A0A087XZW5_POEFO Loading...

POC1 centriolar protein homolog A

AlphaFold DB , UniProt , Accession A0A087XZW5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 480 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	34.1	Very low	64.1	Low	245 Å²	245	95.7 Å²	95.7	100%	1.207	56%	0.556	S	S	*	*				0	97.3	0	-69.2	177.3	-173.6	0	0	106.1	S3	M1-S3 PolarHBondContact O-N 3.06Å
2	T	32.3	Very low	66.2	Low	142 Å²	142	92.5 Å²	92.5	87%	0.871	53%	0.528	S	S	*	.			trans	-62.6	113	175.7	41.7	0	0	0	0	107.5	A4	T2-A4 PolarHBondContact O-N 2.73Å; T2-A4 VanDerWaalsContact O-N 3.08Å
3	S	39.7	Very low	68.2	Low	85 Å²	85	94.9 Å²	94.9	59%	0.594	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-56.3	116.1	168.8	49.3	0	0	0	0	106.9	M1 L5	M1-S3 PolarHBondContact O-N 3.06Å; S3-L5 PolarHBondContact O-N 3.44Å
4	A	43.6	Very low	70	Confident	89 Å²	89	90.1 Å²	90.1	74%	0.736	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-53.2	125.2	170.2	0	0	0	0	0	107	T2 S6	T2-A4 PolarHBondContact O-N 2.73Å; T2-A4 VanDerWaalsContact O-N 3.08Å; A4-S6 PolarHBondContact O-N 3.26Å
5	L	54.6	Low	71.4	Confident	88 Å²	88	93.7 Å²	93.7	46%	0.461	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-49.6	116.1	167.7	-87.3	118.9	0	0	0	106.3	S3 D7	S3-L5 PolarHBondContact O-N 3.44Å; L5-D7 PolarHBondContact O-N 3.26Å
6	S	65.1	Low	72.6	Confident	47 Å²	47	89.9 Å²	89.9	33%	0.329	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-65.9	132.6	174	51.2	0	0	0	0	107.1	A4 N300 E303	A4-S6 PolarHBondContact O-N 3.26Å; S6-N300 VanDerWaalsContact C-ND2 3.3Å; S6-N300 WeakPolarHBondContact O-CB 3.32Å; S6-N300 PolarHBondContact O-ND2 3.23Å; S6-N300 WeakPolarHBondContact OG-CB 3.21Å; S6-N300 PolarHBondContact OG-ND2 2.94Å; S6-N300 PolarHBondContact OG-OD1 2.99Å; S6-E303 PolarHBondContact OG-OE2 3.01Å
7	D	80.8	Confident	73.8	Confident	105 Å²	105	85 Å²	85	56%	0.561	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-64.5	147.4	-179.8	-70.4	-32.9	0	0	0	110.5	L5 T9 Y264 N300	L5-D7 PolarHBondContact O-N 3.26Å; D7-T9 WeakPolarHBondContact O-CG2 3.33Å; D7-T9 PolarHBondContact O-N 3.08Å; D7-T9 VanDerWaalsContact O-N 3.16Å; D7-Y264 VanDerWaalsContact OD1-CE1 3.25Å; D7-Y264 WeakPolarHBondContact OD1-CE1 3.43Å; D7-Y264 PolarHBondContact OD1-OH 2.76Å; D7-Y264 VanDerWaalsContact OD1-OH 3.07Å; D7-N300 PolarHBondContact O-ND2 2.83Å
8	P	84.8	Confident	75	Confident	15 Å²	15	90.9 Å²	90.9	10%	0.097	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-58.1	122.3	177.5	24.4	-34.5	0	0	0	110.4	Y264 L266 F285 K298	P8-Y264 HydrophobicContact CG-CD1 4.33Å; P8-Y264 HydrophobicContact CG-CD2 4.19Å; P8-Y264 HydrophobicContact CG-CE2 4.39Å; P8-Y264 HydrophobicContact CG-CG 4.14Å; P8-L266 HydrophobicContact CB-CD2 4.49Å; P8-L266 HydrophobicContact CG-CD2 3.66Å; P8-F285 HydrophobicContact CB-CE1 4.1Å; P8-F285 HydrophobicContact CB-CZ 4.14Å; P8-K298 WeakPolarHBondContact CA-O 3.44Å
9	T	88.9	Confident	76	Confident	75 Å²	75	90.8 Å²	90.8	46%	0.46	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	138.6	-175.1	59.1	0	0	0	0	111.7	D7 E11 W297 K298	D7-T9 WeakPolarHBondContact O-CG2 3.33Å; D7-T9 PolarHBondContact O-N 3.08Å; D7-T9 VanDerWaalsContact O-N 3.16Å; T9-E11 PolarHBondContact O-N 2.96Å; T9-W297 WeakPolarHBondContact O-CA 3.46Å; T9-K298 PolarHBondContact N-O 3.35Å; T9-K298 PolarHBondContact O-N 2.96Å
10	L	91.4	Very high	77	Confident	83 Å²	83	87.6 Å²	87.6	44%	0.435	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	116.5	170.4	-177.7	68.9	0	0	0	109.5	R12 L295 W297	L10-R12 WeakPolarHBondContact CD1-O 3.38Å; L10-L295 HydrophobicContact CD1-CB 3.78Å; L10-L295 HydrophobicContact CD1-CD2 4.18Å; L10-L295 HydrophobicContact CD1-CG 4.37Å; L10-W297 HydrophobicContact CB-CD2 4.35Å; L10-W297 HydrophobicContact CB-CE3 3.87Å; L10-W297 HydrophobicContact CB-CH2 4.21Å; L10-W297 HydrophobicContact CB-CZ3 3.79Å; L10-W297 HydrophobicContact CD1-CD2 3.95Å; L10-W297 HydrophobicContact CD1-CE3 4.32Å; L10-W297 HydrophobicContact CD1-CG 4.41Å; L10-W297 HydrophobicContact CD1-CH2 4.36Å; L10-W297 HydrophobicContact CD1-CZ2 4.02Å
11	E	89.7	Confident	78	Confident	79 Å²	79	83.4 Å²	83.4	37%	0.369	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-45.1	178.6	-162.6	-148.4	150.9	0	0	110.4	T9 Y284 V296	T9-E11 PolarHBondContact O-N 2.96Å; E11-Y284 WeakPolarHBondContact OE2-CE1 3.46Å; E11-V296 PolarHBondContact N-O 3.32Å
12	R	89.6	Confident	80.9	Confident	57 Å²	57	73.3 Å²	73.3	22%	0.215	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	152.8	-174.6	-63.5	-168.8	-176.6	-159.6	7.5	113.1	L10 F14 M47 V296	L10-R12 WeakPolarHBondContact CD1-O 3.38Å; R12-F14 HydrophobicContact CB-CE2 4.43Å; R12-M47 VanDerWaalsContact NH1-C 3.34Å; R12-M47 PolarHBondContact NH1-O 3.16Å; R12-M47 PolarHBondContact NH2-O 3.07Å; R12-V296 HydrophobicContact CB-CB 4.38Å; R12-V296 PolarHBondContact N-O 3.07Å; R12-V296 VanDerWaalsContact N-O 3.09Å; R12-V296 PolarHBondContact O-N 3.41Å
13	H	92.5	Very high	83.9	Confident	124 Å²	124	67 Å²	67	57%	0.574	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.2	165.5	65.6	-82	0	0	0	108.9	V294 L295	H13-V294 CarbonylContact C-O 3.57Å; H13-V294 WeakPolarHBondContact CA-O 3.48Å; H13-L295 HydrophobicContact CB-CD2 3.55Å
14	F	92.4	Very high	86.7	Confident	27 Å²	27	63.5 Å²	63.5	12%	0.118	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.5	173.1	-61.1	-74.9	0	0	0	109.5	R12 I33 W45 M47 V294 V296	R12-F14 HydrophobicContact CB-CE2 4.43Å; F14-I33 HydrophobicContact CE2-CD1 4.17Å; F14-W45 HydrophobicContact CB-CD2 3.84Å; F14-W45 HydrophobicContact CB-CE3 3.7Å; F14-W45 HydrophobicContact CB-CG 4.5Å; F14-W45 HydrophobicContact CB-CH2 4.03Å; F14-W45 HydrophobicContact CB-CZ2 4.13Å; F14-W45 HydrophobicContact CB-CZ3 3.83Å; F14-W45 HydrophobicContact CD1-CB 4.28Å; F14-W45 HydrophobicContact CD1-CD2 4.04Å; F14-W45 AromaticContact CD1-CE3 3.55Å; F14-W45 HydrophobicContact CD1-CE3 3.55Å; F14-W45 HydrophobicContact CD1-CG 4.36Å; F14-W45 HydrophobicContact CD1-CZ3 4.21Å; F14-W45 HydrophobicContact CD2-CB 4.42Å; F14-W45 HydrophobicContact CD2-CG 4.37Å; F14-W45 HydrophobicContact CE1-CB 4.17Å; F14-W45 HydrophobicContact CE1-CE3 4.36Å; F14-W45 HydrophobicContact CE2-CB 4.31Å; F14-W45 HydrophobicContact CG-CB 4.41Å; F14-W45 AromaticContact CG-CD2 3.9Å; F14-W45 HydrophobicContact CG-CD2 3.9Å; F14-W45 AromaticContact CG-CE3 3.79Å; F14-W45 HydrophobicContact CG-CE3 3.79Å; F14-W45 HydrophobicContact CG-CG 4.17Å; F14-W45 HydrophobicContact CG-CZ3 4.38Å; F14-W45 HydrophobicContact CZ-CB 4.18Å; F14-M47 HydrophobicContact CE2-SD 4.26Å; F14-M47 HydrophobicContact CZ-SD 4.14Å; F14-V294 HydrophobicContact CB-CB 4.21Å; F14-V294 PolarHBondContact N-O 2.96Å; F14-V294 PolarHBondContact O-N 3.19Å; F14-V296 HydrophobicContact CD2-CG2 4.1Å; F14-V296 HydrophobicContact CE2-CG2 3.72Å
15	K	91.9	Very high	89.2	Confident	144 Å²	144	60 Å²	60	63%	0.626	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	134.5	176	-170.3	171.8	-175.9	172.5	0	109.4
16	G	89.6	Confident	91.1	Very high	34 Å²	34	55.8 Å²	55.8	35%	0.351	28%	0.28	S	S	.	.			trans	165.8	-13.4	178.4	0	0	0	0	0	115.3	R55	G16-R55 PolarHBondContact O-NH1 3.22Å
17	H	94.5	Very high	92.4	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.028	27%	0.265	C	S	.	.			trans	-68.3	150	166.1	-79.6	-65.6	0	0	0	109	H19 V21 T35 S37 D39 M43	H17-H19 WeakPolarHBondContact CB-O 3.26Å; H17-V21 HydrophobicContact CB-CG2 4.47Å; H17-T35 WeakPolarHBondContact NE2-CB 3.49Å; H17-T35 PolarHBondContact NE2-OG1 3.21Å; H17-S37 VanDerWaalsContact CE1-CB 3.43Å; H17-S37 WeakPolarHBondContact CE1-CB 3.42Å; H17-S37 WeakPolarHBondContact ND1-CB 3.32Å; H17-D39 IonicContact ND1-OD1 3.68Å; H17-D39 PolarHBondContact ND1-OD1 3.43Å; H17-D39 IonicContact ND1-OD2 2.79Å; H17-M43 HydrophobicContact CB-CE 3.92Å; H17-M43 WeakPolarHBondContact CD2-CE 3.44Å; H17-M43 WeakPolarHBondContact CE1-CE 3.41Å; H17-M43 VanDerWaalsContact ND1-CE 3.27Å; H17-M43 WeakPolarHBondContact ND1-CE 3.45Å; H17-M43 WeakPolarHBondContact NE2-CE 3.01Å
18	R	93.9	Very high	92.6	Very high	191 Å²	191	52.2 Å²	52.2	72%	0.721	26%	0.262	S	S	*	.	S	Bend	trans	-95.9	2.6	177.8	-61.8	179.9	174.8	178.1	-2	113.3	D39	R18-D39 HydrophobicContact CB-CB 4.01Å; R18-D39 PolarHBondContact N-OD2 2.96Å; R18-D39 VanDerWaalsContact N-OD2 3.14Å
19	H	95.2	Very high	92.6	Very high	89 Å²	89	54.8 Å²	54.8	41%	0.412	28%	0.281	S	S	.	.	S	Bend	trans	-161.7	170.6	-178.1	-149.2	-73.8	0	0	0	109.2	H17 V21 S37 V38 D39	H17-H19 WeakPolarHBondContact CB-O 3.26Å; H19-V21 PolarHBondContact O-N 2.92Å; H19-S37 PolarHBondContact O-OG 3.02Å; H19-V38 HydrophobicContact CB-CB 4.03Å; H19-D39 HydrophobicContact CB-CB 4.15Å
20	T	95.6	Very high	92.5	Very high	27 Å²	27	53 Å²	53	17%	0.166	27%	0.268	C	S	.	.			trans	-34.2	125.6	172.7	-50.7	0	0	0	0	113.9	S37 V38 T274	T20-S37 WeakPolarHBondContact O-CA 3.48Å; T20-S37 WeakPolarHBondContact O-CB 3.41Å; T20-S37 PolarHBondContact O-OG 3.16Å; T20-V38 PolarHBondContact O-N 2.92Å; T20-T274 HydrophobicContact CG2-CG2 3.64Å
21	V	97.1	Very high	92.3	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.7	169.5	-174.5	0	0	0	0	107.4	H17 H19 V24 G36 T274 G289 V294	H17-V21 HydrophobicContact CB-CG2 4.47Å; H19-V21 PolarHBondContact O-N 2.92Å; V21-V24 HydrophobicContact CG1-CG2 3.92Å; V21-G36 CarbonylContact C-O 3.57Å; V21-G36 WeakPolarHBondContact CA-O 3.41Å; V21-G36 WeakPolarHBondContact CG1-O 3.39Å; V21-T274 WeakPolarHBondContact O-CB 3.25Å; V21-T274 PolarHBondContact O-OG1 3.38Å; V21-G289 PolarHBondContact N-O 3.21Å; V21-G289 VanDerWaalsContact N-O 3.07Å; V21-V294 HydrophobicContact CG1-CG2 4.23Å; V21-V294 HydrophobicContact CG2-CG2 3.86Å
22	T	96.2	Very high	92.4	Very high	33 Å²	33	53.7 Å²	53.7	20%	0.202	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	-27.2	-177	54.5	0	0	0	0	112.7	G36 V38 V63 T64 C275	T22-G36 PolarHBondContact N-O 3.39Å; T22-G36 PolarHBondContact OG1-O 3.5Å; T22-V38 HydrophobicContact CG2-CG2 3.6Å; T22-V63 WeakPolarHBondContact CB-O 3.49Å; T22-V63 WeakPolarHBondContact CG2-O 3.48Å; T22-V63 PolarHBondContact OG1-O 3.16Å; T22-T64 PolarHBondContact OG1-O 3.37Å; T22-C275 WeakPolarHBondContact O-CB 3.42Å
23	S	95.9	Very high	92.6	Very high	9 Å²	9	51 Å²	51	6%	0.063	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	150.3	-177.4	51.2	0	0	0	0	111	T35 G36 C65 V66 C275	S23-T35 WeakPolarHBondContact O-CA 3.34Å; S23-G36 PolarHBondContact O-N 3.08Å; S23-C65 VanDerWaalsContact OG-CA 3.24Å; S23-C65 WeakPolarHBondContact OG-CA 3.42Å; S23-V66 PolarHBondContact OG-N 3.42Å; S23-C275 VanDerWaalsContact CA-SG 3.52Å; S23-C275 PolarHBondContact N-SG 3.03Å
24	V	96.7	Very high	92.8	Very high	12 Å²	12	45 Å²	45	7%	0.073	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	141	175.3	-176.5	0	0	0	0	108.3	V21 I33 A34 T35 A277 S286 V294	V21-V24 HydrophobicContact CG1-CG2 3.92Å; V24-I33 HydrophobicContact CG1-CG2 3.52Å; V24-A34 WeakPolarHBondContact CA-O 3.38Å; V24-T35 HydrophobicContact CB-CG2 4.27Å; V24-T35 HydrophobicContact CG1-CG2 3.94Å; V24-T35 HydrophobicContact CG2-CG2 3.79Å; V24-A277 WeakPolarHBondContact O-CB 3.48Å; V24-S286 WeakPolarHBondContact CG1-OG 3.44Å; V24-V294 HydrophobicContact CG1-CG1 4.47Å; V24-V294 HydrophobicContact CG2-CG1 4.23Å
25	D	96.4	Very high	93	Very high	14 Å²	14	43.8 Å²	43.8	8%	0.075	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.6	170.1	-169.4	28.6	0	0	0	111.5	A34 Q67 F68	D25-A34 PolarHBondContact N-O 2.7Å; D25-A34 PolarHBondContact O-N 3.41Å; D25-Q67 WeakPolarHBondContact OD2-CA 3.23Å; D25-Q67 WeakPolarHBondContact OD2-CG 3.4Å; D25-F68 HydrophobicContact CB-CD2 4.29Å; D25-F68 WeakPolarHBondContact O-CE2 3.2Å; D25-F68 PolarHBondContact OD2-N 2.97Å
26	F	94.4	Very high	93.2	Very high	1 Å²	1	36.9 Å²	36.9	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	140.6	178.3	-75.7	-87.3	0	0	0	111.5	M30 I33 F68 A277 S286 V296	F26-M30 HydrophobicContact CB-SD 4Å; F26-M30 HydrophobicContact CD1-CE 3.81Å; F26-M30 HydrophobicContact CD1-SD 3.65Å; F26-M30 HydrophobicContact CE1-CE 3.95Å; F26-M30 HydrophobicContact CE1-SD 4.4Å; F26-M30 HydrophobicContact CG-SD 4.04Å; F26-I33 HydrophobicContact CD1-CD1 4.08Å; F26-I33 HydrophobicContact CD1-CG1 3.67Å; F26-I33 HydrophobicContact CE1-CD1 3.5Å; F26-I33 VanDerWaalsContact CE1-CD1 3.5Å; F26-I33 HydrophobicContact CE1-CG1 3.65Å; F26-I33 HydrophobicContact CZ-CD1 4.15Å; F26-F68 WeakPolarHBondContact O-CD2 3.3Å; F26-A277 HydrophobicContact CD2-CB 4.42Å; F26-A277 WeakPolarHBondContact CE2-O 3.2Å; F26-S286 WeakPolarHBondContact CE2-OG 3.31Å; F26-S286 VanDerWaalsContact CZ-CB 3.5Å; F26-V296 HydrophobicContact CZ-CG1 4.48Å
27	S	92.4	Very high	93.6	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.176	C	C	.	.			trans	-66	145.1	164.9	66.4	0	0	0	0	110.3	S29 M30 K31 Q32	S27-S29 PolarHBondContact O-N 3.23Å; S27-S29 VanDerWaalsContact O-N 3.13Å; S27-M30 PolarHBondContact O-N 3Å; S27-M30 PolarHBondContact OG-N 3.38Å; S27-K31 PolarHBondContact OG-N 3.43Å; S27-Q32 VanDerWaalsContact CB-O 3.32Å; S27-Q32 WeakPolarHBondContact CB-O 3.39Å; S27-Q32 PolarHBondContact N-O 2.96Å; S27-Q32 PolarHBondContact OG-N 2.99Å; S27-Q32 PolarHBondContact OG-O 2.9Å
28	C	85.3	Confident	93.7	Very high	74 Å²	74	37 Å²	37	50%	0.5	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-33.4	176.1	-174.2	0	0	0	0	112.6	M30 P70	C28-M30 VanDerWaalsContact C-N 3.28Å; C28-M30 PolarHBondContact O-N 3.17Å; C28-P70 WeakPolarHBondContact CB-O 3.48Å
29	S	85.1	Confident	93.7	Very high	70 Å²	70	29 Å²	29	49%	0.49	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-4.6	178.1	72.6	0	0	0	0	115.2	S27 K31	S27-S29 PolarHBondContact O-N 3.23Å; S27-S29 VanDerWaalsContact O-N 3.13Å; S29-K31 PolarHBondContact O-N 3.41Å; S29-K31 PolarHBondContact OG-N 3.17Å
30	M	86.1	Confident	93.7	Very high	38 Å²	38	26.2 Å²	26.2	19%	0.187	15%	0.149	C	C	.	.	S	Bend	trans	57.4	12.4	-174.2	-67.4	-61.4	-76.4	0	0	115.7	F26 S27 C28 M47 S279 Y284	F26-M30 HydrophobicContact CB-SD 4Å; F26-M30 HydrophobicContact CD1-CE 3.81Å; F26-M30 HydrophobicContact CD1-SD 3.65Å; F26-M30 HydrophobicContact CE1-CE 3.95Å; F26-M30 HydrophobicContact CE1-SD 4.4Å; F26-M30 HydrophobicContact CG-SD 4.04Å; S27-M30 PolarHBondContact O-N 3Å; S27-M30 PolarHBondContact OG-N 3.38Å; C28-M30 VanDerWaalsContact C-N 3.28Å; C28-M30 PolarHBondContact O-N 3.17Å; M30-M47 WeakPolarHBondContact O-CG 3.5Å; M30-S279 WeakPolarHBondContact SD-CB 3.41Å; M30-Y284 HydrophobicContact CE-CD2 3.5Å; M30-Y284 HydrophobicContact CE-CE2 4.47Å; M30-Y284 HydrophobicContact CE-CG 4.03Å
31	K	87.4	Confident	93.7	Very high	144 Å²	144	25 Å²	25	63%	0.626	14%	0.142	S	C	*	.	S	Bend	trans	-81.3	-28.3	177.1	-66.2	174.9	-175.1	173.6	0	112.1	S27 S29 M47	S27-K31 PolarHBondContact OG-N 3.43Å; S29-K31 PolarHBondContact O-N 3.41Å; S29-K31 PolarHBondContact OG-N 3.17Å; K31-M47 PolarHBondContact O-N 3.3Å
32	Q	92.2	Very high	93.6	Very high	31 Å²	31	25 Å²	25	15%	0.145	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	150	-170	-70.8	177.8	-16.4	0	0	112.4	S27 I44 W45 N46 F68	S27-Q32 VanDerWaalsContact CB-O 3.32Å; S27-Q32 WeakPolarHBondContact CB-O 3.39Å; S27-Q32 PolarHBondContact N-O 2.96Å; S27-Q32 PolarHBondContact OG-N 2.99Å; S27-Q32 PolarHBondContact OG-O 2.9Å; Q32-I44 HydrophobicContact CB-CG2 3.88Å; Q32-I44 HydrophobicContact CG-CG2 3.97Å; Q32-W45 CarbonylContact C-O 3.59Å; Q32-W45 WeakPolarHBondContact CA-O 3.46Å; Q32-N46 VanDerWaalsContact CG-OD1 3.3Å; Q32-N46 WeakPolarHBondContact CG-OD1 3.32Å; Q32-N46 PolarHBondContact NE2-OD1 3Å; Q32-F68 HydrophobicContact CB-CZ 4.13Å
33	I	94.7	Very high	93.6	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	133.9	172.8	-60.2	176.2	0	0	0	107.4	F14 V24 F26 T35 I44 W45 M47 V296	F14-I33 HydrophobicContact CE2-CD1 4.17Å; V24-I33 HydrophobicContact CG1-CG2 3.52Å; F26-I33 HydrophobicContact CD1-CD1 4.08Å; F26-I33 HydrophobicContact CD1-CG1 3.67Å; F26-I33 HydrophobicContact CE1-CD1 3.5Å; F26-I33 VanDerWaalsContact CE1-CD1 3.5Å; F26-I33 HydrophobicContact CE1-CG1 3.65Å; F26-I33 HydrophobicContact CZ-CD1 4.15Å; I33-T35 HydrophobicContact CG2-CG2 4.05Å; I33-I44 CarbonylContact O-C 3.52Å; I33-I44 VanDerWaalsContact O-CA 3.3Å; I33-I44 WeakPolarHBondContact O-CA 3.4Å; I33-W45 HydrophobicContact CB-CB 4.37Å; I33-W45 PolarHBondContact N-O 3.17Å; I33-W45 PolarHBondContact O-N 2.97Å; I33-M47 HydrophobicContact CD1-SD 3.5Å; I33-M47 WeakPolarHBondContact CD1-SD 3.43Å; I33-M47 HydrophobicContact CG1-SD 4.11Å; I33-V296 HydrophobicContact CD1-CG1 4.47Å; I33-V296 HydrophobicContact CD1-CG2 3.43Å; I33-V296 VanDerWaalsContact CD1-CG2 3.43Å
34	A	95.8	Very high	93.5	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	135.3	177	0	0	0	0	0	109.2	V24 D25 M43 I44 V66 F68 V75	V24-A34 WeakPolarHBondContact CA-O 3.38Å; D25-A34 PolarHBondContact N-O 2.7Å; D25-A34 PolarHBondContact O-N 3.41Å; A34-M43 CarbonylContact C-O 3.53Å; A34-M43 WeakPolarHBondContact CA-O 3.43Å; A34-I44 HydrophobicContact CB-CG1 4.16Å; A34-V66 HydrophobicContact CB-CG1 3.63Å; A34-F68 HydrophobicContact CB-CD2 3.98Å; A34-F68 HydrophobicContact CB-CE2 3.26Å; A34-F68 HydrophobicContact CB-CZ 3.56Å; A34-F68 VanDerWaalsContact N-CE2 3.35Å; A34-V75 HydrophobicContact CB-CG1 4.13Å; A34-V75 HydrophobicContact CB-CG2 4.5Å
35	T	96.9	Very high	93.4	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136.6	-178.5	59.9	0	0	0	0	111	H17 S23 V24 I33 V42 M43 W45 V294	H17-T35 WeakPolarHBondContact NE2-CB 3.49Å; H17-T35 PolarHBondContact NE2-OG1 3.21Å; S23-T35 WeakPolarHBondContact O-CA 3.34Å; V24-T35 HydrophobicContact CB-CG2 4.27Å; V24-T35 HydrophobicContact CG1-CG2 3.94Å; V24-T35 HydrophobicContact CG2-CG2 3.79Å; I33-T35 HydrophobicContact CG2-CG2 4.05Å; T35-V42 WeakPolarHBondContact O-CA 3.34Å; T35-M43 PolarHBondContact N-O 3.44Å; T35-M43 PolarHBondContact O-N 3.07Å; T35-W45 PolarHBondContact OG1-NE1 3.1Å; T35-V294 HydrophobicContact CG2-CG1 4.05Å; T35-V294 HydrophobicContact CG2-CG2 3.81Å
36	G	96.5	Very high	93.2	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	147.6	171.7	0	0	0	0	0	110.3	V21 T22 S23	V21-G36 CarbonylContact C-O 3.57Å; V21-G36 WeakPolarHBondContact CA-O 3.41Å; V21-G36 WeakPolarHBondContact CG1-O 3.39Å; T22-G36 PolarHBondContact N-O 3.39Å; T22-G36 PolarHBondContact OG1-O 3.5Å; S23-G36 PolarHBondContact O-N 3.08Å
37	S	97	Very high	92.9	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	163.5	177.2	168.2	0	0	0	0	112	H17 H19 T20 D39 S40 C41 V63	H17-S37 VanDerWaalsContact CE1-CB 3.43Å; H17-S37 WeakPolarHBondContact CE1-CB 3.42Å; H17-S37 WeakPolarHBondContact ND1-CB 3.32Å; H19-S37 PolarHBondContact O-OG 3.02Å; T20-S37 WeakPolarHBondContact O-CA 3.48Å; T20-S37 WeakPolarHBondContact O-CB 3.41Å; T20-S37 PolarHBondContact O-OG 3.16Å; S37-D39 WeakPolarHBondContact CB-OD1 3.34Å; S37-D39 PolarHBondContact O-N 3.29Å; S37-D39 PolarHBondContact OG-N 2.94Å; S37-D39 VanDerWaalsContact OG-N 3.15Å; S37-D39 PolarHBondContact OG-OD1 3.3Å; S37-S40 PolarHBondContact O-N 3.4Å; S37-C41 PolarHBondContact N-O 3.03Å; S37-V63 WeakPolarHBondContact O-CB 3.48Å; S37-V63 PolarHBondContact O-N 3Å
38	V	96.6	Very high	92.6	Very high	43 Å²	43	32.1 Å²	32.1	26%	0.261	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	170.1	-179.2	0	0	0	0	111.7	H19 T20 T22 S40 A62	H19-V38 HydrophobicContact CB-CB 4.03Å; T20-V38 PolarHBondContact O-N 2.92Å; T22-V38 HydrophobicContact CG2-CG2 3.6Å; V38-S40 PolarHBondContact O-N 3.43Å; V38-A62 HydrophobicContact CB-CB 4.29Å; V38-A62 HydrophobicContact CG1-CB 4.02Å
39	D	95	Very high	92.2	Very high	22 Å²	22	33.7 Å²	33.7	12%	0.118	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	18	175.8	81.8	-16.9	0	0	0	115.2	H17 R18 H19 S37 C41 R55	H17-D39 IonicContact ND1-OD1 3.68Å; H17-D39 PolarHBondContact ND1-OD1 3.43Å; H17-D39 IonicContact ND1-OD2 2.79Å; R18-D39 HydrophobicContact CB-CB 4.01Å; R18-D39 PolarHBondContact N-OD2 2.96Å; R18-D39 VanDerWaalsContact N-OD2 3.14Å; H19-D39 HydrophobicContact CB-CB 4.15Å; S37-D39 WeakPolarHBondContact CB-OD1 3.34Å; S37-D39 PolarHBondContact O-N 3.29Å; S37-D39 PolarHBondContact OG-N 2.94Å; S37-D39 VanDerWaalsContact OG-N 3.15Å; S37-D39 PolarHBondContact OG-OD1 3.3Å; D39-C41 PolarHBondContact O-N 2.95Å; D39-C41 PolarHBondContact O-SG 3.31Å; D39-C41 WeakPolarHBondContact OD1-CB 3.25Å; D39-C41 PolarHBondContact OD1-N 2.71Å; D39-C41 VanDerWaalsContact OD1-N 3.13Å; D39-R55 IonicContact OD2-CZ 3.57Å; D39-R55 IonicContact OD2-NH1 3.68Å; D39-R55 PolarHBondContact OD2-NH1 3.47Å; D39-R55 IonicContact OD2-NH2 3.3Å; D39-R55 PolarHBondContact OD2-NH2 2.89Å
40	S	95	Very high	91.9	Very high	30 Å²	30	39.2 Å²	39.2	21%	0.21	20%	0.196	C	C	.	.	S	Bend	trans	55.8	11.1	-177.4	66.8	0	0	0	0	115.5	S37 V38 E61	S37-S40 PolarHBondContact O-N 3.4Å; V38-S40 PolarHBondContact O-N 3.43Å; S40-E61 WeakPolarHBondContact CA-O 3.33Å; S40-E61 VanDerWaalsContact CB-O 3.23Å; S40-E61 WeakPolarHBondContact CB-O 3.37Å
41	C	94.9	Very high	91.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.014	21%	0.208	C	C	.	.			trans	-110	147.8	-177.6	-63	0	0	0	0	111.5	S37 D39 R55	S37-C41 PolarHBondContact N-O 3.03Å; D39-C41 PolarHBondContact O-N 2.95Å; D39-C41 PolarHBondContact O-SG 3.31Å; D39-C41 WeakPolarHBondContact OD1-CB 3.25Å; D39-C41 PolarHBondContact OD1-N 2.71Å; D39-C41 VanDerWaalsContact OD1-N 3.13Å; C41-R55 HydrophobicContact CB-CG 4.36Å; C41-R55 VanDerWaalsContact SG-CZ 3.52Å; C41-R55 PolarHBondContact SG-NE 3.24Å; C41-R55 PolarHBondContact SG-NH2 3.14Å
42	V	96	Very high	91.6	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	132	166.5	-179.2	0	0	0	0	107	T35 F56 V63 V66	T35-V42 WeakPolarHBondContact O-CA 3.34Å; V42-F56 HydrophobicContact CB-CB 4.27Å; V42-F56 PolarHBondContact N-O 3.46Å; V42-F56 VanDerWaalsContact N-O 3.12Å; V42-F56 WeakPolarHBondContact O-CB 3.44Å; V42-F56 PolarHBondContact O-N 3.01Å; V42-V63 HydrophobicContact CG2-CG1 4.15Å; V42-V63 HydrophobicContact CG2-CG2 4.07Å; V42-V66 HydrophobicContact CG1-CG1 4.2Å; V42-V66 HydrophobicContact CG1-CG2 4.22Å; V42-V66 HydrophobicContact CG2-CG2 4.17Å
43	M	95.1	Very high	91.5	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.039	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	142.3	173.5	-69.4	-157.8	-73.1	0	0	111	H17 A34 T35 W45 Y54 R55	H17-M43 HydrophobicContact CB-CE 3.92Å; H17-M43 WeakPolarHBondContact CD2-CE 3.44Å; H17-M43 WeakPolarHBondContact CE1-CE 3.41Å; H17-M43 VanDerWaalsContact ND1-CE 3.27Å; H17-M43 WeakPolarHBondContact ND1-CE 3.45Å; H17-M43 WeakPolarHBondContact NE2-CE 3.01Å; A34-M43 CarbonylContact C-O 3.53Å; A34-M43 WeakPolarHBondContact CA-O 3.43Å; T35-M43 PolarHBondContact N-O 3.44Å; T35-M43 PolarHBondContact O-N 3.07Å; M43-W45 HydrophobicContact CB-CZ2 4.19Å; M43-W45 HydrophobicContact CE-CH2 3.53Å; M43-W45 HydrophobicContact CE-CZ2 3.17Å; M43-W45 HydrophobicContact SD-CH2 4.06Å; M43-W45 HydrophobicContact SD-CZ2 3.99Å; M43-Y54 CarbonylContact C-O 3.54Å; M43-Y54 VanDerWaalsContact CA-O 3.26Å; M43-Y54 WeakPolarHBondContact CA-O 3.49Å; M43-R55 HydrophobicContact CG-CB 4.41Å; M43-R55 HydrophobicContact CG-CG 4.28Å
44	I	94.8	Very high	91.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	113.6	171	-62.5	178.8	0	0	0	108.2	Q32 I33 A34 A53 Y54 F56 V75 P89	Q32-I44 HydrophobicContact CB-CG2 3.88Å; Q32-I44 HydrophobicContact CG-CG2 3.97Å; I33-I44 CarbonylContact O-C 3.52Å; I33-I44 VanDerWaalsContact O-CA 3.3Å; I33-I44 WeakPolarHBondContact O-CA 3.4Å; A34-I44 HydrophobicContact CB-CG1 4.16Å; I44-A53 CarbonylContact O-C 3.55Å; I44-A53 VanDerWaalsContact O-CA 3.3Å; I44-A53 WeakPolarHBondContact O-CA 3.47Å; I44-Y54 HydrophobicContact CB-CD2 4.48Å; I44-Y54 PolarHBondContact N-O 2.87Å; I44-Y54 PolarHBondContact O-N 3.2Å; I44-F56 HydrophobicContact CB-CE2 3.9Å; I44-F56 HydrophobicContact CD1-CD2 4.22Å; I44-F56 HydrophobicContact CD1-CE2 3.36Å; I44-F56 HydrophobicContact CD1-CZ 3.94Å; I44-F56 HydrophobicContact CG1-CD2 4.15Å; I44-F56 HydrophobicContact CG1-CE2 3.5Å; I44-F56 HydrophobicContact CG1-CZ 4.47Å; I44-V75 HydrophobicContact CD1-CG2 3.88Å; I44-P89 HydrophobicContact CD1-CB 3.54Å
45	W	93.6	Very high	91.2	Very high	17 Å²	17	52.1 Å²	52.1	6%	0.064	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	144.7	177.7	-48.8	91.3	0	0	0	109.6	F14 Q32 I33 T35 M43 A53	F14-W45 HydrophobicContact CB-CD2 3.84Å; F14-W45 HydrophobicContact CB-CE3 3.7Å; F14-W45 HydrophobicContact CB-CG 4.5Å; F14-W45 HydrophobicContact CB-CH2 4.03Å; F14-W45 HydrophobicContact CB-CZ2 4.13Å; F14-W45 HydrophobicContact CB-CZ3 3.83Å; F14-W45 HydrophobicContact CD1-CB 4.28Å; F14-W45 HydrophobicContact CD1-CD2 4.04Å; F14-W45 AromaticContact CD1-CE3 3.55Å; F14-W45 HydrophobicContact CD1-CE3 3.55Å; F14-W45 HydrophobicContact CD1-CG 4.36Å; F14-W45 HydrophobicContact CD1-CZ3 4.21Å; F14-W45 HydrophobicContact CD2-CB 4.42Å; F14-W45 HydrophobicContact CD2-CG 4.37Å; F14-W45 HydrophobicContact CE1-CB 4.17Å; F14-W45 HydrophobicContact CE1-CE3 4.36Å; F14-W45 HydrophobicContact CE2-CB 4.31Å; F14-W45 HydrophobicContact CG-CB 4.41Å; F14-W45 AromaticContact CG-CD2 3.9Å; F14-W45 HydrophobicContact CG-CD2 3.9Å; F14-W45 AromaticContact CG-CE3 3.79Å; F14-W45 HydrophobicContact CG-CE3 3.79Å; F14-W45 HydrophobicContact CG-CG 4.17Å; F14-W45 HydrophobicContact CG-CZ3 4.38Å; F14-W45 HydrophobicContact CZ-CB 4.18Å; Q32-W45 CarbonylContact C-O 3.59Å; Q32-W45 WeakPolarHBondContact CA-O 3.46Å; I33-W45 HydrophobicContact CB-CB 4.37Å; I33-W45 PolarHBondContact N-O 3.17Å; I33-W45 PolarHBondContact O-N 2.97Å; T35-W45 PolarHBondContact OG1-NE1 3.1Å; M43-W45 HydrophobicContact CB-CZ2 4.19Å; M43-W45 HydrophobicContact CE-CH2 3.53Å; M43-W45 HydrophobicContact CE-CZ2 3.17Å; M43-W45 HydrophobicContact SD-CH2 4.06Å; M43-W45 HydrophobicContact SD-CZ2 3.99Å; W45-A53 HydrophobicContact CD2-CB 4.05Å; W45-A53 HydrophobicContact CE3-CB 3.41Å; W45-A53 VanDerWaalsContact CE3-CB 3.41Å; W45-A53 HydrophobicContact CZ3-CB 3.74Å
46	N	92.1	Very high	91	Very high	16 Å²	16	52.2 Å²	52.2	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.4	172.1	-71.8	-65.4	0	0	0	109.4	Q32 K48 M51 R52	Q32-N46 VanDerWaalsContact CG-OD1 3.3Å; Q32-N46 WeakPolarHBondContact CG-OD1 3.32Å; Q32-N46 PolarHBondContact NE2-OD1 3Å; N46-K48 PolarHBondContact O-N 3.28Å; N46-M51 HydrophobicContact CB-CB 3.49Å; N46-M51 VanDerWaalsContact CB-CB 3.49Å; N46-M51 HydrophobicContact CB-CG 4.38Å; N46-R52 PolarHBondContact ND2-O 2.84Å
47	M	87.9	Confident	90.8	Very high	25 Å²	25	57.8 Å²	57.8	12%	0.123	28%	0.281	C	S	.	.	S	Bend	trans	-74.1	-5.6	176.5	-68.9	-57.2	-72.7	0	0	113.2	R12 F14 M30 K31 I33 V296	R12-M47 VanDerWaalsContact NH1-C 3.34Å; R12-M47 PolarHBondContact NH1-O 3.16Å; R12-M47 PolarHBondContact NH2-O 3.07Å; F14-M47 HydrophobicContact CE2-SD 4.26Å; F14-M47 HydrophobicContact CZ-SD 4.14Å; M30-M47 WeakPolarHBondContact O-CG 3.5Å; K31-M47 PolarHBondContact O-N 3.3Å; I33-M47 HydrophobicContact CD1-SD 3.5Å; I33-M47 WeakPolarHBondContact CD1-SD 3.43Å; I33-M47 HydrophobicContact CG1-SD 4.11Å; M47-V296 HydrophobicContact CE-CG1 3.93Å
48	K	86.7	Confident	90.4	Very high	153 Å²	153	58.7 Å²	58.7	67%	0.665	29%	0.29	S	S	*	.	S	Bend	trans	-92.6	126.1	171.2	-69.1	-173.8	178.5	-175.4	0	109.3	N46 Q50 M51	N46-K48 PolarHBondContact O-N 3.28Å; K48-Q50 PolarHBondContact O-N 3.49Å; K48-Q50 VanDerWaalsContact O-N 3.13Å; K48-M51 HydrophobicContact CB-CG 4.14Å; K48-M51 PolarHBondContact O-N 3.26Å
49	P	77.3	Confident	90.4	Very high	107 Å²	107	56.9 Å²	56.9	70%	0.695	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23.2	-170.3	27	-32.8	0	0	0	113.1	M51	P49-M51 VanDerWaalsContact C-N 3.29Å; P49-M51 PolarHBondContact O-N 3.31Å
50	Q	78.3	Confident	90.4	Very high	187 Å²	187	64.6 Å²	64.6	87%	0.874	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-12.4	178.5	-65.2	176.1	-8.5	0	0	113.6	K48	K48-Q50 PolarHBondContact O-N 3.49Å; K48-Q50 VanDerWaalsContact O-N 3.13Å
51	M	83.4	Confident	90.5	Very high	90 Å²	90	67.8 Å²	67.8	44%	0.443	32%	0.323	S	S	.	.	S	Bend	trans	-97.3	128.7	-175.5	-69.3	-69.1	-66	0	0	110.6	N46 K48 P49	N46-M51 HydrophobicContact CB-CB 3.49Å; N46-M51 VanDerWaalsContact CB-CB 3.49Å; N46-M51 HydrophobicContact CB-CG 4.38Å; K48-M51 HydrophobicContact CB-CG 4.14Å; K48-M51 PolarHBondContact O-N 3.26Å; P49-M51 VanDerWaalsContact C-N 3.29Å; P49-M51 PolarHBondContact O-N 3.31Å
52	R	84.1	Confident	90.6	Very high	218 Å²	218	68.2 Å²	68.2	82%	0.823	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-69	154.3	175.1	-65.3	-176.5	179.6	-177.6	-0.3	111.1	N46	N46-R52 PolarHBondContact ND2-O 2.84Å
53	A	89.7	Confident	90.6	Very high	39 Å²	39	68.1 Å²	68.1	32%	0.322	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-76.3	146.4	169.6	0	0	0	0	0	110.6	I44 W45	I44-A53 CarbonylContact O-C 3.55Å; I44-A53 VanDerWaalsContact O-CA 3.3Å; I44-A53 WeakPolarHBondContact O-CA 3.47Å; W45-A53 HydrophobicContact CD2-CB 4.05Å; W45-A53 HydrophobicContact CE3-CB 3.41Å; W45-A53 VanDerWaalsContact CE3-CB 3.41Å; W45-A53 HydrophobicContact CZ3-CB 3.74Å
54	Y	91.1	Very high	90.7	Very high	40 Å²	40	68.8 Å²	68.8	16%	0.157	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	131.2	172	-55.4	-48.6	0	0	0	109.5	M43 I44 F56 M91	M43-Y54 CarbonylContact C-O 3.54Å; M43-Y54 VanDerWaalsContact CA-O 3.26Å; M43-Y54 WeakPolarHBondContact CA-O 3.49Å; I44-Y54 HydrophobicContact CB-CD2 4.48Å; I44-Y54 PolarHBondContact N-O 2.87Å; I44-Y54 PolarHBondContact O-N 3.2Å; Y54-F56 HydrophobicContact CD2-CZ 4.47Å; Y54-F56 HydrophobicContact CG-CZ 4.35Å; Y54-M91 HydrophobicContact CD1-CG 4.11Å; Y54-M91 HydrophobicContact CE1-CB 4.45Å; Y54-M91 HydrophobicContact CE1-CE 3.77Å; Y54-M91 HydrophobicContact CE1-CG 3.32Å; Y54-M91 HydrophobicContact CE1-SD 4.41Å
55	R	92.9	Very high	90.8	Very high	96 Å²	96	69.1 Å²	69.1	36%	0.362	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.6	173.6	-173.3	-179.7	-175.4	97	3.3	108.8	G16 D39 C41 M43	G16-R55 PolarHBondContact O-NH1 3.22Å; D39-R55 IonicContact OD2-CZ 3.57Å; D39-R55 IonicContact OD2-NH1 3.68Å; D39-R55 PolarHBondContact OD2-NH1 3.47Å; D39-R55 IonicContact OD2-NH2 3.3Å; D39-R55 PolarHBondContact OD2-NH2 2.89Å; C41-R55 HydrophobicContact CB-CG 4.36Å; C41-R55 VanDerWaalsContact SG-CZ 3.52Å; C41-R55 PolarHBondContact SG-NE 3.24Å; C41-R55 PolarHBondContact SG-NH2 3.14Å; M43-R55 HydrophobicContact CG-CB 4.41Å; M43-R55 HydrophobicContact CG-CG 4.28Å
56	F	93.1	Very high	91	Very high	3 Å²	3	68.5 Å²	68.5	1%	0.013	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	117.7	176.5	-58.4	-76.3	0	0	0	109.4	V42 I44 Y54 W87 A93	V42-F56 HydrophobicContact CB-CB 4.27Å; V42-F56 PolarHBondContact N-O 3.46Å; V42-F56 VanDerWaalsContact N-O 3.12Å; V42-F56 WeakPolarHBondContact O-CB 3.44Å; V42-F56 PolarHBondContact O-N 3.01Å; I44-F56 HydrophobicContact CB-CE2 3.9Å; I44-F56 HydrophobicContact CD1-CD2 4.22Å; I44-F56 HydrophobicContact CD1-CE2 3.36Å; I44-F56 HydrophobicContact CD1-CZ 3.94Å; I44-F56 HydrophobicContact CG1-CD2 4.15Å; I44-F56 HydrophobicContact CG1-CE2 3.5Å; I44-F56 HydrophobicContact CG1-CZ 4.47Å; Y54-F56 HydrophobicContact CD2-CZ 4.47Å; Y54-F56 HydrophobicContact CG-CZ 4.35Å; F56-W87 HydrophobicContact CB-CD2 4.09Å; F56-W87 HydrophobicContact CB-CE3 3.67Å; F56-W87 HydrophobicContact CB-CH2 4.01Å; F56-W87 HydrophobicContact CB-CZ2 4.35Å; F56-W87 HydrophobicContact CB-CZ3 3.67Å; F56-W87 AromaticContact CD1-CE3 3.79Å; F56-W87 HydrophobicContact CD1-CE3 3.79Å; F56-W87 HydrophobicContact CD1-CZ3 4.25Å; F56-W87 HydrophobicContact CG-CD2 4.32Å; F56-W87 AromaticContact CG-CE3 3.9Å; F56-W87 HydrophobicContact CG-CE3 3.9Å; F56-W87 HydrophobicContact CG-CZ3 4.32Å; F56-A93 HydrophobicContact CD1-CB 3.51Å; F56-A93 HydrophobicContact CE1-CB 3.7Å
57	D	91.9	Very high	91.2	Very high	117 Å²	117	68.2 Å²	68.2	63%	0.626	33%	0.329	S	S	*	.			trans	-106.5	139.1	176.5	-161.4	-46.9	0	0	0	109.2
58	G	89.8	Confident	91.6	Very high	18 Å²	18	67 Å²	67	19%	0.186	32%	0.323	C	S	.	.			trans	165.3	-27.7	174.8	0	0	0	0	0	114.7	R85	G58-R85 VanDerWaalsContact C-NH2 3.33Å; G58-R85 PolarHBondContact O-NE 3.38Å; G58-R85 PolarHBondContact O-NH2 3.4Å
59	H	95.4	Very high	91.9	Very high	5 Å²	5	60 Å²	60	2%	0.023	29%	0.293	C	S	.	.			trans	-67.9	141.8	171	-82	-62.8	0	0	0	110.3	V63 S77 S79 D81 T83	H59-V63 HydrophobicContact CB-CG2 4.24Å; H59-S77 PolarHBondContact CD2-OG 3.05Å; H59-S77 PolarHBondContact NE2-OG 3.36Å; H59-S79 WeakPolarHBondContact ND1-CB 3.31Å; H59-D81 WeakPolarHBondContact CA-OD2 3.5Å; H59-D81 IonicContact CG-OD2 3.41Å; H59-D81 IonicContact ND1-OD1 3.71Å; H59-D81 IonicContact ND1-OD2 2.98Å; H59-D81 PolarHBondContact ND1-OD2 3.04Å; H59-T83 PolarHBondContact CE1-OG1 3.49Å; H59-T83 PolarHBondContact ND1-OG1 3.43Å
60	K	95.1	Very high	92.6	Very high	184 Å²	184	56.7 Å²	56.7	80%	0.8	27%	0.271	S	S	*	.	S	Bend	trans	-84.1	-22.3	-179.1	-65.8	-176.1	178.5	-176.7	0	112.8	D81	K60-D81 HydrophobicContact CB-CB 4.04Å; K60-D81 PolarHBondContact N-OD2 2.99Å
61	E	97	Very high	93.2	Very high	98 Å²	98	51.2 Å²	51.2	46%	0.458	25%	0.254	S	S	.	.	S	Bend	trans	-135.6	177.2	-178.3	-62	-175.4	-169.1	0	0	110.6	S40 V63 S79 R80 D81	S40-E61 WeakPolarHBondContact CA-O 3.33Å; S40-E61 VanDerWaalsContact CB-O 3.23Å; S40-E61 WeakPolarHBondContact CB-O 3.37Å; E61-V63 PolarHBondContact O-N 3.34Å; E61-S79 VanDerWaalsContact C-OG 3.32Å; E61-S79 PolarHBondContact O-OG 2.94Å; E61-R80 HydrophobicContact CB-CB 3.95Å; E61-R80 VanDerWaalsContact OE2-C 3.26Å; E61-R80 WeakPolarHBondContact OE2-CB 3.48Å; E61-D81 HydrophobicContact CB-CB 4.16Å; E61-D81 HydrophobicContact CG-CB 4.22Å
62	A	96.5	Very high	93.5	Very high	10 Å²	10	47.8 Å²	47.8	8%	0.083	24%	0.241	C	C	.	.			trans	-46.3	129.5	-179.5	0	0	0	0	0	113.4	V38 S79 R80	V38-A62 HydrophobicContact CB-CB 4.29Å; V38-A62 HydrophobicContact CG1-CB 4.02Å; A62-S79 VanDerWaalsContact O-CA 3.31Å; A62-S79 WeakPolarHBondContact O-CA 3.45Å; A62-S79 PolarHBondContact O-OG 2.88Å; A62-S79 VanDerWaalsContact O-OG 3.06Å; A62-R80 HydrophobicContact CB-CG 4.3Å; A62-R80 PolarHBondContact O-N 3.26Å
63	V	97.6	Very high	93.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.1	171.4	-178.4	0	0	0	0	107.8	T22 S37 V42 H59 E61 V66 T78	T22-V63 WeakPolarHBondContact CB-O 3.49Å; T22-V63 WeakPolarHBondContact CG2-O 3.48Å; T22-V63 PolarHBondContact OG1-O 3.16Å; S37-V63 WeakPolarHBondContact O-CB 3.48Å; S37-V63 PolarHBondContact O-N 3Å; V42-V63 HydrophobicContact CG2-CG1 4.15Å; V42-V63 HydrophobicContact CG2-CG2 4.07Å; H59-V63 HydrophobicContact CB-CG2 4.24Å; E61-V63 PolarHBondContact O-N 3.34Å; V63-V66 HydrophobicContact CG1-CG2 3.65Å; V63-T78 CarbonylContact C-O 3.51Å; V63-T78 WeakPolarHBondContact CA-O 3.21Å; V63-T78 WeakPolarHBondContact CG1-O 3.36Å
64	T	96.9	Very high	94	Very high	21 Å²	21	44.2 Å²	44.2	13%	0.129	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-36.1	-176.1	62.5	0	0	0	0	112.6	T22 T78 R80 V105 R106	T22-T64 PolarHBondContact OG1-O 3.37Å; T64-T78 PolarHBondContact N-O 3.39Å; T64-T78 PolarHBondContact OG1-O 2.65Å; T64-T78 PolarHBondContact OG1-OG1 2.94Å; T64-R80 HydrophobicContact CG2-CG 3.87Å; T64-V105 PolarHBondContact OG1-O 3.07Å; T64-R106 WeakPolarHBondContact CB-O 3.48Å; T64-R106 WeakPolarHBondContact OG1-CA 3.39Å; T64-R106 PolarHBondContact OG1-O 3.46Å
65	C	96.9	Very high	94.3	Very high	8 Å²	8	42.3 Å²	42.3	5%	0.054	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	145.7	-177.1	-168.2	0	0	0	0	110.1	S23 S77 T78 R106	S23-C65 VanDerWaalsContact OG-CA 3.24Å; S23-C65 WeakPolarHBondContact OG-CA 3.42Å; C65-S77 WeakPolarHBondContact O-CA 3.34Å; C65-T78 WeakPolarHBondContact CB-OG1 3.32Å; C65-T78 PolarHBondContact N-OG1 3.03Å; C65-T78 PolarHBondContact O-N 3.39Å; C65-T78 PolarHBondContact O-OG1 2.74Å; C65-R106 VanDerWaalsContact CB-O 3.3Å; C65-R106 WeakPolarHBondContact CB-O 3.14Å
66	V	97.1	Very high	94.4	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.1	176.8	177.3	0	0	0	0	108	S23 A34 V42 V63 V75 A76	S23-V66 PolarHBondContact OG-N 3.42Å; A34-V66 HydrophobicContact CB-CG1 3.63Å; V42-V66 HydrophobicContact CG1-CG1 4.2Å; V42-V66 HydrophobicContact CG1-CG2 4.22Å; V42-V66 HydrophobicContact CG2-CG2 4.17Å; V63-V66 HydrophobicContact CG1-CG2 3.65Å; V66-V75 HydrophobicContact CG1-CG1 3.5Å; V66-V75 VanDerWaalsContact CG1-CG1 3.5Å; V66-A76 CarbonylContact C-O 3.55Å; V66-A76 VanDerWaalsContact CA-O 3.29Å; V66-A76 WeakPolarHBondContact CA-O 3.46Å
67	Q	96.4	Very high	94.6	Very high	10 Å²	10	37.6 Å²	37.6	5%	0.047	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	141.9	175.4	-157.8	-169.8	24.9	0	0	112	D25 V75 A76 V108 N109 F110	D25-Q67 WeakPolarHBondContact OD2-CA 3.23Å; D25-Q67 WeakPolarHBondContact OD2-CG 3.4Å; Q67-V75 CarbonylContact O-C 3.55Å; Q67-V75 WeakPolarHBondContact O-CA 3.48Å; Q67-A76 PolarHBondContact N-O 3.28Å; Q67-A76 PolarHBondContact O-N 3.06Å; Q67-V108 HydrophobicContact CB-CG1 4.39Å; Q67-N109 VanDerWaalsContact CD-OD1 3.27Å; Q67-N109 PolarHBondContact NE2-OD1 3.42Å; Q67-N109 PolarHBondContact OE1-OD1 3.43Å; Q67-F110 HydrophobicContact CB-CD2 4.41Å; Q67-F110 HydrophobicContact CG-CD2 4.5Å
68	F	95.9	Very high	94.9	Very high	1 Å²	1	32 Å²	32	0%	0.004	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	146.6	167.2	-78.1	-83.1	0	0	0	111.7	D25 F26 Q32 A34 V75 F110	D25-F68 HydrophobicContact CB-CD2 4.29Å; D25-F68 WeakPolarHBondContact O-CE2 3.2Å; D25-F68 PolarHBondContact OD2-N 2.97Å; F26-F68 WeakPolarHBondContact O-CD2 3.3Å; Q32-F68 HydrophobicContact CB-CZ 4.13Å; A34-F68 HydrophobicContact CB-CD2 3.98Å; A34-F68 HydrophobicContact CB-CE2 3.26Å; A34-F68 HydrophobicContact CB-CZ 3.56Å; A34-F68 VanDerWaalsContact N-CE2 3.35Å; F68-V75 HydrophobicContact CD1-CG2 3.38Å; F68-V75 HydrophobicContact CE1-CG2 3.26Å; F68-V75 HydrophobicContact CG-CG2 4.12Å; F68-V75 HydrophobicContact CZ-CG2 3.94Å; F68-F110 WeakPolarHBondContact O-CD2 3.38Å
69	S	94.5	Very high	95.3	Very high	4 Å²	4	31.1 Å²	31.1	3%	0.028	16%	0.164	C	C	.	.			trans	-63.6	151.7	162.4	69.5	0	0	0	0	110	S71 G72 H73 L74	S69-S71 PolarHBondContact O-N 3.44Å; S69-S71 VanDerWaalsContact O-N 3.12Å; S69-S71 PolarHBondContact OG-OG 3.19Å; S69-G72 WeakPolarHBondContact O-CA 3.47Å; S69-G72 PolarHBondContact O-N 2.98Å; S69-G72 PolarHBondContact OG-N 3.26Å; S69-H73 PolarHBondContact OG-N 2.81Å; S69-L74 PolarHBondContact N-O 3.24Å; S69-L74 PolarHBondContact OG-N 2.86Å; S69-L74 VanDerWaalsContact OG-N 3.16Å; S69-L74 PolarHBondContact OG-O 3.45Å
70	P	91.7	Very high	95.3	Very high	38 Å²	38	35.9 Å²	35.9	25%	0.247	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.2	175.8	-25.2	32.5	0	0	0	113.4	C28 G72 S111 C112	C28-P70 WeakPolarHBondContact CB-O 3.48Å; P70-G72 VanDerWaalsContact C-N 3.33Å; P70-S111 VanDerWaalsContact CG-O 3.23Å; P70-S111 WeakPolarHBondContact CG-O 3.45Å; P70-C112 WeakPolarHBondContact CG-O 3.4Å
71	S	90.6	Very high	95.4	Very high	73 Å²	73	28.2 Å²	28.2	51%	0.51	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.7	174.1	59.4	0	0	0	0	114.4	S69 H73	S69-S71 PolarHBondContact O-N 3.44Å; S69-S71 VanDerWaalsContact O-N 3.12Å; S69-S71 PolarHBondContact OG-OG 3.19Å; S71-H73 PolarHBondContact O-N 3.2Å
72	G	89.7	Confident	95.4	Very high	17 Å²	17	27.1 Å²	27.1	18%	0.175	14%	0.143	C	C	.	.	S	Bend	trans	74.5	2.5	-175.7	0	0	0	0	0	115.3	S69 P70	S69-G72 WeakPolarHBondContact O-CA 3.47Å; S69-G72 PolarHBondContact O-N 2.98Å; S69-G72 PolarHBondContact OG-N 3.26Å; P70-G72 VanDerWaalsContact C-N 3.33Å
73	H	90.8	Very high	95.4	Very high	135 Å²	135	27.8 Å²	27.8	63%	0.625	15%	0.146	S	C	*	.	S	Bend	trans	-83.2	-17.1	-179.3	-64.7	-49.4	0	0	0	114.3	S69 S71 P89	S69-H73 PolarHBondContact OG-N 2.81Å; S71-H73 PolarHBondContact O-N 3.2Å; H73-P89 WeakPolarHBondContact O-CD 3.4Å
74	L	93.9	Very high	95.4	Very high	47 Å²	47	27.8 Å²	27.8	25%	0.246	15%	0.146	C	C	.	.			trans	-131.2	150.7	179.8	-66.4	173	0	0	0	110.2	S69 W87 V88 V131	S69-L74 PolarHBondContact N-O 3.24Å; S69-L74 PolarHBondContact OG-N 2.86Å; S69-L74 VanDerWaalsContact OG-N 3.16Å; S69-L74 PolarHBondContact OG-O 3.45Å; L74-W87 CarbonylContact C-O 3.56Å; L74-W87 WeakPolarHBondContact CA-O 3.17Å; L74-V88 HydrophobicContact CD2-CG2 4.11Å; L74-V131 HydrophobicContact CD1-CG1 3.74Å
75	V	95.7	Very high	95.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	123.4	168.1	177.3	0	0	0	0	107.8	A34 I44 V66 Q67 F68 L86 W87 P89	A34-V75 HydrophobicContact CB-CG1 4.13Å; A34-V75 HydrophobicContact CB-CG2 4.5Å; I44-V75 HydrophobicContact CD1-CG2 3.88Å; V66-V75 HydrophobicContact CG1-CG1 3.5Å; V66-V75 VanDerWaalsContact CG1-CG1 3.5Å; Q67-V75 CarbonylContact O-C 3.55Å; Q67-V75 WeakPolarHBondContact O-CA 3.48Å; F68-V75 HydrophobicContact CD1-CG2 3.38Å; F68-V75 HydrophobicContact CE1-CG2 3.26Å; F68-V75 HydrophobicContact CG-CG2 4.12Å; F68-V75 HydrophobicContact CZ-CG2 3.94Å; V75-L86 CarbonylContact O-C 3.56Å; V75-L86 WeakPolarHBondContact O-CA 3.24Å; V75-W87 HydrophobicContact CB-CB 4.3Å; V75-W87 PolarHBondContact N-O 3.03Å; V75-W87 PolarHBondContact O-N 3.46Å; V75-P89 HydrophobicContact CG2-CB 4.35Å
76	A	96.8	Very high	95.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	139.1	168.9	0	0	0	0	0	109.9	V66 Q67 R85 L86 V108 F110	V66-A76 CarbonylContact C-O 3.55Å; V66-A76 VanDerWaalsContact CA-O 3.29Å; V66-A76 WeakPolarHBondContact CA-O 3.46Å; Q67-A76 PolarHBondContact N-O 3.28Å; Q67-A76 PolarHBondContact O-N 3.06Å; A76-R85 CarbonylContact C-O 3.52Å; A76-R85 WeakPolarHBondContact CA-O 3.5Å; A76-L86 HydrophobicContact CB-CD2 3.7Å; A76-V108 HydrophobicContact CB-CG1 3.96Å; A76-V108 HydrophobicContact CB-CG2 3.94Å; A76-F110 HydrophobicContact CB-CE2 3.45Å; A76-F110 VanDerWaalsContact CB-CE2 3.45Å; A76-F110 HydrophobicContact CB-CZ 3.5Å
77	S	97.3	Very high	95.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	143.7	167.9	65.4	0	0	0	0	111.2	H59 C65 V84 R85 W87	H59-S77 PolarHBondContact CD2-OG 3.05Å; H59-S77 PolarHBondContact NE2-OG 3.36Å; C65-S77 WeakPolarHBondContact O-CA 3.34Å; S77-V84 WeakPolarHBondContact O-CA 3.48Å; S77-R85 PolarHBondContact N-O 2.81Å; S77-R85 PolarHBondContact O-N 2.59Å; S77-W87 PolarHBondContact OG-NE1 3.13Å
78	T	97.6	Very high	95.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	146.7	176.3	61.5	0	0	0	0	110.3	V63 T64 C65 V84 V105 V108	V63-T78 CarbonylContact C-O 3.51Å; V63-T78 WeakPolarHBondContact CA-O 3.21Å; V63-T78 WeakPolarHBondContact CG1-O 3.36Å; T64-T78 PolarHBondContact N-O 3.39Å; T64-T78 PolarHBondContact OG1-O 2.65Å; T64-T78 PolarHBondContact OG1-OG1 2.94Å; C65-T78 WeakPolarHBondContact CB-OG1 3.32Å; C65-T78 PolarHBondContact N-OG1 3.03Å; C65-T78 PolarHBondContact O-N 3.39Å; C65-T78 PolarHBondContact O-OG1 2.74Å; T78-V84 HydrophobicContact CG2-CG2 4.11Å; T78-V105 HydrophobicContact CG2-CB 4.32Å; T78-V105 HydrophobicContact CG2-CG1 3.52Å; T78-V108 HydrophobicContact CG2-CB 3.52Å; T78-V108 HydrophobicContact CG2-CG1 3.66Å
79	S	97.6	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	161.9	-177.9	171.7	0	0	0	0	112.3	H59 E61 A62 D81 K82 T83 V105	H59-S79 WeakPolarHBondContact ND1-CB 3.31Å; E61-S79 VanDerWaalsContact C-OG 3.32Å; E61-S79 PolarHBondContact O-OG 2.94Å; A62-S79 VanDerWaalsContact O-CA 3.31Å; A62-S79 WeakPolarHBondContact O-CA 3.45Å; A62-S79 PolarHBondContact O-OG 2.88Å; A62-S79 VanDerWaalsContact O-OG 3.06Å; S79-D81 WeakPolarHBondContact CB-OD1 3.15Å; S79-D81 PolarHBondContact O-N 3.45Å; S79-D81 VanDerWaalsContact OG-CG 3.28Å; S79-D81 PolarHBondContact OG-N 3.22Å; S79-D81 VanDerWaalsContact OG-N 3.16Å; S79-D81 PolarHBondContact OG-OD1 2.72Å; S79-K82 PolarHBondContact O-N 3.19Å; S79-T83 PolarHBondContact N-O 2.93Å; S79-V105 PolarHBondContact O-N 3Å
80	R	96.9	Very high	94.2	Very high	105 Å²	105	34.4 Å²	34.4	40%	0.396	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.9	168.9	-61.7	-172.8	-173.1	175.1	1.7	113.3	E61 A62 T64 K82 T104	E61-R80 HydrophobicContact CB-CB 3.95Å; E61-R80 VanDerWaalsContact OE2-C 3.26Å; E61-R80 WeakPolarHBondContact OE2-CB 3.48Å; A62-R80 HydrophobicContact CB-CG 4.3Å; A62-R80 PolarHBondContact O-N 3.26Å; T64-R80 HydrophobicContact CG2-CG 3.87Å; R80-K82 PolarHBondContact O-N 3.25Å; R80-T104 HydrophobicContact CB-CG2 3.95Å; R80-T104 HydrophobicContact CG-CG2 4.17Å
81	D	96.2	Very high	93.6	Very high	22 Å²	22	39.7 Å²	39.7	12%	0.118	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	3.4	174	73.8	12.1	0	0	0	114.9	H59 K60 E61 S79 T83	H59-D81 WeakPolarHBondContact CA-OD2 3.5Å; H59-D81 IonicContact CG-OD2 3.41Å; H59-D81 IonicContact ND1-OD1 3.71Å; H59-D81 IonicContact ND1-OD2 2.98Å; H59-D81 PolarHBondContact ND1-OD2 3.04Å; K60-D81 HydrophobicContact CB-CB 4.04Å; K60-D81 PolarHBondContact N-OD2 2.99Å; E61-D81 HydrophobicContact CB-CB 4.16Å; E61-D81 HydrophobicContact CG-CB 4.22Å; S79-D81 WeakPolarHBondContact CB-OD1 3.15Å; S79-D81 PolarHBondContact O-N 3.45Å; S79-D81 VanDerWaalsContact OG-CG 3.28Å; S79-D81 PolarHBondContact OG-N 3.22Å; S79-D81 VanDerWaalsContact OG-N 3.16Å; S79-D81 PolarHBondContact OG-OD1 2.72Å; D81-T83 VanDerWaalsContact CG-OG1 3.23Å; D81-T83 PolarHBondContact O-N 2.88Å; D81-T83 WeakPolarHBondContact OD1-CA 3.47Å; D81-T83 VanDerWaalsContact OD1-CB 3.3Å; D81-T83 WeakPolarHBondContact OD1-CB 3.39Å; D81-T83 PolarHBondContact OD1-N 3.37Å; D81-T83 PolarHBondContact OD1-OG1 3.47Å; D81-T83 PolarHBondContact OD2-OG1 2.87Å
82	K	96.6	Very high	92.9	Very high	76 Å²	76	44.1 Å²	44.1	33%	0.33	22%	0.218	S	C	.	.	S	Bend	trans	75	6.4	175.7	-41.9	167.1	175.6	-168.7	0	113.5	S79 R80 A100 H101 T102 A103	S79-K82 PolarHBondContact O-N 3.19Å; R80-K82 PolarHBondContact O-N 3.25Å; K82-A100 PolarHBondContact O-N 2.77Å; K82-H101 PolarHBondContact O-N 3.03Å; K82-T102 VanDerWaalsContact CD-O 3.26Å; K82-T102 WeakPolarHBondContact CD-O 3.18Å; K82-T102 WeakPolarHBondContact CE-O 3.19Å; K82-T102 PolarHBondContact NZ-O 3.35Å; K82-A103 WeakPolarHBondContact CA-O 3.38Å; K82-A103 WeakPolarHBondContact CB-O 3.37Å; K82-A103 WeakPolarHBondContact CG-O 3.46Å
83	T	96.9	Very high	92.3	Very high	23 Å²	23	45.2 Å²	45.2	14%	0.141	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	156	-179.1	74.8	0	0	0	0	111.8	H59 S79 D81 V97 F98	H59-T83 PolarHBondContact CE1-OG1 3.49Å; H59-T83 PolarHBondContact ND1-OG1 3.43Å; S79-T83 PolarHBondContact N-O 2.93Å; D81-T83 VanDerWaalsContact CG-OG1 3.23Å; D81-T83 PolarHBondContact O-N 2.88Å; D81-T83 WeakPolarHBondContact OD1-CA 3.47Å; D81-T83 VanDerWaalsContact OD1-CB 3.3Å; D81-T83 WeakPolarHBondContact OD1-CB 3.39Å; D81-T83 PolarHBondContact OD1-N 3.37Å; D81-T83 PolarHBondContact OD1-OG1 3.47Å; D81-T83 PolarHBondContact OD2-OG1 2.87Å; T83-V97 HydrophobicContact CG2-CG2 4.16Å; T83-F98 WeakPolarHBondContact CA-O 3.44Å
84	V	97.3	Very high	92.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	134.5	166.6	177.8	0	0	0	0	106.3	S77 T78 F98 A100 V105 T119	S77-V84 WeakPolarHBondContact O-CA 3.48Å; T78-V84 HydrophobicContact CG2-CG2 4.11Å; V84-F98 HydrophobicContact CB-CE1 3.75Å; V84-F98 HydrophobicContact CB-CE2 4.14Å; V84-F98 HydrophobicContact CB-CZ 3.51Å; V84-F98 HydrophobicContact CG1-CE1 3.8Å; V84-F98 HydrophobicContact CG1-CZ 3.71Å; V84-F98 HydrophobicContact CG2-CE2 4.42Å; V84-F98 HydrophobicContact CG2-CZ 4.1Å; V84-F98 PolarHBondContact N-O 2.77Å; V84-F98 PolarHBondContact O-N 3.46Å; V84-F98 VanDerWaalsContact O-N 3.13Å; V84-A100 HydrophobicContact CB-CB 4.42Å; V84-A100 HydrophobicContact CG2-CB 3.52Å; V84-V105 HydrophobicContact CG2-CG1 4.13Å; V84-V105 HydrophobicContact CG2-CG2 4.44Å; V84-T119 HydrophobicContact CG2-CG2 3.86Å
85	R	96.3	Very high	92	Very high	41 Å²	41	43.3 Å²	43.3	16%	0.155	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.9	174.4	-71.5	-179.9	170.5	-109	-0.4	109.7	G58 A76 S77 W87 S95 T96 V97	G58-R85 VanDerWaalsContact C-NH2 3.33Å; G58-R85 PolarHBondContact O-NE 3.38Å; G58-R85 PolarHBondContact O-NH2 3.4Å; A76-R85 CarbonylContact C-O 3.52Å; A76-R85 WeakPolarHBondContact CA-O 3.5Å; S77-R85 PolarHBondContact N-O 2.81Å; S77-R85 PolarHBondContact O-N 2.59Å; R85-W87 HydrophobicContact CB-CZ2 3.94Å; R85-W87 HydrophobicContact CG-CZ2 4.3Å; R85-S95 PolarHBondContact NH1-OG 2.84Å; R85-T96 WeakPolarHBondContact CA-O 3.39Å; R85-V97 HydrophobicContact CG-CB 3.87Å; R85-V97 HydrophobicContact CG-CG2 3.7Å
86	L	96.1	Very high	91.9	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.8	169.4	-57	176.3	0	0	0	107.9	V75 A76 S95 T96 F110 M117 V131 Q134	V75-L86 CarbonylContact O-C 3.56Å; V75-L86 WeakPolarHBondContact O-CA 3.24Å; A76-L86 HydrophobicContact CB-CD2 3.7Å; L86-S95 CarbonylContact O-C 3.55Å; L86-S95 WeakPolarHBondContact O-CA 3.28Å; L86-T96 PolarHBondContact N-O 3.3Å; L86-T96 PolarHBondContact O-N 3.35Å; L86-F110 HydrophobicContact CD2-CZ 4.06Å; L86-M117 HydrophobicContact CD2-SD 4.19Å; L86-V131 HydrophobicContact CD1-CG1 4.16Å; L86-Q134 HydrophobicContact CD1-CG 4.12Å
87	W	95	Very high	91.8	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.011	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	142.2	-178.5	-51.4	89	0	0	0	109.8	F56 L74 V75 S77 R85 S95	F56-W87 HydrophobicContact CB-CD2 4.09Å; F56-W87 HydrophobicContact CB-CE3 3.67Å; F56-W87 HydrophobicContact CB-CH2 4.01Å; F56-W87 HydrophobicContact CB-CZ2 4.35Å; F56-W87 HydrophobicContact CB-CZ3 3.67Å; F56-W87 AromaticContact CD1-CE3 3.79Å; F56-W87 HydrophobicContact CD1-CE3 3.79Å; F56-W87 HydrophobicContact CD1-CZ3 4.25Å; F56-W87 HydrophobicContact CG-CD2 4.32Å; F56-W87 AromaticContact CG-CE3 3.9Å; F56-W87 HydrophobicContact CG-CE3 3.9Å; F56-W87 HydrophobicContact CG-CZ3 4.32Å; L74-W87 CarbonylContact C-O 3.56Å; L74-W87 WeakPolarHBondContact CA-O 3.17Å; V75-W87 HydrophobicContact CB-CB 4.3Å; V75-W87 PolarHBondContact N-O 3.03Å; V75-W87 PolarHBondContact O-N 3.46Å; S77-W87 PolarHBondContact OG-NE1 3.13Å; R85-W87 HydrophobicContact CB-CZ2 3.94Å; R85-W87 HydrophobicContact CG-CZ2 4.3Å; W87-S95 VanDerWaalsContact CZ3-CB 3.41Å
88	V	93.2	Very high	91.8	Very high	63 Å²	63	51 Å²	51	38%	0.382	27%	0.268	S	S	.	.			trans	-87.9	124.8	163.4	-177.6	0	0	0	0	107.5	L74 S90 D94	L74-V88 HydrophobicContact CD2-CG2 4.11Å; V88-S90 PolarHBondContact O-N 2.82Å; V88-D94 HydrophobicContact CG2-CB 4.46Å; V88-D94 PolarHBondContact N-O 3.09Å
89	P	88.2	Confident	91.6	Very high	22 Å²	22	59 Å²	59	14%	0.143	30%	0.299	C	S	.	.	S	Bend	trans	-75.5	62	-176	33.3	-36	0	0	0	111.6	I44 H73 V75	I44-P89 HydrophobicContact CD1-CB 3.54Å; H73-P89 WeakPolarHBondContact O-CD 3.4Å; V75-P89 HydrophobicContact CG2-CB 4.35Å
90	S	85	Confident	91.4	Very high	52 Å²	52	59.1 Å²	59.1	36%	0.364	30%	0.3	S	S	.	.	S	Bend	trans	-133.2	160.6	-177.3	-176.3	0	0	0	0	110.1	V88 K92 A93	V88-S90 PolarHBondContact O-N 2.82Å; S90-K92 PolarHBondContact O-N 3.09Å; S90-A93 PolarHBondContact O-N 3.38Å
91	M	78.1	Confident	91.4	Very high	149 Å²	149	54.3 Å²	54.3	73%	0.734	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-25.7	178.4	-82.9	-171.2	172.6	0	0	113.7	Y54 A93	Y54-M91 HydrophobicContact CD1-CG 4.11Å; Y54-M91 HydrophobicContact CE1-CB 4.45Å; Y54-M91 HydrophobicContact CE1-CE 3.77Å; Y54-M91 HydrophobicContact CE1-CG 3.32Å; Y54-M91 HydrophobicContact CE1-SD 4.41Å; M91-A93 PolarHBondContact O-N 3.28Å
92	K	75.8	Confident	91.4	Very high	165 Å²	165	57.8 Å²	57.8	72%	0.717	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.5	-176.3	-66.7	-173.8	178	-178	0	114.2	S90 D94	S90-K92 PolarHBondContact O-N 3.09Å; K92-D94 PolarHBondContact O-N 2.88Å; K92-D94 VanDerWaalsContact O-N 3.17Å
93	A	77.1	Confident	91.4	Very high	40 Å²	40	55.3 Å²	55.3	33%	0.331	30%	0.298	S	S	.	.			trans	55.2	30.1	179.2	0	0	0	0	0	115	F56 S90 M91 S95	F56-A93 HydrophobicContact CD1-CB 3.51Å; F56-A93 HydrophobicContact CE1-CB 3.7Å; S90-A93 PolarHBondContact O-N 3.38Å; M91-A93 PolarHBondContact O-N 3.28Å; A93-S95 PolarHBondContact O-N 2.77Å
94	D	87.3	Confident	91.4	Very high	95 Å²	95	55.4 Å²	55.4	51%	0.508	30%	0.298	S	S	.	.			trans	-62.7	126.8	175.7	-65	-33.2	0	0	0	109.6	V88 K92	V88-D94 HydrophobicContact CG2-CB 4.46Å; V88-D94 PolarHBondContact N-O 3.09Å; K92-D94 PolarHBondContact O-N 2.88Å; K92-D94 VanDerWaalsContact O-N 3.17Å
95	S	91.4	Very high	91.4	Very high	48 Å²	48	55.4 Å²	55.4	34%	0.336	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.8	179.8	72	0	0	0	0	112.2	R85 L86 W87 A93	R85-S95 PolarHBondContact NH1-OG 2.84Å; L86-S95 CarbonylContact O-C 3.55Å; L86-S95 WeakPolarHBondContact O-CA 3.28Å; W87-S95 VanDerWaalsContact CZ3-CB 3.41Å; A93-S95 PolarHBondContact O-N 2.77Å
96	T	93.8	Very high	91.5	Very high	64 Å²	64	56 Å²	56	39%	0.393	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.4	169.4	59.4	0	0	0	0	108.9	R85 L86 Q134	R85-T96 WeakPolarHBondContact CA-O 3.39Å; L86-T96 PolarHBondContact N-O 3.3Å; L86-T96 PolarHBondContact O-N 3.35Å; T96-Q134 VanDerWaalsContact CB-NE2 3.28Å; T96-Q134 PolarHBondContact OG1-NE2 3.44Å
97	V	95	Very high	91.5	Very high	73 Å²	73	55.9 Å²	55.9	44%	0.442	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.6	-178.3	63.6	0	0	0	0	110	T83 R85	T83-V97 HydrophobicContact CG2-CG2 4.16Å; R85-V97 HydrophobicContact CG-CB 3.87Å; R85-V97 HydrophobicContact CG-CG2 3.7Å
98	F	95.9	Very high	91.6	Very high	24 Å²	24	55.7 Å²	55.7	11%	0.105	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151.3	169.1	66.7	-80	0	0	0	110.2	T83 V84 A100 M117 W129 Q134	T83-F98 WeakPolarHBondContact CA-O 3.44Å; V84-F98 HydrophobicContact CB-CE1 3.75Å; V84-F98 HydrophobicContact CB-CE2 4.14Å; V84-F98 HydrophobicContact CB-CZ 3.51Å; V84-F98 HydrophobicContact CG1-CE1 3.8Å; V84-F98 HydrophobicContact CG1-CZ 3.71Å; V84-F98 HydrophobicContact CG2-CE2 4.42Å; V84-F98 HydrophobicContact CG2-CZ 4.1Å; V84-F98 PolarHBondContact N-O 2.77Å; V84-F98 PolarHBondContact O-N 3.46Å; V84-F98 VanDerWaalsContact O-N 3.13Å; F98-A100 HydrophobicContact CD2-CB 4.31Å; F98-A100 HydrophobicContact CE2-CB 3.81Å; F98-A100 PolarHBondContact O-N 3.44Å; F98-M117 HydrophobicContact CE1-CE 3.62Å; F98-M117 HydrophobicContact CE2-CE 4.22Å; F98-M117 HydrophobicContact CZ-CE 3.22Å; F98-M117 HydrophobicContact CZ-SD 4.42Å; F98-W129 HydrophobicContact CD2-CE3 4.12Å; F98-W129 HydrophobicContact CD2-CH2 4.35Å; F98-W129 AromaticContact CD2-CZ3 3.99Å; F98-W129 HydrophobicContact CD2-CZ3 3.99Å; F98-W129 AromaticContact CE2-CD2 3.75Å; F98-W129 HydrophobicContact CE2-CD2 3.75Å; F98-W129 AromaticContact CE2-CE2 4Å; F98-W129 AromaticContact CE2-CE3 3.7Å; F98-W129 HydrophobicContact CE2-CE3 3.7Å; F98-W129 HydrophobicContact CE2-CG 4.31Å; F98-W129 HydrophobicContact CE2-CH2 4.24Å; F98-W129 HydrophobicContact CE2-CZ2 4.27Å; F98-W129 AromaticContact CE2-CZ3 3.95Å; F98-W129 HydrophobicContact CE2-CZ3 3.95Å; F98-W129 HydrophobicContact CZ-CD2 4.45Å; F98-Q134 HydrophobicContact CD1-CB 3.95Å; F98-Q134 HydrophobicContact CD1-CG 3.75Å; F98-Q134 VanDerWaalsContact CD1-OE1 3.29Å; F98-Q134 HydrophobicContact CE1-CB 4.36Å; F98-Q134 HydrophobicContact CE1-CG 3.99Å; F98-Q134 HydrophobicContact CG-CB 4.15Å; F98-Q134 HydrophobicContact CG-CG 4.45Å
99	R	95.1	Very high	91.8	Very high	168 Å²	168	53.4 Å²	53.4	63%	0.634	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	105.2	178.1	-172.8	172.7	-177.3	157.8	-3.2	109.3
100	A	92.7	Very high	92.2	Very high	3 Å²	3	52.8 Å²	52.8	3%	0.025	28%	0.28	C	S	.	.			trans	-82.3	-42.2	-176.6	0	0	0	0	0	112.2	K82 V84 F98 V105 K127 W129	K82-A100 PolarHBondContact O-N 2.77Å; V84-A100 HydrophobicContact CB-CB 4.42Å; V84-A100 HydrophobicContact CG2-CB 3.52Å; F98-A100 HydrophobicContact CD2-CB 4.31Å; F98-A100 HydrophobicContact CE2-CB 3.81Å; F98-A100 PolarHBondContact O-N 3.44Å; A100-V105 HydrophobicContact CB-CG2 4.42Å; A100-K127 VanDerWaalsContact O-CD 3.32Å; A100-K127 WeakPolarHBondContact O-CD 3.32Å; A100-K127 PolarHBondContact O-NZ 2.93Å; A100-W129 VanDerWaalsContact CA-CZ2 3.44Å; A100-W129 HydrophobicContact CB-CH2 4.33Å; A100-W129 HydrophobicContact CB-CZ2 3.67Å; A100-W129 VanDerWaalsContact O-CZ2 3.31Å; A100-W129 WeakPolarHBondContact O-CZ2 3.38Å
101	H	96.6	Very high	92.7	Very high	3 Å²	3	50.3 Å²	50.3	1%	0.014	26%	0.263	C	S	.	.			trans	-131.9	169.1	-168.4	-74.2	-89.6	0	0	0	113.2	K82 V105 T119 S121 D123 T125 K127	K82-H101 PolarHBondContact O-N 3.03Å; H101-V105 HydrophobicContact CB-CG2 3.93Å; H101-T119 PolarHBondContact CD2-OG1 2.84Å; H101-T119 PolarHBondContact NE2-O 2.97Å; H101-T119 PolarHBondContact NE2-OG1 3.15Å; H101-S121 WeakPolarHBondContact CB-OG 3.4Å; H101-S121 WeakPolarHBondContact ND1-CB 3.17Å; H101-D123 VanDerWaalsContact CB-OD2 3.23Å; H101-D123 WeakPolarHBondContact CB-OD2 3.3Å; H101-D123 IonicContact CE1-OD1 2.91Å; H101-D123 IonicContact CE1-OD2 4Å; H101-D123 IonicContact CG-OD2 3.5Å; H101-D123 IonicContact ND1-OD1 3.65Å; H101-D123 PolarHBondContact ND1-OD1 3.27Å; H101-D123 IonicContact ND1-OD2 2.79Å; H101-D123 PolarHBondContact ND1-OD2 2.9Å; H101-T125 PolarHBondContact CE1-O 3.03Å; H101-T125 PolarHBondContact ND1-OG1 3.01Å; H101-K127 VanDerWaalsContact CE1-CG 3.44Å; H101-K127 WeakPolarHBondContact CE1-CG 3.16Å
102	T	96	Very high	93.3	Very high	95 Å²	95	46.7 Å²	46.7	58%	0.583	25%	0.252	S	S	*	.	S	Bend	trans	-88.4	-20	176.7	56.8	0	0	0	0	112.6	K82 D123	K82-T102 VanDerWaalsContact CD-O 3.26Å; K82-T102 WeakPolarHBondContact CD-O 3.18Å; K82-T102 WeakPolarHBondContact CE-O 3.19Å; K82-T102 PolarHBondContact NZ-O 3.35Å; T102-D123 PolarHBondContact N-OD2 2.79Å; T102-D123 VanDerWaalsContact OG1-CB 3.23Å; T102-D123 WeakPolarHBondContact OG1-CB 3.3Å; T102-D123 PolarHBondContact OG1-OD2 2.87Å
103	A	97.1	Very high	94.1	Very high	25 Å²	25	43 Å²	43	21%	0.207	24%	0.24	C	C	.	.	S	Bend	trans	-126.3	-171.4	175.9	0	0	0	0	0	111.4	K82 V105 D122 D123	K82-A103 WeakPolarHBondContact CA-O 3.38Å; K82-A103 WeakPolarHBondContact CB-O 3.37Å; K82-A103 WeakPolarHBondContact CG-O 3.46Å; A103-V105 PolarHBondContact O-N 3.23Å; A103-D122 HydrophobicContact CB-CB 3.93Å; A103-D123 HydrophobicContact CB-CB 3.95Å
104	T	97.1	Very high	94.8	Very high	25 Å²	25	41.9 Å²	41.9	15%	0.153	23%	0.232	C	C	.	.			trans	-60.8	134	-173.4	80.5	0	0	0	0	110.8	R80 R106 S121 D122	R80-T104 HydrophobicContact CB-CG2 3.95Å; R80-T104 HydrophobicContact CG-CG2 4.17Å; T104-R106 PolarHBondContact OG1-NE 3.04Å; T104-S121 CarbonylContact O-C 3.44Å; T104-S121 WeakPolarHBondContact O-CA 3.4Å; T104-S121 WeakPolarHBondContact O-CB 3.45Å; T104-S121 PolarHBondContact O-OG 3.26Å; T104-D122 PolarHBondContact O-N 3.37Å; T104-D122 PolarHBondContact OG1-OD1 3.16Å; T104-D122 PolarHBondContact OG1-OD2 2.9Å
105	V	97.9	Very high	95.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.3	174.9	-171.7	0	0	0	0	107.1	T64 T78 S79 V84 A100 H101 A103 S120	T64-V105 PolarHBondContact OG1-O 3.07Å; T78-V105 HydrophobicContact CG2-CB 4.32Å; T78-V105 HydrophobicContact CG2-CG1 3.52Å; S79-V105 PolarHBondContact O-N 3Å; V84-V105 HydrophobicContact CG2-CG1 4.13Å; V84-V105 HydrophobicContact CG2-CG2 4.44Å; A100-V105 HydrophobicContact CB-CG2 4.42Å; H101-V105 HydrophobicContact CB-CG2 3.93Å; A103-V105 PolarHBondContact O-N 3.23Å; V105-S120 CarbonylContact C-O 3.56Å; V105-S120 WeakPolarHBondContact CA-O 3.21Å; V105-S120 WeakPolarHBondContact CG1-O 3.5Å
106	R	96.8	Very high	95.3	Very high	53 Å²	53	41 Å²	41	20%	0.2	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-44.3	-172	-68.9	-74.7	-179.2	176.9	-5.7	112.5	T64 C65 T104 S120 D122 R148	T64-R106 WeakPolarHBondContact CB-O 3.48Å; T64-R106 WeakPolarHBondContact OG1-CA 3.39Å; T64-R106 PolarHBondContact OG1-O 3.46Å; C65-R106 VanDerWaalsContact CB-O 3.3Å; C65-R106 WeakPolarHBondContact CB-O 3.14Å; T104-R106 PolarHBondContact OG1-NE 3.04Å; R106-S120 PolarHBondContact N-O 2.8Å; R106-D122 WeakPolarHBondContact CG-OD1 3.44Å; R106-D122 IonicContact CZ-OD1 3.54Å; R106-D122 IonicContact CZ-OD2 2.83Å; R106-D122 IonicContact NE-OD1 3.61Å; R106-D122 PolarHBondContact NE-OD1 3.02Å; R106-D122 IonicContact NE-OD2 3.44Å; R106-D122 PolarHBondContact NE-OD2 2.97Å; R106-D122 IonicContact NH2-OD1 2.9Å; R106-D122 PolarHBondContact NH2-OD1 2.82Å; R106-D122 IonicContact NH2-OD2 3.6Å; R106-D122 PolarHBondContact NH2-OD2 2.78Å; R106-R148 VanDerWaalsContact CB-O 3.24Å; R106-R148 WeakPolarHBondContact CB-O 3.28Å
107	C	97.1	Very high	95.4	Very high	3 Å²	3	37.9 Å²	37.9	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	152	-174.7	-171.7	0	0	0	0	111.4	T119 S120 C149 V150	C107-T119 WeakPolarHBondContact O-CA 3.45Å; C107-S120 WeakPolarHBondContact CB-OG 3.45Å; C107-S120 PolarHBondContact N-OG 2.98Å; C107-S120 PolarHBondContact O-N 3.27Å; C107-C149 VanDerWaalsContact SG-SG 3.69Å; C107-V150 HydrophobicContact CB-CG1 4.32Å
108	V	97.3	Very high	95.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.3	168.4	58.8	0	0	0	0	109.1	Q67 A76 T78 M117 V118 T119	Q67-V108 HydrophobicContact CB-CG1 4.39Å; A76-V108 HydrophobicContact CB-CG1 3.96Å; A76-V108 HydrophobicContact CB-CG2 3.94Å; T78-V108 HydrophobicContact CG2-CB 3.52Å; T78-V108 HydrophobicContact CG2-CG1 3.66Å; V108-M117 HydrophobicContact CG2-CB 4.46Å; V108-V118 CarbonylContact C-O 3.58Å; V108-V118 WeakPolarHBondContact CA-O 3.21Å; V108-T119 HydrophobicContact CB-CG2 4.44Å; V108-T119 HydrophobicContact CG2-CG2 4.18Å
109	N	97.3	Very high	95.6	Very high	14 Å²	14	33.3 Å²	33.3	8%	0.075	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	136.3	165.8	-163	10.3	0	0	0	111.3	Q67 M117 V118 R151 F152	Q67-N109 VanDerWaalsContact CD-OD1 3.27Å; Q67-N109 PolarHBondContact NE2-OD1 3.42Å; Q67-N109 PolarHBondContact OE1-OD1 3.43Å; N109-M117 CarbonylContact O-C 3.57Å; N109-M117 VanDerWaalsContact O-CA 3.23Å; N109-M117 WeakPolarHBondContact O-CA 3.49Å; N109-V118 HydrophobicContact CB-CG1 3.9Å; N109-V118 PolarHBondContact N-O 3.08Å; N109-V118 PolarHBondContact O-N 3.31Å; N109-R151 VanDerWaalsContact ND2-CA 3.33Å; N109-R151 WeakPolarHBondContact ND2-CA 3.38Å; N109-R151 WeakPolarHBondContact ND2-CD 3.37Å; N109-R151 PolarHBondContact OD1-NH1 3.3Å; N109-F152 HydrophobicContact CB-CD2 4.19Å; N109-F152 PolarHBondContact ND2-N 2.86Å; N109-F152 WeakPolarHBondContact O-CE2 3.49Å
110	F	96.7	Very high	95.7	Very high	9 Å²	9	25.3 Å²	25.3	4%	0.039	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	146.1	168.6	-74.4	-76.2	0	0	0	111.2	Q67 F68 A76 L86 M117 V131 F152	Q67-F110 HydrophobicContact CB-CD2 4.41Å; Q67-F110 HydrophobicContact CG-CD2 4.5Å; F68-F110 WeakPolarHBondContact O-CD2 3.38Å; A76-F110 HydrophobicContact CB-CE2 3.45Å; A76-F110 VanDerWaalsContact CB-CE2 3.45Å; A76-F110 HydrophobicContact CB-CZ 3.5Å; L86-F110 HydrophobicContact CD2-CZ 4.06Å; F110-M117 HydrophobicContact CD1-CB 3.99Å; F110-M117 HydrophobicContact CE1-CB 4.3Å; F110-M117 HydrophobicContact CE1-SD 4.47Å; F110-V131 HydrophobicContact CD1-CG2 3.89Å; F110-V131 HydrophobicContact CE1-CG1 4.18Å; F110-V131 HydrophobicContact CE1-CG2 3.7Å; F110-F152 WeakPolarHBondContact O-CD2 3.09Å
111	S	95.1	Very high	96	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.144	C	C	.	.			trans	-69.2	157.4	165.7	51.3	0	0	0	0	110.7	P70 D113 G114 T116 D156	P70-S111 VanDerWaalsContact CG-O 3.23Å; P70-S111 WeakPolarHBondContact CG-O 3.45Å; S111-D113 WeakPolarHBondContact CB-OD1 3.07Å; S111-D113 PolarHBondContact O-N 2.81Å; S111-D113 PolarHBondContact OG-OD1 3.12Å; S111-G114 WeakPolarHBondContact O-CA 3.39Å; S111-G114 PolarHBondContact O-N 3.42Å; S111-T116 WeakPolarHBondContact CB-OG1 3.29Å; S111-T116 PolarHBondContact N-O 3.37Å; S111-T116 WeakPolarHBondContact OG-CA 3.38Å; S111-T116 PolarHBondContact OG-N 3.01Å; S111-T116 PolarHBondContact OG-O 2.91Å; S111-T116 PolarHBondContact OG-OG1 3.22Å; S111-D156 WeakPolarHBondContact CB-OD1 3.32Å
112	C	91.3	Very high	96	Very high	74 Å²	74	25.7 Å²	25.7	50%	0.5	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-29.3	-178.9	-63.9	0	0	0	0	113.5	P70 G114 P154	P70-C112 WeakPolarHBondContact CG-O 3.4Å; C112-G114 VanDerWaalsContact C-N 3.3Å; C112-P154 PolarHBondContact SG-O 2.92Å; C112-P154 VanDerWaalsContact SG-O 3.33Å
113	D	91.1	Very high	96	Very high	88 Å²	88	22.6 Å²	22.6	47%	0.471	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-10.6	174.6	70.8	-4.7	0	0	0	113.9	S111 Q115	S111-D113 WeakPolarHBondContact CB-OD1 3.07Å; S111-D113 PolarHBondContact O-N 2.81Å; S111-D113 PolarHBondContact OG-OD1 3.12Å; D113-Q115 HydrophobicContact CB-CG 4.31Å; D113-Q115 PolarHBondContact O-N 2.92Å; D113-Q115 PolarHBondContact OD1-N 3.4Å; D113-Q115 WeakPolarHBondContact OD2-CB 3.46Å
114	G	92.1	Very high	96	Very high	16 Å²	16	25.9 Å²	25.9	17%	0.165	14%	0.137	C	C	.	.	S	Bend	trans	67	7.6	-175.7	0	0	0	0	0	115.4	S111 C112 V131	S111-G114 WeakPolarHBondContact O-CA 3.39Å; S111-G114 PolarHBondContact O-N 3.42Å; C112-G114 VanDerWaalsContact C-N 3.3Å; G114-V131 WeakPolarHBondContact O-CG2 3.23Å
115	Q	93.8	Very high	96	Very high	107 Å²	107	25.9 Å²	25.9	50%	0.5	14%	0.137	S	C	.	.	S	Bend	trans	-87.5	-29.6	-177.9	-61.3	-58.5	-33.7	0	0	112.6	D113 V131	D113-Q115 HydrophobicContact CB-CG 4.31Å; D113-Q115 PolarHBondContact O-N 2.92Å; D113-Q115 PolarHBondContact OD1-N 3.4Å; D113-Q115 WeakPolarHBondContact OD2-CB 3.46Å; Q115-V131 PolarHBondContact O-N 3.45Å
116	T	95.6	Very high	96	Very high	16 Å²	16	26 Å²	26	10%	0.098	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	158.3	178.9	64.4	0	0	0	0	111.8	S111 W129 L137 K173	S111-T116 WeakPolarHBondContact CB-OG1 3.29Å; S111-T116 PolarHBondContact N-O 3.37Å; S111-T116 WeakPolarHBondContact OG-CA 3.38Å; S111-T116 PolarHBondContact OG-N 3.01Å; S111-T116 PolarHBondContact OG-O 2.91Å; S111-T116 PolarHBondContact OG-OG1 3.22Å; T116-W129 CarbonylContact C-O 3.52Å; T116-W129 VanDerWaalsContact CA-O 3.24Å; T116-W129 WeakPolarHBondContact CA-O 3.45Å; T116-L137 HydrophobicContact CG2-CD1 4.25Å; T116-K173 PolarHBondContact OG1-NZ 2.9Å; T116-K173 VanDerWaalsContact OG1-NZ 3.11Å
117	M	96.4	Very high	96	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.8	171.9	64.6	-178.4	166	0	0	109.8	L86 F98 V108 N109 F110 W129 V131	L86-M117 HydrophobicContact CD2-SD 4.19Å; F98-M117 HydrophobicContact CE1-CE 3.62Å; F98-M117 HydrophobicContact CE2-CE 4.22Å; F98-M117 HydrophobicContact CZ-CE 3.22Å; F98-M117 HydrophobicContact CZ-SD 4.42Å; V108-M117 HydrophobicContact CG2-CB 4.46Å; N109-M117 CarbonylContact O-C 3.57Å; N109-M117 VanDerWaalsContact O-CA 3.23Å; N109-M117 WeakPolarHBondContact O-CA 3.49Å; F110-M117 HydrophobicContact CD1-CB 3.99Å; F110-M117 HydrophobicContact CE1-CB 4.3Å; F110-M117 HydrophobicContact CE1-SD 4.47Å; M117-W129 HydrophobicContact CE-CB 3.58Å; M117-W129 HydrophobicContact CE-CG 4.1Å; M117-W129 HydrophobicContact CG-CB 3.82Å; M117-W129 HydrophobicContact CG-CG 4.48Å; M117-W129 PolarHBondContact N-O 2.99Å; M117-W129 PolarHBondContact O-N 3.26Å; M117-V131 HydrophobicContact CB-CG2 4.22Å; M117-V131 HydrophobicContact CG-CG2 4.22Å; M117-V131 HydrophobicContact SD-CG2 4.42Å
118	V	97.3	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.4	176.8	68.5	0	0	0	0	109.4	V108 N109 I126 K127 L128 V150 F152 I159	V108-V118 CarbonylContact C-O 3.58Å; V108-V118 WeakPolarHBondContact CA-O 3.21Å; N109-V118 HydrophobicContact CB-CG1 3.9Å; N109-V118 PolarHBondContact N-O 3.08Å; N109-V118 PolarHBondContact O-N 3.31Å; V118-I126 HydrophobicContact CG2-CG2 3.29Å; V118-K127 CarbonylContact C-O 3.53Å; V118-K127 WeakPolarHBondContact CA-O 3.42Å; V118-L128 HydrophobicContact CB-CD1 4.16Å; V118-V150 HydrophobicContact CB-CG2 4.36Å; V118-V150 HydrophobicContact CG1-CB 4.43Å; V118-V150 HydrophobicContact CG1-CG1 3.9Å; V118-V150 HydrophobicContact CG1-CG2 3.73Å; V118-V150 HydrophobicContact CG2-CG1 4.28Å; V118-V150 HydrophobicContact CG2-CG2 3.67Å; V118-F152 HydrophobicContact CB-CD2 4.49Å; V118-F152 HydrophobicContact CB-CE1 4.49Å; V118-F152 HydrophobicContact CB-CE2 3.71Å; V118-F152 HydrophobicContact CB-CZ 3.71Å; V118-F152 HydrophobicContact CG1-CD2 3.77Å; V118-F152 HydrophobicContact CG1-CE2 3.44Å; V118-F152 VanDerWaalsContact CG1-CE2 3.44Å; V118-F152 HydrophobicContact CG1-CG 4.48Å; V118-F152 HydrophobicContact CG1-CZ 3.88Å; V118-I159 HydrophobicContact CG2-CD1 4.48Å; V118-I159 HydrophobicContact CG2-CG2 4.39Å
119	T	97.8	Very high	96	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140	180	58.8	0	0	0	0	110.2	V84 H101 C107 V108 I126 K127 W129	V84-T119 HydrophobicContact CG2-CG2 3.86Å; H101-T119 PolarHBondContact CD2-OG1 2.84Å; H101-T119 PolarHBondContact NE2-O 2.97Å; H101-T119 PolarHBondContact NE2-OG1 3.15Å; C107-T119 WeakPolarHBondContact O-CA 3.45Å; V108-T119 HydrophobicContact CB-CG2 4.44Å; V108-T119 HydrophobicContact CG2-CG2 4.18Å; T119-I126 CarbonylContact O-C 3.58Å; T119-I126 VanDerWaalsContact O-CA 3.31Å; T119-I126 WeakPolarHBondContact O-CA 3.42Å; T119-K127 PolarHBondContact N-O 2.86Å; T119-K127 PolarHBondContact O-N 3.37Å; T119-K127 PolarHBondContact OG1-O 3.16Å; T119-W129 PolarHBondContact OG1-NE1 2.87Å
120	S	97.4	Very high	95.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.5	174.5	69.7	0	0	0	0	111.6	V105 R106 C107 V147	V105-S120 CarbonylContact C-O 3.56Å; V105-S120 WeakPolarHBondContact CA-O 3.21Å; V105-S120 WeakPolarHBondContact CG1-O 3.5Å; R106-S120 PolarHBondContact N-O 2.8Å; C107-S120 WeakPolarHBondContact CB-OG 3.45Å; C107-S120 PolarHBondContact N-OG 2.98Å; C107-S120 PolarHBondContact O-N 3.27Å; S120-V147 PolarHBondContact OG-O 2.88Å
121	S	97.7	Very high	95.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.6	-170.7	170.5	0	0	0	0	113.7	H101 T104 D123 K124 T125 V147	H101-S121 WeakPolarHBondContact CB-OG 3.4Å; H101-S121 WeakPolarHBondContact ND1-CB 3.17Å; T104-S121 CarbonylContact O-C 3.44Å; T104-S121 WeakPolarHBondContact O-CA 3.4Å; T104-S121 WeakPolarHBondContact O-CB 3.45Å; T104-S121 PolarHBondContact O-OG 3.26Å; S121-D123 VanDerWaalsContact CB-OD1 3.28Å; S121-D123 WeakPolarHBondContact CB-OD1 3.44Å; S121-D123 PolarHBondContact O-N 2.93Å; S121-D123 PolarHBondContact OG-N 3.2Å; S121-D123 PolarHBondContact OG-OD1 3.45Å; S121-D123 PolarHBondContact OG-OD2 3Å; S121-K124 PolarHBondContact O-N 3.48Å; S121-T125 PolarHBondContact N-O 2.93Å; S121-V147 PolarHBondContact O-N 3.18Å; S121-V147 VanDerWaalsContact O-N 3.13Å
122	D	97.4	Very high	95.5	Very high	15 Å²	15	34.6 Å²	34.6	8%	0.08	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-8.6	168.9	-71.2	0.4	0	0	0	112.4	A103 T104 R106 K124 W146	A103-D122 HydrophobicContact CB-CB 3.93Å; T104-D122 PolarHBondContact O-N 3.37Å; T104-D122 PolarHBondContact OG1-OD1 3.16Å; T104-D122 PolarHBondContact OG1-OD2 2.9Å; R106-D122 WeakPolarHBondContact CG-OD1 3.44Å; R106-D122 IonicContact CZ-OD1 3.54Å; R106-D122 IonicContact CZ-OD2 2.83Å; R106-D122 IonicContact NE-OD1 3.61Å; R106-D122 PolarHBondContact NE-OD1 3.02Å; R106-D122 IonicContact NE-OD2 3.44Å; R106-D122 PolarHBondContact NE-OD2 2.97Å; R106-D122 IonicContact NH2-OD1 2.9Å; R106-D122 PolarHBondContact NH2-OD1 2.82Å; R106-D122 IonicContact NH2-OD2 3.6Å; R106-D122 PolarHBondContact NH2-OD2 2.78Å; D122-K124 PolarHBondContact O-N 2.58Å; D122-K124 VanDerWaalsContact O-N 3.17Å; D122-W146 HydrophobicContact CB-CB 4.34Å; D122-W146 HydrophobicContact CB-CD2 4.11Å; D122-W146 HydrophobicContact CB-CG 3.79Å; D122-W146 PolarHBondContact O-NE1 3.41Å
123	D	96.6	Very high	95.2	Very high	30 Å²	30	39.1 Å²	39.1	16%	0.16	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	7.7	171.2	70.4	12.3	0	0	0	113.2	H101 T102 A103 S121 T125	H101-D123 VanDerWaalsContact CB-OD2 3.23Å; H101-D123 WeakPolarHBondContact CB-OD2 3.3Å; H101-D123 IonicContact CE1-OD1 2.91Å; H101-D123 IonicContact CE1-OD2 4Å; H101-D123 IonicContact CG-OD2 3.5Å; H101-D123 IonicContact ND1-OD1 3.65Å; H101-D123 PolarHBondContact ND1-OD1 3.27Å; H101-D123 IonicContact ND1-OD2 2.79Å; H101-D123 PolarHBondContact ND1-OD2 2.9Å; T102-D123 PolarHBondContact N-OD2 2.79Å; T102-D123 VanDerWaalsContact OG1-CB 3.23Å; T102-D123 WeakPolarHBondContact OG1-CB 3.3Å; T102-D123 PolarHBondContact OG1-OD2 2.87Å; A103-D123 HydrophobicContact CB-CB 3.95Å; S121-D123 VanDerWaalsContact CB-OD1 3.28Å; S121-D123 WeakPolarHBondContact CB-OD1 3.44Å; S121-D123 PolarHBondContact O-N 2.93Å; S121-D123 PolarHBondContact OG-N 3.2Å; S121-D123 PolarHBondContact OG-OD1 3.45Å; S121-D123 PolarHBondContact OG-OD2 3Å; D123-T125 VanDerWaalsContact CG-OG1 3.25Å; D123-T125 PolarHBondContact O-N 3.38Å; D123-T125 WeakPolarHBondContact OD1-CA 3.5Å; D123-T125 WeakPolarHBondContact OD1-CB 3.3Å; D123-T125 PolarHBondContact OD1-N 3.27Å; D123-T125 PolarHBondContact OD1-OG1 2.79Å; D123-T125 PolarHBondContact OD2-OG1 3.21Å
124	K	96.6	Very high	95.3	Very high	94 Å²	94	37.4 Å²	37.4	41%	0.409	18%	0.176	S	C	.	.	S	Bend	trans	68.7	9.3	178.5	-41.9	177.2	177.6	-166.1	0	113.5	S121 D122 M144 N145	S121-K124 PolarHBondContact O-N 3.48Å; D122-K124 PolarHBondContact O-N 2.58Å; D122-K124 VanDerWaalsContact O-N 3.17Å; K124-M144 WeakPolarHBondContact CD-O 3.42Å; K124-M144 WeakPolarHBondContact CE-O 3.34Å; K124-M144 PolarHBondContact NZ-O 3.48Å; K124-N145 WeakPolarHBondContact CB-O 3.27Å; K124-N145 WeakPolarHBondContact CG-O 3.24Å
125	T	96.8	Very high	95.3	Very high	25 Å²	25	42.1 Å²	42.1	15%	0.153	19%	0.192	C	C	.	.			trans	-112.4	152.4	-179.6	74.5	0	0	0	0	112	H101 S121 D123 F140	H101-T125 PolarHBondContact CE1-O 3.03Å; H101-T125 PolarHBondContact ND1-OG1 3.01Å; S121-T125 PolarHBondContact N-O 2.93Å; D123-T125 VanDerWaalsContact CG-OG1 3.25Å; D123-T125 PolarHBondContact O-N 3.38Å; D123-T125 WeakPolarHBondContact OD1-CA 3.5Å; D123-T125 WeakPolarHBondContact OD1-CB 3.3Å; D123-T125 PolarHBondContact OD1-N 3.27Å; D123-T125 PolarHBondContact OD1-OG1 2.79Å; D123-T125 PolarHBondContact OD2-OG1 3.21Å; T125-F140 VanDerWaalsContact CA-O 3.3Å; T125-F140 WeakPolarHBondContact CA-O 3.3Å
126	I	97.7	Very high	95.5	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132	168.1	-59.9	152.7	0	0	0	106.4	V118 T119 S139 F140 V147 V150 S161 W171	V118-I126 HydrophobicContact CG2-CG2 3.29Å; T119-I126 CarbonylContact O-C 3.58Å; T119-I126 VanDerWaalsContact O-CA 3.31Å; T119-I126 WeakPolarHBondContact O-CA 3.42Å; I126-S139 CarbonylContact O-C 3.59Å; I126-S139 WeakPolarHBondContact O-CA 3.36Å; I126-F140 HydrophobicContact CB-CB 4.22Å; I126-F140 HydrophobicContact CB-CD2 4.17Å; I126-F140 HydrophobicContact CD1-CB 4.49Å; I126-F140 HydrophobicContact CG2-CD2 4.09Å; I126-F140 PolarHBondContact N-O 2.96Å; I126-F140 PolarHBondContact O-N 2.9Å; I126-V147 HydrophobicContact CD1-CG1 4.23Å; I126-V147 HydrophobicContact CG1-CG1 3.93Å; I126-V147 HydrophobicContact CG1-CG2 4.37Å; I126-V150 HydrophobicContact CG2-CG2 3.87Å; I126-S161 VanDerWaalsContact CD1-OG 3.22Å; I126-S161 WeakPolarHBondContact CD1-OG 3.47Å; I126-W171 HydrophobicContact CD1-CZ2 4.17Å
127	K	97.4	Very high	95.4	Very high	39 Å²	39	44.7 Å²	44.7	17%	0.17	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.8	-178.2	-67.5	-175.6	-177.9	-174.3	0	111.2	A100 H101 V118 T119 W129 F136	A100-K127 VanDerWaalsContact O-CD 3.32Å; A100-K127 WeakPolarHBondContact O-CD 3.32Å; A100-K127 PolarHBondContact O-NZ 2.93Å; H101-K127 VanDerWaalsContact CE1-CG 3.44Å; H101-K127 WeakPolarHBondContact CE1-CG 3.16Å; V118-K127 CarbonylContact C-O 3.53Å; V118-K127 WeakPolarHBondContact CA-O 3.42Å; T119-K127 PolarHBondContact N-O 2.86Å; T119-K127 PolarHBondContact O-N 3.37Å; T119-K127 PolarHBondContact OG1-O 3.16Å; K127-W129 HydrophobicContact CB-CZ2 4Å; K127-W129 HydrophobicContact CD-CZ2 3.69Å; K127-F136 HydrophobicContact CB-CD2 4.41Å; K127-F136 HydrophobicContact CB-CE2 4.07Å; K127-F136 HydrophobicContact CD-CD2 4.31Å; K127-F136 HydrophobicContact CD-CE2 3.96Å; K127-F136 HydrophobicContact CG-CE2 3.91Å
128	L	96.8	Very high	95.4	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	137.3	175.4	-169.1	76.9	0	0	0	110.4	V118 L137 F138 F152	V118-L128 HydrophobicContact CB-CD1 4.16Å; L128-L137 HydrophobicContact CB-CB 4.41Å; L128-L137 HydrophobicContact CD2-CB 4.32Å; L128-L137 HydrophobicContact CD2-CD1 3.75Å; L128-L137 HydrophobicContact CG-CB 4.5Å; L128-L137 HydrophobicContact CG-CD1 4.05Å; L128-L137 PolarHBondContact O-N 2.99Å; L128-F138 HydrophobicContact CB-CD2 4.4Å; L128-F138 HydrophobicContact CB-CE2 4.21Å; L128-F138 HydrophobicContact CB-CZ 4.34Å; L128-F138 HydrophobicContact CD2-CD1 4.23Å; L128-F138 HydrophobicContact CD2-CE1 3.44Å; L128-F138 VanDerWaalsContact CD2-CE1 3.44Å; L128-F138 HydrophobicContact CD2-CE2 4.03Å; L128-F138 HydrophobicContact CD2-CZ 3.33Å; L128-F138 HydrophobicContact CG-CZ 4.42Å; L128-F138 PolarHBondContact N-O 2.83Å; L128-F152 HydrophobicContact CD1-CE1 3.98Å; L128-F152 HydrophobicContact CD1-CZ 3.46Å; L128-F152 VanDerWaalsContact CD1-CZ 3.46Å
129	W	96.8	Very high	95.3	Very high	18 Å²	18	49.3 Å²	49.3	7%	0.068	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.9	-175.5	-52.3	85.3	0	0	0	111.8	F98 A100 T116 M117 T119 K127 K135 F136	F98-W129 HydrophobicContact CD2-CE3 4.12Å; F98-W129 HydrophobicContact CD2-CH2 4.35Å; F98-W129 AromaticContact CD2-CZ3 3.99Å; F98-W129 HydrophobicContact CD2-CZ3 3.99Å; F98-W129 AromaticContact CE2-CD2 3.75Å; F98-W129 HydrophobicContact CE2-CD2 3.75Å; F98-W129 AromaticContact CE2-CE2 4Å; F98-W129 AromaticContact CE2-CE3 3.7Å; F98-W129 HydrophobicContact CE2-CE3 3.7Å; F98-W129 HydrophobicContact CE2-CG 4.31Å; F98-W129 HydrophobicContact CE2-CH2 4.24Å; F98-W129 HydrophobicContact CE2-CZ2 4.27Å; F98-W129 AromaticContact CE2-CZ3 3.95Å; F98-W129 HydrophobicContact CE2-CZ3 3.95Å; F98-W129 HydrophobicContact CZ-CD2 4.45Å; A100-W129 VanDerWaalsContact CA-CZ2 3.44Å; A100-W129 HydrophobicContact CB-CH2 4.33Å; A100-W129 HydrophobicContact CB-CZ2 3.67Å; A100-W129 VanDerWaalsContact O-CZ2 3.31Å; A100-W129 WeakPolarHBondContact O-CZ2 3.38Å; T116-W129 CarbonylContact C-O 3.52Å; T116-W129 VanDerWaalsContact CA-O 3.24Å; T116-W129 WeakPolarHBondContact CA-O 3.45Å; M117-W129 HydrophobicContact CE-CB 3.58Å; M117-W129 HydrophobicContact CE-CG 4.1Å; M117-W129 HydrophobicContact CG-CB 3.82Å; M117-W129 HydrophobicContact CG-CG 4.48Å; M117-W129 PolarHBondContact N-O 2.99Å; M117-W129 PolarHBondContact O-N 3.26Å; T119-W129 PolarHBondContact OG1-NE1 2.87Å; K127-W129 HydrophobicContact CB-CZ2 4Å; K127-W129 HydrophobicContact CD-CZ2 3.69Å; W129-K135 CarbonylContact C-O 3.58Å; W129-K135 VanDerWaalsContact CA-O 3.3Å; W129-K135 WeakPolarHBondContact CA-O 3.4Å; W129-F136 HydrophobicContact CE3-CB 3.9Å; W129-F136 HydrophobicContact CH2-CB 4.08Å; W129-F136 HydrophobicContact CH2-CD2 4.08Å; W129-F136 HydrophobicContact CH2-CG 4.49Å; W129-F136 HydrophobicContact CZ2-CD2 4.11Å; W129-F136 HydrophobicContact CZ3-CB 3.58Å; W129-F136 HydrophobicContact CZ3-CD2 4.32Å; W129-F136 HydrophobicContact CZ3-CG 4.43Å
130	T	96	Very high	95.2	Very high	38 Å²	38	49.7 Å²	49.7	23%	0.233	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132.9	165.2	-52.7	0	0	0	0	110.3	Q134 K135	T130-Q134 WeakPolarHBondContact O-CA 3.42Å; T130-Q134 PolarHBondContact O-N 3.33Å; T130-K135 PolarHBondContact N-O 3.27Å; T130-K135 PolarHBondContact O-N 2.79Å
131	V	93.8	Very high	95.1	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.055	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-49.6	-175.4	179.3	0	0	0	0	112.2	L74 L86 F110 G114 Q115 M117 R133 Q134	L74-V131 HydrophobicContact CD1-CG1 3.74Å; L86-V131 HydrophobicContact CD1-CG1 4.16Å; F110-V131 HydrophobicContact CD1-CG2 3.89Å; F110-V131 HydrophobicContact CE1-CG1 4.18Å; F110-V131 HydrophobicContact CE1-CG2 3.7Å; G114-V131 WeakPolarHBondContact O-CG2 3.23Å; Q115-V131 PolarHBondContact O-N 3.45Å; M117-V131 HydrophobicContact CB-CG2 4.22Å; M117-V131 HydrophobicContact CG-CG2 4.22Å; M117-V131 HydrophobicContact SD-CG2 4.42Å; V131-R133 VanDerWaalsContact C-N 3.27Å; V131-R133 PolarHBondContact O-N 2.7Å; V131-Q134 PolarHBondContact O-N 2.98Å
132	H	88.3	Confident	94.9	Very high	155 Å²	155	58.3 Å²	58.3	72%	0.718	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.7	-172.7	-176	63.7	0	0	0	114.4
133	R	86.7	Confident	94.9	Very high	169 Å²	169	58 Å²	58	64%	0.638	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.5	0.3	-178.1	-65.6	-175.9	173.1	-169.5	-6.8	114.2	V131 K135	V131-R133 VanDerWaalsContact C-N 3.27Å; V131-R133 PolarHBondContact O-N 2.7Å; R133-K135 HydrophobicContact CB-CD 4.14Å; R133-K135 HydrophobicContact CB-CG 3.84Å; R133-K135 PolarHBondContact O-N 3.1Å; R133-K135 VanDerWaalsContact O-N 3.11Å
134	Q	91.9	Very high	94.8	Very high	51 Å²	51	63.7 Å²	63.7	24%	0.238	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	35.2	-176.5	-63.2	158.9	42.3	0	0	112.5	L86 T96 F98 T130 V131	L86-Q134 HydrophobicContact CD1-CG 4.12Å; T96-Q134 VanDerWaalsContact CB-NE2 3.28Å; T96-Q134 PolarHBondContact OG1-NE2 3.44Å; F98-Q134 HydrophobicContact CD1-CB 3.95Å; F98-Q134 HydrophobicContact CD1-CG 3.75Å; F98-Q134 VanDerWaalsContact CD1-OE1 3.29Å; F98-Q134 HydrophobicContact CE1-CB 4.36Å; F98-Q134 HydrophobicContact CE1-CG 3.99Å; F98-Q134 HydrophobicContact CG-CB 4.15Å; F98-Q134 HydrophobicContact CG-CG 4.45Å; T130-Q134 WeakPolarHBondContact O-CA 3.42Å; T130-Q134 PolarHBondContact O-N 3.33Å; V131-Q134 PolarHBondContact O-N 2.98Å
135	K	93.4	Very high	94.8	Very high	116 Å²	116	61.9 Å²	61.9	50%	0.504	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	133	-178.2	-73.8	-171.9	175.9	-164.7	0	109.9	W129 T130 R133	W129-K135 CarbonylContact C-O 3.58Å; W129-K135 VanDerWaalsContact CA-O 3.3Å; W129-K135 WeakPolarHBondContact CA-O 3.4Å; T130-K135 PolarHBondContact N-O 3.27Å; T130-K135 PolarHBondContact O-N 2.79Å; R133-K135 HydrophobicContact CB-CD 4.14Å; R133-K135 HydrophobicContact CB-CG 3.84Å; R133-K135 PolarHBondContact O-N 3.1Å; R133-K135 VanDerWaalsContact O-N 3.11Å
136	F	96.4	Very high	94.8	Very high	97 Å²	97	66 Å²	66	43%	0.425	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	134.9	169	175.4	-107.4	0	0	0	110.1	K127 W129 F138	K127-F136 HydrophobicContact CB-CD2 4.41Å; K127-F136 HydrophobicContact CB-CE2 4.07Å; K127-F136 HydrophobicContact CD-CD2 4.31Å; K127-F136 HydrophobicContact CD-CE2 3.96Å; K127-F136 HydrophobicContact CG-CE2 3.91Å; W129-F136 HydrophobicContact CE3-CB 3.9Å; W129-F136 HydrophobicContact CH2-CB 4.08Å; W129-F136 HydrophobicContact CH2-CD2 4.08Å; W129-F136 HydrophobicContact CH2-CG 4.49Å; W129-F136 HydrophobicContact CZ2-CD2 4.11Å; W129-F136 HydrophobicContact CZ3-CB 3.58Å; W129-F136 HydrophobicContact CZ3-CD2 4.32Å; W129-F136 HydrophobicContact CZ3-CG 4.43Å; F136-F138 VanDerWaalsContact CE2-C 3.47Å; F136-F138 WeakPolarHBondContact CE2-O 3.26Å; F136-F138 VanDerWaalsContact CZ-CA 3.49Å
137	L	94.6	Very high	94.7	Very high	79 Å²	79	65.9 Å²	65.9	41%	0.414	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-66.3	175.9	-65.4	176.9	0	0	0	110.9	T116 L128	T116-L137 HydrophobicContact CG2-CD1 4.25Å; L128-L137 HydrophobicContact CB-CB 4.41Å; L128-L137 HydrophobicContact CD2-CB 4.32Å; L128-L137 HydrophobicContact CD2-CD1 3.75Å; L128-L137 HydrophobicContact CG-CB 4.5Å; L128-L137 HydrophobicContact CG-CD1 4.05Å; L128-L137 PolarHBondContact O-N 2.99Å
138	F	95.5	Very high	94.6	Very high	42 Å²	42	66.5 Å²	66.5	18%	0.184	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	170.8	178.4	55.4	-96.8	0	0	0	111	L128 F136 F140 K173 R176	L128-F138 HydrophobicContact CB-CD2 4.4Å; L128-F138 HydrophobicContact CB-CE2 4.21Å; L128-F138 HydrophobicContact CB-CZ 4.34Å; L128-F138 HydrophobicContact CD2-CD1 4.23Å; L128-F138 HydrophobicContact CD2-CE1 3.44Å; L128-F138 VanDerWaalsContact CD2-CE1 3.44Å; L128-F138 HydrophobicContact CD2-CE2 4.03Å; L128-F138 HydrophobicContact CD2-CZ 3.33Å; L128-F138 HydrophobicContact CG-CZ 4.42Å; L128-F138 PolarHBondContact N-O 2.83Å; F136-F138 VanDerWaalsContact CE2-C 3.47Å; F136-F138 WeakPolarHBondContact CE2-O 3.26Å; F136-F138 VanDerWaalsContact CZ-CA 3.49Å; F138-F140 HydrophobicContact CD2-CE2 4.27Å; F138-F140 HydrophobicContact CD2-CZ 4.22Å; F138-F140 HydrophobicContact CE2-CE1 4.25Å; F138-F140 AromaticContact CE2-CE2 3.72Å; F138-F140 HydrophobicContact CE2-CE2 3.72Å; F138-F140 AromaticContact CE2-CZ 3.53Å; F138-F140 HydrophobicContact CE2-CZ 3.53Å; F138-K173 HydrophobicContact CZ-CG 4.34Å; F138-K173 WeakPolarHBondContact CZ-O 3.3Å; F138-R176 HydrophobicContact CD1-CG 4.44Å; F138-R176 HydrophobicContact CD2-CG 4.1Å; F138-R176 HydrophobicContact CE1-CG 4.26Å; F138-R176 HydrophobicContact CE2-CG 3.92Å; F138-R176 HydrophobicContact CG-CG 4.35Å; F138-R176 HydrophobicContact CZ-CG 3.98Å
139	S	95.9	Very high	94.6	Very high	56 Å²	56	66.4 Å²	66.4	39%	0.392	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.5	-178.7	59	0	0	0	0	112.3	I126	I126-S139 CarbonylContact O-C 3.59Å; I126-S139 WeakPolarHBondContact O-CA 3.36Å
140	F	96.4	Very high	94.7	Very high	7 Å²	7	65.6 Å²	65.6	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	131.8	168.3	-55.2	-78.4	0	0	0	109.9	T125 I126 F138 I159 W171 R176	T125-F140 VanDerWaalsContact CA-O 3.3Å; T125-F140 WeakPolarHBondContact CA-O 3.3Å; I126-F140 HydrophobicContact CB-CB 4.22Å; I126-F140 HydrophobicContact CB-CD2 4.17Å; I126-F140 HydrophobicContact CD1-CB 4.49Å; I126-F140 HydrophobicContact CG2-CD2 4.09Å; I126-F140 PolarHBondContact N-O 2.96Å; I126-F140 PolarHBondContact O-N 2.9Å; F138-F140 HydrophobicContact CD2-CE2 4.27Å; F138-F140 HydrophobicContact CD2-CZ 4.22Å; F138-F140 HydrophobicContact CE2-CE1 4.25Å; F138-F140 AromaticContact CE2-CE2 3.72Å; F138-F140 HydrophobicContact CE2-CE2 3.72Å; F138-F140 AromaticContact CE2-CZ 3.53Å; F138-F140 HydrophobicContact CE2-CZ 3.53Å; F140-I159 HydrophobicContact CE2-CD1 3.82Å; F140-I159 HydrophobicContact CZ-CD1 4.31Å; F140-W171 HydrophobicContact CB-CD2 4.16Å; F140-W171 HydrophobicContact CB-CE3 3.9Å; F140-W171 HydrophobicContact CB-CH2 3.79Å; F140-W171 HydrophobicContact CB-CZ2 4.1Å; F140-W171 HydrophobicContact CB-CZ3 3.71Å; F140-W171 HydrophobicContact CD1-CB 4.47Å; F140-W171 AromaticContact CD1-CD2 3.87Å; F140-W171 HydrophobicContact CD1-CD2 3.87Å; F140-W171 AromaticContact CD1-CE3 3.26Å; F140-W171 HydrophobicContact CD1-CE3 3.26Å; F140-W171 HydrophobicContact CD1-CG 4.39Å; F140-W171 AromaticContact CD1-CZ3 3.69Å; F140-W171 HydrophobicContact CD1-CZ3 3.69Å; F140-W171 HydrophobicContact CE1-CB 4.01Å; F140-W171 HydrophobicContact CE1-CD2 4.28Å; F140-W171 AromaticContact CE1-CE3 3.81Å; F140-W171 HydrophobicContact CE1-CE3 3.81Å; F140-W171 HydrophobicContact CE1-CG 4.41Å; F140-W171 HydrophobicContact CE2-CB 4.4Å; F140-W171 AromaticContact CG-CD2 3.96Å; F140-W171 HydrophobicContact CG-CD2 3.96Å; F140-W171 AromaticContact CG-CE3 3.74Å; F140-W171 HydrophobicContact CG-CE3 3.74Å; F140-W171 HydrophobicContact CG-CG 4.44Å; F140-W171 HydrophobicContact CG-CZ3 4.03Å; F140-W171 HydrophobicContact CZ-CB 3.96Å; F140-R176 HydrophobicContact CE1-CB 4.2Å
141	S	94	Very high	94.7	Very high	89 Å²	89	64.7 Å²	64.7	62%	0.622	31%	0.306	S	S	*	.			trans	-138.8	44.6	-172	64.1	0	0	0	0	113.1
142	Q	94.8	Very high	94.9	Very high	93 Å²	93	64.7 Å²	64.7	44%	0.435	31%	0.305	S	S	.	.			trans	-105	-4.8	176.2	-47.6	179.2	-6.7	0	0	114.1	K169 W171	Q142-K169 HydrophobicContact CB-CD 4.5Å; Q142-W171 HydrophobicContact CB-CH2 3.58Å; Q142-W171 HydrophobicContact CB-CZ3 4.25Å; Q142-W171 HydrophobicContact CG-CH2 3.61Å; Q142-W171 HydrophobicContact CG-CZ3 3.76Å
143	H	95.6	Very high	95.2	Very high	9 Å²	9	57.4 Å²	57.4	4%	0.042	27%	0.272	C	S	.	.			trans	-72.8	141.6	173	-82	-65	0	0	0	110.4	V147 S161 S163 D165 T167	H143-V147 HydrophobicContact CB-CG2 3.81Å; H143-S161 PolarHBondContact NE2-OG 3.01Å; H143-S163 WeakPolarHBondContact ND1-CB 3.42Å; H143-D165 WeakPolarHBondContact CA-OD2 3.38Å; H143-D165 IonicContact CG-OD2 3.56Å; H143-D165 IonicContact ND1-OD1 3.61Å; H143-D165 IonicContact ND1-OD2 3.5Å; H143-D165 PolarHBondContact ND1-OD2 2.92Å; H143-T167 PolarHBondContact ND1-OG1 3.3Å
144	M	95.3	Very high	95.5	Very high	148 Å²	148	52 Å²	52	73%	0.729	26%	0.258	S	S	*	.	S	Bend	trans	-92	-16.2	-176.5	-62.6	-59.6	-71.7	0	0	112.3	K124 D165	K124-M144 WeakPolarHBondContact CD-O 3.42Å; K124-M144 WeakPolarHBondContact CE-O 3.34Å; K124-M144 PolarHBondContact NZ-O 3.48Å; M144-D165 HydrophobicContact CB-CB 4.17Å; M144-D165 PolarHBondContact N-OD2 3.4Å
145	N	95.9	Very high	95.5	Very high	57 Å²	57	55.1 Å²	55.1	31%	0.305	28%	0.276	S	S	.	.	S	Bend	trans	-138.7	-173	-179.8	-151.7	-4	0	0	0	111.9	K124 S163 D164 D165	K124-N145 WeakPolarHBondContact CB-O 3.27Å; K124-N145 WeakPolarHBondContact CG-O 3.24Å; N145-S163 PolarHBondContact O-OG 3.38Å; N145-D164 HydrophobicContact CB-CB 4.15Å; N145-D165 HydrophobicContact CB-CB 3.91Å
146	W	96.5	Very high	95.4	Very high	110 Å²	110	51 Å²	51	42%	0.417	26%	0.26	S	S	.	.			trans	-58.7	131.2	-176.3	-62.2	-12.9	0	0	0	113	D122 S163 D164	D122-W146 HydrophobicContact CB-CB 4.34Å; D122-W146 HydrophobicContact CB-CD2 4.11Å; D122-W146 HydrophobicContact CB-CG 3.79Å; D122-W146 PolarHBondContact O-NE1 3.41Å; W146-S163 CarbonylContact O-C 3.54Å; W146-S163 VanDerWaalsContact O-CA 3.23Å; W146-S163 WeakPolarHBondContact O-CA 3.41Å; W146-S163 PolarHBondContact O-OG 2.99Å; W146-D164 HydrophobicContact CB-CB 4.45Å; W146-D164 PolarHBondContact O-N 3.49Å
147	V	97.4	Very high	95.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.3	179.2	-170.6	0	0	0	0	109.7	S120 S121 I126 H143 C162	S120-V147 PolarHBondContact OG-O 2.88Å; S121-V147 PolarHBondContact O-N 3.18Å; S121-V147 VanDerWaalsContact O-N 3.13Å; I126-V147 HydrophobicContact CD1-CG1 4.23Å; I126-V147 HydrophobicContact CG1-CG1 3.93Å; I126-V147 HydrophobicContact CG1-CG2 4.37Å; H143-V147 HydrophobicContact CB-CG2 3.81Å; V147-C162 CarbonylContact C-O 3.56Å; V147-C162 WeakPolarHBondContact CA-O 3.41Å; V147-C162 VanDerWaalsContact CG1-O 3.32Å; V147-C162 WeakPolarHBondContact CG1-O 3.43Å
148	R	95.6	Very high	95.3	Very high	51 Å²	51	45 Å²	45	19%	0.192	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	-49.8	-172.7	-68.4	-69.3	-154.4	-142.1	-1	112.9	R106 C162 D164 S190	R106-R148 VanDerWaalsContact CB-O 3.24Å; R106-R148 WeakPolarHBondContact CB-O 3.28Å; R148-C162 PolarHBondContact N-O 2.99Å; R148-D164 VanDerWaalsContact CG-OD1 3.29Å; R148-D164 WeakPolarHBondContact CG-OD1 3.23Å; R148-D164 VanDerWaalsContact CZ-CG 3.48Å; R148-D164 IonicContact CZ-OD1 3.38Å; R148-D164 IonicContact CZ-OD2 3.37Å; R148-D164 IonicContact NE-OD1 2.83Å; R148-D164 PolarHBondContact NE-OD1 2.86Å; R148-D164 IonicContact NE-OD2 2.94Å; R148-D164 IonicContact NH1-OD2 3.21Å; R148-D164 PolarHBondContact NH1-OD2 2.73Å; R148-D164 VanDerWaalsContact NH2-CG 3.34Å; R148-D164 IonicContact NH2-OD1 2.62Å; R148-D164 PolarHBondContact NH2-OD1 3.18Å; R148-D164 VanDerWaalsContact NH2-OD1 3.14Å; R148-D164 IonicContact NH2-OD2 3.87Å; R148-D164 PolarHBondContact NH2-OD2 2.97Å; R148-S190 WeakPolarHBondContact CB-O 3.47Å
149	C	96.6	Very high	95.4	Very high	1 Å²	1	43 Å²	43	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	150.6	-176.3	-172.2	0	0	0	0	110.6	C107 S161 C162 Y191 V192	C107-C149 VanDerWaalsContact SG-SG 3.69Å; C149-S161 WeakPolarHBondContact O-CA 3.24Å; C149-C162 WeakPolarHBondContact CB-SG 3.23Å; C149-C162 PolarHBondContact N-SG 3.03Å; C149-C162 PolarHBondContact O-N 3.38Å; C149-Y191 HydrophobicContact CB-CD2 4.32Å; C149-Y191 HydrophobicContact CB-CG 4.43Å; C149-V192 HydrophobicContact CB-CG1 4.16Å
150	V	97.4	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.9	173.4	60.9	0	0	0	0	109.3	C107 V118 I126 I159 V160	C107-V150 HydrophobicContact CB-CG1 4.32Å; V118-V150 HydrophobicContact CB-CG2 4.36Å; V118-V150 HydrophobicContact CG1-CB 4.43Å; V118-V150 HydrophobicContact CG1-CG1 3.9Å; V118-V150 HydrophobicContact CG1-CG2 3.73Å; V118-V150 HydrophobicContact CG2-CG1 4.28Å; V118-V150 HydrophobicContact CG2-CG2 3.67Å; I126-V150 HydrophobicContact CG2-CG2 3.87Å; V150-I159 HydrophobicContact CG2-CG2 3.43Å; V150-I159 VanDerWaalsContact CG2-CG2 3.43Å; V150-V160 CarbonylContact C-O 3.56Å; V150-V160 VanDerWaalsContact CA-O 3.29Å; V150-V160 WeakPolarHBondContact CA-O 3.3Å
151	R	97	Very high	95.5	Very high	19 Å²	19	40 Å²	40	7%	0.072	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	145	176.5	-65.2	-67.4	176.3	-170.4	-8.7	111.6	N109 I159 V160 Y191 V192 F194	N109-R151 VanDerWaalsContact ND2-CA 3.33Å; N109-R151 WeakPolarHBondContact ND2-CA 3.38Å; N109-R151 WeakPolarHBondContact ND2-CD 3.37Å; N109-R151 PolarHBondContact OD1-NH1 3.3Å; R151-I159 CarbonylContact O-C 3.6Å; R151-I159 WeakPolarHBondContact O-CA 3.33Å; R151-V160 HydrophobicContact CB-CG1 4Å; R151-V160 PolarHBondContact N-O 2.98Å; R151-V160 PolarHBondContact O-N 3.26Å; R151-Y191 PolarHBondContact NH2-OH 3.42Å; R151-V192 WeakPolarHBondContact CG-O 3.43Å; R151-F194 HydrophobicContact CB-CD2 4.2Å; R151-F194 WeakPolarHBondContact O-CE2 3.33Å
152	F	97	Very high	95.6	Very high	10 Å²	10	35.8 Å²	35.8	4%	0.044	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.1	163.7	-75.8	-72.7	0	0	0	110.5	N109 F110 V118 L128 D156 I159 K173 F194	N109-F152 HydrophobicContact CB-CD2 4.19Å; N109-F152 PolarHBondContact ND2-N 2.86Å; N109-F152 WeakPolarHBondContact O-CE2 3.49Å; F110-F152 WeakPolarHBondContact O-CD2 3.09Å; V118-F152 HydrophobicContact CB-CD2 4.49Å; V118-F152 HydrophobicContact CB-CE1 4.49Å; V118-F152 HydrophobicContact CB-CE2 3.71Å; V118-F152 HydrophobicContact CB-CZ 3.71Å; V118-F152 HydrophobicContact CG1-CD2 3.77Å; V118-F152 HydrophobicContact CG1-CE2 3.44Å; V118-F152 VanDerWaalsContact CG1-CE2 3.44Å; V118-F152 HydrophobicContact CG1-CG 4.48Å; V118-F152 HydrophobicContact CG1-CZ 3.88Å; L128-F152 HydrophobicContact CD1-CE1 3.98Å; L128-F152 HydrophobicContact CD1-CZ 3.46Å; L128-F152 VanDerWaalsContact CD1-CZ 3.46Å; F152-D156 VanDerWaalsContact CD1-OD1 3.32Å; F152-D156 WeakPolarHBondContact CD1-OD1 3.48Å; F152-D156 WeakPolarHBondContact CE1-OD1 3.39Å; F152-I159 HydrophobicContact CD1-CD1 4.22Å; F152-I159 HydrophobicContact CD1-CG1 3.63Å; F152-I159 HydrophobicContact CE1-CD1 3.72Å; F152-I159 HydrophobicContact CE1-CG1 3.68Å; F152-K173 HydrophobicContact CE1-CD 4.36Å; F152-F194 VanDerWaalsContact C-CD2 3.48Å; F152-F194 WeakPolarHBondContact O-CD2 3.42Å
153	S	95.7	Very high	95.6	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.014	16%	0.158	C	C	.	.			trans	-69.4	157.9	163.9	55.3	0	0	0	0	111.4	D155 D156 G157 L158	S153-D155 WeakPolarHBondContact CB-OD1 3.03Å; S153-D155 PolarHBondContact O-N 3.11Å; S153-D155 PolarHBondContact OG-OD1 3Å; S153-D156 PolarHBondContact O-N 2.93Å; S153-G157 PolarHBondContact OG-N 3.01Å; S153-L158 PolarHBondContact N-O 3Å; S153-L158 WeakPolarHBondContact OG-CA 3.45Å; S153-L158 WeakPolarHBondContact OG-CB 3.44Å; S153-L158 PolarHBondContact OG-N 3.46Å; S153-L158 PolarHBondContact OG-O 3.39Å; S153-L158 VanDerWaalsContact OG-O 3.05Å
154	P	92.1	Very high	95.6	Very high	55 Å²	55	32.1 Å²	32.1	36%	0.357	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.3	176.5	-24.7	34.6	0	0	0	114.4	C112 P196	C112-P154 PolarHBondContact SG-O 2.92Å; C112-P154 VanDerWaalsContact SG-O 3.33Å; P154-P196 WeakPolarHBondContact CG-O 3.45Å
155	D	91.4	Very high	95.5	Very high	116 Å²	116	26.6 Å²	26.6	62%	0.62	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-0.8	176.7	70.9	-11.2	0	0	0	113.7	S153 G157	S153-D155 WeakPolarHBondContact CB-OD1 3.03Å; S153-D155 PolarHBondContact O-N 3.11Å; S153-D155 PolarHBondContact OG-OD1 3Å; D155-G157 PolarHBondContact O-N 3.13Å; D155-G157 PolarHBondContact OD1-N 3.31Å; D155-G157 VanDerWaalsContact OD1-N 3.09Å
156	D	92.8	Very high	95.4	Very high	30 Å²	30	28.8 Å²	28.8	16%	0.16	14%	0.142	C	C	.	.	S	Bend	trans	58.7	9.7	-177.1	-169.7	46.9	0	0	0	114.8	S111 F152 S153 K173	S111-D156 WeakPolarHBondContact CB-OD1 3.32Å; F152-D156 VanDerWaalsContact CD1-OD1 3.32Å; F152-D156 WeakPolarHBondContact CD1-OD1 3.48Å; F152-D156 WeakPolarHBondContact CE1-OD1 3.39Å; S153-D156 PolarHBondContact O-N 2.93Å; D156-K173 WeakPolarHBondContact O-CD 3.33Å; D156-K173 IonicContact OD1-NZ 3.57Å; D156-K173 PolarHBondContact OD1-NZ 2.87Å; D156-K173 IonicContact OD2-NZ 2.9Å; D156-K173 PolarHBondContact OD2-NZ 2.8Å
157	G	92.8	Very high	95.4	Very high	18 Å²	18	24.5 Å²	24.5	19%	0.186	13%	0.129	C	C	.	.	S	Bend	trans	-83.3	-31.3	178.2	0	0	0	0	0	113.4	S153 D155 K173	S153-G157 PolarHBondContact OG-N 3.01Å; D155-G157 PolarHBondContact O-N 3.13Å; D155-G157 PolarHBondContact OD1-N 3.31Å; D155-G157 VanDerWaalsContact OD1-N 3.09Å; G157-K173 VanDerWaalsContact O-CB 3.31Å; G157-K173 WeakPolarHBondContact O-CB 3.38Å; G157-K173 PolarHBondContact O-N 2.89Å
158	L	96	Very high	95.3	Very high	32 Å²	32	24.5 Å²	24.5	17%	0.168	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154.5	-173.1	-57.5	175	0	0	0	111.4	S153 L170 W171 I179 F194 I215	S153-L158 PolarHBondContact N-O 3Å; S153-L158 WeakPolarHBondContact OG-CA 3.45Å; S153-L158 WeakPolarHBondContact OG-CB 3.44Å; S153-L158 PolarHBondContact OG-N 3.46Å; S153-L158 PolarHBondContact OG-O 3.39Å; S153-L158 VanDerWaalsContact OG-O 3.05Å; L158-L170 HydrophobicContact CB-CD1 4.2Å; L158-L170 HydrophobicContact CD1-CD1 4.41Å; L158-L170 HydrophobicContact CD1-CD2 4.48Å; L158-W171 WeakPolarHBondContact CA-O 3.43Å; L158-I179 HydrophobicContact CD2-CD1 3.4Å; L158-I179 VanDerWaalsContact CD2-CD1 3.4Å; L158-F194 HydrophobicContact CB-CZ 4.24Å; L158-I215 HydrophobicContact CD1-CG2 4.12Å
159	I	97.3	Very high	95.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	134	173.2	-61.2	166.6	0	0	0	107.3	V118 F140 V150 R151 F152 W171	V118-I159 HydrophobicContact CG2-CD1 4.48Å; V118-I159 HydrophobicContact CG2-CG2 4.39Å; F140-I159 HydrophobicContact CE2-CD1 3.82Å; F140-I159 HydrophobicContact CZ-CD1 4.31Å; V150-I159 HydrophobicContact CG2-CG2 3.43Å; V150-I159 VanDerWaalsContact CG2-CG2 3.43Å; R151-I159 CarbonylContact O-C 3.6Å; R151-I159 WeakPolarHBondContact O-CA 3.33Å; F152-I159 HydrophobicContact CD1-CD1 4.22Å; F152-I159 HydrophobicContact CD1-CG1 3.63Å; F152-I159 HydrophobicContact CE1-CD1 3.72Å; F152-I159 HydrophobicContact CE1-CG1 3.68Å; I159-W171 HydrophobicContact CB-CB 4.23Å; I159-W171 PolarHBondContact N-O 2.99Å; I159-W171 PolarHBondContact O-N 2.94Å
160	V	97.2	Very high	95.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	141.1	172.1	72.3	0	0	0	0	109.5	V150 R151 I168 K169 L170 V192 F194 I201	V150-V160 CarbonylContact C-O 3.56Å; V150-V160 VanDerWaalsContact CA-O 3.29Å; V150-V160 WeakPolarHBondContact CA-O 3.3Å; R151-V160 HydrophobicContact CB-CG1 4Å; R151-V160 PolarHBondContact N-O 2.98Å; R151-V160 PolarHBondContact O-N 3.26Å; V160-I168 HydrophobicContact CG2-CG2 3.53Å; V160-K169 WeakPolarHBondContact CA-O 3.27Å; V160-L170 HydrophobicContact CB-CD1 4.38Å; V160-V192 HydrophobicContact CB-CG2 4.35Å; V160-V192 HydrophobicContact CG1-CB 4.38Å; V160-V192 HydrophobicContact CG1-CG1 3.8Å; V160-V192 HydrophobicContact CG1-CG2 3.69Å; V160-V192 HydrophobicContact CG2-CG1 4.49Å; V160-V192 HydrophobicContact CG2-CG2 3.68Å; V160-F194 HydrophobicContact CB-CD2 4.44Å; V160-F194 HydrophobicContact CB-CE2 3.57Å; V160-F194 HydrophobicContact CB-CZ 3.6Å; V160-F194 HydrophobicContact CG1-CD2 3.7Å; V160-F194 HydrophobicContact CG1-CE2 3.24Å; V160-F194 HydrophobicContact CG1-CZ 3.79Å; V160-I201 HydrophobicContact CB-CG2 4.49Å; V160-I201 HydrophobicContact CG2-CD1 4.23Å; V160-I201 HydrophobicContact CG2-CG2 4.28Å
161	S	97.1	Very high	95.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.8	176.1	59.3	0	0	0	0	111.9	I126 H143 C149 I168 K169 W171	I126-S161 VanDerWaalsContact CD1-OG 3.22Å; I126-S161 WeakPolarHBondContact CD1-OG 3.47Å; H143-S161 PolarHBondContact NE2-OG 3.01Å; C149-S161 WeakPolarHBondContact O-CA 3.24Å; S161-I168 CarbonylContact O-C 3.57Å; S161-I168 VanDerWaalsContact O-CA 3.26Å; S161-I168 WeakPolarHBondContact O-CA 3.41Å; S161-I168 WeakPolarHBondContact O-CG2 3.39Å; S161-K169 PolarHBondContact N-O 3.28Å; S161-K169 PolarHBondContact O-N 2.87Å; S161-W171 PolarHBondContact OG-NE1 2.87Å
162	C	95.9	Very high	95.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.4	174.3	70.5	0	0	0	0	111.2	V147 R148 C149 I168 A189 V192	V147-C162 CarbonylContact C-O 3.56Å; V147-C162 WeakPolarHBondContact CA-O 3.41Å; V147-C162 VanDerWaalsContact CG1-O 3.32Å; V147-C162 WeakPolarHBondContact CG1-O 3.43Å; R148-C162 PolarHBondContact N-O 2.99Å; C149-C162 WeakPolarHBondContact CB-SG 3.23Å; C149-C162 PolarHBondContact N-SG 3.03Å; C149-C162 PolarHBondContact O-N 3.38Å; C162-I168 HydrophobicContact CB-CG1 4.11Å; C162-A189 HydrophobicContact CB-CB 3.69Å; C162-A189 PolarHBondContact SG-O 2.91Å; C162-V192 HydrophobicContact CB-CB 4.25Å; C162-V192 HydrophobicContact CB-CG1 4.18Å
163	S	95.8	Very high	95.1	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.5	-171.8	169.2	0	0	0	0	112	H143 N145 W146 D165 K166 T167	H143-S163 WeakPolarHBondContact ND1-CB 3.42Å; N145-S163 PolarHBondContact O-OG 3.38Å; W146-S163 CarbonylContact O-C 3.54Å; W146-S163 VanDerWaalsContact O-CA 3.23Å; W146-S163 WeakPolarHBondContact O-CA 3.41Å; W146-S163 PolarHBondContact O-OG 2.99Å; S163-D165 WeakPolarHBondContact CB-OD1 3.46Å; S163-D165 PolarHBondContact O-N 3.15Å; S163-D165 VanDerWaalsContact O-N 3.14Å; S163-D165 PolarHBondContact OG-N 3.4Å; S163-D165 PolarHBondContact OG-OD1 3.01Å; S163-D165 PolarHBondContact OG-OD2 3.44Å; S163-K166 PolarHBondContact O-N 3.36Å; S163-T167 PolarHBondContact N-O 3.1Å
164	D	95	Very high	95	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.134	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-4.3	172.4	-77.3	5.8	0	0	0	112.4	N145 W146 R148 K166 Y188	N145-D164 HydrophobicContact CB-CB 4.15Å; W146-D164 HydrophobicContact CB-CB 4.45Å; W146-D164 PolarHBondContact O-N 3.49Å; R148-D164 VanDerWaalsContact CG-OD1 3.29Å; R148-D164 WeakPolarHBondContact CG-OD1 3.23Å; R148-D164 VanDerWaalsContact CZ-CG 3.48Å; R148-D164 IonicContact CZ-OD1 3.38Å; R148-D164 IonicContact CZ-OD2 3.37Å; R148-D164 IonicContact NE-OD1 2.83Å; R148-D164 PolarHBondContact NE-OD1 2.86Å; R148-D164 IonicContact NE-OD2 2.94Å; R148-D164 IonicContact NH1-OD2 3.21Å; R148-D164 PolarHBondContact NH1-OD2 2.73Å; R148-D164 VanDerWaalsContact NH2-CG 3.34Å; R148-D164 IonicContact NH2-OD1 2.62Å; R148-D164 PolarHBondContact NH2-OD1 3.18Å; R148-D164 VanDerWaalsContact NH2-OD1 3.14Å; R148-D164 IonicContact NH2-OD2 3.87Å; R148-D164 PolarHBondContact NH2-OD2 2.97Å; D164-K166 PolarHBondContact O-N 3.38Å; D164-Y188 VanDerWaalsContact OD1-CD2 3.27Å; D164-Y188 WeakPolarHBondContact OD1-CD2 3.2Å; D164-Y188 WeakPolarHBondContact OD1-CE2 3.34Å
165	D	94	Very high	95.1	Very high	32 Å²	32	34.3 Å²	34.3	17%	0.171	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	8	169.5	62.7	22.7	0	0	0	113.5	H143 M144 N145 S163 T167	H143-D165 WeakPolarHBondContact CA-OD2 3.38Å; H143-D165 IonicContact CG-OD2 3.56Å; H143-D165 IonicContact ND1-OD1 3.61Å; H143-D165 IonicContact ND1-OD2 3.5Å; H143-D165 PolarHBondContact ND1-OD2 2.92Å; M144-D165 HydrophobicContact CB-CB 4.17Å; M144-D165 PolarHBondContact N-OD2 3.4Å; N145-D165 HydrophobicContact CB-CB 3.91Å; S163-D165 WeakPolarHBondContact CB-OD1 3.46Å; S163-D165 PolarHBondContact O-N 3.15Å; S163-D165 VanDerWaalsContact O-N 3.14Å; S163-D165 PolarHBondContact OG-N 3.4Å; S163-D165 PolarHBondContact OG-OD1 3.01Å; S163-D165 PolarHBondContact OG-OD2 3.44Å; D165-T167 VanDerWaalsContact CG-OG1 3.26Å; D165-T167 PolarHBondContact O-N 3.5Å; D165-T167 WeakPolarHBondContact OD1-CA 3.27Å; D165-T167 VanDerWaalsContact OD1-CB 3.25Å; D165-T167 WeakPolarHBondContact OD1-CB 3.46Å; D165-T167 WeakPolarHBondContact OD1-CG2 3.47Å; D165-T167 PolarHBondContact OD1-N 3.11Å; D165-T167 PolarHBondContact OD1-OG1 3.48Å; D165-T167 PolarHBondContact OD2-OG1 3.11Å
166	K	94	Very high	95.2	Very high	103 Å²	103	36.3 Å²	36.3	45%	0.448	17%	0.173	S	C	.	.	S	Bend	trans	64.1	16.7	-176.6	-49.1	-172.6	178.4	-164.6	0	114.1	S163 D164 A186 G187	S163-K166 PolarHBondContact O-N 3.36Å; D164-K166 PolarHBondContact O-N 3.38Å; K166-A186 PolarHBondContact NZ-O 3.49Å; K166-G187 WeakPolarHBondContact CG-O 3.2Å
167	T	95	Very high	95.3	Very high	21 Å²	21	41 Å²	41	13%	0.129	19%	0.194	C	C	.	.			trans	-111.4	145.5	177.9	78	0	0	0	0	112.1	H143 S163 D165 T181 F182 T183	H143-T167 PolarHBondContact ND1-OG1 3.3Å; S163-T167 PolarHBondContact N-O 3.1Å; D165-T167 VanDerWaalsContact CG-OG1 3.26Å; D165-T167 PolarHBondContact O-N 3.5Å; D165-T167 WeakPolarHBondContact OD1-CA 3.27Å; D165-T167 VanDerWaalsContact OD1-CB 3.25Å; D165-T167 WeakPolarHBondContact OD1-CB 3.46Å; D165-T167 WeakPolarHBondContact OD1-CG2 3.47Å; D165-T167 PolarHBondContact OD1-N 3.11Å; D165-T167 PolarHBondContact OD1-OG1 3.48Å; D165-T167 PolarHBondContact OD2-OG1 3.11Å; T167-T181 HydrophobicContact CG2-CG2 3.99Å; T167-F182 WeakPolarHBondContact CA-O 3.39Å; T167-T183 HydrophobicContact CG2-CG2 3.99Å
168	I	96.2	Very high	95.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	125.5	164.4	-58	169.3	0	0	0	106.9	V160 S161 C162 T181 F182 H185 A189 V192 I201 A203 W213	V160-I168 HydrophobicContact CG2-CG2 3.53Å; S161-I168 CarbonylContact O-C 3.57Å; S161-I168 VanDerWaalsContact O-CA 3.26Å; S161-I168 WeakPolarHBondContact O-CA 3.41Å; S161-I168 WeakPolarHBondContact O-CG2 3.39Å; C162-I168 HydrophobicContact CB-CG1 4.11Å; I168-T181 CarbonylContact O-C 3.58Å; I168-T181 WeakPolarHBondContact O-CA 3.09Å; I168-F182 HydrophobicContact CB-CB 4.26Å; I168-F182 HydrophobicContact CB-CD2 4.24Å; I168-F182 HydrophobicContact CG2-CD2 4.24Å; I168-F182 PolarHBondContact N-O 3.28Å; I168-F182 PolarHBondContact O-N 3.29Å; I168-H185 WeakPolarHBondContact CD1-NE2 3.17Å; I168-A189 HydrophobicContact CD1-CB 4.04Å; I168-A189 HydrophobicContact CG1-CB 4Å; I168-V192 HydrophobicContact CG2-CG2 4.28Å; I168-I201 HydrophobicContact CG2-CD1 4.23Å; I168-A203 HydrophobicContact CD1-CB 3.27Å; I168-W213 HydrophobicContact CD1-CH2 3.67Å; I168-W213 HydrophobicContact CD1-CZ2 4.4Å; I168-W213 HydrophobicContact CD1-CZ3 3.81Å
169	K	96.3	Very high	95.3	Very high	22 Å²	22	43.8 Å²	43.8	10%	0.096	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.6	-179.2	-70.8	-177.9	177.9	-76.1	0	110.4	Q142 V160 S161 W171 H180 T181	Q142-K169 HydrophobicContact CB-CD 4.5Å; V160-K169 WeakPolarHBondContact CA-O 3.27Å; S161-K169 PolarHBondContact N-O 3.28Å; S161-K169 PolarHBondContact O-N 2.87Å; K169-W171 HydrophobicContact CB-CZ2 3.81Å; K169-W171 HydrophobicContact CD-CH2 4.07Å; K169-W171 HydrophobicContact CD-CZ2 3.59Å; K169-W171 HydrophobicContact CG-CZ2 4.34Å; K169-H180 WeakPolarHBondContact CA-O 3.46Å; K169-T181 HydrophobicContact CG-CG2 3.97Å; K169-T181 PolarHBondContact NZ-OG1 3.46Å
170	L	96.8	Very high	95.2	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	128.4	171.7	-173.1	71.5	0	0	0	108.8	L158 V160 C178 I179 H180 F194 I215	L158-L170 HydrophobicContact CB-CD1 4.2Å; L158-L170 HydrophobicContact CD1-CD1 4.41Å; L158-L170 HydrophobicContact CD1-CD2 4.48Å; V160-L170 HydrophobicContact CB-CD1 4.38Å; L170-C178 CarbonylContact O-C 3.45Å; L170-C178 WeakPolarHBondContact O-CA 3.26Å; L170-I179 HydrophobicContact CD2-CB 4.4Å; L170-I179 HydrophobicContact CD2-CD1 4.1Å; L170-I179 HydrophobicContact CG-CD1 4.16Å; L170-I179 PolarHBondContact O-N 3.36Å; L170-H180 PolarHBondContact N-O 2.98Å; L170-H180 PolarHBondContact O-N 3.06Å; L170-F194 HydrophobicContact CD1-CE1 4.21Å; L170-F194 HydrophobicContact CD1-CZ 3.9Å; L170-I215 HydrophobicContact CD2-CG2 3.72Å
171	W	96.8	Very high	95.2	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.008	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.6	-175.8	-48.8	86.9	0	0	0	110.1	I126 F140 Q142 L158 I159 S161 K169 E177 C178	I126-W171 HydrophobicContact CD1-CZ2 4.17Å; F140-W171 HydrophobicContact CB-CD2 4.16Å; F140-W171 HydrophobicContact CB-CE3 3.9Å; F140-W171 HydrophobicContact CB-CH2 3.79Å; F140-W171 HydrophobicContact CB-CZ2 4.1Å; F140-W171 HydrophobicContact CB-CZ3 3.71Å; F140-W171 HydrophobicContact CD1-CB 4.47Å; F140-W171 AromaticContact CD1-CD2 3.87Å; F140-W171 HydrophobicContact CD1-CD2 3.87Å; F140-W171 AromaticContact CD1-CE3 3.26Å; F140-W171 HydrophobicContact CD1-CE3 3.26Å; F140-W171 HydrophobicContact CD1-CG 4.39Å; F140-W171 AromaticContact CD1-CZ3 3.69Å; F140-W171 HydrophobicContact CD1-CZ3 3.69Å; F140-W171 HydrophobicContact CE1-CB 4.01Å; F140-W171 HydrophobicContact CE1-CD2 4.28Å; F140-W171 AromaticContact CE1-CE3 3.81Å; F140-W171 HydrophobicContact CE1-CE3 3.81Å; F140-W171 HydrophobicContact CE1-CG 4.41Å; F140-W171 HydrophobicContact CE2-CB 4.4Å; F140-W171 AromaticContact CG-CD2 3.96Å; F140-W171 HydrophobicContact CG-CD2 3.96Å; F140-W171 AromaticContact CG-CE3 3.74Å; F140-W171 HydrophobicContact CG-CE3 3.74Å; F140-W171 HydrophobicContact CG-CG 4.44Å; F140-W171 HydrophobicContact CG-CZ3 4.03Å; F140-W171 HydrophobicContact CZ-CB 3.96Å; Q142-W171 HydrophobicContact CB-CH2 3.58Å; Q142-W171 HydrophobicContact CB-CZ3 4.25Å; Q142-W171 HydrophobicContact CG-CH2 3.61Å; Q142-W171 HydrophobicContact CG-CZ3 3.76Å; L158-W171 WeakPolarHBondContact CA-O 3.43Å; I159-W171 HydrophobicContact CB-CB 4.23Å; I159-W171 PolarHBondContact N-O 2.99Å; I159-W171 PolarHBondContact O-N 2.94Å; S161-W171 PolarHBondContact OG-NE1 2.87Å; K169-W171 HydrophobicContact CB-CZ2 3.81Å; K169-W171 HydrophobicContact CD-CH2 4.07Å; K169-W171 HydrophobicContact CD-CZ2 3.59Å; K169-W171 HydrophobicContact CG-CZ2 4.34Å; W171-E177 WeakPolarHBondContact CA-O 3.47Å; W171-C178 HydrophobicContact CD2-CB 4.34Å; W171-C178 HydrophobicContact CE3-CB 3.67Å; W171-C178 HydrophobicContact CH2-CB 4.24Å; W171-C178 HydrophobicContact CZ3-CB 3.62Å
172	D	95.8	Very high	95	Very high	31 Å²	31	48.9 Å²	48.9	17%	0.166	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	125.5	168.7	174.1	8.7	0	0	0	109.6	K174 T175 R176 E177 I179	D172-K174 VanDerWaalsContact C-N 3.29Å; D172-K174 PolarHBondContact O-N 2.7Å; D172-K174 PolarHBondContact OD1-N 3.28Å; D172-T175 WeakPolarHBondContact CB-OG1 3.44Å; D172-T175 WeakPolarHBondContact OD2-CB 3.42Å; D172-T175 WeakPolarHBondContact OD2-CG2 3.19Å; D172-T175 PolarHBondContact OD2-N 3.07Å; D172-T175 PolarHBondContact OD2-OG1 3.31Å; D172-R176 VanDerWaalsContact O-CA 3.26Å; D172-R176 WeakPolarHBondContact O-CA 3.4Å; D172-R176 PolarHBondContact O-N 3.35Å; D172-E177 PolarHBondContact N-O 3.3Å; D172-I179 HydrophobicContact CB-CD1 3.69Å; D172-I179 HydrophobicContact CB-CG1 3.91Å
173	K	94.1	Very high	94.5	Very high	35 Å²	35	52.9 Å²	52.9	15%	0.152	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-32.8	179	-173.8	-179	-176.8	169.9	0	112.1	T116 F138 F152 D156 G157	T116-K173 PolarHBondContact OG1-NZ 2.9Å; T116-K173 VanDerWaalsContact OG1-NZ 3.11Å; F138-K173 HydrophobicContact CZ-CG 4.34Å; F138-K173 WeakPolarHBondContact CZ-O 3.3Å; F152-K173 HydrophobicContact CE1-CD 4.36Å; D156-K173 WeakPolarHBondContact O-CD 3.33Å; D156-K173 IonicContact OD1-NZ 3.57Å; D156-K173 PolarHBondContact OD1-NZ 2.87Å; D156-K173 IonicContact OD2-NZ 2.9Å; D156-K173 PolarHBondContact OD2-NZ 2.8Å; G157-K173 VanDerWaalsContact O-CB 3.31Å; G157-K173 WeakPolarHBondContact O-CB 3.38Å; G157-K173 PolarHBondContact O-N 2.89Å
174	K	93.5	Very high	93.1	Very high	179 Å²	179	59.2 Å²	59.2	78%	0.778	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-52.8	-175.1	-67.9	-179.1	-178.1	172.6	0	112.2	D172 R176	D172-K174 VanDerWaalsContact C-N 3.29Å; D172-K174 PolarHBondContact O-N 2.7Å; D172-K174 PolarHBondContact OD1-N 3.28Å; K174-R176 VanDerWaalsContact C-N 3.31Å
175	T	93.9	Very high	91.8	Very high	72 Å²	72	58.6 Å²	58.6	44%	0.442	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-26	179.5	55.5	0	0	0	0	112	D172 E177	D172-T175 WeakPolarHBondContact CB-OG1 3.44Å; D172-T175 WeakPolarHBondContact OD2-CB 3.42Å; D172-T175 WeakPolarHBondContact OD2-CG2 3.19Å; D172-T175 PolarHBondContact OD2-N 3.07Å; D172-T175 PolarHBondContact OD2-OG1 3.31Å; T175-E177 VanDerWaalsContact C-N 3.27Å
176	R	93.9	Very high	91.3	Very high	158 Å²	158	60.8 Å²	60.8	60%	0.596	31%	0.306	S	S	*	.			trans	67.7	27.3	-176	-51.2	167.7	-69.1	179.9	-1.1	112.9	F138 F140 D172 K174	F138-R176 HydrophobicContact CD1-CG 4.44Å; F138-R176 HydrophobicContact CD2-CG 4.1Å; F138-R176 HydrophobicContact CE1-CG 4.26Å; F138-R176 HydrophobicContact CE2-CG 3.92Å; F138-R176 HydrophobicContact CG-CG 4.35Å; F138-R176 HydrophobicContact CZ-CG 3.98Å; F140-R176 HydrophobicContact CE1-CB 4.2Å; D172-R176 VanDerWaalsContact O-CA 3.26Å; D172-R176 WeakPolarHBondContact O-CA 3.4Å; D172-R176 PolarHBondContact O-N 3.35Å; K174-R176 VanDerWaalsContact C-N 3.31Å
177	E	93.8	Very high	91	Very high	128 Å²	128	56.3 Å²	56.3	60%	0.598	29%	0.289	S	S	*	.	S	Bend	trans	-113.6	157.8	-179.5	-63.7	-175.6	168.1	0	0	111.3	W171 D172 T175 I179	W171-E177 WeakPolarHBondContact CA-O 3.47Å; D172-E177 PolarHBondContact N-O 3.3Å; T175-E177 VanDerWaalsContact C-N 3.27Å; E177-I179 PolarHBondContact O-N 2.99Å
178	C	95.2	Very high	90.9	Very high	27 Å²	27	59.2 Å²	59.2	18%	0.182	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	115.4	170.6	179.4	0	0	0	0	108.3	L170 W171 H180	L170-C178 CarbonylContact O-C 3.45Å; L170-C178 WeakPolarHBondContact O-CA 3.26Å; W171-C178 HydrophobicContact CD2-CB 4.34Å; W171-C178 HydrophobicContact CE3-CB 3.67Å; W171-C178 HydrophobicContact CH2-CB 4.24Å; W171-C178 HydrophobicContact CZ3-CB 3.62Å; C178-H180 PolarHBondContact SG-O 3.05Å; C178-H180 VanDerWaalsContact SG-O 3.41Å
179	I	94.6	Very high	90.7	Very high	82 Å²	82	59.3 Å²	59.3	42%	0.421	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	-49.2	177.2	-60.5	160.3	0	0	0	109.9	L158 L170 D172 E177	L158-I179 HydrophobicContact CD2-CD1 3.4Å; L158-I179 VanDerWaalsContact CD2-CD1 3.4Å; L170-I179 HydrophobicContact CD2-CB 4.4Å; L170-I179 HydrophobicContact CD2-CD1 4.1Å; L170-I179 HydrophobicContact CG-CD1 4.16Å; L170-I179 PolarHBondContact O-N 3.36Å; D172-I179 HydrophobicContact CB-CD1 3.69Å; D172-I179 HydrophobicContact CB-CG1 3.91Å; E177-I179 PolarHBondContact O-N 2.99Å
180	H	95	Very high	90.6	Very high	59 Å²	59	59.2 Å²	59.2	27%	0.273	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	152.9	-172.5	-165.4	72.6	0	0	0	112.4	K169 L170 C178 F182 H218	K169-H180 WeakPolarHBondContact CA-O 3.46Å; L170-H180 PolarHBondContact N-O 2.98Å; L170-H180 PolarHBondContact O-N 3.06Å; C178-H180 PolarHBondContact SG-O 3.05Å; C178-H180 VanDerWaalsContact SG-O 3.41Å; H180-F182 AromaticContact CD2-CD1 3.61Å; H180-F182 AromaticContact CD2-CE1 3.44Å; H180-F182 VanDerWaalsContact CD2-CE1 3.44Å; H180-F182 WeakPolarHBondContact CD2-CE1 3.45Å; H180-F182 AromaticContact CD2-CE2 3.85Å; H180-F182 AromaticContact CD2-CG 3.91Å; H180-F182 AromaticContact CD2-CZ 3.58Å; H180-F182 AromaticContact NE2-CD1 3.78Å; H180-F182 AromaticContact NE2-CE1 3.83Å; H180-H218 AromaticContact CD2-CG 3.98Å; H180-H218 AromaticContact CD2-ND1 3.68Å; H180-H218 AromaticContact CG-CE1 3.9Å; H180-H218 AromaticContact CG-CG 3.83Å; H180-H218 AromaticContact CG-ND1 3.47Å; H180-H218 AromaticContact ND1-CG 3.88Å; H180-H218 AromaticContact ND1-ND1 3.98Å
181	T	95.7	Very high	90.6	Very high	42 Å²	42	61.3 Å²	61.3	26%	0.258	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	118.7	176.5	-57.6	0	0	0	0	109.5	T167 I168 K169 T183	T167-T181 HydrophobicContact CG2-CG2 3.99Å; I168-T181 CarbonylContact O-C 3.58Å; I168-T181 WeakPolarHBondContact O-CA 3.09Å; K169-T181 HydrophobicContact CG-CG2 3.97Å; K169-T181 PolarHBondContact NZ-OG1 3.46Å; T181-T183 HydrophobicContact CG2-CG2 3.97Å
182	F	93.9	Very high	90.6	Very high	7 Å²	7	61.2 Å²	61.2	3%	0.031	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	126.4	175	-54.1	-83.9	0	0	0	109.8	T167 I168 H180 I201 W213 H218	T167-F182 WeakPolarHBondContact CA-O 3.39Å; I168-F182 HydrophobicContact CB-CB 4.26Å; I168-F182 HydrophobicContact CB-CD2 4.24Å; I168-F182 HydrophobicContact CG2-CD2 4.24Å; I168-F182 PolarHBondContact N-O 3.28Å; I168-F182 PolarHBondContact O-N 3.29Å; H180-F182 AromaticContact CD2-CD1 3.61Å; H180-F182 AromaticContact CD2-CE1 3.44Å; H180-F182 VanDerWaalsContact CD2-CE1 3.44Å; H180-F182 WeakPolarHBondContact CD2-CE1 3.45Å; H180-F182 AromaticContact CD2-CE2 3.85Å; H180-F182 AromaticContact CD2-CG 3.91Å; H180-F182 AromaticContact CD2-CZ 3.58Å; H180-F182 AromaticContact NE2-CD1 3.78Å; H180-F182 AromaticContact NE2-CE1 3.83Å; F182-I201 HydrophobicContact CD2-CD1 3.85Å; F182-I201 HydrophobicContact CE2-CD1 3.44Å; F182-I201 VanDerWaalsContact CE2-CD1 3.44Å; F182-I201 HydrophobicContact CZ-CD1 3.98Å; F182-W213 HydrophobicContact CD1-CB 4.37Å; F182-W213 AromaticContact CD1-CD1 3.67Å; F182-W213 AromaticContact CD1-CG 3.98Å; F182-W213 HydrophobicContact CD1-CG 3.98Å; F182-W213 HydrophobicContact CE1-CB 3.95Å; F182-W213 HydrophobicContact CE1-CG 4.06Å; F182-W213 HydrophobicContact CZ-CB 4.31Å; F182-H218 HydrophobicContact CE1-CB 4.15Å; F182-H218 AromaticContact CZ-ND1 3.95Å
183	T	85.9	Confident	90.6	Very high	84 Å²	84	61.2 Å²	61.2	52%	0.515	31%	0.308	S	S	.	.			trans	-123.2	8.6	-171.8	53.2	0	0	0	0	114.8	T167 T181 H185	T167-T183 HydrophobicContact CG2-CG2 3.99Å; T181-T183 HydrophobicContact CG2-CG2 3.97Å; T183-H185 PolarHBondContact O-N 3.4Å
184	E	65.9	Low	90.7	Very high	132 Å²	132	59.9 Å²	59.9	62%	0.617	30%	0.303	S	S	*	.			trans	-80.9	25.3	-168.6	-64.9	-60.5	138.3	0	0	114.6	K211	E184-K211 PolarHBondContact O-NZ 2.95Å
185	H	68.4	Low	90.8	Very high	13 Å²	13	53 Å²	53	6%	0.06	27%	0.273	C	S	.	.			trans	-99.6	129.3	-173.5	-68.7	-87.6	0	0	0	112.7	I168 T183 G187 W213	I168-H185 WeakPolarHBondContact CD1-NE2 3.17Å; T183-H185 PolarHBondContact O-N 3.4Å; H185-G187 VanDerWaalsContact C-N 3.34Å; H185-G187 WeakPolarHBondContact CB-O 3.4Å; H185-W213 AromaticContact CE1-CH2 3.26Å; H185-W213 WeakPolarHBondContact CE1-CH2 3.38Å; H185-W213 AromaticContact CE1-CZ2 3.57Å; H185-W213 AromaticContact NE2-CH2 3.23Å; H185-W213 WeakPolarHBondContact NE2-CH2 3.34Å; H185-W213 AromaticContact NE2-CZ2 3.29Å; H185-W213 VanDerWaalsContact NE2-CZ2 3.29Å; H185-W213 WeakPolarHBondContact NE2-CZ2 3.27Å
186	A	82.4	Confident	90.8	Very high	78 Å²	78	51.9 Å²	51.9	65%	0.645	27%	0.267	S	S	*	.	S	Bend	trans	-69	-41	168.8	0	0	0	0	0	109.8	K166 D207	K166-A186 PolarHBondContact NZ-O 3.49Å; A186-D207 HydrophobicContact CB-CB 4.09Å; A186-D207 PolarHBondContact N-OD2 2.9Å
187	G	87.9	Confident	90.7	Very high	9 Å²	9	47.7 Å²	47.7	9%	0.093	26%	0.262	C	S	.	.	S	Bend	trans	-95.1	-162.6	171.9	0	0	0	0	0	114	K166 H185 D207	K166-G187 WeakPolarHBondContact CG-O 3.2Å; H185-G187 VanDerWaalsContact C-N 3.34Å; H185-G187 WeakPolarHBondContact CB-O 3.4Å; G187-D207 PolarHBondContact N-OD2 3.34Å
188	Y	91.9	Very high	90.7	Very high	82 Å²	82	42.8 Å²	42.8	32%	0.322	25%	0.246	S	C	.	.			trans	-109.6	154.1	165.9	56.2	-94.7	0	0	0	109.9	D164 S205 T206	D164-Y188 VanDerWaalsContact OD1-CD2 3.27Å; D164-Y188 WeakPolarHBondContact OD1-CD2 3.2Å; D164-Y188 WeakPolarHBondContact OD1-CE2 3.34Å; Y188-S205 WeakPolarHBondContact O-CA 3.39Å; Y188-T206 HydrophobicContact CD1-CG2 4.42Å; Y188-T206 HydrophobicContact CD2-CG2 3.74Å; Y188-T206 HydrophobicContact CE1-CG2 4.07Å; Y188-T206 HydrophobicContact CE2-CG2 3.32Å; Y188-T206 HydrophobicContact CG-CG2 4.27Å; Y188-T206 PolarHBondContact N-OG1 3.47Å; Y188-T206 PolarHBondContact O-N 3.41Å; Y188-T206 PolarHBondContact O-OG1 3.42Å
189	A	93.7	Very high	90.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.2	179.8	0	0	0	0	0	110.7	C162 I168 A203 A204	C162-A189 HydrophobicContact CB-CB 3.69Å; C162-A189 PolarHBondContact SG-O 2.91Å; I168-A189 HydrophobicContact CD1-CB 4.04Å; I168-A189 HydrophobicContact CG1-CB 4Å; A189-A203 HydrophobicContact CB-CB 4.15Å; A189-A204 CarbonylContact C-O 3.58Å; A189-A204 WeakPolarHBondContact CA-O 3.38Å
190	S	93.9	Very high	90.6	Very high	20 Å²	20	41.9 Å²	41.9	14%	0.14	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	-36.8	178.1	57.5	0	0	0	0	111.6	R148 A204 V231	R148-S190 WeakPolarHBondContact CB-O 3.47Å; S190-A204 PolarHBondContact N-O 3.47Å; S190-A204 PolarHBondContact OG-O 2.91Å; S190-A204 VanDerWaalsContact OG-O 3.13Å; S190-V231 WeakPolarHBondContact CB-O 3.48Å; S190-V231 PolarHBondContact OG-O 3.44Å
191	Y	95.8	Very high	90.7	Very high	47 Å²	47	39.1 Å²	39.1	18%	0.184	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	151.1	-174.3	-158.9	-83	0	0	0	110.7	C149 R151 D193 A203 A204 L234	C149-Y191 HydrophobicContact CB-CD2 4.32Å; C149-Y191 HydrophobicContact CB-CG 4.43Å; R151-Y191 PolarHBondContact NH2-OH 3.42Å; Y191-D193 HydrophobicContact CE1-CB 4.43Å; Y191-A203 WeakPolarHBondContact O-CA 3.49Å; Y191-A204 PolarHBondContact O-N 3.02Å; Y191-L234 HydrophobicContact CD1-CD2 3.8Å; Y191-L234 HydrophobicContact CD1-CG 3.64Å; Y191-L234 HydrophobicContact CE1-CG 4.16Å; Y191-L234 VanDerWaalsContact CE1-O 3.23Å; Y191-L234 WeakPolarHBondContact CE1-O 3.5Å; Y191-L234 HydrophobicContact CG-CD2 4.48Å; Y191-L234 WeakPolarHBondContact O-CD2 3.47Å
192	V	96.5	Very high	90.7	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145.9	179	65	0	0	0	0	109.3	C149 R151 V160 C162 I168 A202 A203	C149-V192 HydrophobicContact CB-CG1 4.16Å; R151-V192 WeakPolarHBondContact CG-O 3.43Å; V160-V192 HydrophobicContact CB-CG2 4.35Å; V160-V192 HydrophobicContact CG1-CB 4.38Å; V160-V192 HydrophobicContact CG1-CG1 3.8Å; V160-V192 HydrophobicContact CG1-CG2 3.69Å; V160-V192 HydrophobicContact CG2-CG1 4.49Å; V160-V192 HydrophobicContact CG2-CG2 3.68Å; C162-V192 HydrophobicContact CB-CB 4.25Å; C162-V192 HydrophobicContact CB-CG1 4.18Å; I168-V192 HydrophobicContact CG2-CG2 4.28Å; V192-A202 WeakPolarHBondContact CA-O 3.02Å; V192-A202 WeakPolarHBondContact CG2-O 3.35Å; V192-A203 HydrophobicContact CG2-CB 4.41Å
193	D	96.6	Very high	90.8	Very high	30 Å²	30	36.8 Å²	36.8	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	157.9	173.8	-156.2	13.4	0	0	0	111.7	Y191 I201 A202 L234 F236	Y191-D193 HydrophobicContact CE1-CB 4.43Å; D193-I201 WeakPolarHBondContact O-CA 3.42Å; D193-A202 PolarHBondContact N-O 2.9Å; D193-A202 PolarHBondContact O-N 2.94Å; D193-L234 HydrophobicContact CB-CD1 3.35Å; D193-L234 HydrophobicContact CB-CG 4.29Å; D193-F236 HydrophobicContact CB-CD2 4Å; D193-F236 HydrophobicContact CB-CE2 4.09Å
194	F	96.8	Very high	91.2	Very high	8 Å²	8	32.8 Å²	32.8	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141	173.6	-79.6	-84.9	0	0	0	110.5	R151 F152 L158 V160 L170 I201 I215 F236	R151-F194 HydrophobicContact CB-CD2 4.2Å; R151-F194 WeakPolarHBondContact O-CE2 3.33Å; F152-F194 VanDerWaalsContact C-CD2 3.48Å; F152-F194 WeakPolarHBondContact O-CD2 3.42Å; L158-F194 HydrophobicContact CB-CZ 4.24Å; V160-F194 HydrophobicContact CB-CD2 4.44Å; V160-F194 HydrophobicContact CB-CE2 3.57Å; V160-F194 HydrophobicContact CB-CZ 3.6Å; V160-F194 HydrophobicContact CG1-CD2 3.7Å; V160-F194 HydrophobicContact CG1-CE2 3.24Å; V160-F194 HydrophobicContact CG1-CZ 3.79Å; L170-F194 HydrophobicContact CD1-CE1 4.21Å; L170-F194 HydrophobicContact CD1-CZ 3.9Å; F194-I201 HydrophobicContact CD1-CG2 3.49Å; F194-I201 VanDerWaalsContact CD1-CG2 3.49Å; F194-I201 HydrophobicContact CE1-CG2 3.47Å; F194-I201 VanDerWaalsContact CE1-CG2 3.47Å; F194-I201 HydrophobicContact CG-CG2 4.17Å; F194-I201 HydrophobicContact CZ-CG2 4.15Å; F194-I215 HydrophobicContact CD1-CD1 3.7Å; F194-I215 HydrophobicContact CE1-CD1 3.55Å; F194-I215 HydrophobicContact CE1-CG1 4.45Å; F194-F236 VanDerWaalsContact C-CE2 3.48Å; F194-F236 WeakPolarHBondContact O-CD2 3.04Å
195	H	95.9	Very high	92.5	Very high	33 Å²	33	26.5 Å²	26.5	15%	0.153	16%	0.164	C	C	.	.			trans	-62.5	143.1	165.4	-175.2	-89.1	0	0	0	109.6	S197 G198 C200 F236 G240	H195-S197 PolarHBondContact CE1-OG 2.96Å; H195-S197 WeakPolarHBondContact ND1-CB 3.36Å; H195-S197 PolarHBondContact ND1-N 3.16Å; H195-S197 VanDerWaalsContact ND1-N 3.15Å; H195-S197 PolarHBondContact ND1-OG 3.22Å; H195-S197 PolarHBondContact O-N 2.83Å; H195-S197 VanDerWaalsContact O-N 3.1Å; H195-G198 WeakPolarHBondContact O-CA 3.48Å; H195-G198 PolarHBondContact O-N 3.18Å; H195-C200 HydrophobicContact CB-CB 4.01Å; H195-C200 WeakPolarHBondContact CB-O 3.3Å; H195-C200 PolarHBondContact N-O 3.27Å; H195-F236 HydrophobicContact CB-CE1 4.16Å; H195-F236 HydrophobicContact CB-CE2 4.44Å; H195-F236 HydrophobicContact CB-CZ 4.08Å; H195-F236 AromaticContact CD2-CD1 3.8Å; H195-F236 AromaticContact CD2-CE1 3.73Å; H195-G240 WeakPolarHBondContact NE2-CA 3.33Å; H195-G240 PolarHBondContact NE2-O 2.94Å
196	P	93.2	Very high	93.7	Very high	49 Å²	49	27.7 Å²	27.7	32%	0.318	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.2	-176.8	-26.3	32.9	0	0	0	115	P154 G198 F236 H237 P238	P154-P196 WeakPolarHBondContact CG-O 3.45Å; P196-G198 PolarHBondContact O-N 3.2Å; P196-F236 HydrophobicContact CG-CB 4.21Å; P196-H237 VanDerWaalsContact CG-O 3.3Å; P196-H237 WeakPolarHBondContact CG-O 3.23Å; P196-P238 WeakPolarHBondContact CB-O 3.46Å
197	S	92.5	Very high	94.1	Very high	70 Å²	70	25.9 Å²	25.9	49%	0.49	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-14.8	173.4	70.1	0	0	0	0	114.1	H195 T199	H195-S197 PolarHBondContact CE1-OG 2.96Å; H195-S197 WeakPolarHBondContact ND1-CB 3.36Å; H195-S197 PolarHBondContact ND1-N 3.16Å; H195-S197 VanDerWaalsContact ND1-N 3.15Å; H195-S197 PolarHBondContact ND1-OG 3.22Å; H195-S197 PolarHBondContact O-N 2.83Å; H195-S197 VanDerWaalsContact O-N 3.1Å; S197-T199 VanDerWaalsContact C-N 3.26Å; S197-T199 PolarHBondContact O-N 2.89Å; S197-T199 PolarHBondContact OG-N 3.48Å; S197-T199 PolarHBondContact OG-OG1 2.83Å
198	G	92.8	Very high	94.4	Very high	25 Å²	25	27.5 Å²	27.5	26%	0.258	16%	0.16	S	C	.	.	S	Bend	trans	73.3	9.8	-174	0	0	0	0	0	114.9	H195 P196 I215	H195-G198 WeakPolarHBondContact O-CA 3.48Å; H195-G198 PolarHBondContact O-N 3.18Å; P196-G198 PolarHBondContact O-N 3.2Å; G198-I215 WeakPolarHBondContact O-CD1 3.35Å
199	T	92.9	Very high	94.4	Very high	72 Å²	72	23.8 Å²	23.8	44%	0.442	15%	0.145	S	C	.	.	S	Bend	trans	-90.3	-27.5	-177.7	59.3	0	0	0	0	113.7	S197 I215	S197-T199 VanDerWaalsContact C-N 3.26Å; S197-T199 PolarHBondContact O-N 2.89Å; S197-T199 PolarHBondContact OG-N 3.48Å; S197-T199 PolarHBondContact OG-OG1 2.83Å; T199-I215 WeakPolarHBondContact O-CB 3.42Å; T199-I215 PolarHBondContact O-N 2.78Å
200	C	95.1	Very high	94.5	Very high	19 Å²	19	23.7 Å²	23.7	13%	0.128	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.9	-174.1	-54.9	0	0	0	0	111.4	H195 I212 W213	H195-C200 HydrophobicContact CB-CB 4.01Å; H195-C200 WeakPolarHBondContact CB-O 3.3Å; H195-C200 PolarHBondContact N-O 3.27Å; C200-I212 HydrophobicContact CB-CG2 4.01Å; C200-W213 CarbonylContact C-O 3.57Å; C200-W213 WeakPolarHBondContact CA-O 3.39Å; C200-W213 WeakPolarHBondContact CB-O 3.24Å
201	I	96.3	Very high	94.6	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	142	168.7	50.8	163.2	0	0	0	109.4	V160 I168 F182 D193 F194 I212 W213 I215	V160-I201 HydrophobicContact CB-CG2 4.49Å; V160-I201 HydrophobicContact CG2-CD1 4.23Å; V160-I201 HydrophobicContact CG2-CG2 4.28Å; I168-I201 HydrophobicContact CG2-CD1 4.23Å; F182-I201 HydrophobicContact CD2-CD1 3.85Å; F182-I201 HydrophobicContact CE2-CD1 3.44Å; F182-I201 VanDerWaalsContact CE2-CD1 3.44Å; F182-I201 HydrophobicContact CZ-CD1 3.98Å; D193-I201 WeakPolarHBondContact O-CA 3.42Å; F194-I201 HydrophobicContact CD1-CG2 3.49Å; F194-I201 VanDerWaalsContact CD1-CG2 3.49Å; F194-I201 HydrophobicContact CE1-CG2 3.47Å; F194-I201 VanDerWaalsContact CE1-CG2 3.47Å; F194-I201 HydrophobicContact CG-CG2 4.17Å; F194-I201 HydrophobicContact CZ-CG2 4.15Å; I201-I212 CarbonylContact O-C 3.58Å; I201-I212 VanDerWaalsContact O-CA 3.26Å; I201-I212 WeakPolarHBondContact O-CA 3.15Å; I201-I212 WeakPolarHBondContact O-CG2 3.22Å; I201-W213 HydrophobicContact CD1-CB 4.31Å; I201-W213 HydrophobicContact CD1-CE3 4.06Å; I201-W213 HydrophobicContact CG1-CB 3.95Å; I201-W213 HydrophobicContact CG1-CE3 4.01Å; I201-W213 PolarHBondContact N-O 2.95Å; I201-W213 PolarHBondContact O-N 3.35Å; I201-I215 HydrophobicContact CG1-CG1 4.46Å; I201-I215 HydrophobicContact CG2-CD1 3.94Å; I201-I215 HydrophobicContact CG2-CG1 3.94Å
202	A	96	Very high	94.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	145.3	168.1	0	0	0	0	0	110.2	V192 D193 K211 I212 L234 F236 L243	V192-A202 WeakPolarHBondContact CA-O 3.02Å; V192-A202 WeakPolarHBondContact CG2-O 3.35Å; D193-A202 PolarHBondContact N-O 2.9Å; D193-A202 PolarHBondContact O-N 2.94Å; A202-K211 CarbonylContact C-O 3.53Å; A202-K211 WeakPolarHBondContact CA-O 3.01Å; A202-I212 HydrophobicContact CB-CD1 4.44Å; A202-I212 HydrophobicContact CB-CG1 3.98Å; A202-L234 HydrophobicContact CB-CD1 3.91Å; A202-F236 HydrophobicContact CB-CE1 4.28Å; A202-F236 HydrophobicContact CB-CE2 3.61Å; A202-F236 HydrophobicContact CB-CZ 3.29Å; A202-L243 HydrophobicContact CB-CD2 4.26Å
203	A	95.7	Very high	94.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	136.2	172.2	0	0	0	0	0	112	I168 A189 Y191 V192 V210 K211 W213	I168-A203 HydrophobicContact CD1-CB 3.27Å; A189-A203 HydrophobicContact CB-CB 4.15Å; Y191-A203 WeakPolarHBondContact O-CA 3.49Å; V192-A203 HydrophobicContact CG2-CB 4.41Å; A203-V210 WeakPolarHBondContact O-CA 3.45Å; A203-K211 PolarHBondContact N-O 3.08Å; A203-K211 PolarHBondContact O-N 2.82Å; A203-K211 VanDerWaalsContact O-N 3.08Å; A203-W213 HydrophobicContact CB-CH2 3.76Å; A203-W213 HydrophobicContact CB-CZ3 3.48Å; A203-W213 VanDerWaalsContact CB-CZ3 3.48Å
204	A	94.9	Very high	94.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	128.1	171.6	0	0	0	0	0	108.2	A189 S190 Y191 V231 L234	A189-A204 CarbonylContact C-O 3.58Å; A189-A204 WeakPolarHBondContact CA-O 3.38Å; S190-A204 PolarHBondContact N-O 3.47Å; S190-A204 PolarHBondContact OG-O 2.91Å; S190-A204 VanDerWaalsContact OG-O 3.13Å; Y191-A204 PolarHBondContact O-N 3.02Å; A204-V231 HydrophobicContact CB-CB 3.78Å; A204-V231 HydrophobicContact CB-CG1 3.46Å; A204-V231 VanDerWaalsContact CB-CG1 3.46Å; A204-L234 HydrophobicContact CB-CB 4.5Å; A204-L234 HydrophobicContact CB-CD2 3.53Å
205	S	93.9	Very high	94.3	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.7	-175.8	-178.9	0	0	0	0	111.1	Y188 D207 T208 S209 V231	Y188-S205 WeakPolarHBondContact O-CA 3.39Å; S205-D207 WeakPolarHBondContact CB-OD1 3.29Å; S205-D207 PolarHBondContact O-N 2.78Å; S205-D207 PolarHBondContact OG-N 3.43Å; S205-D207 PolarHBondContact OG-OD1 3.13Å; S205-D207 PolarHBondContact OG-OD2 3.31Å; S205-T208 PolarHBondContact O-N 2.93Å; S205-S209 WeakPolarHBondContact CB-O 3.22Å; S205-S209 PolarHBondContact N-O 3.43Å; S205-S209 VanDerWaalsContact N-O 3.09Å; S205-V231 PolarHBondContact O-N 2.9Å
206	T	93.2	Very high	94.2	Very high	39 Å²	39	30 Å²	30	24%	0.239	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-12.3	173.7	60.9	0	0	0	0	113.1	Y188 T208 A230	Y188-T206 HydrophobicContact CD1-CG2 4.42Å; Y188-T206 HydrophobicContact CD2-CG2 3.74Å; Y188-T206 HydrophobicContact CE1-CG2 4.07Å; Y188-T206 HydrophobicContact CE2-CG2 3.32Å; Y188-T206 HydrophobicContact CG-CG2 4.27Å; Y188-T206 PolarHBondContact N-OG1 3.47Å; Y188-T206 PolarHBondContact O-N 3.41Å; Y188-T206 PolarHBondContact O-OG1 3.42Å; T206-T208 PolarHBondContact O-N 2.82Å; T206-T208 VanDerWaalsContact O-N 3.14Å; T206-A230 HydrophobicContact CG2-CB 4.32Å
207	D	91.2	Very high	94.2	Very high	39 Å²	39	30.6 Å²	30.6	21%	0.209	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	21.9	172.5	64.1	14.2	0	0	0	113.1	A186 G187 S205 S209	A186-D207 HydrophobicContact CB-CB 4.09Å; A186-D207 PolarHBondContact N-OD2 2.9Å; G187-D207 PolarHBondContact N-OD2 3.34Å; S205-D207 WeakPolarHBondContact CB-OD1 3.29Å; S205-D207 PolarHBondContact O-N 2.78Å; S205-D207 PolarHBondContact OG-N 3.43Å; S205-D207 PolarHBondContact OG-OD1 3.13Å; S205-D207 PolarHBondContact OG-OD2 3.31Å; D207-S209 PolarHBondContact O-N 3.48Å; D207-S209 WeakPolarHBondContact OD1-CB 3.5Å; D207-S209 PolarHBondContact OD1-N 3.12Å; D207-S209 VanDerWaalsContact OD1-N 3.15Å; D207-S209 PolarHBondContact OD1-OG 2.76Å
208	T	93.2	Very high	94.2	Very high	44 Å²	44	30.4 Å²	30.4	27%	0.27	16%	0.159	S	C	.	.	S	Bend	trans	66.3	-1.6	179.9	77.3	0	0	0	0	115.3	S205 T206 H227 G229	S205-T208 PolarHBondContact O-N 2.93Å; T206-T208 PolarHBondContact O-N 2.82Å; T206-T208 VanDerWaalsContact O-N 3.14Å; T208-H227 VanDerWaalsContact CB-O 3.27Å; T208-H227 WeakPolarHBondContact CB-O 3.49Å; T208-H227 PolarHBondContact O-N 3.4Å; T208-H227 PolarHBondContact OG1-O 2.98Å; T208-G229 WeakPolarHBondContact CA-O 3.19Å; T208-G229 WeakPolarHBondContact CB-O 3.44Å; T208-G229 WeakPolarHBondContact CG2-O 3.35Å
209	S	93	Very high	94.1	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.021	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	154.2	-177.8	79	0	0	0	0	112.9	S205 D207 K211 H223 Y224	S205-S209 WeakPolarHBondContact CB-O 3.22Å; S205-S209 PolarHBondContact N-O 3.43Å; S205-S209 VanDerWaalsContact N-O 3.09Å; D207-S209 PolarHBondContact O-N 3.48Å; D207-S209 WeakPolarHBondContact OD1-CB 3.5Å; D207-S209 PolarHBondContact OD1-N 3.12Å; D207-S209 VanDerWaalsContact OD1-N 3.15Å; D207-S209 PolarHBondContact OD1-OG 2.76Å; S209-K211 WeakPolarHBondContact OG-CE 3.5Å; S209-H223 WeakPolarHBondContact CB-NE2 3.49Å; S209-Y224 CarbonylContact C-O 3.58Å; S209-Y224 VanDerWaalsContact CA-O 3.27Å; S209-Y224 WeakPolarHBondContact CA-O 3.36Å
210	V	95.3	Very high	94.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.7	164.6	179.3	0	0	0	0	108.3	A203 Y224 V231 L243 T245	A203-V210 WeakPolarHBondContact O-CA 3.45Å; V210-Y224 PolarHBondContact N-O 3.39Å; V210-Y224 PolarHBondContact O-N 2.98Å; V210-V231 HydrophobicContact CG2-CB 4.47Å; V210-V231 HydrophobicContact CG2-CG1 4.05Å; V210-V231 HydrophobicContact CG2-CG2 4.07Å; V210-L243 HydrophobicContact CG1-CD2 3.8Å; V210-T245 HydrophobicContact CG2-CG2 3.75Å
211	K	95	Very high	94.1	Very high	21 Å²	21	40.5 Å²	40.5	9%	0.091	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.2	-177.8	-71.1	179.7	-170	-163.1	0	109.7	E184 A202 A203 S209 W213 M220 Q222	E184-K211 PolarHBondContact O-NZ 2.95Å; A202-K211 CarbonylContact C-O 3.53Å; A202-K211 WeakPolarHBondContact CA-O 3.01Å; A203-K211 PolarHBondContact N-O 3.08Å; A203-K211 PolarHBondContact O-N 2.82Å; A203-K211 VanDerWaalsContact O-N 3.08Å; S209-K211 WeakPolarHBondContact OG-CE 3.5Å; K211-W213 HydrophobicContact CB-CE3 4.48Å; K211-W213 HydrophobicContact CB-CH2 3.2Å; K211-W213 HydrophobicContact CB-CZ2 3.42Å; K211-W213 VanDerWaalsContact CB-CZ2 3.42Å; K211-W213 HydrophobicContact CB-CZ3 3.8Å; K211-W213 HydrophobicContact CD-CH2 4.28Å; K211-W213 HydrophobicContact CD-CZ2 3.88Å; K211-W213 HydrophobicContact CG-CH2 4.32Å; K211-W213 HydrophobicContact CG-CZ2 4.27Å; K211-W213 WeakPolarHBondContact O-CZ3 3.38Å; K211-M220 HydrophobicContact CB-SD 4.47Å; K211-M220 HydrophobicContact CD-SD 3.92Å; K211-M220 HydrophobicContact CG-SD 4.09Å; K211-Q222 WeakPolarHBondContact CA-O 3.35Å
212	I	95.6	Very high	93.9	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.026	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.7	179	-54.7	-172	0	0	0	108.8	C200 I201 A202 M220 L221 Q222 Y224 L243 L257	C200-I212 HydrophobicContact CB-CG2 4.01Å; I201-I212 CarbonylContact O-C 3.58Å; I201-I212 VanDerWaalsContact O-CA 3.26Å; I201-I212 WeakPolarHBondContact O-CA 3.15Å; I201-I212 WeakPolarHBondContact O-CG2 3.22Å; A202-I212 HydrophobicContact CB-CD1 4.44Å; A202-I212 HydrophobicContact CB-CG1 3.98Å; I212-M220 CarbonylContact O-C 3.59Å; I212-L221 PolarHBondContact O-N 3.36Å; I212-Q222 HydrophobicContact CB-CB 4.27Å; I212-Q222 PolarHBondContact N-O 3.31Å; I212-Q222 PolarHBondContact O-N 3.4Å; I212-Y224 HydrophobicContact CD1-CE2 3.93Å; I212-Y224 HydrophobicContact CG1-CE2 4.4Å; I212-L243 HydrophobicContact CD1-CD2 4.38Å; I212-L257 HydrophobicContact CD1-CD2 3.42Å; I212-L257 VanDerWaalsContact CD1-CD2 3.42Å
213	W	95.4	Very high	93.8	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.011	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.6	176.9	-55.7	-101.5	0	0	0	110.8	I168 F182 H185 C200 I201 A203 K211 K219	I168-W213 HydrophobicContact CD1-CH2 3.67Å; I168-W213 HydrophobicContact CD1-CZ2 4.4Å; I168-W213 HydrophobicContact CD1-CZ3 3.81Å; F182-W213 HydrophobicContact CD1-CB 4.37Å; F182-W213 AromaticContact CD1-CD1 3.67Å; F182-W213 AromaticContact CD1-CG 3.98Å; F182-W213 HydrophobicContact CD1-CG 3.98Å; F182-W213 HydrophobicContact CE1-CB 3.95Å; F182-W213 HydrophobicContact CE1-CG 4.06Å; F182-W213 HydrophobicContact CZ-CB 4.31Å; H185-W213 AromaticContact CE1-CH2 3.26Å; H185-W213 WeakPolarHBondContact CE1-CH2 3.38Å; H185-W213 AromaticContact CE1-CZ2 3.57Å; H185-W213 AromaticContact NE2-CH2 3.23Å; H185-W213 WeakPolarHBondContact NE2-CH2 3.34Å; H185-W213 AromaticContact NE2-CZ2 3.29Å; H185-W213 VanDerWaalsContact NE2-CZ2 3.29Å; H185-W213 WeakPolarHBondContact NE2-CZ2 3.27Å; C200-W213 CarbonylContact C-O 3.57Å; C200-W213 WeakPolarHBondContact CA-O 3.39Å; C200-W213 WeakPolarHBondContact CB-O 3.24Å; I201-W213 HydrophobicContact CD1-CB 4.31Å; I201-W213 HydrophobicContact CD1-CE3 4.06Å; I201-W213 HydrophobicContact CG1-CB 3.95Å; I201-W213 HydrophobicContact CG1-CE3 4.01Å; I201-W213 PolarHBondContact N-O 2.95Å; I201-W213 PolarHBondContact O-N 3.35Å; A203-W213 HydrophobicContact CB-CH2 3.76Å; A203-W213 HydrophobicContact CB-CZ3 3.48Å; A203-W213 VanDerWaalsContact CB-CZ3 3.48Å; K211-W213 HydrophobicContact CB-CE3 4.48Å; K211-W213 HydrophobicContact CB-CH2 3.2Å; K211-W213 HydrophobicContact CB-CZ2 3.42Å; K211-W213 VanDerWaalsContact CB-CZ2 3.42Å; K211-W213 HydrophobicContact CB-CZ3 3.8Å; K211-W213 HydrophobicContact CD-CH2 4.28Å; K211-W213 HydrophobicContact CD-CZ2 3.88Å; K211-W213 HydrophobicContact CG-CH2 4.32Å; K211-W213 HydrophobicContact CG-CZ2 4.27Å; K211-W213 WeakPolarHBondContact O-CZ3 3.38Å; W213-K219 WeakPolarHBondContact CA-O 3.38Å
214	D	95.4	Very high	93.7	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.107	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	128.9	166.2	178.8	2.2	0	0	0	109.2	R216 T217 H218 K219 L221	D214-R216 VanDerWaalsContact C-N 3.33Å; D214-R216 PolarHBondContact OD1-N 2.9Å; D214-T217 VanDerWaalsContact CB-OG1 3.27Å; D214-T217 WeakPolarHBondContact CB-OG1 3.35Å; D214-T217 WeakPolarHBondContact OD2-CB 3.26Å; D214-T217 WeakPolarHBondContact OD2-CG2 3.12Å; D214-T217 PolarHBondContact OD2-N 3.06Å; D214-T217 PolarHBondContact OD2-OG1 3.44Å; D214-H218 VanDerWaalsContact O-CA 3.23Å; D214-H218 WeakPolarHBondContact O-CA 3.23Å; D214-H218 PolarHBondContact O-N 3.32Å; D214-K219 PolarHBondContact N-O 3.31Å; D214-L221 HydrophobicContact CB-CD1 3.91Å; D214-L221 HydrophobicContact CB-CD2 4Å; D214-L221 HydrophobicContact CB-CG 3.9Å
215	I	94.4	Very high	93.6	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.092	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-34.5	-179.7	-66.7	160.2	0	0	0	111.1	L158 L170 F194 G198 T199 I201 H218	L158-I215 HydrophobicContact CD1-CG2 4.12Å; L170-I215 HydrophobicContact CD2-CG2 3.72Å; F194-I215 HydrophobicContact CD1-CD1 3.7Å; F194-I215 HydrophobicContact CE1-CD1 3.55Å; F194-I215 HydrophobicContact CE1-CG1 4.45Å; G198-I215 WeakPolarHBondContact O-CD1 3.35Å; T199-I215 WeakPolarHBondContact O-CB 3.42Å; T199-I215 PolarHBondContact O-N 2.78Å; I201-I215 HydrophobicContact CG1-CG1 4.46Å; I201-I215 HydrophobicContact CG2-CD1 3.94Å; I201-I215 HydrophobicContact CG2-CG1 3.94Å; I215-H218 PolarHBondContact O-CE1 3.33Å; I215-H218 PolarHBondContact O-ND1 3.01Å; I215-H218 VanDerWaalsContact O-ND1 3.14Å
216	R	92.8	Very high	93.3	Very high	204 Å²	204	53.9 Å²	53.9	77%	0.77	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-42.1	-173.9	-179.6	178.7	57.3	105.5	5.8	112.2	D214	D214-R216 VanDerWaalsContact C-N 3.33Å; D214-R216 PolarHBondContact OD1-N 2.9Å
217	T	93.2	Very high	93.4	Very high	60 Å²	60	52.6 Å²	52.6	37%	0.368	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-12.7	-179.8	61.7	0	0	0	0	113	D214 K219	D214-T217 VanDerWaalsContact CB-OG1 3.27Å; D214-T217 WeakPolarHBondContact CB-OG1 3.35Å; D214-T217 WeakPolarHBondContact OD2-CB 3.26Å; D214-T217 WeakPolarHBondContact OD2-CG2 3.12Å; D214-T217 PolarHBondContact OD2-N 3.06Å; D214-T217 PolarHBondContact OD2-OG1 3.44Å; T217-K219 PolarHBondContact O-N 2.94Å
218	H	92.4	Very high	93.5	Very high	66 Å²	66	55.7 Å²	55.7	31%	0.306	28%	0.281	S	S	.	.			trans	56.9	23	-175.2	-55.2	-63.8	0	0	0	114	H180 F182 D214 I215	H180-H218 AromaticContact CD2-CG 3.98Å; H180-H218 AromaticContact CD2-ND1 3.68Å; H180-H218 AromaticContact CG-CE1 3.9Å; H180-H218 AromaticContact CG-CG 3.83Å; H180-H218 AromaticContact CG-ND1 3.47Å; H180-H218 AromaticContact ND1-CG 3.88Å; H180-H218 AromaticContact ND1-ND1 3.98Å; F182-H218 HydrophobicContact CE1-CB 4.15Å; F182-H218 AromaticContact CZ-ND1 3.95Å; D214-H218 VanDerWaalsContact O-CA 3.23Å; D214-H218 WeakPolarHBondContact O-CA 3.23Å; D214-H218 PolarHBondContact O-N 3.32Å; I215-H218 PolarHBondContact O-CE1 3.33Å; I215-H218 PolarHBondContact O-ND1 3.01Å; I215-H218 VanDerWaalsContact O-ND1 3.14Å
219	K	92.2	Very high	93.6	Very high	148 Å²	148	54.4 Å²	54.4	64%	0.643	28%	0.276	S	S	*	.			trans	-103.2	146.5	179	-68.9	-175	-179.8	-176.3	0	110.7	W213 D214 T217 L221	W213-K219 WeakPolarHBondContact CA-O 3.38Å; D214-K219 PolarHBondContact N-O 3.31Å; T217-K219 PolarHBondContact O-N 2.94Å; K219-L221 PolarHBondContact O-N 2.79Å
220	M	93.4	Very high	93.6	Very high	90 Å²	90	55.5 Å²	55.5	44%	0.443	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	124.9	168.5	-172.9	175.2	67.7	0	0	108.5	K211 I212 H223	K211-M220 HydrophobicContact CB-SD 4.47Å; K211-M220 HydrophobicContact CD-SD 3.92Å; K211-M220 HydrophobicContact CG-SD 4.09Å; I212-M220 CarbonylContact O-C 3.59Å; M220-H223 HydrophobicContact CE-CB 4.26Å; M220-H223 HydrophobicContact SD-CB 4.2Å
221	L	93	Very high	93.7	Very high	91 Å²	91	55.5 Å²	55.5	48%	0.476	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-48.9	177.6	-66.2	-179.3	0	0	0	111	I212 D214 K219	I212-L221 PolarHBondContact O-N 3.36Å; D214-L221 HydrophobicContact CB-CD1 3.91Å; D214-L221 HydrophobicContact CB-CD2 4Å; D214-L221 HydrophobicContact CB-CG 3.9Å; K219-L221 PolarHBondContact O-N 2.79Å
222	Q	92.9	Very high	93.7	Very high	56 Å²	56	56.6 Å²	56.6	26%	0.262	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	145.5	-171	-67.6	169.6	-29.5	0	0	110.5	K211 I212 Y224 L257	K211-Q222 WeakPolarHBondContact CA-O 3.35Å; I212-Q222 HydrophobicContact CB-CB 4.27Å; I212-Q222 PolarHBondContact N-O 3.31Å; I212-Q222 PolarHBondContact O-N 3.4Å; Q222-Y224 HydrophobicContact CB-CD2 4.31Å; Q222-Y224 HydrophobicContact CB-CE2 3.57Å; Q222-Y224 HydrophobicContact CG-CE2 4.37Å; Q222-Y224 PolarHBondContact NE2-OH 2.81Å; Q222-Y224 PolarHBondContact OE1-OH 2.79Å; Q222-L257 PolarHBondContact NE2-O 3.09Å
223	H	93.6	Very high	93.6	Very high	91 Å²	91	56.4 Å²	56.4	42%	0.421	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	121.4	177.6	169.5	-115	0	0	0	109.2	S209 M220	S209-H223 WeakPolarHBondContact CB-NE2 3.49Å; M220-H223 HydrophobicContact CE-CB 4.26Å; M220-H223 HydrophobicContact SD-CB 4.2Å
224	Y	93.8	Very high	93.6	Very high	18 Å²	18	56.3 Å²	56.3	7%	0.071	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	100	-172.9	-62.9	-71.8	0	0	0	111	S209 V210 I212 Q222 V226 L255 L257 G260	S209-Y224 CarbonylContact C-O 3.58Å; S209-Y224 VanDerWaalsContact CA-O 3.27Å; S209-Y224 WeakPolarHBondContact CA-O 3.36Å; V210-Y224 PolarHBondContact N-O 3.39Å; V210-Y224 PolarHBondContact O-N 2.98Å; I212-Y224 HydrophobicContact CD1-CE2 3.93Å; I212-Y224 HydrophobicContact CG1-CE2 4.4Å; Q222-Y224 HydrophobicContact CB-CD2 4.31Å; Q222-Y224 HydrophobicContact CB-CE2 3.57Å; Q222-Y224 HydrophobicContact CG-CE2 4.37Å; Q222-Y224 PolarHBondContact NE2-OH 2.81Å; Q222-Y224 PolarHBondContact OE1-OH 2.79Å; Y224-V226 VanDerWaalsContact C-N 3.31Å; Y224-V226 VanDerWaalsContact CB-CG2 3.43Å; Y224-V226 HydrophobicContact CG-CG2 4.44Å; Y224-V226 PolarHBondContact O-N 3.27Å; Y224-V226 VanDerWaalsContact O-N 3.13Å; Y224-L255 HydrophobicContact CD2-CD1 4.12Å; Y224-L255 HydrophobicContact CG-CD1 4.11Å; Y224-L257 HydrophobicContact CE2-CD2 4.3Å; Y224-G260 WeakPolarHBondContact CE1-O 3.48Å; Y224-G260 VanDerWaalsContact OH-CA 3.3Å; Y224-G260 WeakPolarHBondContact OH-CA 3.42Å
225	P	92.3	Very high	93.7	Very high	93 Å²	93	56.1 Å²	56.1	60%	0.604	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	72.9	172.5	34.1	-33.4	0	0	0	110
226	V	89	Confident	93.7	Very high	22 Å²	22	55.8 Å²	55.8	13%	0.133	29%	0.29	C	S	.	.			trans	-97.7	-30.7	-166.8	-154	0	0	0	0	112.7	Y224 K253 L255 L262	Y224-V226 VanDerWaalsContact C-N 3.31Å; Y224-V226 VanDerWaalsContact CB-CG2 3.43Å; Y224-V226 HydrophobicContact CG-CG2 4.44Å; Y224-V226 PolarHBondContact O-N 3.27Å; Y224-V226 VanDerWaalsContact O-N 3.13Å; V226-K253 HydrophobicContact CB-CD 4.12Å; V226-K253 HydrophobicContact CG1-CB 4.32Å; V226-K253 HydrophobicContact CG1-CD 3.26Å; V226-K253 HydrophobicContact CG1-CG 4.39Å; V226-K253 PolarHBondContact O-NZ 3.39Å; V226-L255 HydrophobicContact CG1-CD2 4.07Å; V226-L255 HydrophobicContact CG2-CD1 4.24Å; V226-L255 HydrophobicContact CG2-CD2 3.85Å; V226-L262 HydrophobicContact CG1-CB 4.34Å; V226-L262 HydrophobicContact CG1-CD1 3.85Å; V226-L262 HydrophobicContact CG1-CD2 3.81Å; V226-L262 HydrophobicContact CG1-CG 4.22Å
227	H	94.4	Very high	93.8	Very high	12 Å²	12	46.2 Å²	46.2	6%	0.056	25%	0.254	C	S	.	.			trans	-100.5	159.2	-172.6	-75.9	-73.2	0	0	0	111.5	T208 V231 T245 S247 D249 T251 K253	T208-H227 VanDerWaalsContact CB-O 3.27Å; T208-H227 WeakPolarHBondContact CB-O 3.49Å; T208-H227 PolarHBondContact O-N 3.4Å; T208-H227 PolarHBondContact OG1-O 2.98Å; H227-V231 HydrophobicContact CB-CG2 4.17Å; H227-T245 PolarHBondContact NE2-OG1 3.49Å; H227-S247 WeakPolarHBondContact CE1-CB 3.33Å; H227-S247 VanDerWaalsContact CG-CB 3.43Å; H227-S247 WeakPolarHBondContact ND1-CB 3.23Å; H227-S247 PolarHBondContact ND1-OG 2.68Å; H227-D249 VanDerWaalsContact CB-OD2 3.28Å; H227-D249 WeakPolarHBondContact CB-OD2 3.3Å; H227-D249 IonicContact CG-OD2 3.56Å; H227-D249 IonicContact ND1-OD1 3.14Å; H227-D249 IonicContact ND1-OD2 3.12Å; H227-D249 PolarHBondContact ND1-OD2 3.33Å; H227-T251 PolarHBondContact CE1-OG1 2.55Å; H227-T251 PolarHBondContact ND1-OG1 3.49Å; H227-K253 VanDerWaalsContact CE1-CG 3.49Å; H227-K253 WeakPolarHBondContact CE1-CG 3.14Å
228	S	93.8	Very high	93.8	Very high	105 Å²	105	45.6 Å²	45.6	73%	0.734	25%	0.251	S	S	*	.	S	Bend	trans	-94.7	-14.2	170	56.3	0	0	0	0	112.1	D249	S228-D249 PolarHBondContact N-OD2 3.45Å; S228-D249 VanDerWaalsContact N-OD2 3.16Å; S228-D249 VanDerWaalsContact OG-CB 3.24Å; S228-D249 WeakPolarHBondContact OG-CB 3.37Å
229	G	93.8	Very high	93.6	Very high	16 Å²	16	44.6 Å²	44.6	17%	0.165	26%	0.258	C	S	.	.	S	Bend	trans	-120.5	175.7	177.6	0	0	0	0	0	113.1	T208 V231 S247	T208-G229 WeakPolarHBondContact CA-O 3.19Å; T208-G229 WeakPolarHBondContact CB-O 3.44Å; T208-G229 WeakPolarHBondContact CG2-O 3.35Å; G229-V231 PolarHBondContact O-N 3.03Å; G229-S247 PolarHBondContact O-OG 3.12Å
230	A	94.3	Very high	93.6	Very high	27 Å²	27	37.8 Å²	37.8	22%	0.223	23%	0.23	C	C	.	.			trans	-62.9	131	176.6	0	0	0	0	0	110.9	T206 S247 S248	T206-A230 HydrophobicContact CG2-CB 4.32Å; A230-S247 WeakPolarHBondContact O-CA 3.39Å; A230-S247 PolarHBondContact O-OG 3.37Å; A230-S248 PolarHBondContact O-N 2.82Å; A230-S248 PolarHBondContact O-OG 2.54Å; A230-S248 VanDerWaalsContact O-OG 3.04Å
231	V	96	Very high	93.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	122.6	175.3	-169.4	0	0	0	0	107.7	S190 A204 S205 V210 H227 G229 A246	S190-V231 WeakPolarHBondContact CB-O 3.48Å; S190-V231 PolarHBondContact OG-O 3.44Å; A204-V231 HydrophobicContact CB-CB 3.78Å; A204-V231 HydrophobicContact CB-CG1 3.46Å; A204-V231 VanDerWaalsContact CB-CG1 3.46Å; S205-V231 PolarHBondContact O-N 2.9Å; V210-V231 HydrophobicContact CG2-CB 4.47Å; V210-V231 HydrophobicContact CG2-CG1 4.05Å; V210-V231 HydrophobicContact CG2-CG2 4.07Å; H227-V231 HydrophobicContact CB-CG2 4.17Å; G229-V231 PolarHBondContact O-N 3.03Å; V231-A246 CarbonylContact C-O 3.58Å; V231-A246 WeakPolarHBondContact CA-O 3.48Å; V231-A246 WeakPolarHBondContact CG1-O 3.21Å
232	N	95.3	Very high	93.5	Very high	44 Å²	44	33.5 Å²	33.5	24%	0.235	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-29.9	-173.3	-65.7	-40.7	0	0	0	113	A246 S248 V273 T274	N232-A246 PolarHBondContact N-O 3.5Å; N232-S248 PolarHBondContact ND2-N 3.15Å; N232-S248 PolarHBondContact ND2-OG 3.48Å; N232-S248 PolarHBondContact OD1-OG 3.04Å; N232-V273 PolarHBondContact ND2-O 3.24Å; N232-T274 VanDerWaalsContact CB-O 3.3Å; N232-T274 WeakPolarHBondContact CB-O 3.42Å
233	G	94.1	Very high	93.7	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	156.7	-176.4	0	0	0	0	0	112	A246	G233-A246 PolarHBondContact N-O 3.04Å; G233-A246 PolarHBondContact O-N 3.48Å
234	L	96.1	Very high	93.8	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.5	175.6	70.9	107.8	0	0	0	110.2	Y191 D193 A202 A204 F236 L243 I244	Y191-L234 HydrophobicContact CD1-CD2 3.8Å; Y191-L234 HydrophobicContact CD1-CG 3.64Å; Y191-L234 HydrophobicContact CE1-CG 4.16Å; Y191-L234 VanDerWaalsContact CE1-O 3.23Å; Y191-L234 WeakPolarHBondContact CE1-O 3.5Å; Y191-L234 HydrophobicContact CG-CD2 4.48Å; Y191-L234 WeakPolarHBondContact O-CD2 3.47Å; D193-L234 HydrophobicContact CB-CD1 3.35Å; D193-L234 HydrophobicContact CB-CG 4.29Å; A202-L234 HydrophobicContact CB-CD1 3.91Å; A204-L234 HydrophobicContact CB-CB 4.5Å; A204-L234 HydrophobicContact CB-CD2 3.53Å; L234-F236 HydrophobicContact CD1-CE2 4.28Å; L234-L243 HydrophobicContact CB-CD1 4.41Å; L234-L243 HydrophobicContact CD1-CD1 3.97Å; L234-I244 VanDerWaalsContact CA-O 3.29Å; L234-I244 WeakPolarHBondContact CA-O 3.49Å
235	S	96.2	Very high	93.9	Very high	16 Å²	16	25.6 Å²	25.6	11%	0.112	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	132.3	173.5	-178.2	0	0	0	0	110.2	L243 I244 F278	S235-L243 WeakPolarHBondContact O-CD1 3.19Å; S235-I244 PolarHBondContact N-O 3.29Å; S235-I244 WeakPolarHBondContact O-CG2 3.33Å; S235-I244 PolarHBondContact O-N 3Å; S235-F278 WeakPolarHBondContact O-CD2 3.45Å; S235-F278 WeakPolarHBondContact O-CE2 3.08Å; S235-F278 PolarHBondContact OG-N 3.49Å
236	F	96.1	Very high	94.1	Very high	12 Å²	12	21.2 Å²	21.2	5%	0.053	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	144.1	173.1	-73.2	-83.8	0	0	0	111.4	D193 F194 H195 P196 A202 L234 L243 L257 F278	D193-F236 HydrophobicContact CB-CD2 4Å; D193-F236 HydrophobicContact CB-CE2 4.09Å; F194-F236 VanDerWaalsContact C-CE2 3.48Å; F194-F236 WeakPolarHBondContact O-CD2 3.04Å; H195-F236 HydrophobicContact CB-CE1 4.16Å; H195-F236 HydrophobicContact CB-CE2 4.44Å; H195-F236 HydrophobicContact CB-CZ 4.08Å; H195-F236 AromaticContact CD2-CD1 3.8Å; H195-F236 AromaticContact CD2-CE1 3.73Å; P196-F236 HydrophobicContact CG-CB 4.21Å; A202-F236 HydrophobicContact CB-CE1 4.28Å; A202-F236 HydrophobicContact CB-CE2 3.61Å; A202-F236 HydrophobicContact CB-CZ 3.29Å; L234-F236 HydrophobicContact CD1-CE2 4.28Å; F236-L243 HydrophobicContact CD1-CB 4.5Å; F236-L243 HydrophobicContact CD1-CD1 3.73Å; F236-L243 HydrophobicContact CD2-CD1 4.11Å; F236-L243 HydrophobicContact CE1-CD1 3.89Å; F236-L243 HydrophobicContact CE2-CD1 4.24Å; F236-L243 HydrophobicContact CG-CD1 3.88Å; F236-L243 HydrophobicContact CZ-CD1 4.17Å; F236-L257 HydrophobicContact CD1-CD1 3.73Å; F236-L257 HydrophobicContact CE1-CD1 3.51Å; F236-F278 VanDerWaalsContact C-CD2 3.46Å; F236-F278 WeakPolarHBondContact O-CD2 3.33Å
237	H	94.9	Very high	94.5	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.014	14%	0.137	C	C	.	.			trans	-65	141.7	165	-169.4	-97.3	0	0	0	109.7	P196 G239 G240 F242 F278 G282 D302	P196-H237 VanDerWaalsContact CG-O 3.3Å; P196-H237 WeakPolarHBondContact CG-O 3.23Å; H237-G239 PolarHBondContact ND1-N 3.13Å; H237-G239 VanDerWaalsContact ND1-N 3.15Å; H237-G239 PolarHBondContact O-N 3.28Å; H237-G239 VanDerWaalsContact O-N 3.16Å; H237-G240 WeakPolarHBondContact O-CA 3.48Å; H237-G240 PolarHBondContact O-N 3.38Å; H237-F242 HydrophobicContact CB-CB 3.91Å; H237-F242 HydrophobicContact CB-CD2 4.44Å; H237-F242 WeakPolarHBondContact CB-O 3.2Å; H237-F242 PolarHBondContact N-O 3.14Å; H237-F278 HydrophobicContact CB-CD2 4.36Å; H237-F278 HydrophobicContact CB-CE2 4.18Å; H237-F278 HydrophobicContact CB-CZ 4.35Å; H237-F278 AromaticContact CD2-CD1 3.78Å; H237-F278 AromaticContact CD2-CE1 3.71Å; H237-G282 WeakPolarHBondContact NE2-CA 3.37Å; H237-G282 PolarHBondContact NE2-O 2.7Å; H237-D302 IonicContact CE1-OD1 3.37Å; H237-D302 PolarHBondContact CE1-OD1 3.39Å; H237-D302 VanDerWaalsContact CE1-OD1 3.3Å; H237-D302 IonicContact CE1-OD2 3.46Å; H237-D302 IonicContact NE2-OD2 2.81Å
238	P	91.5	Very high	94.6	Very high	47 Å²	47	22 Å²	22	31%	0.305	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-32.9	179	-27.6	36.3	0	0	0	114.1	P196 G240 S279 R280	P196-P238 WeakPolarHBondContact CB-O 3.46Å; P238-G240 PolarHBondContact O-N 3.15Å; P238-S279 WeakPolarHBondContact CG-O 3.48Å; P238-R280 WeakPolarHBondContact CG-O 3.32Å
239	G	89.7	Confident	94.6	Very high	45 Å²	45	18.3 Å²	18.3	46%	0.464	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-11.4	173.7	0	0	0	0	0	115	H237 N241	H237-G239 PolarHBondContact ND1-N 3.13Å; H237-G239 VanDerWaalsContact ND1-N 3.15Å; H237-G239 PolarHBondContact O-N 3.28Å; H237-G239 VanDerWaalsContact O-N 3.16Å; G239-N241 VanDerWaalsContact C-N 3.26Å; G239-N241 PolarHBondContact O-N 2.83Å
240	G	90.8	Very high	94.7	Very high	4 Å²	4	19.6 Å²	19.6	4%	0.041	13%	0.13	C	C	.	.	S	Bend	trans	80.5	-12	176.6	0	0	0	0	0	116.1	H195 H237 P238 L257	H195-G240 WeakPolarHBondContact NE2-CA 3.33Å; H195-G240 PolarHBondContact NE2-O 2.94Å; H237-G240 WeakPolarHBondContact O-CA 3.48Å; H237-G240 PolarHBondContact O-N 3.38Å; P238-G240 PolarHBondContact O-N 3.15Å; G240-L257 WeakPolarHBondContact O-CD1 3.4Å
241	N	91.8	Very high	94.8	Very high	64 Å²	64	19 Å²	19	34%	0.342	12%	0.123	S	C	.	.	S	Bend	trans	-79.2	-24.5	-176.1	-62	-19.7	0	0	0	113.8	G239 L257 V258	G239-N241 VanDerWaalsContact C-N 3.26Å; G239-N241 PolarHBondContact O-N 2.83Å; N241-L257 WeakPolarHBondContact O-CB 3.36Å; N241-L257 PolarHBondContact O-N 3.35Å; N241-V258 HydrophobicContact CB-CG2 4.21Å
242	F	94	Very high	94.8	Very high	27 Å²	27	19.1 Å²	19.1	12%	0.118	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.5	-173.4	-51.3	-70.7	0	0	0	112	H237 I254 L255 L263 F301	H237-F242 HydrophobicContact CB-CB 3.91Å; H237-F242 HydrophobicContact CB-CD2 4.44Å; H237-F242 WeakPolarHBondContact CB-O 3.2Å; H237-F242 PolarHBondContact N-O 3.14Å; F242-I254 HydrophobicContact CB-CG2 4.4Å; F242-L255 VanDerWaalsContact CA-O 3.32Å; F242-L255 WeakPolarHBondContact CA-O 3.33Å; F242-L263 HydrophobicContact CD1-CD1 3.62Å; F242-L263 HydrophobicContact CE1-CD1 3.5Å; F242-F301 HydrophobicContact CD1-CD1 4.41Å; F242-F301 HydrophobicContact CD2-CB 3.69Å; F242-F301 AromaticContact CD2-CD1 3.97Å; F242-F301 HydrophobicContact CD2-CD1 3.97Å; F242-F301 HydrophobicContact CD2-CD2 4.43Å; F242-F301 AromaticContact CD2-CG 3.76Å; F242-F301 HydrophobicContact CD2-CG 3.76Å; F242-F301 HydrophobicContact CE1-CD1 4.34Å; F242-F301 HydrophobicContact CE2-CB 3.55Å; F242-F301 AromaticContact CE2-CD1 3.91Å; F242-F301 HydrophobicContact CE2-CD1 3.91Å; F242-F301 AromaticContact CE2-CG 3.91Å; F242-F301 HydrophobicContact CE2-CG 3.91Å; F242-F301 HydrophobicContact CG-CD1 4.23Å; F242-F301 HydrophobicContact CG-CG 4.31Å; F242-F301 HydrophobicContact CZ-CB 4.42Å; F242-F301 HydrophobicContact CZ-CD1 4.08Å
243	L	95.6	Very high	94.8	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132.4	173.9	-179	70.5	0	0	0	109.3	A202 V210 I212 L234 S235 F236 T245 I254 L255 L257	A202-L243 HydrophobicContact CB-CD2 4.26Å; V210-L243 HydrophobicContact CG1-CD2 3.8Å; I212-L243 HydrophobicContact CD1-CD2 4.38Å; L234-L243 HydrophobicContact CB-CD1 4.41Å; L234-L243 HydrophobicContact CD1-CD1 3.97Å; S235-L243 WeakPolarHBondContact O-CD1 3.19Å; F236-L243 HydrophobicContact CD1-CB 4.5Å; F236-L243 HydrophobicContact CD1-CD1 3.73Å; F236-L243 HydrophobicContact CD2-CD1 4.11Å; F236-L243 HydrophobicContact CE1-CD1 3.89Å; F236-L243 HydrophobicContact CE2-CD1 4.24Å; F236-L243 HydrophobicContact CG-CD1 3.88Å; F236-L243 HydrophobicContact CZ-CD1 4.17Å; L243-T245 HydrophobicContact CD2-CG2 4.32Å; L243-T245 HydrophobicContact CG-CG2 4.31Å; L243-I254 CarbonylContact O-C 3.55Å; L243-I254 WeakPolarHBondContact O-CA 3.33Å; L243-L255 HydrophobicContact CB-CB 4.4Å; L243-L255 HydrophobicContact CD2-CD1 4.31Å; L243-L255 PolarHBondContact N-O 3.03Å; L243-L255 PolarHBondContact O-N 2.74Å; L243-L257 HydrophobicContact CB-CD1 4.15Å; L243-L257 HydrophobicContact CB-CD2 3.93Å; L243-L257 HydrophobicContact CB-CG 4.17Å; L243-L257 HydrophobicContact CD2-CD2 4.4Å
244	I	96.1	Very high	94.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	138.7	172.3	-164.1	164.6	0	0	0	110.5	L234 S235 M252 K253 I254 V276 F278 F285	L234-I244 VanDerWaalsContact CA-O 3.29Å; L234-I244 WeakPolarHBondContact CA-O 3.49Å; S235-I244 PolarHBondContact N-O 3.29Å; S235-I244 WeakPolarHBondContact O-CG2 3.33Å; S235-I244 PolarHBondContact O-N 3Å; I244-M252 HydrophobicContact CD1-CE 3.59Å; I244-M252 HydrophobicContact CG1-CE 4.34Å; I244-K253 CarbonylContact C-O 3.58Å; I244-K253 WeakPolarHBondContact CA-O 3.4Å; I244-I254 HydrophobicContact CB-CG1 4.32Å; I244-I254 HydrophobicContact CD1-CD1 4.01Å; I244-I254 HydrophobicContact CD1-CG1 3.86Å; I244-I254 HydrophobicContact CG1-CG1 3.83Å; I244-V276 HydrophobicContact CB-CG2 4.25Å; I244-V276 HydrophobicContact CD1-CG2 3.69Å; I244-V276 HydrophobicContact CG1-CG2 3.81Å; I244-V276 HydrophobicContact CG2-CB 4.28Å; I244-V276 HydrophobicContact CG2-CG1 3.87Å; I244-V276 HydrophobicContact CG2-CG2 3.43Å; I244-V276 VanDerWaalsContact CG2-CG2 3.43Å; I244-F278 HydrophobicContact CB-CD2 4.36Å; I244-F278 HydrophobicContact CB-CE2 3.52Å; I244-F278 HydrophobicContact CB-CZ 3.86Å; I244-F278 HydrophobicContact CG2-CD2 3.61Å; I244-F278 HydrophobicContact CG2-CE2 3.27Å; I244-F278 HydrophobicContact CG2-CZ 3.96Å; I244-F285 HydrophobicContact CD1-CB 4.47Å; I244-F285 HydrophobicContact CD1-CD2 3.34Å; I244-F285 HydrophobicContact CD1-CE2 3.54Å; I244-F285 HydrophobicContact CD1-CG 3.9Å; I244-F285 HydrophobicContact CD1-CZ 4.26Å
245	T	96.8	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	138.5	-176.5	60	0	0	0	0	109.7	V210 H227 L243 M252 K253 L255	V210-T245 HydrophobicContact CG2-CG2 3.75Å; H227-T245 PolarHBondContact NE2-OG1 3.49Å; L243-T245 HydrophobicContact CD2-CG2 4.32Å; L243-T245 HydrophobicContact CG-CG2 4.31Å; T245-M252 CarbonylContact O-C 3.53Å; T245-M252 WeakPolarHBondContact O-CA 3.42Å; T245-K253 PolarHBondContact N-O 3.14Å; T245-K253 PolarHBondContact O-N 3.35Å; T245-K253 PolarHBondContact OG1-O 3.04Å; T245-L255 HydrophobicContact CG2-CD1 4.05Å
246	A	96.6	Very high	94.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.4	176.4	0	0	0	0	0	109.8	V231 N232 G233 V273 V276	V231-A246 CarbonylContact C-O 3.58Å; V231-A246 WeakPolarHBondContact CA-O 3.48Å; V231-A246 WeakPolarHBondContact CG1-O 3.21Å; N232-A246 PolarHBondContact N-O 3.5Å; G233-A246 PolarHBondContact N-O 3.04Å; G233-A246 PolarHBondContact O-N 3.48Å; A246-V273 HydrophobicContact CB-CB 3.99Å; A246-V273 HydrophobicContact CB-CG1 3.59Å; A246-V276 HydrophobicContact CB-CB 3.98Å; A246-V276 HydrophobicContact CB-CG1 3.83Å
247	S	97	Very high	94.4	Very high	0 Å²	0	19 Å²	19	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157	-173.8	175	0	0	0	0	113.3	H227 G229 A230 D249 S250 T251 V273	H227-S247 WeakPolarHBondContact CE1-CB 3.33Å; H227-S247 VanDerWaalsContact CG-CB 3.43Å; H227-S247 WeakPolarHBondContact ND1-CB 3.23Å; H227-S247 PolarHBondContact ND1-OG 2.68Å; G229-S247 PolarHBondContact O-OG 3.12Å; A230-S247 WeakPolarHBondContact O-CA 3.39Å; A230-S247 PolarHBondContact O-OG 3.37Å; S247-D249 VanDerWaalsContact CB-OD1 3.23Å; S247-D249 WeakPolarHBondContact CB-OD1 3.36Å; S247-D249 PolarHBondContact O-N 2.81Å; S247-D249 PolarHBondContact OG-N 2.9Å; S247-D249 PolarHBondContact OG-OD1 3.04Å; S247-D249 PolarHBondContact OG-OD2 3.32Å; S247-S250 PolarHBondContact O-N 2.88Å; S247-T251 PolarHBondContact N-O 3Å; S247-V273 CarbonylContact C-O 3.57Å; S247-V273 PolarHBondContact O-N 2.84Å
248	S	95.8	Very high	94.1	Very high	52 Å²	52	23.9 Å²	23.9	36%	0.364	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.5	172.6	-54.5	0	0	0	0	113.2	A230 N232 S250	A230-S248 PolarHBondContact O-N 2.82Å; A230-S248 PolarHBondContact O-OG 2.54Å; A230-S248 VanDerWaalsContact O-OG 3.04Å; N232-S248 PolarHBondContact ND2-N 3.15Å; N232-S248 PolarHBondContact ND2-OG 3.48Å; N232-S248 PolarHBondContact OD1-OG 3.04Å; S248-S250 PolarHBondContact O-N 3.22Å
249	D	95.1	Very high	94	Very high	26 Å²	26	27 Å²	27	14%	0.139	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	11.6	174.3	64.8	22.1	0	0	0	114.3	H227 S228 S247 T251	H227-D249 VanDerWaalsContact CB-OD2 3.28Å; H227-D249 WeakPolarHBondContact CB-OD2 3.3Å; H227-D249 IonicContact CG-OD2 3.56Å; H227-D249 IonicContact ND1-OD1 3.14Å; H227-D249 IonicContact ND1-OD2 3.12Å; H227-D249 PolarHBondContact ND1-OD2 3.33Å; S228-D249 PolarHBondContact N-OD2 3.45Å; S228-D249 VanDerWaalsContact N-OD2 3.16Å; S228-D249 VanDerWaalsContact OG-CB 3.24Å; S228-D249 WeakPolarHBondContact OG-CB 3.37Å; S247-D249 VanDerWaalsContact CB-OD1 3.23Å; S247-D249 WeakPolarHBondContact CB-OD1 3.36Å; S247-D249 PolarHBondContact O-N 2.81Å; S247-D249 PolarHBondContact OG-N 2.9Å; S247-D249 PolarHBondContact OG-OD1 3.04Å; S247-D249 PolarHBondContact OG-OD2 3.32Å; D249-T251 VanDerWaalsContact CG-OG1 3.28Å; D249-T251 PolarHBondContact O-N 3.06Å; D249-T251 WeakPolarHBondContact OD1-CA 3.24Å; D249-T251 WeakPolarHBondContact OD1-CB 3.36Å; D249-T251 PolarHBondContact OD1-N 3Å; D249-T251 PolarHBondContact OD1-OG1 3.29Å; D249-T251 PolarHBondContact OD2-OG1 3.46Å
250	S	94.7	Very high	93.9	Very high	44 Å²	44	26.3 Å²	26.3	31%	0.308	15%	0.153	S	C	.	.	S	Bend	trans	67.1	2.3	-176	72.5	0	0	0	0	116.4	S247 S248 G271	S247-S250 PolarHBondContact O-N 2.88Å; S248-S250 PolarHBondContact O-N 3.22Å; S250-G271 VanDerWaalsContact CA-O 3.23Å; S250-G271 WeakPolarHBondContact CA-O 3.47Å; S250-G271 WeakPolarHBondContact CB-O 3.35Å
251	T	95.9	Very high	93.9	Very high	13 Å²	13	31.7 Å²	31.7	8%	0.08	18%	0.176	C	C	.	.			trans	-101.6	154.8	178	74.4	0	0	0	0	111.9	H227 S247 D249 T265	H227-T251 PolarHBondContact CE1-OG1 2.55Å; H227-T251 PolarHBondContact ND1-OG1 3.49Å; S247-T251 PolarHBondContact N-O 3Å; D249-T251 VanDerWaalsContact CG-OG1 3.28Å; D249-T251 PolarHBondContact O-N 3.06Å; D249-T251 WeakPolarHBondContact OD1-CA 3.24Å; D249-T251 WeakPolarHBondContact OD1-CB 3.36Å; D249-T251 PolarHBondContact OD1-N 3Å; D249-T251 PolarHBondContact OD1-OG1 3.29Å; D249-T251 PolarHBondContact OD2-OG1 3.46Å; T251-T265 HydrophobicContact CG2-CG2 4.23Å
252	M	95.8	Very high	93.9	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.02	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.7	162.5	-61.5	156.5	55.4	0	0	108.5	I244 T245 L266 V273 V276 F285 S287	I244-M252 HydrophobicContact CD1-CE 3.59Å; I244-M252 HydrophobicContact CG1-CE 4.34Å; T245-M252 CarbonylContact O-C 3.53Å; T245-M252 WeakPolarHBondContact O-CA 3.42Å; M252-L266 HydrophobicContact CB-CB 4.24Å; M252-L266 HydrophobicContact CE-CD1 4.4Å; M252-L266 PolarHBondContact N-O 3.37Å; M252-L266 VanDerWaalsContact N-O 3.09Å; M252-L266 PolarHBondContact O-N 3.3Å; M252-V273 HydrophobicContact CG-CB 4.31Å; M252-V273 HydrophobicContact CG-CG1 3.84Å; M252-V273 HydrophobicContact CG-CG2 4.09Å; M252-V273 HydrophobicContact SD-CG1 4.21Å; M252-V276 HydrophobicContact CE-CG2 3.86Å; M252-F285 HydrophobicContact CE-CD2 3.87Å; M252-F285 HydrophobicContact CE-CE2 3.69Å; M252-S287 VanDerWaalsContact CE-CB 3.46Å; M252-S287 WeakPolarHBondContact SD-CB 3.32Å; M252-S287 PolarHBondContact SD-OG 3.36Å
253	K	95.6	Very high	93.8	Very high	32 Å²	32	34.2 Å²	34.2	14%	0.139	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	142.6	-179.1	-67.8	-172	-176.7	-163.7	0	110.6	V226 H227 I244 T245 L262 Y264 T265	V226-K253 HydrophobicContact CB-CD 4.12Å; V226-K253 HydrophobicContact CG1-CB 4.32Å; V226-K253 HydrophobicContact CG1-CD 3.26Å; V226-K253 HydrophobicContact CG1-CG 4.39Å; V226-K253 PolarHBondContact O-NZ 3.39Å; H227-K253 VanDerWaalsContact CE1-CG 3.49Å; H227-K253 WeakPolarHBondContact CE1-CG 3.14Å; I244-K253 CarbonylContact C-O 3.58Å; I244-K253 WeakPolarHBondContact CA-O 3.4Å; T245-K253 PolarHBondContact N-O 3.14Å; T245-K253 PolarHBondContact O-N 3.35Å; T245-K253 PolarHBondContact OG1-O 3.04Å; K253-L262 HydrophobicContact CB-CD1 3.7Å; K253-L262 HydrophobicContact CD-CD1 3.98Å; K253-L262 HydrophobicContact CD-CD2 4.19Å; K253-L262 HydrophobicContact CG-CD1 4.06Å; K253-Y264 VanDerWaalsContact CA-O 3.31Å; K253-Y264 WeakPolarHBondContact CA-O 3.23Å; K253-T265 HydrophobicContact CD-CG2 4.44Å; K253-T265 HydrophobicContact CG-CG2 4.1Å
254	I	95.2	Very high	93.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.9	177.5	-58.7	-178.2	0	0	0	108	F242 L243 I244 L263 Y264 L266 F285 F301	F242-I254 HydrophobicContact CB-CG2 4.4Å; L243-I254 CarbonylContact O-C 3.55Å; L243-I254 WeakPolarHBondContact O-CA 3.33Å; I244-I254 HydrophobicContact CB-CG1 4.32Å; I244-I254 HydrophobicContact CD1-CD1 4.01Å; I244-I254 HydrophobicContact CD1-CG1 3.86Å; I244-I254 HydrophobicContact CG1-CG1 3.83Å; I254-L263 PolarHBondContact O-N 2.57Å; I254-Y264 PolarHBondContact N-O 3.04Å; I254-Y264 PolarHBondContact O-N 3.15Å; I254-L266 HydrophobicContact CD1-CD1 3.84Å; I254-L266 HydrophobicContact CG1-CD1 4.28Å; I254-F285 HydrophobicContact CD1-CE1 4.25Å; I254-F285 HydrophobicContact CD1-CZ 4.11Å; I254-F301 HydrophobicContact CD1-CE2 3.92Å; I254-F301 HydrophobicContact CD1-CZ 3.5Å; I254-F301 HydrophobicContact CG2-CE1 4.25Å; I254-F301 HydrophobicContact CG2-CE2 4.46Å; I254-F301 HydrophobicContact CG2-CZ 3.85Å
255	L	94.6	Very high	93.5	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.3	-176.5	-54	173.8	0	0	0	109.4	Y224 V226 F242 L243 T245 K261 L262	Y224-L255 HydrophobicContact CD2-CD1 4.12Å; Y224-L255 HydrophobicContact CG-CD1 4.11Å; V226-L255 HydrophobicContact CG1-CD2 4.07Å; V226-L255 HydrophobicContact CG2-CD1 4.24Å; V226-L255 HydrophobicContact CG2-CD2 3.85Å; F242-L255 VanDerWaalsContact CA-O 3.32Å; F242-L255 WeakPolarHBondContact CA-O 3.33Å; L243-L255 HydrophobicContact CB-CB 4.4Å; L243-L255 HydrophobicContact CD2-CD1 4.31Å; L243-L255 PolarHBondContact N-O 3.03Å; L243-L255 PolarHBondContact O-N 2.74Å; T245-L255 HydrophobicContact CG2-CD1 4.05Å; L255-K261 WeakPolarHBondContact CA-O 3.29Å; L255-L262 HydrophobicContact CD2-CB 4.16Å; L255-L262 HydrophobicContact CD2-CD1 3.84Å
256	D	93.1	Very high	93.4	Very high	17 Å²	17	39.9 Å²	39.9	9%	0.091	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.7	164.3	-167.6	-24.4	0	0	0	109	V258 E259 G260 K261 L263	D256-V258 WeakPolarHBondContact OD1-CA 3.18Å; D256-V258 WeakPolarHBondContact OD1-CB 3.29Å; D256-V258 PolarHBondContact OD1-N 2.87Å; D256-E259 HydrophobicContact CB-CB 4.17Å; D256-E259 PolarHBondContact OD1-N 3.13Å; D256-E259 WeakPolarHBondContact OD2-CG 3.48Å; D256-G260 CarbonylContact O-C 3.58Å; D256-G260 WeakPolarHBondContact O-CA 3.33Å; D256-G260 PolarHBondContact O-N 2.93Å; D256-K261 PolarHBondContact N-O 2.87Å; D256-K261 PolarHBondContact O-N 2.68Å; D256-L263 HydrophobicContact CB-CD1 3.78Å; D256-L263 HydrophobicContact CB-CD2 4.04Å; D256-L263 HydrophobicContact CB-CG 3.79Å
257	L	91.8	Very high	93.2	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.099	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-23.5	179	-60.2	-177.9	0	0	0	112.6	I212 Q222 Y224 F236 G240 N241 L243	I212-L257 HydrophobicContact CD1-CD2 3.42Å; I212-L257 VanDerWaalsContact CD1-CD2 3.42Å; Q222-L257 PolarHBondContact NE2-O 3.09Å; Y224-L257 HydrophobicContact CE2-CD2 4.3Å; F236-L257 HydrophobicContact CD1-CD1 3.73Å; F236-L257 HydrophobicContact CE1-CD1 3.51Å; G240-L257 WeakPolarHBondContact O-CD1 3.4Å; N241-L257 WeakPolarHBondContact O-CB 3.36Å; N241-L257 PolarHBondContact O-N 3.35Å; L243-L257 HydrophobicContact CB-CD1 4.15Å; L243-L257 HydrophobicContact CB-CD2 3.93Å; L243-L257 HydrophobicContact CB-CG 4.17Å; L243-L257 HydrophobicContact CD2-CD2 4.4Å
258	V	89.6	Confident	92.8	Very high	107 Å²	107	47.7 Å²	47.7	65%	0.648	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-51.6	177.7	-177.5	0	0	0	0	109.6	N241 D256	N241-V258 HydrophobicContact CB-CG2 4.21Å; D256-V258 WeakPolarHBondContact OD1-CA 3.18Å; D256-V258 WeakPolarHBondContact OD1-CB 3.29Å; D256-V258 PolarHBondContact OD1-N 2.87Å
259	E	87.8	Confident	92.7	Very high	113 Å²	113	45.7 Å²	45.7	53%	0.528	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-23.3	177.8	-70.1	-162.6	-166.3	0	0	113.4	D256 K261	D256-E259 HydrophobicContact CB-CB 4.17Å; D256-E259 PolarHBondContact OD1-N 3.13Å; D256-E259 WeakPolarHBondContact OD2-CG 3.48Å; E259-K261 HydrophobicContact CB-CD 4.41Å; E259-K261 HydrophobicContact CB-CG 4.32Å; E259-K261 IonicContact OE2-NZ 3.47Å; E259-K261 PolarHBondContact OE2-NZ 2.93Å
260	G	88.7	Confident	92.6	Very high	29 Å²	29	52.4 Å²	52.4	30%	0.299	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	36.4	-175.5	0	0	0	0	0	113.7	Y224 D256	Y224-G260 WeakPolarHBondContact CE1-O 3.48Å; Y224-G260 VanDerWaalsContact OH-CA 3.3Å; Y224-G260 WeakPolarHBondContact OH-CA 3.42Å; D256-G260 CarbonylContact O-C 3.58Å; D256-G260 WeakPolarHBondContact O-CA 3.33Å; D256-G260 PolarHBondContact O-N 2.93Å
261	K	89.9	Confident	92.5	Very high	118 Å²	118	51.1 Å²	51.1	51%	0.513	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.3	-176.4	-62.7	178.7	-160.9	147.8	0	112.3	L255 D256 E259	L255-K261 WeakPolarHBondContact CA-O 3.29Å; D256-K261 PolarHBondContact N-O 2.87Å; D256-K261 PolarHBondContact O-N 2.68Å; E259-K261 HydrophobicContact CB-CD 4.41Å; E259-K261 HydrophobicContact CB-CG 4.32Å; E259-K261 IonicContact OE2-NZ 3.47Å; E259-K261 PolarHBondContact OE2-NZ 2.93Å
262	L	93.1	Very high	92.5	Very high	75 Å²	75	51.9 Å²	51.9	39%	0.393	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	122.9	167.5	174.1	62.8	0	0	0	109.6	V226 K253 L255 Y264	V226-L262 HydrophobicContact CG1-CB 4.34Å; V226-L262 HydrophobicContact CG1-CD1 3.85Å; V226-L262 HydrophobicContact CG1-CD2 3.81Å; V226-L262 HydrophobicContact CG1-CG 4.22Å; K253-L262 HydrophobicContact CB-CD1 3.7Å; K253-L262 HydrophobicContact CD-CD1 3.98Å; K253-L262 HydrophobicContact CD-CD2 4.19Å; K253-L262 HydrophobicContact CG-CD1 4.06Å; L255-L262 HydrophobicContact CD2-CB 4.16Å; L255-L262 HydrophobicContact CD2-CD1 3.84Å; L262-Y264 WeakPolarHBondContact CD1-O 3.33Å
263	L	90.9	Very high	92.6	Very high	69 Å²	69	51.7 Å²	51.7	36%	0.361	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-57.8	176.1	-66	178.3	0	0	0	111.5	F242 I254 D256	F242-L263 HydrophobicContact CD1-CD1 3.62Å; F242-L263 HydrophobicContact CE1-CD1 3.5Å; I254-L263 PolarHBondContact O-N 2.57Å; D256-L263 HydrophobicContact CB-CD1 3.78Å; D256-L263 HydrophobicContact CB-CD2 4.04Å; D256-L263 HydrophobicContact CB-CG 3.79Å
264	Y	92	Very high	92.6	Very high	50 Å²	50	51.5 Å²	51.5	20%	0.196	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.5	-173.4	-66.4	-71.4	0	0	0	111.7	D7 P8 K253 I254 L262 F301	D7-Y264 VanDerWaalsContact OD1-CE1 3.25Å; D7-Y264 WeakPolarHBondContact OD1-CE1 3.43Å; D7-Y264 PolarHBondContact OD1-OH 2.76Å; D7-Y264 VanDerWaalsContact OD1-OH 3.07Å; P8-Y264 HydrophobicContact CG-CD1 4.33Å; P8-Y264 HydrophobicContact CG-CD2 4.19Å; P8-Y264 HydrophobicContact CG-CE2 4.39Å; P8-Y264 HydrophobicContact CG-CG 4.14Å; K253-Y264 VanDerWaalsContact CA-O 3.31Å; K253-Y264 WeakPolarHBondContact CA-O 3.23Å; I254-Y264 PolarHBondContact N-O 3.04Å; I254-Y264 PolarHBondContact O-N 3.15Å; L262-Y264 WeakPolarHBondContact CD1-O 3.33Å; Y264-F301 HydrophobicContact CD2-CE1 4.24Å; Y264-F301 HydrophobicContact CD2-CZ 4.4Å; Y264-F301 HydrophobicContact CE2-CE1 4.05Å
265	T	94.4	Very high	92.6	Very high	53 Å²	53	52 Å²	52	33%	0.325	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	108.4	163.1	-58.4	0	0	0	0	108.6	T251 K253 H267	T251-T265 HydrophobicContact CG2-CG2 4.23Å; K253-T265 HydrophobicContact CD-CG2 4.44Å; K253-T265 HydrophobicContact CG-CG2 4.1Å; T265-H267 PolarHBondContact O-ND1 2.76Å
266	L	93.8	Very high	92.7	Very high	16 Å²	16	52.3 Å²	52.3	8%	0.084	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132.6	-176.8	-53.7	176.1	0	0	0	110.2	P8 M252 I254 F285	P8-L266 HydrophobicContact CB-CD2 4.49Å; P8-L266 HydrophobicContact CG-CD2 3.66Å; M252-L266 HydrophobicContact CB-CB 4.24Å; M252-L266 HydrophobicContact CE-CD1 4.4Å; M252-L266 PolarHBondContact N-O 3.37Å; M252-L266 VanDerWaalsContact N-O 3.09Å; M252-L266 PolarHBondContact O-N 3.3Å; I254-L266 HydrophobicContact CD1-CD1 3.84Å; I254-L266 HydrophobicContact CG1-CD1 4.28Å; L266-F285 HydrophobicContact CD1-CE2 3.54Å; L266-F285 HydrophobicContact CD1-CZ 3.41Å; L266-F285 VanDerWaalsContact CD1-CZ 3.41Å
267	H	93.2	Very high	92.8	Very high	131 Å²	131	51.9 Å²	51.9	61%	0.606	29%	0.285	S	S	*	.			trans	-117.2	141.9	175.9	-58.9	84.2	0	0	0	108.6	T265	T265-H267 PolarHBondContact O-ND1 2.76Å
268	G	88.1	Confident	93	Very high	33 Å²	33	51.4 Å²	51.4	34%	0.34	28%	0.282	S	S	.	.			trans	177.2	-38.1	177.9	0	0	0	0	0	112.5
269	H	94.4	Very high	93.2	Very high	9 Å²	9	46.4 Å²	46.4	4%	0.042	25%	0.252	C	S	.	.			trans	-76.2	141.5	174.2	-73.2	-71.8	0	0	0	111.6	G271 V273 S287 D291	H269-G271 VanDerWaalsContact C-N 3.3Å; H269-V273 HydrophobicContact CB-CG2 3.87Å; H269-S287 WeakPolarHBondContact NE2-CB 3.35Å; H269-S287 PolarHBondContact NE2-OG 3.16Å; H269-D291 VanDerWaalsContact CA-OD2 3.24Å; H269-D291 WeakPolarHBondContact CA-OD2 3.45Å; H269-D291 IonicContact CE1-OD1 2.74Å; H269-D291 IonicContact CG-OD2 3.02Å; H269-D291 VanDerWaalsContact ND1-CG 3.31Å; H269-D291 IonicContact ND1-OD1 3.38Å; H269-D291 PolarHBondContact ND1-OD1 3.05Å; H269-D291 IonicContact ND1-OD2 2.8Å; H269-D291 PolarHBondContact ND1-OD2 2.92Å
270	Q	92	Very high	93.2	Very high	167 Å²	167	46.8 Å²	46.8	78%	0.78	25%	0.249	S	C	*	.	S	Bend	trans	-89.6	4.1	177.5	-62.2	-60.4	-52.9	0	0	113	D291	Q270-D291 HydrophobicContact CB-CB 4.42Å; Q270-D291 PolarHBondContact N-OD2 2.47Å; Q270-D291 VanDerWaalsContact N-OD2 3.16Å
271	G	93.1	Very high	93.2	Very high	17 Å²	17	47.9 Å²	47.9	18%	0.175	26%	0.255	C	S	.	.	S	Bend	trans	-156.5	-170.4	-179.5	0	0	0	0	0	111.5	S250 H269 V273 S290	S250-G271 VanDerWaalsContact CA-O 3.23Å; S250-G271 WeakPolarHBondContact CA-O 3.47Å; S250-G271 WeakPolarHBondContact CB-O 3.35Å; H269-G271 VanDerWaalsContact C-N 3.3Å; G271-V273 PolarHBondContact O-N 3.39Å; G271-S290 WeakPolarHBondContact CA-OG 3.39Å
272	A	95.4	Very high	93.1	Very high	29 Å²	29	42.2 Å²	42.2	24%	0.24	23%	0.23	C	C	.	.			trans	-55.1	126.9	-176.9	0	0	0	0	0	111.8	T274 G289 S290	A272-T274 PolarHBondContact O-N 2.92Å; A272-G289 CarbonylContact O-C 3.54Å; A272-G289 WeakPolarHBondContact O-CA 3.38Å; A272-S290 PolarHBondContact N-OG 2.99Å; A272-S290 PolarHBondContact O-N 3.33Å
273	V	97	Very high	93	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	117.5	172.5	-167.1	0	0	0	0	107.4	N232 A246 S247 M252 H269 G271 G288	N232-V273 PolarHBondContact ND2-O 3.24Å; A246-V273 HydrophobicContact CB-CB 3.99Å; A246-V273 HydrophobicContact CB-CG1 3.59Å; S247-V273 CarbonylContact C-O 3.57Å; S247-V273 PolarHBondContact O-N 2.84Å; M252-V273 HydrophobicContact CG-CB 4.31Å; M252-V273 HydrophobicContact CG-CG1 3.84Å; M252-V273 HydrophobicContact CG-CG2 4.09Å; M252-V273 HydrophobicContact SD-CG1 4.21Å; H269-V273 HydrophobicContact CB-CG2 3.87Å; G271-V273 PolarHBondContact O-N 3.39Å; V273-G288 WeakPolarHBondContact CG1-O 3.27Å
274	T	96.1	Very high	93.1	Very high	29 Å²	29	41.8 Å²	41.8	18%	0.178	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-30.6	-172.4	55.2	0	0	0	0	111.9	T20 V21 N232 A272 G288	T20-T274 HydrophobicContact CG2-CG2 3.64Å; V21-T274 WeakPolarHBondContact O-CB 3.25Å; V21-T274 PolarHBondContact O-OG1 3.38Å; N232-T274 VanDerWaalsContact CB-O 3.3Å; N232-T274 WeakPolarHBondContact CB-O 3.42Å; A272-T274 PolarHBondContact O-N 2.92Å; T274-G288 PolarHBondContact N-O 3.18Å; T274-G288 PolarHBondContact OG1-O 2.9Å; T274-G288 VanDerWaalsContact OG1-O 3.05Å
275	C	95.4	Very high	93.2	Very high	11 Å²	11	39.4 Å²	39.4	7%	0.074	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	152	-171.8	54.9	0	0	0	0	111.7	T22 S23 S287 G288	T22-C275 WeakPolarHBondContact O-CB 3.42Å; S23-C275 VanDerWaalsContact CA-SG 3.52Å; S23-C275 PolarHBondContact N-SG 3.03Å; C275-S287 WeakPolarHBondContact O-CA 3.17Å; C275-G288 PolarHBondContact N-O 3.23Å; C275-G288 PolarHBondContact O-N 3.25Å
276	V	96.8	Very high	93.3	Very high	6 Å²	6	36.9 Å²	36.9	4%	0.036	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	146.3	176.7	64.7	0	0	0	0	109.1	I244 A246 M252 S286	I244-V276 HydrophobicContact CB-CG2 4.25Å; I244-V276 HydrophobicContact CD1-CG2 3.69Å; I244-V276 HydrophobicContact CG1-CG2 3.81Å; I244-V276 HydrophobicContact CG2-CB 4.28Å; I244-V276 HydrophobicContact CG2-CG1 3.87Å; I244-V276 HydrophobicContact CG2-CG2 3.43Å; I244-V276 VanDerWaalsContact CG2-CG2 3.43Å; A246-V276 HydrophobicContact CB-CB 3.98Å; A246-V276 HydrophobicContact CB-CG1 3.83Å; M252-V276 HydrophobicContact CE-CG2 3.86Å; V276-S286 VanDerWaalsContact CA-O 3.3Å; V276-S286 WeakPolarHBondContact CA-O 3.23Å; V276-S286 WeakPolarHBondContact CG2-O 3.1Å
277	A	96.2	Very high	93.4	Very high	8 Å²	8	36.1 Å²	36.1	7%	0.066	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	137.1	175.6	0	0	0	0	0	110	V24 F26 F285 S286	V24-A277 WeakPolarHBondContact O-CB 3.48Å; F26-A277 HydrophobicContact CD2-CB 4.42Å; F26-A277 WeakPolarHBondContact CE2-O 3.2Å; A277-F285 CarbonylContact O-C 3.6Å; A277-F285 VanDerWaalsContact O-CA 3.3Å; A277-F285 WeakPolarHBondContact O-CA 3.31Å; A277-F285 WeakPolarHBondContact O-CB 3.42Å; A277-S286 PolarHBondContact N-O 3.29Å; A277-S286 PolarHBondContact O-N 3.23Å
278	F	95.3	Very high	93.6	Very high	9 Å²	9	29.9 Å²	29.9	4%	0.039	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	150.5	161.8	-82.7	-74.8	0	0	0	110.7	S235 F236 H237 I244 F285 F301	S235-F278 WeakPolarHBondContact O-CD2 3.45Å; S235-F278 WeakPolarHBondContact O-CE2 3.08Å; S235-F278 PolarHBondContact OG-N 3.49Å; F236-F278 VanDerWaalsContact C-CD2 3.46Å; F236-F278 WeakPolarHBondContact O-CD2 3.33Å; H237-F278 HydrophobicContact CB-CD2 4.36Å; H237-F278 HydrophobicContact CB-CE2 4.18Å; H237-F278 HydrophobicContact CB-CZ 4.35Å; H237-F278 AromaticContact CD2-CD1 3.78Å; H237-F278 AromaticContact CD2-CE1 3.71Å; I244-F278 HydrophobicContact CB-CD2 4.36Å; I244-F278 HydrophobicContact CB-CE2 3.52Å; I244-F278 HydrophobicContact CB-CZ 3.86Å; I244-F278 HydrophobicContact CG2-CD2 3.61Å; I244-F278 HydrophobicContact CG2-CE2 3.27Å; I244-F278 HydrophobicContact CG2-CZ 3.96Å; F278-F285 HydrophobicContact CD1-CB 3.65Å; F278-F285 HydrophobicContact CD1-CD1 4.5Å; F278-F285 HydrophobicContact CD1-CG 4.46Å; F278-F285 HydrophobicContact CE1-CB 3.84Å; F278-F285 AromaticContact CE1-CD1 3.97Å; F278-F285 HydrophobicContact CE1-CD1 3.97Å; F278-F285 HydrophobicContact CE1-CG 4.18Å; F278-F285 HydrophobicContact CG-CB 4.26Å; F278-F301 HydrophobicContact CE1-CD2 4.24Å; F278-F301 HydrophobicContact CE1-CE2 4.12Å; F278-F301 HydrophobicContact CZ-CE2 4.3Å
279	S	93.6	Very high	93.9	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.014	15%	0.151	C	C	.	.			trans	-61.9	155.3	162.9	60.8	0	0	0	0	111.5	M30 P238 A281 G282 D283 Y284	M30-S279 WeakPolarHBondContact SD-CB 3.41Å; P238-S279 WeakPolarHBondContact CG-O 3.48Å; S279-A281 PolarHBondContact O-N 2.71Å; S279-G282 PolarHBondContact O-N 2.97Å; S279-G282 PolarHBondContact OG-N 2.89Å; S279-D283 PolarHBondContact OG-N 3.46Å; S279-Y284 WeakPolarHBondContact CB-O 3.09Å; S279-Y284 PolarHBondContact N-O 2.89Å; S279-Y284 PolarHBondContact OG-N 2.98Å; S279-Y284 VanDerWaalsContact OG-N 3.08Å; S279-Y284 PolarHBondContact OG-O 3.15Å
280	R	88.8	Confident	93.9	Very high	122 Å²	122	30.1 Å²	30.1	46%	0.46	16%	0.164	S	C	.	.	S	Bend	trans	-66.1	-24.5	176.6	-58.9	-60.1	-176.1	133.8	1.4	113.1	P238	P238-R280 WeakPolarHBondContact CG-O 3.32Å
281	A	88.1	Confident	94	Very high	51 Å²	51	23.4 Å²	23.4	42%	0.421	13%	0.133	S	C	.	.	S	Bend	trans	-81.2	-40.5	176.6	0	0	0	0	0	112.1	S279	S279-A281 PolarHBondContact O-N 2.71Å
282	G	88.5	Confident	94.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	116.6	-34.5	-174.7	0	0	0	0	0	112.1	H237 S279 Y284 S299	H237-G282 WeakPolarHBondContact NE2-CA 3.37Å; H237-G282 PolarHBondContact NE2-O 2.7Å; S279-G282 PolarHBondContact O-N 2.97Å; S279-G282 PolarHBondContact OG-N 2.89Å; G282-Y284 PolarHBondContact O-N 2.95Å; G282-S299 VanDerWaalsContact O-CB 3.32Å; G282-S299 WeakPolarHBondContact O-CB 3.38Å; G282-S299 PolarHBondContact O-OG 3.26Å
283	D	89.5	Confident	94	Very high	74 Å²	74	26.7 Å²	26.7	40%	0.396	14%	0.139	S	C	.	.	S	Bend	trans	-53.2	-25	-175.1	-51.6	-29.4	0	0	0	116.7	S279 S299	S279-D283 PolarHBondContact OG-N 3.46Å; D283-S299 WeakPolarHBondContact CA-OG 3.44Å; D283-S299 PolarHBondContact O-N 3.14Å; D283-S299 PolarHBondContact O-OG 3.2Å
284	Y	93	Very high	94	Very high	61 Å²	61	26.7 Å²	26.7	24%	0.239	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157.1	-179.1	-59.3	-89.7	0	0	0	111.7	E11 M30 S279 G282 V296 W297 K298	E11-Y284 WeakPolarHBondContact OE2-CE1 3.46Å; M30-Y284 HydrophobicContact CE-CD2 3.5Å; M30-Y284 HydrophobicContact CE-CE2 4.47Å; M30-Y284 HydrophobicContact CE-CG 4.03Å; S279-Y284 WeakPolarHBondContact CB-O 3.09Å; S279-Y284 PolarHBondContact N-O 2.89Å; S279-Y284 PolarHBondContact OG-N 2.98Å; S279-Y284 VanDerWaalsContact OG-N 3.08Å; S279-Y284 PolarHBondContact OG-O 3.15Å; G282-Y284 PolarHBondContact O-N 2.95Å; Y284-V296 HydrophobicContact CD1-CG1 4.32Å; Y284-W297 CarbonylContact C-O 3.29Å; Y284-W297 VanDerWaalsContact CA-O 3.23Å; Y284-W297 WeakPolarHBondContact CA-O 3.23Å; Y284-W297 WeakPolarHBondContact CB-O 3.31Å; Y284-K298 HydrophobicContact CD1-CB 4.16Å; Y284-K298 HydrophobicContact CD1-CG 4.35Å; Y284-K298 HydrophobicContact CE1-CB 3.98Å; Y284-K298 HydrophobicContact CE1-CG 3.94Å
285	F	95.1	Very high	94	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	156.7	164.6	61.6	-86.7	0	0	0	110.6	P8 I244 M252 I254 L266 A277 F278 W297	P8-F285 HydrophobicContact CB-CE1 4.1Å; P8-F285 HydrophobicContact CB-CZ 4.14Å; I244-F285 HydrophobicContact CD1-CB 4.47Å; I244-F285 HydrophobicContact CD1-CD2 3.34Å; I244-F285 HydrophobicContact CD1-CE2 3.54Å; I244-F285 HydrophobicContact CD1-CG 3.9Å; I244-F285 HydrophobicContact CD1-CZ 4.26Å; M252-F285 HydrophobicContact CE-CD2 3.87Å; M252-F285 HydrophobicContact CE-CE2 3.69Å; I254-F285 HydrophobicContact CD1-CE1 4.25Å; I254-F285 HydrophobicContact CD1-CZ 4.11Å; L266-F285 HydrophobicContact CD1-CE2 3.54Å; L266-F285 HydrophobicContact CD1-CZ 3.41Å; L266-F285 VanDerWaalsContact CD1-CZ 3.41Å; A277-F285 CarbonylContact O-C 3.6Å; A277-F285 VanDerWaalsContact O-CA 3.3Å; A277-F285 WeakPolarHBondContact O-CA 3.31Å; A277-F285 WeakPolarHBondContact O-CB 3.42Å; F278-F285 HydrophobicContact CD1-CB 3.65Å; F278-F285 HydrophobicContact CD1-CD1 4.5Å; F278-F285 HydrophobicContact CD1-CG 4.46Å; F278-F285 HydrophobicContact CE1-CB 3.84Å; F278-F285 AromaticContact CE1-CD1 3.97Å; F278-F285 HydrophobicContact CE1-CD1 3.97Å; F278-F285 HydrophobicContact CE1-CG 4.18Å; F278-F285 HydrophobicContact CG-CB 4.26Å; F285-W297 HydrophobicContact CD1-CB 3.91Å; F285-W297 HydrophobicContact CD2-CB 3.78Å; F285-W297 AromaticContact CD2-CD1 3.68Å; F285-W297 AromaticContact CD2-CG 3.89Å; F285-W297 HydrophobicContact CD2-CG 3.89Å; F285-W297 HydrophobicContact CE1-CB 3.46Å; F285-W297 VanDerWaalsContact CE1-CB 3.46Å; F285-W297 HydrophobicContact CE1-CG 4.27Å; F285-W297 HydrophobicContact CE2-CB 3.32Å; F285-W297 AromaticContact CE2-CD1 3.32Å; F285-W297 AromaticContact CE2-CD2 3.96Å; F285-W297 HydrophobicContact CE2-CD2 3.96Å; F285-W297 AromaticContact CE2-CG 3.24Å; F285-W297 HydrophobicContact CE2-CG 3.24Å; F285-W297 HydrophobicContact CG-CB 4.06Å; F285-W297 HydrophobicContact CZ-CB 3.14Å; F285-W297 HydrophobicContact CZ-CD2 4.05Å; F285-W297 HydrophobicContact CZ-CE3 4.49Å; F285-W297 AromaticContact CZ-CG 3.47Å; F285-W297 HydrophobicContact CZ-CG 3.47Å; F285-W297 VanDerWaalsContact CZ-CG 3.47Å; F285-W297 PolarHBondContact N-O 3.09Å; F285-W297 PolarHBondContact O-N 3.03Å
286	S	95.6	Very high	93.9	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	148.1	-179.1	58.7	0	0	0	0	111.1	V24 F26 V276 A277 L295	V24-S286 WeakPolarHBondContact CG1-OG 3.44Å; F26-S286 WeakPolarHBondContact CE2-OG 3.31Å; F26-S286 VanDerWaalsContact CZ-CB 3.5Å; V276-S286 VanDerWaalsContact CA-O 3.3Å; V276-S286 WeakPolarHBondContact CA-O 3.23Å; V276-S286 WeakPolarHBondContact CG2-O 3.1Å; A277-S286 PolarHBondContact N-O 3.29Å; A277-S286 PolarHBondContact O-N 3.23Å; S286-L295 CarbonylContact C-O 3.59Å; S286-L295 WeakPolarHBondContact CA-O 3.48Å
287	S	96.6	Very high	93.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.2	174.6	56.4	0	0	0	0	111.8	M252 H269 C275 V294 L295 W297	M252-S287 VanDerWaalsContact CE-CB 3.46Å; M252-S287 WeakPolarHBondContact SD-CB 3.32Å; M252-S287 PolarHBondContact SD-OG 3.36Å; H269-S287 WeakPolarHBondContact NE2-CB 3.35Å; H269-S287 PolarHBondContact NE2-OG 3.16Å; C275-S287 WeakPolarHBondContact O-CA 3.17Å; S287-V294 CarbonylContact O-C 3.56Å; S287-V294 VanDerWaalsContact O-CA 3.28Å; S287-V294 WeakPolarHBondContact O-CA 3.29Å; S287-L295 PolarHBondContact N-O 3.3Å; S287-L295 PolarHBondContact O-N 3.18Å; S287-W297 PolarHBondContact OG-NE1 2.9Å
288	G	96.1	Very high	93.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.9	173.5	0	0	0	0	0	110.4	V273 T274 C275	V273-G288 WeakPolarHBondContact CG1-O 3.27Å; T274-G288 PolarHBondContact N-O 3.18Å; T274-G288 PolarHBondContact OG1-O 2.9Å; T274-G288 VanDerWaalsContact OG1-O 3.05Å; C275-G288 PolarHBondContact N-O 3.23Å; C275-G288 PolarHBondContact O-N 3.25Å
289	G	94.8	Very high	93.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	172	-176.6	0	0	0	0	0	114.3	V21 A272 D291 E292 Q293	V21-G289 PolarHBondContact N-O 3.21Å; V21-G289 VanDerWaalsContact N-O 3.07Å; A272-G289 CarbonylContact O-C 3.54Å; A272-G289 WeakPolarHBondContact O-CA 3.38Å; G289-D291 WeakPolarHBondContact CA-OD1 3.38Å; G289-D291 PolarHBondContact O-N 3.18Å; G289-E292 PolarHBondContact O-N 3.42Å; G289-Q293 PolarHBondContact N-O 2.9Å
290	S	95.1	Very high	92.5	Very high	46 Å²	46	28.9 Å²	28.9	32%	0.322	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.5	167.8	67.5	0	0	0	0	113.3	G271 A272 E292	G271-S290 WeakPolarHBondContact CA-OG 3.39Å; A272-S290 PolarHBondContact N-OG 2.99Å; A272-S290 PolarHBondContact O-N 3.33Å; S290-E292 PolarHBondContact O-N 2.92Å
291	D	94.3	Very high	91.8	Very high	26 Å²	26	23.5 Å²	23.5	14%	0.139	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	10	176.2	62.8	-5.1	0	0	0	114.2	H269 Q270 G289 Q293	H269-D291 VanDerWaalsContact CA-OD2 3.24Å; H269-D291 WeakPolarHBondContact CA-OD2 3.45Å; H269-D291 IonicContact CE1-OD1 2.74Å; H269-D291 IonicContact CG-OD2 3.02Å; H269-D291 VanDerWaalsContact ND1-CG 3.31Å; H269-D291 IonicContact ND1-OD1 3.38Å; H269-D291 PolarHBondContact ND1-OD1 3.05Å; H269-D291 IonicContact ND1-OD2 2.8Å; H269-D291 PolarHBondContact ND1-OD2 2.92Å; Q270-D291 HydrophobicContact CB-CB 4.42Å; Q270-D291 PolarHBondContact N-OD2 2.47Å; Q270-D291 VanDerWaalsContact N-OD2 3.16Å; G289-D291 WeakPolarHBondContact CA-OD1 3.38Å; G289-D291 PolarHBondContact O-N 3.18Å; D291-Q293 PolarHBondContact O-N 2.98Å; D291-Q293 VanDerWaalsContact O-N 3.11Å; D291-Q293 PolarHBondContact OD1-N 2.97Å
292	E	94.6	Very high	90.8	Very high	68 Å²	68	23.1 Å²	23.1	32%	0.318	12%	0.115	S	C	.	.	S	Bend	trans	66.1	9.6	176.6	-41.7	176.4	158.6	0	0	113.8	G289 S290	G289-E292 PolarHBondContact O-N 3.42Å; S290-E292 PolarHBondContact O-N 2.92Å
293	Q	94.3	Very high	89.3	Confident	48 Å²	48	27.9 Å²	27.9	22%	0.224	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	148.1	-178.4	-66.7	179.3	49.6	0	0	110.7	G289 D291	G289-Q293 PolarHBondContact N-O 2.9Å; D291-Q293 PolarHBondContact O-N 2.98Å; D291-Q293 VanDerWaalsContact O-N 3.11Å; D291-Q293 PolarHBondContact OD1-N 2.97Å
294	V	95.9	Very high	87.1	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	116.8	169.2	-176.1	0	0	0	0	106.7	H13 F14 V21 V24 T35 S287	H13-V294 CarbonylContact C-O 3.57Å; H13-V294 WeakPolarHBondContact CA-O 3.48Å; F14-V294 HydrophobicContact CB-CB 4.21Å; F14-V294 PolarHBondContact N-O 2.96Å; F14-V294 PolarHBondContact O-N 3.19Å; V21-V294 HydrophobicContact CG1-CG2 4.23Å; V21-V294 HydrophobicContact CG2-CG2 3.86Å; V24-V294 HydrophobicContact CG1-CG1 4.47Å; V24-V294 HydrophobicContact CG2-CG1 4.23Å; T35-V294 HydrophobicContact CG2-CG1 4.05Å; T35-V294 HydrophobicContact CG2-CG2 3.81Å; S287-V294 CarbonylContact O-C 3.56Å; S287-V294 VanDerWaalsContact O-CA 3.28Å; S287-V294 WeakPolarHBondContact O-CA 3.29Å
295	L	95.7	Very high	85	Confident	4 Å²	4	27.1 Å²	27.1	2%	0.021	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	139	178.9	-56	-179.7	0	0	0	109	L10 H13 S286 S287 W297	L10-L295 HydrophobicContact CD1-CB 3.78Å; L10-L295 HydrophobicContact CD1-CD2 4.18Å; L10-L295 HydrophobicContact CD1-CG 4.37Å; H13-L295 HydrophobicContact CB-CD2 3.55Å; S286-L295 CarbonylContact C-O 3.59Å; S286-L295 WeakPolarHBondContact CA-O 3.48Å; S287-L295 PolarHBondContact N-O 3.3Å; S287-L295 PolarHBondContact O-N 3.18Å; L295-W297 HydrophobicContact CB-CZ2 4.49Å; L295-W297 HydrophobicContact CD1-CZ2 3.95Å
296	V	95.1	Very high	82.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126	174.7	-177	0	0	0	0	108.8	E11 R12 F14 F26 I33 M47 Y284	E11-V296 PolarHBondContact N-O 3.32Å; R12-V296 HydrophobicContact CB-CB 4.38Å; R12-V296 PolarHBondContact N-O 3.07Å; R12-V296 VanDerWaalsContact N-O 3.09Å; R12-V296 PolarHBondContact O-N 3.41Å; F14-V296 HydrophobicContact CD2-CG2 4.1Å; F14-V296 HydrophobicContact CE2-CG2 3.72Å; F26-V296 HydrophobicContact CZ-CG1 4.48Å; I33-V296 HydrophobicContact CD1-CG1 4.47Å; I33-V296 HydrophobicContact CD1-CG2 3.43Å; I33-V296 VanDerWaalsContact CD1-CG2 3.43Å; M47-V296 HydrophobicContact CE-CG1 3.93Å; Y284-V296 HydrophobicContact CD1-CG1 4.32Å
297	W	94.3	Very high	79.4	Confident	18 Å²	18	38 Å²	38	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	140.3	-174	-55.8	82.2	0	0	0	108.9	T9 L10 Y284 F285 S287 L295	T9-W297 WeakPolarHBondContact O-CA 3.46Å; L10-W297 HydrophobicContact CB-CD2 4.35Å; L10-W297 HydrophobicContact CB-CE3 3.87Å; L10-W297 HydrophobicContact CB-CH2 4.21Å; L10-W297 HydrophobicContact CB-CZ3 3.79Å; L10-W297 HydrophobicContact CD1-CD2 3.95Å; L10-W297 HydrophobicContact CD1-CE3 4.32Å; L10-W297 HydrophobicContact CD1-CG 4.41Å; L10-W297 HydrophobicContact CD1-CH2 4.36Å; L10-W297 HydrophobicContact CD1-CZ2 4.02Å; Y284-W297 CarbonylContact C-O 3.29Å; Y284-W297 VanDerWaalsContact CA-O 3.23Å; Y284-W297 WeakPolarHBondContact CA-O 3.23Å; Y284-W297 WeakPolarHBondContact CB-O 3.31Å; F285-W297 HydrophobicContact CD1-CB 3.91Å; F285-W297 HydrophobicContact CD2-CB 3.78Å; F285-W297 AromaticContact CD2-CD1 3.68Å; F285-W297 AromaticContact CD2-CG 3.89Å; F285-W297 HydrophobicContact CD2-CG 3.89Å; F285-W297 HydrophobicContact CE1-CB 3.46Å; F285-W297 VanDerWaalsContact CE1-CB 3.46Å; F285-W297 HydrophobicContact CE1-CG 4.27Å; F285-W297 HydrophobicContact CE2-CB 3.32Å; F285-W297 AromaticContact CE2-CD1 3.32Å; F285-W297 AromaticContact CE2-CD2 3.96Å; F285-W297 HydrophobicContact CE2-CD2 3.96Å; F285-W297 AromaticContact CE2-CG 3.24Å; F285-W297 HydrophobicContact CE2-CG 3.24Å; F285-W297 HydrophobicContact CG-CB 4.06Å; F285-W297 HydrophobicContact CZ-CB 3.14Å; F285-W297 HydrophobicContact CZ-CD2 4.05Å; F285-W297 HydrophobicContact CZ-CE3 4.49Å; F285-W297 AromaticContact CZ-CG 3.47Å; F285-W297 HydrophobicContact CZ-CG 3.47Å; F285-W297 VanDerWaalsContact CZ-CG 3.47Å; F285-W297 PolarHBondContact N-O 3.09Å; F285-W297 PolarHBondContact O-N 3.03Å; S287-W297 PolarHBondContact OG-NE1 2.9Å; L295-W297 HydrophobicContact CB-CZ2 4.49Å; L295-W297 HydrophobicContact CD1-CZ2 3.95Å
298	K	91.6	Very high	76.5	Confident	73 Å²	73	41.5 Å²	41.5	32%	0.317	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	127.6	167.7	-169.9	-176.4	174.5	-155.7	0	108.4	P8 T9 Y284	P8-K298 WeakPolarHBondContact CA-O 3.44Å; T9-K298 PolarHBondContact N-O 3.35Å; T9-K298 PolarHBondContact O-N 2.96Å; Y284-K298 HydrophobicContact CD1-CB 4.16Å; Y284-K298 HydrophobicContact CD1-CG 4.35Å; Y284-K298 HydrophobicContact CE1-CB 3.98Å; Y284-K298 HydrophobicContact CE1-CG 3.94Å
299	S	85.8	Confident	73.8	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.042	25%	0.245	C	C	.	.			trans	-89.1	144.4	172.4	103.4	0	0	0	0	108.7	G282 D283	G282-S299 VanDerWaalsContact O-CB 3.32Å; G282-S299 WeakPolarHBondContact O-CB 3.38Å; G282-S299 PolarHBondContact O-OG 3.26Å; D283-S299 WeakPolarHBondContact CA-OG 3.44Å; D283-S299 PolarHBondContact O-N 3.14Å; D283-S299 PolarHBondContact O-OG 3.2Å
300	N	80.7	Confident	70.9	Confident	9 Å²	9	51.3 Å²	51.3	5%	0.048	28%	0.276	C	S	.	.			trans	-118	21.2	176	-54.4	-47	0	0	0	111	S6 D7 D302	S6-N300 VanDerWaalsContact C-ND2 3.3Å; S6-N300 WeakPolarHBondContact O-CB 3.32Å; S6-N300 PolarHBondContact O-ND2 3.23Å; S6-N300 WeakPolarHBondContact OG-CB 3.21Å; S6-N300 PolarHBondContact OG-ND2 2.94Å; S6-N300 PolarHBondContact OG-OD1 2.99Å; D7-N300 PolarHBondContact O-ND2 2.83Å; N300-D302 VanDerWaalsContact C-N 3.3Å; N300-D302 PolarHBondContact O-N 2.98Å
301	F	73.9	Confident	68.1	Low	9 Å²	9	55.6 Å²	55.6	4%	0.039	30%	0.3	C	S	.	.	S	Bend	trans	-71.8	-26.2	-173.5	-61.9	-52.6	0	0	0	112.9	F242 I254 Y264 F278	F242-F301 HydrophobicContact CD1-CD1 4.41Å; F242-F301 HydrophobicContact CD2-CB 3.69Å; F242-F301 AromaticContact CD2-CD1 3.97Å; F242-F301 HydrophobicContact CD2-CD1 3.97Å; F242-F301 HydrophobicContact CD2-CD2 4.43Å; F242-F301 AromaticContact CD2-CG 3.76Å; F242-F301 HydrophobicContact CD2-CG 3.76Å; F242-F301 HydrophobicContact CE1-CD1 4.34Å; F242-F301 HydrophobicContact CE2-CB 3.55Å; F242-F301 AromaticContact CE2-CD1 3.91Å; F242-F301 HydrophobicContact CE2-CD1 3.91Å; F242-F301 AromaticContact CE2-CG 3.91Å; F242-F301 HydrophobicContact CE2-CG 3.91Å; F242-F301 HydrophobicContact CG-CD1 4.23Å; F242-F301 HydrophobicContact CG-CG 4.31Å; F242-F301 HydrophobicContact CZ-CB 4.42Å; F242-F301 HydrophobicContact CZ-CD1 4.08Å; I254-F301 HydrophobicContact CD1-CE2 3.92Å; I254-F301 HydrophobicContact CD1-CZ 3.5Å; I254-F301 HydrophobicContact CG2-CE1 4.25Å; I254-F301 HydrophobicContact CG2-CE2 4.46Å; I254-F301 HydrophobicContact CG2-CZ 3.85Å; Y264-F301 HydrophobicContact CD2-CE1 4.24Å; Y264-F301 HydrophobicContact CD2-CZ 4.4Å; Y264-F301 HydrophobicContact CE2-CE1 4.05Å; F278-F301 HydrophobicContact CE1-CD2 4.24Å; F278-F301 HydrophobicContact CE1-CE2 4.12Å; F278-F301 HydrophobicContact CZ-CE2 4.3Å
302	D	66.1	Low	65.3	Low	44 Å²	44	62.7 Å²	62.7	24%	0.235	33%	0.33	C	S	.	.	S	Bend	trans	-87.6	-18.3	-178.2	-66.9	-42.7	0	0	0	113.6	H237 N300 C304 I305	H237-D302 IonicContact CE1-OD1 3.37Å; H237-D302 PolarHBondContact CE1-OD1 3.39Å; H237-D302 VanDerWaalsContact CE1-OD1 3.3Å; H237-D302 IonicContact CE1-OD2 3.46Å; H237-D302 IonicContact NE2-OD2 2.81Å; N300-D302 VanDerWaalsContact C-N 3.3Å; N300-D302 PolarHBondContact O-N 2.98Å; D302-C304 PolarHBondContact O-N 3.43Å; D302-I305 PolarHBondContact O-N 2.64Å
303	E	56.8	Low	62.3	Low	99 Å²	99	63.7 Å²	63.7	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-61	-29.4	178.9	-72.6	-173.3	167.2	0	0	112	S6 I305	S6-E303 PolarHBondContact OG-OE2 3.01Å; E303-I305 VanDerWaalsContact C-N 3.32Å; E303-I305 PolarHBondContact O-N 3.17Å
304	C	43.2	Very low	59.5	Low	52 Å²	52	70.1 Å²	70.1	35%	0.351	37%	0.374	S	S	.	.	H	α-helix	trans	-70.6	-24.4	175.8	-81.8	0	0	0	0	113.7	D302 S307	D302-C304 PolarHBondContact O-N 3.43Å; C304-S307 PolarHBondContact O-OG 2.75Å; C304-S307 VanDerWaalsContact O-OG 3.1Å
305	I	48.7	Very low	56.2	Low	67 Å²	67	75.9 Å²	75.9	34%	0.344	41%	0.413	S	S	.	.	H	α-helix	trans	-81.4	-36.6	-173.9	-60.1	176	0	0	0	110.9	D302 E303 S307 S308 N309	D302-I305 PolarHBondContact O-N 2.64Å; E303-I305 VanDerWaalsContact C-N 3.32Å; E303-I305 PolarHBondContact O-N 3.17Å; I305-S307 PolarHBondContact O-N 2.77Å; I305-S308 PolarHBondContact O-N 3.37Å; I305-S308 PolarHBondContact O-OG 2.84Å; I305-N309 WeakPolarHBondContact CG2-ND2 3.25Å; I305-N309 PolarHBondContact O-N 3.3Å; I305-N309 PolarHBondContact O-ND2 2.99Å
306	E	39.4	Very low	53.3	Low	149 Å²	149	85.9 Å²	85.9	70%	0.696	46%	0.457	S	S	*	.	H	α-helix	trans	-65.5	-39.1	178.5	-69.1	-165.4	155.6	0	0	112.6	S308 N309 D310	E306-S308 PolarHBondContact O-N 3.41Å; E306-S308 VanDerWaalsContact O-N 3.16Å; E306-N309 PolarHBondContact O-N 2.78Å; E306-D310 PolarHBondContact O-N 3.29Å
307	S	33.9	Very low	50.1	Low	80 Å²	80	91.5 Å²	91.5	56%	0.559	49%	0.491	S	S	*	.	H	α-helix	trans	-63.8	-21.9	177.5	72.2	0	0	0	0	114.4	C304 I305	C304-S307 PolarHBondContact O-OG 2.75Å; C304-S307 VanDerWaalsContact O-OG 3.1Å; I305-S307 PolarHBondContact O-N 2.77Å
308	S	36.5	Very low	46.9	Very low	74 Å²	74	96.5 Å²	96.5	52%	0.517	52%	0.524	S	S	.	.	H	α-helix	trans	-90	-17.4	175	74.2	0	0	0	0	113.5	I305 E306	I305-S308 PolarHBondContact O-N 3.37Å; I305-S308 PolarHBondContact O-OG 2.84Å; E306-S308 PolarHBondContact O-N 3.41Å; E306-S308 VanDerWaalsContact O-N 3.16Å
309	N	40.1	Very low	43.8	Very low	81 Å²	81	99.3 Å²	99.3	43%	0.433	55%	0.552	S	S	.	*	H	α-helix	trans	-97.9	-9.4	-176.2	-78.5	-31.6	0	0	0	114	I305 E306 V311 K312 S313	I305-N309 WeakPolarHBondContact CG2-ND2 3.25Å; I305-N309 PolarHBondContact O-N 3.3Å; I305-N309 PolarHBondContact O-ND2 2.99Å; E306-N309 PolarHBondContact O-N 2.78Å; N309-V311 PolarHBondContact O-N 2.75Å; N309-K312 CarbonylContact O-C 3.53Å; N309-K312 VanDerWaalsContact O-C 3.29Å; N309-K312 WeakPolarHBondContact O-CA 3.21Å; N309-K312 PolarHBondContact O-N 2.82Å; N309-S313 PolarHBondContact O-N 3.25Å
310	D	32	Very low	41.2	Very low	125 Å²	125	104.6 Å²	104.6	67%	0.668	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-9.6	173.2	-85.8	-28.7	0	0	0	114.1	E306	E306-D310 PolarHBondContact O-N 3.29Å
311	V	38	Very low	38.8	Very low	136 Å²	136	113.1 Å²	113.1	82%	0.824	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-6.4	166.6	-174.4	0	0	0	0	112.1	N309	N309-V311 PolarHBondContact O-N 2.75Å
312	K	35.8	Very low	36.7	Very low	174 Å²	174	121.7 Å²	121.7	76%	0.757	67%	0.665	S	S	*	*	S	Bend	trans	-130.3	34.9	179.2	-69.7	-177.5	179.4	174	0	112.7	N309 Q314	N309-K312 CarbonylContact O-C 3.53Å; N309-K312 VanDerWaalsContact O-C 3.29Å; N309-K312 WeakPolarHBondContact O-CA 3.21Å; N309-K312 PolarHBondContact O-N 2.82Å; K312-Q314 PolarHBondContact O-N 3.42Å
313	S	31.5	Very low	35.1	Very low	90 Å²	90	125 Å²	125	63%	0.629	69%	0.689	S	S	*	*			trans	-74	73.1	173.9	55.7	0	0	0	0	112.1	N309	N309-S313 PolarHBondContact O-N 3.25Å
314	Q	34.6	Very low	33.7	Very low	182 Å²	182	126.1 Å²	126.1	85%	0.85	70%	0.703	S	S	*	*			trans	-162.6	79.5	156.4	-112.1	173.5	23	0	0	110.2	K312	K312-Q314 PolarHBondContact O-N 3.42Å
315	C	27.5	Very low	32.9	Very low	121 Å²	121	132.2 Å²	132.2	82%	0.818	73%	0.726	S	S	*	*			trans	-177	96.1	142.7	-99.8	0	0	0	0	109.5
316	K	33.3	Very low	31.8	Very low	214 Å²	214	134 Å²	134	93%	0.93	74%	0.744	S	S	*	*			trans	-68.1	127.9	160.5	-72.3	174.9	174.8	176.6	0	107.8
317	T	28.3	Very low	31.1	Very low	118 Å²	118	133.3 Å²	133.3	72%	0.724	75%	0.745	S	S	*	*			trans	-135	102.9	166.8	-29.7	0	0	0	0	110.8
318	T	27.6	Very low	30.7	Very low	124 Å²	124	140.5 Å²	140.5	76%	0.761	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-50.8	141.2	154.1	35.5	0	0	0	0	111.8	P320	T318-P320 WeakPolarHBondContact O-CD 3.43Å
319	C	27.1	Very low	30.1	Very low	132 Å²	132	142.2 Å²	142.2	89%	0.892	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-47.4	129.3	167.9	-73.3	0	0	0	0	112
320	P	29.9	Very low	29.4	Very low	116 Å²	116	149 Å²	149	75%	0.753	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-98	131.3	160.1	10.6	8.5	0	0	0	110.6	T318	T318-P320 WeakPolarHBondContact O-CD 3.43Å
321	Q	30.6	Very low	29	Very low	188 Å²	188	148.1 Å²	148.1	88%	0.879	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-58.5	150.1	160.5	-67.3	-175.9	-27.3	0	0	110.7
322	Q	30.3	Very low	28.4	Very low	189 Å²	189	151.1 Å²	151.1	88%	0.883	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-58.1	156.8	171.4	-73.8	178.2	-32.2	0	0	112.8
323	P	31.7	Very low	27.9	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	80%	0.798	S	S	*	*			trans	-131.5	129.8	134.2	28.5	-11.9	0	0	0	114.6
324	V	27.3	Very low	28.3	Very low	123 Å²	123	149.4 Å²	149.4	75%	0.745	80%	0.802	S	S	*	*			trans	32.5	119.8	132.6	-132.1	0	0	0	0	121.3
325	H	26.9	Very low	27.7	Very low	180 Å²	180	152.5 Å²	152.5	83%	0.833	81%	0.806	S	S	*	*			trans	25.2	126.9	147	-69.6	-79.6	0	0	0	121.3
326	S	24.7	Very low	27.5	Very low	103 Å²	103	153.8 Å²	153.8	72%	0.72	81%	0.805	S	S	*	*				-177.8	136.2	100.9	40.2	0	0	0	0	113.9
327	N	25	Very low	27	Very low	135 Å²	135	150.1 Å²	150.1	72%	0.722	80%	0.795	S	S	*	*			trans	50.6	114	147.3	-57.2	-20.1	0	0	0	120.1
328	Y	25.9	Very low	26.7	Very low	231 Å²	231	149.1 Å²	149.1	91%	0.906	79%	0.789	S	S	*	*				-147.9	121.5	114.3	-90.5	-73.1	0	0	0	110.1
329	V	23.6	Very low	26.5	Very low	110 Å²	110	151.6 Å²	151.6	67%	0.667	79%	0.792	S	S	*	*			trans	-77.8	132.5	176	168.7	0	0	0	0	108.6
330	Y	26.3	Very low	26.4	Very low	225 Å²	225	151.8 Å²	151.8	88%	0.882	79%	0.789	S	S	*	*			trans	-142.2	124.9	140.2	-84	-69.8	0	0	0	111.4
331	S	24.3	Very low	26.1	Very low	105 Å²	105	154.8 Å²	154.8	73%	0.734	79%	0.792	S	S	*	*			trans	-79.8	133.4	179.8	47	0	0	0	0	111.8
332	F	23.6	Very low	25.8	Very low	199 Å²	199	154.8 Å²	154.8	87%	0.873	79%	0.792	S	S	*	*			trans	-81	139.9	158.1	-112.8	-92.3	0	0	0	109.6
333	S	25	Very low	25.5	Very low	117 Å²	117	148.6 Å²	148.6	82%	0.818	78%	0.779	S	S	*	*			trans	-171.4	154.8	132.1	-83.3	0	0	0	0	113
334	P	40	Very low	25.1	Very low	111 Å²	111	154.4 Å²	154.4	72%	0.721	79%	0.788	S	S	*	*			trans	-111.4	174.1	-156.8	37.9	-24	0	0	0	113.2
335	R	22.9	Very low	24.9	Very low	247 Å²	247	155 Å²	155	93%	0.932	79%	0.792	S	S	*	*			trans	-178.4	158.6	142.3	-101.2	162.6	-166.8	-146.1	4.9	115.4
336	L	22.9	Very low	24.7	Very low	149 Å²	149	153.1 Å²	153.1	78%	0.78	79%	0.793	S	S	*	*			trans	-72.3	172	-166.6	-84.7	95.2	0	0	0	118.9
337	N	22.9	Very low	24.6	Very low	136 Å²	136	152.2 Å²	152.2	73%	0.727	79%	0.791	S	S	*	*			trans	90.1	145	149.2	-77.2	0.1	0	0	0	117.5
338	T	22.7	Very low	24.7	Very low	98 Å²	98	151.3 Å²	151.3	60%	0.601	79%	0.793	S	S	*	*			cis	179.4	145.2	-6.1	29.4	0	0	0	0	107.1
339	H	23	Very low	24.7	Very low	176 Å²	176	148.1 Å²	148.1	82%	0.815	79%	0.791	S	S	*	*			trans	59.3	147.5	160.9	-59.4	-67.9	0	0	0	118.3
340	T	23.9	Very low	24.8	Very low	136 Å²	136	151.4 Å²	151.4	83%	0.834	80%	0.797	S	S	*	*			cis	-158.9	164.3	35.9	37.5	0	0	0	0	111.6
341	H	25.3	Very low	24.7	Very low	178 Å²	178	148.6 Å²	148.6	82%	0.824	80%	0.796	S	S	*	*			trans	-71.1	148.8	174.6	-78.9	-100.9	0	0	0	114.7
342	H	24.5	Very low	24.6	Very low	188 Å²	188	149.9 Å²	149.9	87%	0.87	79%	0.794	S	S	*	*				-172.4	138	128.7	-96.6	17.6	0	0	0	110.1
343	G	22.4	Very low	24.7	Very low	60 Å²	60	145.1 Å²	145.1	62%	0.619	79%	0.785	S	S	*	*			trans	-109.7	162.9	178.9	0	0	0	0	0	112.5
344	Y	24.6	Very low	24.7	Very low	236 Å²	236	146.4 Å²	146.4	93%	0.925	78%	0.783	S	S	*	*			trans	-156.6	143.5	150.5	-81.6	-70.7	0	0	0	110.7
345	T	21.6	Very low	24	Very low	134 Å²	134	147 Å²	147	82%	0.822	79%	0.785	S	S	*	*			trans	-77.9	157	-176.4	-39.5	0	0	0	0	112.8
346	V	23.4	Very low	24.2	Very low	142 Å²	142	142.4 Å²	142.4	86%	0.861	78%	0.777	S	S	*	*				178.3	139.3	127.1	158	0	0	0	0	109.7
347	A	22.8	Very low	24.3	Very low	83 Å²	83	141.5 Å²	141.5	69%	0.686	78%	0.778	S	S	*	*			trans	-66.6	175.4	-170.1	0	0	0	0	0	115.8
348	P	28	Very low	24.4	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	79%	0.787	S	S	*	*				-141.4	145.4	89.2	32.8	-15.1	0	0	0	116.9
349	L	24.7	Very low	24.4	Very low	164 Å²	164	143.5 Å²	143.5	86%	0.859	79%	0.792	S	S	*	*			trans	59.3	121.5	133.4	-72.5	155.9	0	0	0	122.7
350	F	24.9	Very low	24.9	Very low	179 Å²	179	144.3 Å²	144.3	79%	0.785	80%	0.796	S	S	*	*			trans	-57.2	147.8	167.7	-75.8	-101.3	0	0	0	114.8	L352	F350-L352 HydrophobicContact CD1-CD1 4.35Å
351	L	24.4	Very low	25.9	Very low	166 Å²	166	142.8 Å²	142.8	87%	0.869	79%	0.788	S	S	*	*				-161.6	131.4	111.5	-105.7	160.4	0	0	0	112.5
352	L	24	Very low	25.9	Very low	132 Å²	132	142.1 Å²	142.1	69%	0.691	79%	0.79	S	S	*	*			trans	-37	149.3	175.6	-83.1	68.9	0	0	0	115.2	F350	F350-L352 HydrophobicContact CD1-CD1 4.35Å
353	S	24.5	Very low	26	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	79%	0.786	S	S	*	*				-174.6	141.9	61.9	30.2	0	0	0	0	113.3
354	N	25.9	Very low	26.2	Very low	145 Å²	145	142 Å²	142	78%	0.775	79%	0.788	S	S	*	*			trans	80.1	84.8	147.5	-57.2	-6.4	0	0	0	120.5
355	T	24.2	Very low	26.3	Very low	124 Å²	124	137.9 Å²	137.9	76%	0.761	78%	0.781	S	S	*	*				-26.5	147.2	125.4	46.2	0	0	0	0	113.6
356	I	27.3	Very low	26.5	Very low	150 Å²	150	140 Å²	140	77%	0.769	78%	0.779	S	S	*	*				-155.8	130.8	60.7	-72.6	164	0	0	0	110.7	F358	I356-F358 HydrophobicContact CG2-CD2 4.41Å
357	T	25.5	Very low	26.8	Very low	130 Å²	130	141.8 Å²	141.8	80%	0.798	78%	0.781	S	S	*	*			trans	-96.5	136.4	164.6	-16.4	0	0	0	0	109.2
358	F	24.7	Very low	27.2	Very low	207 Å²	207	147.9 Å²	147.9	91%	0.908	79%	0.787	S	S	*	*			trans	-160.5	120.1	148.5	-95.8	-80.4	0	0	0	103.9	I356	I356-F358 HydrophobicContact CG2-CD2 4.41Å
359	G	23.9	Very low	27.2	Very low	69 Å²	69	151.2 Å²	151.2	71%	0.711	79%	0.79	S	S	*	*			cis	112.8	102.8	49.9	0	0	0	0	0	107
360	Q	31.9	Very low	27.6	Very low	193 Å²	193	146.4 Å²	146.4	90%	0.902	77%	0.769	S	S	*	*			trans	-60.4	167.4	158.2	-78.7	-164.2	-19.9	0	0	109.5
361	P	46.3	Very low	28.3	Very low	104 Å²	104	144.2 Å²	144.2	68%	0.675	77%	0.765	S	S	*	*			cis	-145.3	170	25.5	36.2	-13.9	0	0	0	116.4
362	L	24.2	Very low	28.9	Very low	163 Å²	163	143.4 Å²	143.4	85%	0.853	76%	0.757	S	S	*	*				167.8	118.4	128.2	-91	162.3	0	0	0	112.9
363	L	27.1	Very low	29.4	Very low	151 Å²	151	143.5 Å²	143.5	79%	0.791	75%	0.751	S	S	*	*			trans	4.4	134.2	146.3	-99.9	106	0	0	0	121
364	S	27.4	Very low	29.9	Very low	95 Å²	95	144.8 Å²	144.8	66%	0.664	75%	0.748	S	S	*	*			trans	62.8	99.4	131.4	71.1	0	0	0	0	120
365	L	25.3	Very low	30.6	Very low	150 Å²	150	142.1 Å²	142.1	79%	0.785	73%	0.733	S	S	*	*			trans	-173.4	101.8	136	-128.1	68	0	0	0	103.3
366	F	26.7	Very low	31.1	Very low	177 Å²	177	142 Å²	142	78%	0.776	72%	0.724	S	S	*	*				-168.7	99.3	88.4	-90.2	-86.2	0	0	0	109.1
367	M	29.3	Very low	31.5	Very low	181 Å²	181	140.9 Å²	140.9	89%	0.892	72%	0.718	S	S	*	*			trans	-115.6	89.9	145.1	-91.7	-81.5	-93.4	0	0	104.4
368	Y	30.5	Very low	32	Very low	210 Å²	210	140 Å²	140	82%	0.824	71%	0.708	S	S	*	*			trans	-163.5	79.2	159.6	-94.7	-72	0	0	0	107.4
369	F	29.3	Very low	32.5	Very low	187 Å²	187	136.4 Å²	136.4	82%	0.82	69%	0.694	S	S	*	*			trans	-110.8	117.9	143.8	-89.7	-84.7	0	0	0	105.9	L371	F369-L371 PolarHBondContact O-N 2.77Å
370	P	33.6	Very low	32.8	Very low	64 Å²	64	139.8 Å²	139.8	42%	0.416	70%	0.696	S	S	.	*			trans	-69.2	131.7	178.1	27.4	-29.3	0	0	0	108.4	E372 K373	P370-E372 PolarHBondContact O-N 2.85Å; P370-K373 PolarHBondContact O-N 2.81Å
371	L	38	Very low	32.9	Very low	132 Å²	132	137.3 Å²	137.3	69%	0.691	69%	0.688	S	S	*	*	H	α-helix	trans	-53	-22.5	176	-147	82.4	0	0	0	112.1	F369 K373 M374 I375	F369-L371 PolarHBondContact O-N 2.77Å; L371-K373 PolarHBondContact O-N 2.93Å; L371-M374 PolarHBondContact O-N 2.9Å; L371-I375 WeakPolarHBondContact O-CG1 3.36Å; L371-I375 PolarHBondContact O-N 3.44Å
372	E	36.8	Very low	32.4	Very low	150 Å²	150	138.1 Å²	138.1	70%	0.701	69%	0.691	S	S	*	*	H	α-helix	trans	-63.6	-33.8	176.3	-72.8	167.9	156.3	0	0	113.7	P370 M374 I375 E376	P370-E372 PolarHBondContact O-N 2.85Å; E372-M374 VanDerWaalsContact C-N 3.33Å; E372-M374 PolarHBondContact O-N 2.93Å; E372-I375 PolarHBondContact O-N 3.46Å; E372-E376 PolarHBondContact O-N 3.26Å; E372-E376 VanDerWaalsContact O-N 3.11Å
373	K	36	Very low	32.6	Very low	133 Å²	133	136 Å²	136	58%	0.578	69%	0.685	S	S	*	*	H	α-helix	trans	-77.6	-19.5	177.1	-104.5	179.4	177.8	179.4	0	113.8	P370 L371 L377	P370-K373 PolarHBondContact O-N 2.81Å; L371-K373 PolarHBondContact O-N 2.93Å; K373-L377 PolarHBondContact O-N 3.04Å
374	M	33.8	Very low	32.6	Very low	126 Å²	126	139.2 Å²	139.2	62%	0.621	69%	0.688	S	S	*	*	H	α-helix	trans	-79.9	-27.8	173.8	-149.6	-176.4	-69.6	0	0	110.7	L371 E372 L378	L371-M374 PolarHBondContact O-N 2.9Å; E372-M374 VanDerWaalsContact C-N 3.33Å; E372-M374 PolarHBondContact O-N 2.93Å; M374-L378 WeakPolarHBondContact O-CD1 3.24Å; M374-L378 PolarHBondContact O-N 3.03Å
375	I	41.6	Very low	32.8	Very low	88 Å²	88	143 Å²	143	45%	0.451	70%	0.695	S	S	.	*	H	α-helix	trans	-77.9	-39.5	175.6	-64.8	168	0	0	0	111.1	L371 E372 L377 L378 E379	L371-I375 WeakPolarHBondContact O-CG1 3.36Å; L371-I375 PolarHBondContact O-N 3.44Å; E372-I375 PolarHBondContact O-N 3.46Å; I375-L377 VanDerWaalsContact C-N 3.3Å; I375-L377 PolarHBondContact O-N 2.93Å; I375-L378 WeakPolarHBondContact O-CA 3.49Å; I375-L378 WeakPolarHBondContact O-CB 3.1Å; I375-L378 PolarHBondContact O-N 3Å; I375-E379 PolarHBondContact O-N 2.84Å
376	E	34.5	Very low	33	Very low	122 Å²	122	141.3 Å²	141.3	57%	0.57	69%	0.693	S	S	*	*	H	α-helix	trans	-59.4	-38.9	172	-92.3	-177.3	153.7	0	0	112.5	E372 L378 E379 D380	E372-E376 PolarHBondContact O-N 3.26Å; E372-E376 VanDerWaalsContact O-N 3.11Å; E376-L378 PolarHBondContact O-N 2.96Å; E376-E379 PolarHBondContact O-N 2.89Å; E376-D380 PolarHBondContact O-N 2.94Å
377	L	35.9	Very low	33	Very low	126 Å²	126	140.4 Å²	140.4	66%	0.66	70%	0.697	S	S	*	*	H	α-helix	trans	-69.7	-19.5	174.9	-95.7	155.8	0	0	0	113.7	K373 I375	K373-L377 PolarHBondContact O-N 3.04Å; I375-L377 VanDerWaalsContact C-N 3.3Å; I375-L377 PolarHBondContact O-N 2.93Å
378	L	35.3	Very low	33	Very low	111 Å²	111	140.3 Å²	140.3	58%	0.581	69%	0.694	S	S	*	*	H	α-helix	trans	-89.3	-29.7	175.6	-83.3	159.2	0	0	0	112.1	M374 I375 E376 L381	M374-L378 WeakPolarHBondContact O-CD1 3.24Å; M374-L378 PolarHBondContact O-N 3.03Å; I375-L378 WeakPolarHBondContact O-CA 3.49Å; I375-L378 WeakPolarHBondContact O-CB 3.1Å; I375-L378 PolarHBondContact O-N 3Å; E376-L378 PolarHBondContact O-N 2.96Å; L378-L381 PolarHBondContact O-N 2.91Å
379	E	34.4	Very low	32.9	Very low	133 Å²	133	137.7 Å²	137.7	62%	0.621	69%	0.694	S	S	*	*	H	α-helix	trans	-72.8	-33.1	175.2	-80.1	-175.8	153.2	0	0	112.8	I375 E376 L381 V382	I375-E379 PolarHBondContact O-N 2.84Å; E376-E379 PolarHBondContact O-N 2.89Å; E379-L381 PolarHBondContact O-N 2.88Å; E379-V382 PolarHBondContact O-N 3.15Å
380	D	30.8	Very low	32.9	Very low	139 Å²	139	138.1 Å²	138.1	74%	0.743	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	-12	174.7	-88	-11.7	0	0	0	113.8	E376	E376-D380 PolarHBondContact O-N 2.94Å
381	L	34.9	Very low	32.6	Very low	142 Å²	142	141.3 Å²	141.3	74%	0.743	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-0.8	177.4	-82.9	162.2	0	0	0	114	L378 E379	L378-L381 PolarHBondContact O-N 2.91Å; E379-L381 PolarHBondContact O-N 2.88Å
382	V	34.6	Very low	31.9	Very low	120 Å²	120	142.6 Å²	142.6	73%	0.727	73%	0.728	S	S	*	*	S	Bend	trans	-101.3	-4.9	-176.7	175.7	0	0	0	0	113.6	E379 Y384	E379-V382 PolarHBondContact O-N 3.15Å; V382-Y384 PolarHBondContact O-N 3.41Å
383	T	29.4	Very low	31.6	Very low	119 Å²	119	141.3 Å²	141.3	73%	0.73	73%	0.733	S	S	*	*			trans	-98.9	77	177.1	55.3	0	0	0	0	112.6
384	Y	27	Very low	31.2	Very low	218 Å²	218	144.1 Å²	144.1	86%	0.855	75%	0.748	S	S	*	*			trans	-142.1	93.6	156.6	-145.9	-97.8	0	0	0	109.9	V382	V382-Y384 PolarHBondContact O-N 3.41Å
385	E	31.5	Very low	30.9	Very low	174 Å²	174	146.2 Å²	146.2	81%	0.813	76%	0.761	S	S	*	*			trans	-68.6	129.7	168.3	-70	-162.5	161.7	0	0	110.1
386	P	29.3	Very low	30.3	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	78%	0.775	S	S	*	*			trans	-88.7	125.5	158.3	31.2	-22.2	0	0	0	109.3	E388	P386-E388 PolarHBondContact O-N 3.01Å
387	N	27.1	Very low	30.2	Very low	158 Å²	158	145.3 Å²	145.3	85%	0.845	79%	0.785	S	S	*	*			trans	-45.5	115.8	173.7	-72.6	-51.7	0	0	0	112.9	N389	N387-N389 PolarHBondContact O-N 2.89Å
388	E	28.7	Very low	29.8	Very low	180 Å²	180	147.2 Å²	147.2	84%	0.841	79%	0.794	S	S	*	*			trans	-75.4	101	165.2	-74.3	-171.7	160	0	0	110.1	P386	P386-E388 PolarHBondContact O-N 3.01Å
389	N	28.7	Very low	29.3	Very low	154 Å²	154	146.5 Å²	146.5	82%	0.824	80%	0.798	S	S	*	*			trans	-135.3	79.4	154.5	-98.9	-22.3	0	0	0	107.7	N387	N387-N389 PolarHBondContact O-N 2.89Å
390	Q	28.9	Very low	29.3	Very low	196 Å²	196	145.3 Å²	145.3	92%	0.916	81%	0.805	S	S	*	*	S	Bend	trans	-173.8	130.2	144.1	-101	159.5	36.2	0	0	110.5
391	C	26.6	Very low	29.1	Very low	131 Å²	131	145.6 Å²	145.6	89%	0.885	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-55.8	130.4	-171	-74.5	0	0	0	0	115
392	L	24.8	Very low	28.7	Very low	159 Å²	159	146.1 Å²	146.1	83%	0.832	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-85.4	134.2	155	-76	160.4	0	0	0	109.7
393	P	30.2	Very low	28.7	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-83.5	139.2	160.9	17.2	-3.8	0	0	0	111.2
394	Q	27.6	Very low	28.6	Very low	192 Å²	192	148.8 Å²	148.8	90%	0.897	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-63.1	141	-177.8	-67.3	170.2	-29.6	0	0	113.6
395	L	26.8	Very low	29	Very low	169 Å²	169	148.4 Å²	148.4	89%	0.885	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-75	133.7	163.2	-82.1	134	0	0	0	110.7
396	P	29.9	Very low	28.8	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-90	126.8	157.1	20.9	-6.7	0	0	0	110.2
397	G	31.8	Very low	28.7	Very low	77 Å²	77	147.8 Å²	147.8	79%	0.794	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-66.2	151.9	173	0	0	0	0	0	112.6
398	I	27.8	Very low	29.1	Very low	166 Å²	166	146.6 Å²	146.6	85%	0.851	83%	0.831	S	S	*	*			trans	-131.2	113	167.6	-63.9	179.3	0	0	0	109.3
399	S	24.9	Very low	29.5	Very low	95 Å²	95	142 Å²	142	66%	0.664	82%	0.823	S	S	*	*			trans	-61.7	143	161.9	48.6	0	0	0	0	112.6
400	S	33.3	Very low	29.5	Very low	108 Å²	108	142.1 Å²	142.1	76%	0.755	82%	0.824	S	S	*	*			trans	5.8	119.5	148.3	58.9	0	0	0	0	118.9
401	T	27.1	Very low	29.9	Very low	145 Å²	145	139.2 Å²	139.2	89%	0.89	82%	0.824	S	S	*	*			trans	-159.1	126.6	134.5	39.5	0	0	0	0	112.8
402	N	26.6	Very low	30.6	Very low	154 Å²	154	138.9 Å²	138.9	82%	0.824	82%	0.817	S	S	*	*			trans	-21.4	139.5	163	-77.6	-22.3	0	0	0	121.4
403	S	34.3	Very low	31.1	Very low	103 Å²	103	138 Å²	138	72%	0.72	81%	0.814	S	S	*	*			trans	42.9	126.2	132.4	71	0	0	0	0	120.9
404	Q	27.5	Very low	31.9	Very low	191 Å²	191	136.6 Å²	136.6	89%	0.893	82%	0.822	S	S	*	*				-163.7	132.8	124.4	-105.6	163.7	23.2	0	0	111.9
405	F	35	Very low	33.1	Very low	210 Å²	210	138 Å²	138	92%	0.921	82%	0.819	S	S	*	*			trans	-57.5	139.4	169	-92.2	-103.5	0	0	0	111.4
406	L	28.7	Very low	34.5	Very low	171 Å²	171	134.5 Å²	134.5	90%	0.895	80%	0.804	S	S	*	*			trans	-135.7	130.8	158.8	-86.4	162.1	0	0	0	110.5
407	S	26.3	Very low	36.5	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	79%	0.792	S	S	*	*			trans	-76.8	163.9	-176.8	47.8	0	0	0	0	113.6
408	P	35.3	Very low	38.1	Very low	133 Å²	133	133.3 Å²	133.3	86%	0.864	78%	0.784	S	S	*	*			trans	-89.5	113	-174.6	33.7	-27.5	0	0	0	111.4
409	A	37	Very low	40	Very low	83 Å²	83	129.3 Å²	129.3	69%	0.686	77%	0.771	S	S	*	*			trans	-155.7	143.3	157.9	0	0	0	0	0	109
410	D	29.9	Very low	42.1	Very low	157 Å²	157	128.9 Å²	128.9	84%	0.84	76%	0.761	S	S	*	*			trans	88.8	77.7	170.7	-53.3	-21.1	0	0	0	117.4
411	C	36.8	Very low	44	Very low	134 Å²	134	125.5 Å²	125.5	91%	0.905	74%	0.739	S	S	*	*			trans	-82.9	104.1	142.5	-75.4	0	0	0	0	109.2
412	V	41.6	Very low	46.2	Very low	125 Å²	125	123.4 Å²	123.4	76%	0.758	72%	0.723	S	S	*	*			trans	-150	90.9	150.2	-174	0	0	0	0	108.5
413	D	34.3	Very low	48.7	Very low	141 Å²	141	119.5 Å²	119.5	75%	0.754	70%	0.704	S	S	*	*			trans	160.9	131.8	142.5	-90	-20.6	0	0	0	108.2	R415	D413-R415 PolarHBondContact O-N 3.11Å
414	G	48.6	Very low	50.6	Low	94 Å²	94	118.7 Å²	118.7	97%	0.969	69%	0.691	S	S	*	*	S	Bend	trans	-68.8	45.8	-178.5	0	0	0	0	0	114.5
415	R	51.4	Low	53	Low	222 Å²	222	116.2 Å²	116.2	84%	0.838	68%	0.68	S	S	*	*			trans	-108.9	118.7	168.6	-82.9	-179.1	177.1	177.7	-0.3	108.5	D413	D413-R415 PolarHBondContact O-N 3.11Å
416	V	57.5	Low	55.2	Low	94 Å²	94	112 Å²	112	57%	0.57	66%	0.663	S	S	*	*			trans	-49.1	129.8	169.9	-178.5	0	0	0	0	108.2	S418 L420	V416-S418 PolarHBondContact O-N 2.83Å; V416-L420 HydrophobicContact CG1-CB 4.05Å; V416-L420 HydrophobicContact CG1-CD2 4.01Å; V416-L420 HydrophobicContact CG1-CG 4.19Å
417	P	70.1	Confident	57.7	Low	77 Å²	77	107.8 Å²	107.8	50%	0.5	64%	0.641	S	S	.	*			trans	-52.9	130.1	176.7	-24.4	32.4	0	0	0	109.4	S419 L420 A421	P417-S419 PolarHBondContact O-N 2.78Å; P417-L420 HydrophobicContact CB-CB 4.36Å; P417-L420 WeakPolarHBondContact O-CA 3.3Å; P417-L420 WeakPolarHBondContact O-CB 3.26Å; P417-L420 PolarHBondContact O-N 2.62Å; P417-A421 PolarHBondContact O-N 3.34Å; P417-A421 VanDerWaalsContact O-N 3.08Å
418	S	66.3	Low	60.3	Low	91 Å²	91	107.4 Å²	107.4	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-56.2	-28	-178.3	51	0	0	0	0	112.5	V416 N422	V416-S418 PolarHBondContact O-N 2.83Å; S418-N422 WeakPolarHBondContact O-CB 3.36Å; S418-N422 PolarHBondContact O-N 2.8Å; S418-N422 PolarHBondContact O-ND2 2.49Å; S418-N422 PolarHBondContact O-OD1 2.89Å
419	S	67.6	Low	62.6	Low	81 Å²	81	102.8 Å²	102.8	57%	0.566	61%	0.605	S	S	*	*	H	α-helix	trans	-63.1	-42	171	54.7	0	0	0	0	113.1	P417 T423	P417-S419 PolarHBondContact O-N 2.78Å; S419-T423 WeakPolarHBondContact O-CG2 3.22Å; S419-T423 PolarHBondContact O-N 3.47Å; S419-T423 VanDerWaalsContact O-N 3.07Å; S419-T423 PolarHBondContact O-OG1 3.31Å
420	L	69.3	Low	64.8	Low	87 Å²	87	104.1 Å²	104.1	46%	0.455	60%	0.597	S	S	.	*	H	α-helix	trans	-71.7	-38.5	178.4	-174.4	63.3	0	0	0	111.4	V416 P417 T423 L424	V416-L420 HydrophobicContact CG1-CB 4.05Å; V416-L420 HydrophobicContact CG1-CD2 4.01Å; V416-L420 HydrophobicContact CG1-CG 4.19Å; P417-L420 HydrophobicContact CB-CB 4.36Å; P417-L420 WeakPolarHBondContact O-CA 3.3Å; P417-L420 WeakPolarHBondContact O-CB 3.26Å; P417-L420 PolarHBondContact O-N 2.62Å; L420-T423 WeakPolarHBondContact CA-OG1 3.42Å; L420-T423 PolarHBondContact O-N 3.01Å; L420-T423 PolarHBondContact O-OG1 3.46Å; L420-L424 HydrophobicContact CG-CD1 4.33Å; L420-L424 WeakPolarHBondContact O-CG 3.46Å; L420-L424 PolarHBondContact O-N 3Å
421	A	73.1	Confident	67	Low	36 Å²	36	101.3 Å²	101.3	30%	0.298	58%	0.582	S	S	.	*	H	α-helix	trans	-60.4	-46.3	173.7	0	0	0	0	0	111.5	P417 T423 L424 E425	P417-A421 PolarHBondContact O-N 3.34Å; P417-A421 VanDerWaalsContact O-N 3.08Å; A421-T423 VanDerWaalsContact C-N 3.34Å; A421-T423 PolarHBondContact O-N 3.06Å; A421-L424 PolarHBondContact O-N 2.68Å; A421-E425 PolarHBondContact O-N 2.82Å
422	N	73.4	Confident	69.2	Low	102 Å²	102	99.7 Å²	99.7	55%	0.545	56%	0.564	S	S	.	*	H	α-helix	trans	-63.7	-37.5	177.1	-67.9	-4.8	0	0	0	112.4	S418 H426	S418-N422 WeakPolarHBondContact O-CB 3.36Å; S418-N422 PolarHBondContact O-N 2.8Å; S418-N422 PolarHBondContact O-ND2 2.49Å; S418-N422 PolarHBondContact O-OD1 2.89Å; N422-H426 WeakPolarHBondContact O-CB 3.4Å; N422-H426 PolarHBondContact O-N 3.02Å; N422-H426 VanDerWaalsContact O-N 3.07Å
423	T	78.9	Confident	71.2	Confident	71 Å²	71	98 Å²	98	44%	0.436	55%	0.554	S	S	.	*	H	α-helix	trans	-68.3	-36.4	175.2	53.8	0	0	0	0	112.6	S419 L420 A421 H426 I427	S419-T423 WeakPolarHBondContact O-CG2 3.22Å; S419-T423 PolarHBondContact O-N 3.47Å; S419-T423 VanDerWaalsContact O-N 3.07Å; S419-T423 PolarHBondContact O-OG1 3.31Å; L420-T423 WeakPolarHBondContact CA-OG1 3.42Å; L420-T423 PolarHBondContact O-N 3.01Å; L420-T423 PolarHBondContact O-OG1 3.46Å; A421-T423 VanDerWaalsContact C-N 3.34Å; A421-T423 PolarHBondContact O-N 3.06Å; T423-H426 PolarHBondContact O-N 3.16Å; T423-I427 WeakPolarHBondContact O-CD1 3.2Å; T423-I427 VanDerWaalsContact O-CG1 3.25Å; T423-I427 WeakPolarHBondContact O-CG1 3.26Å; T423-I427 PolarHBondContact O-N 3.27Å
424	L	73.6	Confident	73.4	Confident	86 Å²	86	96.2 Å²	96.2	45%	0.45	54%	0.544	S	S	.	.	H	α-helix	trans	-68.6	-42	177.1	-79.4	166.7	0	0	0	111.4	L420 A421 H426 I427 I428	L420-L424 HydrophobicContact CG-CD1 4.33Å; L420-L424 WeakPolarHBondContact O-CG 3.46Å; L420-L424 PolarHBondContact O-N 3Å; A421-L424 PolarHBondContact O-N 2.68Å; L424-H426 VanDerWaalsContact C-N 3.29Å; L424-H426 PolarHBondContact O-N 3.35Å; L424-I427 PolarHBondContact O-N 3.4Å; L424-I428 VanDerWaalsContact O-CG1 3.26Å; L424-I428 WeakPolarHBondContact O-CG1 3.48Å; L424-I428 PolarHBondContact O-N 2.91Å
425	E	77.9	Confident	75.1	Confident	140 Å²	140	96.1 Å²	96.1	65%	0.654	52%	0.524	S	S	*	.	H	α-helix	trans	-60.2	-40.3	173	-76.1	-174	172.6	0	0	111.8	A421 I428 G429	A421-E425 PolarHBondContact O-N 2.82Å; E425-I428 PolarHBondContact O-N 3.26Å; E425-G429 PolarHBondContact O-N 3.49Å
426	H	81.6	Confident	76.6	Confident	120 Å²	120	92 Å²	92	56%	0.556	52%	0.515	S	S	*	.	H	α-helix	trans	-65.3	-39.5	175.8	-168.1	-65.9	0	0	0	112.5	N422 T423 L424 G429 Q430	N422-H426 WeakPolarHBondContact O-CB 3.4Å; N422-H426 PolarHBondContact O-N 3.02Å; N422-H426 VanDerWaalsContact O-N 3.07Å; T423-H426 PolarHBondContact O-N 3.16Å; L424-H426 VanDerWaalsContact C-N 3.29Å; L424-H426 PolarHBondContact O-N 3.35Å; H426-G429 PolarHBondContact O-N 3.37Å; H426-Q430 PolarHBondContact CE1-NE2 3.19Å; H426-Q430 WeakPolarHBondContact O-CG 3.15Å; H426-Q430 PolarHBondContact O-N 2.74Å
427	I	81.9	Confident	77.8	Confident	84 Å²	84	90.5 Å²	90.5	43%	0.431	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-41.9	176.6	-69.7	163.7	0	0	0	110.6	T423 L424 G429 Q430 L431	T423-I427 WeakPolarHBondContact O-CD1 3.2Å; T423-I427 VanDerWaalsContact O-CG1 3.25Å; T423-I427 WeakPolarHBondContact O-CG1 3.26Å; T423-I427 PolarHBondContact O-N 3.27Å; L424-I427 PolarHBondContact O-N 3.4Å; I427-G429 VanDerWaalsContact C-N 3.34Å; I427-Q430 PolarHBondContact O-N 3.38Å; I427-L431 HydrophobicContact CG2-CD1 4.12Å; I427-L431 WeakPolarHBondContact O-CG 3.38Å; I427-L431 PolarHBondContact O-N 3.24Å
428	I	81.1	Confident	78.6	Confident	98 Å²	98	90.3 Å²	90.3	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-62.4	-43.7	176.2	-67.4	164.2	0	0	0	110.1	L424 E425 Q430 L431 D432	L424-I428 VanDerWaalsContact O-CG1 3.26Å; L424-I428 WeakPolarHBondContact O-CG1 3.48Å; L424-I428 PolarHBondContact O-N 2.91Å; E425-I428 PolarHBondContact O-N 3.26Å; I428-Q430 VanDerWaalsContact C-N 3.32Å; I428-Q430 PolarHBondContact O-N 3.14Å; I428-L431 PolarHBondContact O-N 2.79Å; I428-L431 VanDerWaalsContact O-N 3.17Å; I428-D432 PolarHBondContact O-N 3.46Å
429	G	82.9	Confident	79.4	Confident	35 Å²	35	89.2 Å²	89.2	36%	0.361	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-38.7	174.7	0	0	0	0	0	113.3	E425 H426 I427 D432 V433	E425-G429 PolarHBondContact O-N 3.49Å; H426-G429 PolarHBondContact O-N 3.37Å; I427-G429 VanDerWaalsContact C-N 3.34Å; G429-D432 PolarHBondContact O-N 2.8Å; G429-V433 WeakPolarHBondContact O-CG2 3.3Å; G429-V433 PolarHBondContact O-N 3.33Å; G429-V433 VanDerWaalsContact O-N 3.17Å
430	Q	82.9	Confident	80.3	Confident	111 Å²	111	89.5 Å²	89.5	52%	0.519	49%	0.49	S	S	.	.	H	α-helix	trans	-68.5	-35.4	175.3	-75.3	-176.1	-35	0	0	112.9	H426 I427 I428 V433 L434	H426-Q430 PolarHBondContact CE1-NE2 3.19Å; H426-Q430 WeakPolarHBondContact O-CG 3.15Å; H426-Q430 PolarHBondContact O-N 2.74Å; I427-Q430 PolarHBondContact O-N 3.38Å; I428-Q430 VanDerWaalsContact C-N 3.32Å; I428-Q430 PolarHBondContact O-N 3.14Å; Q430-V433 PolarHBondContact O-N 2.84Å; Q430-L434 WeakPolarHBondContact O-CG 3.38Å; Q430-L434 PolarHBondContact O-N 2.79Å
431	L	76.4	Confident	81	Confident	98 Å²	98	90.8 Å²	90.8	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-67.4	-37.7	175	-74.6	166.9	0	0	0	111.8	I427 I428 L434 T435	I427-L431 HydrophobicContact CG2-CD1 4.12Å; I427-L431 WeakPolarHBondContact O-CG 3.38Å; I427-L431 PolarHBondContact O-N 3.24Å; I428-L431 PolarHBondContact O-N 2.79Å; I428-L431 VanDerWaalsContact O-N 3.17Å; L431-L434 PolarHBondContact O-N 2.9Å; L431-T435 WeakPolarHBondContact O-CB 3.39Å; L431-T435 PolarHBondContact O-N 3.13Å; L431-T435 PolarHBondContact O-OG1 3.04Å
432	D	82.2	Confident	81.7	Confident	101 Å²	101	95 Å²	95	54%	0.54	51%	0.51	S	S	.	.	H	α-helix	trans	-65	-42.7	175.7	-85.1	-7.4	0	0	0	111.8	I428 G429 T435 Q436	I428-D432 PolarHBondContact O-N 3.46Å; G429-D432 PolarHBondContact O-N 2.8Å; D432-T435 PolarHBondContact O-N 3.16Å; D432-Q436 PolarHBondContact O-N 3.22Å
433	V	84.7	Confident	82.3	Confident	89 Å²	89	96.2 Å²	96.2	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-45.5	175.9	174.1	0	0	0	0	110.9	G429 Q430 T435 Q436 T437	G429-V433 WeakPolarHBondContact O-CG2 3.3Å; G429-V433 PolarHBondContact O-N 3.33Å; G429-V433 VanDerWaalsContact O-N 3.17Å; Q430-V433 PolarHBondContact O-N 2.84Å; V433-T435 VanDerWaalsContact C-N 3.32Å; V433-T435 PolarHBondContact O-N 2.91Å; V433-Q436 PolarHBondContact O-N 3.14Å; V433-T437 WeakPolarHBondContact O-CG2 3.38Å; V433-T437 PolarHBondContact O-N 3.41Å; V433-T437 PolarHBondContact O-OG1 3.41Å
434	L	79.8	Confident	82.7	Confident	104 Å²	104	101.2 Å²	101.2	55%	0.545	52%	0.523	S	S	.	.	H	α-helix	trans	-59.2	-44.3	175.6	-81.4	165	0	0	0	111.5	Q430 L431 Q436 T437 V438	Q430-L434 WeakPolarHBondContact O-CG 3.38Å; Q430-L434 PolarHBondContact O-N 2.79Å; L431-L434 PolarHBondContact O-N 2.9Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; L434-Q436 PolarHBondContact O-N 2.84Å; L434-T437 WeakPolarHBondContact CA-OG1 3.5Å; L434-T437 PolarHBondContact O-N 2.93Å; L434-T437 VanDerWaalsContact O-N 3.16Å; L434-T437 PolarHBondContact O-OG1 3.36Å; L434-V438 WeakPolarHBondContact O-CG2 3.45Å; L434-V438 PolarHBondContact O-N 2.87Å
435	T	84.8	Confident	83.3	Confident	91 Å²	91	102 Å²	102	56%	0.558	53%	0.527	S	S	*	.	H	α-helix	trans	-61.4	-42.8	178.9	-53.5	0	0	0	0	111.5	L431 D432 V433 V438 S439	L431-T435 WeakPolarHBondContact O-CB 3.39Å; L431-T435 PolarHBondContact O-N 3.13Å; L431-T435 PolarHBondContact O-OG1 3.04Å; D432-T435 PolarHBondContact O-N 3.16Å; V433-T435 VanDerWaalsContact C-N 3.32Å; V433-T435 PolarHBondContact O-N 2.91Å; T435-V438 PolarHBondContact O-N 3.31Å; T435-S439 PolarHBondContact O-N 3.48Å; T435-S439 VanDerWaalsContact O-N 3.07Å
436	Q	82.1	Confident	83.9	Confident	135 Å²	135	98.6 Å²	98.6	63%	0.631	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-41.7	173.9	-76.7	-176.9	-2.9	0	0	112.3	D432 V433 L434 V438 S439 I440	D432-Q436 PolarHBondContact O-N 3.22Å; V433-Q436 PolarHBondContact O-N 3.14Å; L434-Q436 VanDerWaalsContact C-N 3.34Å; L434-Q436 PolarHBondContact O-N 2.84Å; Q436-V438 PolarHBondContact O-N 3.05Å; Q436-S439 PolarHBondContact O-N 2.78Å; Q436-I440 WeakPolarHBondContact O-CG1 3.46Å; Q436-I440 PolarHBondContact O-N 3.49Å
437	T	83.9	Confident	84.1	Confident	63 Å²	63	97.4 Å²	97.4	39%	0.387	51%	0.513	S	S	.	.	H	α-helix	trans	-64.4	-39	178.5	57.7	0	0	0	0	112.6	V433 L434 I440 L441	V433-T437 WeakPolarHBondContact O-CG2 3.38Å; V433-T437 PolarHBondContact O-N 3.41Å; V433-T437 PolarHBondContact O-OG1 3.41Å; L434-T437 WeakPolarHBondContact CA-OG1 3.5Å; L434-T437 PolarHBondContact O-N 2.93Å; L434-T437 VanDerWaalsContact O-N 3.16Å; L434-T437 PolarHBondContact O-OG1 3.36Å; T437-I440 PolarHBondContact O-N 2.86Å; T437-L441 VanDerWaalsContact O-CG 3.32Å; T437-L441 WeakPolarHBondContact O-CG 3.38Å; T437-L441 PolarHBondContact O-N 3.02Å
438	V	86	Confident	84.1	Confident	73 Å²	73	97.3 Å²	97.3	44%	0.442	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-44	175.7	173.1	0	0	0	0	110.6	L434 T435 Q436 I440 L441 E442	L434-V438 WeakPolarHBondContact O-CG2 3.45Å; L434-V438 PolarHBondContact O-N 2.87Å; T435-V438 PolarHBondContact O-N 3.31Å; Q436-V438 PolarHBondContact O-N 3.05Å; V438-I440 VanDerWaalsContact C-N 3.32Å; V438-I440 PolarHBondContact O-N 3.22Å; V438-L441 PolarHBondContact O-N 2.57Å; V438-L441 VanDerWaalsContact O-N 3.14Å; V438-E442 HydrophobicContact CG1-CG 4.43Å; V438-E442 WeakPolarHBondContact O-CG 3.34Å; V438-E442 PolarHBondContact O-N 2.89Å
439	S	83.1	Confident	84.4	Confident	68 Å²	68	97.4 Å²	97.4	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-60.1	-41	177.1	-179.7	0	0	0	0	112.6	T435 Q436 E442 Q443	T435-S439 PolarHBondContact O-N 3.48Å; T435-S439 VanDerWaalsContact O-N 3.07Å; Q436-S439 PolarHBondContact O-N 2.78Å; S439-E442 PolarHBondContact O-N 3.29Å; S439-Q443 PolarHBondContact O-N 2.88Å
440	I	86.6	Confident	84.7	Confident	87 Å²	87	100.1 Å²	100.1	45%	0.446	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-39.5	176.1	-66.3	165.8	0	0	0	111.1	Q436 T437 V438 Q443 R444	Q436-I440 WeakPolarHBondContact O-CG1 3.46Å; Q436-I440 PolarHBondContact O-N 3.49Å; T437-I440 PolarHBondContact O-N 2.86Å; V438-I440 VanDerWaalsContact C-N 3.32Å; V438-I440 PolarHBondContact O-N 3.22Å; I440-Q443 PolarHBondContact O-N 2.9Å; I440-R444 WeakPolarHBondContact O-CG 3.19Å; I440-R444 PolarHBondContact O-N 2.73Å
441	L	84.1	Confident	84.9	Confident	114 Å²	114	101.3 Å²	101.3	60%	0.597	53%	0.525	S	S	*	.	H	α-helix	trans	-66	-42.3	177.3	-73.8	170.7	0	0	0	111.8	T437 V438 Q443 R444 L445	T437-L441 VanDerWaalsContact O-CG 3.32Å; T437-L441 WeakPolarHBondContact O-CG 3.38Å; T437-L441 PolarHBondContact O-N 3.02Å; V438-L441 PolarHBondContact O-N 2.57Å; V438-L441 VanDerWaalsContact O-N 3.14Å; L441-Q443 VanDerWaalsContact C-N 3.34Å; L441-Q443 PolarHBondContact O-N 3.17Å; L441-R444 PolarHBondContact O-N 3.48Å; L441-L445 WeakPolarHBondContact O-CB 3.28Å; L441-L445 PolarHBondContact O-N 3.48Å
442	E	87.5	Confident	85.3	Confident	125 Å²	125	102.1 Å²	102.1	58%	0.584	53%	0.529	S	S	*	.	H	α-helix	trans	-61.3	-42.5	174.6	-75.1	-178.8	165.4	0	0	111.8	V438 S439 R444 L445 T446	V438-E442 HydrophobicContact CG1-CG 4.43Å; V438-E442 WeakPolarHBondContact O-CG 3.34Å; V438-E442 PolarHBondContact O-N 2.89Å; S439-E442 PolarHBondContact O-N 3.29Å; E442-R444 VanDerWaalsContact C-N 3.32Å; E442-R444 PolarHBondContact O-N 3.45Å; E442-L445 PolarHBondContact O-N 3.18Å; E442-T446 WeakPolarHBondContact O-CG2 3.49Å; E442-T446 PolarHBondContact O-N 3.47Å; E442-T446 PolarHBondContact O-OG1 2.8Å
443	Q	87.5	Confident	85.6	Confident	128 Å²	128	102.8 Å²	102.8	60%	0.598	53%	0.527	S	S	*	.	H	α-helix	trans	-65.2	-36.8	176.7	-167.4	-179.5	1.6	0	0	111.9	S439 I440 L441 T446 L447	S439-Q443 PolarHBondContact O-N 2.88Å; I440-Q443 PolarHBondContact O-N 2.9Å; L441-Q443 VanDerWaalsContact C-N 3.34Å; L441-Q443 PolarHBondContact O-N 3.17Å; Q443-T446 WeakPolarHBondContact CA-OG1 3.16Å; Q443-T446 PolarHBondContact O-OG1 2.79Å; Q443-L447 PolarHBondContact O-N 2.87Å
444	R	86.1	Confident	85.8	Confident	176 Å²	176	104 Å²	104	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-70.5	-40	175.5	-75.6	-176.8	173.1	-158.2	-2.1	112	I440 L441 E442 L447 T448	I440-R444 WeakPolarHBondContact O-CG 3.19Å; I440-R444 PolarHBondContact O-N 2.73Å; L441-R444 PolarHBondContact O-N 3.48Å; E442-R444 VanDerWaalsContact C-N 3.32Å; E442-R444 PolarHBondContact O-N 3.45Å; R444-L447 PolarHBondContact O-N 3.44Å; R444-T448 WeakPolarHBondContact O-CG2 3.23Å; R444-T448 PolarHBondContact O-N 2.84Å; R444-T448 PolarHBondContact O-OG1 2.89Å
445	L	86.7	Confident	86	Confident	101 Å²	101	102.4 Å²	102.4	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-47.6	178.6	-163.2	91.5	0	0	0	111.1	L441 E442 L447 T448 E449	L441-L445 WeakPolarHBondContact O-CB 3.28Å; L441-L445 PolarHBondContact O-N 3.48Å; E442-L445 PolarHBondContact O-N 3.18Å; L445-L447 VanDerWaalsContact C-N 3.32Å; L445-L447 PolarHBondContact O-N 2.9Å; L445-T448 WeakPolarHBondContact CA-OG1 3.49Å; L445-T448 PolarHBondContact O-N 3.41Å; L445-T448 PolarHBondContact O-OG1 2.9Å; L445-E449 PolarHBondContact O-N 2.83Å
446	T	89.3	Confident	86.1	Confident	69 Å²	69	103 Å²	103	42%	0.423	52%	0.523	S	S	.	.	H	α-helix	trans	-60	-42.3	177.6	44.2	0	0	0	0	111.9	E442 Q443 T448 E449 D450	E442-T446 WeakPolarHBondContact O-CG2 3.49Å; E442-T446 PolarHBondContact O-N 3.47Å; E442-T446 PolarHBondContact O-OG1 2.8Å; Q443-T446 WeakPolarHBondContact CA-OG1 3.16Å; Q443-T446 PolarHBondContact O-OG1 2.79Å; T446-T448 VanDerWaalsContact C-N 3.31Å; T446-T448 PolarHBondContact O-N 3.35Å; T446-E449 PolarHBondContact O-N 2.8Å; T446-D450 PolarHBondContact O-N 2.88Å
447	L	86.6	Confident	86.4	Confident	95 Å²	95	102.8 Å²	102.8	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-60.4	-37.6	173.6	-118.3	160.9	0	0	0	113	Q443 R444 L445 K451	Q443-L447 PolarHBondContact O-N 2.87Å; R444-L447 PolarHBondContact O-N 3.44Å; L445-L447 VanDerWaalsContact C-N 3.32Å; L445-L447 PolarHBondContact O-N 2.9Å; L447-K451 WeakPolarHBondContact O-CG 3.31Å; L447-K451 PolarHBondContact O-N 3.41Å
448	T	81.1	Confident	86.5	Confident	83 Å²	83	103.4 Å²	103.4	51%	0.509	52%	0.523	S	S	.	.	H	α-helix	trans	-71.5	-37	176.1	55.4	0	0	0	0	112.7	R444 L445 T446 L452	R444-T448 WeakPolarHBondContact O-CG2 3.23Å; R444-T448 PolarHBondContact O-N 2.84Å; R444-T448 PolarHBondContact O-OG1 2.89Å; L445-T448 WeakPolarHBondContact CA-OG1 3.49Å; L445-T448 PolarHBondContact O-N 3.41Å; L445-T448 PolarHBondContact O-OG1 2.9Å; T446-T448 VanDerWaalsContact C-N 3.31Å; T446-T448 PolarHBondContact O-N 3.35Å; T448-L452 WeakPolarHBondContact O-CB 3.32Å; T448-L452 PolarHBondContact O-N 2.67Å
449	E	88.6	Confident	86.3	Confident	100 Å²	100	106.1 Å²	106.1	47%	0.467	53%	0.531	S	S	.	.	H	α-helix	trans	-64.8	-42.2	176	-72.8	-177.9	170.4	0	0	111.7	L445 T446 L452 K453	L445-E449 PolarHBondContact O-N 2.83Å; T446-E449 PolarHBondContact O-N 2.8Å; E449-L452 WeakPolarHBondContact O-CB 3.3Å; E449-L452 PolarHBondContact O-N 2.58Å; E449-K453 WeakPolarHBondContact O-CG 3.44Å; E449-K453 PolarHBondContact O-N 2.59Å
450	D	88.5	Confident	86.4	Confident	92 Å²	92	109.2 Å²	109.2	49%	0.492	54%	0.539	S	S	.	.	H	α-helix	trans	-67.4	-40.8	178.9	-72	-20.2	0	0	0	111.9	T446 L452 K453 E454	T446-D450 PolarHBondContact O-N 2.88Å; D450-L452 VanDerWaalsContact C-N 3.27Å; D450-L452 PolarHBondContact O-N 2.89Å; D450-K453 PolarHBondContact O-N 3.39Å; D450-K453 IonicContact OD1-NZ 2.79Å; D450-K453 PolarHBondContact OD1-NZ 3.04Å; D450-E454 PolarHBondContact O-N 2.96Å
451	K	86.6	Confident	86.4	Confident	135 Å²	135	110.3 Å²	110.3	59%	0.587	54%	0.543	S	S	*	.	H	α-helix	trans	-62.1	-35.3	172.2	-76.2	-175.5	176.8	-174	0	112.7	L447 C455	L447-K451 WeakPolarHBondContact O-CG 3.31Å; L447-K451 PolarHBondContact O-N 3.41Å; K451-C455 WeakPolarHBondContact O-CB 3.49Å; K451-C455 PolarHBondContact O-N 3.48Å
452	L	86.1	Confident	86.4	Confident	115 Å²	115	109.9 Å²	109.9	60%	0.602	54%	0.54	S	S	*	.	H	α-helix	trans	-69.3	-39.1	178.1	-159	112.2	0	0	0	111.4	T448 E449 D450 C455 L456	T448-L452 WeakPolarHBondContact O-CB 3.32Å; T448-L452 PolarHBondContact O-N 2.67Å; E449-L452 WeakPolarHBondContact O-CB 3.3Å; E449-L452 PolarHBondContact O-N 2.58Å; D450-L452 VanDerWaalsContact C-N 3.27Å; D450-L452 PolarHBondContact O-N 2.89Å; L452-C455 PolarHBondContact O-N 3.35Å; L452-L456 HydrophobicContact CD2-CD1 4.07Å; L452-L456 PolarHBondContact O-N 2.96Å
453	K	88.6	Confident	86	Confident	115 Å²	115	105.6 Å²	105.6	50%	0.5	53%	0.529	S	S	.	.	H	α-helix	trans	-61.4	-47.2	172.9	-72.1	173.8	-169.8	156.3	0	111.5	E449 D450 C455 L456 E457	E449-K453 WeakPolarHBondContact O-CG 3.44Å; E449-K453 PolarHBondContact O-N 2.59Å; D450-K453 PolarHBondContact O-N 3.39Å; D450-K453 IonicContact OD1-NZ 2.79Å; D450-K453 PolarHBondContact OD1-NZ 3.04Å; K453-C455 VanDerWaalsContact C-N 3.27Å; K453-C455 PolarHBondContact O-N 2.99Å; K453-L456 WeakPolarHBondContact O-CB 3.36Å; K453-L456 PolarHBondContact O-N 3.42Å; K453-L456 VanDerWaalsContact O-N 3.12Å; K453-E457 WeakPolarHBondContact O-CG 3.5Å; K453-E457 PolarHBondContact O-N 3.36Å
454	E	88.9	Confident	85.6	Confident	115 Å²	115	104 Å²	104	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-59.3	-39.7	177.2	-170.3	-176.6	177.8	0	0	111.4	D450 E457 N458	D450-E454 PolarHBondContact O-N 2.96Å; E454-E457 PolarHBondContact O-N 3.49Å; E454-N458 WeakPolarHBondContact O-CB 3.48Å; E454-N458 VanDerWaalsContact O-CG 3.25Å; E454-N458 PolarHBondContact O-N 3.41Å; E454-N458 PolarHBondContact O-ND2 3.26Å; E454-N458 VanDerWaalsContact O-ND2 3.1Å
455	C	83.8	Confident	85	Confident	71 Å²	71	101.4 Å²	101.4	48%	0.48	52%	0.52	S	S	.	.	H	α-helix	trans	-65.8	-39.5	176.6	-161.6	0	0	0	0	112.6	K451 L452 K453 Q459	K451-C455 WeakPolarHBondContact O-CB 3.49Å; K451-C455 PolarHBondContact O-N 3.48Å; L452-C455 PolarHBondContact O-N 3.35Å; K453-C455 VanDerWaalsContact C-N 3.27Å; K453-C455 PolarHBondContact O-N 2.99Å; C455-Q459 WeakPolarHBondContact O-CG 3.16Å; C455-Q459 PolarHBondContact O-N 3.17Å
456	L	86.7	Confident	84.3	Confident	102 Å²	102	101.4 Å²	101.4	53%	0.534	52%	0.52	S	S	.	.	H	α-helix	trans	-66.4	-42	175.9	-81.2	160.7	0	0	0	112.2	L452 K453 Q459 M460	L452-L456 HydrophobicContact CD2-CD1 4.07Å; L452-L456 PolarHBondContact O-N 2.96Å; K453-L456 WeakPolarHBondContact O-CB 3.36Å; K453-L456 PolarHBondContact O-N 3.42Å; K453-L456 VanDerWaalsContact O-N 3.12Å; L456-Q459 PolarHBondContact O-N 3.24Å; L456-M460 PolarHBondContact O-N 3.42Å
457	E	88.5	Confident	83.3	Confident	132 Å²	132	104.1 Å²	104.1	62%	0.617	53%	0.527	S	S	*	.	H	α-helix	trans	-62.3	-46	175.8	-73	176.9	176.9	0	0	111.1	K453 E454 Q459 M460 E461	K453-E457 WeakPolarHBondContact O-CG 3.5Å; K453-E457 PolarHBondContact O-N 3.36Å; E454-E457 PolarHBondContact O-N 3.49Å; E457-Q459 VanDerWaalsContact C-N 3.32Å; E457-Q459 PolarHBondContact O-N 3.13Å; E457-M460 WeakPolarHBondContact O-CB 3.33Å; E457-M460 PolarHBondContact O-N 3.23Å; E457-M460 VanDerWaalsContact O-N 3.11Å; E457-E461 PolarHBondContact O-N 3.05Å
458	N	85.3	Confident	82.3	Confident	76 Å²	76	104.5 Å²	104.5	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-60.3	-39.6	175.3	-75.1	-33.1	0	0	0	112.3	E454 E461 I462	E454-N458 WeakPolarHBondContact O-CB 3.48Å; E454-N458 VanDerWaalsContact O-CG 3.25Å; E454-N458 PolarHBondContact O-N 3.41Å; E454-N458 PolarHBondContact O-ND2 3.26Å; E454-N458 VanDerWaalsContact O-ND2 3.1Å; N458-E461 PolarHBondContact O-N 3.47Å; N458-I462 WeakPolarHBondContact O-CB 3.37Å; N458-I462 WeakPolarHBondContact O-CD1 3.23Å; N458-I462 WeakPolarHBondContact O-CG1 3.26Å; N458-I462 PolarHBondContact O-N 2.98Å
459	Q	81.7	Confident	81.2	Confident	130 Å²	130	108.5 Å²	108.5	61%	0.607	54%	0.536	S	S	*	.	H	α-helix	trans	-65	-39.1	174.6	-78.8	-170.5	0.4	0	0	112.5	C455 L456 E457 G463	C455-Q459 WeakPolarHBondContact O-CG 3.16Å; C455-Q459 PolarHBondContact O-N 3.17Å; L456-Q459 PolarHBondContact O-N 3.24Å; E457-Q459 VanDerWaalsContact C-N 3.32Å; E457-Q459 PolarHBondContact O-N 3.13Å; Q459-G463 PolarHBondContact O-N 3.36Å
460	M	86.5	Confident	79.7	Confident	132 Å²	132	109.2 Å²	109.2	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-66.2	-41	177.7	-164.8	175.9	80.7	0	0	111.5	L456 E457 G463 L464	L456-M460 PolarHBondContact O-N 3.42Å; E457-M460 WeakPolarHBondContact O-CB 3.33Å; E457-M460 PolarHBondContact O-N 3.23Å; E457-M460 VanDerWaalsContact O-N 3.11Å; M460-G463 PolarHBondContact O-N 3.3Å; M460-L464 PolarHBondContact O-N 3.22Å
461	E	85.1	Confident	78.1	Confident	111 Å²	111	111.1 Å²	111.1	52%	0.519	55%	0.549	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.1	-169.1	171	-161.9	0	0	111.8	E457 N458 G463 L464 H465	E457-E461 PolarHBondContact O-N 3.05Å; N458-E461 PolarHBondContact O-N 3.47Å; E461-G463 VanDerWaalsContact C-N 3.32Å; E461-G463 PolarHBondContact O-N 3.4Å; E461-L464 PolarHBondContact O-N 2.97Å; E461-H465 PolarHBondContact O-CD2 2.88Å; E461-H465 PolarHBondContact O-N 2.95Å
462	I	84	Confident	76.6	Confident	105 Å²	105	108.1 Å²	108.1	54%	0.538	56%	0.556	S	S	.	*	H	α-helix	trans	-61.7	-41	173.5	-67.4	164.9	0	0	0	110.9	N458 H465 L466	N458-I462 WeakPolarHBondContact O-CB 3.37Å; N458-I462 WeakPolarHBondContact O-CD1 3.23Å; N458-I462 WeakPolarHBondContact O-CG1 3.26Å; N458-I462 PolarHBondContact O-N 2.98Å; I462-H465 PolarHBondContact O-N 2.94Å; I462-L466 HydrophobicContact CG2-CD1 4.06Å; I462-L466 WeakPolarHBondContact O-CG 3.33Å; I462-L466 PolarHBondContact O-N 3.48Å
463	G	80.3	Confident	75	Confident	35 Å²	35	111.4 Å²	111.4	36%	0.361	56%	0.561	S	S	.	*	H	α-helix	trans	-59.5	-46.4	175.8	0	0	0	0	0	112.7	Q459 M460 E461 L466 Q467	Q459-G463 PolarHBondContact O-N 3.36Å; M460-G463 PolarHBondContact O-N 3.3Å; E461-G463 VanDerWaalsContact C-N 3.32Å; E461-G463 PolarHBondContact O-N 3.4Å; G463-L466 PolarHBondContact O-N 3.21Å; G463-Q467 PolarHBondContact O-N 2.95Å
464	L	79.1	Confident	73.2	Confident	93 Å²	93	116 Å²	116	49%	0.487	58%	0.575	S	S	.	*	H	α-helix	trans	-64.6	-40.1	176.5	-76.2	165.8	0	0	0	112.4	M460 E461 L466 Q467 N468	M460-L464 PolarHBondContact O-N 3.22Å; E461-L464 PolarHBondContact O-N 2.97Å; L464-L466 VanDerWaalsContact C-N 3.33Å; L464-L466 PolarHBondContact O-N 3.11Å; L464-Q467 PolarHBondContact O-N 3.24Å; L464-N468 PolarHBondContact O-N 2.58Å
465	H	73.5	Confident	71.4	Confident	123 Å²	123	119.5 Å²	119.5	57%	0.569	58%	0.583	S	S	*	*	H	α-helix	trans	-63.6	-37.2	175.7	-91.7	-71.7	0	0	0	112.9	E461 I462 R469	E461-H465 PolarHBondContact O-CD2 2.88Å; E461-H465 PolarHBondContact O-N 2.95Å; I462-H465 PolarHBondContact O-N 2.94Å; H465-R469 WeakPolarHBondContact O-CB 3.37Å; H465-R469 PolarHBondContact O-N 2.98Å
466	L	71.4	Confident	69.5	Low	101 Å²	101	122.2 Å²	122.2	53%	0.529	60%	0.6	S	S	.	*	H	α-helix	trans	-68.8	-40.5	175.3	-72.9	167.3	0	0	0	111.6	I462 G463 L464 R469 D470	I462-L466 HydrophobicContact CG2-CD1 4.06Å; I462-L466 WeakPolarHBondContact O-CG 3.33Å; I462-L466 PolarHBondContact O-N 3.48Å; G463-L466 PolarHBondContact O-N 3.21Å; L464-L466 VanDerWaalsContact C-N 3.33Å; L464-L466 PolarHBondContact O-N 3.11Å; L466-R469 PolarHBondContact O-N 2.91Å; L466-D470 PolarHBondContact O-N 2.92Å; L466-D470 VanDerWaalsContact O-N 3.15Å
467	Q	68.5	Low	67.7	Low	125 Å²	125	123.4 Å²	123.4	58%	0.584	61%	0.607	S	S	*	*	H	α-helix	trans	-66.3	-42.5	178.9	-166.4	159.6	-8.9	0	0	112.6	G463 L464 R469 D470 E471	G463-Q467 PolarHBondContact O-N 2.95Å; L464-Q467 PolarHBondContact O-N 3.24Å; Q467-R469 VanDerWaalsContact C-N 3.27Å; Q467-R469 PolarHBondContact O-N 3.23Å; Q467-D470 PolarHBondContact O-N 3.45Å; Q467-E471 PolarHBondContact O-N 2.79Å
468	N	65.5	Low	65.7	Low	103 Å²	103	125.9 Å²	125.9	55%	0.551	62%	0.618	S	S	*	*	H	α-helix	trans	-65.1	-29.5	173.8	-77.9	-19.9	0	0	0	112.9	L464 G472	L464-N468 PolarHBondContact O-N 2.58Å; N468-G472 PolarHBondContact O-N 2.86Å
469	R	58.4	Low	63.6	Low	168 Å²	168	131.6 Å²	131.6	63%	0.634	64%	0.642	S	S	*	*	H	α-helix	trans	-76.2	-26.7	178.5	-157.5	178.2	-177.2	-167.6	2.2	112.7	H465 L466 Q467	H465-R469 WeakPolarHBondContact O-CB 3.37Å; H465-R469 PolarHBondContact O-N 2.98Å; L466-R469 PolarHBondContact O-N 2.91Å; Q467-R469 VanDerWaalsContact C-N 3.27Å; Q467-R469 PolarHBondContact O-N 3.23Å
470	D	57	Low	61.6	Low	114 Å²	114	135.5 Å²	135.5	61%	0.61	68%	0.681	S	S	*	*	H	α-helix	trans	-80.6	-31	174	-82.7	-17.7	0	0	0	112.6	L466 Q467 R473	L466-D470 PolarHBondContact O-N 2.92Å; L466-D470 VanDerWaalsContact O-N 3.15Å; Q467-D470 PolarHBondContact O-N 3.45Å; D470-R473 PolarHBondContact O-N 2.79Å
471	E	55.4	Low	60.3	Low	133 Å²	133	135.7 Å²	135.7	62%	0.621	68%	0.683	S	S	*	*	H	α-helix	trans	-68.9	-35.4	171.5	-71.1	-169.9	167.4	0	0	112.5	Q467 R473 R474	Q467-E471 PolarHBondContact O-N 2.79Å; E471-R473 PolarHBondContact O-N 3.43Å; E471-R473 VanDerWaalsContact O-N 3.15Å; E471-R474 PolarHBondContact O-N 3.26Å
472	G	54.4	Low	59	Low	72 Å²	72	136.9 Å²	136.9	74%	0.742	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-7.5	175.3	0	0	0	0	0	115.7	N468	N468-G472 PolarHBondContact O-N 2.86Å
473	R	53.3	Low	57.6	Low	184 Å²	184	138.7 Å²	138.7	69%	0.694	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	1.5	176.4	-67.5	-165.4	-154	-145.5	9.3	114.4	D470 E471 W475	D470-R473 PolarHBondContact O-N 2.79Å; E471-R473 PolarHBondContact O-N 3.43Å; E471-R473 VanDerWaalsContact O-N 3.15Å; R473-W475 PolarHBondContact O-N 2.87Å
474	R	49.4	Very low	56.3	Low	211 Å²	211	144.8 Å²	144.8	80%	0.796	72%	0.72	S	S	*	*	S	Bend	trans	-98.6	85	175.8	-82.8	-175.7	-179.8	179.6	2.4	112.4	E471	E471-R474 PolarHBondContact O-N 3.26Å
475	W	51.5	Low	54.9	Low	189 Å²	189	148.1 Å²	148.1	72%	0.716	73%	0.734	S	S	*	*			trans	76	146	149.1	-54.8	102.8	0	0	0	120	R473 N477	R473-W475 PolarHBondContact O-N 2.87Å; W475-N477 HydrophobicContact CE3-CB 3.72Å; W475-N477 HydrophobicContact CZ3-CB 3.87Å
476	P	45.1	Very low	53.6	Low	127 Å²	127	149.7 Å²	149.7	83%	0.825	75%	0.745	S	S	*	*				-130.7	115.6	89.2	34	-21.8	0	0	0	113.2
477	N	47.8	Very low	52.4	Low	128 Å²	128	153.2 Å²	153.2	68%	0.684	76%	0.761	S	S	*	*			trans	-117.8	102	151.1	-98.7	-6.4	0	0	0	107.1	W475	W475-N477 HydrophobicContact CE3-CB 3.72Å; W475-N477 HydrophobicContact CZ3-CB 3.87Å
478	Q	45.8	Very low	51.1	Low	184 Å²	184	155.4 Å²	155.4	86%	0.86	78%	0.775	S	S	*	*			trans	-179.8	97.9	145.6	-101.9	171.4	26.3	0	0	108.8
479	H	41.9	Very low	49.9	Very low	195 Å²	195	159.8 Å²	159.8	90%	0.903	79%	0.793	S	S	*	*			trans	-177.8	97.1	138.4	-89.6	-50.5	0	0	0	108.8
480	C	39	Very low	49.2	Very low	212 Å²	212	159 Å²	159	100%	1.432	81%	0.808	S	S	*	*			trans	172.9	0	135.5	-99.9	0	0	0	0	109.6

Retrieved 480 of 480 residues in 1012.1 ms (Link to these results)

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