	-41.5	173.3	-178.5	57.7	0	0	0	111.7	V705 Y708 R722 K723 K728 L729 L730 L738 Y741 F742	V705-L726 HydrophobicContact CB-CD2 4.46Å; V705-L726 HydrophobicContact CG2-CD2 3.92Å; V705-L726 HydrophobicContact CG2-CG 4.33Å; Y708-L726 HydrophobicContact CD1-CD2 4.05Å; Y708-L726 HydrophobicContact CD2-CD2 4.35Å; Y708-L726 HydrophobicContact CG-CD2 3.8Å; R722-L726 PolarHBondContact O-N 2.94Å; R722-L726 VanDerWaalsContact O-N 3.07Å; K723-L726 PolarHBondContact O-N 3.03Å; L726-K728 PolarHBondContact O-N 2.83Å; L726-L729 HydrophobicContact CD1-CD2 4.47Å; L726-L729 WeakPolarHBondContact O-CB 3.39Å; L726-L729 PolarHBondContact O-N 3.2Å; L726-L729 VanDerWaalsContact O-N 3.15Å; L726-L730 HydrophobicContact CD1-CG 4.47Å; L726-L730 HydrophobicContact CG-CD1 4.24Å; L726-L730 VanDerWaalsContact O-CG 3.31Å; L726-L730 WeakPolarHBondContact O-CG 3.45Å; L726-L730 PolarHBondContact O-N 2.88Å; L726-L738 HydrophobicContact CD1-CD1 3.56Å; L726-Y741 HydrophobicContact CB-CE1 4.05Å; L726-Y741 HydrophobicContact CD1-CD1 3.92Å; L726-Y741 HydrophobicContact CD1-CE1 3.97Å; L726-Y741 HydrophobicContact CG-CE1 4.47Å; L726-F742 HydrophobicContact CD1-CE2 4.25Å
727	L	89.8	Confident	89.3	Confident	53 Å²	53	74.6 Å²	74.6	28%	0.277	36%	0.36	S	S	.	.	H	α-helix	trans	-60.3	-42.7	175.9	-72.8	171.5	0	0	0	112.1	V705 K723 N724 L729 L730 E731	V705-L727 HydrophobicContact CG2-CD2 4.09Å; V705-L727 HydrophobicContact CG2-CG 4.44Å; K723-L727 HydrophobicContact CG-CD1 4.26Å; K723-L727 WeakPolarHBondContact O-CG 3.47Å; K723-L727 PolarHBondContact O-N 2.87Å; N724-L727 PolarHBondContact O-N 2.84Å; L727-L729 VanDerWaalsContact C-N 3.3Å; L727-L729 PolarHBondContact O-N 2.71Å; L727-L730 WeakPolarHBondContact O-CB 3.45Å; L727-L730 PolarHBondContact O-N 3.44Å; L727-E731 PolarHBondContact O-N 2.91Å
728	K	89.7	Confident	89.4	Confident	124 Å²	124	71.5 Å²	71.5	54%	0.539	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-36.1	174.2	-69.2	171.8	-176	168.9	0	112.8	N724 D725 L726 L730 E731 N732	N724-K728 WeakPolarHBondContact O-CG 3.43Å; N724-K728 PolarHBondContact O-N 3.12Å; D725-K728 PolarHBondContact O-N 2.98Å; L726-K728 PolarHBondContact O-N 2.83Å; K728-L730 VanDerWaalsContact C-N 3.33Å; K728-E731 PolarHBondContact O-N 2.79Å; K728-N732 PolarHBondContact O-N 3.32Å
729	L	90.3	Very high	89.5	Confident	37 Å²	37	67 Å²	67	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-66.8	-37.8	175.5	-171.8	67.9	0	0	0	111.2	D725 L726 L727 N732 Y733 K737 L738 Y741	D725-L729 PolarHBondContact O-N 2.86Å; L726-L729 HydrophobicContact CD1-CD2 4.47Å; L726-L729 WeakPolarHBondContact O-CB 3.39Å; L726-L729 PolarHBondContact O-N 3.2Å; L726-L729 VanDerWaalsContact O-N 3.15Å; L727-L729 VanDerWaalsContact C-N 3.3Å; L727-L729 PolarHBondContact O-N 2.71Å; L729-N732 CarbonylContact O-C 3.58Å; L729-N732 PolarHBondContact O-N 2.92Å; L729-Y733 PolarHBondContact O-N 3.45Å; L729-Y733 VanDerWaalsContact O-N 3.16Å; L729-K737 HydrophobicContact CD1-CB 4.13Å; L729-L738 HydrophobicContact CD2-CB 4.5Å; L729-L738 HydrophobicContact CD2-CD1 3.96Å; L729-Y741 HydrophobicContact CD2-CD1 4.45Å; L729-Y741 HydrophobicContact CD2-CD2 4.1Å; L729-Y741 HydrophobicContact CD2-CG 3.83Å
730	L	88.7	Confident	89.5	Confident	0 Å²	0	73 Å²	73	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-69.4	-35.4	176.9	-69.2	171.3	0	0	0	112.4	K625 Y701 I704 V705 L726 L727 K728 N732 Y733 L738	K625-L730 WeakPolarHBondContact CE-O 3.49Å; K625-L730 PolarHBondContact NZ-O 3.43Å; Y701-L730 HydrophobicContact CD1-CB 3.81Å; Y701-L730 HydrophobicContact CD1-CD1 3.91Å; Y701-L730 HydrophobicContact CD1-CD2 4.18Å; Y701-L730 HydrophobicContact CD1-CG 4.18Å; Y701-L730 HydrophobicContact CD2-CB 4.36Å; Y701-L730 HydrophobicContact CE1-CB 3.82Å; Y701-L730 HydrophobicContact CE1-CD2 4.4Å; Y701-L730 HydrophobicContact CE2-CB 4.35Å; Y701-L730 HydrophobicContact CG-CB 4.09Å; Y701-L730 HydrophobicContact CG-CD1 3.96Å; Y701-L730 PolarHBondContact OH-O 3.43Å; I704-L730 HydrophobicContact CB-CD1 4.32Å; I704-L730 HydrophobicContact CD1-CD1 4.43Å; I704-L730 HydrophobicContact CD1-CD2 3.61Å; I704-L730 HydrophobicContact CG2-CD1 4.25Å; I704-L730 HydrophobicContact CG2-CD2 4.18Å; V705-L730 HydrophobicContact CG2-CD1 4.49Å; L726-L730 HydrophobicContact CD1-CG 4.47Å; L726-L730 HydrophobicContact CG-CD1 4.24Å; L726-L730 VanDerWaalsContact O-CG 3.31Å; L726-L730 WeakPolarHBondContact O-CG 3.45Å; L726-L730 PolarHBondContact O-N 2.88Å; L727-L730 WeakPolarHBondContact O-CB 3.45Å; L727-L730 PolarHBondContact O-N 3.44Å; K728-L730 VanDerWaalsContact C-N 3.33Å; L730-N732 VanDerWaalsContact C-N 3.26Å; L730-N732 PolarHBondContact O-N 3.28Å; L730-Y733 HydrophobicContact CD2-CD2 4.22Å; L730-Y733 WeakPolarHBondContact O-CB 3.47Å; L730-Y733 PolarHBondContact O-N 3.08Å; L730-Y733 VanDerWaalsContact O-N 3.14Å; L730-L738 HydrophobicContact CD2-CD1 4.02Å; L730-L738 HydrophobicContact CD2-CD2 4.04Å
731	E	85.7	Confident	89.7	Confident	129 Å²	129	69.9 Å²	69.9	60%	0.603	33%	0.332	S	S	*	.	H	α-helix	trans	-57.6	-40.1	170.8	-73	174.8	-179.3	0	0	111.6	K625 L727 K728	K625-E731 PolarHBondContact NZ-O 2.88Å; L727-E731 PolarHBondContact O-N 2.91Å; K728-E731 PolarHBondContact O-N 2.79Å
732	N	85.8	Confident	89.8	Confident	130 Å²	130	62.6 Å²	62.6	70%	0.695	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	44.7	173.6	-65.2	-51.4	0	0	0	112.7	K728 L729 L730 N734	K728-N732 PolarHBondContact O-N 3.32Å; L729-N732 CarbonylContact O-C 3.58Å; L729-N732 PolarHBondContact O-N 2.92Å; L730-N732 VanDerWaalsContact C-N 3.26Å; L730-N732 PolarHBondContact O-N 3.28Å; N732-N734 PolarHBondContact O-N 3.07Å
733	Y	86.9	Confident	89.7	Confident	35 Å²	35	65.3 Å²	65.3	14%	0.137	32%	0.32	C	S	.	.			trans	-41.7	121.8	-174.1	-174.8	-102.2	0	0	0	114.2	D618 L621 I622 K625 L729 L730 L738	D618-Y733 VanDerWaalsContact OD1-CE1 3.22Å; D618-Y733 WeakPolarHBondContact OD1-CE1 3.48Å; D618-Y733 VanDerWaalsContact OD1-CZ 3.27Å; D618-Y733 PolarHBondContact OD1-OH 3.09Å; L621-Y733 HydrophobicContact CB-CE1 4.39Å; L621-Y733 HydrophobicContact CB-CE2 4.49Å; L621-Y733 HydrophobicContact CD1-CD2 4.49Å; L621-Y733 HydrophobicContact CD1-CE2 3.67Å; I622-Y733 HydrophobicContact CG1-CD1 4.45Å; I622-Y733 HydrophobicContact CG1-CE1 3.95Å; K625-Y733 HydrophobicContact CD-CG 4.49Å; L729-Y733 PolarHBondContact O-N 3.45Å; L729-Y733 VanDerWaalsContact O-N 3.16Å; L730-Y733 HydrophobicContact CD2-CD2 4.22Å; L730-Y733 WeakPolarHBondContact O-CB 3.47Å; L730-Y733 PolarHBondContact O-N 3.08Å; L730-Y733 VanDerWaalsContact O-N 3.14Å; Y733-L738 HydrophobicContact CD2-CD2 4.49Å; Y733-L738 HydrophobicContact CE2-CD2 3.88Å
734	N	89	Confident	89.5	Confident	62 Å²	62	64.2 Å²	64.2	33%	0.332	32%	0.316	S	S	.	.			trans	-144.8	122.8	167	174.2	-72.3	0	0	0	106.5	N732 D736 K737 L738	N732-N734 PolarHBondContact O-N 3.07Å; N734-D736 PolarHBondContact O-N 2.86Å; N734-D736 PolarHBondContact OD1-N 3.49Å; N734-D736 VanDerWaalsContact OD1-N 3.11Å; N734-K737 HydrophobicContact CB-CB 4.23Å; N734-K737 HydrophobicContact CB-CD 4.12Å; N734-K737 HydrophobicContact CB-CG 4.21Å; N734-K737 PolarHBondContact O-N 2.94Å; N734-K737 PolarHBondContact OD1-N 2.87Å; N734-L738 WeakPolarHBondContact O-CB 3.45Å; N734-L738 PolarHBondContact O-N 2.81Å
735	L	90.2	Very high	88.8	Confident	23 Å²	23	68.1 Å²	68.1	12%	0.12	33%	0.331	C	S	.	.	H	α-helix	trans	-59.7	-44.6	-173.7	-179.8	65.8	0	0	0	112	L614 R615 D618 K737 L738 I739	L614-L735 HydrophobicContact CB-CD1 4.23Å; R615-L735 HydrophobicContact CG-CD2 4.42Å; D618-L735 HydrophobicContact CB-CD1 4.36Å; D618-L735 HydrophobicContact CB-CD2 4.23Å; L735-K737 PolarHBondContact O-N 2.78Å; L735-L738 WeakPolarHBondContact O-CB 3.43Å; L735-L738 PolarHBondContact O-N 2.98Å; L735-L738 VanDerWaalsContact O-N 3.15Å; L735-I739 HydrophobicContact CD1-CD1 3.98Å; L735-I739 HydrophobicContact CD1-CG1 4.2Å; L735-I739 HydrophobicContact CD2-CD1 4.33Å; L735-I739 HydrophobicContact CG-CD1 3.78Å; L735-I739 HydrophobicContact CG-CG1 4.37Å; L735-I739 WeakPolarHBondContact O-CG1 3.34Å; L735-I739 PolarHBondContact O-N 2.73Å
736	D	91.5	Very high	88	Confident	112 Å²	112	65.7 Å²	65.7	60%	0.599	32%	0.318	S	S	*	.	H	α-helix	trans	-63.7	-44	-177.3	-59.9	-45.9	0	0	0	111.5	N734 L738 I739 E740	N734-D736 PolarHBondContact O-N 2.86Å; N734-D736 PolarHBondContact OD1-N 3.49Å; N734-D736 VanDerWaalsContact OD1-N 3.11Å; D736-L738 VanDerWaalsContact C-N 3.3Å; D736-L738 PolarHBondContact O-N 3.49Å; D736-I739 PolarHBondContact O-N 2.87Å; D736-E740 WeakPolarHBondContact O-CB 3.36Å; D736-E740 PolarHBondContact O-N 2.78Å
737	K	91.6	Very high	86.5	Confident	121 Å²	121	71.1 Å²	71.1	53%	0.526	36%	0.356	S	S	.	.	H	α-helix	trans	-64.6	-35.9	175	-66.7	-177.1	-177.8	177.2	0	112.2	L729 N734 L735 Y741	L729-K737 HydrophobicContact CD1-CB 4.13Å; N734-K737 HydrophobicContact CB-CB 4.23Å; N734-K737 HydrophobicContact CB-CD 4.12Å; N734-K737 HydrophobicContact CB-CG 4.21Å; N734-K737 PolarHBondContact O-N 2.94Å; N734-K737 PolarHBondContact OD1-N 2.87Å; L735-K737 PolarHBondContact O-N 2.78Å; K737-Y741 VanDerWaalsContact O-CB 3.31Å; K737-Y741 WeakPolarHBondContact O-CB 3.39Å; K737-Y741 PolarHBondContact O-N 3.26Å
738	L	92	Very high	84.6	Confident	2 Å²	2	77.9 Å²	77.9	1%	0.01	40%	0.399	C	S	.	.	H	α-helix	trans	-66.7	-45.2	176.5	-174.6	64.3	0	0	0	110.9	L614 I704 L726 L729 L730 Y733 N734 L735 D736 Y741 F742	L614-L738 HydrophobicContact CD1-CD2 4.34Å; L614-L738 HydrophobicContact CD1-CG 4.24Å; L614-L738 HydrophobicContact CD2-CD2 3.81Å; L614-L738 HydrophobicContact CD2-CG 4.47Å; I704-L738 HydrophobicContact CG2-CD1 4.36Å; I704-L738 HydrophobicContact CG2-CD2 4.36Å; L726-L738 HydrophobicContact CD1-CD1 3.56Å; L729-L738 HydrophobicContact CD2-CB 4.5Å; L729-L738 HydrophobicContact CD2-CD1 3.96Å; L730-L738 HydrophobicContact CD2-CD1 4.02Å; L730-L738 HydrophobicContact CD2-CD2 4.04Å; Y733-L738 HydrophobicContact CD2-CD2 4.49Å; Y733-L738 HydrophobicContact CE2-CD2 3.88Å; N734-L738 WeakPolarHBondContact O-CB 3.45Å; N734-L738 PolarHBondContact O-N 2.81Å; L735-L738 WeakPolarHBondContact O-CB 3.43Å; L735-L738 PolarHBondContact O-N 2.98Å; L735-L738 VanDerWaalsContact O-N 3.15Å; D736-L738 VanDerWaalsContact C-N 3.3Å; D736-L738 PolarHBondContact O-N 3.49Å; L738-Y741 WeakPolarHBondContact O-CB 3.25Å; L738-Y741 PolarHBondContact O-N 3Å; L738-F742 HydrophobicContact CD1-CD2 4.06Å; L738-F742 HydrophobicContact CD1-CE2 3.8Å; L738-F742 HydrophobicContact CG-CD2 4.2Å; L738-F742 HydrophobicContact CG-CE2 4.15Å; L738-F742 VanDerWaalsContact O-CD2 3.27Å; L738-F742 WeakPolarHBondContact O-CD2 3.45Å; L738-F742 PolarHBondContact O-N 3.21Å
739	I	91.2	Very high	84.4	Confident	15 Å²	15	75.6 Å²	75.6	8%	0.077	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-45.3	175.9	-67.9	169.9	0	0	0	110.3	E611 L614 L735 D736 Y741 F742 N743	E611-I739 HydrophobicContact CG-CD1 3.97Å; E611-I739 HydrophobicContact CG-CG1 4.22Å; E611-I739 HydrophobicContact CG-CG2 4.21Å; L614-I739 HydrophobicContact CD1-CG1 4.26Å; L735-I739 HydrophobicContact CD1-CD1 3.98Å; L735-I739 HydrophobicContact CD1-CG1 4.2Å; L735-I739 HydrophobicContact CD2-CD1 4.33Å; L735-I739 HydrophobicContact CG-CD1 3.78Å; L735-I739 HydrophobicContact CG-CG1 4.37Å; L735-I739 WeakPolarHBondContact O-CG1 3.34Å; L735-I739 PolarHBondContact O-N 2.73Å; D736-I739 PolarHBondContact O-N 2.87Å; I739-Y741 VanDerWaalsContact C-N 3.32Å; I739-Y741 PolarHBondContact O-N 3.32Å; I739-F742 WeakPolarHBondContact O-CB 3.5Å; I739-F742 PolarHBondContact O-N 3.05Å; I739-F742 VanDerWaalsContact O-N 3.16Å; I739-N743 WeakPolarHBondContact O-CB 3.24Å; I739-N743 PolarHBondContact O-N 2.79Å
740	E	91.3	Very high	84.1	Confident	129 Å²	129	77.6 Å²	77.6	60%	0.603	40%	0.402	S	S	*	.	H	α-helix	trans	-56.5	-47.9	174.9	-172.4	-176	175.1	0	0	110.7	D736 F742 N743 Q744	D736-E740 WeakPolarHBondContact O-CB 3.36Å; D736-E740 PolarHBondContact O-N 2.78Å; E740-F742 VanDerWaalsContact C-N 3.32Å; E740-F742 PolarHBondContact O-N 2.8Å; E740-N743 CarbonylContact O-C 3.59Å; E740-N743 PolarHBondContact O-N 3.15Å; E740-Q744 WeakPolarHBondContact O-CG 3.38Å; E740-Q744 PolarHBondContact O-N 3.04Å
741	Y	91.5	Very high	83.8	Confident	22 Å²	22	81.9 Å²	81.9	9%	0.086	43%	0.425	C	S	.	.	H	α-helix	trans	-60.1	-39	177	-170.3	-89.5	0	0	0	113.1	Y708 R722 L726 L729 K737 L738 I739 N743	Y708-Y741 HydrophobicContact CD2-CD1 4.45Å; Y708-Y741 HydrophobicContact CD2-CE1 4.45Å; Y708-Y741 HydrophobicContact CE1-CE1 4.35Å; Y708-Y741 AromaticContact CE2-CD1 3.8Å; Y708-Y741 HydrophobicContact CE2-CD1 3.8Å; Y708-Y741 AromaticContact CE2-CE1 3.71Å; Y708-Y741 HydrophobicContact CE2-CE1 3.71Å; Y708-Y741 AromaticContact CZ-CE1 3.69Å; R722-Y741 WeakPolarHBondContact CB-OH 3.34Å; R722-Y741 PolarHBondContact NE-OH 2.76Å; R722-Y741 VanDerWaalsContact NE-OH 3.12Å; R722-Y741 VanDerWaalsContact NH2-CZ 3.31Å; R722-Y741 PolarHBondContact NH2-OH 3.06Å; R722-Y741 PolarHBondContact O-OH 3.28Å; L726-Y741 HydrophobicContact CB-CE1 4.05Å; L726-Y741 HydrophobicContact CD1-CD1 3.92Å; L726-Y741 HydrophobicContact CD1-CE1 3.97Å; L726-Y741 HydrophobicContact CG-CE1 4.47Å; L729-Y741 HydrophobicContact CD2-CD1 4.45Å; L729-Y741 HydrophobicContact CD2-CD2 4.1Å; L729-Y741 HydrophobicContact CD2-CG 3.83Å; K737-Y741 VanDerWaalsContact O-CB 3.31Å; K737-Y741 WeakPolarHBondContact O-CB 3.39Å; K737-Y741 PolarHBondContact O-N 3.26Å; L738-Y741 WeakPolarHBondContact O-CB 3.25Å; L738-Y741 PolarHBondContact O-N 3Å; I739-Y741 VanDerWaalsContact C-N 3.32Å; I739-Y741 PolarHBondContact O-N 3.32Å; Y741-N743 VanDerWaalsContact C-N 3.31Å
742	F	91.1	Very high	83.7	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.009	41%	0.414	C	S	.	.	H	α-helix	trans	-67.9	-29.4	174.8	-94.4	-112.8	0	0	0	112.8	A610 L614 I704 L707 Y708 K711 Y712 L726 L738 I739 E740	A610-F742 HydrophobicContact CB-CD1 4.32Å; L614-F742 HydrophobicContact CD1-CD1 4.1Å; L614-F742 HydrophobicContact CD1-CD2 4Å; L614-F742 HydrophobicContact CD1-CE1 4.23Å; L614-F742 HydrophobicContact CD1-CE2 4.13Å; L614-F742 HydrophobicContact CD1-CG 3.97Å; L614-F742 HydrophobicContact CD1-CZ 4.24Å; L614-F742 HydrophobicContact CD2-CE2 4.48Å; L614-F742 HydrophobicContact CD2-CZ 4.27Å; I704-F742 HydrophobicContact CG2-CE2 3.85Å; I704-F742 HydrophobicContact CG2-CZ 3.77Å; L707-F742 HydrophobicContact CD2-CE1 4.28Å; L707-F742 HydrophobicContact CG-CE1 4.18Å; Y708-F742 HydrophobicContact CD2-CD1 4.06Å; Y708-F742 AromaticContact CD2-CD2 3.87Å; Y708-F742 HydrophobicContact CD2-CD2 3.87Å; Y708-F742 HydrophobicContact CD2-CE1 4.02Å; Y708-F742 AromaticContact CD2-CE2 3.83Å; Y708-F742 HydrophobicContact CD2-CE2 3.83Å; Y708-F742 HydrophobicContact CD2-CG 4.01Å; Y708-F742 AromaticContact CD2-CZ 3.92Å; Y708-F742 HydrophobicContact CD2-CZ 3.92Å; Y708-F742 HydrophobicContact CE2-CD2 4.49Å; Y708-F742 HydrophobicContact CG-CE1 4.49Å; Y708-F742 HydrophobicContact CG-CE2 4.43Å; Y708-F742 HydrophobicContact CG-CZ 4.24Å; K711-F742 HydrophobicContact CD-CD1 4.09Å; K711-F742 PolarHBondContact NZ-O 3.16Å; Y712-F742 PolarHBondContact OH-O 3.36Å; L726-F742 HydrophobicContact CD1-CE2 4.25Å; L738-F742 HydrophobicContact CD1-CD2 4.06Å; L738-F742 HydrophobicContact CD1-CE2 3.8Å; L738-F742 HydrophobicContact CG-CD2 4.2Å; L738-F742 HydrophobicContact CG-CE2 4.15Å; L738-F742 VanDerWaalsContact O-CD2 3.27Å; L738-F742 WeakPolarHBondContact O-CD2 3.45Å; L738-F742 PolarHBondContact O-N 3.21Å; I739-F742 WeakPolarHBondContact O-CB 3.5Å; I739-F742 PolarHBondContact O-N 3.05Å; I739-F742 VanDerWaalsContact O-N 3.16Å; E740-F742 VanDerWaalsContact C-N 3.32Å; E740-F742 PolarHBondContact O-N 2.8Å
743	N	88	Confident	83.6	Confident	84 Å²	84	76 Å²	76	45%	0.449	40%	0.397	S	S	.	.	H	α-helix	trans	-96	-3.4	-176.4	-70.5	-18.1	0	0	0	113.5	K711 I739 E740 Y741 E745	K711-N743 PolarHBondContact NZ-OD1 3.12Å; I739-N743 WeakPolarHBondContact O-CB 3.24Å; I739-N743 PolarHBondContact O-N 2.79Å; E740-N743 CarbonylContact O-C 3.59Å; E740-N743 PolarHBondContact O-N 3.15Å; Y741-N743 VanDerWaalsContact C-N 3.31Å; N743-E745 PolarHBondContact O-N 3.38Å
744	Q	84.5	Confident	83.3	Confident	76 Å²	76	78.7 Å²	78.7	36%	0.355	41%	0.414	S	S	.	.			trans	-56.5	122.1	174	-80.3	171.9	5.6	0	0	111.3	Y712 E740 L746	Y712-Q744 PolarHBondContact OH-O 2.94Å; E740-Q744 WeakPolarHBondContact O-CG 3.38Å; E740-Q744 PolarHBondContact O-N 3.04Å; Q744-L746 PolarHBondContact O-N 3.08Å; Q744-L746 VanDerWaalsContact O-N 3.16Å
745	E	74.1	Confident	82.9	Confident	194 Å²	194	79.9 Å²	79.9	91%	0.907	42%	0.42	S	S	*	.			trans	-67.8	111.5	171	-69.9	-172.6	172.4	0	0	109.5	N743	N743-E745 PolarHBondContact O-N 3.38Å
746	L	73.7	Confident	82.4	Confident	29 Å²	29	84.3 Å²	84.3	15%	0.152	44%	0.443	C	S	.	.			trans	-83.5	116.2	171.5	-70.9	175.8	0	0	0	109.1	Y712 K717 V719 R722 Q744	Y712-L746 HydrophobicContact CD1-CD1 3.88Å; Y712-L746 HydrophobicContact CE1-CB 4.31Å; Y712-L746 HydrophobicContact CE1-CD1 3.47Å; Y712-L746 VanDerWaalsContact CE1-CD1 3.47Å; Y712-L746 HydrophobicContact CE1-CG 3.95Å; Y712-L746 HydrophobicContact CE2-CD1 4.44Å; Y712-L746 HydrophobicContact CG-CD1 4.48Å; K717-L746 HydrophobicContact CD-CB 4.41Å; K717-L746 PolarHBondContact NZ-O 3.27Å; V719-L746 HydrophobicContact CG1-CD1 3.39Å; R722-L746 VanDerWaalsContact NH1-CD2 3.34Å; Q744-L746 PolarHBondContact O-N 3.08Å; Q744-L746 VanDerWaalsContact O-N 3.16Å
747	S	59.8	Low	81.6	Confident	115 Å²	115	82 Å²	82	80%	0.804	43%	0.43	S	S	*	.			trans	-62.6	134.8	164.8	53.7	0	0	0	0	109.4
748	V	50.7	Low	80.7	Confident	195 Å²	195	78.5 Å²	78.5	100%	1.182	42%	0.421	S	S	*	.			trans	-56.4	0	-179	179.8	0	0	0	0	111.9

Retrieved 748 of 748 residues in 1152.8 ms (Link to these results)

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